#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a14 s THR 6 N 0.00 3.53 0.00 -2.13 -4.23 -1.26 -4.97 115.64 106.58 2a14 s THR 6 Ca 0.00 0.59 0.00 0.00 -1.18 0.00 0.00 61.69 61.10 2a14 s THR 6 Cb 0.00 -3.58 0.00 0.00 1.34 0.00 0.00 72.50 70.26 2a14 s THR 6 CO 0.00 -0.27 0.00 0.61 -0.54 0.00 0.00 174.62 174.42 2a14 n GLY 7 N 4.92 2.14 0.26 3.99 0.00 -1.26 -4.70 105.19 110.53 2a14 n GLY 7 Ca 0.21 -2.08 -0.01 0.00 0.00 0.00 0.00 46.02 44.14 2a14 n GLY 7 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2a14 h GLY 8 N 0.00 0.98 1.02 -0.02 0.00 -1.94 -1.49 103.07 101.61 2a14 h GLY 8 Ca 0.00 -0.24 0.03 0.00 0.00 0.00 0.00 47.33 47.12 2a14 h GLY 8 CO 0.00 0.12 0.60 -0.55 0.00 0.00 0.00 176.54 176.72 2a14 h ASP 9 N 0.64 1.01 -0.52 0.19 3.32 -1.99 -0.13 116.42 118.94 2a14 h ASP 9 Ca 0.31 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.26 2a14 h ASP 9 Cb 0.23 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 2a14 h ASP 9 CO -0.20 0.71 0.02 -0.08 -1.72 0.00 0.00 179.24 177.96 2a14 h GLU 10 N 1.18 0.91 0.23 3.56 4.57 -1.66 -1.11 114.58 122.26 2a14 h GLU 10 Ca 0.35 -0.28 -0.01 0.00 -1.18 0.00 0.00 59.36 58.24 2a14 h GLU 10 Cb -0.04 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.47 2a14 h GLU 10 CO -0.10 0.92 -0.11 1.88 -1.18 0.00 0.00 179.01 180.42 2a14 h TYR 11 N 0.78 -0.29 -0.90 0.92 -1.99 -0.92 -0.07 116.97 114.50 2a14 h TYR 11 Ca 0.15 -0.01 0.02 0.00 2.00 0.00 0.00 58.73 60.89 2a14 h TYR 11 Cb 0.50 0.10 -0.05 0.00 2.00 0.00 0.00 36.73 39.28 2a14 h TYR 11 CO 0.04 -0.14 0.59 0.37 -0.00 0.00 0.00 178.16 179.02 2a14 h GLN 12 N -0.36 1.16 0.14 4.88 5.75 -0.90 -0.46 115.11 125.33 2a14 h GLN 12 Ca -0.03 -0.07 -0.29 0.00 -0.15 0.00 0.00 58.65 58.11 2a14 h GLN 12 Cb 0.28 -0.26 0.01 0.00 1.07 0.00 0.00 27.48 28.57 2a14 h GLN 12 CO 0.05 0.77 -1.32 -0.22 -2.65 0.00 0.00 178.83 175.46 2a14 h LYS 13 N 1.19 0.30 0.00 1.69 1.63 -1.22 -3.43 116.57 116.74 2a14 h LYS 13 Ca 0.34 -0.52 0.00 0.00 -0.85 0.00 0.00 60.65 59.63 2a14 h LYS 13 Cb -0.09 0.19 0.00 0.00 -0.60 0.00 0.00 32.23 31.73 2a14 h LYS 13 CO -0.09 1.23 0.00 0.72 -3.45 0.00 0.00 179.45 177.86 2a14 n HIS 14 N -3.54 0.00 -2.53 1.91 8.25 -0.04 -4.99 115.22 114.27 2a14 n HIS 14 Ca -0.11 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 56.92 2a14 n HIS 14 Cb 1.04 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 32.13 2a14 n HIS 14 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 2a14 s PHE 15 N -0.61 2.88 -0.37 4.41 5.36 -0.20 -4.99 117.98 124.45 2a14 s PHE 15 Ca 0.00 0.96 -0.10 0.00 -0.96 0.00 0.00 56.93 56.84 2a14 s PHE 15 Cb 0.00 -3.93 0.03 0.00 -0.34 0.00 0.00 43.02 38.79 2a14 s PHE 15 CO 0.00 -1.28 0.19 -0.51 -1.46 0.00 0.00 175.22 172.16 2a14 s LEU 16 N 4.15 4.66 0.38 6.12 1.43 -1.26 -4.86 118.68 129.30 2a14 s LEU 16 Ca 0.51 -1.07 0.07 0.00 -1.03 0.00 0.00 54.13 52.61 2a14 s LEU 16 Cb -0.13 -1.99 0.80 0.00 0.03 0.00 0.00 46.19 44.91 2a14 s LEU 16 CO 0.22 -0.38 1.98 1.55 0.23 0.00 0.00 176.35 179.95 2a14 h PRO 17 N 8.39 0.65 -0.39 1.29 0.13 -1.94 -1.21 132.00 138.91 2a14 h PRO 17 Ca -0.25 -0.04 -0.07 0.00 -0.87 0.00 0.00 66.00 64.78 2a14 h PRO 17 Cb 1.10 -0.15 -0.02 0.00 0.13 0.00 0.00 31.00 32.06 2a14 h PRO 17 CO 0.66 0.43 -0.04 0.00 -0.23 0.00 0.00 178.00 178.82 2a14 h ARG 18 N 0.67 0.65 -0.36 0.86 2.47 -1.96 0.11 114.38 116.82 2a14 h ARG 18 Ca 0.28 -0.17 -0.16 0.00 -1.26 0.00 0.00 59.98 58.66 2a14 h ARG 18 Cb 0.24 -0.08 -0.00 0.00 -1.65 0.00 0.00 29.97 28.48 2a14 h ARG 18 CO -0.08 0.70 -0.41 -0.44 0.56 0.00 0.00 179.97 180.30 2a14 h ASP 19 N 0.61 0.99 -0.18 7.04 5.19 -1.69 -1.92 116.42 126.45 2a14 h ASP 19 Ca 0.12 -0.48 0.00 0.00 -0.62 0.00 0.00 57.03 56.05 2a14 h ASP 19 Cb 0.45 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.67 2a14 h ASP 19 CO 0.02 1.26 0.12 0.22 -3.12 0.00 0.00 179.24 177.74 2a14 h TYR 20 N 0.73 0.23 -0.67 4.55 3.20 -0.69 -1.45 116.97 122.88 2a14 h TYR 20 Ca 0.05 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.88 2a14 h TYR 20 Cb 1.00 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 39.17 2a14 h TYR 20 CO 0.07 0.14 0.24 -0.07 -1.64 0.00 0.00 178.16 176.90 2a14 h LEU 21 N 0.24 0.91 -1.12 2.82 3.38 -0.78 -1.76 115.31 119.01 2a14 h LEU 21 Ca 0.07 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 2a14 h LEU 21 Cb -0.03 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 2a14 h LEU 21 CO -0.01 0.83 -0.30 0.00 0.09 0.00 0.00 178.44 179.05 2a14 h ALA 22 N 1.30 1.26 0.01 1.53 0.00 -1.09 0.49 119.26 122.76 2a14 h ALA 22 Ca 0.22 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 2a14 h ALA 22 Cb 0.22 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.93 2a14 h ALA 22 CO -0.02 0.50 -0.31 1.15 0.00 0.00 0.00 179.25 180.58 2a14 h THR 23 N 0.21 1.56 0.00 0.00 2.02 -0.81 -3.38 112.91 112.52 2a14 h THR 23 Ca 0.03 -2.05 0.00 0.00 0.77 0.00 0.00 66.41 65.16 2a14 h THR 23 Cb 0.64 2.85 0.00 0.00 -1.74 0.00 0.00 68.15 69.90 2a14 h THR 23 CO 0.05 0.56 -1.52 -1.22 0.37 0.00 0.00 175.52 173.76 2a14 n TYR 24 N -4.45 0.00 -2.68 3.16 4.01 -0.70 -4.70 117.16 111.79 2a14 n TYR 24 Ca -0.10 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.56 2a14 n TYR 24 Cb 0.55 -0.27 0.03 0.00 -0.31 0.00 0.00 39.34 39.34 2a14 n TYR 24 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2a14 n TYR 25 N -1.90 1.43 0.23 -0.72 4.01 0.13 -4.66 117.16 115.68 2a14 n TYR 25 Ca -0.02 -2.56 0.09 0.00 -0.16 0.00 0.00 57.90 55.25 2a14 n TYR 25 Cb 0.32 -0.30 0.53 0.00 -0.31 0.00 0.00 39.34 39.58 2a14 n TYR 25 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2a14 h SER 26 N 2.79 0.00 -6.50 7.72 4.64 -1.64 -3.44 113.55 117.13 2a14 h SER 26 Ca -0.06 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.76 2a14 h SER 26 Cb 1.21 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.23 2a14 h SER 26 CO 0.43 0.23 -0.86 0.49 -0.87 0.00 0.00 176.83 176.25 2a14 n PHE 27 N -3.64 -1.73 1.69 4.77 3.72 -1.26 -4.87 117.46 116.13 2a14 n PHE 27 Ca -0.01 0.77 0.13 0.00 -0.05 0.00 0.00 57.45 58.30 2a14 n PHE 27 Cb 0.36 -3.67 0.63 0.00 -0.94 0.00 0.00 39.48 35.86 2a14 n PHE 27 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2a14 n ASP 28 N -2.92 0.82 0.00 4.37 5.75 -1.26 -4.91 116.55 118.39 2a14 n ASP 28 Ca -0.22 -1.37 0.00 0.00 -0.01 0.00 0.00 54.79 53.19 2a14 n ASP 28 Cb 0.64 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.71 2a14 n ASP 28 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2a14 n GLY 29 N 1.05 1.36 3.89 6.12 0.00 -1.26 -5.01 105.19 111.33 2a14 n GLY 29 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 2a14 n GLY 29 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2a14 s SER 30 N -3.13 6.34 -0.04 1.61 1.04 -1.26 -5.03 113.70 113.23 2a14 s SER 30 Ca 0.00 1.08 -0.30 0.00 0.48 0.00 0.00 55.95 57.21 2a14 s SER 30 Cb 0.00 -2.31 -0.05 0.00 0.10 0.00 0.00 66.02 63.76 2a14 s SER 30 CO 0.00 -0.58 1.48 -2.84 0.98 0.00 0.00 173.24 172.28 2a14 s PRO 31 N -4.56 4.23 0.02 4.02 0.02 -1.26 -4.93 135.00 132.54 2a14 s PRO 31 Ca 0.50 2.01 -0.22 0.00 0.02 0.00 0.00 61.00 63.31 2a14 s PRO 31 Cb -0.10 -3.74 0.05 0.00 0.02 0.00 0.00 34.50 30.72 2a14 s PRO 31 CO 0.42 -0.70 0.49 -1.54 -0.33 0.00 0.00 177.00 175.35 2a14 s SER 32 N 2.41 -0.41 0.29 2.53 1.04 -1.26 -5.04 113.70 113.26 2a14 s SER 32 Ca 0.66 0.24 0.00 0.00 0.48 0.00 0.00 55.95 57.33 2a14 s SER 32 Cb -0.31 0.46 0.45 0.00 0.10 0.00 0.00 66.02 66.71 2a14 s SER 32 CO 0.26 -0.64 1.83 -0.65 0.98 0.00 0.00 173.24 175.01 2a14 h PRO 33 N 3.06 0.73 -0.56 4.02 0.11 -1.94 -1.37 132.00 136.04 2a14 h PRO 33 Ca -0.30 -0.16 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 2a14 h PRO 33 Cb 1.19 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.17 2a14 h PRO 33 CO 0.41 0.70 0.35 0.93 -0.21 0.00 0.00 178.00 180.18 2a14 h GLU 34 N 0.70 0.76 -0.93 1.05 3.07 -1.90 -0.56 114.58 116.77 2a14 h GLU 34 Ca 0.15 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 58.94 2a14 h GLU 34 Cb 0.34 -0.16 -0.04 0.00 -0.84 0.00 0.00 28.75 28.04 2a14 h GLU 34 CO 0.01 0.53 0.54 0.00 -1.40 0.00 0.00 179.01 178.70 2a14 h ALA 35 N 1.18 1.21 -0.26 3.43 0.00 -1.72 -2.23 119.26 120.87 2a14 h ALA 35 Ca 0.20 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 2a14 h ALA 35 Cb -0.04 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.36 2a14 h ALA 35 CO -0.04 0.66 -0.18 0.93 0.00 0.00 0.00 179.25 180.63 2a14 h GLU 36 N 1.29 0.46 -0.26 0.00 4.39 -0.58 -0.69 114.58 119.20 2a14 h GLU 36 Ca 0.33 -0.15 -0.04 0.00 0.34 0.00 0.00 59.36 59.84 2a14 h GLU 36 Cb -0.03 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 2a14 h GLU 36 CO -0.06 0.62 -0.01 1.98 -1.16 0.00 0.00 179.01 180.38 2a14 h MET 37 N 0.42 0.46 -0.49 2.33 4.05 -0.70 -0.45 114.93 120.55 2a14 h MET 37 Ca 0.07 -0.15 0.06 0.00 -0.28 0.00 0.00 59.70 59.39 2a14 h MET 37 Cb 0.55 -0.04 -0.05 0.00 -0.80 0.00 0.00 31.60 31.27 2a14 h MET 37 CO 0.04 0.64 0.20 1.25 0.23 0.00 0.00 176.91 179.27 2a14 h LEU 38 N 0.23 0.25 -0.42 3.39 5.85 -1.20 -1.80 115.31 121.61 2a14 h LEU 38 Ca 0.07 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.85 2a14 h LEU 38 Cb 0.44 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2a14 h LEU 38 CO 0.02 0.18 0.27 0.11 -0.34 0.00 0.00 178.44 178.67 2a14 h LYS 39 N 0.40 0.52 -0.27 1.25 1.57 -0.89 0.32 116.57 119.48 2a14 h LYS 39 Ca 0.23 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 59.02 2a14 h LYS 39 Cb 0.20 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.35 2a14 h LYS 39 CO -0.20 0.35 0.02 0.35 -0.57 0.00 0.00 179.45 179.40 2a14 h PHE 40 N 0.54 0.03 -0.61 -1.35 3.57 -0.80 0.96 116.94 119.28 2a14 h PHE 40 Ca 0.16 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 2a14 h PHE 40 Cb -0.03 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 2a14 h PHE 40 CO -0.06 -0.02 0.30 -0.91 -2.23 0.00 0.00 178.31 175.40 2a14 h ASN 41 N 0.11 0.79 -0.91 0.41 2.35 -0.96 -0.68 115.58 116.70 2a14 h ASN 41 Ca 0.13 -0.12 -0.02 0.00 -0.55 0.00 0.00 56.30 55.74 2a14 h ASN 41 Cb 0.15 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.28 2a14 h ASN 41 CO -0.20 0.69 0.51 -0.07 -1.65 0.00 0.00 177.43 176.72 2a14 h LEU 42 N 0.83 1.13 -0.09 1.61 3.38 -0.51 0.90 115.31 122.57 2a14 h LEU 42 Ca 0.21 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 2a14 h LEU 42 Cb 0.11 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 2a14 h LEU 42 CO -0.03 0.90 0.04 -0.33 0.09 0.00 0.00 178.44 179.11 2a14 h GLU 43 N 1.27 0.12 -0.67 1.13 5.08 -0.45 -1.01 114.58 120.06 2a14 h GLU 43 Ca 0.32 -0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.71 2a14 h GLU 43 Cb 0.01 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.19 2a14 h GLU 43 CO -0.05 0.21 0.39 0.00 -1.00 0.00 0.00 179.01 178.55 2a14 h LEU 45 N 0.74 0.65 -0.63 0.00 3.38 -0.69 -0.79 115.31 117.98 2a14 h LEU 45 Ca 0.29 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 2a14 h LEU 45 Cb 0.12 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2a14 h LEU 45 CO -0.15 0.91 0.21 -0.74 0.09 0.00 0.00 178.44 178.76 2a14 h HIS 46 N 0.55 1.00 -0.62 1.13 2.76 -0.93 -0.35 115.15 118.69 2a14 h HIS 46 Ca 0.07 -0.10 -0.02 0.00 -2.20 0.00 0.00 60.37 58.12 2a14 h HIS 46 Cb 0.78 -0.29 -0.03 0.00 1.55 0.00 0.00 27.41 29.42 2a14 h HIS 46 CO 0.03 0.82 0.32 0.87 -1.30 0.00 0.00 177.93 178.67 2a14 h LYS 47 N 0.90 0.88 -0.31 5.26 1.57 -1.08 0.13 116.57 123.92 2a14 h LYS 47 Ca 0.20 -0.12 -0.17 0.00 -1.87 0.00 0.00 60.65 58.70 2a14 h LYS 47 Cb 0.28 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 2a14 h LYS 47 CO -0.01 0.69 -0.45 1.15 -0.57 0.00 0.00 179.45 180.26 2a14 h THR 48 N 0.85 1.28 -0.00 -0.16 2.02 -0.90 -3.37 112.91 112.63 2a14 h THR 48 Ca 0.22 -1.64 0.00 0.00 0.77 0.00 0.00 66.41 65.76 2a14 h THR 48 Cb 0.08 1.58 0.00 0.00 -1.74 0.00 0.00 68.15 68.07 2a14 h THR 48 CO -0.03 0.53 -0.36 0.49 0.37 0.00 0.00 175.52 176.53 2a14 n PHE 49 N -4.08 0.00 -1.03 3.16 3.72 -0.16 -0.47 117.46 118.59 2a14 n PHE 49 Ca -0.04 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.35 2a14 n PHE 49 Cb 0.58 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.12 2a14 n PHE 49 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2a14 n GLY 50 N 1.16 -1.14 3.56 1.37 0.00 0.46 -4.55 105.19 106.05 2a14 n GLY 50 Ca 0.02 -1.67 -0.55 0.00 0.00 0.00 0.00 46.02 43.81 2a14 n GLY 50 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2a14 n PRO 51 N -1.10 0.66 -0.68 1.61 -0.02 -1.26 -0.87 135.00 133.34 2a14 n PRO 51 Ca 0.01 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 2a14 n PRO 51 Cb 0.02 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 2a14 n PRO 51 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2a14 n GLY 52 N 2.20 1.22 0.00 -1.23 0.00 -1.26 -5.01 105.19 101.11 2a14 n GLY 52 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2a14 n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a14 n GLY 53 N -2.00 1.70 3.78 -0.02 0.00 -0.05 -5.06 105.19 103.54 2a14 n GLY 53 Ca 0.00 -1.86 -0.36 0.00 0.00 0.00 0.00 46.02 43.79 2a14 n GLY 53 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a14 s LEU 54 N 0.00 4.09 0.05 0.99 1.43 0.38 -4.97 118.68 120.65 2a14 s LEU 54 Ca 0.00 2.06 -0.15 0.00 -1.03 0.00 0.00 54.13 55.01 2a14 s LEU 54 Cb 0.00 -4.23 0.03 0.00 0.03 0.00 0.00 46.19 42.01 2a14 s LEU 54 CO 0.00 -0.57 0.34 0.00 0.23 0.00 0.00 176.35 176.34 2a14 s GLN 55 N -2.61 0.86 0.00 1.70 -2.07 -1.26 -4.70 119.66 111.58 2a14 s GLN 55 Ca 0.60 -0.49 0.00 0.00 -1.82 0.00 0.00 55.36 53.65 2a14 s GLN 55 Cb -0.22 0.38 0.00 0.00 -1.09 0.00 0.00 33.01 32.08 2a14 s GLN 55 CO 0.27 -0.29 0.00 0.41 -1.32 0.00 0.00 175.29 174.37 2a14 n GLY 56 N 0.49 -1.09 0.13 2.60 0.00 -0.47 -5.03 105.19 101.82 2a14 n GLY 56 Ca -0.18 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 44.83 2a14 n GLY 56 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2a14 n ASP 57 N 0.17 1.98 -4.12 1.61 8.00 -1.26 -3.94 116.55 118.99 2a14 n ASP 57 Ca 0.00 0.23 -0.24 0.00 0.71 0.00 0.00 54.79 55.49 2a14 n ASP 57 Cb 0.00 -0.80 -0.16 0.00 -0.02 0.00 0.00 41.12 40.14 2a14 n ASP 57 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2a14 s THR 58 N -2.48 1.26 -0.01 -3.53 -4.23 -1.26 -1.80 115.64 103.59 2a14 s THR 58 Ca -0.30 -0.65 0.04 0.00 -1.18 0.00 0.00 61.69 59.59 2a14 s THR 58 Cb 0.09 -1.07 -0.01 0.00 1.34 0.00 0.00 72.50 72.84 2a14 s THR 58 CO 0.62 0.36 -0.12 -0.22 -0.54 0.00 0.00 174.62 174.73 2a14 s LEU 59 N -0.12 2.02 -0.18 4.79 0.20 -0.04 -1.94 118.68 123.41 2a14 s LEU 59 Ca 0.01 -0.21 0.01 0.00 0.69 0.00 0.00 54.13 54.62 2a14 s LEU 59 Cb -0.09 -0.61 0.03 0.00 -0.43 0.00 0.00 46.19 45.10 2a14 s LEU 59 CO 0.01 0.14 -0.14 -0.63 -0.29 0.00 0.00 176.35 175.44 2a14 s ILE 60 N -0.28 1.77 -0.12 6.68 1.01 -0.11 -0.99 121.20 129.15 2a14 s ILE 60 Ca 0.05 -0.93 -0.19 0.00 0.00 0.00 0.00 60.65 59.58 2a14 s ILE 60 Cb -0.05 -1.72 -0.04 0.00 0.01 0.00 0.00 42.46 40.66 2a14 s ILE 60 CO -0.00 0.33 0.51 -0.62 0.00 0.00 0.00 174.94 175.16 2a14 s ASP 61 N 1.37 6.70 -0.15 3.58 2.15 0.60 -0.51 116.67 130.42 2a14 s ASP 61 Ca 0.02 0.84 -0.01 0.00 0.43 0.00 0.00 52.55 53.82 2a14 s ASP 61 Cb -0.15 -2.30 -0.02 0.00 -0.30 0.00 0.00 42.92 40.16 2a14 s ASP 61 CO -0.10 -0.04 -0.10 -0.63 -0.17 0.00 0.00 175.17 174.13 2a14 s ILE 62 N 0.79 3.25 -0.70 4.11 -1.09 0.64 -2.12 121.20 126.09 2a14 s ILE 62 Ca 0.27 -0.58 -0.03 0.00 -2.23 0.00 0.00 60.65 58.08 2a14 s ILE 62 Cb -0.15 -2.39 0.00 0.00 -1.58 0.00 0.00 42.46 38.34 2a14 s ILE 62 CO 0.11 0.51 0.60 0.61 -1.23 0.00 0.00 174.94 175.54 2a14 n GLY 63 N 3.70 0.11 0.35 6.18 0.00 -0.49 -4.29 105.19 110.76 2a14 n GLY 63 Ca -0.18 -0.18 0.18 0.00 0.00 0.00 0.00 46.02 45.84 2a14 n GLY 63 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2a14 h SER 64 N -1.31 0.00 0.00 1.61 0.02 -0.92 -3.43 113.55 109.52 2a14 h SER 64 Ca -0.31 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 2a14 h SER 64 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 2a14 h SER 64 CO 0.29 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.59 2a14 n GLY 65 N -1.40 0.99 1.34 -3.77 0.00 -1.26 -2.50 105.19 98.60 2a14 n GLY 65 Ca 0.02 -0.65 0.01 0.00 0.00 0.00 0.00 46.02 45.40 2a14 n GLY 65 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2a14 n PRO 66 N 0.00 2.90 -4.19 1.61 -0.04 -1.26 -4.62 135.00 129.40 2a14 n PRO 66 Ca 0.00 -1.72 -0.30 0.00 -0.04 0.00 0.00 63.50 61.44 2a14 n PRO 66 Cb 0.00 -1.88 -0.09 0.00 -0.04 0.00 0.00 33.50 31.49 2a14 n PRO 66 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2a14 s THR 67 N -1.94 3.62 0.00 0.52 -4.23 -1.04 -4.67 115.64 107.91 2a14 s THR 67 Ca 0.30 -1.17 0.00 0.00 -1.18 0.00 0.00 61.69 59.65 2a14 s THR 67 Cb 0.24 -2.71 0.00 0.00 1.34 0.00 0.00 72.50 71.36 2a14 s THR 67 CO 0.08 0.11 0.27 2.30 -0.54 0.00 0.00 174.62 176.84 2a14 n ILE 68 N 0.63 0.00 0.19 2.99 -6.64 -1.26 -4.77 119.36 110.50 2a14 n ILE 68 Ca -0.12 -0.43 0.07 0.00 -1.77 0.00 0.00 62.75 60.49 2a14 n ILE 68 Cb 0.52 1.08 0.57 0.00 -1.44 0.00 0.00 39.64 40.37 2a14 n ILE 68 CO 0.00 0.00 0.00 0.10 -1.77 0.00 0.00 176.55 174.88 2a14 h TYR 69 N 0.00 0.13 0.00 4.28 -0.00 -1.96 -2.73 116.97 116.69 2a14 h TYR 69 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 2a14 h TYR 69 Cb 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 36.73 36.73 2a14 h TYR 69 CO 0.00 0.10 0.00 0.00 -0.00 0.00 0.00 178.16 178.26 2a14 n GLN 70 N -4.50 0.08 -0.06 0.10 0.00 -1.26 -2.52 117.38 109.23 2a14 n GLN 70 Ca -0.01 0.35 0.02 0.00 0.00 0.00 0.00 57.00 57.36 2a14 n GLN 70 Cb 0.10 -1.67 0.05 0.00 0.00 0.00 0.00 30.24 28.73 2a14 n GLN 70 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.06 178.39 2a14 n VAL 71 N -1.82 1.08 -0.19 -0.39 0.24 -1.03 -4.66 118.33 111.55 2a14 n VAL 71 Ca 0.03 -1.09 -0.09 0.00 -2.04 0.00 0.00 64.34 61.15 2a14 n VAL 71 Cb 0.18 0.44 0.01 0.00 -1.47 0.00 0.00 33.84 33.00 2a14 n VAL 71 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2a14 h LEU 72 N 0.58 0.85 -0.03 1.34 3.38 -1.59 -1.93 115.31 117.91 2a14 h LEU 72 Ca 0.00 -0.26 -0.26 0.00 0.09 0.00 0.00 57.88 57.45 2a14 h LEU 72 Cb 0.61 -0.22 0.02 0.00 0.09 0.00 0.00 40.66 41.15 2a14 h LEU 72 CO 0.01 0.89 -1.02 0.00 0.09 0.00 0.00 178.44 178.41 2a14 h ALA 73 N 0.99 0.17 -0.49 1.53 0.00 -1.84 -3.33 119.26 116.28 2a14 h ALA 73 Ca 0.16 -0.69 0.03 0.00 0.00 0.00 0.00 54.91 54.41 2a14 h ALA 73 Cb 0.40 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2a14 h ALA 73 CO 0.01 0.70 0.33 0.00 0.00 0.00 0.00 179.25 180.29 2a14 h ALA 74 N 0.46 1.77 0.00 0.00 0.00 -1.77 -2.64 119.26 117.08 2a14 h ALA 74 Ca -0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2a14 h ALA 74 Cb 1.67 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.30 2a14 h ALA 74 CO 0.20 0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.62 2a14 h ASP 76 N 0.00 0.00 0.00 0.00 3.32 -1.69 -3.38 116.42 114.67 2a14 h ASP 76 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2a14 h ASP 76 Cb 0.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.81 2a14 h ASP 76 CO 0.00 0.07 0.00 -1.54 -1.72 0.00 0.00 179.24 176.05 2a14 n SER 77 N -3.13 0.09 -3.76 6.45 3.41 -0.26 -4.96 113.62 111.46 2a14 n SER 77 Ca 0.03 -0.46 -0.26 0.00 -0.26 0.00 0.00 58.87 57.93 2a14 n SER 77 Cb 0.52 0.68 -0.17 0.00 -0.26 0.00 0.00 64.21 64.98 2a14 n SER 77 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2a14 s PHE 78 N -0.68 0.92 -0.18 7.33 0.08 -0.37 -1.36 117.98 123.72 2a14 s PHE 78 Ca 0.00 -0.59 0.18 0.00 0.12 0.00 0.00 56.93 56.63 2a14 s PHE 78 Cb 0.00 -0.96 0.21 0.00 -0.57 0.00 0.00 43.02 41.71 2a14 s PHE 78 CO 0.00 -0.50 1.52 -0.56 -0.10 0.00 0.00 175.22 175.58 2a14 h GLN 79 N 8.27 0.00 -4.79 0.44 -0.00 -1.67 -3.41 115.11 113.95 2a14 h GLN 79 Ca -0.18 0.00 -0.68 0.00 -0.00 0.00 0.00 58.65 57.79 2a14 h GLN 79 Cb 1.12 0.00 -0.35 0.00 -0.00 0.00 0.00 27.48 28.25 2a14 h GLN 79 CO 0.31 0.37 -0.74 0.34 -0.00 0.00 0.00 178.83 179.12 2a14 s ASP 80 N -6.38 4.71 -0.11 0.06 -1.08 -0.75 -4.59 116.67 108.53 2a14 s ASP 80 Ca 0.04 -1.45 0.00 0.00 -0.52 0.00 0.00 52.55 50.62 2a14 s ASP 80 Cb 0.07 -1.64 -0.02 0.00 -1.46 0.00 0.00 42.92 39.87 2a14 s ASP 80 CO 0.72 -0.26 -0.12 -0.63 0.52 0.00 0.00 175.17 175.41 2a14 s ILE 81 N 1.15 3.22 -0.14 4.11 1.01 -0.09 -0.86 121.20 129.59 2a14 s ILE 81 Ca -0.05 -0.62 -0.04 0.00 0.00 0.00 0.00 60.65 59.95 2a14 s ILE 81 Cb -0.20 -2.34 -0.03 0.00 0.01 0.00 0.00 42.46 39.90 2a14 s ILE 81 CO -0.04 0.54 -0.00 -0.89 0.00 0.00 0.00 174.94 174.55 2a14 s THR 82 N 0.06 4.24 0.09 2.92 2.01 -0.17 -0.76 115.64 124.04 2a14 s THR 82 Ca -0.04 -0.24 0.04 0.00 0.31 0.00 0.00 61.69 61.75 2a14 s THR 82 Cb -0.14 -2.85 -0.04 0.00 0.01 0.00 0.00 72.50 69.47 2a14 s THR 82 CO 0.04 0.51 0.05 -0.76 -0.69 0.00 0.00 174.62 173.78 2a14 s LEU 83 N 0.04 3.67 -0.14 4.42 1.43 -0.82 -0.29 118.68 126.99 2a14 s LEU 83 Ca 0.02 -0.08 -0.20 0.00 -1.03 0.00 0.00 54.13 52.84 2a14 s LEU 83 Cb -0.13 -2.37 0.05 0.00 0.03 0.00 0.00 46.19 43.77 2a14 s LEU 83 CO 0.02 0.17 0.52 -0.94 0.23 0.00 0.00 176.35 176.35 2a14 s SER 84 N -2.40 -0.51 0.04 2.29 1.04 -0.90 -1.09 113.70 112.18 2a14 s SER 84 Ca 0.28 0.84 -0.14 0.00 0.48 0.00 0.00 55.95 57.41 2a14 s SER 84 Cb -0.12 0.86 0.02 0.00 0.10 0.00 0.00 66.02 66.88 2a14 s SER 84 CO 0.21 -0.30 0.32 -0.62 0.98 0.00 0.00 173.24 173.82 2a14 s ASP 85 N -0.25 -0.15 0.27 7.02 2.15 -0.63 -0.33 116.67 124.76 2a14 s ASP 85 Ca -0.04 -0.14 0.04 0.00 0.43 0.00 0.00 52.55 52.84 2a14 s ASP 85 Cb -0.03 0.36 0.39 0.00 -0.30 0.00 0.00 42.92 43.34 2a14 s ASP 85 CO 0.03 -0.60 1.68 0.15 -0.17 0.00 0.00 175.17 176.26 2a14 h PHE 86 N 3.26 0.42 -3.64 -5.34 3.57 -1.86 -2.74 116.94 110.62 2a14 h PHE 86 Ca -0.31 -0.11 -0.62 0.00 3.53 0.00 0.00 57.97 60.46 2a14 h PHE 86 Cb 1.20 -0.09 -0.14 0.00 2.79 0.00 0.00 35.95 39.71 2a14 h PHE 86 CO 0.46 0.69 -0.21 0.99 -2.23 0.00 0.00 178.31 178.01 2a14 s THR 87 N -4.23 5.17 0.18 4.41 2.01 -1.26 -4.80 115.64 117.12 2a14 s THR 87 Ca -0.06 0.63 -0.13 0.00 0.31 0.00 0.00 61.69 62.45 2a14 s THR 87 Cb 0.13 -3.72 0.09 0.00 0.01 0.00 0.00 72.50 69.01 2a14 s THR 87 CO 0.79 0.18 1.75 0.44 -0.69 0.00 0.00 174.62 177.08 2a14 h ASP 88 N 7.92 0.17 -0.72 3.53 3.32 -1.90 -1.38 116.42 127.38 2a14 h ASP 88 Ca -0.33 0.06 0.10 0.00 0.02 0.00 0.00 57.03 56.89 2a14 h ASP 88 Cb 1.16 0.04 -0.05 0.00 0.22 0.00 0.00 39.33 40.71 2a14 h ASP 88 CO 0.67 0.13 0.47 0.03 -1.72 0.00 0.00 179.24 178.82 2a14 h ARG 89 N 0.35 0.56 -0.27 3.56 3.08 -1.91 -1.25 114.38 118.49 2a14 h ARG 89 Ca 0.23 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 60.17 2a14 h ARG 89 Cb 0.24 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 2a14 h ARG 89 CO -0.24 0.37 -0.14 -0.91 -1.07 0.00 0.00 179.97 177.98 2a14 h ASN 90 N 0.58 0.60 -0.77 7.04 2.35 -1.59 -2.34 115.58 121.44 2a14 h ASN 90 Ca 0.33 -0.41 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 2a14 h ASN 90 Cb 0.52 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 38.69 2a14 h ASN 90 CO -0.11 0.88 0.49 0.03 -1.65 0.00 0.00 177.43 177.06 2a14 h ARG 91 N 0.32 1.04 -0.57 0.81 3.08 -0.95 -1.56 114.38 116.54 2a14 h ARG 91 Ca 0.06 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2a14 h ARG 91 Cb 0.66 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 30.45 2a14 h ARG 91 CO 0.04 0.71 0.38 1.49 -1.07 0.00 0.00 179.97 181.52 2a14 h GLU 92 N 1.06 0.76 -0.48 0.04 4.81 -1.14 -1.27 114.58 118.37 2a14 h GLU 92 Ca 0.28 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.46 2a14 h GLU 92 Cb -0.08 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.11 2a14 h GLU 92 CO -0.06 0.51 0.29 0.93 -0.73 0.00 0.00 179.01 179.95 2a14 h GLU 93 N 0.78 0.65 -0.34 1.92 4.39 -0.85 -1.51 114.58 119.62 2a14 h GLU 93 Ca 0.21 -0.06 0.04 0.00 0.34 0.00 0.00 59.36 59.89 2a14 h GLU 93 Cb -0.08 -0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 28.40 2a14 h GLU 93 CO -0.04 0.48 0.11 -0.07 -1.16 0.00 0.00 179.01 178.33 2a14 h LEU 94 N 0.64 0.12 -1.18 1.33 3.38 -1.04 -2.39 115.31 116.17 2a14 h LEU 94 Ca 0.17 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 2a14 h LEU 94 Cb -0.00 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 2a14 h LEU 94 CO -0.03 0.10 0.27 -0.33 0.09 0.00 0.00 178.44 178.54 2a14 h GLU 95 N 0.26 0.84 -0.67 1.13 5.08 -0.95 -0.84 114.58 119.43 2a14 h GLU 95 Ca 0.16 -0.11 0.03 0.00 -1.00 0.00 0.00 59.36 58.43 2a14 h GLU 95 Cb 0.14 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 2a14 h GLU 95 CO -0.17 0.67 0.42 0.87 -1.00 0.00 0.00 179.01 179.80 2a14 h LYS 96 N 0.84 0.80 -0.22 2.33 1.57 -0.87 0.11 116.57 121.13 2a14 h LYS 96 Ca 0.21 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.90 2a14 h LYS 96 Cb 0.11 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 2a14 h LYS 96 CO -0.02 0.53 -0.03 2.35 -0.57 0.00 0.00 179.45 181.71 2a14 h TRP 97 N 0.82 0.44 -0.52 -1.35 7.01 -0.91 -0.13 115.95 121.32 2a14 h TRP 97 Ca 0.27 -0.09 -0.05 0.00 2.11 0.00 0.00 58.89 61.13 2a14 h TRP 97 Cb 0.01 -0.11 -0.02 0.00 -2.10 0.00 0.00 29.16 26.93 2a14 h TRP 97 CO -0.04 0.61 0.13 -0.07 -2.79 0.00 0.00 178.44 176.28 2a14 h LEU 98 N 0.15 0.73 -0.01 0.65 3.38 -0.91 -2.44 115.31 116.85 2a14 h LEU 98 Ca 0.06 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2a14 h LEU 98 Cb 0.46 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2a14 h LEU 98 CO 0.02 0.71 -0.08 0.29 0.09 0.00 0.00 178.44 179.47 2a14 n LYS 99 N -4.29 0.07 -3.66 1.13 5.02 0.00 -4.94 118.16 111.49 2a14 n LYS 99 Ca 0.04 -0.01 -0.23 0.00 -2.02 0.00 0.00 58.31 56.09 2a14 n LYS 99 Cb 0.22 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 33.78 2a14 n LYS 99 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2a14 n LYS 100 N -1.46 -6.01 -1.88 1.97 5.02 -0.74 -5.00 118.16 110.06 2a14 n LYS 100 Ca 0.08 0.71 -0.31 0.00 -2.02 0.00 0.00 58.31 56.76 2a14 n LYS 100 Cb 0.33 -5.54 0.01 0.00 -0.02 0.00 0.00 35.03 29.81 2a14 n LYS 100 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2a14 s GLU 101 N -6.03 3.56 0.43 1.97 2.02 -0.14 -4.96 118.70 115.55 2a14 s GLU 101 Ca 0.25 0.79 0.19 0.00 0.02 0.00 0.00 54.97 56.21 2a14 s GLU 101 Cb -0.12 -2.07 1.12 0.00 0.10 0.00 0.00 34.13 33.16 2a14 s GLU 101 CO 0.78 -0.60 1.87 -1.35 0.02 0.00 0.00 175.26 175.98 2a14 h PRO 102 N -0.27 0.35 -0.03 0.39 0.11 -1.95 -2.08 132.00 128.52 2a14 h PRO 102 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2a14 h PRO 102 Cb 1.19 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2a14 h PRO 102 CO 0.61 0.23 0.00 0.41 -0.21 0.00 0.00 178.00 179.05 2a14 n GLY 103 N -1.54 -0.56 3.72 -0.55 0.00 -1.26 -4.94 105.19 100.06 2a14 n GLY 103 Ca 0.18 -0.27 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 2a14 n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a14 n ALA 104 N -0.46 2.01 -1.77 4.61 0.00 -0.78 -4.95 120.51 119.17 2a14 n ALA 104 Ca 0.19 0.38 -0.38 0.00 0.00 0.00 0.00 53.44 53.63 2a14 n ALA 104 Cb 0.19 -2.39 -0.02 0.00 0.00 0.00 0.00 19.45 17.23 2a14 n ALA 104 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2a14 s TYR 105 N -0.17 2.98 -0.53 0.00 5.04 -1.26 -4.97 117.35 118.43 2a14 s TYR 105 Ca 0.64 1.55 -0.22 0.00 -2.44 0.00 0.00 57.07 56.59 2a14 s TYR 105 Cb -0.55 -3.38 0.05 0.00 0.35 0.00 0.00 41.96 38.44 2a14 s TYR 105 CO 0.51 -1.39 0.82 0.34 -1.34 0.00 0.00 175.55 174.49 2a14 s ASP 106 N -1.27 6.30 -0.00 4.32 -1.08 -1.26 -4.89 116.67 118.78 2a14 s ASP 106 Ca 0.60 -0.56 0.19 0.00 -0.52 0.00 0.00 52.55 52.27 2a14 s ASP 106 Cb -0.29 -2.38 0.55 0.00 -1.46 0.00 0.00 42.92 39.33 2a14 s ASP 106 CO 0.36 -1.09 1.45 0.79 0.52 0.00 0.00 175.17 177.20 2a14 n TRP 107 N 6.96 0.84 -0.20 -5.34 7.02 -1.26 -4.72 117.44 120.73 2a14 n TRP 107 Ca -0.01 -0.41 0.01 0.00 -1.02 0.00 0.00 57.50 56.06 2a14 n TRP 107 Cb 0.47 -0.01 0.11 0.00 -2.42 0.00 0.00 31.31 29.46 2a14 n TRP 107 CO 0.00 0.00 0.00 1.15 -2.02 0.00 0.00 177.69 176.82 2a14 h THR 108 N 3.59 0.60 -0.97 -0.99 2.02 -1.99 -0.72 112.91 114.44 2a14 h THR 108 Ca 0.00 -0.08 0.07 0.00 0.77 0.00 0.00 66.41 67.18 2a14 h THR 108 Cb 0.84 0.35 -0.07 0.00 -1.74 0.00 0.00 68.15 67.53 2a14 h THR 108 CO 0.01 0.04 0.62 -0.65 0.37 0.00 0.00 175.52 175.91 2a14 h PRO 109 N 0.23 1.07 -0.38 6.66 0.11 -1.99 0.11 132.00 137.81 2a14 h PRO 109 Ca 0.32 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.28 2a14 h PRO 109 Cb 0.50 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 2a14 h PRO 109 CO -0.44 0.71 -0.13 0.00 -0.21 0.00 0.00 178.00 177.92 2a14 h ALA 110 N 1.46 0.53 -0.33 -0.75 0.00 -1.55 -1.50 119.26 117.13 2a14 h ALA 110 Ca 0.43 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 55.02 2a14 h ALA 110 Cb 0.23 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2a14 h ALA 110 CO -0.19 0.43 0.19 0.28 0.00 0.00 0.00 179.25 179.96 2a14 h VAL 111 N 0.56 1.04 -0.53 0.00 2.07 -0.75 0.11 116.25 118.75 2a14 h VAL 111 Ca 0.09 -0.14 0.03 0.00 0.82 0.00 0.00 66.70 67.51 2a14 h VAL 111 Cb 0.67 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 2a14 h VAL 111 CO 0.05 0.07 0.30 0.11 0.02 0.00 0.00 177.57 178.12 2a14 h LYS 112 N 0.39 0.58 -0.35 1.57 1.57 -0.74 -1.14 116.57 118.45 2a14 h LYS 112 Ca 0.13 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.85 2a14 h LYS 112 Cb -0.00 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 2a14 h LYS 112 CO -0.06 0.38 0.14 0.35 -0.57 0.00 0.00 179.45 179.70 2a14 h PHE 113 N 0.60 0.54 -0.77 -1.35 3.57 -0.95 0.12 116.94 118.70 2a14 h PHE 113 Ca 0.22 -0.04 0.12 0.00 3.53 0.00 0.00 57.97 61.80 2a14 h PHE 113 Cb 0.06 -0.16 -0.08 0.00 2.79 0.00 0.00 35.95 38.55 2a14 h PHE 113 CO -0.07 0.50 0.38 0.00 -2.23 0.00 0.00 178.31 176.88 2a14 h ALA 114 N 0.98 1.10 -0.23 2.41 0.00 -0.71 -1.58 119.26 121.24 2a14 h ALA 114 Ca 0.12 0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.95 2a14 h ALA 114 Cb 0.19 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2a14 h ALA 114 CO -0.01 -0.08 -0.50 0.00 0.00 0.00 0.00 179.25 178.66 2a14 h GLU 116 N 0.50 0.83 0.00 0.00 4.81 -0.21 -0.61 114.58 119.90 2a14 h GLU 116 Ca 0.02 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 2a14 h GLU 116 Cb 1.05 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 30.24 2a14 h GLU 116 CO 0.10 0.55 -0.04 -0.07 -0.73 0.00 0.00 179.01 178.82 2a14 h LEU 117 N 0.86 0.00 -1.03 1.64 3.38 -1.14 -1.06 115.31 117.96 2a14 h LEU 117 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 2a14 h LEU 117 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 2a14 h LEU 117 CO -0.22 0.04 -0.04 -0.62 0.09 0.00 0.00 178.44 177.70 2a14 n GLU 118 N -3.91 1.65 0.00 1.13 1.02 -0.32 -4.94 120.64 115.27 2a14 n GLU 118 Ca -0.03 -1.03 0.00 0.00 -0.02 0.00 0.00 57.16 56.08 2a14 n GLU 118 Cb 0.13 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 2a14 n GLU 118 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2a14 n GLY 119 N 1.22 0.55 3.17 0.62 0.00 -0.40 -5.03 105.19 105.31 2a14 n GLY 119 Ca 0.17 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.21 2a14 n GLY 119 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2a14 s ASN 120 N -2.82 -1.46 0.20 1.61 3.84 -0.71 -4.98 114.94 110.63 2a14 s ASN 120 Ca 0.00 -0.43 0.19 0.00 0.21 0.00 0.00 52.86 52.83 2a14 s ASN 120 Cb 0.00 1.94 0.85 0.00 -0.55 0.00 0.00 41.25 43.49 2a14 s ASN 120 CO 0.00 -0.23 1.57 -1.54 -2.79 0.00 0.00 177.10 174.11 2a14 n SER 121 N 4.81 0.44 0.23 -4.21 3.41 -1.24 -2.81 113.62 114.25 2a14 n SER 121 Ca 0.08 0.64 0.15 0.00 -0.26 0.00 0.00 58.87 59.49 2a14 n SER 121 Cb 0.55 -0.72 0.52 0.00 -0.26 0.00 0.00 64.21 64.30 2a14 n SER 121 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2a14 h GLY 122 N 1.39 0.00 -2.83 5.00 0.00 -1.91 -3.19 103.07 101.54 2a14 h GLY 122 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.13 2a14 h GLY 122 CO 0.00 0.00 0.26 0.54 0.00 0.00 0.00 176.54 177.34 2a14 n ARG 123 N -2.90 1.84 -0.22 4.80 1.74 -1.12 -4.55 116.66 116.23 2a14 n ARG 123 Ca 0.02 -1.46 -0.09 0.00 -0.77 0.00 0.00 57.85 55.55 2a14 n ARG 123 Cb 0.35 -1.62 0.03 0.00 -1.02 0.00 0.00 32.46 30.21 2a14 n ARG 123 CO 0.00 0.00 0.00 0.11 -1.52 0.00 0.00 177.63 176.22 2a14 h TRP 124 N 0.75 1.19 -0.82 -1.55 5.08 -1.81 -2.24 115.95 116.54 2a14 h TRP 124 Ca 0.25 -0.19 -0.03 0.00 1.08 0.00 0.00 58.89 60.00 2a14 h TRP 124 Cb 1.78 -0.32 -0.04 0.00 -3.00 0.00 0.00 29.16 27.58 2a14 h TRP 124 CO 0.72 1.02 0.41 0.93 -1.28 0.00 0.00 178.44 180.24 2a14 h GLU 125 N 1.01 1.18 -0.55 0.12 5.08 -1.91 0.15 114.58 119.67 2a14 h GLU 125 Ca 0.19 -0.16 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2a14 h GLU 125 Cb 0.52 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 2a14 h GLU 125 CO 0.02 0.90 0.35 1.49 -1.00 0.00 0.00 179.01 180.77 2a14 h GLU 126 N 1.16 0.68 -0.21 2.33 4.81 -1.85 -1.29 114.58 120.21 2a14 h GLU 126 Ca 0.28 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.44 2a14 h GLU 126 Cb 0.10 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 2a14 h GLU 126 CO -0.04 0.45 0.01 -0.22 -0.73 0.00 0.00 179.01 178.48 2a14 h LYS 127 N 0.70 0.37 -0.36 1.92 3.64 -0.99 -0.53 116.57 121.32 2a14 h LYS 127 Ca 0.21 -0.12 0.08 0.00 -1.27 0.00 0.00 60.65 59.55 2a14 h LYS 127 Cb -0.04 -0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 31.67 2a14 h LYS 127 CO -0.07 0.56 -0.19 1.49 -2.27 0.00 0.00 179.45 178.97 2a14 h GLU 128 N 0.14 -0.13 -0.13 1.90 4.81 -0.77 -0.04 114.58 120.36 2a14 h GLU 128 Ca 0.06 0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.17 2a14 h GLU 128 Cb 0.39 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 2a14 h GLU 128 CO 0.01 -0.09 -0.47 0.93 -0.73 0.00 0.00 179.01 178.66 2a14 h GLU 129 N -0.13 0.32 -0.32 1.92 4.39 -1.17 -1.85 114.58 117.72 2a14 h GLU 129 Ca 0.18 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 2a14 h GLU 129 Cb 0.41 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 2a14 h GLU 129 CO -0.44 0.73 0.16 -0.22 -1.16 0.00 0.00 179.01 178.07 2a14 h LYS 130 N 0.26 0.47 0.05 2.33 3.64 -0.42 -0.43 116.57 122.46 2a14 h LYS 130 Ca 0.01 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2a14 h LYS 130 Cb 0.93 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.66 2a14 h LYS 130 CO 0.08 0.43 -0.03 1.25 -2.27 0.00 0.00 179.45 178.90 2a14 h LEU 131 N 0.39 -0.08 -0.80 5.20 5.85 -0.91 -1.55 115.31 123.42 2a14 h LEU 131 Ca 0.11 0.01 0.12 0.00 0.84 0.00 0.00 57.88 58.96 2a14 h LEU 131 Cb 0.11 0.03 -0.08 0.00 0.37 0.00 0.00 40.66 41.08 2a14 h LEU 131 CO -0.01 -0.05 0.41 -0.09 -0.34 0.00 0.00 178.44 178.35 2a14 h ARG 132 N -0.08 0.61 -0.20 1.25 2.43 -1.17 -0.36 114.38 116.86 2a14 h ARG 132 Ca -0.00 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.03 2a14 h ARG 132 Cb 0.07 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 2a14 h ARG 132 CO -0.00 0.40 -0.31 0.00 -1.51 0.00 0.00 179.97 178.55 2a14 h ALA 133 N 1.50 1.11 0.00 2.80 0.00 -0.84 -3.09 119.26 120.73 2a14 h ALA 133 Ca 0.41 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 2a14 h ALA 133 Cb 0.52 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2a14 h ALA 133 CO -0.32 0.56 -0.50 0.00 0.00 0.00 0.00 179.25 178.99 2a14 h ALA 134 N 1.33 0.88 -1.77 0.00 0.00 -0.05 -3.42 119.26 116.23 2a14 h ALA 134 Ca 0.04 -0.45 -0.56 0.00 0.00 0.00 0.00 54.91 53.94 2a14 h ALA 134 Cb 0.72 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.37 2a14 h ALA 134 CO 0.05 0.62 1.01 0.08 0.00 0.00 0.00 179.25 181.02 2a14 s VAL 135 N -3.42 4.03 -0.13 0.00 1.01 -0.71 -0.91 120.40 120.26 2a14 s VAL 135 Ca 0.01 1.05 0.19 0.00 0.00 0.00 0.00 61.98 63.22 2a14 s VAL 135 Cb 0.11 -4.35 -0.17 0.00 0.00 0.00 0.00 36.38 31.96 2a14 s VAL 135 CO 0.72 -0.84 0.68 0.29 0.00 0.00 0.00 175.10 175.95 2a14 n LYS 136 N 7.96 0.64 -3.52 2.72 4.76 0.06 -4.95 118.16 125.83 2a14 n LYS 136 Ca 0.15 0.09 -0.16 0.00 -2.87 0.00 0.00 58.31 55.52 2a14 n LYS 136 Cb 0.48 -1.71 -0.05 0.00 -1.84 0.00 0.00 35.03 31.91 2a14 n LYS 136 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2a14 s ARG 137 N -3.03 1.02 -0.16 1.97 1.70 -1.25 -5.08 118.95 114.11 2a14 s ARG 137 Ca -0.05 0.16 0.01 0.00 -0.47 0.00 0.00 55.73 55.38 2a14 s ARG 137 Cb 0.09 0.48 0.02 0.00 -0.57 0.00 0.00 34.95 34.98 2a14 s ARG 137 CO 0.83 -0.34 -0.16 0.08 -1.08 0.00 0.00 175.30 174.63 2a14 s VAL 138 N -1.48 1.75 0.14 4.99 1.01 -1.26 -1.94 120.40 123.62 2a14 s VAL 138 Ca -0.08 -0.77 0.09 0.00 0.00 0.00 0.00 61.98 61.21 2a14 s VAL 138 Cb -0.00 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 2a14 s VAL 138 CO 0.06 0.46 -0.20 -0.76 0.00 0.00 0.00 175.10 174.66 2a14 s LEU 139 N 1.41 2.37 0.49 3.92 1.43 -0.25 -4.99 118.68 123.06 2a14 s LEU 139 Ca 0.04 -0.78 -0.23 0.00 -1.03 0.00 0.00 54.13 52.14 2a14 s LEU 139 Cb -0.13 -0.90 -0.07 0.00 0.03 0.00 0.00 46.19 45.13 2a14 s LEU 139 CO -0.11 0.03 1.31 -0.75 0.23 0.00 0.00 176.35 177.06 2a14 s LYS 140 N -2.34 3.50 0.06 1.70 2.47 -1.26 -1.60 119.74 122.27 2a14 s LYS 140 Ca 0.12 2.14 -0.07 0.00 -1.56 0.00 0.00 55.97 56.60 2a14 s LYS 140 Cb -0.08 -2.43 -0.01 0.00 -1.46 0.00 0.00 37.83 33.85 2a14 s LYS 140 CO 0.06 -0.87 0.14 0.00 0.16 0.00 0.00 175.35 174.83 2a14 s ASP 142 N -2.61 0.43 0.14 0.00 -1.08 -0.21 -3.15 116.67 110.19 2a14 s ASP 142 Ca 0.02 0.12 0.15 0.00 -0.52 0.00 0.00 52.55 52.32 2a14 s ASP 142 Cb 0.03 1.00 0.68 0.00 -1.46 0.00 0.00 42.92 43.18 2a14 s ASP 142 CO -0.09 -0.31 1.46 1.33 0.52 0.00 0.00 175.17 178.09 2a14 n VAL 143 N 5.36 1.20 0.28 1.11 0.24 -1.26 -1.80 118.33 123.46 2a14 n VAL 143 Ca -0.04 0.41 0.12 0.00 -2.04 0.00 0.00 64.34 62.79 2a14 n VAL 143 Cb 0.50 -1.32 0.21 0.00 -1.47 0.00 0.00 33.84 31.76 2a14 n VAL 143 CO 0.00 0.00 0.00 0.45 -2.14 0.00 0.00 176.83 175.14 2a14 h HIS 144 N 0.00 0.00 -3.87 6.34 3.86 -1.94 -3.41 115.15 116.13 2a14 h HIS 144 Ca 0.00 0.00 -0.49 0.00 -1.16 0.00 0.00 60.37 58.72 2a14 h HIS 144 Cb 0.17 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.64 2a14 h HIS 144 CO 0.00 0.00 0.41 -0.51 0.86 0.00 0.00 177.93 178.69 2a14 s LEU 145 N -5.97 4.37 0.22 2.43 1.43 -0.74 -4.96 118.68 115.45 2a14 s LEU 145 Ca 0.07 2.05 -0.08 0.00 -1.03 0.00 0.00 54.13 55.15 2a14 s LEU 145 Cb 0.06 -3.92 0.34 0.00 0.03 0.00 0.00 46.19 42.70 2a14 s LEU 145 CO 0.66 -0.22 1.75 1.23 0.23 0.00 0.00 176.35 179.99 2a14 h GLY 146 N 3.23 0.97 -7.38 -3.19 0.00 -1.88 -2.96 103.07 91.86 2a14 h GLY 146 Ca -0.47 -0.14 -0.74 0.00 0.00 0.00 0.00 47.33 45.98 2a14 h GLY 146 CO 0.65 -0.03 -0.29 0.21 0.00 0.00 0.00 176.54 177.08 2a14 s ASN 147 N -5.40 5.87 0.61 0.19 2.47 -1.26 -4.71 114.94 112.72 2a14 s ASN 147 Ca -0.13 -2.13 0.28 0.00 0.42 0.00 0.00 52.86 51.30 2a14 s ASN 147 Cb 0.18 -2.05 1.41 0.00 -1.45 0.00 0.00 41.25 39.35 2a14 s ASN 147 CO 0.75 -0.66 1.82 -0.65 -3.72 0.00 0.00 177.10 174.64 2a14 h PRO 148 N 8.23 0.00 -0.09 0.43 0.11 -1.70 -1.23 132.00 137.76 2a14 h PRO 148 Ca -0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.96 2a14 h PRO 148 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2a14 h PRO 148 CO 0.85 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.92 2a14 n LEU 149 N -3.43 2.43 -4.60 2.35 4.77 -1.26 -1.04 117.00 116.21 2a14 n LEU 149 Ca 0.07 -0.87 -0.46 0.00 -0.03 0.00 0.00 56.01 54.72 2a14 n LEU 149 Cb 0.68 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.70 2a14 n LEU 149 CO 0.23 0.44 0.69 0.00 -1.33 0.00 0.00 177.39 177.42 2a14 n ALA 150 N 0.87 -0.18 1.84 -1.18 0.00 -0.47 -0.76 120.51 120.65 2a14 n ALA 150 Ca 0.17 0.42 0.15 0.00 0.00 0.00 0.00 53.44 54.17 2a14 n ALA 150 Cb 0.49 -2.07 0.79 0.00 0.00 0.00 0.00 19.45 18.67 2a14 n ALA 150 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2a14 n PRO 151 N 1.25 1.20 -2.22 0.00 -0.04 -1.26 -4.96 135.00 128.96 2a14 n PRO 151 Ca 0.12 -0.29 -0.39 0.00 -0.04 0.00 0.00 63.50 62.90 2a14 n PRO 151 Cb 0.30 -1.48 -0.02 0.00 -0.04 0.00 0.00 33.50 32.26 2a14 n PRO 151 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2a14 s ALA 152 N -1.99 3.24 -0.31 0.55 0.00 0.06 -5.01 121.76 118.30 2a14 s ALA 152 Ca 0.43 1.07 -0.01 0.00 0.00 0.00 0.00 51.96 53.46 2a14 s ALA 152 Cb 0.21 -3.42 0.10 0.00 0.00 0.00 0.00 23.12 20.01 2a14 s ALA 152 CO 0.35 -0.60 0.10 0.08 0.00 0.00 0.00 175.76 175.69 2a14 s VAL 153 N -1.32 0.91 0.55 0.00 1.01 -1.26 -4.60 120.40 115.69 2a14 s VAL 153 Ca 0.55 -1.42 -0.07 0.00 0.00 0.00 0.00 61.98 61.04 2a14 s VAL 153 Cb -0.34 -1.69 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 2a14 s VAL 153 CO 0.43 -0.67 0.89 -0.76 0.00 0.00 0.00 175.10 174.99 2a14 s LEU 154 N 1.60 3.41 0.71 3.92 1.43 -1.26 -5.05 118.68 123.44 2a14 s LEU 154 Ca 0.10 1.01 -0.15 0.00 -1.03 0.00 0.00 54.13 54.05 2a14 s LEU 154 Cb -0.17 -3.95 0.03 0.00 0.03 0.00 0.00 46.19 42.12 2a14 s LEU 154 CO -0.25 -0.80 1.20 -2.84 0.23 0.00 0.00 176.35 173.89 2a14 s PRO 155 N -4.94 2.30 0.28 1.29 0.02 -1.26 -4.92 135.00 127.78 2a14 s PRO 155 Ca 0.51 1.72 -0.30 0.00 0.02 0.00 0.00 61.00 62.96 2a14 s PRO 155 Cb -0.11 -1.86 -0.13 0.00 0.02 0.00 0.00 34.50 32.43 2a14 s PRO 155 CO 0.47 -1.71 1.28 1.28 -0.33 0.00 0.00 177.00 178.00 2a14 n LEU 156 N -2.58 2.99 -4.89 -5.54 4.77 -1.26 -4.96 117.00 105.54 2a14 n LEU 156 Ca 0.13 1.17 -0.23 0.00 -0.03 0.00 0.00 56.01 57.05 2a14 n LEU 156 Cb 0.50 -1.42 -0.04 0.00 -2.33 0.00 0.00 43.42 40.14 2a14 n LEU 156 CO 0.47 -0.68 -0.12 0.00 -1.33 0.00 0.00 177.39 175.73 2a14 s ALA 157 N -0.63 3.75 0.22 -1.18 0.00 0.41 -4.56 121.76 119.77 2a14 s ALA 157 Ca 0.62 -1.26 0.06 0.00 0.00 0.00 0.00 51.96 51.37 2a14 s ALA 157 Cb -0.64 -1.52 0.17 0.00 0.00 0.00 0.00 23.12 21.13 2a14 s ALA 157 CO 0.56 0.34 1.50 -0.44 0.00 0.00 0.00 175.76 177.72 2a14 h ASP 158 N 1.65 0.18 -3.67 0.00 3.32 -1.71 -0.77 116.42 115.41 2a14 h ASP 158 Ca -0.49 -0.12 -0.17 0.00 0.02 0.00 0.00 57.03 56.27 2a14 h ASP 158 Cb 1.22 -0.05 -0.27 0.00 0.22 0.00 0.00 39.33 40.45 2a14 h ASP 158 CO 0.62 0.83 -0.43 0.00 -1.72 0.00 0.00 179.24 178.55 2a14 s VAL 160 N 0.49 2.94 -0.06 0.00 1.01 -0.04 -0.93 120.40 123.80 2a14 s VAL 160 Ca -0.03 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.29 2a14 s VAL 160 Cb -0.04 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 34.08 2a14 s VAL 160 CO -0.03 0.52 -0.13 -0.22 0.00 0.00 0.00 175.10 175.24 2a14 s LEU 161 N 0.51 2.81 -0.27 3.92 2.96 0.33 -0.73 118.68 128.20 2a14 s LEU 161 Ca -0.09 -0.18 -0.06 0.00 -0.22 0.00 0.00 54.13 53.58 2a14 s LEU 161 Cb -0.16 -1.58 0.14 0.00 0.50 0.00 0.00 46.19 45.09 2a14 s LEU 161 CO 0.04 0.33 0.57 0.28 -1.32 0.00 0.00 176.35 176.25 2a14 s THR 162 N -0.65 -0.89 -0.14 3.68 -1.32 -0.21 -0.26 115.64 115.84 2a14 s THR 162 Ca 0.10 0.03 0.02 0.00 -1.21 0.00 0.00 61.69 60.63 2a14 s THR 162 Cb -0.11 -0.92 0.01 0.00 -1.51 0.00 0.00 72.50 69.97 2a14 s THR 162 CO 0.01 0.00 -0.22 -0.76 -2.21 0.00 0.00 174.62 171.45 2a14 s LEU 163 N 2.80 2.09 -1.44 9.08 1.02 -1.26 -2.31 118.68 128.66 2a14 s LEU 163 Ca 0.04 -0.60 0.00 0.00 0.02 0.00 0.00 54.13 53.59 2a14 s LEU 163 Cb -0.13 -1.43 0.00 0.00 0.02 0.00 0.00 46.19 44.65 2a14 s LEU 163 CO -0.18 0.08 0.00 0.18 0.02 0.00 0.00 176.35 176.45 2a14 n LEU 164 N 4.08 -0.82 -0.04 1.79 4.77 -0.53 -4.80 117.00 121.45 2a14 n LEU 164 Ca -0.20 0.33 -0.05 0.00 -0.03 0.00 0.00 56.01 56.06 2a14 n LEU 164 Cb 0.51 -2.35 -0.03 0.00 -2.33 0.00 0.00 43.42 39.22 2a14 n LEU 164 CO 0.27 -0.87 -0.74 0.00 -1.33 0.00 0.00 177.39 174.72 2a14 n ALA 165 N 1.25 1.91 -0.26 -1.18 0.00 -1.26 -4.60 120.51 116.37 2a14 n ALA 165 Ca -0.14 -0.30 0.02 0.00 0.00 0.00 0.00 53.44 53.02 2a14 n ALA 165 Cb 0.52 0.34 0.15 0.00 0.00 0.00 0.00 19.45 20.47 2a14 n ALA 165 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2a14 h MET 166 N -0.03 0.66 0.00 0.00 2.86 -1.91 0.78 114.93 117.29 2a14 h MET 166 Ca -0.16 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.44 2a14 h MET 166 Cb 1.24 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.75 2a14 h MET 166 CO -0.03 0.44 0.00 1.05 1.06 0.00 0.00 176.91 179.42 2a14 h GLU 167 N 0.68 0.00 0.09 1.72 9.09 -1.89 -1.46 114.58 122.82 2a14 h GLU 167 Ca 0.37 0.00 -0.33 0.00 0.05 0.00 0.00 59.36 59.45 2a14 h GLU 167 Cb 0.37 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.44 2a14 h GLU 167 CO -0.26 0.00 -1.82 0.00 0.05 0.00 0.00 179.01 176.98 2a14 h ALA 169 N 0.43 0.82 -3.26 0.00 0.00 -0.51 -3.46 119.26 113.27 2a14 h ALA 169 Ca -0.35 -0.57 -0.63 0.00 0.00 0.00 0.00 54.91 53.37 2a14 h ALA 169 Cb 2.03 -0.10 -0.16 0.00 0.00 0.00 0.00 17.79 19.56 2a14 h ALA 169 CO 0.10 0.78 -0.58 0.00 0.00 0.00 0.00 179.25 179.56 2a14 s SER 172 N -2.85 -0.30 0.22 0.00 1.04 -1.26 -4.79 113.70 105.76 2a14 s SER 172 Ca 0.17 -0.42 -0.09 0.00 0.48 0.00 0.00 55.95 56.09 2a14 s SER 172 Cb 0.19 0.59 0.18 0.00 0.10 0.00 0.00 66.02 67.08 2a14 s SER 172 CO 0.58 -1.06 1.89 0.25 0.98 0.00 0.00 173.24 175.88 2a14 h LEU 173 N 2.15 0.93 -0.63 2.42 5.85 -1.92 -1.12 115.31 122.99 2a14 h LEU 173 Ca -0.29 -0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.45 2a14 h LEU 173 Cb 1.27 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 42.02 2a14 h LEU 173 CO 0.36 0.68 0.36 0.44 -0.34 0.00 0.00 178.44 179.94 2a14 h ASP 174 N 1.09 0.57 -0.70 1.25 3.32 -1.99 0.89 116.42 120.84 2a14 h ASP 174 Ca 0.29 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.32 2a14 h ASP 174 Cb -0.12 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 2a14 h ASP 174 CO -0.06 0.38 0.28 0.00 -1.72 0.00 0.00 179.24 178.12 2a14 h ALA 175 N 1.30 0.91 -0.51 3.45 0.00 -1.86 -1.63 119.26 120.92 2a14 h ALA 175 Ca 0.27 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2a14 h ALA 175 Cb 0.10 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2a14 h ALA 175 CO -0.14 0.54 0.21 -0.92 0.00 0.00 0.00 179.25 178.94 2a14 h TYR 176 N 1.00 0.78 -0.44 0.00 3.20 -0.67 -0.40 116.97 120.44 2a14 h TYR 176 Ca 0.23 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 62.05 2a14 h TYR 176 Cb 0.22 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.23 2a14 h TYR 176 CO 0.02 0.65 0.29 0.00 -1.64 0.00 0.00 178.16 177.47 2a14 h ARG 177 N 0.69 0.59 -0.63 1.82 3.08 -0.56 -1.66 114.38 117.71 2a14 h ARG 177 Ca 0.17 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 60.09 2a14 h ARG 177 Cb 0.19 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2a14 h ARG 177 CO -0.01 0.41 0.03 0.00 -1.07 0.00 0.00 179.97 179.32 2a14 h ALA 178 N 1.15 0.86 -0.77 0.04 0.00 -1.15 -2.91 119.26 116.48 2a14 h ALA 178 Ca 0.16 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2a14 h ALA 178 Cb -0.05 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 2a14 h ALA 178 CO -0.03 0.67 0.48 0.00 0.00 0.00 0.00 179.25 180.37 2a14 h ALA 179 N 1.02 1.40 -0.79 0.00 0.00 -0.75 -1.10 119.26 119.03 2a14 h ALA 179 Ca 0.18 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 2a14 h ALA 179 Cb 0.53 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2a14 h ALA 179 CO 0.03 0.53 0.31 -0.07 0.00 0.00 0.00 179.25 180.05 2a14 h LEU 180 N 1.05 1.09 -1.08 0.00 3.38 -1.12 -0.65 115.31 117.98 2a14 h LEU 180 Ca 0.28 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 2a14 h LEU 180 Cb -0.07 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.36 2a14 h LEU 180 CO -0.06 0.97 0.23 0.00 0.09 0.00 0.00 178.44 179.67 2a14 h ASN 182 N 0.87 1.08 -0.62 0.00 2.35 -0.38 -1.93 115.58 116.96 2a14 h ASN 182 Ca 0.20 -0.20 -0.08 0.00 -0.55 0.00 0.00 56.30 55.67 2a14 h ASN 182 Cb 0.19 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 2a14 h ASN 182 CO -0.02 0.99 0.07 -0.07 -1.65 0.00 0.00 177.43 176.76 2a14 h LEU 183 N 1.11 1.02 -1.76 1.61 3.38 -0.83 -2.76 115.31 117.09 2a14 h LEU 183 Ca 0.25 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2a14 h LEU 183 Cb 0.28 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2a14 h LEU 183 CO -0.01 1.03 -0.00 0.00 0.09 0.00 0.00 178.44 179.55 2a14 h ALA 184 N 1.08 1.81 0.00 1.53 0.00 -0.62 -1.27 119.26 121.79 2a14 h ALA 184 Ca 0.19 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2a14 h ALA 184 Cb 0.47 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2a14 h ALA 184 CO 0.02 0.15 -0.05 0.66 0.00 0.00 0.00 179.25 180.02 2a14 h SER 185 N 0.14 0.00 0.87 0.00 4.64 -1.05 -1.92 113.55 116.24 2a14 h SER 185 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2a14 h SER 185 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2a14 h SER 185 CO 0.00 0.05 -0.05 0.18 -0.87 0.00 0.00 176.83 176.14 2a14 n LEU 186 N -3.34 0.07 -4.90 5.97 4.77 -0.48 -4.89 117.00 114.20 2a14 n LEU 186 Ca -0.02 0.41 -0.34 0.00 -0.03 0.00 0.00 56.01 56.03 2a14 n LEU 186 Cb 0.21 -0.44 -0.05 0.00 -2.33 0.00 0.00 43.42 40.81 2a14 n LEU 186 CO 0.26 0.02 -0.15 -0.76 -1.33 0.00 0.00 177.39 175.43 2a14 s LEU 187 N -2.93 4.38 0.63 2.23 1.43 -0.72 -0.44 118.68 123.26 2a14 s LEU 187 Ca 0.16 0.40 -0.18 0.00 -1.03 0.00 0.00 54.13 53.48 2a14 s LEU 187 Cb 0.19 -2.49 -0.02 0.00 0.03 0.00 0.00 46.19 43.90 2a14 s LEU 187 CO 0.54 0.30 1.26 0.29 0.23 0.00 0.00 176.35 178.96 2a14 n LYS 188 N 1.22 1.14 -1.69 1.70 5.02 -0.29 -4.70 118.16 120.55 2a14 n LYS 188 Ca -0.13 0.44 -0.44 0.00 -2.02 0.00 0.00 58.31 56.16 2a14 n LYS 188 Cb 0.53 -2.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.03 2a14 n LYS 188 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 2a14 n PRO 189 N -1.71 2.17 -0.08 1.97 -0.02 -1.26 -0.60 135.00 135.46 2a14 n PRO 189 Ca 0.15 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.40 2a14 n PRO 189 Cb 0.48 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 2a14 n PRO 189 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2a14 n GLY 190 N 1.93 2.00 3.66 -1.23 0.00 0.34 -4.90 105.19 106.98 2a14 n GLY 190 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 2a14 n GLY 190 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2a14 s GLY 191 N -1.97 1.59 0.00 -0.02 0.00 0.23 -4.61 107.32 102.54 2a14 s GLY 191 Ca 0.00 -0.17 0.08 0.00 0.00 0.00 0.00 44.72 44.63 2a14 s GLY 191 CO 0.00 0.40 -0.26 0.30 0.00 0.00 0.00 173.10 173.55 2a14 s HIS 192 N -2.86 2.27 -0.15 1.90 3.76 -0.35 -0.73 115.29 119.14 2a14 s HIS 192 Ca 0.65 -0.42 -0.11 0.00 -0.15 0.00 0.00 55.06 55.03 2a14 s HIS 192 Cb -0.20 -1.43 -0.05 0.00 1.11 0.00 0.00 32.58 32.02 2a14 s HIS 192 CO 0.58 0.02 0.20 -1.17 -0.85 0.00 0.00 174.74 173.52 2a14 s LEU 193 N -0.81 4.29 -0.14 0.89 2.96 0.55 -0.86 118.68 125.56 2a14 s LEU 193 Ca 0.10 0.43 0.01 0.00 -0.22 0.00 0.00 54.13 54.46 2a14 s LEU 193 Cb -0.10 -2.20 0.02 0.00 0.50 0.00 0.00 46.19 44.41 2a14 s LEU 193 CO 0.00 0.23 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.42 2a14 s VAL 194 N -0.12 1.64 -0.06 1.68 1.01 0.09 -0.38 120.40 124.27 2a14 s VAL 194 Ca 0.14 -0.70 -0.09 0.00 0.00 0.00 0.00 61.98 61.33 2a14 s VAL 194 Cb -0.12 -1.51 0.02 0.00 0.00 0.00 0.00 36.38 34.77 2a14 s VAL 194 CO 0.03 0.47 0.23 0.28 0.00 0.00 0.00 175.10 176.10 2a14 s THR 195 N 1.22 0.03 -0.08 3.92 -1.32 -0.27 -1.05 115.64 118.09 2a14 s THR 195 Ca -0.00 -0.23 0.05 0.00 -1.21 0.00 0.00 61.69 60.30 2a14 s THR 195 Cb -0.14 -0.40 -0.00 0.00 -1.51 0.00 0.00 72.50 70.44 2a14 s THR 195 CO -0.07 -0.12 -0.24 -0.89 -2.21 0.00 0.00 174.62 171.08 2a14 s THR 196 N -0.43 2.05 -0.04 5.08 2.01 -0.98 -0.16 115.64 123.18 2a14 s THR 196 Ca -0.05 -1.04 0.03 0.00 0.31 0.00 0.00 61.69 60.93 2a14 s THR 196 Cb -0.04 -1.76 0.01 0.00 0.01 0.00 0.00 72.50 70.72 2a14 s THR 196 CO 0.01 0.56 -0.11 0.54 -0.69 0.00 0.00 174.62 174.94 2a14 s VAL 197 N 0.11 0.97 0.21 3.82 0.11 -0.23 -1.46 120.40 123.93 2a14 s VAL 197 Ca -0.12 -0.44 -0.27 0.00 -2.93 0.00 0.00 61.98 58.23 2a14 s VAL 197 Cb -0.16 -0.87 -0.09 0.00 -1.53 0.00 0.00 36.38 33.73 2a14 s VAL 197 CO 0.07 0.30 0.85 0.42 -3.33 0.00 0.00 175.10 173.41 2a14 s THR 198 N 0.35 4.25 0.03 5.04 -4.23 -1.26 -1.50 115.64 118.31 2a14 s THR 198 Ca -0.07 1.84 -0.00 0.00 -1.18 0.00 0.00 61.69 62.28 2a14 s THR 198 Cb -0.12 -4.19 -0.04 0.00 1.34 0.00 0.00 72.50 69.50 2a14 s THR 198 CO 0.02 0.46 0.15 -0.76 -0.54 0.00 0.00 174.62 173.95 2a14 s LEU 199 N -1.29 4.15 -1.49 4.79 1.43 -0.66 -4.52 118.68 121.09 2a14 s LEU 199 Ca 0.39 0.21 -0.13 0.00 -1.03 0.00 0.00 54.13 53.58 2a14 s LEU 199 Cb -0.23 -2.59 0.10 0.00 0.03 0.00 0.00 46.19 43.49 2a14 s LEU 199 CO 0.28 0.23 0.75 0.54 0.23 0.00 0.00 176.35 178.37 2a14 n ARG 200 N 0.75 -4.20 -3.72 1.70 1.74 0.76 -0.25 116.66 113.44 2a14 n ARG 200 Ca -0.09 0.52 -0.37 0.00 -0.77 0.00 0.00 57.85 57.13 2a14 n ARG 200 Cb 0.52 -5.31 -0.12 0.00 -1.02 0.00 0.00 32.46 26.53 2a14 n ARG 200 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2a14 s LEU 201 N -6.97 3.77 0.12 0.55 2.96 -1.26 -4.39 118.68 113.45 2a14 s LEU 201 Ca 0.58 -0.44 0.23 0.00 -0.22 0.00 0.00 54.13 54.27 2a14 s LEU 201 Cb -0.30 -1.94 0.13 0.00 0.50 0.00 0.00 46.19 44.58 2a14 s LEU 201 CO 0.71 -0.13 1.12 -0.81 -1.32 0.00 0.00 176.35 175.92 2a14 n PRO 202 N 4.93 0.40 -3.60 0.98 -0.04 -1.26 -2.67 135.00 133.74 2a14 n PRO 202 Ca -0.15 0.06 -0.04 0.00 -0.04 0.00 0.00 63.50 63.33 2a14 n PRO 202 Cb 0.50 -1.70 -0.02 0.00 -0.04 0.00 0.00 33.50 32.24 2a14 n PRO 202 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2a14 s SER 203 N -4.51 -0.21 -0.00 3.54 1.04 -1.26 -1.42 113.70 110.88 2a14 s SER 203 Ca 0.03 -0.11 -0.14 0.00 0.48 0.00 0.00 55.95 56.21 2a14 s SER 203 Cb 0.12 0.30 0.02 0.00 0.10 0.00 0.00 66.02 66.57 2a14 s SER 203 CO 0.77 -0.52 0.29 -0.72 0.98 0.00 0.00 173.24 174.05 2a14 s TYR 204 N -2.84 -0.14 0.06 5.02 -0.85 0.03 -4.41 117.35 114.22 2a14 s TYR 204 Ca 0.09 0.17 -0.15 0.00 -0.52 0.00 0.00 57.07 56.66 2a14 s TYR 204 Cb -0.00 0.08 -0.06 0.00 0.38 0.00 0.00 41.96 42.36 2a14 s TYR 204 CO -0.05 -0.40 0.48 -1.64 -1.52 0.00 0.00 175.55 172.43 2a14 s MET 205 N -1.57 3.99 -0.34 -3.49 -1.94 0.38 -0.81 119.30 115.52 2a14 s MET 205 Ca -0.12 0.49 0.02 0.00 -1.71 0.00 0.00 55.69 54.38 2a14 s MET 205 Cb -0.05 -3.14 0.10 0.00 2.01 0.00 0.00 34.83 33.76 2a14 s MET 205 CO 0.03 0.62 0.08 0.08 -0.01 0.00 0.00 175.02 175.81 2a14 s VAL 206 N -1.21 1.77 0.00 -6.03 1.01 0.11 -4.96 120.40 111.09 2a14 s VAL 206 Ca 0.29 -2.07 0.00 0.00 0.00 0.00 0.00 61.98 60.20 2a14 s VAL 206 Cb -0.17 -2.31 0.00 0.00 0.00 0.00 0.00 36.38 33.90 2a14 s VAL 206 CO 0.17 -0.65 0.00 0.61 0.00 0.00 0.00 175.10 175.23 2a14 n GLY 207 N 4.38 3.44 0.35 4.51 0.00 -1.25 -1.84 105.19 114.77 2a14 n GLY 207 Ca 0.02 -0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.10 2a14 n GLY 207 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2a14 n LYS 208 N 14.00 1.47 -3.90 1.61 5.02 -1.26 -4.87 118.16 130.24 2a14 n LYS 208 Ca 0.00 -0.69 -0.36 0.00 -2.02 0.00 0.00 58.31 55.24 2a14 n LYS 208 Cb 0.00 -1.45 -0.07 0.00 -0.02 0.00 0.00 35.03 33.48 2a14 n LYS 208 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2a14 s ARG 209 N -1.96 3.71 -0.16 1.97 3.52 -0.77 -5.09 118.95 120.17 2a14 s ARG 209 Ca 0.38 -0.21 -0.11 0.00 -0.13 0.00 0.00 55.73 55.66 2a14 s ARG 209 Cb 0.20 -3.23 -0.05 0.00 -1.56 0.00 0.00 34.95 30.31 2a14 s ARG 209 CO 0.32 0.55 0.22 -2.00 -0.81 0.00 0.00 175.30 173.58 2a14 s GLU 210 N -0.38 4.10 0.18 5.12 2.12 -1.26 0.04 118.70 128.62 2a14 s GLU 210 Ca 0.11 -0.04 0.10 0.00 0.36 0.00 0.00 54.97 55.50 2a14 s GLU 210 Cb -0.12 -3.38 -0.04 0.00 0.26 0.00 0.00 34.13 30.85 2a14 s GLU 210 CO 0.01 0.36 -0.17 -0.06 -0.54 0.00 0.00 175.26 174.86 2a14 s PHE 211 N 0.15 2.46 0.59 5.30 0.08 0.01 -4.98 117.98 121.59 2a14 s PHE 211 Ca 0.13 -0.29 -0.10 0.00 0.12 0.00 0.00 56.93 56.79 2a14 s PHE 211 Cb -0.12 -1.23 -0.04 0.00 -0.57 0.00 0.00 43.02 41.06 2a14 s PHE 211 CO 0.02 0.49 0.97 -1.12 -0.10 0.00 0.00 175.22 175.48 2a14 s SER 212 N -2.66 6.24 0.02 1.36 0.01 -1.26 -0.79 113.70 116.62 2a14 s SER 212 Ca 0.22 1.31 -0.01 0.00 1.31 0.00 0.00 55.95 58.78 2a14 s SER 212 Cb -0.09 -2.42 -0.02 0.00 0.21 0.00 0.00 66.02 63.70 2a14 s SER 212 CO 0.12 -0.80 -0.02 0.00 0.41 0.00 0.00 173.24 172.95 2a14 s VAL 214 N -1.84 4.87 -0.38 0.00 0.11 -0.06 -4.33 120.40 118.77 2a14 s VAL 214 Ca -0.12 1.78 -0.28 0.00 -2.93 0.00 0.00 61.98 60.42 2a14 s VAL 214 Cb -0.07 -4.20 0.02 0.00 -1.53 0.00 0.00 36.38 30.60 2a14 s VAL 214 CO -0.02 0.06 1.07 0.00 -3.33 0.00 0.00 175.10 172.88 2a14 s ALA 215 N 1.81 3.37 -0.03 1.54 0.00 -1.09 -4.48 121.76 122.88 2a14 s ALA 215 Ca 0.43 -0.26 0.07 0.00 0.00 0.00 0.00 51.96 52.19 2a14 s ALA 215 Cb -0.18 -3.73 -0.02 0.00 0.00 0.00 0.00 23.12 19.20 2a14 s ALA 215 CO 0.16 -1.77 -0.24 -0.51 0.00 0.00 0.00 175.76 173.40 2a14 s LEU 216 N 3.90 2.13 0.23 0.00 1.43 -1.26 -4.78 118.68 120.32 2a14 s LEU 216 Ca 0.45 -0.45 -0.06 0.00 -1.03 0.00 0.00 54.13 53.04 2a14 s LEU 216 Cb -0.10 -1.37 -0.06 0.00 0.03 0.00 0.00 46.19 44.69 2a14 s LEU 216 CO 0.21 0.31 0.49 -1.61 0.23 0.00 0.00 176.35 175.99 2a14 s GLU 217 N -0.53 3.67 0.40 1.70 0.41 -1.26 -0.17 118.70 122.93 2a14 s GLU 217 Ca 0.07 0.04 0.11 0.00 -0.41 0.00 0.00 54.97 54.78 2a14 s GLU 217 Cb -0.11 -2.71 0.85 0.00 -1.78 0.00 0.00 34.13 30.38 2a14 s GLU 217 CO 0.00 0.33 1.94 1.57 -0.49 0.00 0.00 175.26 178.60 2a14 h LYS 218 N 2.27 0.16 -0.69 1.61 2.10 -1.98 -1.26 116.57 118.77 2a14 h LYS 218 Ca -0.47 -0.04 0.04 0.00 -2.00 0.00 0.00 60.65 58.18 2a14 h LYS 218 Cb 1.18 -0.02 -0.05 0.00 -0.90 0.00 0.00 32.23 32.44 2a14 h LYS 218 CO 0.69 0.32 0.42 0.78 -2.00 0.00 0.00 179.45 179.65 2a14 h GLY 219 N 0.69 1.00 0.89 0.07 0.00 -1.99 0.13 103.07 103.87 2a14 h GLY 219 Ca 0.03 -0.31 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 2a14 h GLY 219 CO 0.02 0.24 0.09 0.83 0.00 0.00 0.00 176.54 177.72 2a14 h GLU 220 N 0.81 0.41 -0.22 4.80 5.08 -1.67 -1.05 114.58 122.73 2a14 h GLU 220 Ca 0.29 -0.09 0.03 0.00 -1.00 0.00 0.00 59.36 58.59 2a14 h GLU 220 Cb 0.07 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 2a14 h GLU 220 CO -0.13 0.47 0.04 0.28 -1.00 0.00 0.00 179.01 178.66 2a14 h VAL 221 N 0.26 0.89 -0.36 3.13 2.07 -1.02 -0.48 116.25 120.74 2a14 h VAL 221 Ca 0.09 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.58 2a14 h VAL 221 Cb 0.23 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 2a14 h VAL 221 CO -0.00 0.02 0.21 -0.33 0.02 0.00 0.00 177.57 177.49 2a14 h GLU 222 N 0.12 0.42 -0.78 1.57 5.08 -0.62 -0.44 114.58 119.93 2a14 h GLU 222 Ca 0.10 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2a14 h GLU 222 Cb 0.10 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 2a14 h GLU 222 CO -0.14 0.28 0.47 0.37 -1.00 0.00 0.00 179.01 178.99 2a14 h GLN 223 N 0.43 1.05 -0.89 2.33 5.75 -0.99 -2.16 115.11 120.64 2a14 h GLN 223 Ca 0.14 -0.09 0.01 0.00 -0.15 0.00 0.00 58.65 58.56 2a14 h GLN 223 Cb 0.00 -0.22 -0.04 0.00 1.07 0.00 0.00 27.48 28.29 2a14 h GLN 223 CO -0.07 0.74 0.58 0.00 -2.65 0.00 0.00 178.83 177.43 2a14 h ALA 224 N 1.25 1.12 -0.09 3.38 0.00 -0.40 0.07 119.26 124.60 2a14 h ALA 224 Ca 0.28 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2a14 h ALA 224 Cb -0.04 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.38 2a14 h ALA 224 CO -0.05 0.54 0.02 0.28 0.00 0.00 0.00 179.25 180.03 2a14 h VAL 225 N 1.20 1.20 -0.45 0.00 2.07 -0.76 -1.24 116.25 118.27 2a14 h VAL 225 Ca 0.32 -0.62 0.04 0.00 0.82 0.00 0.00 66.70 67.26 2a14 h VAL 225 Cb -0.13 1.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 2a14 h VAL 225 CO -0.07 0.18 0.22 -0.07 0.02 0.00 0.00 177.57 177.85 2a14 h LEU 226 N -0.07 0.31 -1.99 2.57 3.38 -1.16 -2.53 115.31 115.81 2a14 h LEU 226 Ca 0.03 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2a14 h LEU 226 Cb 0.26 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2a14 h LEU 226 CO 0.00 0.22 -0.04 0.44 0.09 0.00 0.00 178.44 179.15 2a14 h ASP 227 N 0.44 0.00 -0.04 -0.43 3.32 -0.78 -1.72 116.42 117.21 2a14 h ASP 227 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 2a14 h ASP 227 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 2a14 h ASP 227 CO -0.14 0.04 0.00 0.00 -1.72 0.00 0.00 179.24 177.42 2a14 n ALA 228 N -2.14 2.59 -0.26 3.45 0.00 -0.49 -4.89 120.51 118.77 2a14 n ALA 228 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.20 2a14 n ALA 228 Cb 0.23 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.42 2a14 n ALA 228 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a14 n GLY 229 N 0.89 0.84 3.82 0.00 0.00 -0.65 -4.74 105.19 105.37 2a14 n GLY 229 Ca 0.15 -0.23 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 2a14 n GLY 229 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2a14 s PHE 230 N -2.00 3.09 0.36 1.61 0.08 -1.14 -1.60 117.98 118.38 2a14 s PHE 230 Ca 0.00 -0.13 0.08 0.00 0.12 0.00 0.00 56.93 57.00 2a14 s PHE 230 Cb 0.00 -1.43 -0.03 0.00 -0.57 0.00 0.00 43.02 40.99 2a14 s PHE 230 CO 0.00 0.49 0.29 0.16 -0.10 0.00 0.00 175.22 176.06 2a14 s ASP 231 N -3.85 5.09 -0.20 1.36 1.47 -0.30 -4.17 116.67 116.06 2a14 s ASP 231 Ca 0.34 -0.63 -0.17 0.00 1.18 0.00 0.00 52.55 53.26 2a14 s ASP 231 Cb -0.08 -0.80 -0.04 0.00 -0.34 0.00 0.00 42.92 41.66 2a14 s ASP 231 CO 0.25 -0.43 0.45 -0.63 0.68 0.00 0.00 175.17 175.48 2a14 s ILE 232 N -2.38 5.16 -0.24 2.11 1.01 -1.26 -1.13 121.20 124.47 2a14 s ILE 232 Ca 0.42 0.81 0.05 0.00 0.00 0.00 0.00 60.65 61.93 2a14 s ILE 232 Cb -0.04 -3.78 -0.18 0.00 0.01 0.00 0.00 42.46 38.48 2a14 s ILE 232 CO 0.26 0.21 -0.17 1.21 0.00 0.00 0.00 174.94 176.46 2a14 n GLU 233 N 4.65 0.66 -3.87 2.79 2.13 0.90 -4.93 120.64 122.97 2a14 n GLU 233 Ca -0.07 0.11 -0.11 0.00 0.66 0.00 0.00 57.16 57.75 2a14 n GLU 233 Cb 0.51 -1.49 -0.11 0.00 0.27 0.00 0.00 31.44 30.62 2a14 n GLU 233 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 2a14 s GLN 234 N -2.49 0.40 -0.09 5.31 -1.52 -0.70 -4.98 119.66 115.59 2a14 s GLN 234 Ca -0.29 -0.27 -0.04 0.00 -1.95 0.00 0.00 55.36 52.81 2a14 s GLN 234 Cb 0.08 0.17 0.05 0.00 -0.22 0.00 0.00 33.01 33.08 2a14 s GLN 234 CO 0.61 -0.09 0.19 -1.17 -0.25 0.00 0.00 175.29 174.58 2a14 s LEU 235 N -1.04 0.35 -0.17 2.90 0.20 -1.26 -0.67 118.68 118.99 2a14 s LEU 235 Ca -0.11 0.40 0.00 0.00 0.69 0.00 0.00 54.13 55.10 2a14 s LEU 235 Cb -0.06 0.47 0.04 0.00 -0.43 0.00 0.00 46.19 46.21 2a14 s LEU 235 CO 0.01 -0.18 -0.08 -0.76 -0.29 0.00 0.00 176.35 175.05 2a14 s LEU 236 N 1.58 1.79 0.04 -0.68 1.02 0.34 -4.99 118.68 117.78 2a14 s LEU 236 Ca -0.05 -0.69 0.05 0.00 0.02 0.00 0.00 54.13 53.46 2a14 s LEU 236 Cb -0.11 -1.03 -0.04 0.00 0.02 0.00 0.00 46.19 45.03 2a14 s LEU 236 CO -0.07 -0.15 -0.08 -2.28 0.02 0.00 0.00 176.35 173.78 2a14 s HIS 237 N 1.55 2.82 0.02 0.29 2.46 -1.26 -0.20 115.29 120.97 2a14 s HIS 237 Ca 0.01 -0.09 0.02 0.00 0.47 0.00 0.00 55.06 55.46 2a14 s HIS 237 Cb -0.15 -1.54 -0.01 0.00 -0.13 0.00 0.00 32.58 30.74 2a14 s HIS 237 CO -0.08 0.38 -0.06 0.45 -2.47 0.00 0.00 174.74 172.96 2a14 s SER 238 N -1.68 0.61 0.00 9.88 0.15 -0.41 -5.02 113.70 117.23 2a14 s SER 238 Ca 0.18 -0.32 0.28 0.00 0.70 0.00 0.00 55.95 56.80 2a14 s SER 238 Cb -0.11 -0.00 1.62 0.00 -1.71 0.00 0.00 66.02 65.82 2a14 s SER 238 CO 0.10 -0.09 2.02 -0.81 1.20 0.00 0.00 173.24 175.66 2a14 n PRO 239 N 2.20 0.74 -1.62 5.44 -0.04 -1.26 -0.86 135.00 139.60 2a14 n PRO 239 Ca -0.18 0.01 -0.48 0.00 -0.04 0.00 0.00 63.50 62.81 2a14 n PRO 239 Cb 0.57 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.49 2a14 n PRO 239 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2a14 n GLN 240 N -1.09 1.55 -4.42 0.54 -0.06 -1.26 -3.54 117.38 109.11 2a14 n GLN 240 Ca 0.19 0.56 -0.22 0.00 -2.00 0.00 0.00 57.00 55.52 2a14 n GLN 240 Cb 0.14 -2.16 -0.10 0.00 -4.06 0.00 0.00 30.24 24.05 2a14 n GLN 240 CO 0.00 0.00 0.00 -1.54 -0.20 0.00 0.00 177.06 175.32 2a14 s SER 241 N 0.29 3.18 0.97 1.69 1.04 -1.26 -3.64 113.70 115.97 2a14 s SER 241 Ca 0.74 -1.00 -0.15 0.00 0.48 0.00 0.00 55.95 56.02 2a14 s SER 241 Cb -0.79 -0.23 0.19 0.00 0.10 0.00 0.00 66.02 65.29 2a14 s SER 241 CO 0.48 -0.03 1.25 -0.31 0.98 0.00 0.00 173.24 175.61 2a14 s TYR 242 N -2.56 1.77 0.20 5.02 2.02 -1.26 -4.69 117.35 117.84 2a14 s TYR 242 Ca 0.26 0.48 -0.33 0.00 -0.37 0.00 0.00 57.07 57.11 2a14 s TYR 242 Cb -0.04 -3.84 -0.14 0.00 -0.40 0.00 0.00 41.96 37.55 2a14 s TYR 242 CO 0.11 -2.65 1.50 0.45 -1.57 0.00 0.00 175.55 173.39 2a14 n SER 243 N -3.84 2.95 0.31 2.29 2.88 -1.26 -4.83 113.62 112.12 2a14 n SER 243 Ca 0.13 1.11 0.20 0.00 -1.33 0.00 0.00 58.87 58.98 2a14 n SER 243 Cb 0.60 -1.43 1.00 0.00 -0.75 0.00 0.00 64.21 63.63 2a14 n SER 243 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 2a14 h VAL 244 N 3.37 0.05 0.00 2.46 -1.51 -1.95 -0.36 116.25 118.30 2a14 h VAL 244 Ca -0.45 -0.21 -0.08 0.00 -1.23 0.00 0.00 66.70 64.73 2a14 h VAL 244 Cb 1.26 1.20 -0.01 0.00 -2.13 0.00 0.00 31.29 31.61 2a14 h VAL 244 CO 0.83 0.01 -0.38 0.74 -1.23 0.00 0.00 177.57 177.54 2a14 h THR 245 N 0.00 0.98 0.00 7.19 2.02 -2.02 -3.30 112.91 117.77 2a14 h THR 245 Ca -0.00 -1.45 -0.23 0.00 0.77 0.00 0.00 66.41 65.51 2a14 h THR 245 Cb 0.20 1.85 -0.03 0.00 -1.74 0.00 0.00 68.15 68.43 2a14 h THR 245 CO 0.00 0.37 -1.26 0.59 0.37 0.00 0.00 175.52 175.59 2a14 n ASN 246 N -3.67 1.86 -3.15 4.18 3.02 -0.30 -4.74 115.26 112.47 2a14 n ASN 246 Ca -0.01 0.43 0.04 0.00 -0.03 0.00 0.00 54.58 55.02 2a14 n ASN 246 Cb 0.48 -0.96 -0.01 0.00 -0.61 0.00 0.00 39.78 38.68 2a14 n ASN 246 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2a14 s ALA 247 N -2.38 -2.64 -1.34 5.41 0.00 -0.32 -0.47 121.76 120.03 2a14 s ALA 247 Ca -0.28 1.63 -0.11 0.00 0.00 0.00 0.00 51.96 53.19 2a14 s ALA 247 Cb 0.06 -2.32 0.12 0.00 0.00 0.00 0.00 23.12 20.98 2a14 s ALA 247 CO 0.57 -1.46 1.97 0.00 0.00 0.00 0.00 175.76 176.85 2a14 n ALA 248 N 5.43 5.34 -2.44 0.00 0.00 -1.25 -4.04 120.51 123.55 2a14 n ALA 248 Ca -0.01 -4.16 -0.27 0.00 0.00 0.00 0.00 53.44 48.99 2a14 n ALA 248 Cb 0.52 -3.18 -0.02 0.00 0.00 0.00 0.00 19.45 16.78 2a14 n ALA 248 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2a14 s ASN 249 N 1.75 6.37 -0.97 0.00 4.22 -1.26 -4.54 114.94 120.49 2a14 s ASN 249 Ca 0.42 0.77 -0.02 0.00 -2.14 0.00 0.00 52.86 51.89 2a14 s ASN 249 Cb 0.11 -2.17 0.29 0.00 1.28 0.00 0.00 41.25 40.75 2a14 s ASN 249 CO -0.02 -0.35 1.23 -3.20 -2.04 0.00 0.00 177.10 172.71 2a14 n ASN 250 N -1.56 5.57 -0.23 3.54 5.15 0.66 -4.77 115.26 123.62 2a14 n ASN 250 Ca -0.01 -3.36 0.00 0.00 -0.60 0.00 0.00 54.58 50.61 2a14 n ASN 250 Cb 0.55 -1.13 0.00 0.00 -0.53 0.00 0.00 39.78 38.66 2a14 n ASN 250 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2a14 n GLY 251 N 1.45 -1.61 3.43 8.20 0.00 -1.23 -4.48 105.19 110.94 2a14 n GLY 251 Ca 0.26 -1.29 -0.16 0.00 0.00 0.00 0.00 46.02 44.84 2a14 n GLY 251 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a14 s VAL 252 N 0.00 0.02 -0.07 1.61 0.11 -0.04 -1.65 120.40 120.38 2a14 s VAL 252 Ca 0.00 -0.14 0.01 0.00 -2.93 0.00 0.00 61.98 58.93 2a14 s VAL 252 Cb 0.00 -0.84 0.02 0.00 -1.53 0.00 0.00 36.38 34.03 2a14 s VAL 252 CO 0.00 -0.07 -0.08 0.00 -3.33 0.00 0.00 175.10 171.62 2a14 s ILE 255 N 0.73 1.62 -0.22 0.00 1.01 0.78 -0.51 121.20 124.62 2a14 s ILE 255 Ca 0.01 -0.81 -0.05 0.00 0.00 0.00 0.00 60.65 59.80 2a14 s ILE 255 Cb -0.14 -1.40 -0.02 0.00 0.01 0.00 0.00 42.46 40.91 2a14 s ILE 255 CO 0.02 0.46 -0.01 -0.69 0.00 0.00 0.00 174.94 174.73 2a14 s VAL 256 N 0.14 3.75 0.02 2.92 1.01 0.15 -1.12 120.40 127.27 2a14 s VAL 256 Ca -0.08 -0.37 0.05 0.00 0.00 0.00 0.00 61.98 61.58 2a14 s VAL 256 Cb -0.14 -2.71 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 2a14 s VAL 256 CO 0.04 0.41 -0.16 0.00 0.00 0.00 0.00 175.10 175.39 2a14 s ALA 257 N 1.31 1.32 -0.17 5.51 0.00 0.49 -0.07 121.76 130.16 2a14 s ALA 257 Ca 0.04 -0.79 -0.05 0.00 0.00 0.00 0.00 51.96 51.16 2a14 s ALA 257 Cb -0.15 -0.28 -0.03 0.00 0.00 0.00 0.00 23.12 22.67 2a14 s ALA 257 CO 0.00 0.29 -0.00 0.50 0.00 0.00 0.00 175.76 176.55 2a14 s ARG 258 N -0.77 3.75 -0.19 0.00 3.52 -0.28 -0.33 118.95 124.65 2a14 s ARG 258 Ca 0.05 -0.47 -0.29 0.00 -0.13 0.00 0.00 55.73 54.89 2a14 s ARG 258 Cb -0.07 -3.03 -0.02 0.00 -1.56 0.00 0.00 34.95 30.27 2a14 s ARG 258 CO 0.00 0.21 1.39 0.21 -0.81 0.00 0.00 175.30 176.31 2a14 s LYS 259 N 0.47 4.07 0.04 5.12 2.20 0.09 -1.15 119.74 130.59 2a14 s LYS 259 Ca -0.01 1.63 -0.31 0.00 -0.36 0.00 0.00 55.97 56.93 2a14 s LYS 259 Cb -0.14 -3.87 -0.06 0.00 -1.51 0.00 0.00 37.83 32.25 2a14 s LYS 259 CO 0.02 -0.93 1.30 0.15 -0.36 0.00 0.00 175.35 175.53 2a14 s LYS 260 N 3.94 4.35 0.00 4.03 1.02 -0.62 -0.51 119.74 131.95 2a14 s LYS 260 Ca 0.60 1.88 0.32 0.00 0.02 0.00 0.00 55.97 58.80 2a14 s LYS 260 Cb -0.23 -3.41 1.90 0.00 -0.52 0.00 0.00 37.83 35.58 2a14 s LYS 260 CO 0.21 -0.41 2.22 -0.35 -0.92 0.00 0.00 175.35 176.11