#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a14 s ARG 4 N 0.00 2.88 0.07 5.31 3.00 -0.74 -4.98 118.95 124.49 3a14 s ARG 4 Ca 0.00 -0.48 -0.17 0.00 0.00 0.00 0.00 55.73 55.08 3a14 s ARG 4 Cb 0.00 -2.71 -0.07 0.00 0.00 0.00 0.00 34.95 32.17 3a14 s ARG 4 CO 0.00 0.68 0.53 0.95 0.00 0.00 0.00 175.30 177.47 3a14 s THR 5 N -0.88 4.82 -0.05 0.02 -4.23 -1.26 0.01 115.64 114.06 3a14 s THR 5 Ca 0.14 1.07 0.04 0.00 -1.18 0.00 0.00 61.69 61.76 3a14 s THR 5 Cb -0.11 -3.83 -0.00 0.00 1.34 0.00 0.00 72.50 69.89 3a14 s THR 5 CO 0.03 0.50 -0.19 -0.22 -0.54 0.00 0.00 174.62 174.20 3a14 s LEU 6 N -1.28 1.94 -0.15 4.79 2.96 0.58 -0.98 118.68 126.53 3a14 s LEU 6 Ca 0.30 -0.39 -0.03 0.00 -0.22 0.00 0.00 54.13 53.79 3a14 s LEU 6 Cb -0.18 -1.05 -0.02 0.00 0.50 0.00 0.00 46.19 45.43 3a14 s LEU 6 CO 0.18 0.16 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.63 3a14 s VAL 7 N 0.05 3.73 -0.40 1.68 1.01 0.02 -1.03 120.40 125.46 3a14 s VAL 7 Ca -0.05 -0.41 -0.13 0.00 0.00 0.00 0.00 61.98 61.39 3a14 s VAL 7 Cb -0.12 -2.63 0.04 0.00 0.00 0.00 0.00 36.38 33.67 3a14 s VAL 7 CO 0.03 0.50 0.26 -0.63 0.00 0.00 0.00 175.10 175.26 3a14 s ILE 8 N 0.37 4.84 -0.16 2.22 -1.09 -0.81 -0.60 121.20 125.97 3a14 s ILE 8 Ca -0.05 -0.87 -0.27 0.00 -2.23 0.00 0.00 60.65 57.23 3a14 s ILE 8 Cb -0.15 -3.75 -0.01 0.00 -1.58 0.00 0.00 42.46 36.97 3a14 s ILE 8 CO 0.03 -0.33 0.89 -0.76 -1.23 0.00 0.00 174.94 173.55 3a14 s LEU 9 N 1.59 4.18 0.00 2.97 1.43 0.75 -1.80 118.68 127.81 3a14 s LEU 9 Ca 0.03 1.28 0.00 0.00 -1.03 0.00 0.00 54.13 54.41 3a14 s LEU 9 Cb -0.20 -3.34 0.00 0.00 0.03 0.00 0.00 46.19 42.68 3a14 s LEU 9 CO 0.07 -0.44 0.00 0.61 0.23 0.00 0.00 176.35 176.83 3a14 n GLY 10 N 3.36 0.58 0.20 -3.19 0.00 -0.82 -0.09 105.19 105.23 3a14 n GLY 10 Ca 0.06 -0.46 0.14 0.00 0.00 0.00 0.00 46.02 45.77 3a14 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a14 h ALA 11 N 0.00 1.00 -0.01 4.61 0.00 -1.35 -2.95 119.26 120.56 3a14 h ALA 11 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3a14 h ALA 11 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3a14 h ALA 11 CO 0.00 0.00 -0.20 0.25 0.00 0.00 0.00 179.25 179.30 3a14 n THR 12 N -2.71 0.00 -1.92 0.00 -2.24 -1.26 -3.20 114.28 102.95 3a14 n THR 12 Ca 0.02 -0.22 -0.12 0.00 -2.27 0.00 0.00 64.05 61.46 3a14 n THR 12 Cb 0.33 0.67 0.07 0.00 -2.10 0.00 0.00 70.33 69.30 3a14 n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3a14 n GLY 13 N 1.31 -0.29 0.24 3.38 0.00 -1.11 -4.78 105.19 103.94 3a14 n GLY 13 Ca 0.14 -1.84 -0.15 0.00 0.00 0.00 0.00 46.02 44.16 3a14 n GLY 13 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3a14 h SER 14 N -0.53 -0.46 -0.26 1.61 0.87 -1.92 0.52 113.55 113.38 3a14 h SER 14 Ca -0.17 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.39 3a14 h SER 14 Cb 0.55 0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.62 3a14 h SER 14 CO 0.15 -0.32 0.12 0.40 -0.53 0.00 0.00 176.83 176.65 3a14 h ILE 15 N -0.53 1.14 -0.48 2.23 1.08 -1.89 -1.32 117.51 117.74 3a14 h ILE 15 Ca -0.05 -0.41 0.09 0.00 -0.39 0.00 0.00 64.86 64.10 3a14 h ILE 15 Cb 0.41 0.94 -0.10 0.00 -3.07 0.00 0.00 36.82 35.00 3a14 h ILE 15 CO 0.08 0.14 -0.36 1.23 -0.69 0.00 0.00 178.15 178.55 3a14 h GLY 16 N 0.28 -0.29 1.28 5.37 0.00 -1.66 0.19 103.07 108.24 3a14 h GLY 16 Ca 0.09 0.46 -0.13 0.00 0.00 0.00 0.00 47.33 47.75 3a14 h GLY 16 CO -0.01 -0.20 -0.28 -0.91 0.00 0.00 0.00 176.54 175.14 3a14 h THR 17 N -0.23 1.28 -0.37 4.70 1.35 -0.73 -1.89 112.91 117.01 3a14 h THR 17 Ca 0.19 -1.42 -0.02 0.00 -0.55 0.00 0.00 66.41 64.61 3a14 h THR 17 Cb 0.56 1.28 -0.02 0.00 -1.73 0.00 0.00 68.15 68.23 3a14 h THR 17 CO -0.61 0.47 0.16 1.56 -0.25 0.00 0.00 175.52 176.86 3a14 h GLN 18 N 0.69 0.51 -0.55 4.72 4.20 -0.86 -0.71 115.11 123.12 3a14 h GLN 18 Ca 0.08 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.69 3a14 h GLN 18 Cb 0.82 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.47 3a14 h GLN 18 CO 0.07 0.41 0.16 1.15 -0.67 0.00 0.00 178.83 179.96 3a14 h THR 19 N 0.51 1.24 -0.69 -0.54 2.02 -0.30 -2.25 112.91 112.90 3a14 h THR 19 Ca 0.13 -0.81 -0.05 0.00 0.77 0.00 0.00 66.41 66.46 3a14 h THR 19 Cb 0.08 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 3a14 h THR 19 CO -0.02 0.30 0.25 -0.07 0.37 0.00 0.00 175.52 176.35 3a14 h LEU 20 N 0.76 0.96 -0.83 2.58 3.38 -0.63 -1.82 115.31 119.72 3a14 h LEU 20 Ca 0.18 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3a14 h LEU 20 Cb 0.29 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 3a14 h LEU 20 CO -0.00 0.88 0.47 -0.78 0.09 0.00 0.00 178.44 179.10 3a14 h ASP 21 N 1.01 1.02 -0.58 -0.43 3.58 -0.99 -2.53 116.42 117.49 3a14 h ASP 21 Ca 0.23 -0.09 -0.02 0.00 0.42 0.00 0.00 57.03 57.58 3a14 h ASP 21 Cb 0.24 -0.26 -0.03 0.00 1.72 0.00 0.00 39.33 41.00 3a14 h ASP 21 CO -0.01 0.81 0.30 0.58 -2.88 0.00 0.00 179.24 178.03 3a14 h VAL 22 N 1.14 1.20 0.00 2.25 2.07 -0.96 -2.63 116.25 119.33 3a14 h VAL 22 Ca 0.29 -0.54 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 3a14 h VAL 22 Cb -0.00 0.49 -0.00 0.00 -1.52 0.00 0.00 31.29 30.26 3a14 h VAL 22 CO -0.05 0.22 -0.04 -0.07 0.02 0.00 0.00 177.57 177.65 3a14 h LEU 23 N 0.79 0.00 0.06 2.57 3.38 -0.96 -1.48 115.31 119.67 3a14 h LEU 23 Ca 0.20 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.90 3a14 h LEU 23 Cb 0.09 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.85 3a14 h LEU 23 CO -0.03 0.04 -1.19 0.11 0.09 0.00 0.00 178.44 177.46 3a14 h LYS 24 N 0.00 0.39 0.00 1.13 1.57 -1.12 -3.33 116.57 115.22 3a14 h LYS 24 Ca -0.00 -0.57 0.00 0.00 -1.87 0.00 0.00 60.65 58.21 3a14 h LYS 24 Cb 0.15 0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.65 3a14 h LYS 24 CO 0.01 1.24 0.00 0.87 -0.57 0.00 0.00 179.45 181.00 3a14 h LYS 25 N 0.15 0.00 -3.68 3.15 1.57 -1.03 -3.47 116.57 113.26 3a14 h LYS 25 Ca -0.14 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.41 3a14 h LYS 25 Cb 1.88 0.00 -0.28 0.00 0.08 0.00 0.00 32.23 33.91 3a14 h LYS 25 CO 0.21 0.00 -0.70 0.08 -0.57 0.00 0.00 179.45 178.47 3a14 s VAL 26 N -3.15 -0.00 0.20 0.50 1.01 -0.63 -5.08 120.40 113.24 3a14 s VAL 26 Ca 0.09 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.08 3a14 s VAL 26 Cb 0.09 -0.03 -0.04 0.00 0.00 0.00 0.00 36.38 36.40 3a14 s VAL 26 CO 0.63 0.00 0.38 -0.54 0.00 0.00 0.00 175.10 175.57 3a14 s LYS 27 N 0.04 3.50 0.00 2.72 -0.14 -1.26 -4.64 119.74 119.96 3a14 s LYS 27 Ca -0.00 -0.41 0.00 0.00 -1.36 0.00 0.00 55.97 54.20 3a14 s LYS 27 Cb -0.00 -2.86 0.00 0.00 -1.68 0.00 0.00 37.83 33.29 3a14 s LYS 27 CO -0.00 0.41 0.00 0.41 -0.76 0.00 0.00 175.35 175.41 3a14 n GLY 28 N -0.73 1.14 2.83 -3.33 0.00 -1.26 -5.10 105.19 98.73 3a14 n GLY 28 Ca -0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.74 3a14 n GLY 28 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a14 s ILE 29 N -2.00 0.53 -0.24 -0.61 1.01 -1.26 -1.80 121.20 116.83 3a14 s ILE 29 Ca 0.00 -0.01 -0.09 0.00 0.00 0.00 0.00 60.65 60.55 3a14 s ILE 29 Cb 0.00 -0.63 -0.04 0.00 0.01 0.00 0.00 42.46 41.80 3a14 s ILE 29 CO 0.00 0.27 0.11 -0.60 0.00 0.00 0.00 174.94 174.71 3a14 s ARG 30 N 1.63 3.84 -0.30 2.79 3.52 0.10 -4.96 118.95 125.57 3a14 s ARG 30 Ca 0.01 -0.39 -0.29 0.00 -0.13 0.00 0.00 55.73 54.93 3a14 s ARG 30 Cb -0.13 -3.40 0.01 0.00 -1.56 0.00 0.00 34.95 29.87 3a14 s ARG 30 CO -0.04 -0.06 1.11 -1.17 -0.81 0.00 0.00 175.30 174.34 3a14 s LEU 31 N 1.31 3.96 0.00 -0.88 2.96 -1.26 -0.31 118.68 124.46 3a14 s LEU 31 Ca 0.06 1.14 0.09 0.00 -0.22 0.00 0.00 54.13 55.20 3a14 s LEU 31 Cb -0.15 -3.54 0.03 0.00 0.50 0.00 0.00 46.19 43.03 3a14 s LEU 31 CO 0.05 -0.88 0.67 2.30 -1.32 0.00 0.00 176.35 177.17 3a14 n ILE 32 N 5.83 0.00 -3.60 6.68 -0.00 -0.19 -4.79 119.36 123.29 3a14 n ILE 32 Ca 0.12 -0.45 -0.10 0.00 -0.00 0.00 0.00 62.75 62.32 3a14 n ILE 32 Cb 0.47 1.14 -0.06 0.00 -0.00 0.00 0.00 39.64 41.19 3a14 n ILE 32 CO 0.00 0.00 0.00 -0.83 -0.00 0.00 0.00 176.55 175.72 3a14 s GLY 33 N -0.99 -0.20 0.15 3.28 0.00 -1.22 -3.96 107.32 104.39 3a14 s GLY 33 Ca 0.09 2.33 0.02 0.00 0.00 0.00 0.00 44.72 47.16 3a14 s GLY 33 CO 0.16 1.36 -0.03 -0.26 0.00 0.00 0.00 173.10 174.33 3a14 s ILE 34 N -0.57 0.80 0.12 0.90 -4.36 -0.71 -1.92 121.20 115.45 3a14 s ILE 34 Ca 0.00 -1.99 0.08 0.00 -0.26 0.00 0.00 60.65 58.48 3a14 s ILE 34 Cb -0.02 -1.98 -0.04 0.00 1.25 0.00 0.00 42.46 41.67 3a14 s ILE 34 CO -0.02 -0.61 -0.18 -0.94 0.24 0.00 0.00 174.94 173.43 3a14 s SER 35 N -3.15 2.39 0.25 4.36 1.04 -0.74 -0.93 113.70 116.91 3a14 s SER 35 Ca 0.20 -0.75 -0.13 0.00 0.48 0.00 0.00 55.95 55.75 3a14 s SER 35 Cb 0.05 -0.12 -0.00 0.00 0.10 0.00 0.00 66.02 66.05 3a14 s SER 35 CO 0.02 -0.02 0.48 0.72 0.98 0.00 0.00 173.24 175.42 3a14 s PHE 36 N -1.59 0.36 -0.19 5.02 -0.12 -0.84 -1.40 117.98 119.23 3a14 s PHE 36 Ca 0.08 -0.73 -0.11 0.00 -0.05 0.00 0.00 56.93 56.13 3a14 s PHE 36 Cb -0.08 0.19 -0.08 0.00 -0.63 0.00 0.00 43.02 42.42 3a14 s PHE 36 CO 0.04 -0.99 -0.27 1.58 -0.05 0.00 0.00 175.22 175.53 3a14 n HIS 37 N -0.38 0.00 -0.60 3.49 -0.00 -1.26 -1.49 115.22 114.97 3a14 n HIS 37 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.70 3a14 n HIS 37 Cb 0.62 -0.67 0.00 0.00 -0.00 0.00 0.00 29.99 29.94 3a14 n HIS 37 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 3a14 n SER 38 N -4.01 0.00 -4.44 0.26 3.41 -1.26 -2.16 113.62 105.42 3a14 n SER 38 Ca -0.34 -0.01 -0.43 0.00 -0.26 0.00 0.00 58.87 57.82 3a14 n SER 38 Cb 0.70 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.65 3a14 n SER 38 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3a14 n ASN 39 N 0.00 5.00 -0.25 4.04 2.85 -1.26 -4.82 115.26 120.81 3a14 n ASN 39 Ca 0.00 -2.95 -0.06 0.00 -0.11 0.00 0.00 54.58 51.46 3a14 n ASN 39 Cb 0.00 -1.66 0.05 0.00 1.24 0.00 0.00 39.78 39.41 3a14 n ASN 39 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 3a14 h LEU 40 N 11.02 0.90 0.15 1.20 3.38 -1.97 -1.38 115.31 128.60 3a14 h LEU 40 Ca 0.40 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.26 3a14 h LEU 40 Cb 0.84 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.32 3a14 h LEU 40 CO 1.41 0.77 -0.53 -0.08 0.09 0.00 0.00 178.44 180.10 3a14 h GLU 41 N 0.96 -0.75 -0.41 1.13 4.81 -2.00 -0.56 114.58 117.76 3a14 h GLU 41 Ca 0.24 0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.45 3a14 h GLU 41 Cb 0.10 0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 3a14 h GLU 41 CO -0.03 -0.50 -0.04 1.25 -0.73 0.00 0.00 179.01 178.95 3a14 h LEU 42 N -0.78 0.65 -1.00 1.64 5.85 -1.97 -2.92 115.31 116.79 3a14 h LEU 42 Ca -0.01 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.51 3a14 h LEU 42 Cb 0.77 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 3a14 h LEU 42 CO -0.27 0.75 0.24 0.00 -0.34 0.00 0.00 178.44 178.82 3a14 h ALA 43 N 1.32 1.20 -0.04 1.25 0.00 -0.92 -1.29 119.26 120.78 3a14 h ALA 43 Ca 0.12 -0.18 -0.23 0.00 0.00 0.00 0.00 54.91 54.62 3a14 h ALA 43 Cb 0.46 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.00 3a14 h ALA 43 CO 0.02 0.57 -0.92 0.35 0.00 0.00 0.00 179.25 179.28 3a14 h PHE 44 N 0.94 0.81 0.00 0.00 3.57 -0.99 -2.06 116.94 119.23 3a14 h PHE 44 Ca 0.22 -0.42 -0.07 0.00 3.53 0.00 0.00 57.97 61.23 3a14 h PHE 44 Cb 0.21 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 3a14 h PHE 44 CO 0.02 1.24 -0.35 1.57 -2.23 0.00 0.00 178.31 178.55 3a14 h LYS 45 N 0.34 0.00 -0.10 1.11 2.10 -1.38 0.51 116.57 119.15 3a14 h LYS 45 Ca -0.08 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.54 3a14 h LYS 45 Cb 1.55 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.88 3a14 h LYS 45 CO 0.17 0.35 -0.03 0.82 -2.00 0.00 0.00 179.45 178.77 3a14 h ILE 46 N 0.00 1.30 -0.89 0.07 1.08 -1.15 -1.53 117.51 116.39 3a14 h ILE 46 Ca -0.00 -0.97 0.05 0.00 -0.39 0.00 0.00 64.86 63.55 3a14 h ILE 46 Cb 0.87 1.75 -0.06 0.00 -3.07 0.00 0.00 36.82 36.31 3a14 h ILE 46 CO 0.05 0.27 0.56 0.58 -0.69 0.00 0.00 178.15 178.92 3a14 h VAL 47 N -0.14 1.09 -0.01 1.67 2.07 -1.04 0.92 116.25 120.81 3a14 h VAL 47 Ca 0.02 -0.36 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 3a14 h VAL 47 Cb 0.45 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.16 3a14 h VAL 47 CO 0.01 0.19 -0.03 0.11 0.02 0.00 0.00 177.57 177.87 3a14 h LYS 48 N 1.05 0.04 -0.04 1.57 1.57 -0.92 -0.56 116.57 119.27 3a14 h LYS 48 Ca 0.37 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 59.03 3a14 h LYS 48 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 3a14 h LYS 48 CO -0.15 0.65 -0.42 0.93 -0.57 0.00 0.00 179.45 179.89 3a14 h GLU 49 N -0.57 0.09 -0.28 3.15 5.08 -1.15 -3.09 114.58 117.82 3a14 h GLU 49 Ca -0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3a14 h GLU 49 Cb 0.65 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 3a14 h GLU 49 CO 0.01 0.50 0.00 1.19 -1.00 0.00 0.00 179.01 179.71 3a14 n PHE 50 N -4.03 0.35 -4.00 4.33 3.72 0.31 -4.99 117.46 113.15 3a14 n PHE 50 Ca -0.02 -0.22 -0.28 0.00 -0.05 0.00 0.00 57.45 56.88 3a14 n PHE 50 Cb 0.46 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.97 3a14 n PHE 50 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3a14 n ASN 51 N 1.14 -0.61 -4.71 4.37 5.15 -0.55 -4.91 115.26 115.14 3a14 n ASN 51 Ca 0.15 -1.07 -0.42 0.00 -0.60 0.00 0.00 54.58 52.64 3a14 n ASN 51 Cb 0.51 -2.76 -0.03 0.00 -0.53 0.00 0.00 39.78 36.97 3a14 n ASN 51 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3a14 s VAL 52 N -3.98 4.83 -2.61 3.44 1.01 -0.33 -4.95 120.40 117.82 3a14 s VAL 52 Ca 0.06 2.00 0.22 0.00 0.00 0.00 0.00 61.98 64.26 3a14 s VAL 52 Cb -0.02 -4.29 0.26 0.00 0.00 0.00 0.00 36.38 32.32 3a14 s VAL 52 CO 0.91 0.19 1.26 0.29 0.00 0.00 0.00 175.10 177.76 3a14 n LYS 53 N 3.73 2.22 -3.74 2.72 4.76 -1.26 -4.88 118.16 121.70 3a14 n LYS 53 Ca 0.05 -1.98 -0.16 0.00 -2.87 0.00 0.00 58.31 53.35 3a14 n LYS 53 Cb 0.51 -1.45 -0.16 0.00 -1.84 0.00 0.00 35.03 32.09 3a14 n LYS 53 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3a14 s ASN 54 N -1.69 0.34 -0.05 4.39 0.01 -1.25 -0.14 114.94 116.54 3a14 s ASN 54 Ca 0.30 0.07 -0.02 0.00 -0.71 0.00 0.00 52.86 52.50 3a14 s ASN 54 Cb 0.20 -0.07 0.04 0.00 0.41 0.00 0.00 41.25 41.83 3a14 s ASN 54 CO 0.29 -0.16 0.10 -0.69 -1.51 0.00 0.00 177.10 175.12 3a14 s VAL 55 N 1.38 -0.06 -0.14 1.60 1.01 -0.07 -1.74 120.40 122.38 3a14 s VAL 55 Ca -0.05 0.21 -0.03 0.00 0.00 0.00 0.00 61.98 62.10 3a14 s VAL 55 Cb -0.13 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 36.05 3a14 s VAL 55 CO -0.03 0.09 -0.03 0.00 0.00 0.00 0.00 175.10 175.12 3a14 s ALA 56 N 1.21 3.05 -0.17 5.51 0.00 -0.11 0.26 121.76 131.52 3a14 s ALA 56 Ca -0.08 -0.82 -0.07 0.00 0.00 0.00 0.00 51.96 50.99 3a14 s ALA 56 Cb -0.12 -1.54 -0.04 0.00 0.00 0.00 0.00 23.12 21.42 3a14 s ALA 56 CO -0.05 0.28 0.06 0.42 0.00 0.00 0.00 175.76 176.47 3a14 s ILE 57 N 0.14 4.77 -0.26 0.00 -1.09 0.26 -1.98 121.20 123.04 3a14 s ILE 57 Ca -0.01 -0.05 0.12 0.00 -2.23 0.00 0.00 60.65 58.48 3a14 s ILE 57 Cb -0.14 -3.13 -0.16 0.00 -1.58 0.00 0.00 42.46 37.46 3a14 s ILE 57 CO 0.03 0.49 0.37 0.35 -1.23 0.00 0.00 174.94 174.95 3a14 n THR 58 N 3.27 0.00 -2.62 2.92 -2.24 -0.56 -4.16 114.28 110.88 3a14 n THR 58 Ca -0.17 -0.25 -0.23 0.00 -2.27 0.00 0.00 64.05 61.13 3a14 n THR 58 Cb 0.53 0.58 0.12 0.00 -2.10 0.00 0.00 70.33 69.45 3a14 n THR 58 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3a14 n GLY 59 N 1.57 0.68 3.01 3.38 0.00 -0.92 -4.94 105.19 107.97 3a14 n GLY 59 Ca -0.00 -2.04 -0.43 0.00 0.00 0.00 0.00 46.02 43.55 3a14 n GLY 59 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3a14 n ASP 60 N -2.89 5.76 -4.23 1.61 2.03 -1.26 -4.77 116.55 112.79 3a14 n ASP 60 Ca 0.16 -3.24 -0.17 0.00 0.52 0.00 0.00 54.79 52.07 3a14 n ASP 60 Cb 0.59 -1.38 -0.11 0.00 -0.72 0.00 0.00 41.12 39.50 3a14 n ASP 60 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3a14 s VAL 61 N -1.15 1.25 -0.13 5.18 1.01 -1.26 -5.13 120.40 120.18 3a14 s VAL 61 Ca 0.35 -1.72 -0.08 0.00 0.00 0.00 0.00 61.98 60.53 3a14 s VAL 61 Cb 0.05 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 3a14 s VAL 61 CO 0.05 -0.46 0.16 -1.61 0.00 0.00 0.00 175.10 173.24 3a14 s GLU 62 N -2.74 3.63 -0.34 2.72 0.41 -1.26 -5.06 118.70 116.06 3a14 s GLU 62 Ca 0.09 -0.10 0.00 0.00 -0.41 0.00 0.00 54.97 54.55 3a14 s GLU 62 Cb -0.04 -3.24 0.11 0.00 -1.78 0.00 0.00 34.13 29.18 3a14 s GLU 62 CO 0.02 0.67 0.13 0.12 -0.49 0.00 0.00 175.26 175.72 3a14 s PHE 63 N -0.74 1.89 -0.67 1.61 5.36 -1.26 -5.07 117.98 119.09 3a14 s PHE 63 Ca 0.15 -1.98 -0.27 0.00 -0.96 0.00 0.00 56.93 53.86 3a14 s PHE 63 Cb -0.12 -1.82 0.03 0.00 -0.34 0.00 0.00 43.02 40.76 3a14 s PHE 63 CO 0.04 -0.86 1.30 -1.83 -1.46 0.00 0.00 175.22 172.41 3a14 s GLU 64 N 1.26 3.26 -0.30 10.12 -1.05 -1.26 -4.95 118.70 125.78 3a14 s GLU 64 Ca 0.12 0.00 -0.14 0.00 -0.15 0.00 0.00 54.97 54.80 3a14 s GLU 64 Cb -0.19 -4.14 0.16 0.00 -0.44 0.00 0.00 34.13 29.51 3a14 s GLU 64 CO -0.17 -2.04 0.91 -0.51 0.95 0.00 0.00 175.26 174.40 3a14 s ASP 65 N 3.84 -0.70 0.04 0.83 -0.00 -1.26 -5.00 116.67 114.42 3a14 s ASP 65 Ca 0.41 0.97 0.23 0.00 -0.00 0.00 0.00 52.55 54.16 3a14 s ASP 65 Cb -0.08 1.78 0.04 0.00 -0.00 0.00 0.00 42.92 44.66 3a14 s ASP 65 CO 0.19 -0.14 1.02 -0.24 -0.00 0.00 0.00 175.17 176.01 3a14 n SER 66 N 5.03 0.62 0.26 0.27 2.88 -1.26 -4.09 113.62 117.32 3a14 n SER 66 Ca -0.10 -0.25 0.18 0.00 -1.33 0.00 0.00 58.87 57.37 3a14 n SER 66 Cb 0.52 0.81 0.82 0.00 -0.75 0.00 0.00 64.21 65.61 3a14 n SER 66 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 3a14 h SER 67 N 0.00 0.00 -5.08 -3.46 0.02 -1.99 -3.45 113.55 99.59 3a14 h SER 67 Ca 0.00 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.80 3a14 h SER 67 Cb 0.71 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 63.08 3a14 h SER 67 CO 0.00 0.00 -0.69 0.27 -1.14 0.00 0.00 176.83 175.27 3a14 s ILE 68 N -3.76 0.22 -0.05 3.27 -4.36 -1.26 -4.96 121.20 110.31 3a14 s ILE 68 Ca -0.01 -1.42 -0.30 0.00 -0.26 0.00 0.00 60.65 58.66 3a14 s ILE 68 Cb 0.10 -0.98 -0.02 0.00 1.25 0.00 0.00 42.46 42.80 3a14 s ILE 68 CO 0.44 -0.76 1.03 0.20 0.24 0.00 0.00 174.94 176.09 3a14 s ASN 69 N -2.28 7.26 -0.14 4.36 -0.87 0.80 -4.90 114.94 119.16 3a14 s ASN 69 Ca -0.03 1.65 0.01 0.00 -1.57 0.00 0.00 52.86 52.92 3a14 s ASN 69 Cb -0.00 -2.56 0.02 0.00 -0.02 0.00 0.00 41.25 38.68 3a14 s ASN 69 CO -0.06 -0.40 -0.16 -0.69 -2.57 0.00 0.00 177.10 173.23 3a14 s VAL 70 N 1.60 1.65 -0.00 1.60 1.01 -1.26 -0.89 120.40 124.10 3a14 s VAL 70 Ca 0.51 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.78 3a14 s VAL 70 Cb -0.21 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 3a14 s VAL 70 CO 0.23 0.47 0.17 0.26 0.00 0.00 0.00 175.10 176.23 3a14 s TRP 71 N 1.31 3.51 0.17 5.22 0.51 0.14 -4.99 118.94 124.81 3a14 s TRP 71 Ca 0.02 0.33 -0.08 0.00 -2.12 0.00 0.00 56.10 54.25 3a14 s TRP 71 Cb -0.13 -1.81 -0.01 0.00 -0.81 0.00 0.00 33.47 30.70 3a14 s TRP 71 CO -0.08 0.63 0.27 -1.59 -0.51 0.00 0.00 176.95 175.67 3a14 s LYS 72 N -1.94 1.17 0.00 4.98 0.00 -1.26 -0.57 119.74 122.11 3a14 s LYS 72 Ca 0.27 -1.24 0.00 0.00 0.00 0.00 0.00 55.97 55.00 3a14 s LYS 72 Cb -0.13 0.36 0.00 0.00 0.00 0.00 0.00 37.83 38.07 3a14 s LYS 72 CO 0.19 -0.42 0.00 0.41 0.00 0.00 0.00 175.35 175.52 3a14 n GLY 73 N -0.22 -0.48 0.00 0.59 0.00 -1.26 -4.33 105.19 99.49 3a14 n GLY 73 Ca -0.06 -1.80 0.05 0.00 0.00 0.00 0.00 46.02 44.21 3a14 n GLY 73 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3a14 n SER 74 N -0.62 0.00 -0.09 1.61 3.41 -1.26 -2.73 113.62 113.95 3a14 n SER 74 Ca 0.00 0.42 0.09 0.00 -0.26 0.00 0.00 58.87 59.12 3a14 n SER 74 Cb 0.00 -0.45 0.13 0.00 -0.26 0.00 0.00 64.21 63.62 3a14 n SER 74 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3a14 n HIS 75 N -1.45 0.00 -0.15 7.33 8.25 -1.26 -4.84 115.22 123.09 3a14 n HIS 75 Ca 0.03 -0.94 -0.06 0.00 -0.26 0.00 0.00 57.72 56.49 3a14 n HIS 75 Cb 0.12 -0.14 0.11 0.00 1.12 0.00 0.00 29.99 31.19 3a14 n HIS 75 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3a14 h SER 76 N 0.00 0.87 -0.06 0.41 4.64 -1.70 -1.02 113.55 116.68 3a14 h SER 76 Ca 0.00 -0.23 -0.01 0.00 -0.47 0.00 0.00 61.79 61.08 3a14 h SER 76 Cb 1.00 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 62.86 3a14 h SER 76 CO 0.00 0.94 0.01 0.40 -0.87 0.00 0.00 176.83 177.31 3a14 h ILE 77 N 0.83 1.22 -0.61 0.95 2.04 -1.88 -1.43 117.51 118.63 3a14 h ILE 77 Ca 0.16 -0.67 -0.03 0.00 1.00 0.00 0.00 64.86 65.32 3a14 h ILE 77 Cb 0.50 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 38.11 3a14 h ILE 77 CO 0.02 0.19 0.28 1.05 0.00 0.00 0.00 178.15 179.69 3a14 h GLU 78 N -0.15 0.87 0.14 2.37 9.09 -1.86 -0.88 114.58 124.17 3a14 h GLU 78 Ca 0.02 -0.12 -0.01 0.00 0.05 0.00 0.00 59.36 59.30 3a14 h GLU 78 Cb 0.29 -0.16 0.00 0.00 -1.65 0.00 0.00 28.75 27.23 3a14 h GLU 78 CO 0.00 0.69 -0.07 0.93 0.05 0.00 0.00 179.01 180.62 3a14 h GLU 79 N 0.87 -0.18 -0.06 1.06 5.08 -1.18 -2.06 114.58 118.12 3a14 h GLU 79 Ca 0.21 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 3a14 h GLU 79 Cb 0.12 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 3a14 h GLU 79 CO -0.03 0.15 0.02 1.98 -1.00 0.00 0.00 179.01 180.13 3a14 h MET 80 N -0.52 0.05 -0.93 2.33 4.05 -1.06 -1.88 114.93 116.97 3a14 h MET 80 Ca -0.02 -0.00 0.04 0.00 -0.28 0.00 0.00 59.70 59.44 3a14 h MET 80 Cb 0.41 -0.01 -0.06 0.00 -0.80 0.00 0.00 31.60 31.14 3a14 h MET 80 CO 0.03 0.03 0.60 -0.07 0.23 0.00 0.00 176.91 177.74 3a14 h LEU 81 N 0.05 1.00 -1.24 3.39 3.38 -1.23 0.25 115.31 120.90 3a14 h LEU 81 Ca 0.02 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3a14 h LEU 81 Cb 0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 3a14 h LEU 81 CO -0.02 0.68 -0.06 -0.08 0.09 0.00 0.00 178.44 179.05 3a14 h GLU 82 N 1.16 0.45 -0.03 1.13 4.81 -1.17 0.12 114.58 121.04 3a14 h GLU 82 Ca 0.37 -0.10 -0.06 0.00 -0.13 0.00 0.00 59.36 59.44 3a14 h GLU 82 Cb 0.02 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.35 3a14 h GLU 82 CO -0.13 0.52 -0.21 0.00 -0.73 0.00 0.00 179.01 178.46 3a14 h ALA 83 N 1.52 0.07 0.05 2.92 0.00 -0.43 -3.37 119.26 120.02 3a14 h ALA 83 Ca 0.09 -0.42 -0.23 0.00 0.00 0.00 0.00 54.91 54.35 3a14 h ALA 83 Cb 0.37 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3a14 h ALA 83 CO 0.02 0.06 -1.05 -0.07 0.00 0.00 0.00 179.25 178.20 3a14 h LEU 84 N -0.39 0.21 -3.90 0.00 4.07 -0.46 -3.49 115.31 111.35 3a14 h LEU 84 Ca -0.02 -0.21 -0.57 0.00 0.08 0.00 0.00 57.88 57.16 3a14 h LEU 84 Cb 0.89 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 42.55 3a14 h LEU 84 CO 0.04 1.12 -1.05 0.29 -1.08 0.00 0.00 178.44 177.77 3a14 n LYS 85 N -3.49 -0.67 -1.61 1.13 5.02 0.40 -4.87 118.16 114.06 3a14 n LYS 85 Ca -0.04 0.29 -0.32 0.00 -2.02 0.00 0.00 58.31 56.22 3a14 n LYS 85 Cb 0.93 -2.34 0.06 0.00 -0.02 0.00 0.00 35.03 33.66 3a14 n LYS 85 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3a14 s PRO 86 N -6.61 2.65 0.16 1.97 0.04 -1.20 -4.91 135.00 127.10 3a14 s PRO 86 Ca 0.32 1.31 -0.14 0.00 0.04 0.00 0.00 61.00 62.53 3a14 s PRO 86 Cb -0.18 -1.94 0.04 0.00 0.04 0.00 0.00 34.50 32.46 3a14 s PRO 86 CO 0.95 -1.35 1.71 -0.44 0.04 0.00 0.00 177.00 177.91 3a14 h ASP 87 N -0.32 0.69 -3.43 6.66 3.32 -1.75 -3.28 116.42 118.31 3a14 h ASP 87 Ca -0.46 -0.16 -0.49 0.00 0.02 0.00 0.00 57.03 55.94 3a14 h ASP 87 Cb 1.24 -0.18 -0.33 0.00 0.22 0.00 0.00 39.33 40.28 3a14 h ASP 87 CO 0.53 0.67 -0.80 -0.63 -1.72 0.00 0.00 179.24 177.29 3a14 s ILE 88 N -5.57 0.98 -0.17 0.35 1.01 -0.15 -1.18 121.20 116.46 3a14 s ILE 88 Ca -0.13 -0.39 -0.02 0.00 0.00 0.00 0.00 60.65 60.11 3a14 s ILE 88 Cb 0.12 -0.92 -0.01 0.00 0.01 0.00 0.00 42.46 41.66 3a14 s ILE 88 CO 0.77 0.32 -0.08 -0.89 0.00 0.00 0.00 174.94 175.06 3a14 s THR 89 N 0.71 3.25 -0.34 2.92 2.01 -0.63 -0.80 115.64 122.76 3a14 s THR 89 Ca -0.14 -0.56 -0.23 0.00 0.31 0.00 0.00 61.69 61.07 3a14 s THR 89 Cb -0.15 -2.42 0.00 0.00 0.01 0.00 0.00 72.50 69.94 3a14 s THR 89 CO 0.03 0.48 0.76 -0.32 -0.69 0.00 0.00 174.62 174.88 3a14 s MET 90 N 0.87 3.83 -0.82 4.92 1.75 0.23 -0.88 119.30 129.21 3a14 s MET 90 Ca -0.02 0.39 -0.16 0.00 -1.25 0.00 0.00 55.69 54.64 3a14 s MET 90 Cb -0.15 -3.77 0.18 0.00 2.84 0.00 0.00 34.83 33.92 3a14 s MET 90 CO 0.01 -0.76 0.86 0.08 -0.65 0.00 0.00 175.02 174.56 3a14 s VAL 91 N 2.98 5.24 -0.22 10.11 1.01 -0.01 -0.18 120.40 139.33 3a14 s VAL 91 Ca 0.31 -2.00 0.12 0.00 0.00 0.00 0.00 61.98 60.41 3a14 s VAL 91 Cb -0.14 -4.56 0.44 0.00 0.00 0.00 0.00 36.38 32.12 3a14 s VAL 91 CO 0.15 -1.18 1.33 0.00 0.00 0.00 0.00 175.10 175.39 3a14 n ALA 92 N 5.07 3.56 -1.77 5.51 0.00 0.87 -1.60 120.51 132.14 3a14 n ALA 92 Ca 0.13 -2.98 -0.37 0.00 0.00 0.00 0.00 53.44 50.22 3a14 n ALA 92 Cb 0.47 -0.55 -0.02 0.00 0.00 0.00 0.00 19.45 19.35 3a14 n ALA 92 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3a14 s VAL 93 N -3.12 3.24 0.02 0.00 -7.23 -1.13 -4.57 120.40 107.61 3a14 s VAL 93 Ca 0.40 0.93 -0.07 0.00 -1.81 0.00 0.00 61.98 61.43 3a14 s VAL 93 Cb 0.36 -3.47 -0.05 0.00 0.56 0.00 0.00 36.38 33.78 3a14 s VAL 93 CO -0.00 -0.01 0.29 -0.94 -0.31 0.00 0.00 175.10 174.12 3a14 s SER 94 N -1.41 6.51 0.00 4.85 1.04 -1.26 -4.63 113.70 118.81 3a14 s SER 94 Ca 0.62 0.58 0.00 0.00 0.48 0.00 0.00 55.95 57.63 3a14 s SER 94 Cb -0.27 -2.10 0.00 0.00 0.10 0.00 0.00 66.02 63.75 3a14 s SER 94 CO 0.33 0.23 0.00 0.61 0.98 0.00 0.00 173.24 175.40 3a14 n GLY 95 N 1.04 -1.87 0.22 7.32 0.00 -1.26 -4.49 105.19 106.16 3a14 n GLY 95 Ca -0.10 -1.77 0.03 0.00 0.00 0.00 0.00 46.02 44.17 3a14 n GLY 95 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3a14 h PHE 96 N 0.00 0.14 0.00 1.61 3.57 -1.96 -2.56 116.94 117.74 3a14 h PHE 96 Ca 0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 3a14 h PHE 96 Cb 0.00 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.70 3a14 h PHE 96 CO 0.00 0.33 0.00 -1.13 -2.23 0.00 0.00 178.31 175.28 3a14 n SER 97 N -4.24 0.40 0.26 0.41 3.41 -1.26 -1.71 113.62 110.88 3a14 n SER 97 Ca -0.01 0.64 0.15 0.00 -0.26 0.00 0.00 58.87 59.39 3a14 n SER 97 Cb 0.30 -0.71 0.86 0.00 -0.26 0.00 0.00 64.21 64.39 3a14 n SER 97 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3a14 h GLY 98 N 1.09 0.00 0.82 5.00 0.00 -1.70 -2.09 103.07 106.20 3a14 h GLY 98 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3a14 h GLY 98 CO 0.00 0.00 -0.12 -2.00 0.00 0.00 0.00 176.54 174.42 3a14 h LEU 99 N 0.00 -0.30 -0.42 3.11 5.85 -1.57 0.65 115.31 122.63 3a14 h LEU 99 Ca 0.03 -0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.67 3a14 h LEU 99 Cb 0.17 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 3a14 h LEU 99 CO -0.00 -0.05 0.20 0.03 -0.34 0.00 0.00 178.44 178.27 3a14 h ARG 100 N -0.54 0.39 -0.42 1.25 3.08 -1.70 -2.44 114.38 114.01 3a14 h ARG 100 Ca -0.04 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.03 3a14 h ARG 100 Cb 0.40 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.32 3a14 h ARG 100 CO 0.06 0.26 0.18 0.00 -1.07 0.00 0.00 179.97 179.39 3a14 h ALA 101 N 1.24 0.51 -0.65 0.04 0.00 -1.25 -1.88 119.26 117.26 3a14 h ALA 101 Ca 0.19 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 3a14 h ALA 101 Cb 0.11 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3a14 h ALA 101 CO -0.14 -0.20 0.28 0.28 0.00 0.00 0.00 179.25 179.47 3a14 h VAL 102 N 0.36 1.23 -0.63 0.00 2.07 -0.73 0.36 116.25 118.92 3a14 h VAL 102 Ca 0.19 -0.70 -0.05 0.00 0.82 0.00 0.00 66.70 66.95 3a14 h VAL 102 Cb 0.14 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 3a14 h VAL 102 CO -0.16 0.28 0.18 -0.07 0.02 0.00 0.00 177.57 177.82 3a14 h LEU 103 N 0.91 0.93 -0.74 2.57 3.38 -1.06 -0.35 115.31 120.95 3a14 h LEU 103 Ca 0.22 -0.22 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 3a14 h LEU 103 Cb 0.17 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3a14 h LEU 103 CO -0.02 0.90 -0.44 0.00 0.09 0.00 0.00 178.44 178.98 3a14 h ALA 104 N 1.06 0.92 -0.45 1.53 0.00 -1.21 -2.82 119.26 118.29 3a14 h ALA 104 Ca 0.20 -0.45 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 3a14 h ALA 104 Cb 0.32 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3a14 h ALA 104 CO -0.00 0.64 0.18 0.77 0.00 0.00 0.00 179.25 180.84 3a14 h SER 105 N 0.35 0.62 0.18 0.00 0.02 -0.52 -2.75 113.55 111.46 3a14 h SER 105 Ca 0.03 -0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 60.79 3a14 h SER 105 Cb 0.91 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 63.29 3a14 h SER 105 CO 0.08 0.62 -0.10 -0.07 -1.14 0.00 0.00 176.83 176.22 3a14 h LEU 106 N 0.59 0.00 -0.76 5.07 3.38 -0.96 -0.78 115.31 121.85 3a14 h LEU 106 Ca 0.15 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 3a14 h LEU 106 Cb 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 3a14 h LEU 106 CO -0.01 0.10 -0.33 -0.08 0.09 0.00 0.00 178.44 178.20 3a14 h GLU 107 N 0.00 0.00 0.00 1.13 4.57 -1.24 -3.38 114.58 115.66 3a14 h GLU 107 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3a14 h GLU 107 Cb 0.22 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 3a14 h GLU 107 CO 0.01 0.33 0.00 0.72 -1.18 0.00 0.00 179.01 178.90 3a14 n HIS 108 N -3.39 0.00 -4.43 0.92 8.25 -0.93 -5.06 115.22 110.58 3a14 n HIS 108 Ca 0.01 -0.10 -0.24 0.00 -0.26 0.00 0.00 57.72 57.13 3a14 n HIS 108 Cb 0.53 -0.01 -0.09 0.00 1.12 0.00 0.00 29.99 31.54 3a14 n HIS 108 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 3a14 s SER 109 N -0.20 3.81 0.00 0.41 0.01 -0.34 -3.21 113.70 114.19 3a14 s SER 109 Ca 0.00 -0.94 0.10 0.00 1.31 0.00 0.00 55.95 56.42 3a14 s SER 109 Cb 0.00 -0.42 -0.23 0.00 0.21 0.00 0.00 66.02 65.58 3a14 s SER 109 CO 0.00 0.03 0.84 0.11 0.41 0.00 0.00 173.24 174.63 3a14 h LYS 110 N 2.18 0.01 -4.09 12.44 1.57 -1.20 -3.46 116.57 124.01 3a14 h LYS 110 Ca -0.41 -0.02 -0.34 0.00 -1.87 0.00 0.00 60.65 58.00 3a14 h LYS 110 Cb 1.26 0.01 -0.31 0.00 0.08 0.00 0.00 32.23 33.27 3a14 h LYS 110 CO 0.60 0.67 -0.76 0.50 -0.57 0.00 0.00 179.45 179.90 3a14 s ARG 111 N -2.63 0.47 -0.20 3.15 3.52 -0.40 -1.74 118.95 121.12 3a14 s ARG 111 Ca -0.03 -0.10 -0.05 0.00 -0.13 0.00 0.00 55.73 55.41 3a14 s ARG 111 Cb 0.08 -0.50 -0.03 0.00 -1.56 0.00 0.00 34.95 32.94 3a14 s ARG 111 CO 0.82 0.01 0.01 0.08 -0.81 0.00 0.00 175.30 175.42 3a14 s VAL 112 N 0.36 4.09 -0.34 7.11 1.01 0.24 -1.60 120.40 131.27 3a14 s VAL 112 Ca -0.04 -0.27 -0.17 0.00 0.00 0.00 0.00 61.98 61.50 3a14 s VAL 112 Cb -0.07 -2.85 -0.01 0.00 0.00 0.00 0.00 36.38 33.45 3a14 s VAL 112 CO -0.00 0.43 0.47 0.00 0.00 0.00 0.00 175.10 175.99 3a14 s LEU 114 N 2.28 4.91 -0.50 0.00 2.96 -0.62 -0.83 118.68 126.89 3a14 s LEU 114 Ca 0.17 -0.72 0.06 0.00 -0.22 0.00 0.00 54.13 53.42 3a14 s LEU 114 Cb -0.16 -2.28 0.38 0.00 0.50 0.00 0.00 46.19 44.63 3a14 s LEU 114 CO 0.12 -0.49 1.02 0.00 -1.32 0.00 0.00 176.35 175.68 3a14 n ALA 115 N 5.38 4.70 -3.69 5.97 0.00 -0.63 -1.06 120.51 131.18 3a14 n ALA 115 Ca -0.09 -4.41 -0.19 0.00 0.00 0.00 0.00 53.44 48.75 3a14 n ALA 115 Cb 0.47 -0.66 -0.17 0.00 0.00 0.00 0.00 19.45 19.09 3a14 n ALA 115 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3a14 s ASN 116 N -3.45 0.87 0.09 0.00 3.84 -1.19 -4.25 114.94 110.85 3a14 s ASN 116 Ca 0.47 0.08 -0.06 0.00 0.21 0.00 0.00 52.86 53.56 3a14 s ASN 116 Cb 0.35 -0.11 -0.21 0.00 -0.55 0.00 0.00 41.25 40.73 3a14 s ASN 116 CO -0.15 -0.22 1.20 0.11 -2.79 0.00 0.00 177.10 175.24 3a14 h LYS 117 N 8.16 0.40 -0.35 0.43 1.57 -1.92 -3.35 116.57 121.51 3a14 h LYS 117 Ca -0.20 -0.54 -0.01 0.00 -1.87 0.00 0.00 60.65 58.04 3a14 h LYS 117 Cb 1.12 0.18 -0.02 0.00 0.08 0.00 0.00 32.23 33.59 3a14 h LYS 117 CO 0.23 1.21 0.19 0.93 -0.57 0.00 0.00 179.45 181.44 3a14 h GLU 118 N 0.17 0.47 -0.60 3.15 3.07 -1.95 -1.82 114.58 117.06 3a14 h GLU 118 Ca -0.13 -0.04 0.08 0.00 -0.50 0.00 0.00 59.36 58.77 3a14 h GLU 118 Cb 1.81 -0.10 -0.06 0.00 -0.84 0.00 0.00 28.75 29.56 3a14 h GLU 118 CO 0.20 0.35 0.27 0.66 -1.40 0.00 0.00 179.01 179.08 3a14 h SER 119 N 0.48 0.34 0.29 1.42 4.64 -1.84 -1.06 113.55 117.83 3a14 h SER 119 Ca 0.13 0.06 -0.34 0.00 -0.47 0.00 0.00 61.79 61.17 3a14 h SER 119 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 3a14 h SER 119 CO -0.02 0.21 -1.68 -0.07 -0.87 0.00 0.00 176.83 174.40 3a14 h LEU 120 N 0.50 0.52 0.36 5.97 3.38 -1.68 -1.30 115.31 123.06 3a14 h LEU 120 Ca 0.29 -0.77 -0.01 0.00 0.09 0.00 0.00 57.88 57.48 3a14 h LEU 120 Cb 0.29 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3a14 h LEU 120 CO -0.24 1.65 -0.24 0.58 0.09 0.00 0.00 178.44 180.28 3a14 h VAL 121 N 0.09 0.51 0.16 1.22 2.07 -1.32 -2.29 116.25 116.68 3a14 h VAL 121 Ca -0.31 0.00 -0.26 0.00 0.82 0.00 0.00 66.70 66.95 3a14 h VAL 121 Cb 2.07 0.51 0.03 0.00 -1.52 0.00 0.00 31.29 32.37 3a14 h VAL 121 CO 0.17 0.00 -1.10 0.00 0.02 0.00 0.00 177.57 176.66 3a14 n GLY 123 N 1.56 2.86 0.37 0.00 0.00 -0.53 -4.73 105.19 104.72 3a14 n GLY 123 Ca -0.14 -1.24 0.15 0.00 0.00 0.00 0.00 46.02 44.79 3a14 n GLY 123 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3a14 h GLY 124 N 1.52 1.53 1.70 -0.02 0.00 -1.00 -0.68 103.07 106.12 3a14 h GLY 124 Ca -0.08 -0.31 -0.07 0.00 0.00 0.00 0.00 47.33 46.88 3a14 h GLY 124 CO 0.18 -0.06 -0.16 0.27 0.00 0.00 0.00 176.54 176.77 3a14 h PHE 125 N 0.64 0.39 -0.24 5.60 -5.15 -1.89 -0.43 116.94 115.87 3a14 h PHE 125 Ca 0.56 -0.06 -0.10 0.00 -0.20 0.00 0.00 57.97 58.17 3a14 h PHE 125 Cb 1.03 -0.10 -0.00 0.00 0.22 0.00 0.00 35.95 37.10 3a14 h PHE 125 CO -0.00 0.52 -0.25 -0.07 -2.00 0.00 0.00 178.31 176.51 3a14 h LEU 126 N 0.34 0.63 -0.26 2.10 3.38 -1.53 -2.51 115.31 117.46 3a14 h LEU 126 Ca 0.06 -0.48 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 3a14 h LEU 126 Cb 0.49 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3a14 h LEU 126 CO 0.03 0.98 0.14 0.58 0.09 0.00 0.00 178.44 180.26 3a14 h VAL 127 N 0.29 1.13 -0.73 1.22 2.07 -1.04 -2.33 116.25 116.87 3a14 h VAL 127 Ca 0.04 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.19 3a14 h VAL 127 Cb 0.81 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 3a14 h VAL 127 CO 0.06 0.12 0.34 0.50 0.02 0.00 0.00 177.57 178.61 3a14 h LYS 128 N 0.31 1.04 0.00 1.57 1.63 -1.10 0.06 116.57 120.09 3a14 h LYS 128 Ca 0.09 -0.15 -0.00 0.00 -0.85 0.00 0.00 60.65 59.74 3a14 h LYS 128 Cb 0.07 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 31.51 3a14 h LYS 128 CO -0.01 0.81 -0.00 -0.22 -3.45 0.00 0.00 179.45 176.58 3a14 h LYS 129 N 1.03 -0.00 -0.92 1.90 3.64 -1.42 -2.60 116.57 118.20 3a14 h LYS 129 Ca 0.25 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.65 3a14 h LYS 129 Cb 0.12 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.90 3a14 h LYS 129 CO -0.03 0.24 0.61 -0.22 -2.27 0.00 0.00 179.45 177.78 3a14 h LYS 130 N -0.25 1.17 -0.19 1.90 1.63 -1.21 -2.24 116.57 117.38 3a14 h LYS 130 Ca -0.00 -0.07 0.03 0.00 -0.85 0.00 0.00 60.65 59.76 3a14 h LYS 130 Cb 0.25 -0.26 -0.03 0.00 -0.60 0.00 0.00 32.23 31.58 3a14 h LYS 130 CO 0.00 0.78 -0.00 1.25 -3.45 0.00 0.00 179.45 178.03 3a14 h LEU 131 N 1.21 -0.07 -0.39 5.20 5.85 -0.93 -1.76 115.31 124.41 3a14 h LEU 131 Ca 0.35 0.04 0.00 0.00 0.84 0.00 0.00 57.88 59.11 3a14 h LEU 131 Cb -0.08 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.02 3a14 h LEU 131 CO -0.09 -0.01 0.00 0.07 -0.34 0.00 0.00 178.44 178.07 3a14 h LYS 132 N 0.06 0.00 -0.07 1.25 2.10 -1.23 0.29 116.57 118.97 3a14 h LYS 132 Ca 0.09 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.68 3a14 h LYS 132 Cb 0.11 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.44 3a14 h LYS 132 CO -0.15 0.00 -0.18 0.93 -2.00 0.00 0.00 179.45 178.05 3a14 h GLU 133 N 0.00 0.24 0.00 0.07 5.08 -1.11 -3.37 114.58 115.48 3a14 h GLU 133 Ca 0.00 -0.17 -0.28 0.00 -1.00 0.00 0.00 59.36 57.91 3a14 h GLU 133 Cb 0.69 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.92 3a14 h GLU 133 CO 0.00 0.79 -1.71 1.63 -1.00 0.00 0.00 179.01 178.72 3a14 n LYS 134 N -4.57 0.63 -1.05 2.33 4.76 -0.69 -4.98 118.16 114.60 3a14 n LYS 134 Ca -0.08 0.27 -0.02 0.00 -2.87 0.00 0.00 58.31 55.61 3a14 n LYS 134 Cb 0.41 -1.78 -0.01 0.00 -1.84 0.00 0.00 35.03 31.81 3a14 n LYS 134 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3a14 n GLY 135 N 1.54 0.48 3.76 0.72 0.00 0.10 -5.00 105.19 106.79 3a14 n GLY 135 Ca -0.17 -0.20 -0.39 0.00 0.00 0.00 0.00 46.02 45.27 3a14 n GLY 135 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3a14 s THR 136 N -1.84 2.26 0.20 2.61 2.01 -1.25 -4.98 115.64 114.65 3a14 s THR 136 Ca 0.00 0.21 -0.30 0.00 0.31 0.00 0.00 61.69 61.91 3a14 s THR 136 Cb 0.00 -3.12 -0.08 0.00 0.01 0.00 0.00 72.50 69.31 3a14 s THR 136 CO 0.00 0.01 1.12 -1.61 -0.69 0.00 0.00 174.62 173.46 3a14 s GLU 137 N -2.62 4.58 -0.18 4.92 2.02 -0.71 -4.94 118.70 121.76 3a14 s GLU 137 Ca 0.65 1.78 -0.00 0.00 0.02 0.00 0.00 54.97 57.41 3a14 s GLU 137 Cb -0.40 -3.25 0.04 0.00 0.10 0.00 0.00 34.13 30.63 3a14 s GLU 137 CO 0.50 0.06 -0.06 -1.17 0.02 0.00 0.00 175.26 174.61 3a14 s LEU 138 N -0.58 1.89 -0.16 1.80 2.96 -1.26 0.82 118.68 124.15 3a14 s LEU 138 Ca 0.49 -0.79 -0.01 0.00 -0.22 0.00 0.00 54.13 53.60 3a14 s LEU 138 Cb -0.31 -1.02 -0.01 0.00 0.50 0.00 0.00 46.19 45.35 3a14 s LEU 138 CO 0.37 -0.18 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.47 3a14 s ILE 139 N 1.55 3.06 0.37 6.68 1.01 0.10 -4.98 121.20 128.99 3a14 s ILE 139 Ca -0.01 -0.64 -0.26 0.00 0.00 0.00 0.00 60.65 59.75 3a14 s ILE 139 Cb -0.16 -2.32 -0.09 0.00 0.01 0.00 0.00 42.46 39.91 3a14 s ILE 139 CO -0.08 0.50 1.15 -2.16 0.00 0.00 0.00 174.94 174.35 3a14 s PRO 140 N 0.72 4.21 -0.17 2.79 0.04 -1.26 -1.59 135.00 139.74 3a14 s PRO 140 Ca -0.05 1.81 0.17 0.00 0.04 0.00 0.00 61.00 62.97 3a14 s PRO 140 Cb -0.15 -2.79 -0.25 0.00 0.04 0.00 0.00 34.50 31.35 3a14 s PRO 140 CO 0.02 -0.17 0.16 0.28 0.04 0.00 0.00 177.00 177.33 3a14 n VAL 141 N 0.33 1.38 -1.57 -0.36 0.31 -0.23 -4.33 118.33 113.86 3a14 n VAL 141 Ca 0.03 -0.84 -0.53 0.00 -0.01 0.00 0.00 64.34 62.99 3a14 n VAL 141 Cb 0.46 -0.52 -0.06 0.00 -0.91 0.00 0.00 33.84 32.81 3a14 n VAL 141 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3a14 n ASP 142 N -2.77 1.21 0.05 4.52 2.03 -1.26 -4.51 116.55 115.81 3a14 n ASP 142 Ca -0.30 1.13 0.03 0.00 0.52 0.00 0.00 54.79 56.17 3a14 n ASP 142 Cb 1.13 -1.13 0.39 0.00 -0.72 0.00 0.00 41.12 40.79 3a14 n ASP 142 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 3a14 h SER 143 N 4.02 0.38 -0.07 1.67 4.64 -1.96 0.12 113.55 122.35 3a14 h SER 143 Ca -0.47 -0.04 -0.02 0.00 -0.47 0.00 0.00 61.79 60.78 3a14 h SER 143 Cb 1.36 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3a14 h SER 143 CO 0.74 0.39 -0.03 -0.33 -0.87 0.00 0.00 176.83 176.73 3a14 h GLU 144 N 0.42 0.15 -0.40 4.77 3.07 -1.89 -2.01 114.58 118.68 3a14 h GLU 144 Ca 0.10 -0.06 -0.09 0.00 -0.50 0.00 0.00 59.36 58.81 3a14 h GLU 144 Cb 0.17 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.05 3a14 h GLU 144 CO -0.00 0.51 -0.11 0.45 -1.40 0.00 0.00 179.01 178.46 3a14 h HIS 145 N -0.22 0.77 -0.22 4.33 3.86 -1.76 -1.34 115.15 120.58 3a14 h HIS 145 Ca 0.02 -0.13 0.02 0.00 -1.16 0.00 0.00 60.37 59.12 3a14 h HIS 145 Cb 0.47 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.71 3a14 h HIS 145 CO 0.06 0.78 0.07 1.03 0.86 0.00 0.00 177.93 180.74 3a14 h SER 146 N 0.65 0.07 -0.21 2.45 0.87 -0.77 0.10 113.55 116.71 3a14 h SER 146 Ca 0.11 0.02 0.04 0.00 -1.23 0.00 0.00 61.79 60.74 3a14 h SER 146 Cb 0.56 0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.50 3a14 h SER 146 CO 0.03 0.07 -0.04 0.00 -0.53 0.00 0.00 176.83 176.36 3a14 h ALA 147 N 1.14 0.15 -0.58 6.23 0.00 -0.99 -2.29 119.26 122.92 3a14 h ALA 147 Ca 0.10 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 3a14 h ALA 147 Cb 0.07 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3a14 h ALA 147 CO -0.10 -0.46 0.17 0.82 0.00 0.00 0.00 179.25 179.67 3a14 h ILE 148 N 0.02 1.24 -0.97 0.00 1.08 -1.06 -2.03 117.51 115.80 3a14 h ILE 148 Ca 0.10 -0.85 0.17 0.00 -0.39 0.00 0.00 64.86 63.89 3a14 h ILE 148 Cb 0.14 0.69 -0.09 0.00 -3.07 0.00 0.00 36.82 34.49 3a14 h ILE 148 CO -0.20 0.32 0.61 0.15 -0.69 0.00 0.00 178.15 178.34 3a14 h PHE 149 N 0.83 0.97 0.00 1.37 3.57 -0.56 0.30 116.94 123.41 3a14 h PHE 149 Ca 0.19 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.71 3a14 h PHE 149 Cb 0.31 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 38.75 3a14 h PHE 149 CO 0.02 0.29 -0.02 1.96 -2.23 0.00 0.00 178.31 178.33 3a14 h GLN 150 N 0.76 0.00 0.00 1.11 4.20 -0.79 -3.31 115.11 117.08 3a14 h GLN 150 Ca 0.52 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.23 3a14 h GLN 150 Cb 0.81 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.59 3a14 h GLN 150 CO -0.29 0.02 0.00 1.33 -0.67 0.00 0.00 178.83 179.22 3a14 n VAL 151 N -3.11 0.00 -1.76 -0.54 0.24 -0.63 -5.08 118.33 107.44 3a14 n VAL 151 Ca 0.01 -0.32 -0.40 0.00 -2.04 0.00 0.00 64.34 61.59 3a14 n VAL 151 Cb 0.36 1.28 0.02 0.00 -1.47 0.00 0.00 33.84 34.03 3a14 n VAL 151 CO 0.00 0.00 0.00 0.80 -2.14 0.00 0.00 176.83 175.49 3a14 n MET 152 N -0.13 2.30 -3.89 7.34 0.00 0.95 -4.93 117.12 118.76 3a14 n MET 152 Ca 0.00 0.82 -0.09 0.00 0.00 0.00 0.00 57.70 58.43 3a14 n MET 152 Cb 0.07 -2.62 -0.07 0.00 0.00 0.00 0.00 33.22 30.59 3a14 n MET 152 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 175.97 174.14 3a14 s GLU 153 N -2.38 0.90 0.34 2.12 -1.05 -1.26 -5.05 118.70 112.32 3a14 s GLU 153 Ca 0.60 -1.02 0.05 0.00 -0.15 0.00 0.00 54.97 54.45 3a14 s GLU 153 Cb -0.46 0.34 0.70 0.00 -0.44 0.00 0.00 34.13 34.28 3a14 s GLU 153 CO 0.58 -0.29 1.91 -1.35 0.95 0.00 0.00 175.26 177.07 3a14 h PRO 154 N 2.72 0.79 -0.99 -4.83 0.11 -1.99 -3.04 132.00 124.77 3a14 h PRO 154 Ca -0.34 -0.05 -0.55 0.00 0.11 0.00 0.00 66.00 65.18 3a14 h PRO 154 Cb 1.20 -0.18 -0.30 0.00 0.11 0.00 0.00 31.00 31.83 3a14 h PRO 154 CO 0.55 0.53 0.70 0.39 -0.21 0.00 0.00 178.00 179.95 3a14 n GLU 155 N -4.51 2.34 -1.72 1.05 1.02 -1.26 -4.98 120.64 112.58 3a14 n GLU 155 Ca 0.14 -3.07 -0.40 0.00 -0.02 0.00 0.00 57.16 53.81 3a14 n GLU 155 Cb 0.30 -2.20 0.03 0.00 -0.02 0.00 0.00 31.44 29.54 3a14 n GLU 155 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 3a14 n VAL 156 N -1.10 3.10 -0.07 2.62 0.24 -1.15 -4.27 118.33 117.70 3a14 n VAL 156 Ca 0.60 -0.50 -0.19 0.00 -2.04 0.00 0.00 64.34 62.21 3a14 n VAL 156 Cb 1.45 -1.61 -0.13 0.00 -1.47 0.00 0.00 33.84 32.09 3a14 n VAL 156 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3a14 h GLU 157 N 1.77 0.05 -4.08 7.34 4.57 -0.80 -3.47 114.58 119.97 3a14 h GLU 157 Ca -0.49 -0.09 -0.25 0.00 -1.18 0.00 0.00 59.36 57.34 3a14 h GLU 157 Cb 1.30 0.03 -0.26 0.00 -0.16 0.00 0.00 28.75 29.66 3a14 h GLU 157 CO 0.58 1.04 -0.73 0.15 -1.18 0.00 0.00 179.01 178.88 3a14 s LYS 158 N -2.33 0.26 -0.24 1.92 -0.14 -0.86 -4.78 119.74 113.57 3a14 s LYS 158 Ca -0.23 -0.28 -0.10 0.00 -1.36 0.00 0.00 55.97 54.00 3a14 s LYS 158 Cb 0.02 -0.15 -0.05 0.00 -1.68 0.00 0.00 37.83 35.98 3a14 s LYS 158 CO 0.67 0.03 0.14 0.08 -0.76 0.00 0.00 175.35 175.50 3a14 s VAL 159 N -0.51 5.13 -0.25 3.17 1.01 0.64 -0.53 120.40 129.06 3a14 s VAL 159 Ca -0.04 0.10 -0.07 0.00 0.00 0.00 0.00 61.98 61.97 3a14 s VAL 159 Cb -0.04 -3.39 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 3a14 s VAL 159 CO -0.00 0.35 0.05 -0.69 0.00 0.00 0.00 175.10 174.81 3a14 s VAL 160 N 1.10 4.13 -0.12 2.92 1.01 0.91 -0.84 120.40 129.50 3a14 s VAL 160 Ca 0.07 -0.27 -0.06 0.00 0.00 0.00 0.00 61.98 61.72 3a14 s VAL 160 Cb -0.14 -2.94 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 3a14 s VAL 160 CO 0.04 0.33 0.11 -0.76 0.00 0.00 0.00 175.10 174.82 3a14 s LEU 161 N 1.58 4.17 0.15 3.92 1.43 0.20 -1.90 118.68 128.23 3a14 s LEU 161 Ca 0.06 0.36 0.04 0.00 -1.03 0.00 0.00 54.13 53.56 3a14 s LEU 161 Cb -0.15 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 44.02 3a14 s LEU 161 CO 0.02 0.37 0.17 0.42 0.23 0.00 0.00 176.35 177.57 3a14 s THR 162 N -0.79 4.76 0.00 5.49 -4.23 -1.26 -0.80 115.64 118.80 3a14 s THR 162 Ca 0.13 -0.91 0.00 0.00 -1.18 0.00 0.00 61.69 59.73 3a14 s THR 162 Cb -0.12 -3.42 -0.00 0.00 1.34 0.00 0.00 72.50 70.30 3a14 s THR 162 CO 0.03 -0.07 -0.02 0.00 -0.54 0.00 0.00 174.62 174.02 3a14 s ALA 163 N -1.70 0.14 0.39 3.99 0.00 0.18 -4.90 121.76 119.85 3a14 s ALA 163 Ca 0.32 -0.13 0.25 0.00 0.00 0.00 0.00 51.96 52.40 3a14 s ALA 163 Cb -0.11 -0.01 1.32 0.00 0.00 0.00 0.00 23.12 24.32 3a14 s ALA 163 CO 0.25 0.01 2.03 0.66 0.00 0.00 0.00 175.76 178.71 3a14 h SER 164 N 5.94 0.00 0.00 0.00 4.64 -1.88 0.35 113.55 122.61 3a14 h SER 164 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 3a14 h SER 164 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3a14 h SER 164 CO 0.50 0.15 0.00 0.61 -0.87 0.00 0.00 176.83 177.22 3a14 n GLY 165 N -0.62 2.27 1.37 -0.77 0.00 -1.26 -4.65 105.19 101.53 3a14 n GLY 165 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.06 3a14 n GLY 165 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a14 n GLY 166 N -2.00 -2.09 0.29 -0.02 0.00 -1.23 -3.85 105.19 96.29 3a14 n GLY 166 Ca 0.00 -1.40 0.13 0.00 0.00 0.00 0.00 46.02 44.75 3a14 n GLY 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a14 h ALA 167 N -0.42 1.83 -0.47 4.61 0.00 -1.85 -1.56 119.26 121.39 3a14 h ALA 167 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3a14 h ALA 167 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3a14 h ALA 167 CO 0.00 -0.09 0.00 1.28 0.00 0.00 0.00 179.25 180.44 3a14 n LEU 168 N -4.16 4.67 0.04 0.00 4.77 -1.26 -4.65 117.00 116.41 3a14 n LEU 168 Ca -0.01 -2.76 0.10 0.00 -0.03 0.00 0.00 56.01 53.31 3a14 n LEU 168 Cb 0.16 -0.58 0.54 0.00 -2.33 0.00 0.00 43.42 41.22 3a14 n LEU 168 CO 0.31 0.70 1.15 0.08 -1.33 0.00 0.00 177.39 178.30 3a14 h ARG 169 N 3.14 0.28 -0.41 3.23 0.11 -1.38 -1.26 114.38 118.09 3a14 h ARG 169 Ca 0.00 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.06 3a14 h ARG 169 Cb 1.57 -0.06 0.00 0.00 1.11 0.00 0.00 29.97 32.59 3a14 h ARG 169 CO 0.30 0.18 0.00 -0.25 0.10 0.00 0.00 179.97 180.30 3a14 n ASP 170 N -4.48 3.04 -4.83 0.08 8.00 -1.26 -4.96 116.55 112.15 3a14 n ASP 170 Ca 0.05 -1.94 -0.34 0.00 0.71 0.00 0.00 54.79 53.27 3a14 n ASP 170 Cb 0.26 -0.26 -0.06 0.00 -0.02 0.00 0.00 41.12 41.03 3a14 n ASP 170 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 3a14 s TRP 171 N -1.47 3.47 0.46 1.24 0.52 -0.48 -5.05 118.94 117.64 3a14 s TRP 171 Ca 0.38 1.41 -0.24 0.00 0.02 0.00 0.00 56.10 57.67 3a14 s TRP 171 Cb 0.21 -2.67 -0.07 0.00 -1.15 0.00 0.00 33.47 29.79 3a14 s TRP 171 CO 0.29 0.13 1.28 0.15 0.02 0.00 0.00 176.95 178.83 3a14 s LYS 172 N -2.64 3.65 0.44 4.98 1.02 -1.26 -4.93 119.74 121.01 3a14 s LYS 172 Ca 0.52 2.08 0.13 0.00 0.02 0.00 0.00 55.97 58.72 3a14 s LYS 172 Cb -0.13 -2.50 1.04 0.00 -0.52 0.00 0.00 37.83 35.73 3a14 s LYS 172 CO 0.18 -0.73 2.02 0.82 -0.92 0.00 0.00 175.35 176.72 3a14 h ILE 173 N 1.98 0.94 -0.14 2.17 5.03 -1.96 -1.89 117.51 123.64 3a14 h ILE 173 Ca -0.50 -0.13 -0.16 0.00 -0.12 0.00 0.00 64.86 63.96 3a14 h ILE 173 Cb 1.26 0.54 -0.01 0.00 -3.03 0.00 0.00 36.82 35.58 3a14 h ILE 173 CO 0.60 0.07 -0.58 0.77 -0.68 0.00 0.00 178.15 178.33 3a14 h SER 174 N 0.37 0.50 0.90 1.72 4.64 -1.98 -3.03 113.55 116.66 3a14 h SER 174 Ca 0.22 -0.28 -0.09 0.00 -0.47 0.00 0.00 61.79 61.17 3a14 h SER 174 Cb 0.39 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.32 3a14 h SER 174 CO -0.05 0.97 -0.42 0.11 -0.87 0.00 0.00 176.83 176.56 3a14 h LYS 175 N 0.34 0.00 -0.42 4.77 1.57 -1.74 -3.32 116.57 117.77 3a14 h LYS 175 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 3a14 h LYS 175 Cb 1.11 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.40 3a14 h LYS 175 CO 0.10 0.42 0.15 0.82 -0.57 0.00 0.00 179.45 180.38 3a14 h ILE 176 N 0.00 1.21 -0.81 1.86 2.04 -1.35 -2.98 117.51 117.48 3a14 h ILE 176 Ca -0.00 -0.66 0.13 0.00 1.00 0.00 0.00 64.86 65.33 3a14 h ILE 176 Cb 0.99 0.85 -0.06 0.00 -0.74 0.00 0.00 36.82 37.85 3a14 h ILE 176 CO 0.06 0.24 0.53 -0.78 0.00 0.00 0.00 178.15 178.19 3a14 h ASP 177 N 0.54 0.55 -0.38 1.72 3.58 -1.66 -2.06 116.42 118.71 3a14 h ASP 177 Ca 0.14 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.62 3a14 h ASP 177 Cb 0.22 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.18 3a14 h ASP 177 CO -0.01 0.29 0.00 0.54 -2.88 0.00 0.00 179.24 177.19 3a14 n ARG 178 N -4.52 2.28 -1.28 0.28 1.74 -1.13 -1.23 116.66 112.80 3a14 n ARG 178 Ca 0.15 -1.95 -0.34 0.00 -0.77 0.00 0.00 57.85 54.94 3a14 n ARG 178 Cb 0.45 -1.47 0.11 0.00 -1.02 0.00 0.00 32.46 30.53 3a14 n ARG 178 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3a14 s ALA 179 N -1.51 1.98 0.34 7.54 0.00 -0.77 -4.71 121.76 124.63 3a14 s ALA 179 Ca 0.37 0.87 0.09 0.00 0.00 0.00 0.00 51.96 53.29 3a14 s ALA 179 Cb 0.21 -3.48 -0.06 0.00 0.00 0.00 0.00 23.12 19.79 3a14 s ALA 179 CO 0.29 -2.08 -0.00 1.03 0.00 0.00 0.00 175.76 175.00 3a14 s ARG 180 N -4.02 2.04 0.33 0.00 3.00 -1.26 -1.62 118.95 117.42 3a14 s ARG 180 Ca 0.74 -1.78 0.09 0.00 0.00 0.00 0.00 55.73 54.78 3a14 s ARG 180 Cb -0.29 -1.90 0.85 0.00 0.00 0.00 0.00 34.95 33.61 3a14 s ARG 180 CO 0.48 0.13 1.77 -1.35 0.00 0.00 0.00 175.30 176.33 3a14 h PRO 181 N 1.84 0.63 0.00 3.54 0.11 -1.94 -0.92 132.00 135.25 3a14 h PRO 181 Ca -0.43 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 3a14 h PRO 181 Cb 1.25 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 3a14 h PRO 181 CO 0.67 0.42 -0.11 0.93 -0.21 0.00 0.00 178.00 179.70 3a14 h GLU 182 N 0.65 0.00 -0.14 1.05 3.07 -1.96 0.21 114.58 117.46 3a14 h GLU 182 Ca 0.59 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 59.29 3a14 h GLU 182 Cb 1.08 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.98 3a14 h GLU 182 CO -0.38 0.11 -0.61 -0.44 -1.40 0.00 0.00 179.01 176.30 3a14 h ASP 183 N 0.00 0.53 0.18 1.42 3.32 -1.53 -2.75 116.42 117.60 3a14 h ASP 183 Ca -0.00 -0.30 -0.34 0.00 0.02 0.00 0.00 57.03 56.40 3a14 h ASP 183 Cb 0.21 -0.15 0.01 0.00 0.22 0.00 0.00 39.33 39.61 3a14 h ASP 183 CO 0.01 1.01 -1.70 0.58 -1.72 0.00 0.00 179.24 177.42 3a14 h VAL 184 N 0.35 0.95 -0.01 -1.35 2.07 -1.11 -3.38 116.25 113.77 3a14 h VAL 184 Ca -0.01 -2.49 0.00 0.00 0.82 0.00 0.00 66.70 65.02 3a14 h VAL 184 Cb 1.15 2.76 0.00 0.00 -1.52 0.00 0.00 31.29 33.68 3a14 h VAL 184 CO 0.11 0.84 -0.15 0.18 0.02 0.00 0.00 177.57 178.56 3a14 n LEU 185 N -3.64 0.83 -2.90 2.57 4.77 0.63 -4.74 117.00 114.51 3a14 n LEU 185 Ca -0.25 -0.17 -0.10 0.00 -0.03 0.00 0.00 56.01 55.46 3a14 n LEU 185 Cb 1.05 -0.13 -0.01 0.00 -2.33 0.00 0.00 43.42 42.00 3a14 n LEU 185 CO 0.50 0.15 0.02 1.17 -1.33 0.00 0.00 177.39 177.90 3a14 n LYS 186 N -0.68 0.49 0.00 3.23 4.81 -1.03 -5.04 118.16 119.94 3a14 n LYS 186 Ca 0.14 -2.28 0.00 0.00 -0.87 0.00 0.00 58.31 55.30 3a14 n LYS 186 Cb 0.31 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.86 3a14 n LYS 186 CO 0.00 0.00 0.00 -0.12 1.17 0.00 0.00 177.40 178.45 3a14 n MET 192 N 2.74 0.00 0.00 1.64 0.00 -1.26 -4.93 117.12 115.32 3a14 n MET 192 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.90 3a14 n MET 192 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.77 3a14 n MET 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3a14 n GLY 193 N 0.00 2.77 0.12 -5.12 0.00 -1.26 -4.78 105.19 96.92 3a14 n GLY 193 Ca 0.00 -1.83 -0.13 0.00 0.00 0.00 0.00 46.02 44.05 3a14 n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a14 h ALA 194 N 0.00 -0.22 -0.35 4.61 0.00 -2.02 -1.68 119.26 119.61 3a14 h ALA 194 Ca 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 3a14 h ALA 194 Cb 0.00 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3a14 h ALA 194 CO 0.00 -0.56 0.21 -0.09 0.00 0.00 0.00 179.25 178.81 3a14 h ARG 195 N -0.33 0.48 -0.63 0.00 2.43 -1.97 -2.21 114.38 112.14 3a14 h ARG 195 Ca -0.02 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.05 3a14 h ARG 195 Cb 0.26 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.68 3a14 h ARG 195 CO 0.04 0.35 0.17 0.82 -1.51 0.00 0.00 179.97 179.85 3a14 h ILE 196 N 0.46 1.24 -0.47 1.20 5.03 -1.84 -0.24 117.51 122.88 3a14 h ILE 196 Ca 0.13 -0.86 -0.03 0.00 -0.12 0.00 0.00 64.86 63.97 3a14 h ILE 196 Cb -0.00 0.57 -0.02 0.00 -3.03 0.00 0.00 36.82 34.34 3a14 h ILE 196 CO -0.02 0.33 0.16 0.74 -0.68 0.00 0.00 178.15 178.67 3a14 h THR 197 N 0.94 1.22 -0.02 -0.27 2.02 -1.11 -0.40 112.91 115.28 3a14 h THR 197 Ca 0.20 -0.72 -0.00 0.00 0.77 0.00 0.00 66.41 66.66 3a14 h THR 197 Cb 0.30 0.80 -0.00 0.00 -1.74 0.00 0.00 68.15 67.52 3a14 h THR 197 CO -0.00 0.26 0.01 0.58 0.37 0.00 0.00 175.52 176.74 3a14 h VAL 198 N 0.63 1.17 -0.63 3.16 2.07 -0.85 -2.26 116.25 119.55 3a14 h VAL 198 Ca 0.15 -0.52 0.12 0.00 0.82 0.00 0.00 66.70 67.27 3a14 h VAL 198 Cb 0.25 1.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.46 3a14 h VAL 198 CO -0.01 0.14 0.42 0.44 0.02 0.00 0.00 177.57 178.58 3a14 h ASP 199 N -0.17 0.34 0.62 0.57 3.32 -1.00 0.31 116.42 120.40 3a14 h ASP 199 Ca 0.01 0.01 -0.10 0.00 0.02 0.00 0.00 57.03 56.97 3a14 h ASP 199 Cb 0.22 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 3a14 h ASP 199 CO -0.00 0.19 -0.47 0.28 -1.72 0.00 0.00 179.24 177.52 3a14 h SER 200 N 0.37 0.00 0.41 6.45 0.02 -0.83 -0.70 113.55 119.26 3a14 h SER 200 Ca 0.30 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 61.02 3a14 h SER 200 Cb 0.67 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.21 3a14 h SER 200 CO -0.08 0.47 -0.96 0.00 -1.14 0.00 0.00 176.83 175.12 3a14 h ALA 201 N 1.53 0.37 0.00 3.77 0.00 0.16 -3.14 119.26 121.95 3a14 h ALA 201 Ca -0.00 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.18 3a14 h ALA 201 Cb 0.91 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.67 3a14 h ALA 201 CO 0.06 0.85 -0.47 0.25 0.00 0.00 0.00 179.25 179.94 3a14 n THR 202 N -3.71 0.12 -1.37 0.00 -2.24 -0.48 -4.82 114.28 101.77 3a14 n THR 202 Ca -0.06 -0.09 -0.13 0.00 -2.27 0.00 0.00 64.05 61.50 3a14 n THR 202 Cb 0.85 0.03 -0.05 0.00 -2.10 0.00 0.00 70.33 69.05 3a14 n THR 202 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 3a14 n MET 203 N -1.70 -1.39 0.18 -0.78 2.81 -0.37 -4.02 117.12 111.84 3a14 n MET 203 Ca 0.05 0.93 0.03 0.00 -1.81 0.00 0.00 57.70 56.90 3a14 n MET 203 Cb 0.37 -5.20 0.42 0.00 -0.71 0.00 0.00 33.22 28.10 3a14 n MET 203 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3a14 h VAL 204 N 0.00 1.19 -0.75 2.03 2.07 -1.61 -1.87 116.25 117.31 3a14 h VAL 204 Ca -0.26 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.38 3a14 h VAL 204 Cb 1.08 1.40 -0.04 0.00 -1.52 0.00 0.00 31.29 32.22 3a14 h VAL 204 CO 0.38 0.25 0.43 -1.13 0.02 0.00 0.00 177.57 177.53 3a14 h ASN 205 N 0.08 0.91 -0.38 0.57 -0.73 -1.67 -0.92 115.58 113.44 3a14 h ASN 205 Ca 0.01 -0.08 -0.06 0.00 1.87 0.00 0.00 56.30 58.04 3a14 h ASN 205 Cb 0.44 -0.23 -0.02 0.00 0.27 0.00 0.00 38.32 38.78 3a14 h ASN 205 CO 0.03 0.73 0.03 0.11 -0.37 0.00 0.00 177.43 177.96 3a14 h LYS 206 N 1.03 0.75 -0.51 6.67 1.79 -1.72 -0.49 116.57 124.09 3a14 h LYS 206 Ca 0.27 -0.18 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 3a14 h LYS 206 Cb -0.00 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 30.53 3a14 h LYS 206 CO -0.05 0.74 0.33 0.00 -1.08 0.00 0.00 179.45 179.39 3a14 h ALA 207 N 1.32 0.65 -0.32 3.86 0.00 -0.73 -0.73 119.26 123.30 3a14 h ALA 207 Ca 0.14 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.04 3a14 h ALA 207 Cb 0.39 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3a14 h ALA 207 CO 0.01 0.10 0.13 0.74 0.00 0.00 0.00 179.25 180.24 3a14 h PHE 208 N 0.69 0.23 -0.33 0.00 0.04 -0.84 -2.47 116.94 114.26 3a14 h PHE 208 Ca 0.19 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.96 3a14 h PHE 208 Cb -0.06 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.02 3a14 h PHE 208 CO -0.04 0.11 0.16 0.93 -0.60 0.00 0.00 178.31 178.87 3a14 h GLU 209 N 0.28 0.45 0.08 1.51 5.08 -0.80 -0.52 114.58 120.66 3a14 h GLU 209 Ca 0.14 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3a14 h GLU 209 Cb 0.10 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3a14 h GLU 209 CO -0.13 0.36 -0.04 0.28 -1.00 0.00 0.00 179.01 178.48 3a14 h VAL 210 N 0.46 1.10 -0.68 3.13 2.07 -0.80 -0.88 116.25 120.65 3a14 h VAL 210 Ca 0.12 -0.65 0.06 0.00 0.82 0.00 0.00 66.70 67.04 3a14 h VAL 210 Cb 0.05 1.52 -0.06 0.00 -1.52 0.00 0.00 31.29 31.29 3a14 h VAL 210 CO -0.02 0.16 0.38 -0.07 0.02 0.00 0.00 177.57 178.04 3a14 h LEU 211 N -0.40 0.56 -0.90 2.57 3.38 -1.25 -1.66 115.31 117.61 3a14 h LEU 211 Ca -0.01 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 3a14 h LEU 211 Cb 0.35 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.98 3a14 h LEU 211 CO 0.02 0.36 0.37 -0.33 0.09 0.00 0.00 178.44 178.95 3a14 h GLU 212 N 0.70 1.17 -0.56 1.13 5.08 -1.03 -2.59 114.58 118.47 3a14 h GLU 212 Ca 0.31 -0.18 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 3a14 h GLU 212 Cb 0.19 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 3a14 h GLU 212 CO -0.19 0.91 0.18 0.00 -1.00 0.00 0.00 179.01 178.91 3a14 h ALA 213 N 1.25 0.73 -0.80 3.43 0.00 -0.71 0.12 119.26 123.28 3a14 h ALA 213 Ca 0.28 -0.19 0.09 0.00 0.00 0.00 0.00 54.91 55.08 3a14 h ALA 213 Cb 0.14 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 17.64 3a14 h ALA 213 CO -0.03 0.39 0.46 0.52 0.00 0.00 0.00 179.25 180.58 3a14 h MET 214 N 0.78 0.76 0.22 0.00 2.86 -1.19 -0.45 114.93 117.90 3a14 h MET 214 Ca 0.18 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 3a14 h MET 214 Cb 0.27 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 31.76 3a14 h MET 214 CO -0.01 0.50 -0.11 0.93 1.06 0.00 0.00 176.91 179.29 3a14 h GLU 215 N 0.79 -0.28 -0.84 1.72 4.39 -1.06 -1.64 114.58 117.65 3a14 h GLU 215 Ca 0.38 0.02 -0.00 0.00 0.34 0.00 0.00 59.36 60.09 3a14 h GLU 215 Cb 0.32 0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 28.99 3a14 h GLU 215 CO -0.23 0.09 0.51 -0.07 -1.16 0.00 0.00 179.01 178.15 3a14 h LEU 216 N -0.79 1.01 -2.37 1.33 3.38 -0.69 -3.24 115.31 113.93 3a14 h LEU 216 Ca -0.03 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3a14 h LEU 216 Cb 0.51 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.01 3a14 h LEU 216 CO 0.05 0.77 0.00 0.49 0.09 0.00 0.00 178.44 179.84 3a14 n PHE 217 N -4.44 0.22 -3.79 1.13 3.72 -0.19 -5.01 117.46 109.11 3a14 n PHE 217 Ca 0.09 -0.33 -0.26 0.00 -0.05 0.00 0.00 57.45 56.90 3a14 n PHE 217 Cb 0.06 -0.02 0.01 0.00 -0.94 0.00 0.00 39.48 38.59 3a14 n PHE 217 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3a14 n GLU 218 N 0.32 -3.20 -4.24 -1.08 1.02 -0.66 -4.98 120.64 107.81 3a14 n GLU 218 Ca 0.07 0.49 -0.35 0.00 -0.02 0.00 0.00 57.16 57.35 3a14 n GLU 218 Cb 0.32 -4.64 -0.09 0.00 -0.02 0.00 0.00 31.44 27.01 3a14 n GLU 218 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3a14 s LEU 219 N -6.72 3.68 0.58 -4.62 1.43 -0.98 -5.05 118.68 107.00 3a14 s LEU 219 Ca 0.14 0.13 -0.20 0.00 -1.03 0.00 0.00 54.13 53.17 3a14 s LEU 219 Cb -0.05 -1.87 -0.04 0.00 0.03 0.00 0.00 46.19 44.26 3a14 s LEU 219 CO 0.86 0.31 1.27 -2.16 0.23 0.00 0.00 176.35 176.86 3a14 s PRO 220 N -0.47 3.01 0.29 1.29 0.04 -1.26 -4.55 135.00 133.36 3a14 s PRO 220 Ca 0.09 2.01 0.05 0.00 0.04 0.00 0.00 61.00 63.19 3a14 s PRO 220 Cb -0.12 -2.07 0.75 0.00 0.04 0.00 0.00 34.50 33.10 3a14 s PRO 220 CO 0.02 -1.23 1.71 0.35 0.04 0.00 0.00 177.00 177.90 3a14 h PHE 221 N 1.12 0.76 0.00 0.56 3.57 -1.97 -0.96 116.94 120.03 3a14 h PHE 221 Ca -0.51 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.03 3a14 h PHE 221 Cb 1.30 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.85 3a14 h PHE 221 CO 0.46 0.01 0.00 0.93 -2.23 0.00 0.00 178.31 177.48 3a14 h GLU 222 N 0.48 0.00 -0.00 1.11 3.07 -2.02 -1.36 114.58 115.85 3a14 h GLU 222 Ca 0.57 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.43 3a14 h GLU 222 Cb 1.05 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.96 3a14 h GLU 222 CO -0.49 0.00 -0.12 1.63 -1.40 0.00 0.00 179.01 178.62 3a14 n LYS 223 N -3.02 0.73 -3.75 2.33 4.76 -0.36 -4.84 118.16 114.01 3a14 n LYS 223 Ca -0.02 -0.28 -0.36 0.00 -2.87 0.00 0.00 58.31 54.77 3a14 n LYS 223 Cb 0.09 -1.49 -0.07 0.00 -1.84 0.00 0.00 35.03 31.72 3a14 n LYS 223 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3a14 s ILE 224 N -2.46 5.41 0.03 -0.18 -1.09 -0.52 -0.26 121.20 122.13 3a14 s ILE 224 Ca 0.29 0.29 0.07 0.00 -2.23 0.00 0.00 60.65 59.07 3a14 s ILE 224 Cb 0.20 -3.48 -0.02 0.00 -1.58 0.00 0.00 42.46 37.58 3a14 s ILE 224 CO 0.48 0.52 -0.22 -1.61 -1.23 0.00 0.00 174.94 172.88 3a14 s GLU 225 N -0.29 1.52 -0.13 2.79 2.02 -0.02 -4.93 118.70 119.67 3a14 s GLU 225 Ca 0.13 -0.92 0.00 0.00 0.02 0.00 0.00 54.97 54.20 3a14 s GLU 225 Cb -0.12 -1.60 -0.01 0.00 0.10 0.00 0.00 34.13 32.49 3a14 s GLU 225 CO 0.02 0.42 -0.14 0.08 0.02 0.00 0.00 175.26 175.66 3a14 s VAL 226 N -0.73 2.99 -0.06 2.63 1.01 -1.26 -0.62 120.40 124.36 3a14 s VAL 226 Ca 0.08 -0.69 0.06 0.00 0.00 0.00 0.00 61.98 61.43 3a14 s VAL 226 Cb -0.09 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 3a14 s VAL 226 CO 0.01 0.53 -0.23 -0.54 0.00 0.00 0.00 175.10 174.87 3a14 s LYS 227 N 0.33 2.58 0.05 2.72 -0.14 0.02 -4.49 119.74 120.80 3a14 s LYS 227 Ca -0.11 -0.87 -0.31 0.00 -1.36 0.00 0.00 55.97 53.32 3a14 s LYS 227 Cb -0.16 -2.21 -0.06 0.00 -1.68 0.00 0.00 37.83 33.73 3a14 s LYS 227 CO 0.06 0.40 1.23 0.42 -0.76 0.00 0.00 175.35 176.70 3a14 s ILE 228 N -0.21 3.97 -0.39 2.17 1.01 0.85 -0.65 121.20 127.96 3a14 s ILE 228 Ca -0.02 1.40 0.01 0.00 0.00 0.00 0.00 60.65 62.04 3a14 s ILE 228 Cb -0.13 -3.90 0.13 0.00 0.01 0.00 0.00 42.46 38.57 3a14 s ILE 228 CO 0.03 0.09 0.20 -2.28 0.00 0.00 0.00 174.94 172.98 3a14 s HIS 229 N 1.29 1.64 0.30 3.97 5.65 0.12 -1.43 115.29 126.83 3a14 s HIS 229 Ca 0.59 -2.08 0.03 0.00 0.25 0.00 0.00 55.06 53.85 3a14 s HIS 229 Cb -0.30 -1.64 0.60 0.00 -1.18 0.00 0.00 32.58 30.06 3a14 s HIS 229 CO 0.28 -0.82 1.86 -0.09 -0.65 0.00 0.00 174.74 175.33 3a14 h ARG 230 N 7.13 0.92 0.00 2.88 2.43 -1.80 -2.12 114.38 123.82 3a14 h ARG 230 Ca -0.03 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 3a14 h ARG 230 Cb 0.96 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 30.30 3a14 h ARG 230 CO 0.43 0.61 -0.10 0.93 -1.51 0.00 0.00 179.97 180.34 3a14 h GLU 231 N 0.95 0.00 -1.43 0.20 3.07 -1.88 -3.47 114.58 112.01 3a14 h GLU 231 Ca 0.46 0.00 -0.37 0.00 -0.50 0.00 0.00 59.36 58.95 3a14 h GLU 231 Cb 0.45 0.00 -0.10 0.00 -0.84 0.00 0.00 28.75 28.26 3a14 h GLU 231 CO -0.22 0.10 -0.38 0.41 -1.40 0.00 0.00 179.01 177.52 3a14 n GLY 232 N 0.29 1.06 0.10 -3.84 0.00 -0.80 -4.91 105.19 97.10 3a14 n GLY 232 Ca 0.01 -0.14 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 3a14 n GLY 232 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3a14 h LEU 233 N 0.00 0.06 -9.21 0.99 3.38 -1.85 -3.44 115.31 105.25 3a14 h LEU 233 Ca -0.39 -0.67 -0.56 0.00 0.09 0.00 0.00 57.88 56.34 3a14 h LEU 233 Cb 1.23 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.91 3a14 h LEU 233 CO 0.53 1.42 0.71 -0.69 0.09 0.00 0.00 178.44 180.50 3a14 s VAL 234 N -2.35 4.57 -1.09 1.22 1.01 -1.26 -2.58 120.40 119.92 3a14 s VAL 234 Ca -0.25 1.87 0.21 0.00 0.00 0.00 0.00 61.98 63.81 3a14 s VAL 234 Cb 0.04 -4.21 -0.21 0.00 0.00 0.00 0.00 36.38 32.01 3a14 s VAL 234 CO 0.64 -0.07 0.91 1.41 0.00 0.00 0.00 175.10 177.99 3a14 n HIS 235 N 5.63 0.00 0.00 5.22 8.25 -0.26 -4.73 115.22 129.33 3a14 n HIS 235 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 3a14 n HIS 235 Cb 0.47 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.58 3a14 n HIS 235 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3a14 n GLY 236 N 1.49 1.28 3.26 -1.41 0.00 -1.24 -4.18 105.19 104.39 3a14 n GLY 236 Ca 0.04 -0.47 -0.12 0.00 0.00 0.00 0.00 46.02 45.47 3a14 n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a14 s ALA 237 N -2.00 -0.76 -0.06 4.61 0.00 -0.80 -1.20 121.76 121.56 3a14 s ALA 237 Ca 0.00 0.11 0.04 0.00 0.00 0.00 0.00 51.96 52.11 3a14 s ALA 237 Cb 0.00 0.28 0.00 0.00 0.00 0.00 0.00 23.12 23.41 3a14 s ALA 237 CO 0.00 -0.40 -0.16 0.14 0.00 0.00 0.00 175.76 175.34 3a14 s VAL 238 N -2.34 1.40 -0.20 0.00 -7.23 0.07 -0.06 120.40 112.02 3a14 s VAL 238 Ca -0.06 -0.67 -0.12 0.00 -1.81 0.00 0.00 61.98 59.31 3a14 s VAL 238 Cb -0.01 -1.22 -0.05 0.00 0.56 0.00 0.00 36.38 35.65 3a14 s VAL 238 CO -0.02 0.41 0.23 -0.69 -0.31 0.00 0.00 175.10 174.71 3a14 s VAL 239 N 0.27 5.33 0.15 1.32 1.01 0.32 -1.04 120.40 127.76 3a14 s VAL 239 Ca -0.09 0.36 0.03 0.00 0.00 0.00 0.00 61.98 62.28 3a14 s VAL 239 Cb -0.14 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 3a14 s VAL 239 CO 0.03 0.36 0.26 -0.76 0.00 0.00 0.00 175.10 175.00 3a14 s LEU 240 N 0.79 4.26 0.16 3.92 2.01 -0.57 -0.10 118.68 129.15 3a14 s LEU 240 Ca 0.12 0.13 0.14 0.00 0.01 0.00 0.00 54.13 54.53 3a14 s LEU 240 Cb -0.13 -2.84 0.69 0.00 0.01 0.00 0.00 46.19 43.92 3a14 s LEU 240 CO 0.03 0.05 1.44 -2.65 1.01 0.00 0.00 176.35 176.24 3a14 n PRO 241 N -0.52 0.09 0.02 1.29 -0.02 -1.26 -3.05 135.00 131.54 3a14 n PRO 241 Ca -0.07 0.49 0.11 0.00 -2.02 0.00 0.00 63.50 62.01 3a14 n PRO 241 Cb 0.54 -1.73 0.03 0.00 -0.02 0.00 0.00 33.50 32.33 3a14 n PRO 241 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3a14 n ASP 242 N -1.90 0.64 0.00 2.55 5.75 -1.26 -4.95 116.55 117.38 3a14 n ASP 242 Ca 0.01 -0.34 0.00 0.00 -0.01 0.00 0.00 54.79 54.45 3a14 n ASP 242 Cb 0.09 0.76 0.00 0.00 -1.03 0.00 0.00 41.12 40.94 3a14 n ASP 242 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3a14 n GLY 243 N 1.41 1.86 3.79 6.12 0.00 -1.17 -5.10 105.19 112.10 3a14 n GLY 243 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 3a14 n GLY 243 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a14 s ASN 244 N -1.90 6.41 -0.04 1.61 -0.87 -1.26 -4.90 114.94 113.99 3a14 s ASN 244 Ca 0.00 1.95 0.01 0.00 -1.57 0.00 0.00 52.86 53.25 3a14 s ASN 244 Cb 0.00 -2.56 0.02 0.00 -0.02 0.00 0.00 41.25 38.69 3a14 s ASN 244 CO 0.00 -0.74 -0.02 -0.69 -2.57 0.00 0.00 177.10 173.09 3a14 s VAL 245 N -1.92 0.32 -0.23 1.60 1.01 -1.26 -1.51 120.40 118.40 3a14 s VAL 245 Ca 0.66 0.01 -0.08 0.00 0.00 0.00 0.00 61.98 62.56 3a14 s VAL 245 Cb -0.17 -0.39 -0.04 0.00 0.00 0.00 0.00 36.38 35.78 3a14 s VAL 245 CO 0.21 0.18 0.09 -0.54 0.00 0.00 0.00 175.10 175.03 3a14 s LYS 246 N 0.99 3.82 0.02 2.72 1.02 -0.21 -4.96 119.74 123.14 3a14 s LYS 246 Ca -0.10 -0.40 0.09 0.00 0.02 0.00 0.00 55.97 55.57 3a14 s LYS 246 Cb -0.14 -3.33 -0.03 0.00 -0.52 0.00 0.00 37.83 33.81 3a14 s LYS 246 CO -0.01 -0.01 -0.26 -1.64 -0.92 0.00 0.00 175.35 172.51 3a14 s MET 247 N 1.16 1.93 -0.21 1.68 -1.94 -1.26 -0.76 119.30 119.91 3a14 s MET 247 Ca 0.05 -1.04 -0.03 0.00 -1.71 0.00 0.00 55.69 52.96 3a14 s MET 247 Cb -0.14 -2.02 -0.01 0.00 2.01 0.00 0.00 34.83 34.67 3a14 s MET 247 CO 0.04 0.53 -0.05 0.08 -0.01 0.00 0.00 175.02 175.61 3a14 s VAL 248 N -0.74 3.36 -0.03 -6.03 1.01 -0.34 -5.01 120.40 112.61 3a14 s VAL 248 Ca 0.11 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.63 3a14 s VAL 248 Cb -0.10 -2.51 -0.03 0.00 0.00 0.00 0.00 36.38 33.74 3a14 s VAL 248 CO 0.01 0.44 -0.15 -0.69 0.00 0.00 0.00 175.10 174.71 3a14 s VAL 249 N 1.28 3.02 0.15 2.92 1.01 -1.26 -1.10 120.40 126.42 3a14 s VAL 249 Ca 0.03 -0.80 -0.24 0.00 0.00 0.00 0.00 61.98 60.97 3a14 s VAL 249 Cb -0.14 -2.20 0.06 0.00 0.00 0.00 0.00 36.38 34.10 3a14 s VAL 249 CO -0.02 0.55 0.79 -0.94 0.00 0.00 0.00 175.10 175.48 3a14 s SER 250 N -0.86 -0.34 0.85 3.32 1.04 -1.07 -4.98 113.70 111.67 3a14 s SER 250 Ca 0.12 -0.27 -0.13 0.00 0.48 0.00 0.00 55.95 56.16 3a14 s SER 250 Cb -0.11 0.56 0.08 0.00 0.10 0.00 0.00 66.02 66.65 3a14 s SER 250 CO 0.01 -0.97 0.98 -2.65 0.98 0.00 0.00 173.24 171.60 3a14 n PRO 251 N -0.40 -0.06 -2.07 4.02 -0.02 -1.26 -4.74 135.00 130.48 3a14 n PRO 251 Ca -0.09 0.05 -0.42 0.00 -2.02 0.00 0.00 63.50 61.02 3a14 n PRO 251 Cb 0.62 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 3a14 n PRO 251 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3a14 n PRO 252 N -3.01 3.15 -3.80 0.52 -0.04 -1.26 -4.87 135.00 125.70 3a14 n PRO 252 Ca 0.12 -3.02 -0.24 0.00 -0.04 0.00 0.00 63.50 60.32 3a14 n PRO 252 Cb 0.51 -3.18 -0.17 0.00 -0.04 0.00 0.00 33.50 30.61 3a14 n PRO 252 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3a14 s ASP 253 N 2.56 1.75 0.57 3.54 2.15 -1.26 -5.02 116.67 120.95 3a14 s ASP 253 Ca 0.45 -0.15 0.35 0.00 0.43 0.00 0.00 52.55 53.63 3a14 s ASP 253 Cb 0.11 -0.52 1.61 0.00 -0.30 0.00 0.00 42.92 43.82 3a14 s ASP 253 CO -0.04 -0.18 2.08 0.24 -0.17 0.00 0.00 175.17 177.10 3a14 h MET 254 N 8.30 0.00 -0.17 4.34 2.86 -1.99 -2.50 114.93 125.76 3a14 h MET 254 Ca -0.21 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.48 3a14 h MET 254 Cb 1.13 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.78 3a14 h MET 254 CO 0.29 0.03 0.14 0.00 1.06 0.00 0.00 176.91 178.43 3a14 h ARG 255 N 0.00 0.00 0.57 1.72 3.08 -1.95 -2.44 114.38 115.35 3a14 h ARG 255 Ca -0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 3a14 h ARG 255 Cb 0.38 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.44 3a14 h ARG 255 CO 0.00 0.00 -0.27 0.82 -1.07 0.00 0.00 179.97 179.45 3a14 h ILE 256 N 0.00 0.00 0.00 2.04 5.03 -1.85 -0.14 117.51 122.60 3a14 h ILE 256 Ca 0.08 -0.04 -0.04 0.00 -0.12 0.00 0.00 64.86 64.75 3a14 h ILE 256 Cb 0.36 0.00 -0.01 0.00 -3.03 0.00 0.00 36.82 34.15 3a14 h ILE 256 CO -0.00 0.00 -0.18 1.55 -0.68 0.00 0.00 178.15 178.84 3a14 h PRO 257 N -0.80 0.00 0.08 2.37 0.13 -1.74 -0.78 132.00 131.26 3a14 h PRO 257 Ca -0.08 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.05 3a14 h PRO 257 Cb 0.58 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.71 3a14 h PRO 257 CO 0.13 0.18 -0.04 0.82 -0.23 0.00 0.00 178.00 178.86 3a14 h ILE 258 N 0.00 1.02 -0.49 -3.56 2.04 -1.44 -2.27 117.51 112.81 3a14 h ILE 258 Ca -0.00 -0.34 0.04 0.00 1.00 0.00 0.00 64.86 65.56 3a14 h ILE 258 Cb 0.46 1.24 -0.04 0.00 -0.74 0.00 0.00 36.82 37.74 3a14 h ILE 258 CO 0.02 0.08 0.26 0.28 0.00 0.00 0.00 178.15 178.80 3a14 h SER 259 N -0.26 0.39 -0.45 1.72 0.02 -0.54 -1.18 113.55 113.26 3a14 h SER 259 Ca -0.01 0.02 0.07 0.00 -0.84 0.00 0.00 61.79 61.03 3a14 h SER 259 Cb 0.22 -0.06 -0.06 0.00 0.14 0.00 0.00 62.40 62.64 3a14 h SER 259 CO 0.02 0.27 0.08 0.22 -1.14 0.00 0.00 176.83 176.28 3a14 h TYR 260 N 0.52 0.12 -0.26 3.45 3.20 -1.14 0.06 116.97 122.91 3a14 h TYR 260 Ca 0.21 0.03 -0.16 0.00 3.14 0.00 0.00 58.73 61.94 3a14 h TYR 260 Cb 0.09 0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.38 3a14 h TYR 260 CO -0.09 -0.01 -0.48 0.00 -1.64 0.00 0.00 178.16 175.94 3a14 h ALA 261 N 1.35 0.41 -0.25 1.82 0.00 -1.10 0.16 119.26 121.65 3a14 h ALA 261 Ca 0.22 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 3a14 h ALA 261 Cb 0.29 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3a14 h ALA 261 CO -0.30 0.57 0.10 -0.07 0.00 0.00 0.00 179.25 179.55 3a14 h LEU 262 N 0.53 0.33 0.00 0.00 3.38 -1.02 -3.34 115.31 115.19 3a14 h LEU 262 Ca 0.01 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.83 3a14 h LEU 262 Cb 1.09 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.75 3a14 h LEU 262 CO 0.11 0.40 -1.07 0.49 0.09 0.00 0.00 178.44 178.46 3a14 n PHE 263 N -4.80 0.01 -1.44 1.13 3.72 -0.01 -4.98 117.46 111.09 3a14 n PHE 263 Ca -0.03 0.00 -0.51 0.00 -0.05 0.00 0.00 57.45 56.86 3a14 n PHE 263 Cb 0.12 -0.09 -0.04 0.00 -0.94 0.00 0.00 39.48 38.53 3a14 n PHE 263 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 3a14 n TYR 264 N -1.60 -0.07 1.79 1.38 9.36 0.04 -0.93 117.16 127.13 3a14 n TYR 264 Ca 0.03 0.98 0.14 0.00 3.32 0.00 0.00 57.90 62.37 3a14 n TYR 264 Cb 0.36 -2.01 0.82 0.00 -0.63 0.00 0.00 39.34 37.88 3a14 n TYR 264 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3a14 n PRO 265 N 1.16 0.90 -2.78 2.98 -0.04 -1.26 -5.06 135.00 130.90 3a14 n PRO 265 Ca 0.18 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.25 3a14 n PRO 265 Cb 0.20 -1.48 -0.06 0.00 -0.04 0.00 0.00 33.50 32.12 3a14 n PRO 265 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 3a14 s ARG 266 N -2.00 4.77 -0.17 0.54 3.52 -0.11 -5.05 118.95 120.46 3a14 s ARG 266 Ca 0.42 1.42 -0.12 0.00 -0.13 0.00 0.00 55.73 57.32 3a14 s ARG 266 Cb 0.19 -3.19 -0.05 0.00 -1.56 0.00 0.00 34.95 30.34 3a14 s ARG 266 CO 0.32 0.48 0.22 1.03 -0.81 0.00 0.00 175.30 176.54 3a14 s ARG 267 N -1.34 4.17 0.21 5.12 1.81 -1.26 -4.67 118.95 122.99 3a14 s ARG 267 Ca 0.42 -0.05 -0.22 0.00 -1.72 0.00 0.00 55.73 54.16 3a14 s ARG 267 Cb -0.24 -3.41 -0.08 0.00 -0.45 0.00 0.00 34.95 30.77 3a14 s ARG 267 CO 0.30 0.30 0.76 0.08 -0.68 0.00 0.00 175.30 176.07 3a14 s VAL 268 N 0.30 4.46 -0.44 3.52 1.01 -1.26 -5.02 120.40 122.97 3a14 s VAL 268 Ca 0.13 1.49 -0.28 0.00 0.00 0.00 0.00 61.98 63.32 3a14 s VAL 268 Cb -0.12 -3.97 0.03 0.00 0.00 0.00 0.00 36.38 32.31 3a14 s VAL 268 CO 0.01 0.32 1.06 0.00 0.00 0.00 0.00 175.10 176.50 3a14 s ALA 269 N -1.39 3.24 0.00 5.51 0.00 -1.26 -4.92 121.76 122.93 3a14 s ALA 269 Ca 0.41 -0.49 0.00 0.00 0.00 0.00 0.00 51.96 51.88 3a14 s ALA 269 Cb -0.19 -3.78 0.00 0.00 0.00 0.00 0.00 23.12 19.15 3a14 s ALA 269 CO 0.23 -2.06 0.00 1.28 0.00 0.00 0.00 175.76 175.21 3a14 n LEU 270 N 7.48 0.00 -4.15 0.00 4.77 -1.26 -5.07 117.00 118.76 3a14 n LEU 270 Ca 0.10 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.74 3a14 n LEU 270 Cb 0.49 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.44 3a14 n LEU 270 CO 0.67 0.00 -0.36 -1.61 -1.33 0.00 0.00 177.39 174.76 3a14 s GLU 271 N 2.98 2.36 0.35 3.23 0.41 -1.26 -5.10 118.70 121.68 3a14 s GLU 271 Ca 0.00 -1.32 -0.28 0.00 -0.41 0.00 0.00 54.97 52.96 3a14 s GLU 271 Cb 0.00 -3.15 -0.10 0.00 -1.78 0.00 0.00 34.13 29.10 3a14 s GLU 271 CO 0.00 -0.64 1.33 -2.14 -0.49 0.00 0.00 175.26 173.32 3a14 s PRO 272 N 1.21 4.27 -0.39 0.39 0.02 -1.26 -4.98 135.00 134.27 3a14 s PRO 272 Ca -0.05 2.25 -0.21 0.00 0.02 0.00 0.00 61.00 63.02 3a14 s PRO 272 Cb -0.20 -3.01 0.01 0.00 0.02 0.00 0.00 34.50 31.32 3a14 s PRO 272 CO -0.02 -0.28 0.65 0.12 -0.33 0.00 0.00 177.00 177.14 3a14 s PHE 273 N -1.16 3.12 -0.09 6.54 5.36 -1.26 -5.06 117.98 125.44 3a14 s PHE 273 Ca 0.51 0.22 -0.10 0.00 -0.96 0.00 0.00 56.93 56.60 3a14 s PHE 273 Cb -0.40 -3.23 -0.05 0.00 -0.34 0.00 0.00 43.02 39.00 3a14 s PHE 273 CO 0.54 -0.72 0.23 -0.06 -1.46 0.00 0.00 175.22 173.75 3a14 s PHE 274 N 2.78 3.63 0.21 10.12 0.08 -1.26 -5.05 117.98 128.50 3a14 s PHE 274 Ca 0.24 0.67 -0.30 0.00 0.12 0.00 0.00 56.93 57.67 3a14 s PHE 274 Cb -0.14 -2.07 -0.09 0.00 -0.57 0.00 0.00 43.02 40.15 3a14 s PHE 274 CO 0.17 0.68 1.23 -0.51 -0.10 0.00 0.00 175.22 176.69 3a14 s LEU 275 N -0.95 4.45 0.25 -0.37 1.43 -1.26 -5.04 118.68 117.18 3a14 s LEU 275 Ca 0.18 2.33 0.02 0.00 -1.03 0.00 0.00 54.13 55.62 3a14 s LEU 275 Cb -0.13 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.43 3a14 s LEU 275 CO 0.07 -0.42 0.16 -0.13 0.23 0.00 0.00 176.35 176.26 3a14 s ARG 276 N -0.45 1.39 0.08 1.70 0.52 -1.26 -5.11 118.95 115.82 3a14 s ARG 276 Ca 0.53 -1.76 -0.31 0.00 -0.52 0.00 0.00 55.73 53.67 3a14 s ARG 276 Cb -0.34 0.17 -0.09 0.00 0.52 0.00 0.00 34.95 35.21 3a14 s ARG 276 CO 0.39 -0.44 1.81 0.99 0.02 0.00 0.00 175.30 178.07 3a14 s THR 277 N -3.89 2.83 0.05 0.02 2.01 -1.26 -4.98 115.64 110.41 3a14 s THR 277 Ca 0.39 0.18 0.03 0.00 0.31 0.00 0.00 61.69 62.60 3a14 s THR 277 Cb 0.06 -3.11 -0.02 0.00 0.01 0.00 0.00 72.50 69.43 3a14 s THR 277 CO 0.16 -0.01 -0.10 0.27 -0.69 0.00 0.00 174.62 174.26 3a14 s ILE 278 N 3.22 0.74 -0.14 1.82 -4.36 -1.26 -5.14 121.20 116.08 3a14 s ILE 278 Ca 0.81 -1.12 -0.07 0.00 -0.26 0.00 0.00 60.65 60.01 3a14 s ILE 278 Cb -0.43 -0.76 -0.04 0.00 1.25 0.00 0.00 42.46 42.48 3a14 s ILE 278 CO 0.36 -0.30 0.12 -0.55 0.24 0.00 0.00 174.94 174.82 3a14 s SER 279 N -1.56 6.24 -0.22 4.36 0.15 -1.26 -5.09 113.70 116.32 3a14 s SER 279 Ca -0.07 0.38 0.02 0.00 0.70 0.00 0.00 55.95 56.99 3a14 s SER 279 Cb -0.10 -2.03 0.04 0.00 -1.71 0.00 0.00 66.02 62.23 3a14 s SER 279 CO 0.01 0.35 -0.15 -0.76 1.20 0.00 0.00 173.24 173.89 3a14 s LEU 280 N -0.68 2.77 -0.14 3.45 1.43 -1.26 -4.85 118.68 119.40 3a14 s LEU 280 Ca 0.13 -1.02 -0.07 0.00 -1.03 0.00 0.00 54.13 52.14 3a14 s LEU 280 Cb -0.12 -1.50 -0.04 0.00 0.03 0.00 0.00 46.19 44.56 3a14 s LEU 280 CO 0.03 -0.10 0.13 -0.44 0.23 0.00 0.00 176.35 176.19 3a14 s SER 281 N 1.21 6.26 -0.14 2.29 0.01 -1.26 -5.09 113.70 116.98 3a14 s SER 281 Ca -0.02 0.39 -0.03 0.00 1.31 0.00 0.00 55.95 57.60 3a14 s SER 281 Cb -0.17 -2.03 0.05 0.00 0.21 0.00 0.00 66.02 64.08 3a14 s SER 281 CO -0.09 0.36 0.06 -0.36 0.41 0.00 0.00 173.24 173.62 3a14 s PHE 282 N -0.70 0.39 0.07 2.43 0.08 -1.25 -4.10 117.98 114.89 3a14 s PHE 282 Ca 0.13 -0.29 0.06 0.00 0.12 0.00 0.00 56.93 56.95 3a14 s PHE 282 Cb -0.12 -0.73 -0.03 0.00 -0.57 0.00 0.00 43.02 41.57 3a14 s PHE 282 CO 0.03 -0.44 -0.16 -1.83 -0.10 0.00 0.00 175.22 172.71 3a14 s GLU 283 N 2.07 0.93 0.23 0.44 -1.05 -0.52 -4.93 118.70 115.87 3a14 s GLU 283 Ca 0.02 -0.96 -0.30 0.00 -0.15 0.00 0.00 54.97 53.59 3a14 s GLU 283 Cb -0.15 -0.99 -0.09 0.00 -0.44 0.00 0.00 34.13 32.46 3a14 s GLU 283 CO -0.07 0.23 1.23 -0.51 0.95 0.00 0.00 175.26 177.09 3a14 s ASP 284 N -1.64 7.01 0.30 0.83 1.01 -1.26 -0.10 116.67 122.83 3a14 s ASP 284 Ca 0.01 2.37 -0.29 0.00 0.71 0.00 0.00 52.55 55.34 3a14 s ASP 284 Cb -0.10 -2.62 -0.10 0.00 1.01 0.00 0.00 42.92 41.11 3a14 s ASP 284 CO 0.02 -0.40 1.34 -2.84 0.21 0.00 0.00 175.17 173.51 3a14 s PRO 285 N -0.70 4.33 -0.30 8.23 0.02 -1.26 -4.85 135.00 140.46 3a14 s PRO 285 Ca 0.52 2.23 -0.29 0.00 0.02 0.00 0.00 61.00 63.48 3a14 s PRO 285 Cb -0.35 -3.09 0.01 0.00 0.02 0.00 0.00 34.50 31.09 3a14 s PRO 285 CO 0.41 -0.25 1.23 0.34 -0.33 0.00 0.00 177.00 178.40 3a14 s ASP 286 N -0.23 6.76 0.58 2.53 -1.08 -1.26 -4.92 116.67 119.05 3a14 s ASP 286 Ca 0.52 1.17 0.28 0.00 -0.52 0.00 0.00 52.55 54.00 3a14 s ASP 286 Cb -0.40 -2.54 1.53 0.00 -1.46 0.00 0.00 42.92 40.05 3a14 s ASP 286 CO 0.50 -1.01 1.99 1.55 0.52 0.00 0.00 175.17 178.71 3a14 h PRO 287 N 8.90 0.00 0.00 4.34 0.13 -1.93 0.45 132.00 143.89 3a14 h PRO 287 Ca -0.25 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.77 3a14 h PRO 287 Cb 1.09 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.20 3a14 h PRO 287 CO 1.03 0.00 -0.55 0.93 -0.23 0.00 0.00 178.00 179.18 3a14 h GLU 288 N 0.00 0.00 0.07 0.86 5.08 -1.99 -3.05 114.58 115.55 3a14 h GLU 288 Ca 0.17 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.25 3a14 h GLU 288 Cb 0.90 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.13 3a14 h GLU 288 CO -0.00 0.55 -1.47 -0.22 -1.00 0.00 0.00 179.01 176.87 3a14 h LYS 289 N 0.00 0.15 -2.22 2.33 3.64 -1.36 -3.41 116.57 115.71 3a14 h LYS 289 Ca -0.01 -0.26 -0.56 0.00 -1.27 0.00 0.00 60.65 58.55 3a14 h LYS 289 Cb 1.16 0.10 -0.42 0.00 -0.41 0.00 0.00 32.23 32.66 3a14 h LYS 289 CO 0.07 0.98 -0.77 0.66 -2.27 0.00 0.00 179.45 178.12 3a14 n TYR 290 N -3.36 3.11 -0.28 1.91 4.01 -0.49 -4.95 117.16 117.11 3a14 n TYR 290 Ca -0.14 -3.96 0.05 0.00 -0.16 0.00 0.00 57.90 53.70 3a14 n TYR 290 Cb 1.02 -0.47 0.27 0.00 -0.31 0.00 0.00 39.34 39.85 3a14 n TYR 290 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3a14 h PRO 291 N 3.03 0.94 0.00 -0.72 0.13 -1.77 -2.06 132.00 131.54 3a14 h PRO 291 Ca 0.12 -0.06 -0.08 0.00 -0.87 0.00 0.00 66.00 65.12 3a14 h PRO 291 Cb 0.62 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 31.53 3a14 h PRO 291 CO 0.74 0.62 -0.39 0.00 -0.23 0.00 0.00 178.00 178.75 3a14 h ALA 292 N 1.53 1.36 -0.58 -0.56 0.00 -1.90 -2.68 119.26 116.44 3a14 h ALA 292 Ca 0.39 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 3a14 h ALA 292 Cb 0.25 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3a14 h ALA 292 CO -0.15 0.48 -0.03 0.35 0.00 0.00 0.00 179.25 179.91 3a14 h PHE 293 N 0.00 1.13 0.00 0.00 3.57 -1.51 -2.99 116.94 117.13 3a14 h PHE 293 Ca -0.00 -0.20 0.00 0.00 3.53 0.00 0.00 57.97 61.30 3a14 h PHE 293 Cb 0.68 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 39.13 3a14 h PHE 293 CO 0.00 1.01 0.00 1.19 -2.23 0.00 0.00 178.31 178.28 3a14 n PHE 294 N -4.17 0.00 0.59 0.41 3.72 -1.01 -2.83 117.46 114.17 3a14 n PHE 294 Ca 0.03 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.51 3a14 n PHE 294 Cb 0.36 0.00 0.37 0.00 -0.94 0.00 0.00 39.48 39.27 3a14 n PHE 294 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3a14 n LEU 295 N -0.81 0.03 -0.17 4.37 4.77 -1.13 -4.07 117.00 119.98 3a14 n LEU 295 Ca 0.14 0.51 -0.01 0.00 -0.03 0.00 0.00 56.01 56.61 3a14 n LEU 295 Cb 0.06 -0.50 0.07 0.00 -2.33 0.00 0.00 43.42 40.73 3a14 n LEU 295 CO 0.11 -0.21 0.86 -0.07 -1.33 0.00 0.00 177.39 176.74 3a14 h LEU 296 N 0.00 -0.17 -1.89 2.23 3.38 -1.74 -1.38 115.31 115.73 3a14 h LEU 296 Ca 0.00 0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 3a14 h LEU 296 Cb 0.30 0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 3a14 h LEU 296 CO 0.00 -0.06 -0.01 0.07 0.09 0.00 0.00 178.44 178.53 3a14 h LYS 297 N 0.15 0.05 0.00 1.13 2.10 -1.87 -0.97 116.57 117.15 3a14 h LYS 297 Ca 0.27 -0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.76 3a14 h LYS 297 Cb 0.41 -0.01 -0.02 0.00 -0.90 0.00 0.00 32.23 31.71 3a14 h LYS 297 CO -0.43 0.07 -0.73 0.93 -2.00 0.00 0.00 179.45 177.29 3a14 h GLU 298 N 0.05 0.00 0.00 0.07 4.39 -1.53 -3.38 114.58 114.19 3a14 h GLU 298 Ca 0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 3a14 h GLU 298 Cb 0.05 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 3a14 h GLU 298 CO 0.00 0.73 -1.12 0.44 -1.16 0.00 0.00 179.01 177.90 3a14 n ILE 299 N -3.59 0.00 0.02 3.13 -6.64 -0.66 -4.75 119.36 106.87 3a14 n ILE 299 Ca -0.01 -0.25 0.11 0.00 -1.77 0.00 0.00 62.75 60.83 3a14 n ILE 299 Cb 0.73 0.58 0.55 0.00 -1.44 0.00 0.00 39.64 40.06 3a14 n ILE 299 CO 0.00 0.00 0.00 0.07 -1.77 0.00 0.00 176.55 174.85 3a14 h LYS 300 N 0.00 0.27 -0.00 6.28 2.10 -1.39 -1.39 116.57 122.43 3a14 h LYS 300 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 3a14 h LYS 300 Cb 0.46 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 31.73 3a14 h LYS 300 CO 0.00 0.18 -0.41 -0.25 -2.00 0.00 0.00 179.45 176.97 3a14 n ASP 301 N -4.47 0.59 -4.14 7.07 8.00 -1.26 -4.80 116.55 117.54 3a14 n ASP 301 Ca 0.06 -0.37 -0.33 0.00 0.71 0.00 0.00 54.79 54.85 3a14 n ASP 301 Cb 0.29 0.18 -0.15 0.00 -0.02 0.00 0.00 41.12 41.42 3a14 n ASP 301 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 3a14 s SER 302 N -2.87 4.13 0.59 -2.24 0.15 -0.52 -4.97 113.70 107.97 3a14 s SER 302 Ca 0.15 -1.01 0.34 0.00 0.70 0.00 0.00 55.95 56.13 3a14 s SER 302 Cb 0.18 -1.59 1.86 0.00 -1.71 0.00 0.00 66.02 64.76 3a14 s SER 302 CO 0.65 -0.13 2.21 1.88 1.20 0.00 0.00 173.24 179.05 3a14 h TYR 303 N 7.92 0.00 0.13 3.44 0.05 -1.87 -0.09 116.97 126.56 3a14 h TYR 303 Ca -0.31 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.47 3a14 h TYR 303 Cb 1.09 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.83 3a14 h TYR 303 CO 0.58 0.04 -0.06 0.00 -1.05 0.00 0.00 178.16 177.66 3a14 h ALA 304 N 1.96 -0.17 -0.40 3.88 0.00 -1.90 -0.77 119.26 121.87 3a14 h ALA 304 Ca -0.00 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 3a14 h ALA 304 Cb 0.15 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3a14 h ALA 304 CO 0.00 -0.43 -0.11 -0.07 0.00 0.00 0.00 179.25 178.64 3a14 h LEU 305 N -0.51 0.69 -0.44 0.00 3.38 -1.77 -0.93 115.31 115.73 3a14 h LEU 305 Ca -0.02 -0.20 -0.13 0.00 0.09 0.00 0.00 57.88 57.62 3a14 h LEU 305 Cb 0.40 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3a14 h LEU 305 CO 0.03 0.83 -0.23 0.03 0.09 0.00 0.00 178.44 179.19 3a14 h ARG 306 N 0.64 0.93 -0.26 1.13 3.08 -1.04 0.98 114.38 119.85 3a14 h ARG 306 Ca 0.11 -0.42 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 3a14 h ARG 306 Cb 0.56 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.58 3a14 h ARG 306 CO 0.04 1.08 0.14 1.15 -1.07 0.00 0.00 179.97 181.30 3a14 h THR 307 N 0.76 1.12 -0.90 2.04 2.02 -1.00 -1.24 112.91 115.73 3a14 h THR 307 Ca 0.09 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 3a14 h THR 307 Cb 0.81 0.88 -0.04 0.00 -1.74 0.00 0.00 68.15 68.05 3a14 h THR 307 CO 0.07 0.12 0.52 0.00 0.37 0.00 0.00 175.52 176.60 3a14 h ALA 308 N 1.01 1.22 -0.01 6.16 0.00 -1.11 -0.34 119.26 126.19 3a14 h ALA 308 Ca 0.09 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.91 3a14 h ALA 308 Cb 0.07 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 3a14 h ALA 308 CO -0.01 0.65 -0.20 0.35 0.00 0.00 0.00 179.25 180.03 3a14 h PHE 309 N 1.25 -0.54 -0.18 0.00 3.57 -0.66 0.21 116.94 120.58 3a14 h PHE 309 Ca 0.32 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.83 3a14 h PHE 309 Cb -0.01 0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 3a14 h PHE 309 CO 0.01 -0.29 0.09 -0.97 -2.23 0.00 0.00 178.31 174.92 3a14 h ASN 310 N -0.32 0.24 -0.25 0.41 -0.73 -0.97 -0.84 115.58 113.13 3a14 h ASN 310 Ca 0.06 -0.11 0.00 0.00 1.87 0.00 0.00 56.30 58.12 3a14 h ASN 310 Cb 0.40 -0.06 -0.01 0.00 0.27 0.00 0.00 38.32 38.92 3a14 h ASN 310 CO -0.20 0.28 0.16 0.00 -0.37 0.00 0.00 177.43 177.31 3a14 h ALA 311 N 0.96 0.31 -0.99 1.57 0.00 -0.95 -1.13 119.26 119.03 3a14 h ALA 311 Ca 0.06 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.98 3a14 h ALA 311 Cb 0.11 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 3a14 h ALA 311 CO -0.01 -0.21 0.65 0.00 0.00 0.00 0.00 179.25 179.69 3a14 h ALA 312 N 1.08 1.29 -0.49 0.00 0.00 -0.51 -2.01 119.26 118.63 3a14 h ALA 312 Ca 0.09 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3a14 h ALA 312 Cb -0.03 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.36 3a14 h ALA 312 CO -0.02 0.58 0.20 0.22 0.00 0.00 0.00 179.25 180.24 3a14 h ASP 313 N 1.29 0.67 -0.27 0.00 3.58 -0.74 -1.12 116.42 119.84 3a14 h ASP 313 Ca 0.38 -0.16 0.04 0.00 0.42 0.00 0.00 57.03 57.71 3a14 h ASP 313 Cb -0.06 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 40.78 3a14 h ASP 313 CO -0.11 0.65 0.03 -0.08 -2.88 0.00 0.00 179.24 176.85 3a14 h GLU 314 N 0.65 0.12 -0.05 0.28 4.81 -0.69 0.03 114.58 119.73 3a14 h GLU 314 Ca 0.16 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 3a14 h GLU 314 Cb 0.18 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.53 3a14 h GLU 314 CO -0.01 0.08 0.02 0.28 -0.73 0.00 0.00 179.01 178.65 3a14 h VAL 315 N 0.12 1.13 -0.64 0.32 2.07 -1.21 -2.66 116.25 115.39 3a14 h VAL 315 Ca 0.12 -0.38 -0.05 0.00 0.82 0.00 0.00 66.70 67.21 3a14 h VAL 315 Cb 0.14 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 3a14 h VAL 315 CO -0.18 0.11 0.21 0.00 0.02 0.00 0.00 177.57 177.72 3a14 h ALA 316 N 0.87 0.84 -0.36 1.67 0.00 -1.05 -1.20 119.26 120.03 3a14 h ALA 316 Ca 0.02 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 3a14 h ALA 316 Cb 0.15 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3a14 h ALA 316 CO -0.00 0.50 0.04 0.28 0.00 0.00 0.00 179.25 180.07 3a14 h VAL 317 N 0.92 1.25 -0.78 0.00 2.07 -1.01 0.02 116.25 118.71 3a14 h VAL 317 Ca 0.21 -0.89 0.01 0.00 0.82 0.00 0.00 66.70 66.84 3a14 h VAL 317 Cb 0.28 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 3a14 h VAL 317 CO -0.01 0.30 0.52 -0.08 0.02 0.00 0.00 177.57 178.32 3a14 h GLU 318 N 0.44 1.02 -0.73 1.57 4.81 -1.28 -1.16 114.58 119.25 3a14 h GLU 318 Ca 0.11 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.22 3a14 h GLU 318 Cb 0.39 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 3a14 h GLU 318 CO 0.01 0.68 0.24 0.00 -0.73 0.00 0.00 179.01 179.21 3a14 h ALA 319 N 1.29 0.96 -0.13 2.92 0.00 -0.94 -0.71 119.26 122.65 3a14 h ALA 319 Ca 0.29 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 55.00 3a14 h ALA 319 Cb -0.12 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.37 3a14 h ALA 319 CO -0.06 0.63 -0.01 0.35 0.00 0.00 0.00 179.25 180.16 3a14 h PHE 320 N 1.08 -0.02 0.00 0.00 3.57 -0.68 0.42 116.94 121.31 3a14 h PHE 320 Ca 0.24 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.69 3a14 h PHE 320 Cb 0.29 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 3a14 h PHE 320 CO 0.02 -0.02 -0.29 -0.07 -2.23 0.00 0.00 178.31 175.72 3a14 h LEU 321 N 0.04 0.00 -0.20 0.59 3.38 -0.91 -1.01 115.31 117.20 3a14 h LEU 321 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3a14 h LEU 321 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3a14 h LEU 321 CO -0.11 0.29 -0.11 0.29 0.09 0.00 0.00 178.44 178.89 3a14 n LYS 322 N -3.76 0.62 -0.78 1.13 5.02 -0.30 -4.93 118.16 115.16 3a14 n LYS 322 Ca -0.01 -0.20 0.00 0.00 -2.02 0.00 0.00 58.31 56.08 3a14 n LYS 322 Cb 0.39 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 3a14 n LYS 322 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3a14 n GLY 323 N 1.29 0.57 0.10 0.72 0.00 -0.38 -4.94 105.19 102.55 3a14 n GLY 323 Ca 0.14 -0.37 -0.02 0.00 0.00 0.00 0.00 46.02 45.77 3a14 n GLY 323 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3a14 h ARG 324 N 0.95 0.00 -4.12 1.61 3.08 -1.14 -3.47 114.38 111.29 3a14 h ARG 324 Ca 0.00 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.91 3a14 h ARG 324 Cb 0.00 0.00 -0.17 0.00 0.08 0.00 0.00 29.97 29.88 3a14 h ARG 324 CO 0.00 0.76 -0.67 0.96 -1.07 0.00 0.00 179.97 179.95 3a14 s ILE 325 N -2.92 0.18 0.82 2.04 -4.36 -1.21 -4.45 121.20 111.30 3a14 s ILE 325 Ca 0.02 -1.48 -0.11 0.00 -0.26 0.00 0.00 60.65 58.83 3a14 s ILE 325 Cb 0.09 -1.09 0.12 0.00 1.25 0.00 0.00 42.46 42.83 3a14 s ILE 325 CO 0.78 -0.81 1.16 -0.13 0.24 0.00 0.00 174.94 176.18 3a14 s ARG 326 N -3.08 1.55 0.22 0.37 1.81 -1.26 -4.39 118.95 114.16 3a14 s ARG 326 Ca -0.01 -0.30 -0.08 0.00 -1.72 0.00 0.00 55.73 53.61 3a14 s ARG 326 Cb 0.02 -2.02 0.31 0.00 -0.45 0.00 0.00 34.95 32.81 3a14 s ARG 326 CO -0.07 -1.76 1.75 0.35 -0.68 0.00 0.00 175.30 174.89 3a14 h PHE 327 N -1.07 0.44 0.00 -0.53 3.57 -1.35 -1.32 116.94 116.68 3a14 h PHE 327 Ca -0.44 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.09 3a14 h PHE 327 Cb 1.29 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.93 3a14 h PHE 327 CO -0.24 0.11 0.00 0.78 -2.23 0.00 0.00 178.31 176.74 3a14 h GLY 328 N 0.44 0.00 2.00 2.40 0.00 -1.33 -1.91 103.07 104.67 3a14 h GLY 328 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.66 3a14 h GLY 328 CO -0.31 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 174.90 3a14 h GLY 329 N 1.22 0.00 0.78 4.60 0.00 -1.47 -3.27 103.07 104.92 3a14 h GLY 329 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3a14 h GLY 329 CO 0.00 0.00 -0.10 -2.22 0.00 0.00 0.00 176.54 174.22 3a14 h ILE 330 N 0.00 0.88 -0.10 2.60 5.03 -1.46 -0.28 117.51 124.18 3a14 h ILE 330 Ca 0.00 -0.45 -0.03 0.00 -0.12 0.00 0.00 64.86 64.25 3a14 h ILE 330 Cb 0.55 1.15 -0.01 0.00 -3.03 0.00 0.00 36.82 35.48 3a14 h ILE 330 CO 0.00 0.10 -0.09 1.12 -0.68 0.00 0.00 178.15 178.60 3a14 h HIS 331 N -0.50 0.16 -0.29 1.37 2.07 -1.76 -2.06 115.15 114.14 3a14 h HIS 331 Ca -0.03 -0.01 -0.12 0.00 -2.85 0.00 0.00 60.37 57.36 3a14 h HIS 331 Cb 0.38 -0.05 -0.00 0.00 2.57 0.00 0.00 27.41 30.30 3a14 h HIS 331 CO 0.00 0.26 -0.30 0.00 -3.07 0.00 0.00 177.93 174.81 3a14 h ARG 332 N 0.15 0.72 -0.55 5.12 3.08 -1.56 -0.14 114.38 121.20 3a14 h ARG 332 Ca 0.03 -0.39 0.05 0.00 0.07 0.00 0.00 59.98 59.74 3a14 h ARG 332 Cb 0.27 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.29 3a14 h ARG 332 CO 0.01 1.00 0.30 0.28 -1.07 0.00 0.00 179.97 180.49 3a14 h VAL 333 N 0.47 0.97 0.20 2.04 2.07 -0.72 -1.44 116.25 119.83 3a14 h VAL 333 Ca 0.04 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 3a14 h VAL 333 Cb 0.88 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 3a14 h VAL 333 CO 0.07 0.10 -0.10 0.40 0.02 0.00 0.00 177.57 178.07 3a14 h ILE 334 N 0.57 0.83 -0.16 4.57 2.04 -1.22 -1.61 117.51 122.52 3a14 h ILE 334 Ca 0.24 -0.13 0.03 0.00 1.00 0.00 0.00 64.86 66.00 3a14 h ILE 334 Cb 0.13 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 3a14 h ILE 334 CO -0.16 0.03 -0.01 -0.33 0.00 0.00 0.00 178.15 177.69 3a14 h GLU 335 N -0.33 0.04 -0.38 2.37 5.08 -0.90 -1.35 114.58 119.11 3a14 h GLU 335 Ca -0.03 -0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.24 3a14 h GLU 335 Cb 0.26 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 3a14 h GLU 335 CO 0.05 0.03 -0.14 0.87 -1.00 0.00 0.00 179.01 178.82 3a14 h LYS 336 N 0.04 0.67 -0.35 2.33 1.57 -1.29 -2.18 116.57 117.36 3a14 h LYS 336 Ca 0.08 -0.22 -0.06 0.00 -1.87 0.00 0.00 60.65 58.57 3a14 h LYS 336 Cb 0.10 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 3a14 h LYS 336 CO -0.14 0.78 -0.02 1.15 -0.57 0.00 0.00 179.45 180.65 3a14 h THR 337 N 0.61 1.26 -0.90 -0.16 2.02 -1.09 -3.02 112.91 111.64 3a14 h THR 337 Ca 0.10 -1.02 0.03 0.00 0.77 0.00 0.00 66.41 66.30 3a14 h THR 337 Cb 0.58 1.23 -0.05 0.00 -1.74 0.00 0.00 68.15 68.17 3a14 h THR 337 CO 0.04 0.34 0.59 -0.07 0.37 0.00 0.00 175.52 176.78 3a14 h LEU 338 N 0.44 0.97 -1.69 2.58 3.38 -1.10 -2.04 115.31 117.84 3a14 h LEU 338 Ca 0.10 -0.01 0.13 0.00 0.09 0.00 0.00 57.88 58.19 3a14 h LEU 338 Cb 0.49 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.98 3a14 h LEU 338 CO 0.02 0.66 0.44 -0.33 0.09 0.00 0.00 178.44 179.33 3a14 h GLU 339 N 1.12 0.31 0.00 1.13 5.08 -1.26 -0.89 114.58 120.07 3a14 h GLU 339 Ca 0.36 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 3a14 h GLU 339 Cb 0.02 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.20 3a14 h GLU 339 CO -0.11 0.21 0.00 0.39 -1.00 0.00 0.00 179.01 178.50 3a14 n GLU 340 N -4.45 0.14 -0.07 2.33 1.02 -0.77 -3.16 120.64 115.68 3a14 n GLU 340 Ca 0.12 0.19 0.06 0.00 -0.02 0.00 0.00 57.16 57.51 3a14 n GLU 340 Cb 0.49 -1.69 0.10 0.00 -0.02 0.00 0.00 31.44 30.32 3a14 n GLU 340 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3a14 n PHE 341 N -1.94 0.19 -1.57 -0.32 3.72 -0.37 -4.99 117.46 112.18 3a14 n PHE 341 Ca 0.05 -0.18 -0.56 0.00 -0.05 0.00 0.00 57.45 56.72 3a14 n PHE 341 Cb 0.34 -0.01 -0.07 0.00 -0.94 0.00 0.00 39.48 38.80 3a14 n PHE 341 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3a14 n GLN 342 N 0.70 0.70 -0.97 -1.08 6.02 -1.03 -1.49 117.38 120.23 3a14 n GLN 342 Ca 0.10 0.25 0.00 0.00 -0.01 0.00 0.00 57.00 57.34 3a14 n GLN 342 Cb 0.37 -1.84 0.00 0.00 1.02 0.00 0.00 30.24 29.78 3a14 n GLN 342 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3a14 n GLY 343 N 2.36 0.87 3.76 1.08 0.00 -1.26 -5.01 105.19 106.99 3a14 n GLY 343 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 3a14 n GLY 343 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3a14 n TYR 344 N -2.13 2.74 -2.06 1.61 9.36 -0.55 -4.95 117.16 121.19 3a14 n TYR 344 Ca 0.00 0.45 -0.33 0.00 3.32 0.00 0.00 57.90 61.33 3a14 n TYR 344 Cb 0.00 -2.47 0.01 0.00 -0.63 0.00 0.00 39.34 36.25 3a14 n TYR 344 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 3a14 s PRO 345 N -2.33 3.24 0.04 2.98 0.04 -1.26 -4.95 135.00 132.76 3a14 s PRO 345 Ca 0.59 1.33 -0.31 0.00 0.04 0.00 0.00 61.00 62.65 3a14 s PRO 345 Cb -0.46 -2.01 -0.10 0.00 0.04 0.00 0.00 34.50 31.96 3a14 s PRO 345 CO 0.59 -0.89 1.91 0.94 0.04 0.00 0.00 177.00 179.59 3a14 n GLN 346 N -1.90 2.69 -1.80 4.56 -0.06 -1.26 -4.73 117.38 114.88 3a14 n GLN 346 Ca 0.10 0.99 -0.35 0.00 -2.00 0.00 0.00 57.00 55.73 3a14 n GLN 346 Cb 0.52 -2.90 0.05 0.00 -4.06 0.00 0.00 30.24 23.86 3a14 n GLN 346 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 3a14 s PRO 347 N 3.83 2.69 -0.00 3.69 0.04 -1.26 -4.97 135.00 139.02 3a14 s PRO 347 Ca 0.88 1.77 0.01 0.00 0.04 0.00 0.00 61.00 63.70 3a14 s PRO 347 Cb -0.51 -1.90 -0.02 0.00 0.04 0.00 0.00 34.50 32.11 3a14 s PRO 347 CO 0.43 -1.41 0.02 0.54 0.04 0.00 0.00 177.00 176.62 3a14 n ARG 348 N -2.03 0.92 -4.28 4.56 1.74 -1.26 -5.01 116.66 111.30 3a14 n ARG 348 Ca 0.13 -0.01 -0.15 0.00 -0.77 0.00 0.00 57.85 57.05 3a14 n ARG 348 Cb 0.50 -1.03 -0.10 0.00 -1.02 0.00 0.00 32.46 30.80 3a14 n ARG 348 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3a14 s THR 349 N -2.08 0.92 0.23 0.55 -4.23 -1.26 -5.01 115.64 104.76 3a14 s THR 349 Ca -0.01 -2.02 -0.09 0.00 -1.18 0.00 0.00 61.69 58.40 3a14 s THR 349 Cb 0.01 -2.17 0.26 0.00 1.34 0.00 0.00 72.50 71.94 3a14 s THR 349 CO 0.06 -0.46 1.63 0.25 -0.54 0.00 0.00 174.62 175.56 3a14 h LEU 350 N 2.61 -0.42 -0.84 4.79 5.85 -2.00 -2.01 115.31 123.30 3a14 h LEU 350 Ca -0.37 0.19 0.05 0.00 0.84 0.00 0.00 57.88 58.59 3a14 h LEU 350 Cb 1.21 0.36 -0.06 0.00 0.37 0.00 0.00 40.66 42.54 3a14 h LEU 350 CO 0.64 -0.18 0.53 -0.78 -0.34 0.00 0.00 178.44 178.30 3a14 h ASP 351 N 0.08 0.84 -0.71 1.25 3.58 -1.99 -0.23 116.42 119.25 3a14 h ASP 351 Ca 0.38 0.01 0.02 0.00 0.42 0.00 0.00 57.03 57.86 3a14 h ASP 351 Cb 0.64 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 41.48 3a14 h ASP 351 CO -0.66 0.56 0.45 0.44 -2.88 0.00 0.00 179.24 177.15 3a14 h ASP 352 N 0.99 0.76 -0.03 2.28 3.32 -1.78 -2.16 116.42 119.80 3a14 h ASP 352 Ca 0.36 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.39 3a14 h ASP 352 Cb 0.11 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.48 3a14 h ASP 352 CO -0.15 0.54 0.00 0.58 -1.72 0.00 0.00 179.24 178.49 3a14 h VAL 353 N 0.90 1.23 -0.55 -1.35 2.07 -0.82 -2.56 116.25 115.18 3a14 h VAL 353 Ca 0.27 -0.68 0.06 0.00 0.82 0.00 0.00 66.70 67.17 3a14 h VAL 353 Cb -0.03 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 3a14 h VAL 353 CO -0.09 0.18 0.36 -0.33 0.02 0.00 0.00 177.57 177.72 3a14 h GLU 354 N -0.21 0.50 -0.17 1.57 5.08 -0.99 -1.13 114.58 119.23 3a14 h GLU 354 Ca 0.01 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 3a14 h GLU 354 Cb 0.29 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 3a14 h GLU 354 CO 0.00 0.33 -0.04 -0.09 -1.00 0.00 0.00 179.01 178.21 3a14 h ARG 355 N 0.52 0.33 -0.30 2.33 2.43 -1.29 -1.63 114.38 116.76 3a14 h ARG 355 Ca 0.23 -0.13 0.02 0.00 -0.81 0.00 0.00 59.98 59.30 3a14 h ARG 355 Cb 0.27 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.77 3a14 h ARG 355 CO -0.06 0.60 0.15 0.82 -1.51 0.00 0.00 179.97 179.96 3a14 h ILE 356 N 0.04 0.98 -0.00 1.20 2.04 -1.07 -0.52 117.51 120.18 3a14 h ILE 356 Ca 0.04 -0.11 0.03 0.00 1.00 0.00 0.00 64.86 65.83 3a14 h ILE 356 Cb 0.47 0.65 -0.05 0.00 -0.74 0.00 0.00 36.82 37.15 3a14 h ILE 356 CO 0.02 0.06 -0.29 -0.74 0.00 0.00 0.00 178.15 177.19 3a14 h HIS 357 N 0.31 -0.79 -0.45 1.37 2.76 -1.12 0.75 115.15 117.97 3a14 h HIS 357 Ca 0.13 0.03 0.05 0.00 -2.20 0.00 0.00 60.37 58.37 3a14 h HIS 357 Cb 0.05 0.35 -0.05 0.00 1.55 0.00 0.00 27.41 29.31 3a14 h HIS 357 CO -0.10 -0.38 0.19 0.35 -1.30 0.00 0.00 177.93 176.69 3a14 h PHE 358 N -0.44 0.34 -0.68 5.26 3.57 -1.10 -0.59 116.94 123.31 3a14 h PHE 358 Ca 0.06 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.59 3a14 h PHE 358 Cb 0.52 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.14 3a14 h PHE 358 CO -0.32 0.15 0.44 0.93 -2.23 0.00 0.00 178.31 177.28 3a14 h GLU 359 N 0.38 0.89 -0.45 1.11 5.08 -0.75 -2.65 114.58 118.20 3a14 h GLU 359 Ca 0.21 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.40 3a14 h GLU 359 Cb 0.17 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 3a14 h GLU 359 CO -0.18 0.60 -0.13 0.00 -1.00 0.00 0.00 179.01 178.30 3a14 h ALA 360 N 1.24 0.62 -0.65 3.43 0.00 -0.18 0.39 119.26 124.11 3a14 h ALA 360 Ca 0.25 -0.34 0.05 0.00 0.00 0.00 0.00 54.91 54.86 3a14 h ALA 360 Cb -0.09 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.49 3a14 h ALA 360 CO -0.05 0.53 0.38 0.82 0.00 0.00 0.00 179.25 180.93 3a14 h ILE 361 N 0.72 1.00 -0.10 0.00 2.04 -1.04 0.17 117.51 120.31 3a14 h ILE 361 Ca 0.11 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.69 3a14 h ILE 361 Cb 0.67 0.23 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 3a14 h ILE 361 CO 0.05 0.13 -0.10 0.11 0.00 0.00 0.00 178.15 178.34 3a14 h LYS 362 N 0.71 0.25 -1.00 2.37 1.79 -1.17 -1.21 116.57 118.31 3a14 h LYS 362 Ca 0.28 -0.13 0.02 0.00 -2.18 0.00 0.00 60.65 58.65 3a14 h LYS 362 Cb 0.13 0.01 -0.05 0.00 -1.58 0.00 0.00 32.23 30.73 3a14 h LYS 362 CO -0.16 0.67 0.66 0.87 -1.08 0.00 0.00 179.45 180.41 3a14 h LYS 363 N -0.16 1.27 -0.28 3.15 1.57 -0.83 -2.73 116.57 118.56 3a14 h LYS 363 Ca 0.02 -0.08 -0.15 0.00 -1.87 0.00 0.00 60.65 58.57 3a14 h LYS 363 Cb 0.62 -0.29 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 3a14 h LYS 363 CO 0.03 0.84 -0.44 0.00 -0.57 0.00 0.00 179.45 179.31 3a14 h ALA 364 N 1.40 0.69 -0.54 3.86 0.00 -0.56 -2.46 119.26 121.65 3a14 h ALA 364 Ca 0.38 -0.47 0.09 0.00 0.00 0.00 0.00 54.91 54.92 3a14 h ALA 364 Cb -0.08 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 17.53 3a14 h ALA 364 CO -0.10 0.67 0.12 1.49 0.00 0.00 0.00 179.25 181.43 3a14 h GLU 365 N 0.58 0.26 -0.34 0.00 4.81 -1.02 0.31 114.58 119.17 3a14 h GLU 365 Ca 0.04 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 3a14 h GLU 365 Cb 0.99 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.30 3a14 h GLU 365 CO 0.09 0.17 0.16 0.00 -0.73 0.00 0.00 179.01 178.70 3a14 h ARG 366 N 0.26 0.49 -0.34 1.92 3.08 -1.20 -1.31 114.38 117.28 3a14 h ARG 366 Ca 0.28 -0.08 0.04 0.00 0.07 0.00 0.00 59.98 60.29 3a14 h ARG 366 Cb 0.38 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.31 3a14 h ARG 366 CO -0.35 0.46 0.12 0.28 -1.07 0.00 0.00 179.97 179.40 3a14 h VAL 367 N 0.41 0.90 -0.55 2.04 2.07 -1.27 -1.20 116.25 118.66 3a14 h VAL 367 Ca 0.12 -0.09 0.06 0.00 0.82 0.00 0.00 66.70 67.60 3a14 h VAL 367 Cb 0.13 0.61 -0.05 0.00 -1.52 0.00 0.00 31.29 30.47 3a14 h VAL 367 CO -0.01 0.05 0.27 0.74 0.02 0.00 0.00 177.57 178.63 3a14 h THR 368 N 0.26 0.92 -0.28 2.57 2.02 -0.64 -0.20 112.91 117.57 3a14 h THR 368 Ca 0.16 -0.17 0.06 0.00 0.77 0.00 0.00 66.41 67.22 3a14 h THR 368 Cb 0.13 0.37 -0.06 0.00 -1.74 0.00 0.00 68.15 66.85 3a14 h THR 368 CO -0.16 0.09 -0.10 -0.33 0.37 0.00 0.00 175.52 175.39 3a14 h GLU 369 N 0.51 -0.05 -0.17 6.66 5.08 -0.84 0.25 114.58 126.03 3a14 h GLU 369 Ca 0.25 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.66 3a14 h GLU 369 Cb 0.18 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.38 3a14 h GLU 369 CO -0.19 -0.03 -0.28 -1.49 -1.00 0.00 0.00 179.01 176.02 3a14 h TRP 370 N -0.05 -0.75 -0.09 4.33 4.06 -0.34 0.98 115.95 124.09 3a14 h TRP 370 Ca 0.14 0.04 -0.07 0.00 2.06 0.00 0.00 58.89 61.06 3a14 h TRP 370 Cb 0.26 0.36 -0.01 0.00 -1.00 0.00 0.00 29.16 28.77 3a14 h TRP 370 CO -0.30 -0.36 -0.26 -0.07 -3.56 0.00 0.00 178.44 173.89 3a14 h LEU 371 N -0.33 0.15 -0.34 -4.49 3.38 -0.80 -2.31 115.31 110.57 3a14 h LEU 371 Ca 0.11 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 3a14 h LEU 371 Cb 0.50 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 3a14 h LEU 371 CO -0.35 0.42 -0.13 -1.28 0.09 0.00 0.00 178.44 177.19 3a14 h SER 372 N 0.14 0.70 0.39 -0.43 0.87 0.29 -2.14 113.55 113.37 3a14 h SER 372 Ca 0.02 -0.39 0.00 0.00 -1.23 0.00 0.00 61.79 60.19 3a14 h SER 372 Cb 0.55 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 3a14 h SER 372 CO 0.04 0.93 0.00 -1.20 -0.53 0.00 0.00 176.83 176.07 3a14 n SER 373 N -4.37 0.47 0.00 6.23 7.64 0.26 -5.00 113.62 118.84 3a14 n SER 373 Ca -0.02 0.65 0.00 0.00 1.01 0.00 0.00 58.87 60.51 3a14 n SER 373 Cb 0.37 -0.74 0.00 0.00 -1.01 0.00 0.00 64.21 62.83 3a14 n SER 373 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44