#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f91 s LYS 2 N 0.00 2.62 0.20 2.12 1.02 -1.26 -5.03 119.74 119.41 1f91 s LYS 2 Ca 0.00 1.47 -0.07 0.00 0.02 0.00 0.00 55.97 57.39 1f91 s LYS 2 Cb 0.00 -1.92 -0.06 0.00 -0.52 0.00 0.00 37.83 35.33 1f91 s LYS 2 CO 0.00 -1.40 0.47 1.03 -0.92 0.00 0.00 175.35 174.53 1f91 s ARG 3 N -4.07 3.70 -0.02 1.68 0.52 -1.26 -4.68 118.95 114.82 1f91 s ARG 3 Ca 0.68 0.07 0.05 0.00 -0.52 0.00 0.00 55.73 56.02 1f91 s ARG 3 Cb -0.22 -2.74 -0.01 0.00 0.52 0.00 0.00 34.95 32.50 1f91 s ARG 3 CO 0.43 0.38 -0.17 0.08 0.02 0.00 0.00 175.30 176.03 1f91 s VAL 4 N -1.77 1.36 0.26 3.52 1.01 -1.26 -0.61 120.40 122.90 1f91 s VAL 4 Ca 0.44 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.73 1f91 s VAL 4 Cb -0.12 -1.14 -0.05 0.00 0.00 0.00 0.00 36.38 35.07 1f91 s VAL 4 CO 0.24 0.39 0.05 0.68 0.00 0.00 0.00 175.10 176.45 1f91 s VAL 5 N -0.28 0.88 -0.22 2.92 -7.23 -0.09 -0.68 120.40 115.70 1f91 s VAL 5 Ca 0.04 -2.01 -0.04 0.00 -1.81 0.00 0.00 61.98 58.16 1f91 s VAL 5 Cb -0.08 -2.53 -0.00 0.00 0.56 0.00 0.00 36.38 34.32 1f91 s VAL 5 CO 0.00 -0.15 -0.04 -0.63 -0.31 0.00 0.00 175.10 173.97 1f91 s ILE 6 N -3.52 3.32 -0.59 -0.62 1.01 -0.36 -0.38 121.20 120.06 1f91 s ILE 6 Ca 0.33 -0.55 0.10 0.00 0.00 0.00 0.00 60.65 60.53 1f91 s ILE 6 Cb 0.07 -2.53 0.29 0.00 0.01 0.00 0.00 42.46 40.30 1f91 s ILE 6 CO 0.12 0.39 1.23 0.35 0.00 0.00 0.00 174.94 177.03 1f91 n THR 7 N 4.79 1.27 -3.62 2.92 -2.24 -0.57 -1.66 114.28 115.17 1f91 n THR 7 Ca -0.18 -1.22 -0.04 0.00 -2.27 0.00 0.00 64.05 60.34 1f91 n THR 7 Cb 0.50 0.33 -0.03 0.00 -2.10 0.00 0.00 70.33 69.03 1f91 n THR 7 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1f91 s GLY 8 N -1.25 -0.10 0.01 3.38 0.00 -1.26 -3.95 107.32 104.14 1f91 s GLY 8 Ca 0.23 2.27 -0.18 0.00 0.00 0.00 0.00 44.72 47.04 1f91 s GLY 8 CO 0.11 0.89 0.39 0.48 0.00 0.00 0.00 173.10 174.98 1f91 s LEU 9 N -1.45 0.50 0.01 0.66 0.05 -1.26 -0.92 118.68 116.27 1f91 s LEU 9 Ca 0.07 0.10 -0.03 0.00 0.05 0.00 0.00 54.13 54.33 1f91 s LEU 9 Cb -0.01 1.61 -0.01 0.00 -2.05 0.00 0.00 46.19 45.73 1f91 s LEU 9 CO -0.05 -0.56 0.05 -0.83 -0.55 0.00 0.00 176.35 174.40 1f91 s GLY 10 N -1.63 0.13 -0.11 -3.48 0.00 0.00 -3.51 107.32 98.72 1f91 s GLY 10 Ca -0.09 -0.32 -0.30 0.00 0.00 0.00 0.00 44.72 44.01 1f91 s GLY 10 CO 0.02 -0.41 0.73 -1.50 0.00 0.00 0.00 173.10 171.93 1f91 s ILE 11 N -1.27 0.00 -0.23 0.90 2.07 -1.26 -1.37 121.20 120.04 1f91 s ILE 11 Ca -0.14 0.00 -0.04 0.00 -1.41 0.00 0.00 60.65 59.06 1f91 s ILE 11 Cb -0.08 -1.00 0.08 0.00 0.13 0.00 0.00 42.46 41.59 1f91 s ILE 11 CO 0.00 0.00 0.11 -0.69 -1.91 0.00 0.00 174.94 172.45 1f91 s VAL 12 N -0.84 -0.08 0.36 4.00 1.01 -0.95 -3.16 120.40 120.74 1f91 s VAL 12 Ca -0.08 -0.48 0.07 0.00 0.00 0.00 0.00 61.98 61.49 1f91 s VAL 12 Cb -0.01 -0.79 -0.02 0.00 0.00 0.00 0.00 36.38 35.56 1f91 s VAL 12 CO 0.07 -0.52 0.24 -1.54 0.00 0.00 0.00 175.10 173.35 1f91 n SER 13 N 5.26 -0.09 0.32 3.32 3.41 0.22 -1.32 113.62 124.75 1f91 n SER 13 Ca -0.06 -3.18 0.20 0.00 -0.26 0.00 0.00 58.87 55.57 1f91 n SER 13 Cb 0.45 1.46 1.06 0.00 -0.26 0.00 0.00 64.21 66.92 1f91 n SER 13 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1f91 h SER 14 N 1.91 0.00 -0.23 4.04 4.64 -1.77 -2.60 113.55 119.54 1f91 h SER 14 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1f91 h SER 14 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1f91 h SER 14 CO 0.39 0.01 0.00 2.30 -0.87 0.00 0.00 176.83 178.66 1f91 n ILE 15 N -3.23 1.97 0.00 0.95 -5.35 -1.26 -4.39 119.36 108.05 1f91 n ILE 15 Ca -0.02 -1.75 0.00 0.00 -0.27 0.00 0.00 62.75 60.70 1f91 n ILE 15 Cb 0.13 -0.10 0.00 0.00 -1.74 0.00 0.00 39.64 37.93 1f91 n ILE 15 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1f91 n GLY 16 N -0.47 3.53 1.20 3.28 0.00 -0.98 -3.89 105.19 107.86 1f91 n GLY 16 Ca 0.18 -0.32 0.11 0.00 0.00 0.00 0.00 46.02 45.99 1f91 n GLY 16 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1f91 n ASN 17 N 0.00 3.50 -3.67 1.61 3.02 -1.26 -0.61 115.26 117.85 1f91 n ASN 17 Ca 0.00 -1.99 -0.05 0.00 -0.03 0.00 0.00 54.58 52.52 1f91 n ASN 17 Cb 0.00 -0.40 -0.01 0.00 -0.61 0.00 0.00 39.78 38.76 1f91 n ASN 17 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1f91 s ASN 18 N -1.12 -0.23 0.52 6.41 2.20 -1.19 -4.64 114.94 116.89 1f91 s ASN 18 Ca 0.43 -0.27 0.17 0.00 -0.94 0.00 0.00 52.86 52.25 1f91 s ASN 18 Cb 0.23 0.44 1.29 0.00 -2.00 0.00 0.00 41.25 41.21 1f91 s ASN 18 CO 0.31 -0.78 2.15 0.06 -2.94 0.00 0.00 177.10 175.89 1f91 h GLN 19 N 2.00 0.00 0.37 3.55 3.07 -1.92 -1.71 115.11 120.47 1f91 h GLN 19 Ca -0.24 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.48 1f91 h GLN 19 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.80 1f91 h GLN 19 CO 0.27 0.00 -0.18 1.96 0.09 0.00 0.00 178.83 180.97 1f91 h GLN 20 N 0.00 -0.48 -0.55 0.06 7.50 -1.98 0.13 115.11 119.78 1f91 h GLN 20 Ca 0.00 0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.19 1f91 h GLN 20 Cb 0.02 0.11 -0.03 0.00 0.05 0.00 0.00 27.48 27.63 1f91 h GLN 20 CO -0.00 -0.19 0.34 0.93 -1.50 0.00 0.00 178.83 178.41 1f91 h GLU 21 N -0.76 0.73 -0.52 1.46 5.08 -1.84 -1.47 114.58 117.27 1f91 h GLU 21 Ca -0.05 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.15 1f91 h GLU 21 Cb 0.51 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 1f91 h GLU 21 CO 0.08 0.50 -0.10 0.28 -1.00 0.00 0.00 179.01 178.77 1f91 h VAL 22 N 0.75 1.27 -0.80 3.13 2.07 -1.19 -2.30 116.25 119.18 1f91 h VAL 22 Ca 0.20 -1.25 0.07 0.00 0.82 0.00 0.00 66.70 66.54 1f91 h VAL 22 Cb -0.05 1.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.66 1f91 h VAL 22 CO -0.04 0.44 0.48 0.25 0.02 0.00 0.00 177.57 178.71 1f91 h LEU 23 N 0.85 0.73 0.85 2.57 5.85 0.30 -0.40 115.31 126.06 1f91 h LEU 23 Ca 0.13 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.84 1f91 h LEU 23 Cb 0.66 -0.12 0.01 0.00 0.37 0.00 0.00 40.66 41.58 1f91 h LEU 23 CO 0.05 0.46 -0.41 0.00 -0.34 0.00 0.00 178.44 178.20 1f91 h ALA 24 N 1.40 -1.14 -0.70 1.25 0.00 -1.23 -1.76 119.26 117.08 1f91 h ALA 24 Ca 0.36 -0.25 0.15 0.00 0.00 0.00 0.00 54.91 55.16 1f91 h ALA 24 Cb 0.21 0.44 -0.13 0.00 0.00 0.00 0.00 17.79 18.31 1f91 h ALA 24 CO -0.19 -1.07 -0.09 0.77 0.00 0.00 0.00 179.25 178.67 1f91 h SER 25 N -1.28 -0.50 -0.19 0.00 0.02 -1.15 0.13 113.55 110.59 1f91 h SER 25 Ca -0.12 0.20 0.01 0.00 -0.84 0.00 0.00 61.79 61.04 1f91 h SER 25 Cb 0.88 0.38 -0.01 0.00 0.14 0.00 0.00 62.40 63.79 1f91 h SER 25 CO 0.19 -0.20 0.11 -0.07 -1.14 0.00 0.00 176.83 175.72 1f91 h LEU 26 N 0.05 0.17 -1.25 5.07 3.38 -1.00 0.26 115.31 121.99 1f91 h LEU 26 Ca 0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.33 1f91 h LEU 26 Cb 0.58 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 1f91 h LEU 26 CO -0.67 0.13 0.44 0.03 0.09 0.00 0.00 178.44 178.46 1f91 h ARG 27 N 0.23 0.95 -0.01 1.13 3.08 -0.31 -2.67 114.38 116.78 1f91 h ARG 27 Ca 0.07 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1f91 h ARG 27 Cb -0.00 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.84 1f91 h ARG 27 CO -0.04 0.65 -0.28 0.39 -1.07 0.00 0.00 179.97 179.63 1f91 n GLU 28 N -4.41 0.79 -3.51 0.04 1.02 -0.08 -4.71 120.64 109.79 1f91 n GLU 28 Ca 0.07 -0.47 -0.22 0.00 -0.02 0.00 0.00 57.16 56.52 1f91 n GLU 28 Cb 0.06 -1.49 0.08 0.00 -0.02 0.00 0.00 31.44 30.06 1f91 n GLU 28 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1f91 n GLY 29 N 1.35 -0.44 3.79 0.62 0.00 0.83 -4.97 105.19 106.37 1f91 n GLY 29 Ca 0.12 0.19 -0.39 0.00 0.00 0.00 0.00 46.02 45.93 1f91 n GLY 29 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1f91 s ARG 30 N -6.11 4.26 0.28 1.61 3.52 -0.68 -5.00 118.95 116.83 1f91 s ARG 30 Ca 0.48 0.75 -0.19 0.00 -0.13 0.00 0.00 55.73 56.64 1f91 s ARG 30 Cb -0.21 -3.28 -0.09 0.00 -1.56 0.00 0.00 34.95 29.81 1f91 s ARG 30 CO 0.69 0.53 0.78 0.45 -0.81 0.00 0.00 175.30 176.93 1f91 s SER 31 N -0.75 7.02 0.00 -2.12 0.15 -1.26 -4.80 113.70 111.93 1f91 s SER 31 Ca 0.30 1.47 0.15 0.00 0.70 0.00 0.00 55.95 58.56 1f91 s SER 31 Cb -0.19 -2.44 0.28 0.00 -1.71 0.00 0.00 66.02 61.95 1f91 s SER 31 CO 0.19 -0.08 1.17 0.61 1.20 0.00 0.00 173.24 176.33 1f91 n GLY 32 N 0.30 1.48 3.73 9.45 0.00 0.33 -4.96 105.19 115.53 1f91 n GLY 32 Ca 0.01 -0.47 -0.41 0.00 0.00 0.00 0.00 46.02 45.15 1f91 n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1f91 s ILE 33 N -1.11 4.58 0.31 -0.61 -1.09 -1.26 -4.01 121.20 118.01 1f91 s ILE 33 Ca 0.25 1.95 0.04 0.00 -2.23 0.00 0.00 60.65 60.65 1f91 s ILE 33 Cb 0.14 -4.26 -0.03 0.00 -1.58 0.00 0.00 42.46 36.72 1f91 s ILE 33 CO 0.20 0.32 0.19 0.42 -1.23 0.00 0.00 174.94 174.84 1f91 s THR 34 N 0.03 0.21 0.17 2.92 -4.23 -0.69 -4.13 115.64 109.91 1f91 s THR 34 Ca 0.45 -2.00 -0.27 0.00 -1.18 0.00 0.00 61.69 58.68 1f91 s THR 34 Cb -0.22 -2.49 -0.08 0.00 1.34 0.00 0.00 72.50 71.05 1f91 s THR 34 CO 0.28 0.00 0.85 0.12 -0.54 0.00 0.00 174.62 175.33 1f91 s PHE 35 N -3.60 3.90 -0.32 3.99 5.36 -1.26 -2.21 117.98 123.84 1f91 s PHE 35 Ca 0.37 1.73 -0.04 0.00 -0.96 0.00 0.00 56.93 58.03 1f91 s PHE 35 Cb 0.04 -2.88 0.05 0.00 -0.34 0.00 0.00 43.02 39.89 1f91 s PHE 35 CO 0.19 0.43 0.05 0.45 -1.46 0.00 0.00 175.22 174.88 1f91 s SER 36 N -0.87 5.08 0.23 6.13 0.15 0.39 -4.91 113.70 119.90 1f91 s SER 36 Ca 0.39 -1.23 -0.06 0.00 0.70 0.00 0.00 55.95 55.75 1f91 s SER 36 Cb -0.24 -1.78 0.22 0.00 -1.71 0.00 0.00 66.02 62.51 1f91 s SER 36 CO 0.28 -0.29 1.79 -0.61 1.20 0.00 0.00 173.24 175.61 1f91 h GLN 37 N 8.09 1.11 -0.49 5.44 5.75 -1.96 -2.65 115.11 130.40 1f91 h GLN 37 Ca -0.22 -0.21 0.06 0.00 -0.15 0.00 0.00 58.65 58.13 1f91 h GLN 37 Cb 1.07 -0.18 -0.05 0.00 1.07 0.00 0.00 27.48 29.39 1f91 h GLN 37 CO 0.56 0.91 0.20 1.49 -2.65 0.00 0.00 178.83 179.35 1f91 h GLU 38 N 1.08 0.39 -0.45 1.69 4.81 -1.96 -0.05 114.58 120.08 1f91 h GLU 38 Ca 0.24 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.43 1f91 h GLU 38 Cb 0.24 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 1f91 h GLU 38 CO -0.02 0.26 0.19 -0.07 -0.73 0.00 0.00 179.01 178.64 1f91 h LEU 39 N 0.40 0.61 -0.20 1.64 3.38 -1.83 -1.59 115.31 117.72 1f91 h LEU 39 Ca 0.23 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1f91 h LEU 39 Cb 0.21 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1f91 h LEU 39 CO -0.21 0.60 0.11 0.50 0.09 0.00 0.00 178.44 179.54 1f91 h LYS 40 N 0.58 0.28 0.00 1.13 3.64 -1.10 -2.58 116.57 118.53 1f91 h LYS 40 Ca 0.15 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 1f91 h LYS 40 Cb 0.18 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1f91 h LYS 40 CO -0.01 0.27 -0.11 -0.44 -2.27 0.00 0.00 179.45 176.89 1f91 h ASP 41 N 0.22 0.00 0.87 4.20 3.32 -0.86 -1.85 116.42 122.31 1f91 h ASP 41 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1f91 h ASP 41 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 1f91 h ASP 41 CO -0.01 0.11 0.00 0.77 -1.72 0.00 0.00 179.24 178.39 1f91 h SER 42 N 0.00 0.00 0.00 6.45 4.64 -0.89 -3.46 113.55 120.30 1f91 h SER 42 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1f91 h SER 42 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1f91 h SER 42 CO 0.01 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 1f91 n GLY 43 N -0.09 0.97 3.79 -0.77 0.00 -0.70 -5.10 105.19 103.29 1f91 n GLY 43 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1f91 n GLY 43 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1f91 s MET 44 N -0.77 2.12 -0.07 1.61 -1.94 -1.12 -4.99 119.30 114.14 1f91 s MET 44 Ca 0.00 0.77 0.15 0.00 -1.71 0.00 0.00 55.69 54.90 1f91 s MET 44 Cb 0.00 -1.91 -0.22 0.00 2.01 0.00 0.00 34.83 34.70 1f91 s MET 44 CO 0.00 -1.63 0.52 0.54 -0.01 0.00 0.00 175.02 174.45 1f91 n ARG 45 N -3.46 0.65 -3.07 2.03 1.74 -1.26 -4.74 116.66 108.54 1f91 n ARG 45 Ca 0.07 0.19 -0.40 0.00 -0.77 0.00 0.00 57.85 56.94 1f91 n ARG 45 Cb 0.55 -1.72 -0.05 0.00 -1.02 0.00 0.00 32.46 30.22 1f91 n ARG 45 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1f91 s SER 46 N -5.85 6.75 -0.15 0.55 0.15 -1.26 -4.75 113.70 109.14 1f91 s SER 46 Ca -0.06 0.92 0.17 0.00 0.70 0.00 0.00 55.95 57.68 1f91 s SER 46 Cb 0.08 -2.37 0.36 0.00 -1.71 0.00 0.00 66.02 62.37 1f91 s SER 46 CO 0.83 -0.29 1.22 1.41 1.20 0.00 0.00 173.24 177.61 1f91 n HIS 47 N 5.02 0.22 -4.37 3.44 8.25 -1.26 -4.57 115.22 121.96 1f91 n HIS 47 Ca -0.00 -1.06 -0.23 0.00 -0.26 0.00 0.00 57.72 56.18 1f91 n HIS 47 Cb 0.50 -0.21 -0.11 0.00 1.12 0.00 0.00 29.99 31.29 1f91 n HIS 47 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1f91 s VAL 48 N -2.93 1.98 0.06 1.59 -7.23 -1.26 -0.46 120.40 112.16 1f91 s VAL 48 Ca 0.35 -2.02 -0.27 0.00 -1.81 0.00 0.00 61.98 58.23 1f91 s VAL 48 Cb 0.31 -1.97 0.09 0.00 0.56 0.00 0.00 36.38 35.37 1f91 s VAL 48 CO 0.03 -0.31 0.80 -1.66 -0.31 0.00 0.00 175.10 173.65 1f91 s TRP 49 N -2.12 -0.38 -0.72 2.82 -2.14 -0.94 -4.52 118.94 110.94 1f91 s TRP 49 Ca 0.19 0.21 -0.13 0.00 2.66 0.00 0.00 56.10 59.02 1f91 s TRP 49 Cb -0.06 0.56 0.19 0.00 -3.10 0.00 0.00 33.47 31.06 1f91 s TRP 49 CO 0.08 -0.67 0.65 0.20 -2.66 0.00 0.00 176.95 174.55 1f91 s GLY 50 N -2.60 2.48 0.31 3.67 0.00 -0.69 -1.70 107.32 108.79 1f91 s GLY 50 Ca 0.04 -3.09 -0.03 0.00 0.00 0.00 0.00 44.72 41.64 1f91 s GLY 50 CO -0.09 1.22 0.56 0.54 0.00 0.00 0.00 173.10 175.33 1f91 s ASN 51 N 2.39 6.39 -0.31 1.64 6.03 -1.26 -2.22 114.94 127.61 1f91 s ASN 51 Ca 0.14 0.64 -0.28 0.00 -1.03 0.00 0.00 52.86 52.33 1f91 s ASN 51 Cb -0.17 -2.11 0.01 0.00 -3.03 0.00 0.00 41.25 35.95 1f91 s ASN 51 CO -0.05 -0.24 1.00 -0.69 -2.03 0.00 0.00 177.10 175.09 1f91 s VAL 52 N -2.18 4.60 -1.33 3.54 1.01 -1.26 -4.00 120.40 120.79 1f91 s VAL 52 Ca 0.43 1.63 -0.12 0.00 0.00 0.00 0.00 61.98 63.92 1f91 s VAL 52 Cb -0.10 -4.34 0.12 0.00 0.00 0.00 0.00 36.38 32.06 1f91 s VAL 52 CO 0.33 -0.39 1.91 0.29 0.00 0.00 0.00 175.10 177.24 1f91 n LYS 53 N 6.63 3.32 -3.63 2.72 4.76 -1.26 -4.87 118.16 125.83 1f91 n LYS 53 Ca 0.10 -3.27 -0.11 0.00 -2.87 0.00 0.00 58.31 52.16 1f91 n LYS 53 Cb 0.47 -3.10 -0.07 0.00 -1.84 0.00 0.00 35.03 30.49 1f91 n LYS 53 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1f91 s LEU 54 N 1.17 -0.84 -0.42 -0.35 2.96 -1.26 -4.94 118.68 115.00 1f91 s LEU 54 Ca 0.43 1.48 -0.21 0.00 -0.22 0.00 0.00 54.13 55.62 1f91 s LEU 54 Cb 0.09 2.43 0.02 0.00 0.50 0.00 0.00 46.19 49.23 1f91 s LEU 54 CO -0.02 -0.25 0.64 -0.62 -1.32 0.00 0.00 176.35 174.79 1f91 s ASP 55 N 0.97 6.34 0.03 3.68 2.15 -1.26 -4.91 116.67 123.67 1f91 s ASP 55 Ca -0.05 -0.25 0.29 0.00 0.43 0.00 0.00 52.55 52.97 1f91 s ASP 55 Cb -0.05 -2.32 1.18 0.00 -0.30 0.00 0.00 42.92 41.43 1f91 s ASP 55 CO -0.09 -0.75 1.91 0.35 -0.17 0.00 0.00 175.17 176.42 1f91 n THR 56 N 5.81 0.08 -1.53 1.71 -2.24 -1.26 -4.87 114.28 111.98 1f91 n THR 56 Ca -0.01 -0.04 -0.56 0.00 -2.27 0.00 0.00 64.05 61.17 1f91 n THR 56 Cb 0.48 -0.51 -0.07 0.00 -2.10 0.00 0.00 70.33 68.13 1f91 n THR 56 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1f91 n THR 57 N -1.60 0.16 -0.83 4.28 -1.04 -1.26 -0.98 114.28 113.01 1f91 n THR 57 Ca 0.07 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 1f91 n THR 57 Cb 0.35 -0.31 0.00 0.00 -1.82 0.00 0.00 70.33 68.55 1f91 n THR 57 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1f91 n GLY 58 N 1.88 0.11 0.01 3.41 0.00 -1.26 -4.81 105.19 104.53 1f91 n GLY 58 Ca 0.19 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.35 1f91 n GLY 58 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1f91 n LEU 59 N 0.00 0.19 -3.99 0.99 4.77 -0.15 -4.79 117.00 114.02 1f91 n LEU 59 Ca 0.00 0.41 -0.17 0.00 -0.03 0.00 0.00 56.01 56.22 1f91 n LEU 59 Cb 0.25 -0.43 -0.14 0.00 -2.33 0.00 0.00 43.42 40.77 1f91 n LEU 59 CO 0.00 0.00 -0.42 -0.63 -1.33 0.00 0.00 177.39 175.02 1f91 s ILE 60 N -3.01 0.55 0.27 -0.08 1.01 -1.26 -5.08 121.20 113.60 1f91 s ILE 60 Ca 0.13 -0.33 -0.30 0.00 0.00 0.00 0.00 60.65 60.15 1f91 s ILE 60 Cb 0.18 -0.47 -0.13 0.00 0.01 0.00 0.00 42.46 42.05 1f91 s ILE 60 CO 0.57 0.14 1.30 -0.67 0.00 0.00 0.00 174.94 176.29 1f91 n ASP 61 N 2.86 2.49 -0.34 3.58 2.03 -1.26 -4.67 116.55 121.23 1f91 n ASP 61 Ca -0.13 1.17 0.08 0.00 0.52 0.00 0.00 54.79 56.42 1f91 n ASP 61 Cb 0.57 -1.42 0.25 0.00 -0.72 0.00 0.00 41.12 39.81 1f91 n ASP 61 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 1f91 h ARG 62 N 3.35 0.84 0.00 -0.67 3.08 -1.98 0.83 114.38 119.83 1f91 h ARG 62 Ca -0.45 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 59.51 1f91 h ARG 62 Cb 1.29 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 31.14 1f91 h ARG 62 CO 0.69 0.55 -0.22 0.87 -1.07 0.00 0.00 179.97 180.80 1f91 h LYS 63 N 0.86 0.00 0.04 0.04 1.79 -2.02 -3.02 116.57 114.26 1f91 h LYS 63 Ca 0.50 0.00 -0.28 0.00 -2.18 0.00 0.00 60.65 58.69 1f91 h LYS 63 Cb 0.59 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.21 1f91 h LYS 63 CO -0.31 0.22 -1.50 0.28 -1.08 0.00 0.00 179.45 177.06 1f91 n VAL 64 N -3.88 1.61 0.30 0.50 0.31 -0.29 -4.35 118.33 112.53 1f91 n VAL 64 Ca -0.02 -0.22 0.16 0.00 -0.01 0.00 0.00 64.34 64.25 1f91 n VAL 64 Cb 0.31 -1.95 0.73 0.00 -0.91 0.00 0.00 33.84 32.02 1f91 n VAL 64 CO 0.00 0.00 0.00 1.62 -1.32 0.00 0.00 176.83 177.13 1f91 h VAL 65 N -0.68 0.00 0.00 2.52 3.04 -0.96 -3.00 116.25 117.16 1f91 h VAL 65 Ca -0.38 -0.23 0.00 0.00 -1.01 0.00 0.00 66.70 65.09 1f91 h VAL 65 Cb 1.53 1.05 0.00 0.00 -2.01 0.00 0.00 31.29 31.86 1f91 h VAL 65 CO -0.13 0.00 0.00 0.08 -1.01 0.00 0.00 177.57 176.51 1f91 h ARG 66 N 0.00 0.00 -0.01 4.17 0.11 -1.72 -1.83 114.38 115.10 1f91 h ARG 66 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1f91 h ARG 66 Cb 0.26 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.34 1f91 h ARG 66 CO 0.00 0.00 -0.55 1.19 0.10 0.00 0.00 179.97 180.71 1f91 n PHE 67 N -2.98 0.00 -3.76 4.08 3.01 -1.13 -4.85 117.46 111.83 1f91 n PHE 67 Ca -0.01 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.13 1f91 n PHE 67 Cb 0.18 -0.10 -0.05 0.00 -0.01 0.00 0.00 39.48 39.51 1f91 n PHE 67 CO 0.00 0.00 0.00 -1.64 1.01 0.00 0.00 176.76 176.13 1f91 s MET 68 N -2.75 3.56 0.47 -1.08 -1.94 -0.69 -3.30 119.30 113.57 1f91 s MET 68 Ca 0.16 -0.19 0.08 0.00 -1.71 0.00 0.00 55.69 54.02 1f91 s MET 68 Cb 0.18 -2.94 0.01 0.00 2.01 0.00 0.00 34.83 34.09 1f91 s MET 68 CO 0.66 0.54 0.50 -1.54 -0.01 0.00 0.00 175.02 175.17 1f91 s SER 69 N -2.34 5.12 0.27 3.03 1.04 -1.26 -4.93 113.70 114.64 1f91 s SER 69 Ca 0.37 -0.77 -0.04 0.00 0.48 0.00 0.00 55.95 55.99 1f91 s SER 69 Cb -0.13 -0.28 0.35 0.00 0.10 0.00 0.00 66.02 66.07 1f91 s SER 69 CO 0.24 -0.87 1.95 0.44 0.98 0.00 0.00 173.24 175.98 1f91 h ASP 70 N 0.75 1.05 -0.74 7.02 3.32 -1.93 -1.79 116.42 124.10 1f91 h ASP 70 Ca -0.38 -0.03 0.08 0.00 0.02 0.00 0.00 57.03 56.72 1f91 h ASP 70 Cb 1.28 -0.26 -0.07 0.00 0.22 0.00 0.00 39.33 40.50 1f91 h ASP 70 CO 0.52 0.76 0.40 0.00 -1.72 0.00 0.00 179.24 179.20 1f91 h ALA 71 N 1.43 1.02 -0.47 3.45 0.00 -1.87 0.19 119.26 123.01 1f91 h ALA 71 Ca 0.34 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.18 1f91 h ALA 71 Cb -0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1f91 h ALA 71 CO -0.08 0.04 -0.12 0.77 0.00 0.00 0.00 179.25 179.87 1f91 h SER 72 N 0.70 0.87 -0.33 0.00 0.02 -1.76 -1.60 113.55 111.45 1f91 h SER 72 Ca 0.35 -0.27 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 1f91 h SER 72 Cb 0.30 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.59 1f91 h SER 72 CO -0.23 1.00 0.12 0.40 -1.14 0.00 0.00 176.83 176.98 1f91 h ILE 73 N 0.78 1.20 -0.42 3.27 2.04 -0.45 0.13 117.51 124.06 1f91 h ILE 73 Ca 0.13 -0.62 -0.02 0.00 1.00 0.00 0.00 64.86 65.34 1f91 h ILE 73 Cb 0.63 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 1f91 h ILE 73 CO 0.04 0.21 0.17 1.88 0.00 0.00 0.00 178.15 180.45 1f91 h TYR 74 N 0.39 0.64 -0.60 1.37 0.05 -0.86 -0.75 116.97 117.21 1f91 h TYR 74 Ca 0.11 -0.05 -0.06 0.00 0.05 0.00 0.00 58.73 58.79 1f91 h TYR 74 Cb 0.22 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 37.74 1f91 h TYR 74 CO 0.00 0.56 0.16 0.00 -1.05 0.00 0.00 178.16 177.83 1f91 h ALA 75 N 1.01 0.79 -0.16 3.88 0.00 -1.18 -1.64 119.26 121.95 1f91 h ALA 75 Ca 0.14 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1f91 h ALA 75 Cb 0.19 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1f91 h ALA 75 CO -0.01 0.48 0.10 0.35 0.00 0.00 0.00 179.25 180.17 1f91 h PHE 76 N 0.86 0.21 -0.88 0.00 3.57 -0.50 0.06 116.94 120.28 1f91 h PHE 76 Ca 0.19 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 1f91 h PHE 76 Cb 0.33 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.96 1f91 h PHE 76 CO 0.02 0.16 0.51 -0.07 -2.23 0.00 0.00 178.31 176.71 1f91 h LEU 77 N 0.20 1.06 -1.29 0.59 3.38 -1.03 -1.87 115.31 116.35 1f91 h LEU 77 Ca 0.06 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1f91 h LEU 77 Cb 0.01 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1f91 h LEU 77 CO -0.01 0.83 -0.26 0.28 0.09 0.00 0.00 178.44 179.36 1f91 h SER 78 N 1.21 0.15 -0.18 -0.43 0.02 -0.78 -2.72 113.55 110.82 1f91 h SER 78 Ca 0.31 -0.04 -0.21 0.00 -0.84 0.00 0.00 61.79 61.01 1f91 h SER 78 Cb -0.03 -0.04 0.01 0.00 0.14 0.00 0.00 62.40 62.48 1f91 h SER 78 CO -0.06 0.41 -0.72 -0.03 -1.14 0.00 0.00 176.83 175.30 1f91 h MET 79 N 0.14 0.82 -0.51 3.45 1.85 -0.23 -1.15 114.93 119.29 1f91 h MET 79 Ca 0.02 -0.63 0.05 0.00 -0.61 0.00 0.00 59.70 58.54 1f91 h MET 79 Cb 0.54 0.12 -0.05 0.00 0.43 0.00 0.00 31.60 32.64 1f91 h MET 79 CO 0.04 1.24 0.25 0.93 -0.40 0.00 0.00 176.91 178.97 1f91 h GLU 80 N 0.58 0.47 -0.34 0.39 5.08 -1.17 0.15 114.58 119.73 1f91 h GLU 80 Ca -0.04 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1f91 h GLU 80 Cb 1.35 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.47 1f91 h GLU 80 CO 0.15 0.31 0.23 1.96 -1.00 0.00 0.00 179.01 180.65 1f91 h GLN 81 N 0.48 0.45 -0.67 2.33 4.20 -1.41 -2.20 115.11 118.28 1f91 h GLN 81 Ca 0.23 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.86 1f91 h GLN 81 Cb 0.16 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 1f91 h GLN 81 CO -0.18 0.30 0.20 0.00 -0.67 0.00 0.00 178.83 178.49 1f91 h ALA 82 N 1.12 1.09 -0.31 3.87 0.00 -0.40 -0.01 119.26 124.63 1f91 h ALA 82 Ca 0.13 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1f91 h ALA 82 Cb -0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1f91 h ALA 82 CO -0.03 0.62 0.09 0.82 0.00 0.00 0.00 179.25 180.75 1f91 h ILE 83 N 0.99 1.21 -0.34 0.00 2.04 -0.55 -0.72 117.51 120.14 1f91 h ILE 83 Ca 0.22 -0.68 -0.06 0.00 1.00 0.00 0.00 64.86 65.34 1f91 h ILE 83 Cb 0.29 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1f91 h ILE 83 CO -0.01 0.23 -0.02 0.00 0.00 0.00 0.00 178.15 178.35 1f91 h ALA 84 N 0.92 0.46 0.00 1.87 0.00 -1.24 -2.37 119.26 118.90 1f91 h ALA 84 Ca 0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1f91 h ALA 84 Cb 0.26 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1f91 h ALA 84 CO -0.00 0.24 -0.09 0.22 0.00 0.00 0.00 179.25 179.62 1f91 h ASP 85 N 0.42 0.00 0.27 0.00 3.58 -0.90 -1.70 116.42 118.08 1f91 h ASP 85 Ca 0.09 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.54 1f91 h ASP 85 Cb 0.48 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.53 1f91 h ASP 85 CO 0.02 0.09 -0.24 0.00 -2.88 0.00 0.00 179.24 176.23 1f91 n ALA 86 N -2.22 3.03 -2.01 -0.78 0.00 -0.29 -4.71 120.51 113.54 1f91 n ALA 86 Ca -0.01 -0.38 -0.12 0.00 0.00 0.00 0.00 53.44 52.93 1f91 n ALA 86 Cb 0.23 -1.17 -0.02 0.00 0.00 0.00 0.00 19.45 18.50 1f91 n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1f91 n GLY 87 N 1.34 0.23 3.87 0.00 0.00 -0.64 -4.79 105.19 105.19 1f91 n GLY 87 Ca 0.12 -0.42 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1f91 n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1f91 s LEU 88 N -3.17 4.36 0.20 0.99 1.43 -0.92 -5.06 118.68 116.51 1f91 s LEU 88 Ca 0.00 0.72 0.09 0.00 -1.03 0.00 0.00 54.13 53.91 1f91 s LEU 88 Cb 0.00 -2.86 -0.04 0.00 0.03 0.00 0.00 46.19 43.32 1f91 s LEU 88 CO 0.00 0.21 -0.11 -0.44 0.23 0.00 0.00 176.35 176.23 1f91 s SER 89 N -1.71 4.12 0.30 2.29 0.01 -1.26 -4.66 113.70 112.79 1f91 s SER 89 Ca 0.31 -0.65 0.02 0.00 1.31 0.00 0.00 55.95 56.94 1f91 s SER 89 Cb -0.14 -0.64 0.76 0.00 0.21 0.00 0.00 66.02 66.21 1f91 s SER 89 CO 0.17 0.09 1.53 -2.65 0.41 0.00 0.00 173.24 172.79 1f91 n PRO 90 N -0.04 -0.08 0.20 12.44 -0.02 -1.26 0.99 135.00 147.23 1f91 n PRO 90 Ca -0.10 1.46 0.17 0.00 -2.02 0.00 0.00 63.50 63.00 1f91 n PRO 90 Cb 0.56 -2.32 0.81 0.00 -0.02 0.00 0.00 33.50 32.53 1f91 n PRO 90 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1f91 h GLU 91 N 0.00 0.00 0.00 -0.52 9.09 -1.96 0.56 114.58 121.75 1f91 h GLU 91 Ca 0.60 0.00 -0.16 0.00 0.05 0.00 0.00 59.36 59.85 1f91 h GLU 91 Cb 1.24 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 28.31 1f91 h GLU 91 CO -0.91 0.00 -1.08 0.00 0.05 0.00 0.00 179.01 177.07 1f91 h ALA 92 N 1.78 0.64 0.00 1.06 0.00 0.24 -3.40 119.26 119.57 1f91 h ALA 92 Ca 0.09 -0.76 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1f91 h ALA 92 Cb 0.49 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1f91 h ALA 92 CO -0.00 0.89 -0.34 2.48 0.00 0.00 0.00 179.25 182.28 1f91 n TYR 93 N -3.06 0.00 -3.08 0.00 0.18 -0.98 -4.94 117.16 105.28 1f91 n TYR 93 Ca -0.05 0.00 -0.39 0.00 1.88 0.00 0.00 57.90 59.34 1f91 n TYR 93 Cb 0.83 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.73 1f91 n TYR 93 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 1f91 s GLN 94 N -1.22 4.42 -1.50 -3.48 -0.21 0.15 -4.03 119.66 113.78 1f91 s GLN 94 Ca 0.00 1.00 -0.13 0.00 0.02 0.00 0.00 55.36 56.25 1f91 s GLN 94 Cb 0.00 -3.20 0.09 0.00 1.00 0.00 0.00 33.01 30.91 1f91 s GLN 94 CO 0.00 0.56 0.78 0.09 -2.12 0.00 0.00 175.29 174.60 1f91 n ASN 95 N 1.49 -4.28 -4.16 5.90 3.02 0.63 -4.88 115.26 112.99 1f91 n ASN 95 Ca -0.06 -0.68 -0.34 0.00 -0.03 0.00 0.00 54.58 53.46 1f91 n ASN 95 Cb 0.50 -3.47 -0.15 0.00 -0.61 0.00 0.00 39.78 36.05 1f91 n ASN 95 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1f91 s ASN 96 N -3.09 4.35 0.59 6.41 3.84 -1.26 -4.93 114.94 120.86 1f91 s ASN 96 Ca 0.59 -1.06 0.29 0.00 0.21 0.00 0.00 52.86 52.89 1f91 s ASN 96 Cb -0.30 -1.63 1.68 0.00 -0.55 0.00 0.00 41.25 40.45 1f91 s ASN 96 CO 0.73 -0.16 2.10 -0.65 -2.79 0.00 0.00 177.10 176.33 1f91 h PRO 97 N 7.94 0.00 -0.08 0.43 0.11 -1.92 -1.34 132.00 137.14 1f91 h PRO 97 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1f91 h PRO 97 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1f91 h PRO 97 CO 0.54 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.87 1f91 n ARG 98 N -3.74 1.49 -4.60 1.05 5.12 -1.26 -3.85 116.66 110.87 1f91 n ARG 98 Ca 0.01 -0.73 -0.33 0.00 -1.93 0.00 0.00 57.85 54.87 1f91 n ARG 98 Cb 0.32 -1.41 -0.16 0.00 -1.16 0.00 0.00 32.46 30.05 1f91 n ARG 98 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1f91 s VAL 99 N -1.91 2.17 0.18 1.55 1.01 -0.51 -0.51 120.40 122.38 1f91 s VAL 99 Ca 0.35 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.40 1f91 s VAL 99 Cb 0.18 -1.88 -0.01 0.00 0.00 0.00 0.00 36.38 34.67 1f91 s VAL 99 CO 0.28 0.54 0.05 0.61 0.00 0.00 0.00 175.10 176.59 1f91 n GLY 100 N 4.11 3.77 2.99 4.51 0.00 -0.49 -0.76 105.19 119.33 1f91 n GLY 100 Ca -0.20 -2.04 -0.13 0.00 0.00 0.00 0.00 46.02 43.65 1f91 n GLY 100 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1f91 s LEU 101 N 0.00 0.33 -0.30 0.99 0.20 -0.43 -0.65 118.68 118.81 1f91 s LEU 101 Ca 0.07 0.46 -0.01 0.00 0.69 0.00 0.00 54.13 55.35 1f91 s LEU 101 Cb 0.00 0.59 0.10 0.00 -0.43 0.00 0.00 46.19 46.45 1f91 s LEU 101 CO 0.05 -0.18 0.09 -0.63 -0.29 0.00 0.00 176.35 175.39 1f91 s ILE 102 N 1.51 0.91 0.00 6.68 1.01 0.28 -2.98 121.20 128.61 1f91 s ILE 102 Ca -0.07 -1.38 -0.05 0.00 0.00 0.00 0.00 60.65 59.15 1f91 s ILE 102 Cb -0.11 -1.67 -0.00 0.00 0.01 0.00 0.00 42.46 40.69 1f91 s ILE 102 CO -0.08 -0.64 0.09 0.00 0.00 0.00 0.00 174.94 174.31 1f91 s ALA 103 N 1.61 -0.21 0.23 9.38 0.00 -1.18 -2.83 121.76 128.76 1f91 s ALA 103 Ca 0.09 -0.22 -0.05 0.00 0.00 0.00 0.00 51.96 51.78 1f91 s ALA 103 Cb -0.17 0.10 0.02 0.00 0.00 0.00 0.00 23.12 23.07 1f91 s ALA 103 CO -0.24 -0.18 0.40 0.41 0.00 0.00 0.00 175.76 176.15 1f91 n GLY 104 N 1.61 1.90 3.26 0.00 0.00 -1.08 -3.68 105.19 107.19 1f91 n GLY 104 Ca -0.22 -1.33 -0.14 0.00 0.00 0.00 0.00 46.02 44.33 1f91 n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1f91 s SER 105 N -2.30 1.07 -0.00 1.61 1.04 -1.26 -2.04 113.70 111.82 1f91 s SER 105 Ca 0.14 -1.26 -0.00 0.00 0.48 0.00 0.00 55.95 55.30 1f91 s SER 105 Cb -0.02 0.16 -0.26 0.00 0.10 0.00 0.00 66.02 66.00 1f91 s SER 105 CO 0.10 -0.65 0.83 1.23 0.98 0.00 0.00 173.24 175.72 1f91 h GLY 106 N 2.60 0.22 0.00 7.32 0.00 -1.83 -3.41 103.07 107.96 1f91 h GLY 106 Ca -0.37 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 46.40 1f91 h GLY 106 CO 0.61 0.49 0.00 0.61 0.00 0.00 0.00 176.54 178.25 1f91 n GLY 107 N 1.65 0.35 7.00 4.60 0.00 -1.26 -4.75 105.19 112.77 1f91 n GLY 107 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1f91 n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f91 n GLY 108 N -0.20 1.57 2.59 -0.02 0.00 -1.26 -4.02 105.19 103.86 1f91 n GLY 108 Ca 0.00 -0.01 -0.17 0.00 0.00 0.00 0.00 46.02 45.84 1f91 n GLY 108 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1f91 s SER 109 N -4.00 0.33 0.34 1.61 0.15 -1.26 -4.70 113.70 106.16 1f91 s SER 109 Ca 0.00 -2.32 0.05 0.00 0.70 0.00 0.00 55.95 54.37 1f91 s SER 109 Cb 0.00 0.58 0.68 0.00 -1.71 0.00 0.00 66.02 65.57 1f91 s SER 109 CO 0.00 -0.14 1.91 -0.65 1.20 0.00 0.00 173.24 175.56 1f91 h PRO 110 N 5.67 0.82 -0.39 5.44 0.11 -1.92 -1.65 132.00 140.07 1f91 h PRO 110 Ca 0.16 -0.05 0.05 0.00 0.11 0.00 0.00 66.00 66.27 1f91 h PRO 110 Cb 1.01 -0.18 -0.05 0.00 0.11 0.00 0.00 31.00 31.89 1f91 h PRO 110 CO 0.21 0.54 0.11 -0.09 -0.21 0.00 0.00 178.00 178.56 1f91 h ARG 111 N 0.84 0.24 0.00 1.05 2.43 -1.93 -1.22 114.38 115.79 1f91 h ARG 111 Ca 0.39 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.54 1f91 h ARG 111 Cb 0.38 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1f91 h ARG 111 CO -0.15 0.16 -0.22 0.74 -1.51 0.00 0.00 179.97 178.98 1f91 h PHE 112 N 0.25 0.00 -0.40 2.20 -1.00 -1.81 -1.01 116.94 115.17 1f91 h PHE 112 Ca 0.19 0.00 -0.15 0.00 2.81 0.00 0.00 57.97 60.81 1f91 h PHE 112 Cb 0.20 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.75 1f91 h PHE 112 CO -0.17 0.00 -0.36 1.96 -1.61 0.00 0.00 178.31 178.13 1f91 h GLN 113 N 0.00 0.93 -0.24 1.51 4.20 -0.94 -2.00 115.11 118.58 1f91 h GLN 113 Ca 0.00 -0.47 -0.16 0.00 0.06 0.00 0.00 58.65 58.07 1f91 h GLN 113 Cb 0.95 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.74 1f91 h GLN 113 CO 0.00 1.13 -0.48 0.28 -0.67 0.00 0.00 178.83 179.09 1f91 h VAL 114 N 0.77 1.30 -0.77 -0.54 2.07 -1.18 -2.91 116.25 114.99 1f91 h VAL 114 Ca 0.07 -1.68 0.08 0.00 0.82 0.00 0.00 66.70 65.99 1f91 h VAL 114 Cb 0.95 1.76 -0.07 0.00 -1.52 0.00 0.00 31.29 32.41 1f91 h VAL 114 CO 0.09 0.54 0.43 0.15 0.02 0.00 0.00 177.57 178.80 1f91 h PHE 115 N 0.47 0.78 -0.41 1.57 3.57 -1.06 0.58 116.94 122.45 1f91 h PHE 115 Ca 0.01 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 1f91 h PHE 115 Cb 1.08 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.57 1f91 h PHE 115 CO 0.08 0.33 0.14 0.78 -2.23 0.00 0.00 178.31 177.42 1f91 h GLY 116 N 0.74 0.67 0.94 2.40 0.00 -1.33 0.82 103.07 107.31 1f91 h GLY 116 Ca 0.36 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 1f91 h GLY 116 CO -0.23 0.36 0.15 0.00 0.00 0.00 0.00 176.54 176.82 1f91 h ALA 117 N 0.99 0.38 -0.03 3.60 0.00 -1.18 0.11 119.26 123.12 1f91 h ALA 117 Ca 0.13 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1f91 h ALA 117 Cb 0.23 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1f91 h ALA 117 CO -0.01 -0.08 0.02 -0.44 0.00 0.00 0.00 179.25 178.74 1f91 h ASP 118 N 0.35 0.04 -0.01 0.00 3.45 -0.82 -2.06 116.42 117.37 1f91 h ASP 118 Ca 0.10 -0.13 0.03 0.00 0.43 0.00 0.00 57.03 57.46 1f91 h ASP 118 Cb 0.09 -0.01 -0.04 0.00 -0.56 0.00 0.00 39.33 38.81 1f91 h ASP 118 CO -0.01 0.16 -0.20 0.00 -1.57 0.00 0.00 179.24 177.61 1f91 h ALA 119 N 0.89 -0.25 -0.92 3.45 0.00 -0.66 -2.61 119.26 119.16 1f91 h ALA 119 Ca 0.01 0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.07 1f91 h ALA 119 Cb 0.13 0.36 -0.09 0.00 0.00 0.00 0.00 17.79 18.18 1f91 h ALA 119 CO -0.00 -0.69 0.53 1.98 0.00 0.00 0.00 179.25 181.06 1f91 h MET 120 N -0.32 0.74 0.00 0.00 1.85 -0.68 0.16 114.93 116.68 1f91 h MET 120 Ca 0.06 -0.04 0.00 0.00 -0.61 0.00 0.00 59.70 59.11 1f91 h MET 120 Cb 0.40 -0.17 0.00 0.00 0.43 0.00 0.00 31.60 32.26 1f91 h MET 120 CO -0.19 0.49 0.00 0.54 -0.40 0.00 0.00 176.91 177.35 1f91 n ARG 121 N -4.77 0.88 -2.38 0.39 1.74 -0.79 -4.15 116.66 107.58 1f91 n ARG 121 Ca 0.18 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 57.02 1f91 n ARG 121 Cb 0.42 -1.49 0.07 0.00 -1.02 0.00 0.00 32.46 30.44 1f91 n ARG 121 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1f91 s GLY 122 N -1.99 1.75 0.57 -0.13 0.00 0.04 -4.98 107.32 102.58 1f91 s GLY 122 Ca 0.41 -1.16 0.37 0.00 0.00 0.00 0.00 44.72 44.34 1f91 s GLY 122 CO 0.32 -0.77 2.10 -0.56 0.00 0.00 0.00 173.10 174.20 1f91 h PRO 123 N -0.41 0.00 0.00 2.90 0.13 -1.87 -2.69 132.00 130.06 1f91 h PRO 123 Ca -0.43 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.69 1f91 h PRO 123 Cb 1.30 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.43 1f91 h PRO 123 CO 0.54 0.00 -0.06 0.00 -0.23 0.00 0.00 178.00 178.25 1f91 h ARG 124 N 0.00 0.00 0.00 0.86 2.47 -1.90 -3.49 114.38 112.32 1f91 h ARG 124 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1f91 h ARG 124 Cb 0.28 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.60 1f91 h ARG 124 CO 0.00 0.06 0.00 0.41 0.56 0.00 0.00 179.97 181.00 1f91 n GLY 125 N 0.89 3.25 0.38 0.04 0.00 -1.02 -2.45 105.19 106.28 1f91 n GLY 125 Ca 0.03 -0.16 0.18 0.00 0.00 0.00 0.00 46.02 46.07 1f91 n GLY 125 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1f91 h LEU 126 N 0.00 0.22 -1.18 0.99 3.38 -1.88 -1.77 115.31 115.07 1f91 h LEU 126 Ca 0.00 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 1f91 h LEU 126 Cb 0.00 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1f91 h LEU 126 CO 0.00 0.11 -0.13 0.11 0.09 0.00 0.00 178.44 178.63 1f91 h LYS 127 N 0.23 0.42 0.00 1.13 1.57 -1.88 -2.62 116.57 115.42 1f91 h LYS 127 Ca 0.33 -0.11 -0.18 0.00 -1.87 0.00 0.00 60.65 58.81 1f91 h LYS 127 Cb 0.95 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.19 1f91 h LYS 127 CO -0.07 0.55 -0.86 0.00 -0.57 0.00 0.00 179.45 178.50 1f91 h ALA 128 N 1.48 0.58 -0.01 3.86 0.00 -1.43 -3.28 119.26 120.47 1f91 h ALA 128 Ca 0.07 -0.78 -0.00 0.00 0.00 0.00 0.00 54.91 54.20 1f91 h ALA 128 Cb 0.46 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1f91 h ALA 128 CO 0.03 1.07 0.00 0.28 0.00 0.00 0.00 179.25 180.63 1f91 h VAL 129 N 0.00 1.16 0.00 0.00 2.07 -1.30 -3.48 116.25 114.70 1f91 h VAL 129 Ca -0.01 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1f91 h VAL 129 Cb 1.52 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.77 1f91 h VAL 129 CO 0.11 0.12 0.00 0.61 0.02 0.00 0.00 177.57 178.44 1f91 n GLY 130 N -0.55 -1.04 0.49 2.17 0.00 -1.03 -4.62 105.19 100.62 1f91 n GLY 130 Ca -0.08 -1.63 0.11 0.00 0.00 0.00 0.00 46.02 44.43 1f91 n GLY 130 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1f91 n PRO 131 N -1.07 1.66 -0.15 1.61 -0.04 -1.26 -4.27 135.00 131.48 1f91 n PRO 131 Ca 0.00 -0.98 0.07 0.00 -0.04 0.00 0.00 63.50 62.55 1f91 n PRO 131 Cb 0.00 -1.41 0.15 0.00 -0.04 0.00 0.00 33.50 32.20 1f91 n PRO 131 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1f91 n TYR 132 N 0.20 0.39 0.01 0.54 4.01 -1.26 -4.65 117.16 116.40 1f91 n TYR 132 Ca 0.17 -0.34 -0.10 0.00 -0.16 0.00 0.00 57.90 57.47 1f91 n TYR 132 Cb 0.31 -0.01 0.04 0.00 -0.31 0.00 0.00 39.34 39.37 1f91 n TYR 132 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1f91 h VAL 133 N 2.62 1.33 0.12 -0.72 2.07 -1.82 -3.24 116.25 116.60 1f91 h VAL 133 Ca 0.00 -1.87 0.02 0.00 0.82 0.00 0.00 66.70 65.67 1f91 h VAL 133 Cb 0.72 1.85 -0.04 0.00 -1.52 0.00 0.00 31.29 32.30 1f91 h VAL 133 CO 0.00 0.58 -0.30 0.58 0.02 0.00 0.00 177.57 178.45 1f91 h VAL 134 N 0.41 0.35 0.00 2.57 2.07 -1.91 0.26 116.25 120.00 1f91 h VAL 134 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1f91 h VAL 134 Cb 1.15 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.27 1f91 h VAL 134 CO 0.11 0.00 -0.03 0.71 0.02 0.00 0.00 177.57 178.38 1f91 h THR 135 N -0.52 0.19 0.11 2.57 1.35 -1.83 0.11 112.91 114.89 1f91 h THR 135 Ca 0.03 -0.28 -0.31 0.00 -0.55 0.00 0.00 66.41 65.31 1f91 h THR 135 Cb 0.55 1.23 -0.01 0.00 -1.73 0.00 0.00 68.15 68.19 1f91 h THR 135 CO -0.18 0.03 -1.55 0.11 -0.25 0.00 0.00 175.52 173.68 1f91 h LYS 136 N 0.00 0.23 0.00 4.72 1.57 -1.30 -3.39 116.57 118.39 1f91 h LYS 136 Ca -0.00 -0.40 -0.14 0.00 -1.87 0.00 0.00 60.65 58.25 1f91 h LYS 136 Cb 0.22 0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 1f91 h LYS 136 CO 0.00 1.08 -1.52 0.00 -0.57 0.00 0.00 179.45 178.45 1f91 n ALA 137 N -2.67 2.10 -1.75 3.86 0.00 0.83 -4.29 120.51 118.59 1f91 n ALA 137 Ca -0.17 -0.57 -0.37 0.00 0.00 0.00 0.00 53.44 52.33 1f91 n ALA 137 Cb 1.04 -0.88 0.04 0.00 0.00 0.00 0.00 19.45 19.66 1f91 n ALA 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1f91 s MET 138 N -3.03 3.01 0.56 0.00 0.23 0.34 -4.06 119.30 116.35 1f91 s MET 138 Ca -0.04 2.08 0.27 0.00 -1.03 0.00 0.00 55.69 56.97 1f91 s MET 138 Cb 0.09 -2.11 1.66 0.00 -1.53 0.00 0.00 34.83 32.95 1f91 s MET 138 CO 0.82 -1.24 2.20 0.00 -2.03 0.00 0.00 175.02 174.77 1f91 h ALA 139 N 1.17 1.53 -0.45 3.16 0.00 -1.92 -1.95 119.26 120.80 1f91 h ALA 139 Ca -0.51 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1f91 h ALA 139 Cb 1.30 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1f91 h ALA 139 CO 0.56 0.04 0.00 -1.13 0.00 0.00 0.00 179.25 178.72 1f91 n SER 140 N -3.89 3.42 -0.23 0.00 3.41 -1.26 -4.51 113.62 110.56 1f91 n SER 140 Ca -0.03 -2.31 0.03 0.00 -0.26 0.00 0.00 58.87 56.30 1f91 n SER 140 Cb 0.12 -0.48 0.15 0.00 -0.26 0.00 0.00 64.21 63.74 1f91 n SER 140 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1f91 h GLY 141 N 4.64 1.00 1.00 5.00 0.00 -1.58 -0.57 103.07 112.56 1f91 h GLY 141 Ca 0.00 -0.13 0.05 0.00 0.00 0.00 0.00 47.33 47.26 1f91 h GLY 141 CO 0.16 -0.07 0.53 -2.08 0.00 0.00 0.00 176.54 175.09 1f91 h VAL 142 N 0.42 1.08 0.10 4.60 2.07 -1.85 -0.42 116.25 122.24 1f91 h VAL 142 Ca 0.36 -0.32 -0.31 0.00 0.82 0.00 0.00 66.70 67.25 1f91 h VAL 142 Cb 0.51 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 1f91 h VAL 142 CO -0.37 0.17 -1.63 0.77 0.02 0.00 0.00 177.57 176.53 1f91 h SER 143 N 0.93 0.32 -0.32 0.57 4.64 -1.50 -3.28 113.55 114.92 1f91 h SER 143 Ca 0.34 -0.52 -0.04 0.00 -0.47 0.00 0.00 61.79 61.10 1f91 h SER 143 Cb 0.15 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 1f91 h SER 143 CO -0.11 1.44 0.04 0.00 -0.87 0.00 0.00 176.83 177.33 1f91 h ALA 144 N 0.51 0.43 0.00 5.18 0.00 -0.88 -1.58 119.26 122.92 1f91 h ALA 144 Ca -0.28 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1f91 h ALA 144 Cb 2.01 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.68 1f91 h ALA 144 CO 0.14 0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.52 1f91 n LEU 146 N -1.82 2.05 0.09 0.00 4.32 -1.15 -4.37 117.00 116.12 1f91 n LEU 146 Ca 0.04 0.27 0.09 0.00 -0.02 0.00 0.00 56.01 56.39 1f91 n LEU 146 Cb 0.27 -0.81 0.55 0.00 -1.62 0.00 0.00 43.42 41.81 1f91 n LEU 146 CO 0.21 0.61 1.13 0.00 -1.22 0.00 0.00 177.39 178.13 1f91 h ALA 147 N -0.85 1.97 0.10 -1.18 0.00 -1.37 -2.18 119.26 115.75 1f91 h ALA 147 Ca -0.68 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.22 1f91 h ALA 147 Cb 1.64 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.37 1f91 h ALA 147 CO -0.38 -0.02 -0.05 1.15 0.00 0.00 0.00 179.25 179.96 1f91 h THR 148 N 0.25 1.10 0.00 0.00 2.02 -1.77 -0.93 112.91 113.59 1f91 h THR 148 Ca 0.12 -1.30 -0.07 0.00 0.77 0.00 0.00 66.41 65.93 1f91 h THR 148 Cb 0.19 1.86 -0.01 0.00 -1.74 0.00 0.00 68.15 68.46 1f91 h THR 148 CO -0.02 0.29 -0.33 1.55 0.37 0.00 0.00 175.52 177.38 1f91 h PRO 149 N -0.79 0.00 -0.24 6.66 0.13 -1.74 -2.92 132.00 133.10 1f91 h PRO 149 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1f91 h PRO 149 Cb 0.58 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.71 1f91 h PRO 149 CO 0.02 0.33 0.00 1.19 -0.23 0.00 0.00 178.00 179.31 1f91 n PHE 150 N -3.54 0.32 -3.67 1.56 3.01 -0.83 -4.93 117.46 109.38 1f91 n PHE 150 Ca -0.00 -0.16 -0.24 0.00 1.01 0.00 0.00 57.45 58.05 1f91 n PHE 150 Cb 0.47 0.00 0.06 0.00 -0.01 0.00 0.00 39.48 40.00 1f91 n PHE 150 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1f91 n LYS 151 N 0.28 -6.84 -2.57 -1.08 4.76 -1.10 -4.55 118.16 107.06 1f91 n LYS 151 Ca 0.12 0.75 -0.41 0.00 -2.87 0.00 0.00 58.31 55.89 1f91 n LYS 151 Cb 0.26 -5.71 -0.04 0.00 -1.84 0.00 0.00 35.03 27.70 1f91 n LYS 151 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1f91 s ILE 152 N -3.35 4.23 -0.25 -0.18 -1.09 -0.36 -0.27 121.20 119.93 1f91 s ILE 152 Ca 0.47 1.75 0.06 0.00 -2.23 0.00 0.00 60.65 60.70 1f91 s ILE 152 Cb -0.22 -4.12 -0.07 0.00 -1.58 0.00 0.00 42.46 36.47 1f91 s ILE 152 CO 0.77 0.22 0.25 1.41 -1.23 0.00 0.00 174.94 176.35 1f91 n HIS 153 N 3.16 0.00 -0.10 3.97 8.25 -1.24 -4.88 115.22 124.37 1f91 n HIS 153 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1f91 n HIS 153 Cb 0.48 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.56 1f91 n HIS 153 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1f91 n GLY 154 N 1.32 1.06 3.73 -1.41 0.00 0.06 -4.64 105.19 105.29 1f91 n GLY 154 Ca 0.01 -1.50 -0.35 0.00 0.00 0.00 0.00 46.02 44.18 1f91 n GLY 154 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1f91 s VAL 155 N 0.57 2.31 -0.29 1.61 -7.23 -1.26 -4.85 120.40 111.27 1f91 s VAL 155 Ca 0.00 0.16 0.06 0.00 -1.81 0.00 0.00 61.98 60.39 1f91 s VAL 155 Cb 0.00 -2.79 0.20 0.00 0.56 0.00 0.00 36.38 34.35 1f91 s VAL 155 CO 0.00 -0.07 0.58 0.21 -0.31 0.00 0.00 175.10 175.51 1f91 s ASN 156 N -1.94 -1.54 0.20 4.85 2.47 -1.25 -1.32 114.94 116.41 1f91 s ASN 156 Ca 0.75 0.17 -0.24 0.00 0.42 0.00 0.00 52.86 53.97 1f91 s ASN 156 Cb -0.30 2.00 0.05 0.00 -1.45 0.00 0.00 41.25 41.54 1f91 s ASN 156 CO 0.44 -0.30 0.87 -0.72 -3.72 0.00 0.00 177.10 173.66 1f91 s TYR 157 N 2.82 -0.16 0.02 0.43 1.13 -1.16 -5.01 117.35 115.42 1f91 s TYR 157 Ca 0.10 -0.20 0.04 0.00 -1.41 0.00 0.00 57.07 55.61 1f91 s TYR 157 Cb -0.10 0.66 -0.03 0.00 -1.10 0.00 0.00 41.96 41.39 1f91 s TYR 157 CO -0.26 -0.97 -0.08 -1.12 -2.51 0.00 0.00 175.55 170.60 1f91 s SER 158 N -2.92 4.50 -0.09 -0.18 0.01 -1.26 -3.08 113.70 110.67 1f91 s SER 158 Ca 0.12 -0.21 0.02 0.00 1.31 0.00 0.00 55.95 57.19 1f91 s SER 158 Cb -0.03 -0.99 -0.02 0.00 0.21 0.00 0.00 66.02 65.19 1f91 s SER 158 CO 0.04 0.26 -0.16 -0.63 0.41 0.00 0.00 173.24 173.16 1f91 s ILE 159 N -1.02 2.86 -0.07 1.44 1.01 -1.26 -4.97 121.20 119.19 1f91 s ILE 159 Ca 0.18 -0.76 0.02 0.00 0.00 0.00 0.00 60.65 60.09 1f91 s ILE 159 Cb -0.11 -2.15 0.01 0.00 0.01 0.00 0.00 42.46 40.22 1f91 s ILE 159 CO 0.08 0.55 -0.12 -0.55 0.00 0.00 0.00 174.94 174.91 1f91 s SER 160 N -0.07 1.83 -0.38 3.58 0.15 -1.26 -4.32 113.70 113.22 1f91 s SER 160 Ca -0.03 -0.30 0.11 0.00 0.70 0.00 0.00 55.95 56.42 1f91 s SER 160 Cb -0.14 -0.84 0.40 0.00 -1.71 0.00 0.00 66.02 63.73 1f91 s SER 160 CO 0.04 0.02 1.25 -1.54 1.20 0.00 0.00 173.24 174.22 1f91 n SER 161 N 3.89 -1.15 0.00 5.45 3.41 -1.26 -4.92 113.62 119.04 1f91 n SER 161 Ca -0.22 -2.57 0.00 0.00 -0.26 0.00 0.00 58.87 55.81 1f91 n SER 161 Cb 0.52 0.69 0.00 0.00 -0.26 0.00 0.00 64.21 65.16 1f91 n SER 161 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1f91 n ALA 162 N -0.43 0.00 0.38 7.33 0.00 -1.26 -1.28 120.51 125.25 1f91 n ALA 162 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1f91 n ALA 162 Cb 0.83 0.00 0.23 0.00 0.00 0.00 0.00 19.45 20.51 1f91 n ALA 162 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1f91 n SER 163 N 3.82 0.00 -0.55 0.00 7.64 -1.26 -2.08 113.62 121.19 1f91 n SER 163 Ca 0.00 0.42 0.11 0.00 1.01 0.00 0.00 58.87 60.41 1f91 n SER 163 Cb 0.00 -0.45 0.01 0.00 -1.01 0.00 0.00 64.21 62.75 1f91 n SER 163 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1f91 n ALA 164 N -1.45 3.42 -0.03 -0.43 0.00 -0.40 -4.24 120.51 117.38 1f91 n ALA 164 Ca 0.03 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.82 1f91 n ALA 164 Cb 0.11 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 18.78 1f91 n ALA 164 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1f91 n THR 165 N 0.14 0.00 0.45 0.00 -1.04 -0.88 -1.25 114.28 111.69 1f91 n THR 165 Ca 0.10 1.14 0.07 0.00 -2.04 0.00 0.00 64.05 63.31 1f91 n THR 165 Cb 0.48 -1.52 0.30 0.00 -1.82 0.00 0.00 70.33 67.76 1f91 n THR 165 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1f91 n SER 166 N -2.71 0.04 0.08 8.00 3.41 -1.06 -1.80 113.62 119.57 1f91 n SER 166 Ca 0.00 0.51 -0.22 0.00 -0.26 0.00 0.00 58.87 58.90 1f91 n SER 166 Cb 0.00 -0.52 -0.15 0.00 -0.26 0.00 0.00 64.21 63.28 1f91 n SER 166 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1f91 h ALA 167 N 2.44 -0.05 -0.14 7.33 0.00 -1.43 -3.06 119.26 124.34 1f91 h ALA 167 Ca 0.00 -0.86 -0.10 0.00 0.00 0.00 0.00 54.91 53.96 1f91 h ALA 167 Cb 0.23 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1f91 h ALA 167 CO 0.00 0.61 -0.34 0.45 0.00 0.00 0.00 179.25 179.97 1f91 h HIS 168 N -0.15 0.33 -0.45 0.00 -0.00 -0.87 -1.43 115.15 112.58 1f91 h HIS 168 Ca -0.23 -0.08 0.00 0.00 -0.00 0.00 0.00 60.37 60.07 1f91 h HIS 168 Cb 1.87 -0.08 -0.02 0.00 -0.00 0.00 0.00 27.41 29.18 1f91 h HIS 168 CO 0.16 0.60 0.29 0.00 -0.00 0.00 0.00 177.93 178.98 1f91 h ILE 170 N 0.60 1.24 -0.28 0.00 2.04 -1.39 -1.47 117.51 118.24 1f91 h ILE 170 Ca 0.16 -0.82 -0.04 0.00 1.00 0.00 0.00 64.86 65.16 1f91 h ILE 170 Cb -0.05 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 1f91 h ILE 170 CO -0.03 0.28 0.01 1.23 0.00 0.00 0.00 178.15 179.63 1f91 h GLY 171 N 0.42 0.45 1.98 5.37 0.00 -0.93 -1.32 103.07 109.04 1f91 h GLY 171 Ca 0.11 -0.25 -0.16 0.00 0.00 0.00 0.00 47.33 47.03 1f91 h GLY 171 CO 0.01 0.23 -0.77 -0.57 0.00 0.00 0.00 176.54 175.44 1f91 h ASN 172 N 0.41 0.03 -0.48 0.19 -0.73 -0.53 -2.51 115.58 111.96 1f91 h ASN 172 Ca 0.09 -0.02 -0.10 0.00 1.87 0.00 0.00 56.30 58.14 1f91 h ASN 172 Cb 0.26 -0.01 -0.02 0.00 0.27 0.00 0.00 38.32 38.82 1f91 h ASN 172 CO 0.01 0.78 -0.09 0.00 -0.37 0.00 0.00 177.43 177.76 1f91 h ALA 173 N 1.22 0.66 -0.39 1.57 0.00 -0.51 -1.51 119.26 120.28 1f91 h ALA 173 Ca -0.01 -0.33 0.02 0.00 0.00 0.00 0.00 54.91 54.59 1f91 h ALA 173 Cb 1.35 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1f91 h ALA 173 CO 0.10 0.54 0.22 0.28 0.00 0.00 0.00 179.25 180.39 1f91 h VAL 174 N 0.76 1.02 -0.91 0.00 2.07 -1.11 -2.37 116.25 115.71 1f91 h VAL 174 Ca 0.12 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 1f91 h VAL 174 Cb 0.64 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 1f91 h VAL 174 CO 0.04 0.08 0.51 -0.33 0.02 0.00 0.00 177.57 177.90 1f91 h GLU 175 N 0.45 1.27 -0.53 1.57 5.08 -1.21 0.14 114.58 121.34 1f91 h GLU 175 Ca 0.16 -0.14 0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1f91 h GLU 175 Cb 0.03 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.00 1f91 h GLU 175 CO -0.09 0.92 0.35 1.96 -1.00 0.00 0.00 179.01 181.15 1f91 h GLN 176 N 1.28 0.67 0.09 2.33 1.08 -0.81 0.11 115.11 119.86 1f91 h GLN 176 Ca 0.32 -0.04 -0.20 0.00 -1.45 0.00 0.00 58.65 57.28 1f91 h GLN 176 Cb 0.01 -0.15 0.02 0.00 -0.05 0.00 0.00 27.48 27.31 1f91 h GLN 176 CO -0.05 0.45 -0.83 0.82 -0.95 0.00 0.00 178.83 178.26 1f91 h ILE 177 N 0.69 1.44 -0.11 2.54 2.04 -0.87 -1.44 117.51 121.79 1f91 h ILE 177 Ca 0.20 -2.37 -0.02 0.00 1.00 0.00 0.00 64.86 63.67 1f91 h ILE 177 Cb -0.04 2.90 -0.01 0.00 -0.74 0.00 0.00 36.82 38.93 1f91 h ILE 177 CO -0.05 0.69 -0.01 1.56 0.00 0.00 0.00 178.15 180.34 1f91 h GLN 178 N -0.15 0.15 0.00 2.37 4.20 -0.36 0.13 115.11 121.45 1f91 h GLN 178 Ca -0.13 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.56 1f91 h GLN 178 Cb 1.59 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.34 1f91 h GLN 178 CO 0.16 0.18 0.00 1.28 -0.67 0.00 0.00 178.83 179.78 1f91 n LEU 179 N -4.43 0.00 -0.18 1.46 4.77 0.34 -3.63 117.00 115.33 1f91 n LEU 179 Ca -0.01 0.37 -0.02 0.00 -0.03 0.00 0.00 56.01 56.32 1f91 n LEU 179 Cb 0.15 -0.37 -0.01 0.00 -2.33 0.00 0.00 43.42 40.86 1f91 n LEU 179 CO 0.35 -0.06 -0.02 0.61 -1.33 0.00 0.00 177.39 176.94 1f91 n GLY 180 N 0.93 0.57 0.09 -0.72 0.00 0.46 -4.92 105.19 101.61 1f91 n GLY 180 Ca 0.10 -0.47 -0.03 0.00 0.00 0.00 0.00 46.02 45.61 1f91 n GLY 180 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1f91 h LYS 181 N 0.36 0.00 -4.33 1.61 1.57 -1.46 -3.47 116.57 110.85 1f91 h LYS 181 Ca -0.05 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.55 1f91 h LYS 181 Cb 0.25 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 32.38 1f91 h LYS 181 CO 0.07 0.60 -0.70 -0.65 -0.57 0.00 0.00 179.45 178.20 1f91 s GLN 182 N -2.80 0.58 -0.22 3.15 -1.52 -1.13 -4.77 119.66 112.95 1f91 s GLN 182 Ca -0.00 -1.03 0.08 0.00 -1.95 0.00 0.00 55.36 52.46 1f91 s GLN 182 Cb 0.09 0.01 -0.19 0.00 -0.22 0.00 0.00 33.01 32.70 1f91 s GLN 182 CO 0.80 -0.05 -0.10 -0.25 -0.25 0.00 0.00 175.29 175.44 1f91 n ASP 183 N 0.65 1.45 -4.02 5.90 8.00 0.33 -4.35 116.55 124.50 1f91 n ASP 183 Ca -0.17 -0.08 -0.17 0.00 0.71 0.00 0.00 54.79 55.09 1f91 n ASP 183 Cb 0.58 0.17 -0.14 0.00 -0.02 0.00 0.00 41.12 41.72 1f91 n ASP 183 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1f91 s ILE 184 N -2.46 0.61 -0.08 0.53 1.01 -1.15 -0.87 121.20 118.78 1f91 s ILE 184 Ca -0.23 -0.53 -0.03 0.00 0.00 0.00 0.00 60.65 59.86 1f91 s ILE 184 Cb 0.07 -0.55 0.05 0.00 0.01 0.00 0.00 42.46 42.04 1f91 s ILE 184 CO 0.63 0.03 0.17 -0.69 0.00 0.00 0.00 174.94 175.09 1f91 s VAL 185 N -0.47 -0.19 -0.17 2.92 1.01 -0.20 -1.39 120.40 121.90 1f91 s VAL 185 Ca 0.00 0.28 -0.26 0.00 0.00 0.00 0.00 61.98 62.00 1f91 s VAL 185 Cb -0.05 -0.30 -0.01 0.00 0.00 0.00 0.00 36.38 36.03 1f91 s VAL 185 CO 0.00 0.12 0.88 -0.36 0.00 0.00 0.00 175.10 175.73 1f91 s PHE 186 N 1.86 3.42 -0.01 5.22 0.40 0.18 -1.80 117.98 127.25 1f91 s PHE 186 Ca -0.02 1.32 0.05 0.00 -0.60 0.00 0.00 56.93 57.68 1f91 s PHE 186 Cb -0.12 -3.06 -0.01 0.00 0.51 0.00 0.00 43.02 40.33 1f91 s PHE 186 CO -0.06 -0.27 -0.18 0.00 0.70 0.00 0.00 175.22 175.41 1f91 s ALA 187 N 2.26 1.47 0.00 5.36 0.00 -0.59 -0.56 121.76 129.70 1f91 s ALA 187 Ca 0.40 -0.76 0.00 0.00 0.00 0.00 0.00 51.96 51.60 1f91 s ALA 187 Cb -0.17 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.58 1f91 s ALA 187 CO 0.12 0.36 0.00 0.41 0.00 0.00 0.00 175.76 176.65 1f91 n GLY 188 N 2.63 -0.70 0.00 0.00 0.00 -1.13 -0.10 105.19 105.88 1f91 n GLY 188 Ca -0.15 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.49 1f91 n GLY 188 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f91 n GLY 189 N 0.00 -1.53 3.64 -0.02 0.00 -0.55 -2.65 105.19 104.09 1f91 n GLY 189 Ca 0.00 -1.04 -0.09 0.00 0.00 0.00 0.00 46.02 44.88 1f91 n GLY 189 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1f91 s GLY 190 N 0.00 -0.32 -0.18 -0.02 0.00 -0.87 -1.41 107.32 104.52 1f91 s GLY 190 Ca 0.00 0.05 -0.09 0.00 0.00 0.00 0.00 44.72 44.68 1f91 s GLY 190 CO 0.00 0.01 0.43 1.85 0.00 0.00 0.00 173.10 175.39 1f91 s GLU 191 N -3.84 0.40 0.80 2.90 2.56 -0.26 -4.16 118.70 117.10 1f91 s GLU 191 Ca 0.07 0.86 -0.11 0.00 0.00 0.00 0.00 54.97 55.78 1f91 s GLU 191 Cb -0.03 0.05 0.07 0.00 2.00 0.00 0.00 34.13 36.22 1f91 s GLU 191 CO -0.02 -0.18 1.09 -1.83 -0.56 0.00 0.00 175.26 173.76 1f91 s GLU 192 N 1.64 2.09 -0.18 4.30 -1.05 -1.26 -1.75 118.70 122.49 1f91 s GLU 192 Ca -0.08 0.68 0.01 0.00 -0.15 0.00 0.00 54.97 55.43 1f91 s GLU 192 Cb -0.09 -1.91 0.04 0.00 -0.44 0.00 0.00 34.13 31.72 1f91 s GLU 192 CO -0.13 -1.63 -0.12 -1.17 0.95 0.00 0.00 175.26 173.16 1f91 s LEU 193 N -5.80 2.05 0.11 1.83 2.96 -1.26 -4.71 118.68 113.86 1f91 s LEU 193 Ca 0.61 -0.74 -0.25 0.00 -0.22 0.00 0.00 54.13 53.53 1f91 s LEU 193 Cb -0.15 -1.20 0.07 0.00 0.50 0.00 0.00 46.19 45.41 1f91 s LEU 193 CO 0.54 -0.11 0.63 0.00 -1.32 0.00 0.00 176.35 176.09 1f91 h TRP 195 N 2.19 0.04 -0.87 0.00 5.08 -1.97 -1.13 115.95 119.29 1f91 h TRP 195 Ca -0.32 -0.01 0.17 0.00 1.08 0.00 0.00 58.89 59.80 1f91 h TRP 195 Cb 1.27 -0.01 -0.07 0.00 -3.00 0.00 0.00 29.16 27.36 1f91 h TRP 195 CO 0.26 0.50 0.57 0.93 -1.28 0.00 0.00 178.44 179.42 1f91 h GLU 196 N 0.03 0.53 0.05 0.12 3.07 -1.96 -0.55 114.58 115.88 1f91 h GLU 196 Ca -0.00 -0.03 -0.37 0.00 -0.50 0.00 0.00 59.36 58.45 1f91 h GLU 196 Cb 0.84 -0.12 -0.04 0.00 -0.84 0.00 0.00 28.75 28.59 1f91 h GLU 196 CO 0.06 0.35 -2.18 -0.12 -1.40 0.00 0.00 179.01 175.72 1f91 n MET 197 N -4.54 0.68 -0.27 2.33 0.00 -1.13 -4.47 117.12 109.73 1f91 n MET 197 Ca 0.18 0.25 -0.01 0.00 0.00 0.00 0.00 57.70 58.11 1f91 n MET 197 Cb 0.56 -1.62 0.11 0.00 0.00 0.00 0.00 33.22 32.28 1f91 n MET 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1f91 h ALA 198 N -0.11 1.03 -0.42 -5.12 0.00 -0.89 -1.94 119.26 111.80 1f91 h ALA 198 Ca -0.51 -0.00 0.12 0.00 0.00 0.00 0.00 54.91 54.52 1f91 h ALA 198 Cb 1.88 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.46 1f91 h ALA 198 CO -0.06 0.18 0.33 0.00 0.00 0.00 0.00 179.25 179.70 1f91 h GLU 200 N 0.00 0.43 0.20 0.00 5.08 -1.57 0.19 114.58 118.91 1f91 h GLU 200 Ca 0.20 -0.18 -0.31 0.00 -1.00 0.00 0.00 59.36 58.07 1f91 h GLU 200 Cb 0.86 -0.02 0.02 0.00 0.50 0.00 0.00 28.75 30.11 1f91 h GLU 200 CO -0.00 0.70 -1.38 0.74 -1.00 0.00 0.00 179.01 178.07 1f91 h PHE 201 N 0.37 0.76 -0.60 4.33 0.04 -1.19 -3.25 116.94 117.41 1f91 h PHE 201 Ca 0.05 -0.56 -0.03 0.00 2.80 0.00 0.00 57.97 60.23 1f91 h PHE 201 Cb 0.74 -0.03 -0.03 0.00 2.20 0.00 0.00 35.95 38.84 1f91 h PHE 201 CO 0.02 1.44 0.26 0.22 -0.60 0.00 0.00 178.31 179.65 1f91 h ASP 202 N 0.11 0.82 0.00 2.17 1.82 -1.19 -1.30 116.42 118.85 1f91 h ASP 202 Ca -0.20 -0.16 0.00 0.00 -0.39 0.00 0.00 57.03 56.28 1f91 h ASP 202 Cb 2.08 -0.21 0.00 0.00 0.68 0.00 0.00 39.33 41.88 1f91 h ASP 202 CO 0.24 0.75 0.09 0.00 -1.61 0.00 0.00 179.24 178.71 1f91 h ALA 203 N 1.10 1.08 -0.32 -0.78 0.00 -0.64 0.37 119.26 120.08 1f91 h ALA 203 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1f91 h ALA 203 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1f91 h ALA 203 CO -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.14 1f91 n MET 204 N -2.87 2.97 -3.71 0.00 0.00 -0.78 -4.97 117.12 107.76 1f91 n MET 204 Ca -0.02 -2.50 -0.26 0.00 0.00 0.00 0.00 57.70 54.92 1f91 n MET 204 Cb 0.15 -1.60 0.06 0.00 0.00 0.00 0.00 33.22 31.83 1f91 n MET 204 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1f91 n GLY 205 N 0.03 -0.52 0.00 3.17 0.00 0.13 -4.91 105.19 103.09 1f91 n GLY 205 Ca 0.17 0.23 0.10 0.00 0.00 0.00 0.00 46.02 46.52 1f91 n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f91 n ALA 206 N -4.85 4.12 -2.85 4.61 0.00 -0.56 -4.95 120.51 116.04 1f91 n ALA 206 Ca 0.00 -0.56 -0.28 0.00 0.00 0.00 0.00 53.44 52.60 1f91 n ALA 206 Cb 0.56 -0.75 -0.03 0.00 0.00 0.00 0.00 19.45 19.22 1f91 n ALA 206 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1f91 s LEU 207 N -3.45 4.30 0.41 0.00 1.43 -1.26 -1.50 118.68 118.60 1f91 s LEU 207 Ca 0.03 0.32 -0.26 0.00 -1.03 0.00 0.00 54.13 53.19 1f91 s LEU 207 Cb 0.15 -3.06 -0.09 0.00 0.03 0.00 0.00 46.19 43.23 1f91 s LEU 207 CO 0.87 0.04 1.30 -0.55 0.23 0.00 0.00 176.35 178.24 1f91 s SER 208 N -2.97 6.32 0.00 2.29 0.15 -0.25 -4.65 113.70 114.59 1f91 s SER 208 Ca 0.37 2.64 0.00 0.00 0.70 0.00 0.00 55.95 59.66 1f91 s SER 208 Cb -0.12 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 1f91 s SER 208 CO 0.28 -0.84 0.00 0.35 1.20 0.00 0.00 173.24 174.23 1f91 n THR 209 N 0.13 0.00 1.12 6.45 -2.24 -1.26 -4.30 114.28 114.17 1f91 n THR 209 Ca 0.04 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.92 1f91 n THR 209 Cb 0.44 0.84 0.35 0.00 -2.10 0.00 0.00 70.33 69.86 1f91 n THR 209 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1f91 n LYS 210 N 0.00 1.82 -0.78 -0.78 5.02 -1.26 -4.24 118.16 117.95 1f91 n LYS 210 Ca 0.00 -1.24 0.05 0.00 -2.02 0.00 0.00 58.31 55.10 1f91 n LYS 210 Cb 0.00 -1.41 0.09 0.00 -0.02 0.00 0.00 35.03 33.69 1f91 n LYS 210 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1f91 n TYR 211 N 0.47 0.00 0.20 2.13 4.02 -1.26 -4.82 117.16 117.90 1f91 n TYR 211 Ca 0.16 -0.77 0.11 0.00 -0.01 0.00 0.00 57.90 57.40 1f91 n TYR 211 Cb 0.36 -0.16 0.61 0.00 -0.02 0.00 0.00 39.34 40.13 1f91 n TYR 211 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 1f91 h ASN 212 N 0.61 0.00 0.53 7.72 2.35 -1.93 -0.16 115.58 124.70 1f91 h ASN 212 Ca -0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1f91 h ASN 212 Cb 1.38 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.75 1f91 h ASN 212 CO 0.03 0.00 -0.59 0.47 -1.65 0.00 0.00 177.43 175.70 1f91 n ASP 213 N -2.36 0.56 -3.15 5.81 8.00 -1.26 -4.38 116.55 119.77 1f91 n ASP 213 Ca -0.01 -0.21 -0.22 0.00 0.71 0.00 0.00 54.79 55.05 1f91 n ASP 213 Cb 0.18 0.31 -0.05 0.00 -0.02 0.00 0.00 41.12 41.54 1f91 n ASP 213 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1f91 n THR 214 N -1.64 -0.57 -0.33 -3.53 -2.24 -0.08 -5.01 114.28 100.89 1f91 n THR 214 Ca 0.05 -3.88 0.05 0.00 -2.27 0.00 0.00 64.05 58.00 1f91 n THR 214 Cb 0.36 -1.44 0.12 0.00 -2.10 0.00 0.00 70.33 67.27 1f91 n THR 214 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1f91 n PRO 215 N 1.26 -0.10 0.00 -0.78 -0.02 -1.21 -0.34 135.00 133.81 1f91 n PRO 215 Ca 0.20 1.41 0.03 0.00 -2.02 0.00 0.00 63.50 63.12 1f91 n PRO 215 Cb 0.56 -2.10 0.18 0.00 -0.02 0.00 0.00 33.50 32.12 1f91 n PRO 215 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1f91 n GLU 216 N -5.46 0.25 0.00 -0.52 1.02 -1.26 -1.88 120.64 112.80 1f91 n GLU 216 Ca 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 1f91 n GLU 216 Cb 0.44 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.48 1f91 n GLU 216 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1f91 n LYS 217 N -0.88 -0.40 0.04 3.49 5.02 0.53 -4.77 118.16 121.19 1f91 n LYS 217 Ca 0.05 -0.33 -0.13 0.00 -2.02 0.00 0.00 58.31 55.89 1f91 n LYS 217 Cb 0.02 -0.82 -0.08 0.00 -0.02 0.00 0.00 35.03 34.13 1f91 n LYS 217 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1f91 h ALA 218 N 0.00 -0.05 -1.88 7.82 0.00 -1.33 -3.38 119.26 120.44 1f91 h ALA 218 Ca 0.00 -0.08 -0.57 0.00 0.00 0.00 0.00 54.91 54.26 1f91 h ALA 218 Cb 0.15 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.89 1f91 h ALA 218 CO 0.00 -0.46 0.82 0.45 0.00 0.00 0.00 179.25 180.07 1f91 s SER 219 N -5.29 6.76 -0.40 0.00 0.15 -1.26 -4.76 113.70 108.90 1f91 s SER 219 Ca -0.14 0.72 0.09 0.00 0.70 0.00 0.00 55.95 57.33 1f91 s SER 219 Cb 0.05 -2.53 0.31 0.00 -1.71 0.00 0.00 66.02 62.14 1f91 s SER 219 CO 0.66 -1.02 0.78 -2.11 1.20 0.00 0.00 173.24 172.75 1f91 n ARG 220 N 7.21 0.91 -1.52 5.44 1.85 -1.26 -4.68 116.66 124.61 1f91 n ARG 220 Ca 0.11 -2.90 -0.48 0.00 -1.00 0.00 0.00 57.85 53.57 1f91 n ARG 220 Cb 0.48 -1.44 -0.03 0.00 -1.05 0.00 0.00 32.46 30.41 1f91 n ARG 220 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1f91 n THR 221 N 0.66 1.41 -0.07 8.89 -1.04 -1.26 -1.70 114.28 121.16 1f91 n THR 221 Ca 0.19 -0.35 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 1f91 n THR 221 Cb 0.64 -0.56 0.00 0.00 -1.82 0.00 0.00 70.33 68.58 1f91 n THR 221 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1f91 n TYR 222 N 0.74 0.00 -2.42 -1.42 4.01 -1.26 -4.74 117.16 112.08 1f91 n TYR 222 Ca 0.15 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.48 1f91 n TYR 222 Cb 0.25 -0.46 -0.03 0.00 -0.31 0.00 0.00 39.34 38.79 1f91 n TYR 222 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1f91 s ASP 223 N -3.08 7.12 0.66 7.72 2.15 -0.69 -1.25 116.67 129.31 1f91 s ASP 223 Ca 0.00 2.15 0.31 0.00 0.43 0.00 0.00 52.55 55.45 1f91 s ASP 223 Cb 0.00 -2.60 1.71 0.00 -0.30 0.00 0.00 42.92 41.73 1f91 s ASP 223 CO 0.00 -0.36 1.97 0.00 -0.17 0.00 0.00 175.17 176.61 1f91 h ALA 224 N 5.56 1.34 -0.51 3.66 0.00 -0.87 -1.80 119.26 126.64 1f91 h ALA 224 Ca -0.44 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.26 1f91 h ALA 224 Cb 1.21 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.88 1f91 h ALA 224 CO 0.76 -0.31 0.12 0.72 0.00 0.00 0.00 179.25 180.54 1f91 n HIS 225 N -2.96 1.63 -2.30 0.00 8.25 -1.26 -5.01 115.22 113.57 1f91 n HIS 225 Ca -0.02 -1.45 -0.37 0.00 -0.26 0.00 0.00 57.72 55.62 1f91 n HIS 225 Cb 0.36 -0.57 -0.01 0.00 1.12 0.00 0.00 29.99 30.88 1f91 n HIS 225 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 1f91 s ARG 226 N -3.14 3.74 -0.27 -0.41 1.70 -0.68 -4.98 118.95 114.91 1f91 s ARG 226 Ca 0.48 1.71 0.20 0.00 -0.47 0.00 0.00 55.73 57.65 1f91 s ARG 226 Cb 0.41 -2.35 0.50 0.00 -0.57 0.00 0.00 34.95 32.95 1f91 s ARG 226 CO 0.06 -0.55 1.12 -0.40 -1.08 0.00 0.00 175.30 174.44 1f91 n ASP 227 N -0.59 2.10 0.00 -2.89 5.75 -1.26 -4.61 116.55 115.06 1f91 n ASP 227 Ca 0.08 -2.31 0.00 0.00 -0.01 0.00 0.00 54.79 52.55 1f91 n ASP 227 Cb 0.49 -0.46 0.00 0.00 -1.03 0.00 0.00 41.12 40.12 1f91 n ASP 227 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1f91 n GLY 228 N -0.61 2.49 3.95 6.12 0.00 -0.84 -3.76 105.19 112.55 1f91 n GLY 228 Ca 0.13 -2.08 -0.24 0.00 0.00 0.00 0.00 46.02 43.83 1f91 n GLY 228 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1f91 s PHE 229 N -2.23 3.07 -0.26 1.61 -0.12 -0.56 -3.92 117.98 115.57 1f91 s PHE 229 Ca 0.00 0.29 -0.05 0.00 -0.05 0.00 0.00 56.93 57.12 1f91 s PHE 229 Cb 0.00 -2.69 0.00 0.00 -0.63 0.00 0.00 43.02 39.71 1f91 s PHE 229 CO 0.00 -0.79 0.03 0.08 -0.05 0.00 0.00 175.22 174.48 1f91 s VAL 230 N -2.83 3.67 0.39 -2.49 1.01 -1.26 -1.09 120.40 117.79 1f91 s VAL 230 Ca 0.54 -0.65 -0.26 0.00 0.00 0.00 0.00 61.98 61.61 1f91 s VAL 230 Cb -0.10 -2.82 -0.09 0.00 0.00 0.00 0.00 36.38 33.37 1f91 s VAL 230 CO 0.41 0.21 1.21 -0.51 0.00 0.00 0.00 175.10 176.42 1f91 s ILE 231 N 1.48 3.01 0.18 2.22 2.07 -1.26 0.13 121.20 129.02 1f91 s ILE 231 Ca 0.03 0.88 -0.04 0.00 -1.41 0.00 0.00 60.65 60.11 1f91 s ILE 231 Cb -0.16 -3.51 -0.03 0.00 0.13 0.00 0.00 42.46 38.89 1f91 s ILE 231 CO -0.00 0.11 0.19 0.00 -1.91 0.00 0.00 174.94 173.33 1f91 s ALA 232 N -1.34 0.62 0.25 1.50 0.00 0.19 -1.70 121.76 121.28 1f91 s ALA 232 Ca 0.56 -1.33 0.04 0.00 0.00 0.00 0.00 51.96 51.22 1f91 s ALA 232 Cb -0.33 1.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.84 1f91 s ALA 232 CO 0.42 -0.61 0.13 0.41 0.00 0.00 0.00 175.76 176.11 1f91 n GLY 233 N -0.22 3.45 0.00 0.00 0.00 -0.94 -3.98 105.19 103.49 1f91 n GLY 233 Ca -0.03 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1f91 n GLY 233 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f91 n GLY 234 N 0.02 0.60 3.44 -0.02 0.00 -0.72 -4.39 105.19 104.12 1f91 n GLY 234 Ca -0.01 -2.13 -0.16 0.00 0.00 0.00 0.00 46.02 43.73 1f91 n GLY 234 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1f91 s GLY 235 N 0.00 1.69 -0.15 -0.02 0.00 -0.43 -1.10 107.32 107.30 1f91 s GLY 235 Ca 0.00 -1.65 -0.30 0.00 0.00 0.00 0.00 44.72 42.76 1f91 s GLY 235 CO 0.00 -1.12 0.97 -0.32 0.00 0.00 0.00 173.10 172.63 1f91 s GLY 236 N -3.27 -0.29 -0.10 0.20 0.00 -0.50 -2.24 107.32 101.13 1f91 s GLY 236 Ca 0.33 1.97 -0.15 0.00 0.00 0.00 0.00 44.72 46.87 1f91 s GLY 236 CO 0.22 1.02 0.38 -0.29 0.00 0.00 0.00 173.10 174.44 1f91 s MET 237 N -1.12 0.57 0.03 2.90 1.75 -0.47 -1.48 119.30 121.48 1f91 s MET 237 Ca -0.02 0.29 0.03 0.00 -1.25 0.00 0.00 55.69 54.73 1f91 s MET 237 Cb -0.00 0.27 -0.02 0.00 2.84 0.00 0.00 34.83 37.91 1f91 s MET 237 CO 0.02 -0.11 -0.09 0.14 -0.65 0.00 0.00 175.02 174.33 1f91 s VAL 238 N -0.39 0.66 -0.42 10.11 -7.23 0.85 -0.81 120.40 123.16 1f91 s VAL 238 Ca -0.05 -0.91 -0.19 0.00 -1.81 0.00 0.00 61.98 59.02 1f91 s VAL 238 Cb -0.03 -0.66 0.02 0.00 0.56 0.00 0.00 36.38 36.26 1f91 s VAL 238 CO 0.02 -0.21 0.53 -0.69 -0.31 0.00 0.00 175.10 174.45 1f91 s VAL 239 N -1.03 4.97 -0.22 1.32 1.01 -0.10 -1.54 120.40 124.80 1f91 s VAL 239 Ca -0.05 -0.08 -0.16 0.00 0.00 0.00 0.00 61.98 61.70 1f91 s VAL 239 Cb -0.08 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 1f91 s VAL 239 CO 0.01 -0.47 0.39 -0.69 0.00 0.00 0.00 175.10 174.33 1f91 s VAL 240 N 2.46 5.19 0.03 2.92 1.01 -0.74 -1.52 120.40 129.75 1f91 s VAL 240 Ca 0.17 0.66 0.03 0.00 0.00 0.00 0.00 61.98 62.84 1f91 s VAL 240 Cb -0.16 -3.72 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 1f91 s VAL 240 CO 0.16 0.22 -0.09 -0.70 0.00 0.00 0.00 175.10 174.69 1f91 s GLU 241 N 1.56 0.60 0.58 2.72 2.12 0.49 -1.04 118.70 125.74 1f91 s GLU 241 Ca 0.18 -0.62 -0.20 0.00 0.36 0.00 0.00 54.97 54.69 1f91 s GLU 241 Cb -0.15 -0.48 -0.04 0.00 0.26 0.00 0.00 34.13 33.72 1f91 s GLU 241 CO 0.08 0.11 1.27 -2.00 -0.54 0.00 0.00 175.26 174.18 1f91 s GLU 242 N -1.12 2.99 0.06 4.30 -6.30 -0.05 -0.91 118.70 117.67 1f91 s GLU 242 Ca -0.04 1.99 -0.27 0.00 -2.50 0.00 0.00 54.97 54.15 1f91 s GLU 242 Cb -0.07 -2.04 -0.17 0.00 0.00 0.00 0.00 34.13 31.84 1f91 s GLU 242 CO 0.01 -1.24 1.60 1.25 0.02 0.00 0.00 175.26 176.89 1f91 h LEU 243 N 1.07 -0.35 -0.84 2.70 5.85 -1.21 -2.34 115.31 120.19 1f91 h LEU 243 Ca -0.51 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.16 1f91 h LEU 243 Cb 1.30 0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.39 1f91 h LEU 243 CO 0.56 -0.19 0.46 -0.33 -0.34 0.00 0.00 178.44 178.59 1f91 h GLU 244 N -0.49 1.17 -0.87 1.25 4.39 -1.93 -1.58 114.58 116.52 1f91 h GLU 244 Ca -0.04 -0.14 0.04 0.00 0.34 0.00 0.00 59.36 59.56 1f91 h GLU 244 Cb 0.37 -0.23 -0.05 0.00 -0.10 0.00 0.00 28.75 28.74 1f91 h GLU 244 CO 0.07 0.86 0.57 1.25 -1.16 0.00 0.00 179.01 180.60 1f91 h HIS 245 N 1.16 1.03 -0.12 4.33 2.76 -1.94 0.93 115.15 123.30 1f91 h HIS 245 Ca 0.29 0.03 -0.13 0.00 -2.20 0.00 0.00 60.37 58.36 1f91 h HIS 245 Cb 0.03 -0.34 0.00 0.00 1.55 0.00 0.00 27.41 28.65 1f91 h HIS 245 CO 0.01 0.59 -0.44 0.00 -1.30 0.00 0.00 177.93 176.78 1f91 h ALA 246 N 1.50 0.22 -0.63 5.26 0.00 -0.88 -3.11 119.26 121.62 1f91 h ALA 246 Ca 0.35 -0.48 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 1f91 h ALA 246 Cb 0.07 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1f91 h ALA 246 CO -0.11 0.35 0.08 -0.07 0.00 0.00 0.00 179.25 179.50 1f91 h LEU 247 N 0.12 1.00 -1.60 0.00 3.38 -0.94 -1.99 115.31 115.28 1f91 h LEU 247 Ca -0.02 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 1f91 h LEU 247 Cb 1.07 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 1f91 h LEU 247 CO 0.09 1.01 0.20 0.00 0.09 0.00 0.00 178.44 179.84 1f91 h ALA 248 N 1.10 1.70 -0.70 1.53 0.00 -0.85 -2.47 119.26 119.57 1f91 h ALA 248 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1f91 h ALA 248 Cb 0.45 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1f91 h ALA 248 CO 0.02 0.26 0.00 2.89 0.00 0.00 0.00 179.25 182.41 1f91 n ARG 249 N -4.46 3.02 -3.06 0.00 1.85 -1.13 -4.95 116.66 107.93 1f91 n ARG 249 Ca 0.02 -2.69 -0.21 0.00 -1.00 0.00 0.00 57.85 53.97 1f91 n ARG 249 Cb 0.08 -1.67 0.04 0.00 -1.05 0.00 0.00 32.46 29.86 1f91 n ARG 249 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1f91 n GLY 250 N 1.49 -0.46 3.78 2.89 0.00 -0.93 -4.97 105.19 106.99 1f91 n GLY 250 Ca 0.25 0.10 -0.32 0.00 0.00 0.00 0.00 46.02 46.05 1f91 n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f91 s ALA 251 N -3.17 2.45 -0.16 4.61 0.00 -0.76 -4.99 121.76 119.73 1f91 s ALA 251 Ca 0.33 0.32 -0.23 0.00 0.00 0.00 0.00 51.96 52.39 1f91 s ALA 251 Cb -0.14 -3.26 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 1f91 s ALA 251 CO 0.41 -1.41 0.71 -1.58 0.00 0.00 0.00 175.76 173.88 1f91 s HIS 252 N -2.72 3.43 -0.27 0.00 5.65 -1.26 -4.88 115.29 115.24 1f91 s HIS 252 Ca 0.62 1.10 -0.08 0.00 0.25 0.00 0.00 55.06 56.95 1f91 s HIS 252 Cb -0.17 -2.87 -0.02 0.00 -1.18 0.00 0.00 32.58 28.34 1f91 s HIS 252 CO 0.49 -0.14 0.10 0.42 -0.65 0.00 0.00 174.74 174.96 1f91 s ILE 253 N 1.76 4.41 -0.00 0.89 1.01 -1.26 -4.37 121.20 123.63 1f91 s ILE 253 Ca 0.34 -0.27 -0.20 0.00 0.00 0.00 0.00 60.65 60.51 1f91 s ILE 253 Cb -0.16 -3.14 -0.23 0.00 0.01 0.00 0.00 42.46 38.94 1f91 s ILE 253 CO 0.12 0.23 1.09 1.88 0.00 0.00 0.00 174.94 178.27 1f91 h TYR 254 N 8.27 0.55 -1.46 3.97 0.05 -1.67 -3.47 116.97 123.22 1f91 h TYR 254 Ca -0.36 -0.30 0.30 0.00 0.05 0.00 0.00 58.73 58.43 1f91 h TYR 254 Cb 1.16 -0.06 -0.14 0.00 1.01 0.00 0.00 36.73 38.70 1f91 h TYR 254 CO 0.66 1.11 0.82 0.00 -1.05 0.00 0.00 178.16 179.70 1f91 s ALA 255 N -3.21 -2.18 -0.04 3.88 0.00 -1.25 -4.70 121.76 114.26 1f91 s ALA 255 Ca -0.14 0.95 -0.03 0.00 0.00 0.00 0.00 51.96 52.75 1f91 s ALA 255 Cb 0.03 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.33 1f91 s ALA 255 CO 0.81 -0.92 0.12 -2.00 0.00 0.00 0.00 175.76 173.77 1f91 s GLU 256 N -2.43 3.26 -0.44 0.00 2.12 0.36 -1.22 118.70 120.34 1f91 s GLU 256 Ca 0.13 -0.35 -0.20 0.00 0.36 0.00 0.00 54.97 54.91 1f91 s GLU 256 Cb 0.03 -3.00 0.03 0.00 0.26 0.00 0.00 34.13 31.44 1f91 s GLU 256 CO -0.04 0.69 0.61 0.42 -0.54 0.00 0.00 175.26 176.40 1f91 s ILE 257 N -1.17 4.87 -1.50 -3.70 1.01 0.14 -0.91 121.20 119.94 1f91 s ILE 257 Ca 0.22 -0.01 0.20 0.00 0.00 0.00 0.00 60.65 61.05 1f91 s ILE 257 Cb -0.12 -4.19 -0.09 0.00 0.01 0.00 0.00 42.46 38.08 1f91 s ILE 257 CO 0.12 -0.59 0.94 1.33 0.00 0.00 0.00 174.94 176.75 1f91 n VAL 258 N 5.77 0.00 -3.68 2.92 0.24 -0.55 -4.56 118.33 118.47 1f91 n VAL 258 Ca -0.03 -0.19 -0.13 0.00 -2.04 0.00 0.00 64.34 61.95 1f91 n VAL 258 Cb 0.48 1.15 -0.09 0.00 -1.47 0.00 0.00 33.84 33.91 1f91 n VAL 258 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1f91 s GLY 259 N -2.50 -0.42 -0.16 7.63 0.00 -1.06 -4.79 107.32 106.02 1f91 s GLY 259 Ca 0.13 1.61 -0.04 0.00 0.00 0.00 0.00 44.72 46.42 1f91 s GLY 259 CO 0.62 1.44 0.23 -0.47 0.00 0.00 0.00 173.10 174.92 1f91 s TYR 260 N 0.46 -0.34 0.01 1.90 5.04 -1.26 -0.63 117.35 122.54 1f91 s TYR 260 Ca -0.01 0.54 0.04 0.00 -2.44 0.00 0.00 57.07 55.20 1f91 s TYR 260 Cb -0.04 -0.23 -0.03 0.00 0.35 0.00 0.00 41.96 42.01 1f91 s TYR 260 CO -0.02 -0.48 -0.10 0.20 -1.34 0.00 0.00 175.55 173.81 1f91 s GLY 261 N 2.36 1.69 -0.17 8.97 0.00 0.14 -4.53 107.32 115.79 1f91 s GLY 261 Ca 0.05 -1.06 -0.04 0.00 0.00 0.00 0.00 44.72 43.67 1f91 s GLY 261 CO -0.10 -0.92 0.21 0.00 0.00 0.00 0.00 173.10 172.28 1f91 s ALA 262 N -0.96 -0.25 0.36 3.20 0.00 -1.26 -1.31 121.76 121.54 1f91 s ALA 262 Ca 0.16 0.35 0.05 0.00 0.00 0.00 0.00 51.96 52.52 1f91 s ALA 262 Cb -0.11 -1.19 -0.03 0.00 0.00 0.00 0.00 23.12 21.79 1f91 s ALA 262 CO 0.07 -1.04 0.19 0.95 0.00 0.00 0.00 175.76 175.93 1f91 s THR 263 N 2.32 0.32 0.01 0.00 -4.23 -0.83 -4.99 115.64 108.24 1f91 s THR 263 Ca 0.05 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.59 1f91 s THR 263 Cb -0.15 -2.43 -0.01 0.00 1.34 0.00 0.00 72.50 71.25 1f91 s THR 263 CO -0.10 0.00 -0.08 -0.55 -0.54 0.00 0.00 174.62 173.34 1f91 s SER 264 N -3.48 0.94 0.02 3.99 0.15 -1.26 -0.92 113.70 113.14 1f91 s SER 264 Ca 0.32 -0.27 -0.17 0.00 0.70 0.00 0.00 55.95 56.54 1f91 s SER 264 Cb 0.03 -0.06 -0.35 0.00 -1.71 0.00 0.00 66.02 63.93 1f91 s SER 264 CO 0.20 0.01 1.00 0.44 1.20 0.00 0.00 173.24 176.08 1f91 h ASP 265 N 5.49 0.81 -5.17 5.45 3.32 -0.89 -3.44 116.42 121.99 1f91 h ASP 265 Ca -0.32 -0.91 -0.41 0.00 0.02 0.00 0.00 57.03 55.41 1f91 h ASP 265 Cb 1.19 -0.26 0.07 0.00 0.22 0.00 0.00 39.33 40.55 1f91 h ASP 265 CO 0.47 1.66 -0.64 0.61 -1.72 0.00 0.00 179.24 179.62 1f91 n GLY 266 N 1.68 -0.53 0.00 2.75 0.00 -1.26 -4.87 105.19 102.95 1f91 n GLY 266 Ca -0.16 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1f91 n GLY 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f91 n ALA 267 N -4.18 1.17 -2.83 4.61 0.00 -1.26 -5.13 120.51 112.89 1f91 n ALA 267 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.06 1f91 n ALA 267 Cb 0.59 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.98 1f91 n ALA 267 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1f91 s ASP 268 N 1.00 5.94 0.17 0.00 2.15 -1.26 -5.02 116.67 119.64 1f91 s ASP 268 Ca 0.00 0.19 -0.07 0.00 0.43 0.00 0.00 52.55 53.10 1f91 s ASP 268 Cb 0.00 -1.75 0.03 0.00 -0.30 0.00 0.00 42.92 40.90 1f91 s ASP 268 CO 0.00 0.24 1.49 -0.03 -0.17 0.00 0.00 175.17 176.70 1f91 h MET 269 N 3.75 0.75 0.00 4.34 -1.53 -1.99 -3.33 114.93 116.92 1f91 h MET 269 Ca -0.48 -0.44 -0.06 0.00 -3.44 0.00 0.00 59.70 55.29 1f91 h MET 269 Cb 1.18 0.03 -0.01 0.00 -0.55 0.00 0.00 31.60 32.25 1f91 h MET 269 CO 0.67 1.06 -1.35 0.28 0.14 0.00 0.00 176.91 177.71 1f91 n VAL 270 N -4.01 0.21 -4.46 -5.77 0.31 -1.26 -0.02 118.33 103.34 1f91 n VAL 270 Ca -0.03 -0.20 -0.34 0.00 -0.01 0.00 0.00 64.34 63.76 1f91 n VAL 270 Cb 0.58 -0.29 -0.10 0.00 -0.91 0.00 0.00 33.84 33.12 1f91 n VAL 270 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1f91 s ALA 271 N -2.28 3.14 0.66 3.52 0.00 -1.26 -4.80 121.76 120.74 1f91 s ALA 271 Ca -0.03 -0.83 -0.16 0.00 0.00 0.00 0.00 51.96 50.94 1f91 s ALA 271 Cb 0.03 -1.42 0.00 0.00 0.00 0.00 0.00 23.12 21.73 1f91 s ALA 271 CO 0.25 0.51 1.16 -1.25 0.00 0.00 0.00 175.76 176.43 1f91 s PRO 272 N -0.63 2.67 0.10 0.00 0.04 -1.26 -4.23 135.00 131.69 1f91 s PRO 272 Ca 0.10 1.60 0.22 0.00 0.04 0.00 0.00 61.00 62.96 1f91 s PRO 272 Cb -0.12 -1.91 -0.14 0.00 0.04 0.00 0.00 34.50 32.37 1f91 s PRO 272 CO 0.02 -1.39 0.80 -1.13 0.04 0.00 0.00 177.00 175.34 1f91 n SER 273 N -2.27 0.50 0.00 6.66 3.41 -1.26 -4.96 113.62 115.69 1f91 n SER 273 Ca 0.12 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.92 1f91 n SER 273 Cb 0.51 1.09 0.00 0.00 -0.26 0.00 0.00 64.21 65.54 1f91 n SER 273 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1f91 n GLY 274 N 1.22 2.33 0.29 5.00 0.00 -1.26 -4.75 105.19 108.02 1f91 n GLY 274 Ca -0.02 -0.45 0.01 0.00 0.00 0.00 0.00 46.02 45.56 1f91 n GLY 274 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1f91 h GLU 275 N 0.00 0.78 -0.43 1.61 4.22 -1.93 -1.32 114.58 117.52 1f91 h GLU 275 Ca 0.00 -0.05 -0.06 0.00 0.08 0.00 0.00 59.36 59.33 1f91 h GLU 275 Cb 0.00 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 1f91 h GLU 275 CO 0.00 0.52 0.00 0.78 -2.18 0.00 0.00 179.01 178.13 1f91 h GLY 276 N 0.81 0.75 1.03 1.92 0.00 -1.85 -2.39 103.07 103.33 1f91 h GLY 276 Ca 0.36 -0.48 -0.07 0.00 0.00 0.00 0.00 47.33 47.14 1f91 h GLY 276 CO -0.20 0.44 0.11 0.00 0.00 0.00 0.00 176.54 176.89 1f91 h ALA 277 N 1.35 0.80 0.33 3.60 0.00 -1.67 -1.25 119.26 122.43 1f91 h ALA 277 Ca 0.13 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1f91 h ALA 277 Cb 0.40 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1f91 h ALA 277 CO 0.02 0.54 -0.31 0.28 0.00 0.00 0.00 179.25 179.77 1f91 h VAL 278 N 0.89 0.35 -0.52 0.00 2.07 -0.95 -0.67 116.25 117.42 1f91 h VAL 278 Ca 0.18 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.73 1f91 h VAL 278 Cb 0.40 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 1f91 h VAL 278 CO 0.01 0.00 0.34 0.03 0.02 0.00 0.00 177.57 177.97 1f91 h ARG 279 N -0.66 0.60 -0.01 1.57 3.08 -1.32 -1.73 114.38 115.89 1f91 h ARG 279 Ca -0.02 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 1f91 h ARG 279 Cb 0.60 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.51 1f91 h ARG 279 CO -0.05 0.39 0.00 0.00 -1.07 0.00 0.00 179.97 179.25 1f91 h MET 281 N -0.27 0.92 -0.61 0.00 2.86 -0.90 -1.85 114.93 115.08 1f91 h MET 281 Ca 0.00 -0.18 -0.03 0.00 -2.06 0.00 0.00 59.70 57.44 1f91 h MET 281 Cb 0.31 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 1f91 h MET 281 CO 0.00 0.80 0.28 0.87 1.06 0.00 0.00 176.91 179.92 1f91 h LYS 282 N 0.85 0.87 -0.43 1.72 1.57 -1.30 -1.43 116.57 118.43 1f91 h LYS 282 Ca 0.20 -0.12 -0.06 0.00 -1.87 0.00 0.00 60.65 58.79 1f91 h LYS 282 Cb 0.24 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 1f91 h LYS 282 CO -0.01 0.69 0.02 1.98 -0.57 0.00 0.00 179.45 181.56 1f91 h MET 283 N 0.87 0.74 -0.09 3.15 4.05 -0.94 -1.92 114.93 120.78 1f91 h MET 283 Ca 0.21 -0.23 -0.05 0.00 -0.28 0.00 0.00 59.70 59.35 1f91 h MET 283 Cb 0.12 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 30.84 1f91 h MET 283 CO -0.02 0.81 -0.19 0.00 0.23 0.00 0.00 176.91 177.73 1f91 h ALA 284 N 0.91 1.51 0.00 0.39 0.00 -0.96 -2.89 119.26 118.21 1f91 h ALA 284 Ca 0.12 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1f91 h ALA 284 Cb 0.46 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1f91 h ALA 284 CO 0.02 0.36 -0.20 0.52 0.00 0.00 0.00 179.25 179.94 1f91 h MET 285 N 0.14 0.00 -6.27 0.00 2.07 -1.00 -3.37 114.93 106.51 1f91 h MET 285 Ca 0.03 0.00 -0.62 0.00 -2.07 0.00 0.00 59.70 57.04 1f91 h MET 285 Cb 0.43 0.00 0.02 0.00 -1.87 0.00 0.00 31.60 30.18 1f91 h MET 285 CO 0.03 0.00 1.11 1.58 1.07 0.00 0.00 176.91 180.70 1f91 n HIS 286 N -2.90 2.32 0.00 -0.22 -0.00 -0.74 -0.86 115.22 112.82 1f91 n HIS 286 Ca 0.03 -0.01 0.00 0.00 0.46 0.00 0.00 57.72 58.21 1f91 n HIS 286 Cb 0.52 -2.67 0.00 0.00 -0.12 0.00 0.00 29.99 27.72 1f91 n HIS 286 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1f91 n GLY 287 N 4.45 1.03 3.54 1.57 0.00 -1.26 -4.97 105.19 109.55 1f91 n GLY 287 Ca 0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.82 1f91 n GLY 287 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f91 s VAL 288 N -2.26 4.57 -0.36 1.61 1.01 -0.04 -4.91 120.40 120.01 1f91 s VAL 288 Ca 0.00 0.46 0.21 0.00 0.00 0.00 0.00 61.98 62.66 1f91 s VAL 288 Cb 0.00 -4.39 0.27 0.00 0.00 0.00 0.00 36.38 32.27 1f91 s VAL 288 CO 0.00 -0.81 1.58 -2.24 0.00 0.00 0.00 175.10 173.62 1f91 h ASP 289 N 9.06 0.00 -3.35 3.32 -0.00 -1.96 -3.45 116.42 120.04 1f91 h ASP 289 Ca -0.25 0.00 -0.50 0.00 -0.00 0.00 0.00 57.03 56.28 1f91 h ASP 289 Cb 1.08 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.41 1f91 h ASP 289 CO 1.00 0.12 -0.04 0.42 -0.00 0.00 0.00 179.24 180.74 1f91 s THR 290 N -3.16 4.95 0.72 1.15 -4.23 -1.26 -5.08 115.64 108.73 1f91 s THR 290 Ca 0.06 0.18 -0.11 0.00 -1.18 0.00 0.00 61.69 60.64 1f91 s THR 290 Cb 0.06 -3.76 0.02 0.00 1.34 0.00 0.00 72.50 70.16 1f91 s THR 290 CO 0.69 -0.47 1.09 -2.16 -0.54 0.00 0.00 174.62 173.23 1f91 s PRO 291 N -3.86 2.74 -0.28 3.99 0.04 -1.26 -5.01 135.00 131.37 1f91 s PRO 291 Ca 0.46 0.54 -0.23 0.00 0.04 0.00 0.00 61.00 61.80 1f91 s PRO 291 Cb -0.10 -2.00 -0.00 0.00 0.04 0.00 0.00 34.50 32.43 1f91 s PRO 291 CO 0.33 -1.13 0.78 0.42 0.04 0.00 0.00 177.00 177.44 1f91 s ILE 292 N -3.29 4.83 -0.01 0.56 -1.09 -1.26 -4.51 121.20 116.42 1f91 s ILE 292 Ca 0.59 1.32 -0.12 0.00 -2.23 0.00 0.00 60.65 60.21 1f91 s ILE 292 Cb -0.12 -4.11 -0.32 0.00 -1.58 0.00 0.00 42.46 36.33 1f91 s ILE 292 CO 0.53 -0.15 0.81 0.44 -1.23 0.00 0.00 174.94 175.33 1f91 h ASP 293 N 7.93 0.68 -4.40 3.58 3.32 -1.32 -3.42 116.42 122.79 1f91 h ASP 293 Ca -0.24 -0.89 -0.25 0.00 0.02 0.00 0.00 57.03 55.66 1f91 h ASP 293 Cb 1.10 -0.22 -0.24 0.00 0.22 0.00 0.00 39.33 40.18 1f91 h ASP 293 CO 0.87 1.73 -0.73 -0.47 -1.72 0.00 0.00 179.24 178.92 1f91 s TYR 294 N -2.59 0.39 -0.20 4.55 5.04 -1.17 -2.06 117.35 121.31 1f91 s TYR 294 Ca -0.13 -0.31 -0.01 0.00 -2.44 0.00 0.00 57.07 54.19 1f91 s TYR 294 Cb 0.05 -0.25 0.06 0.00 0.35 0.00 0.00 41.96 42.17 1f91 s TYR 294 CO 0.89 -0.07 -0.02 -1.17 -1.34 0.00 0.00 175.55 173.83 1f91 s LEU 295 N -0.88 1.87 -0.69 6.97 0.20 0.40 -1.13 118.68 125.42 1f91 s LEU 295 Ca -0.07 -0.93 -0.23 0.00 0.69 0.00 0.00 54.13 53.60 1f91 s LEU 295 Cb -0.06 -0.92 0.07 0.00 -0.43 0.00 0.00 46.19 44.85 1f91 s LEU 295 CO -0.00 -0.25 1.02 0.21 -0.29 0.00 0.00 176.35 177.05 1f91 s ASN 296 N 1.61 6.21 0.93 3.68 3.84 0.63 -3.12 114.94 128.72 1f91 s ASN 296 Ca -0.03 -1.01 -0.12 0.00 0.21 0.00 0.00 52.86 51.92 1f91 s ASN 296 Cb -0.17 -2.44 0.15 0.00 -0.55 0.00 0.00 41.25 38.24 1f91 s ASN 296 CO -0.07 -1.47 1.09 -0.94 -2.79 0.00 0.00 177.10 172.92 1f91 s SER 297 N 3.72 3.15 -0.01 -4.21 1.04 -1.20 -2.21 113.70 113.98 1f91 s SER 297 Ca 0.25 1.41 -0.23 0.00 0.48 0.00 0.00 55.95 57.86 1f91 s SER 297 Cb -0.15 -2.08 -0.19 0.00 0.10 0.00 0.00 66.02 63.70 1f91 s SER 297 CO 0.09 -2.83 1.21 -0.74 0.98 0.00 0.00 173.24 171.95 1f91 h HIS 298 N -1.68 0.27 -1.22 5.02 2.76 -1.93 -3.43 115.15 114.93 1f91 h HIS 298 Ca -0.51 -0.10 0.00 0.00 -2.20 0.00 0.00 60.37 57.56 1f91 h HIS 298 Cb 1.30 -0.05 0.00 0.00 1.55 0.00 0.00 27.41 30.21 1f91 h HIS 298 CO 0.38 0.75 0.00 0.41 -1.30 0.00 0.00 177.93 178.18 1f91 n GLY 299 N 0.51 0.00 0.05 5.26 0.00 -1.26 -4.83 105.19 104.92 1f91 n GLY 299 Ca -0.08 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.08 1f91 n GLY 299 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1f91 n THR 300 N 0.20 0.00 -2.28 2.61 -2.24 -1.26 -4.57 114.28 106.73 1f91 n THR 300 Ca 0.00 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1f91 n THR 300 Cb 0.00 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 1f91 n THR 300 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1f91 n SER 301 N -1.25 -1.88 -4.53 3.42 2.88 -1.26 -3.99 113.62 107.01 1f91 n SER 301 Ca 0.11 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.36 1f91 n SER 301 Cb 0.30 -0.47 -0.10 0.00 -0.75 0.00 0.00 64.21 63.19 1f91 n SER 301 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1f91 s THR 302 N -2.93 3.07 0.12 2.46 -4.23 -1.26 -1.98 115.64 110.89 1f91 s THR 302 Ca 0.00 -1.47 -0.29 0.00 -1.18 0.00 0.00 61.69 58.75 1f91 s THR 302 Cb 0.00 -2.44 -0.08 0.00 1.34 0.00 0.00 72.50 71.32 1f91 s THR 302 CO 0.00 0.06 1.60 -0.65 -0.54 0.00 0.00 174.62 175.09 1f91 h PRO 303 N 3.53 -0.55 0.07 3.99 0.11 -1.94 -2.51 132.00 134.70 1f91 h PRO 303 Ca -0.49 0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 1f91 h PRO 303 Cb 1.17 0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1f91 h PRO 303 CO 0.49 -0.37 -0.03 0.28 -0.21 0.00 0.00 178.00 178.16 1f91 h VAL 304 N -0.57 1.19 -0.19 3.15 2.07 -1.98 -3.33 116.25 116.58 1f91 h VAL 304 Ca 0.04 -1.44 0.05 0.00 0.82 0.00 0.00 66.70 66.18 1f91 h VAL 304 Cb 0.62 2.06 -0.07 0.00 -1.52 0.00 0.00 31.29 32.38 1f91 h VAL 304 CO -0.25 0.33 -0.29 1.23 0.02 0.00 0.00 177.57 178.60 1f91 h GLY 305 N -0.80 -0.33 0.12 2.17 0.00 -1.96 -1.91 103.07 100.35 1f91 h GLY 305 Ca -0.01 0.36 0.13 0.00 0.00 0.00 0.00 47.33 47.82 1f91 h GLY 305 CO 0.02 -0.21 0.21 -0.55 0.00 0.00 0.00 176.54 176.01 1f91 h ASP 306 N -0.34 0.12 -0.08 0.19 5.19 -1.61 -2.51 116.42 117.39 1f91 h ASP 306 Ca 0.12 0.12 -0.20 0.00 -0.62 0.00 0.00 57.03 56.44 1f91 h ASP 306 Cb 0.52 0.13 0.00 0.00 0.18 0.00 0.00 39.33 40.16 1f91 h ASP 306 CO -0.38 0.04 -0.69 -0.37 -3.12 0.00 0.00 179.24 174.72 1f91 h VAL 307 N 0.34 1.30 -0.60 -1.35 -1.51 -1.60 -2.58 116.25 110.25 1f91 h VAL 307 Ca 0.38 -1.93 0.06 0.00 -1.23 0.00 0.00 66.70 63.97 1f91 h VAL 307 Cb 0.58 1.90 -0.05 0.00 -2.13 0.00 0.00 31.29 31.59 1f91 h VAL 307 CO -0.42 0.61 0.31 0.11 -1.23 0.00 0.00 177.57 176.94 1f91 h LYS 308 N 0.51 0.56 -0.55 5.19 1.79 -0.94 0.56 116.57 123.68 1f91 h LYS 308 Ca -0.03 -0.03 -0.11 0.00 -2.18 0.00 0.00 60.65 58.30 1f91 h LYS 308 Cb 1.30 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 31.81 1f91 h LYS 308 CO 0.14 0.37 -0.08 1.49 -1.08 0.00 0.00 179.45 180.29 1f91 h GLU 309 N 0.57 1.02 -0.81 3.15 4.81 -1.47 -1.38 114.58 120.48 1f91 h GLU 309 Ca 0.27 -0.36 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 1f91 h GLU 309 Cb 0.20 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.46 1f91 h GLU 309 CO -0.19 1.05 0.48 -0.07 -0.73 0.00 0.00 179.01 179.54 1f91 h LEU 310 N 0.92 0.98 -0.54 1.64 3.38 -0.92 0.17 115.31 120.95 1f91 h LEU 310 Ca 0.15 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1f91 h LEU 310 Cb 0.64 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1f91 h LEU 310 CO 0.04 0.77 0.13 0.00 0.09 0.00 0.00 178.44 179.47 1f91 h ALA 311 N 1.25 0.71 -0.56 1.53 0.00 -0.66 -1.22 119.26 120.31 1f91 h ALA 311 Ca 0.29 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1f91 h ALA 311 Cb -0.02 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1f91 h ALA 311 CO -0.05 0.41 0.29 0.00 0.00 0.00 0.00 179.25 179.90 1f91 h ALA 312 N 1.01 0.72 -0.81 0.00 0.00 -0.59 -1.13 119.26 118.46 1f91 h ALA 312 Ca 0.17 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1f91 h ALA 312 Cb 0.35 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1f91 h ALA 312 CO 0.00 0.26 0.40 0.82 0.00 0.00 0.00 179.25 180.73 1f91 h ILE 313 N 0.75 1.25 -0.59 0.00 2.04 -0.42 -1.88 117.51 118.66 1f91 h ILE 313 Ca 0.19 -0.70 -0.07 0.00 1.00 0.00 0.00 64.86 65.29 1f91 h ILE 313 Cb 0.08 0.22 -0.03 0.00 -0.74 0.00 0.00 36.82 36.35 1f91 h ILE 313 CO -0.03 0.30 0.10 -0.09 0.00 0.00 0.00 178.15 178.43 1f91 h ARG 314 N 1.14 0.96 -0.20 2.37 2.43 -0.84 -0.54 114.38 119.70 1f91 h ARG 314 Ca 0.28 -0.23 -0.13 0.00 -0.81 0.00 0.00 59.98 59.09 1f91 h ARG 314 Cb 0.11 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1f91 h ARG 314 CO -0.04 0.88 -0.41 1.49 -1.51 0.00 0.00 179.97 180.39 1f91 h GLU 315 N 0.90 0.46 0.10 0.20 4.81 -0.79 -0.93 114.58 119.33 1f91 h GLU 315 Ca 0.19 -0.23 -0.14 0.00 -0.13 0.00 0.00 59.36 59.04 1f91 h GLU 315 Cb 0.39 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.79 1f91 h GLU 315 CO 0.01 0.79 -0.64 0.28 -0.73 0.00 0.00 179.01 178.72 1f91 h VAL 316 N 0.38 1.55 -0.02 0.32 2.07 -1.04 -3.37 116.25 116.14 1f91 h VAL 316 Ca 0.03 -2.48 0.00 0.00 0.82 0.00 0.00 66.70 65.08 1f91 h VAL 316 Cb 0.88 3.22 0.00 0.00 -1.52 0.00 0.00 31.29 33.87 1f91 h VAL 316 CO 0.07 0.68 -0.08 0.49 0.02 0.00 0.00 177.57 178.76 1f91 n PHE 317 N -4.25 0.00 0.00 1.57 3.01 -0.24 -5.02 117.46 112.53 1f91 n PHE 317 Ca -0.14 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.32 1f91 n PHE 317 Cb 0.73 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 40.18 1f91 n PHE 317 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1f91 n GLY 318 N 1.25 2.97 0.11 1.37 0.00 -0.36 -1.33 105.19 109.21 1f91 n GLY 318 Ca 0.16 0.13 -0.00 0.00 0.00 0.00 0.00 46.02 46.31 1f91 n GLY 318 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1f91 h ASP 319 N 0.00 0.00 -0.50 1.61 3.45 -1.96 -3.38 116.42 115.65 1f91 h ASP 319 Ca 0.00 0.00 -0.54 0.00 0.43 0.00 0.00 57.03 56.92 1f91 h ASP 319 Cb 0.00 0.00 -0.07 0.00 -0.56 0.00 0.00 39.33 38.70 1f91 h ASP 319 CO 0.00 0.62 1.78 1.17 -1.57 0.00 0.00 179.24 181.24 1f91 n LYS 320 N -3.16 3.26 -1.85 3.56 0.00 -0.44 -4.97 118.16 114.57 1f91 n LYS 320 Ca -0.02 -2.25 -0.41 0.00 0.00 0.00 0.00 58.31 55.63 1f91 n LYS 320 Cb 0.81 -2.43 -0.00 0.00 0.00 0.00 0.00 35.03 33.40 1f91 n LYS 320 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1f91 s SER 321 N 1.32 6.39 0.75 3.14 0.15 -1.25 -4.90 113.70 119.31 1f91 s SER 321 Ca 0.63 3.00 -0.06 0.00 0.70 0.00 0.00 55.95 60.22 1f91 s SER 321 Cb 0.26 -2.67 0.11 0.00 -1.71 0.00 0.00 66.02 62.01 1f91 s SER 321 CO -0.09 -0.83 1.06 -2.16 1.20 0.00 0.00 173.24 172.42 1f91 s PRO 322 N -2.06 1.71 0.30 5.44 0.04 -1.26 -4.79 135.00 134.37 1f91 s PRO 322 Ca 0.52 -0.62 -0.29 0.00 0.04 0.00 0.00 61.00 60.65 1f91 s PRO 322 Cb -0.45 -2.18 -0.10 0.00 0.04 0.00 0.00 34.50 31.81 1f91 s PRO 322 CO 0.62 -1.52 1.26 0.00 0.04 0.00 0.00 177.00 177.39 1f91 s ALA 323 N -3.31 3.48 0.01 8.56 0.00 -0.87 -4.34 121.76 125.29 1f91 s ALA 323 Ca 0.65 1.15 0.04 0.00 0.00 0.00 0.00 51.96 53.80 1f91 s ALA 323 Cb -0.07 -3.44 -0.01 0.00 0.00 0.00 0.00 23.12 19.59 1f91 s ALA 323 CO 0.46 -0.51 -0.12 0.42 0.00 0.00 0.00 175.76 176.01 1f91 s ILE 324 N -0.95 0.96 -0.28 0.00 1.01 0.28 -0.46 121.20 121.77 1f91 s ILE 324 Ca 0.49 -0.71 -0.21 0.00 0.00 0.00 0.00 60.65 60.22 1f91 s ILE 324 Cb -0.37 -0.84 0.08 0.00 0.01 0.00 0.00 42.46 41.34 1f91 s ILE 324 CO 0.48 0.13 0.76 -0.94 0.00 0.00 0.00 174.94 175.36 1f91 s SER 325 N -0.67 -0.78 -0.43 3.58 1.04 -1.18 -0.78 113.70 114.48 1f91 s SER 325 Ca 0.03 1.38 -0.14 0.00 0.48 0.00 0.00 55.95 57.69 1f91 s SER 325 Cb -0.06 1.37 0.04 0.00 0.10 0.00 0.00 66.02 67.47 1f91 s SER 325 CO 0.00 -0.23 0.32 0.00 0.98 0.00 0.00 173.24 174.31 1f91 s ALA 326 N 0.88 3.47 -0.57 5.32 0.00 -1.26 -3.23 121.76 126.36 1f91 s ALA 326 Ca -0.04 -1.90 0.23 0.00 0.00 0.00 0.00 51.96 50.26 1f91 s ALA 326 Cb -0.05 -2.90 0.93 0.00 0.00 0.00 0.00 23.12 21.11 1f91 s ALA 326 CO -0.08 -1.56 1.70 0.25 0.00 0.00 0.00 175.76 176.07 1f91 n THR 327 N 5.13 0.79 0.31 0.00 -2.24 -1.26 -2.53 114.28 114.49 1f91 n THR 327 Ca -0.12 0.15 0.21 0.00 -2.27 0.00 0.00 64.05 62.02 1f91 n THR 327 Cb 0.45 -1.05 1.01 0.00 -2.10 0.00 0.00 70.33 68.64 1f91 n THR 327 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1f91 h LYS 328 N 0.00 0.00 0.00 -0.78 1.57 -1.82 0.79 116.57 116.34 1f91 h LYS 328 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1f91 h LYS 328 Cb 0.41 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.72 1f91 h LYS 328 CO 0.00 0.00 -0.10 0.00 -0.57 0.00 0.00 179.45 178.78 1f91 h ALA 329 N 2.00 1.62 0.03 3.86 0.00 -1.76 0.32 119.26 125.33 1f91 h ALA 329 Ca 0.00 -0.09 -0.38 0.00 0.00 0.00 0.00 54.91 54.44 1f91 h ALA 329 Cb 0.20 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 1f91 h ALA 329 CO 0.00 0.12 -2.24 -1.33 0.00 0.00 0.00 179.25 175.80 1f91 n MET 330 N -4.11 0.65 0.01 0.00 2.81 0.14 -4.65 117.12 111.96 1f91 n MET 330 Ca -0.03 0.26 -0.03 0.00 -1.81 0.00 0.00 57.70 56.10 1f91 n MET 330 Cb 0.18 -1.58 -0.10 0.00 -0.71 0.00 0.00 33.22 31.01 1f91 n MET 330 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1f91 n THR 331 N -3.73 1.31 0.00 2.03 -2.24 -0.39 -0.51 114.28 110.75 1f91 n THR 331 Ca -0.44 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 60.62 1f91 n THR 331 Cb 0.93 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 68.35 1f91 n THR 331 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f91 n GLY 332 N 1.45 -0.09 3.39 3.38 0.00 0.11 -4.50 105.19 108.93 1f91 n GLY 332 Ca -0.12 -1.93 -0.44 0.00 0.00 0.00 0.00 46.02 43.52 1f91 n GLY 332 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1f91 s HIS 333 N -1.07 3.22 -1.69 1.61 2.46 0.35 -4.63 115.29 115.53 1f91 s HIS 333 Ca 0.00 -0.89 0.05 0.00 0.47 0.00 0.00 55.06 54.69 1f91 s HIS 333 Cb 0.00 -3.25 0.18 0.00 -0.13 0.00 0.00 32.58 29.38 1f91 s HIS 333 CO 0.00 -0.84 1.06 -1.13 -2.47 0.00 0.00 174.74 171.36 1f91 n SER 334 N 5.34 1.31 0.00 9.88 3.41 -1.26 0.57 113.62 132.88 1f91 n SER 334 Ca -0.12 -2.06 0.00 0.00 -0.26 0.00 0.00 58.87 56.43 1f91 n SER 334 Cb 0.44 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 1f91 n SER 334 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1f91 n LEU 335 N 0.08 0.00 0.29 1.04 4.77 -1.26 -1.58 117.00 120.34 1f91 n LEU 335 Ca 0.06 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.21 1f91 n LEU 335 Cb 0.24 0.00 0.91 0.00 -2.33 0.00 0.00 43.42 42.24 1f91 n LEU 335 CO 0.05 0.00 1.09 1.23 -1.33 0.00 0.00 177.39 178.43 1f91 h GLY 336 N 0.00 0.00 0.34 -0.72 0.00 -1.86 -1.85 103.07 98.98 1f91 h GLY 336 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1f91 h GLY 336 CO 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 176.54 176.03 1f91 n ALA 337 N -2.25 3.62 -0.24 3.60 0.00 -0.62 -2.57 120.51 122.05 1f91 n ALA 337 Ca -0.02 -0.45 -0.05 0.00 0.00 0.00 0.00 53.44 52.91 1f91 n ALA 337 Cb 0.14 -1.02 0.05 0.00 0.00 0.00 0.00 19.45 18.61 1f91 n ALA 337 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1f91 h ALA 338 N 3.33 0.85 -0.13 0.00 0.00 -1.41 -2.01 119.26 119.88 1f91 h ALA 338 Ca 0.00 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.90 1f91 h ALA 338 Cb 0.53 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 1f91 h ALA 338 CO 0.00 0.28 -0.19 0.78 0.00 0.00 0.00 179.25 180.12 1f91 h GLY 339 N 0.91 -0.15 1.42 0.00 0.00 -1.74 -0.66 103.07 102.84 1f91 h GLY 339 Ca 0.24 0.23 -0.25 0.00 0.00 0.00 0.00 47.33 47.56 1f91 h GLY 339 CO -0.05 -0.18 -1.00 -0.24 0.00 0.00 0.00 176.54 175.07 1f91 h VAL 340 N -0.24 1.36 -0.61 4.60 3.04 -1.69 -2.46 116.25 120.24 1f91 h VAL 340 Ca 0.10 -2.40 -0.03 0.00 -1.01 0.00 0.00 66.70 63.36 1f91 h VAL 340 Cb 0.39 2.43 -0.03 0.00 -2.01 0.00 0.00 31.29 32.07 1f91 h VAL 340 CO -0.28 0.72 0.27 1.56 -1.01 0.00 0.00 177.57 178.84 1f91 h GLN 341 N 0.29 0.90 0.00 4.17 4.20 -1.26 -0.21 115.11 123.20 1f91 h GLN 341 Ca -0.10 -0.15 -0.09 0.00 0.06 0.00 0.00 58.65 58.36 1f91 h GLN 341 Cb 1.65 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 29.26 1f91 h GLN 341 CO 0.18 0.75 -0.44 0.93 -0.67 0.00 0.00 178.83 179.58 1f91 h GLU 342 N 0.85 0.00 -0.18 1.46 5.08 -1.18 -0.46 114.58 120.15 1f91 h GLU 342 Ca 0.21 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.41 1f91 h GLU 342 Cb 0.16 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1f91 h GLU 342 CO -0.02 0.44 -0.55 0.00 -1.00 0.00 0.00 179.01 177.88 1f91 h ALA 343 N 1.56 0.70 -0.40 3.43 0.00 -0.95 -2.42 119.26 121.19 1f91 h ALA 343 Ca -0.00 -0.51 -0.12 0.00 0.00 0.00 0.00 54.91 54.28 1f91 h ALA 343 Cb 0.95 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1f91 h ALA 343 CO 0.06 0.69 -0.20 0.82 0.00 0.00 0.00 179.25 180.61 1f91 h ILE 344 N 0.42 1.28 -0.76 0.00 2.04 -0.47 -1.37 117.51 118.65 1f91 h ILE 344 Ca 0.01 -1.35 -0.01 0.00 1.00 0.00 0.00 64.86 64.51 1f91 h ILE 344 Cb 1.10 1.30 -0.04 0.00 -0.74 0.00 0.00 36.82 38.43 1f91 h ILE 344 CO 0.10 0.45 0.44 1.88 0.00 0.00 0.00 178.15 181.03 1f91 h TYR 345 N 0.65 1.00 -0.49 1.37 0.05 -1.02 -1.19 116.97 117.34 1f91 h TYR 345 Ca 0.09 -0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.78 1f91 h TYR 345 Cb 0.76 -0.33 -0.02 0.00 1.01 0.00 0.00 36.73 38.16 1f91 h TYR 345 CO 0.06 0.68 -0.03 0.77 -1.05 0.00 0.00 178.16 178.59 1f91 h SER 346 N 1.04 0.87 -0.35 3.88 0.02 -1.19 -1.72 113.55 116.10 1f91 h SER 346 Ca 0.27 -0.32 -0.06 0.00 -0.84 0.00 0.00 61.79 60.84 1f91 h SER 346 Cb -0.02 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.26 1f91 h SER 346 CO -0.05 0.98 0.04 -0.07 -1.14 0.00 0.00 176.83 176.59 1f91 h LEU 347 N 0.74 0.65 -0.70 5.07 3.38 -0.68 0.22 115.31 123.99 1f91 h LEU 347 Ca 0.13 -0.13 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1f91 h LEU 347 Cb 0.55 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1f91 h LEU 347 CO 0.03 0.69 -0.32 -0.07 0.09 0.00 0.00 178.44 178.86 1f91 h LEU 348 N 0.66 0.68 -0.51 1.67 3.38 -1.01 0.24 115.31 120.41 1f91 h LEU 348 Ca 0.14 -0.27 -0.15 0.00 0.09 0.00 0.00 57.88 57.69 1f91 h LEU 348 Cb 0.35 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1f91 h LEU 348 CO 0.01 0.95 -0.38 0.24 0.09 0.00 0.00 178.44 179.34 1f91 h MET 349 N 0.55 0.79 -0.41 1.13 2.86 -0.77 -0.09 114.93 119.00 1f91 h MET 349 Ca 0.06 -0.41 -0.15 0.00 -2.06 0.00 0.00 59.70 57.15 1f91 h MET 349 Cb 0.82 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.48 1f91 h MET 349 CO 0.07 1.04 -0.31 1.25 1.06 0.00 0.00 176.91 180.01 1f91 h LEU 350 N 0.65 0.97 -0.24 1.22 5.85 -0.73 -1.06 115.31 121.98 1f91 h LEU 350 Ca 0.06 -0.41 -0.08 0.00 0.84 0.00 0.00 57.88 58.29 1f91 h LEU 350 Cb 0.94 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 1f91 h LEU 350 CO 0.09 1.19 -0.15 -0.08 -0.34 0.00 0.00 178.44 179.15 1f91 h GLU 351 N 0.77 0.52 -0.70 1.25 4.57 -0.35 -3.31 114.58 117.33 1f91 h GLU 351 Ca 0.08 -0.24 0.00 0.00 -1.18 0.00 0.00 59.36 58.02 1f91 h GLU 351 Cb 0.89 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.48 1f91 h GLU 351 CO 0.08 0.81 0.00 0.72 -1.18 0.00 0.00 179.01 179.44 1f91 n HIS 352 N -4.46 0.93 -3.47 0.92 8.25 -0.06 -5.01 115.22 112.32 1f91 n HIS 352 Ca -0.04 -0.47 -0.19 0.00 -0.26 0.00 0.00 57.72 56.76 1f91 n HIS 352 Cb 0.37 -0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.55 1f91 n HIS 352 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1f91 n GLY 353 N 1.66 -0.57 3.33 -1.41 0.00 -0.43 -4.93 105.19 102.83 1f91 n GLY 353 Ca 0.24 0.24 -0.11 0.00 0.00 0.00 0.00 46.02 46.40 1f91 n GLY 353 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1f91 s PHE 354 N -3.45 -0.23 -0.25 1.61 -0.12 -1.02 -0.63 117.98 113.88 1f91 s PHE 354 Ca 0.14 -0.07 -0.02 0.00 -0.05 0.00 0.00 56.93 56.93 1f91 s PHE 354 Cb -0.03 0.29 0.02 0.00 -0.63 0.00 0.00 43.02 42.68 1f91 s PHE 354 CO 0.76 -0.72 -0.06 0.42 -0.05 0.00 0.00 175.22 175.57 1f91 s ILE 355 N -3.80 2.87 0.42 -4.49 1.01 0.12 -4.56 121.20 112.77 1f91 s ILE 355 Ca 0.03 -1.01 -0.26 0.00 0.00 0.00 0.00 60.65 59.41 1f91 s ILE 355 Cb 0.02 -2.45 -0.09 0.00 0.01 0.00 0.00 42.46 39.95 1f91 s ILE 355 CO -0.12 0.21 1.41 0.00 0.00 0.00 0.00 174.94 176.44 1f91 s ALA 356 N 1.33 3.32 0.39 9.38 0.00 -1.26 -2.18 121.76 132.74 1f91 s ALA 356 Ca 0.00 1.43 -0.24 0.00 0.00 0.00 0.00 51.96 53.16 1f91 s ALA 356 Cb -0.16 -3.57 -0.10 0.00 0.00 0.00 0.00 23.12 19.29 1f91 s ALA 356 CO -0.05 -1.07 0.99 -1.25 0.00 0.00 0.00 175.76 174.38 1f91 s PRO 357 N -2.31 4.29 -0.56 0.00 0.04 -1.26 -4.79 135.00 130.40 1f91 s PRO 357 Ca 0.58 1.33 -0.21 0.00 0.04 0.00 0.00 61.00 62.75 1f91 s PRO 357 Cb -0.43 -2.49 0.07 0.00 0.04 0.00 0.00 34.50 31.69 1f91 s PRO 357 CO 0.56 -0.00 0.77 0.45 0.04 0.00 0.00 177.00 178.82 1f91 s SER 358 N -1.78 6.23 0.72 6.66 0.15 -0.43 -4.80 113.70 120.44 1f91 s SER 358 Ca 0.57 -0.94 -0.06 0.00 0.70 0.00 0.00 55.95 56.23 1f91 s SER 358 Cb -0.17 -2.34 0.08 0.00 -1.71 0.00 0.00 66.02 61.88 1f91 s SER 358 CO 0.22 -1.11 1.02 0.27 1.20 0.00 0.00 173.24 174.84 1f91 s ILE 359 N 3.16 2.27 -1.84 6.45 -4.36 -1.26 -4.48 121.20 121.14 1f91 s ILE 359 Ca 0.18 -0.33 0.00 0.00 -0.26 0.00 0.00 60.65 60.25 1f91 s ILE 359 Cb -0.19 -2.94 0.00 0.00 1.25 0.00 0.00 42.46 40.59 1f91 s ILE 359 CO 0.12 0.00 0.00 0.59 0.24 0.00 0.00 174.94 175.89 1f91 n ASN 360 N -2.94 -5.17 -4.42 4.36 3.02 -1.26 -4.51 115.26 104.34 1f91 n ASN 360 Ca 0.10 0.36 -0.44 0.00 -0.03 0.00 0.00 54.58 54.57 1f91 n ASN 360 Cb 0.60 -4.25 -0.03 0.00 -0.61 0.00 0.00 39.78 35.50 1f91 n ASN 360 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1f91 s ILE 361 N -2.71 4.85 0.01 2.41 1.01 -1.26 -4.76 121.20 120.76 1f91 s ILE 361 Ca 0.00 -1.51 -0.07 0.00 0.00 0.00 0.00 60.65 59.07 1f91 s ILE 361 Cb 0.00 -4.67 -0.30 0.00 0.01 0.00 0.00 42.46 37.50 1f91 s ILE 361 CO 0.00 -1.36 0.90 -0.33 0.00 0.00 0.00 174.94 174.15 1f91 h GLU 362 N 8.79 0.33 -3.03 2.79 5.08 -1.95 -3.43 114.58 123.15 1f91 h GLU 362 Ca 0.03 -0.56 -0.56 0.00 -1.00 0.00 0.00 59.36 57.27 1f91 h GLU 362 Cb 1.04 0.21 -0.40 0.00 0.50 0.00 0.00 28.75 30.10 1f91 h GLU 362 CO 1.05 1.22 -0.78 -2.00 -1.00 0.00 0.00 179.01 177.51 1f91 s GLU 363 N -2.62 0.45 0.30 2.33 2.12 -1.26 -5.07 118.70 114.96 1f91 s GLU 363 Ca -0.09 -0.87 -0.29 0.00 0.36 0.00 0.00 54.97 54.09 1f91 s GLU 363 Cb 0.06 -1.51 -0.13 0.00 0.26 0.00 0.00 34.13 32.81 1f91 s GLU 363 CO 0.87 -1.04 1.18 -0.11 -0.54 0.00 0.00 175.26 175.63 1f91 n LEU 364 N 4.90 2.68 -4.76 2.70 7.94 -1.26 -0.25 117.00 128.96 1f91 n LEU 364 Ca -0.02 1.19 -0.41 0.00 -1.11 0.00 0.00 56.01 55.66 1f91 n LEU 364 Cb 0.41 -1.39 -0.02 0.00 0.53 0.00 0.00 43.42 42.95 1f91 n LEU 364 CO 0.08 -0.90 0.97 -0.62 -1.11 0.00 0.00 177.39 175.82 1f91 s ASP 365 N -0.33 6.82 0.25 1.96 -1.08 -0.38 -4.60 116.67 119.30 1f91 s ASP 365 Ca 0.59 2.63 -0.04 0.00 -0.52 0.00 0.00 52.55 55.21 1f91 s ASP 365 Cb -0.64 -2.64 0.43 0.00 -1.46 0.00 0.00 42.92 38.60 1f91 s ASP 365 CO 0.59 -0.51 1.79 -0.33 0.52 0.00 0.00 175.17 177.24 1f91 h GLU 366 N 3.70 0.70 0.00 4.34 5.08 -1.91 -0.20 114.58 126.30 1f91 h GLU 366 Ca -0.48 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 1f91 h GLU 366 Cb 1.22 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.31 1f91 h GLU 366 CO 0.67 0.47 0.00 1.04 -1.00 0.00 0.00 179.01 180.19 1f91 n GLN 367 N -4.79 0.23 0.00 2.33 6.02 -1.26 -0.66 117.38 119.24 1f91 n GLN 367 Ca 0.14 0.00 0.11 0.00 -0.01 0.00 0.00 57.00 57.24 1f91 n GLN 367 Cb 0.32 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.04 1f91 n GLN 367 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1f91 n ALA 368 N -1.00 4.21 -1.59 -1.58 0.00 -0.09 -4.81 120.51 115.65 1f91 n ALA 368 Ca 0.06 -0.59 -0.45 0.00 0.00 0.00 0.00 53.44 52.46 1f91 n ALA 368 Cb 0.03 -0.82 -0.02 0.00 0.00 0.00 0.00 19.45 18.64 1f91 n ALA 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1f91 n ALA 369 N -0.97 -0.19 -1.00 0.00 0.00 0.16 -1.85 120.51 116.66 1f91 n ALA 369 Ca 0.06 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1f91 n ALA 369 Cb 0.38 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 17.79 1f91 n ALA 369 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1f91 n GLY 370 N 1.34 0.66 3.46 0.00 0.00 -1.26 -5.03 105.19 104.35 1f91 n GLY 370 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1f91 n GLY 370 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1f91 s LEU 371 N 0.00 2.91 -1.03 0.99 1.43 -0.77 -4.87 118.68 117.34 1f91 s LEU 371 Ca 0.00 -0.20 -0.23 0.00 -1.03 0.00 0.00 54.13 52.67 1f91 s LEU 371 Cb 0.00 -1.65 0.02 0.00 0.03 0.00 0.00 46.19 44.59 1f91 s LEU 371 CO 0.00 0.24 1.66 0.21 0.23 0.00 0.00 176.35 178.69 1f91 s ASN 372 N -0.10 6.06 -0.55 2.29 2.47 -1.26 -4.91 114.94 118.94 1f91 s ASN 372 Ca -0.00 -1.37 -0.17 0.00 0.42 0.00 0.00 52.86 51.74 1f91 s ASN 372 Cb -0.13 -2.57 0.12 0.00 -1.45 0.00 0.00 41.25 37.22 1f91 s ASN 372 CO 0.03 -1.92 0.54 -0.63 -3.72 0.00 0.00 177.10 171.40 1f91 s ILE 373 N 6.74 5.13 -0.01 -5.21 1.01 -1.26 -0.56 121.20 127.03 1f91 s ILE 373 Ca 0.55 -1.36 -0.30 0.00 0.00 0.00 0.00 60.65 59.54 1f91 s ILE 373 Cb -0.01 -4.36 -0.08 0.00 0.01 0.00 0.00 42.46 38.02 1f91 s ILE 373 CO -0.04 -0.91 1.92 -0.69 0.00 0.00 0.00 174.94 175.23 1f91 s VAL 374 N 1.84 3.14 -1.04 2.92 1.01 0.04 -4.88 120.40 123.43 1f91 s VAL 374 Ca 0.05 0.17 0.11 0.00 0.00 0.00 0.00 61.98 62.31 1f91 s VAL 374 Cb -0.28 -3.12 0.29 0.00 0.00 0.00 0.00 36.38 33.27 1f91 s VAL 374 CO 0.04 -0.02 1.21 0.35 0.00 0.00 0.00 175.10 176.68 1f91 n THR 375 N 5.79 0.86 -3.77 3.92 -2.24 -1.26 -1.32 114.28 116.26 1f91 n THR 375 Ca 0.20 -0.93 -0.13 0.00 -2.27 0.00 0.00 64.05 60.92 1f91 n THR 375 Cb 0.42 0.60 -0.11 0.00 -2.10 0.00 0.00 70.33 69.14 1f91 n THR 375 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1f91 s GLU 376 N -1.00 0.34 -0.25 -0.78 -1.05 -1.26 -4.51 118.70 110.19 1f91 s GLU 376 Ca 0.23 0.43 -0.42 0.00 -0.15 0.00 0.00 54.97 55.06 1f91 s GLU 376 Cb 0.12 0.14 -0.19 0.00 -0.44 0.00 0.00 34.13 33.77 1f91 s GLU 376 CO 0.16 -0.05 1.47 2.41 0.95 0.00 0.00 175.26 180.20 1f91 n THR 377 N 3.06 0.07 -3.89 1.83 -1.04 -1.26 -4.63 114.28 108.42 1f91 n THR 377 Ca -0.14 -0.01 -0.27 0.00 -2.04 0.00 0.00 64.05 61.59 1f91 n THR 377 Cb 0.58 -0.58 -0.17 0.00 -1.82 0.00 0.00 70.33 68.33 1f91 n THR 377 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1f91 s THR 378 N 2.06 0.98 0.01 12.58 2.01 -0.93 -4.96 115.64 127.39 1f91 s THR 378 Ca 0.97 -0.30 -0.30 0.00 0.31 0.00 0.00 61.69 62.37 1f91 s THR 378 Cb -1.27 -1.04 -0.04 0.00 0.01 0.00 0.00 72.50 70.16 1f91 s THR 378 CO 0.68 0.32 1.14 -1.81 -0.69 0.00 0.00 174.62 174.26 1f91 s ASP 379 N 1.72 7.14 0.00 3.53 1.01 -1.26 0.13 116.67 128.95 1f91 s ASP 379 Ca 0.04 1.86 -0.28 0.00 0.71 0.00 0.00 52.55 54.88 1f91 s ASP 379 Cb -0.13 -2.57 0.09 0.00 1.01 0.00 0.00 42.92 41.32 1f91 s ASP 379 CO -0.08 -0.45 0.75 -0.60 0.21 0.00 0.00 175.17 174.99 1f91 s ARG 380 N 1.41 1.00 -0.84 8.23 3.52 0.20 -4.94 118.95 127.54 1f91 s ARG 380 Ca 0.56 -0.07 -0.21 0.00 -0.13 0.00 0.00 55.73 55.87 1f91 s ARG 380 Cb -0.26 0.47 0.09 0.00 -1.56 0.00 0.00 34.95 33.69 1f91 s ARG 380 CO 0.26 -0.38 1.14 -2.00 -0.81 0.00 0.00 175.30 173.52 1f91 s GLU 381 N -2.27 3.40 0.43 5.12 2.12 -1.26 -3.44 118.70 122.79 1f91 s GLU 381 Ca -0.03 -1.21 -0.12 0.00 0.36 0.00 0.00 54.97 53.97 1f91 s GLU 381 Cb -0.01 -4.70 -0.07 0.00 0.26 0.00 0.00 34.13 29.61 1f91 s GLU 381 CO -0.02 -1.90 0.83 -0.51 -0.54 0.00 0.00 175.26 173.12 1f91 s LEU 382 N 3.82 3.79 0.00 2.70 1.43 -1.26 -4.97 118.68 124.18 1f91 s LEU 382 Ca 0.32 1.26 0.00 0.00 -1.03 0.00 0.00 54.13 54.68 1f91 s LEU 382 Cb -0.08 -4.16 0.00 0.00 0.03 0.00 0.00 46.19 41.98 1f91 s LEU 382 CO -0.01 -0.44 0.00 0.41 0.23 0.00 0.00 176.35 176.54 1f91 n THR 383 N -1.31 0.00 -3.88 5.49 -1.04 -1.26 -4.91 114.28 107.37 1f91 n THR 383 Ca 0.04 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.81 1f91 n THR 383 Cb 0.54 -0.10 -0.17 0.00 -1.82 0.00 0.00 70.33 68.77 1f91 n THR 383 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1f91 s THR 384 N -1.17 0.57 0.10 12.58 2.01 -1.26 -1.07 115.64 127.39 1f91 s THR 384 Ca 0.00 -0.02 0.09 0.00 0.31 0.00 0.00 61.69 62.07 1f91 s THR 384 Cb 0.00 -0.67 -0.03 0.00 0.01 0.00 0.00 72.50 71.80 1f91 s THR 384 CO 0.00 0.28 -0.23 0.68 -0.69 0.00 0.00 174.62 174.66 1f91 s VAL 385 N 1.73 1.93 0.05 3.82 -7.23 0.32 -0.73 120.40 120.30 1f91 s VAL 385 Ca 0.02 -1.56 0.07 0.00 -1.81 0.00 0.00 61.98 58.70 1f91 s VAL 385 Cb -0.13 -1.72 -0.03 0.00 0.56 0.00 0.00 36.38 35.07 1f91 s VAL 385 CO -0.05 0.06 -0.20 -0.32 -0.31 0.00 0.00 175.10 174.29 1f91 s MET 386 N -1.81 1.27 -0.03 4.82 -2.45 -0.28 -0.42 119.30 120.40 1f91 s MET 386 Ca 0.10 -0.96 -0.01 0.00 -1.25 0.00 0.00 55.69 53.57 1f91 s MET 386 Cb -0.10 -1.39 0.03 0.00 1.25 0.00 0.00 34.83 34.62 1f91 s MET 386 CO 0.04 0.35 0.04 0.45 1.05 0.00 0.00 175.02 176.96 1f91 s SER 387 N -1.32 0.65 -0.02 1.11 0.15 -0.60 -0.27 113.70 113.39 1f91 s SER 387 Ca 0.06 0.06 -0.03 0.00 0.70 0.00 0.00 55.95 56.74 1f91 s SER 387 Cb -0.09 -0.12 -0.04 0.00 -1.71 0.00 0.00 66.02 64.07 1f91 s SER 387 CO 0.02 -0.19 0.16 0.20 1.20 0.00 0.00 173.24 174.64 1f91 s ASN 388 N 1.64 6.27 -0.13 5.45 0.01 -0.94 -2.01 114.94 125.24 1f91 s ASN 388 Ca -0.02 0.33 -0.04 0.00 -0.71 0.00 0.00 52.86 52.42 1f91 s ASN 388 Cb -0.12 -1.96 0.06 0.00 0.41 0.00 0.00 41.25 39.64 1f91 s ASN 388 CO -0.03 0.28 0.16 -0.44 -1.51 0.00 0.00 177.10 175.56 1f91 s SER 389 N -1.83 1.19 -0.11 -1.22 0.01 -0.01 -3.46 113.70 108.27 1f91 s SER 389 Ca 0.26 0.02 0.01 0.00 1.31 0.00 0.00 55.95 57.55 1f91 s SER 389 Cb -0.12 0.21 0.02 0.00 0.21 0.00 0.00 66.02 66.33 1f91 s SER 389 CO 0.17 -0.28 -0.15 -0.36 0.41 0.00 0.00 173.24 173.03 1f91 s PHE 390 N 2.27 1.98 0.43 2.43 0.08 -1.26 -0.63 117.98 123.28 1f91 s PHE 390 Ca 0.04 -0.96 0.06 0.00 0.12 0.00 0.00 56.93 56.19 1f91 s PHE 390 Cb -0.14 -1.44 -0.07 0.00 -0.57 0.00 0.00 43.02 40.81 1f91 s PHE 390 CO -0.08 -0.51 0.03 0.20 -0.10 0.00 0.00 175.22 174.76 1f91 s GLY 391 N 1.08 2.57 0.55 4.36 0.00 0.21 -4.64 107.32 111.45 1f91 s GLY 391 Ca -0.05 -1.98 -0.20 0.00 0.00 0.00 0.00 44.72 42.49 1f91 s GLY 391 CO -0.03 -2.10 0.91 0.69 0.00 0.00 0.00 173.10 172.58 1f91 n PHE 392 N -1.05 0.70 -0.49 1.90 0.99 -1.26 -2.34 117.46 115.91 1f91 n PHE 392 Ca -0.07 0.47 0.00 0.00 -0.00 0.00 0.00 57.45 57.85 1f91 n PHE 392 Cb 0.67 -2.14 0.00 0.00 -1.00 0.00 0.00 39.48 37.01 1f91 n PHE 392 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1f91 n GLY 393 N 1.33 0.75 2.68 1.37 0.00 0.97 -4.14 105.19 108.16 1f91 n GLY 393 Ca 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 1f91 n GLY 393 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f91 n GLY 394 N -2.35 -0.32 3.70 -0.02 0.00 -0.99 -4.71 105.19 100.50 1f91 n GLY 394 Ca 0.00 -0.06 -0.37 0.00 0.00 0.00 0.00 46.02 45.59 1f91 n GLY 394 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1f91 s THR 395 N -3.02 5.26 0.09 2.61 -1.32 -1.04 -0.23 115.64 118.01 1f91 s THR 395 Ca 0.19 0.61 0.10 0.00 -1.21 0.00 0.00 61.69 61.38 1f91 s THR 395 Cb -0.08 -3.67 -0.04 0.00 -1.51 0.00 0.00 72.50 67.20 1f91 s THR 395 CO 0.24 0.33 -0.26 0.20 -2.21 0.00 0.00 174.62 172.91 1f91 s ASN 396 N 0.73 3.21 -0.13 8.08 0.01 -0.10 -0.62 114.94 126.13 1f91 s ASN 396 Ca 0.18 -0.68 -0.09 0.00 -0.71 0.00 0.00 52.86 51.55 1f91 s ASN 396 Cb -0.14 -0.24 0.04 0.00 0.41 0.00 0.00 41.25 41.32 1f91 s ASN 396 CO 0.06 0.21 0.32 0.00 -1.51 0.00 0.00 177.10 176.17 1f91 s ALA 397 N -0.96 -0.79 -0.02 0.60 0.00 0.19 -1.96 121.76 118.83 1f91 s ALA 397 Ca 0.13 1.09 0.01 0.00 0.00 0.00 0.00 51.96 53.19 1f91 s ALA 397 Cb -0.10 -0.66 0.01 0.00 0.00 0.00 0.00 23.12 22.37 1f91 s ALA 397 CO 0.04 -0.19 -0.05 0.99 0.00 0.00 0.00 175.76 176.55 1f91 s THR 398 N 0.80 0.44 -0.07 0.00 2.01 -0.43 -0.83 115.64 117.57 1f91 s THR 398 Ca -0.05 -0.17 0.04 0.00 0.31 0.00 0.00 61.69 61.82 1f91 s THR 398 Cb -0.06 -0.42 -0.00 0.00 0.01 0.00 0.00 72.50 72.03 1f91 s THR 398 CO -0.06 0.16 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.06 1f91 s LEU 399 N 0.29 1.97 -0.17 4.42 1.43 -0.85 -0.68 118.68 125.09 1f91 s LEU 399 Ca -0.03 -0.45 -0.00 0.00 -1.03 0.00 0.00 54.13 52.61 1f91 s LEU 399 Cb -0.07 -1.19 0.00 0.00 0.03 0.00 0.00 46.19 44.96 1f91 s LEU 399 CO -0.00 0.16 -0.15 -0.69 0.23 0.00 0.00 176.35 175.90 1f91 s VAL 400 N 0.18 2.57 -0.03 -1.59 1.01 0.20 -1.55 120.40 121.19 1f91 s VAL 400 Ca -0.10 -0.79 0.07 0.00 0.00 0.00 0.00 61.98 61.16 1f91 s VAL 400 Cb -0.15 -2.10 -0.01 0.00 0.00 0.00 0.00 36.38 34.12 1f91 s VAL 400 CO 0.05 0.51 -0.24 -0.04 0.00 0.00 0.00 175.10 175.38 1f91 s MET 401 N 1.06 2.14 0.02 2.72 -1.94 0.45 -1.48 119.30 122.27 1f91 s MET 401 Ca -0.01 -0.85 0.02 0.00 -1.71 0.00 0.00 55.69 53.14 1f91 s MET 401 Cb -0.14 -1.95 -0.01 0.00 2.01 0.00 0.00 34.83 34.73 1f91 s MET 401 CO -0.04 0.44 -0.07 0.50 -0.01 0.00 0.00 175.02 175.85 1f91 s ARG 402 N -0.37 0.48 0.52 2.03 3.52 -0.09 -0.52 118.95 124.52 1f91 s ARG 402 Ca 0.04 -0.47 -0.22 0.00 -0.13 0.00 0.00 55.73 54.95 1f91 s ARG 402 Cb -0.11 -0.36 -0.07 0.00 -1.56 0.00 0.00 34.95 32.85 1f91 s ARG 402 CO 0.01 0.08 1.14 1.63 -0.81 0.00 0.00 175.30 177.35 1f91 n LYS 403 N 2.23 1.39 -2.75 5.12 5.02 -0.24 -0.49 118.16 128.44 1f91 n LYS 403 Ca -0.18 0.51 -0.43 0.00 -2.02 0.00 0.00 58.31 56.20 1f91 n LYS 403 Cb 0.56 -2.30 -0.03 0.00 -0.02 0.00 0.00 35.03 33.24 1f91 n LYS 403 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1f91 s LEU 404 N -2.09 3.96 -0.81 -0.35 2.96 -1.26 -4.74 118.68 116.35 1f91 s LEU 404 Ca 0.70 0.72 -0.34 0.00 -0.22 0.00 0.00 54.13 54.99 1f91 s LEU 404 Cb -0.46 -3.35 -0.20 0.00 0.50 0.00 0.00 46.19 42.68 1f91 s LEU 404 CO 0.51 -0.87 2.51 2.29 -1.32 0.00 0.00 176.35 179.47 1f91 n LYS 405 N 6.82 0.11 -0.57 1.98 -0.00 -1.26 -5.10 118.16 120.14 1f91 n LYS 405 Ca 0.09 0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.41 1f91 n LYS 405 Cb 0.48 -1.65 0.00 0.00 -0.00 0.00 0.00 35.03 33.86 1f91 n LYS 405 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93