#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xfw s ASN 65 N 0.00 4.31 -0.04 6.41 -0.87 -1.26 -5.03 114.94 118.46 1xfw s ASN 65 Ca 0.00 -0.41 -0.22 0.00 -1.57 0.00 0.00 52.86 50.66 1xfw s ASN 65 Cb 0.00 -1.74 -0.16 0.00 -0.02 0.00 0.00 41.25 39.33 1xfw s ASN 65 CO 0.00 -0.03 0.94 0.25 -2.57 0.00 0.00 177.10 175.70 1xfw h LEU 66 N 8.11 -0.18 -9.60 0.60 5.85 -1.97 -3.46 115.31 114.67 1xfw h LEU 66 Ca -0.41 -0.36 -0.57 0.00 0.84 0.00 0.00 57.88 57.37 1xfw h LEU 66 Cb 1.16 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 42.19 1xfw h LEU 66 CO 0.60 0.36 -0.03 0.54 -0.34 0.00 0.00 178.44 179.57 1xfw s VAL 67 N -3.60 4.84 -0.09 1.05 0.11 -1.26 -1.20 120.40 120.25 1xfw s VAL 67 Ca -0.13 1.22 0.04 0.00 -2.93 0.00 0.00 61.98 60.18 1xfw s VAL 67 Cb 0.01 -3.91 -0.00 0.00 -1.53 0.00 0.00 36.38 30.94 1xfw s VAL 67 CO 0.51 0.48 -0.24 -0.54 -3.33 0.00 0.00 175.10 171.98 1xfw s LYS 68 N -0.62 2.93 -0.36 1.54 3.01 -0.52 -4.94 119.74 120.78 1xfw s LYS 68 Ca 0.30 -0.88 -0.07 0.00 -1.01 0.00 0.00 55.97 54.30 1xfw s LYS 68 Cb -0.19 -2.26 0.05 0.00 -1.01 0.00 0.00 37.83 34.42 1xfw s LYS 68 CO 0.18 0.22 0.14 0.95 0.51 0.00 0.00 175.35 177.35 1xfw s THR 69 N 0.23 3.92 0.00 2.17 -4.23 -1.26 -1.56 115.64 114.91 1xfw s THR 69 Ca -0.15 -1.16 0.00 0.00 -1.18 0.00 0.00 61.69 59.19 1xfw s THR 69 Cb -0.17 -3.26 0.00 0.00 1.34 0.00 0.00 72.50 70.41 1xfw s THR 69 CO 0.08 -0.24 0.68 1.21 -0.54 0.00 0.00 174.62 175.80 1xfw n GLU 70 N 4.84 0.00 -3.39 3.99 4.07 0.98 -4.63 120.64 126.50 1xfw n GLU 70 Ca -0.12 0.30 -0.43 0.00 -0.06 0.00 0.00 57.16 56.85 1xfw n GLU 70 Cb 0.44 -1.23 -0.09 0.00 -0.06 0.00 0.00 31.44 30.51 1xfw n GLU 70 CO 0.00 0.00 0.00 0.12 -0.06 0.00 0.00 177.13 177.19 1xfw s PHE 71 N -1.96 3.21 -1.40 4.31 5.99 -1.26 -4.94 117.98 121.94 1xfw s PHE 71 Ca 0.00 -0.62 -0.09 0.00 0.00 0.00 0.00 56.93 56.22 1xfw s PHE 71 Cb 0.00 -2.85 -0.10 0.00 0.00 0.00 0.00 43.02 40.08 1xfw s PHE 71 CO 0.00 -0.69 3.01 0.25 -0.00 0.00 0.00 175.22 177.80 1xfw n THR 72 N 5.26 4.21 -0.13 0.12 -2.24 -1.26 -4.39 114.28 115.84 1xfw n THR 72 Ca -0.10 -2.56 -0.28 0.00 -2.27 0.00 0.00 64.05 58.84 1xfw n THR 72 Cb 0.46 -2.50 -0.10 0.00 -2.10 0.00 0.00 70.33 66.10 1xfw n THR 72 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1xfw n ASN 73 N 3.30 1.95 -2.84 3.42 5.15 -1.26 -4.99 115.26 119.99 1xfw n ASN 73 Ca 0.73 0.35 -0.11 0.00 -0.60 0.00 0.00 54.58 54.95 1xfw n ASN 73 Cb 0.32 -0.83 0.09 0.00 -0.53 0.00 0.00 39.78 38.83 1xfw n ASN 73 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1xfw n GLU 74 N -4.28 -1.49 0.00 1.20 4.71 -1.26 -5.06 120.64 114.46 1xfw n GLU 74 Ca -0.50 -0.66 0.00 0.00 -0.01 0.00 0.00 57.16 55.99 1xfw n GLU 74 Cb 0.85 -0.57 0.00 0.00 -1.01 0.00 0.00 31.44 30.71 1xfw n GLU 74 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1xfw n THR 75 N -3.20 0.00 -0.35 2.62 -2.24 -1.26 -4.81 114.28 105.04 1xfw n THR 75 Ca 0.06 0.00 0.37 0.00 -2.27 0.00 0.00 64.05 62.20 1xfw n THR 75 Cb 0.21 -0.66 0.75 0.00 -2.10 0.00 0.00 70.33 68.53 1xfw n THR 75 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1xfw h LEU 76 N 0.00 0.00 -0.88 3.22 -0.00 -1.97 -1.05 115.31 114.63 1xfw h LEU 76 Ca 0.00 0.00 0.23 0.00 -0.00 0.00 0.00 57.88 58.11 1xfw h LEU 76 Cb 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 40.66 40.53 1xfw h LEU 76 CO 0.00 0.00 0.30 0.44 -0.00 0.00 0.00 178.44 179.18 1xfw h ASP 77 N 0.00 0.13 0.00 -0.43 3.45 -1.92 3.18 116.42 120.83 1xfw h ASP 77 Ca 0.60 0.18 -0.03 0.00 0.43 0.00 0.00 57.03 58.21 1xfw h ASP 77 Cb 2.44 0.21 -0.00 0.00 -0.56 0.00 0.00 39.33 41.42 1xfw h ASP 77 CO -0.01 -0.10 -0.19 0.50 -1.57 0.00 0.00 179.24 177.87 1xfw h LYS 78 N 0.27 0.00 0.12 3.56 1.63 -1.50 -3.27 116.57 117.38 1xfw h LYS 78 Ca 0.56 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 60.36 1xfw h LYS 78 Cb 1.11 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.73 1xfw h LYS 78 CO -0.61 0.56 -0.18 0.82 -3.45 0.00 0.00 179.45 176.60 1xfw h ILE 79 N -1.00 0.00 0.00 2.00 2.04 -1.25 0.04 117.51 119.33 1xfw h ILE 79 Ca -0.04 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.82 1xfw h ILE 79 Cb 0.64 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 1xfw h ILE 79 CO -0.02 0.00 0.00 1.67 0.00 0.00 0.00 178.15 179.80 1xfw n GLN 80 N -3.44 0.00 -0.05 2.37 -0.06 1.05 -0.24 117.38 117.01 1xfw n GLN 80 Ca -0.04 0.00 -0.07 0.00 -2.00 0.00 0.00 57.00 54.89 1xfw n GLN 80 Cb 0.15 -1.02 -0.06 0.00 -4.06 0.00 0.00 30.24 25.25 1xfw n GLN 80 CO 0.00 0.00 0.00 0.94 -0.20 0.00 0.00 177.06 177.80 1xfw n GLN 81 N -0.46 1.03 0.15 3.69 7.27 -0.10 -3.56 117.38 125.41 1xfw n GLN 81 Ca 0.00 0.04 0.01 0.00 0.07 0.00 0.00 57.00 57.12 1xfw n GLN 81 Cb 0.00 -1.23 0.23 0.00 2.41 0.00 0.00 30.24 31.64 1xfw n GLN 81 CO 0.00 0.00 0.00 1.79 0.07 0.00 0.00 177.06 178.92 1xfw h THR 82 N 0.00 1.27 0.38 1.69 1.35 0.40 -1.97 112.91 116.03 1xfw h THR 82 Ca -0.26 -1.91 -0.02 0.00 -0.55 0.00 0.00 66.41 63.68 1xfw h THR 82 Cb 1.46 2.06 0.00 0.00 -1.73 0.00 0.00 68.15 69.94 1xfw h THR 82 CO -0.02 0.52 -0.18 1.56 -0.25 0.00 0.00 175.52 177.15 1xfw h GLN 83 N 0.00 -0.50 0.00 4.72 4.20 -1.47 -1.81 115.11 120.25 1xfw h GLN 83 Ca -0.01 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1xfw h GLN 83 Cb 1.02 0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.91 1xfw h GLN 83 CO 0.07 -0.33 0.39 -0.25 -0.67 0.00 0.00 178.83 178.04 1xfw n ASP 84 N -5.03 0.07 -0.10 1.46 8.00 -1.19 -0.46 116.55 119.30 1xfw n ASP 84 Ca -0.06 0.26 -0.20 0.00 0.71 0.00 0.00 54.79 55.50 1xfw n ASP 84 Cb 0.20 -0.21 -0.09 0.00 -0.02 0.00 0.00 41.12 41.00 1xfw n ASP 84 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1xfw n LEU 85 N -1.44 1.87 0.14 0.64 7.94 -0.75 -4.48 117.00 120.92 1xfw n LEU 85 Ca -0.00 0.44 0.00 0.00 -1.11 0.00 0.00 56.01 55.34 1xfw n LEU 85 Cb 0.39 -0.92 0.16 0.00 0.53 0.00 0.00 43.42 43.59 1xfw n LEU 85 CO 0.01 0.18 0.49 -0.07 -1.11 0.00 0.00 177.39 176.89 1xfw h LEU 86 N -1.00 0.00 0.00 -1.96 3.38 0.08 -3.08 115.31 112.73 1xfw h LEU 86 Ca -0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1xfw h LEU 86 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1xfw h LEU 86 CO -0.20 0.60 0.00 2.29 0.09 0.00 0.00 178.44 181.22 1xfw n LYS 87 N -3.63 0.09 -0.07 1.13 2.85 -0.50 -1.37 118.16 116.66 1xfw n LYS 87 Ca -0.01 0.24 -0.04 0.00 -1.05 0.00 0.00 58.31 57.45 1xfw n LYS 87 Cb 0.64 -1.50 -0.15 0.00 -0.65 0.00 0.00 35.03 33.37 1xfw n LYS 87 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 1xfw n LYS 88 N -1.31 0.83 -2.83 -1.58 0.00 -1.16 -4.90 118.16 107.20 1xfw n LYS 88 Ca 0.03 -0.06 -0.41 0.00 0.00 0.00 0.00 58.31 57.87 1xfw n LYS 88 Cb 0.06 -1.49 -0.05 0.00 0.00 0.00 0.00 35.03 33.55 1xfw n LYS 88 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1xfw s ILE 89 N -2.74 4.56 -0.13 3.15 1.01 -0.47 -4.96 121.20 121.62 1xfw s ILE 89 Ca -0.09 1.90 -0.29 0.00 0.00 0.00 0.00 60.65 62.18 1xfw s ILE 89 Cb 0.08 -4.24 -0.06 0.00 0.01 0.00 0.00 42.46 38.24 1xfw s ILE 89 CO 0.80 0.35 2.08 -2.16 0.00 0.00 0.00 174.94 176.01 1xfw s PRO 90 N -0.10 3.54 0.06 2.79 0.04 -1.26 -4.86 135.00 135.20 1xfw s PRO 90 Ca 0.43 2.20 -0.04 0.00 0.04 0.00 0.00 61.00 63.64 1xfw s PRO 90 Cb -0.22 -4.27 0.07 0.00 0.04 0.00 0.00 34.50 30.11 1xfw s PRO 90 CO 0.27 -1.64 0.38 1.17 0.04 0.00 0.00 177.00 177.22 1xfw n LYS 91 N 8.25 -0.05 -0.35 4.56 3.00 -1.26 0.17 118.16 132.47 1xfw n LYS 91 Ca 0.25 0.38 -0.03 0.00 -0.00 0.00 0.00 58.31 58.91 1xfw n LYS 91 Cb 0.44 -0.56 0.10 0.00 0.00 0.00 0.00 35.03 35.01 1xfw n LYS 91 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 1xfw h ASP 92 N 0.00 1.11 -0.01 3.14 3.32 -1.96 -0.03 116.42 122.00 1xfw h ASP 92 Ca 0.09 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1xfw h ASP 92 Cb 0.15 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.42 1xfw h ASP 92 CO -0.24 0.83 0.20 1.62 -1.72 0.00 0.00 179.24 179.93 1xfw h VAL 93 N 1.29 0.03 0.07 -1.35 3.04 0.13 0.44 116.25 119.90 1xfw h VAL 93 Ca 0.34 0.00 -0.11 0.00 -1.01 0.00 0.00 66.70 65.92 1xfw h VAL 93 Cb -0.10 0.80 0.01 0.00 -2.01 0.00 0.00 31.29 29.99 1xfw h VAL 93 CO -0.07 0.00 -0.51 -0.07 -1.01 0.00 0.00 177.57 175.91 1xfw h LEU 94 N 0.00 0.23 -2.59 3.16 3.38 -0.97 -2.94 115.31 115.59 1xfw h LEU 94 Ca 0.01 -0.95 0.00 0.00 0.09 0.00 0.00 57.88 57.03 1xfw h LEU 94 Cb 0.40 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1xfw h LEU 94 CO -0.00 1.24 0.13 -0.33 0.09 0.00 0.00 178.44 179.56 1xfw h GLU 95 N -0.68 0.00 0.00 1.13 4.39 0.15 1.23 114.58 120.80 1xfw h GLU 95 Ca -0.10 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.43 1xfw h GLU 95 Cb 1.35 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.97 1xfw h GLU 95 CO 0.06 0.00 -0.84 0.82 -1.16 0.00 0.00 179.01 177.89 1xfw h ILE 96 N 0.00 1.39 0.05 3.13 2.04 -0.75 -2.92 117.51 120.46 1xfw h ILE 96 Ca 0.01 -2.98 -0.00 0.00 1.00 0.00 0.00 64.86 62.89 1xfw h ILE 96 Cb 0.26 2.69 0.00 0.00 -0.74 0.00 0.00 36.82 39.03 1xfw h ILE 96 CO -0.00 0.79 -0.03 0.22 0.00 0.00 0.00 178.15 179.14 1xfw h TYR 97 N 0.00 -0.06 -1.55 1.37 -0.00 0.15 -3.08 116.97 113.80 1xfw h TYR 97 Ca -0.01 -0.00 0.45 0.00 -0.00 0.00 0.00 58.73 59.16 1xfw h TYR 97 Cb 1.64 0.02 -0.07 0.00 -0.00 0.00 0.00 36.73 38.33 1xfw h TYR 97 CO 0.00 -0.04 1.11 0.66 -0.00 0.00 0.00 178.16 179.89 1xfw h SER 98 N -0.50 0.02 -0.20 -2.11 4.64 -0.70 1.32 113.55 116.01 1xfw h SER 98 Ca -0.01 0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1xfw h SER 98 Cb 0.05 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1xfw h SER 98 CO 0.01 -0.00 -0.13 -0.08 -0.87 0.00 0.00 176.83 175.75 1xfw h GLU 99 N 0.01 0.45 -0.91 4.77 4.57 -1.60 -1.53 114.58 120.34 1xfw h GLU 99 Ca 0.74 -0.21 0.00 0.00 -1.18 0.00 0.00 59.36 58.71 1xfw h GLU 99 Cb 2.95 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 31.53 1xfw h GLU 99 CO -0.03 0.76 0.00 1.28 -1.18 0.00 0.00 179.01 179.84 1xfw n LEU 100 N -4.51 1.03 -0.85 1.64 4.77 0.45 -4.71 117.00 114.80 1xfw n LEU 100 Ca -0.05 -0.51 -0.10 0.00 -0.03 0.00 0.00 56.01 55.32 1xfw n LEU 100 Cb 0.35 -0.29 -0.04 0.00 -2.33 0.00 0.00 43.42 41.11 1xfw n LEU 100 CO 0.40 0.20 -0.10 0.61 -1.33 0.00 0.00 177.39 177.17 1xfw n GLY 101 N 0.41 0.96 3.64 -0.72 0.00 -0.58 -4.10 105.19 104.80 1xfw n GLY 101 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1xfw n GLY 101 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xfw s GLY 102 N -2.17 1.56 -0.24 -0.02 0.00 -1.03 -4.70 107.32 100.72 1xfw s GLY 102 Ca 0.00 -0.47 -0.14 0.00 0.00 0.00 0.00 44.72 44.11 1xfw s GLY 102 CO 0.00 0.21 0.58 -0.54 0.00 0.00 0.00 173.10 173.35 1xfw s GLU 103 N -5.01 0.59 -0.10 2.90 2.02 -1.14 -4.47 118.70 113.49 1xfw s GLU 103 Ca 0.67 1.04 -0.14 0.00 0.02 0.00 0.00 54.97 56.56 1xfw s GLU 103 Cb -0.18 0.09 -0.05 0.00 0.10 0.00 0.00 34.13 34.10 1xfw s GLU 103 CO 0.58 -0.15 0.33 0.42 0.02 0.00 0.00 175.26 176.46 1xfw s ILE 104 N 1.47 5.24 -0.27 -1.63 1.01 -0.34 -2.59 121.20 124.09 1xfw s ILE 104 Ca -0.09 0.64 -0.05 0.00 0.00 0.00 0.00 60.65 61.15 1xfw s ILE 104 Cb -0.06 -3.65 0.00 0.00 0.01 0.00 0.00 42.46 38.76 1xfw s ILE 104 CO -0.16 0.46 0.03 -0.31 0.00 0.00 0.00 174.94 174.96 1xfw s TYR 105 N -0.14 3.09 -0.14 3.97 4.12 0.82 -1.44 117.35 127.63 1xfw s TYR 105 Ca 0.20 -0.99 -0.03 0.00 0.02 0.00 0.00 57.07 56.27 1xfw s TYR 105 Cb -0.14 -2.19 -0.03 0.00 -1.52 0.00 0.00 41.96 38.08 1xfw s TYR 105 CO 0.07 -0.57 -0.05 -0.06 0.02 0.00 0.00 175.55 174.97 1xfw s PHE 106 N 1.48 3.01 0.33 2.71 0.08 -0.60 0.32 117.98 125.31 1xfw s PHE 106 Ca 0.03 -0.24 0.03 0.00 0.12 0.00 0.00 56.93 56.88 1xfw s PHE 106 Cb -0.16 -1.90 -0.01 0.00 -0.57 0.00 0.00 43.02 40.37 1xfw s PHE 106 CO 0.00 0.04 0.13 0.25 -0.10 0.00 0.00 175.22 175.54 1xfw n THR 107 N 3.24 0.00 0.00 0.64 -2.24 0.22 -0.01 114.28 116.13 1xfw n THR 107 Ca -0.18 -1.96 0.00 0.00 -2.27 0.00 0.00 64.05 59.65 1xfw n THR 107 Cb 0.53 0.72 0.00 0.00 -2.10 0.00 0.00 70.33 69.48 1xfw n THR 107 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1xfw n ASP 108 N -1.64 0.00 -3.74 3.42 4.64 -1.26 -3.29 116.55 114.68 1xfw n ASP 108 Ca -0.04 0.00 -0.28 0.00 -1.38 0.00 0.00 54.79 53.09 1xfw n ASP 108 Cb 0.50 0.00 -0.12 0.00 -1.04 0.00 0.00 41.12 40.46 1xfw n ASP 108 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1xfw s ILE 109 N 0.00 1.91 -0.30 5.18 1.01 -1.26 -3.87 121.20 123.87 1xfw s ILE 109 Ca 0.00 -3.42 -0.01 0.00 0.00 0.00 0.00 60.65 57.22 1xfw s ILE 109 Cb 0.00 -2.29 0.10 0.00 0.01 0.00 0.00 42.46 40.28 1xfw s ILE 109 CO 0.00 -1.02 0.10 -1.81 0.00 0.00 0.00 174.94 172.20 1xfw s ASP 110 N -0.59 3.90 -0.07 3.58 1.11 -1.26 -5.00 116.67 118.34 1xfw s ASP 110 Ca 0.25 -1.54 -0.06 0.00 0.18 0.00 0.00 52.55 51.37 1xfw s ASP 110 Cb -0.09 -0.79 -0.02 0.00 1.07 0.00 0.00 42.92 43.09 1xfw s ASP 110 CO -0.12 -0.41 -0.12 0.18 1.18 0.00 0.00 175.17 175.88 1xfw n LEU 111 N 4.90 0.83 0.00 1.23 4.77 -1.26 -4.75 117.00 122.72 1xfw n LEU 111 Ca -0.03 0.28 -0.26 0.00 -0.03 0.00 0.00 56.01 55.97 1xfw n LEU 111 Cb 0.42 -0.63 0.24 0.00 -2.33 0.00 0.00 43.42 41.12 1xfw n LEU 111 CO 0.11 -0.44 0.34 0.52 -1.33 0.00 0.00 177.39 176.58 1xfw n VAL 112 N -3.34 0.00 -0.25 4.08 0.31 -1.26 -4.65 118.33 113.21 1xfw n VAL 112 Ca -0.05 -0.09 -0.21 0.00 -0.01 0.00 0.00 64.34 63.99 1xfw n VAL 112 Cb 0.18 -0.91 -0.05 0.00 -0.91 0.00 0.00 33.84 32.14 1xfw n VAL 112 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1xfw n GLU 113 N -5.03 0.08 -0.00 5.55 1.02 -1.26 -3.78 120.64 117.21 1xfw n GLU 113 Ca 0.12 -0.76 0.01 0.00 -0.02 0.00 0.00 57.16 56.50 1xfw n GLU 113 Cb 0.50 -2.24 -0.02 0.00 -0.02 0.00 0.00 31.44 29.66 1xfw n GLU 113 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 1xfw n HIS 114 N 6.75 0.00 -1.99 -0.32 -0.00 -1.26 -4.81 115.22 113.59 1xfw n HIS 114 Ca 0.22 0.00 -0.39 0.00 0.46 0.00 0.00 57.72 58.01 1xfw n HIS 114 Cb 0.19 -0.06 0.00 0.00 -0.12 0.00 0.00 29.99 30.01 1xfw n HIS 114 CO 0.00 0.00 0.00 0.15 0.46 0.00 0.00 176.34 176.95 1xfw s LYS 115 N -2.14 3.80 0.00 1.57 1.02 -1.25 -4.81 119.74 117.94 1xfw s LYS 115 Ca -0.01 2.19 0.00 0.00 0.02 0.00 0.00 55.97 58.17 1xfw s LYS 115 Cb 0.01 -2.65 0.00 0.00 -0.52 0.00 0.00 37.83 34.67 1xfw s LYS 115 CO 0.09 -0.64 0.01 -0.85 -0.92 0.00 0.00 175.35 173.04 1xfw n GLU 116 N -0.11 0.01 -0.22 1.68 0.28 -1.26 -0.17 120.64 120.85 1xfw n GLU 116 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.05 1xfw n GLU 116 Cb 0.44 -1.00 0.00 0.00 1.43 0.00 0.00 31.44 32.30 1xfw n GLU 116 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1xfw n LEU 117 N 0.12 0.00 -1.38 -1.84 7.99 -1.26 -4.95 117.00 115.68 1xfw n LEU 117 Ca 0.00 -0.65 0.08 0.00 -0.01 0.00 0.00 56.01 55.43 1xfw n LEU 117 Cb 0.00 0.00 0.33 0.00 -0.11 0.00 0.00 43.42 43.64 1xfw n LEU 117 CO 0.00 0.56 0.79 0.00 -1.51 0.00 0.00 177.39 177.23 1xfw n GLN 118 N 0.00 3.85 0.00 3.23 1.13 0.76 -4.99 117.38 121.36 1xfw n GLN 118 Ca 0.00 -2.95 0.00 0.00 -1.94 0.00 0.00 57.00 52.11 1xfw n GLN 118 Cb 0.52 -2.00 0.00 0.00 0.11 0.00 0.00 30.24 28.87 1xfw n GLN 118 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1xfw n ASP 119 N 0.21 0.00 -4.17 1.08 10.43 -1.26 -4.66 116.55 118.18 1xfw n ASP 119 Ca 0.24 0.00 -0.43 0.00 2.57 0.00 0.00 54.79 57.17 1xfw n ASP 119 Cb 1.00 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.96 1xfw n ASP 119 CO 0.00 0.00 0.00 -0.11 -1.07 0.00 0.00 177.20 176.02 1xfw n LEU 120 N 0.00 5.89 0.00 0.64 -0.00 -1.26 -4.85 117.00 117.42 1xfw n LEU 120 Ca 0.00 -4.18 0.00 0.00 -0.00 0.00 0.00 56.01 51.83 1xfw n LEU 120 Cb 0.00 -1.66 0.00 0.00 -0.00 0.00 0.00 43.42 41.76 1xfw n LEU 120 CO 0.00 0.74 0.00 -1.20 -0.00 0.00 0.00 177.39 176.93 1xfw n SER 121 N 6.54 0.00 -4.04 1.96 7.64 -1.26 -4.91 113.62 119.55 1xfw n SER 121 Ca 0.47 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 60.01 1xfw n SER 121 Cb 0.42 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.52 1xfw n SER 121 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1xfw s GLU 122 N 0.00 2.78 0.00 1.43 1.03 -1.26 -5.05 118.70 117.63 1xfw s GLU 122 Ca 0.00 -3.05 0.00 0.00 0.03 0.00 0.00 54.97 51.95 1xfw s GLU 122 Cb 0.00 -3.71 0.00 0.00 -0.80 0.00 0.00 34.13 29.62 1xfw s GLU 122 CO 0.00 -1.23 0.00 -0.85 -1.33 0.00 0.00 175.26 171.85 1xfw n GLU 123 N 2.61 3.51 -2.48 -4.83 0.00 -1.26 -4.51 120.64 113.67 1xfw n GLU 123 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 57.16 56.89 1xfw n GLU 123 Cb 0.36 0.00 -0.02 0.00 0.00 0.00 0.00 31.44 31.78 1xfw n GLU 123 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.13 175.13 1xfw s GLU 124 N 2.37 3.55 0.00 3.44 2.56 -1.26 -4.92 118.70 124.45 1xfw s GLU 124 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 54.97 55.56 1xfw s GLU 124 Cb 0.00 -4.01 0.00 0.00 2.00 0.00 0.00 34.13 32.12 1xfw s GLU 124 CO 0.00 -1.61 0.00 1.63 -0.56 0.00 0.00 175.26 174.72 1xfw n LYS 125 N 8.20 0.00 -4.05 4.30 4.76 -1.26 -5.00 118.16 125.10 1xfw n LYS 125 Ca 0.13 0.04 -0.35 0.00 -2.87 0.00 0.00 58.31 55.25 1xfw n LYS 125 Cb 0.49 -0.29 -0.08 0.00 -1.84 0.00 0.00 35.03 33.31 1xfw n LYS 125 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1xfw s ASN 126 N -2.08 5.78 -0.90 4.39 -0.87 -1.26 -5.07 114.94 114.93 1xfw s ASN 126 Ca 0.00 0.22 -0.23 0.00 -1.57 0.00 0.00 52.86 51.28 1xfw s ASN 126 Cb 0.00 -1.87 0.07 0.00 -0.02 0.00 0.00 41.25 39.43 1xfw s ASN 126 CO 0.00 0.30 1.28 -0.44 -2.57 0.00 0.00 177.10 175.67 1xfw s SER 127 N -0.38 6.42 -0.26 -1.22 0.01 -1.26 -4.86 113.70 112.14 1xfw s SER 127 Ca 0.09 -1.31 -0.01 0.00 1.31 0.00 0.00 55.95 56.03 1xfw s SER 127 Cb -0.12 -2.51 0.13 0.00 0.21 0.00 0.00 66.02 63.73 1xfw s SER 127 CO 0.02 -1.47 0.32 0.00 0.41 0.00 0.00 173.24 172.51 1xfw s MET 128 N 4.52 0.32 0.00 12.44 0.23 -1.26 -4.99 119.30 130.57 1xfw s MET 128 Ca 0.38 0.10 0.00 0.00 -1.03 0.00 0.00 55.69 55.14 1xfw s MET 128 Cb -0.05 -0.67 0.00 0.00 -1.53 0.00 0.00 34.83 32.58 1xfw s MET 128 CO -0.02 -0.88 0.00 0.09 -2.03 0.00 0.00 175.02 172.18 1xfw n ASN 129 N 5.33 0.00 -2.99 -1.18 5.03 -1.26 -5.04 115.26 115.15 1xfw n ASN 129 Ca -0.03 0.00 -0.12 0.00 0.87 0.00 0.00 54.58 55.31 1xfw n ASN 129 Cb 0.48 -0.08 0.07 0.00 -1.02 0.00 0.00 39.78 39.24 1xfw n ASN 129 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 1xfw n SER 130 N -1.77 0.32 -0.15 6.41 3.41 -1.26 -4.96 113.62 115.62 1xfw n SER 130 Ca 0.00 -1.36 -0.04 0.00 -0.26 0.00 0.00 58.87 57.21 1xfw n SER 130 Cb 0.00 -0.37 -0.04 0.00 -0.26 0.00 0.00 64.21 63.55 1xfw n SER 130 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1xfw n ARG 131 N -2.03 -0.16 0.00 4.33 0.63 -1.26 -4.41 116.66 113.76 1xfw n ARG 131 Ca 0.07 0.82 0.00 0.00 -0.92 0.00 0.00 57.85 57.82 1xfw n ARG 131 Cb 0.26 -1.21 0.00 0.00 0.45 0.00 0.00 32.46 31.96 1xfw n ARG 131 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1xfw n GLY 132 N -1.09 1.58 2.81 5.14 0.00 -1.26 -5.08 105.19 107.29 1xfw n GLY 132 Ca 0.01 -1.71 -0.20 0.00 0.00 0.00 0.00 46.02 44.12 1xfw n GLY 132 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xfw s GLU 133 N 2.97 0.54 0.00 1.61 2.56 -1.26 -4.21 118.70 120.91 1xfw s GLU 133 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.97 55.02 1xfw s GLU 133 Cb 0.00 -0.76 0.00 0.00 2.00 0.00 0.00 34.13 35.37 1xfw s GLU 133 CO 0.00 -0.19 0.00 1.17 -0.56 0.00 0.00 175.26 175.68 1xfw n LYS 134 N 4.54 0.00 -3.65 4.30 4.81 -1.26 -4.96 118.16 121.93 1xfw n LYS 134 Ca -0.18 0.00 -0.28 0.00 -0.87 0.00 0.00 58.31 56.99 1xfw n LYS 134 Cb 0.50 -0.72 0.01 0.00 0.02 0.00 0.00 35.03 34.84 1xfw n LYS 134 CO 0.00 0.00 0.00 1.55 1.17 0.00 0.00 177.40 180.12 1xfw n VAL 135 N -1.98 -1.61 -1.22 3.15 3.14 -1.26 -4.93 118.33 113.63 1xfw n VAL 135 Ca 0.00 0.00 -0.25 0.00 -2.96 0.00 0.00 64.34 61.13 1xfw n VAL 135 Cb 0.23 -2.50 0.16 0.00 -1.06 0.00 0.00 33.84 30.67 1xfw n VAL 135 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 1xfw n PRO 136 N -4.29 2.31 0.00 1.45 -0.04 -1.26 -4.91 135.00 128.26 1xfw n PRO 136 Ca 0.01 -3.01 0.00 0.00 -0.04 0.00 0.00 63.50 60.46 1xfw n PRO 136 Cb 0.54 -2.18 0.00 0.00 -0.04 0.00 0.00 33.50 31.82 1xfw n PRO 136 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1xfw n PHE 137 N -1.09 0.00 0.00 0.54 -0.00 -1.26 -1.74 117.46 113.91 1xfw n PHE 137 Ca 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 58.05 1xfw n PHE 137 Cb 1.49 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.97 1xfw n PHE 137 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1xfw n ALA 138 N 0.00 0.00 0.28 3.13 0.00 -1.26 0.22 120.51 122.88 1xfw n ALA 138 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.59 1xfw n ALA 138 Cb 0.00 0.00 0.80 0.00 0.00 0.00 0.00 19.45 20.25 1xfw n ALA 138 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1xfw h SER 139 N 0.00 0.00 -4.07 0.00 4.64 -1.75 -3.40 113.55 108.97 1xfw h SER 139 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1xfw h SER 139 Cb 0.00 0.00 0.20 0.00 -0.31 0.00 0.00 62.40 62.29 1xfw h SER 139 CO 0.00 0.00 0.06 0.54 -0.87 0.00 0.00 176.83 176.56 1xfw n ARG 140 N -2.68 -0.33 0.00 4.77 5.12 0.60 -4.99 116.66 119.16 1xfw n ARG 140 Ca -0.02 -0.03 0.00 0.00 -1.93 0.00 0.00 57.85 55.87 1xfw n ARG 140 Cb 0.23 -2.27 0.00 0.00 -1.16 0.00 0.00 32.46 29.26 1xfw n ARG 140 CO 0.00 0.00 0.00 1.97 -1.93 0.00 0.00 177.63 177.67 1xfw n PHE 141 N -3.97 0.00 -4.37 -1.55 -1.74 -1.26 -4.68 117.46 99.89 1xfw n PHE 141 Ca 0.11 0.00 -0.26 0.00 -0.56 0.00 0.00 57.45 56.74 1xfw n PHE 141 Cb 0.52 0.00 -0.17 0.00 1.52 0.00 0.00 39.48 41.35 1xfw n PHE 141 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 1xfw s VAL 142 N -0.30 1.23 0.04 1.97 1.01 -1.26 -2.14 120.40 120.95 1xfw s VAL 142 Ca 0.00 -0.49 -0.07 0.00 0.00 0.00 0.00 61.98 61.43 1xfw s VAL 142 Cb 0.00 -1.15 -0.01 0.00 0.00 0.00 0.00 36.38 35.22 1xfw s VAL 142 CO 0.00 0.39 0.12 0.12 0.00 0.00 0.00 175.10 175.73 1xfw s PHE 143 N 1.03 0.16 -0.11 5.22 5.36 -0.18 -5.00 117.98 124.47 1xfw s PHE 143 Ca -0.07 -0.45 -0.01 0.00 -0.96 0.00 0.00 56.93 55.44 1xfw s PHE 143 Cb -0.15 -0.11 0.03 0.00 -0.34 0.00 0.00 43.02 42.45 1xfw s PHE 143 CO -0.01 -0.39 -0.05 -2.00 -1.46 0.00 0.00 175.22 171.31 1xfw s GLU 144 N -2.65 1.27 -0.72 10.12 2.56 -1.26 0.47 118.70 128.50 1xfw s GLU 144 Ca -0.05 -0.21 -0.27 0.00 0.00 0.00 0.00 54.97 54.44 1xfw s GLU 144 Cb -0.01 -1.52 0.02 0.00 2.00 0.00 0.00 34.13 34.62 1xfw s GLU 144 CO -0.05 -0.31 1.42 0.21 -0.56 0.00 0.00 175.26 175.97 1xfw s LYS 145 N 1.76 3.06 0.51 4.30 2.20 -0.47 -4.91 119.74 126.20 1xfw s LYS 145 Ca 0.04 -0.06 0.24 0.00 -0.36 0.00 0.00 55.97 55.83 1xfw s LYS 145 Cb -0.13 -4.25 1.39 0.00 -1.51 0.00 0.00 37.83 33.33 1xfw s LYS 145 CO -0.07 -2.29 2.08 1.57 -0.36 0.00 0.00 175.35 176.28 1xfw h LYS 146 N 11.16 0.00 0.15 4.03 2.10 -1.89 -3.22 116.57 128.91 1xfw h LYS 146 Ca -0.27 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 58.07 1xfw h LYS 146 Cb 1.07 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.41 1xfw h LYS 146 CO 1.27 0.12 -1.48 0.00 -2.00 0.00 0.00 179.45 177.36 1xfw h ARG 147 N 0.00 0.32 0.00 0.07 3.08 -1.91 -3.45 114.38 112.50 1xfw h ARG 147 Ca -0.00 -0.55 0.00 0.00 0.07 0.00 0.00 59.98 59.50 1xfw h ARG 147 Cb 0.27 0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.53 1xfw h ARG 147 CO 0.02 1.22 0.00 -1.91 -1.07 0.00 0.00 179.97 178.23 1xfw n GLU 148 N -3.53 0.00 -3.14 0.04 4.07 -1.26 -4.99 120.64 111.82 1xfw n GLU 148 Ca -0.16 0.00 -0.44 0.00 -0.06 0.00 0.00 57.16 56.50 1xfw n GLU 148 Cb 1.05 0.00 -0.05 0.00 -0.06 0.00 0.00 31.44 32.38 1xfw n GLU 148 CO 0.00 0.00 0.00 -0.08 -0.06 0.00 0.00 177.13 176.99 1xfw s THR 149 N 0.00 4.86 0.18 6.31 -1.32 -1.26 -5.02 115.64 119.40 1xfw s THR 149 Ca 0.00 -0.76 -0.32 0.00 -1.21 0.00 0.00 61.69 59.40 1xfw s THR 149 Cb 0.00 -4.38 -0.16 0.00 -1.51 0.00 0.00 72.50 66.45 1xfw s THR 149 CO 0.00 -0.95 1.08 -0.81 -2.21 0.00 0.00 174.62 171.72 1xfw n PRO 150 N 6.21 1.03 -3.75 7.08 -0.04 -1.26 -4.83 135.00 139.43 1xfw n PRO 150 Ca -0.08 0.37 -0.29 0.00 -0.04 0.00 0.00 63.50 63.46 1xfw n PRO 150 Cb 0.44 -1.80 -0.16 0.00 -0.04 0.00 0.00 33.50 31.94 1xfw n PRO 150 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1xfw s LYS 151 N -0.60 0.78 -0.10 0.54 1.02 -1.21 -2.88 119.74 117.29 1xfw s LYS 151 Ca 0.71 -0.72 -0.18 0.00 0.02 0.00 0.00 55.97 55.80 1xfw s LYS 151 Cb -0.86 -2.10 -0.04 0.00 -0.52 0.00 0.00 37.83 34.31 1xfw s LYS 151 CO 0.54 -0.77 0.46 -1.17 -0.92 0.00 0.00 175.35 173.50 1xfw s LEU 152 N 1.72 4.30 -0.11 3.17 0.20 -1.07 -1.36 118.68 125.54 1xfw s LEU 152 Ca 0.02 0.83 0.02 0.00 0.69 0.00 0.00 54.13 55.70 1xfw s LEU 152 Cb -0.17 -2.68 0.01 0.00 -0.43 0.00 0.00 46.19 42.92 1xfw s LEU 152 CO -0.15 0.05 -0.17 -0.63 -0.29 0.00 0.00 176.35 175.17 1xfw s ILE 153 N 0.37 1.57 -0.02 6.68 1.01 0.18 0.28 121.20 131.28 1xfw s ILE 153 Ca 0.25 -0.70 0.02 0.00 0.00 0.00 0.00 60.65 60.22 1xfw s ILE 153 Cb -0.15 -1.42 0.01 0.00 0.01 0.00 0.00 42.46 40.90 1xfw s ILE 153 CO 0.11 0.46 -0.06 -0.63 0.00 0.00 0.00 174.94 174.82 1xfw s ILE 154 N 0.85 0.51 0.10 2.92 -1.09 0.94 -1.01 121.20 124.42 1xfw s ILE 154 Ca -0.09 -0.21 0.10 0.00 -2.23 0.00 0.00 60.65 58.21 1xfw s ILE 154 Cb -0.15 -0.47 -0.04 0.00 -1.58 0.00 0.00 42.46 40.22 1xfw s ILE 154 CO 0.00 0.17 -0.25 0.54 -1.23 0.00 0.00 174.94 174.18 1xfw s ASN 155 N 0.24 2.99 0.06 3.58 4.22 -0.91 0.70 114.94 125.81 1xfw s ASN 155 Ca -0.03 -0.69 0.06 0.00 -2.14 0.00 0.00 52.86 50.07 1xfw s ASN 155 Cb -0.07 -0.20 -0.03 0.00 1.28 0.00 0.00 41.25 42.23 1xfw s ASN 155 CO -0.00 0.15 -0.17 -0.63 -2.04 0.00 0.00 177.10 174.41 1xfw s ILE 156 N -1.03 1.38 0.00 0.54 1.09 -1.21 -4.88 121.20 117.09 1xfw s ILE 156 Ca 0.11 -1.21 0.00 0.00 -1.10 0.00 0.00 60.65 58.45 1xfw s ILE 156 Cb -0.10 -1.25 0.00 0.00 -1.06 0.00 0.00 42.46 40.05 1xfw s ILE 156 CO 0.05 0.01 0.00 1.17 -0.10 0.00 0.00 174.94 176.07 1xfw n LYS 157 N 1.63 0.00 -2.24 2.79 3.00 -1.26 -4.67 118.16 117.40 1xfw n LYS 157 Ca -0.19 0.00 -0.11 0.00 -0.00 0.00 0.00 58.31 58.01 1xfw n LYS 157 Cb 0.54 0.00 0.03 0.00 0.00 0.00 0.00 35.03 35.60 1xfw n LYS 157 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1xfw n ASP 158 N 0.00 1.35 -0.26 3.14 9.92 -1.26 -4.95 116.55 124.48 1xfw n ASP 158 Ca 0.00 -1.88 0.11 0.00 -0.53 0.00 0.00 54.79 52.49 1xfw n ASP 158 Cb 0.00 -0.18 0.23 0.00 -0.64 0.00 0.00 41.12 40.53 1xfw n ASP 158 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1xfw n TYR 159 N -1.56 0.49 -3.73 1.24 4.02 -1.26 -4.79 117.16 111.57 1xfw n TYR 159 Ca 0.06 0.92 -0.12 0.00 -0.01 0.00 0.00 57.90 58.75 1xfw n TYR 159 Cb 0.33 -1.07 -0.12 0.00 -0.02 0.00 0.00 39.34 38.45 1xfw n TYR 159 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xfw s ALA 160 N -5.68 -0.72 -0.22 -0.72 0.00 -1.26 -4.88 121.76 108.29 1xfw s ALA 160 Ca -0.10 1.11 0.22 0.00 0.00 0.00 0.00 51.96 53.19 1xfw s ALA 160 Cb 0.22 -0.68 -0.05 0.00 0.00 0.00 0.00 23.12 22.61 1xfw s ALA 160 CO 0.59 -0.20 0.95 -0.89 0.00 0.00 0.00 175.76 176.21 1xfw n ILE 161 N 4.00 0.49 0.79 0.00 5.41 -1.26 -4.41 119.36 124.38 1xfw n ILE 161 Ca -0.23 -0.52 0.13 0.00 1.00 0.00 0.00 62.75 63.13 1xfw n ILE 161 Cb 0.54 -0.26 0.42 0.00 -0.71 0.00 0.00 39.64 39.64 1xfw n ILE 161 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1xfw n ASN 162 N -2.57 0.49 0.09 4.38 3.02 -1.26 -2.83 115.26 116.58 1xfw n ASN 162 Ca -0.01 0.37 -0.04 0.00 -0.03 0.00 0.00 54.58 54.87 1xfw n ASN 162 Cb 0.55 -0.41 -0.02 0.00 -0.61 0.00 0.00 39.78 39.29 1xfw n ASN 162 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1xfw h SER 163 N 0.00 -0.23 -2.88 6.41 0.02 -1.99 -3.39 113.55 111.49 1xfw h SER 163 Ca 0.00 0.01 -0.62 0.00 -0.84 0.00 0.00 61.79 60.34 1xfw h SER 163 Cb 0.63 0.06 -0.42 0.00 0.14 0.00 0.00 62.40 62.81 1xfw h SER 163 CO 0.00 0.05 -0.57 1.21 -1.14 0.00 0.00 176.83 176.39 1xfw n GLU 164 N -3.97 2.02 0.00 3.45 2.13 -1.26 -4.92 120.64 118.08 1xfw n GLU 164 Ca -0.03 -4.54 0.00 0.00 0.66 0.00 0.00 57.16 53.25 1xfw n GLU 164 Cb 0.11 -2.28 0.00 0.00 0.27 0.00 0.00 31.44 29.53 1xfw n GLU 164 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 1xfw n GLN 165 N 1.69 0.00 0.00 5.31 6.02 -1.13 -2.36 117.38 126.91 1xfw n GLN 165 Ca 0.22 0.07 0.00 0.00 -0.01 0.00 0.00 57.00 57.29 1xfw n GLN 165 Cb 0.36 -1.61 0.01 0.00 1.02 0.00 0.00 30.24 30.03 1xfw n GLN 165 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1xfw n SER 166 N -0.88 0.00 -0.11 1.08 2.88 -1.26 -1.31 113.62 114.01 1xfw n SER 166 Ca 0.00 -0.03 -0.21 0.00 -1.33 0.00 0.00 58.87 57.31 1xfw n SER 166 Cb 0.11 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.48 1xfw n SER 166 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1xfw n LYS 167 N -0.84 0.50 0.23 -1.46 2.85 -1.00 -4.46 118.16 113.98 1xfw n LYS 167 Ca 0.00 0.18 0.09 0.00 -1.05 0.00 0.00 58.31 57.53 1xfw n LYS 167 Cb 0.00 -1.36 0.58 0.00 -0.65 0.00 0.00 35.03 33.60 1xfw n LYS 167 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 177.40 178.84 1xfw h GLU 168 N -0.50 0.00 -0.97 -1.58 4.81 -1.45 -2.75 114.58 112.14 1xfw h GLU 168 Ca -0.54 0.00 0.23 0.00 -0.13 0.00 0.00 59.36 58.92 1xfw h GLU 168 Cb 1.60 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.90 1xfw h GLU 168 CO -0.24 0.20 0.63 -0.24 -0.73 0.00 0.00 179.01 178.63 1xfw h VAL 169 N 0.00 0.62 0.00 0.32 3.04 -1.64 0.39 116.25 118.98 1xfw h VAL 169 Ca -0.00 -0.15 -0.02 0.00 -1.01 0.00 0.00 66.70 65.52 1xfw h VAL 169 Cb 0.49 0.13 -0.00 0.00 -2.01 0.00 0.00 31.29 29.90 1xfw h VAL 169 CO 0.03 0.08 -0.08 1.88 -1.01 0.00 0.00 177.57 178.47 1xfw h TYR 170 N 0.45 0.00 -0.00 3.17 -1.99 -1.75 0.30 116.97 117.15 1xfw h TYR 170 Ca 0.53 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.26 1xfw h TYR 170 Cb 1.27 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.00 1xfw h TYR 170 CO -0.00 0.08 -0.03 0.98 -0.00 0.00 0.00 178.16 179.19 1xfw n TYR 171 N -3.18 0.00 -0.08 4.88 9.36 0.13 0.69 117.16 128.97 1xfw n TYR 171 Ca 0.01 0.00 -0.07 0.00 3.32 0.00 0.00 57.90 61.16 1xfw n TYR 171 Cb 0.40 -0.21 -0.02 0.00 -0.63 0.00 0.00 39.34 38.88 1xfw n TYR 171 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 1xfw n GLU 172 N -1.14 0.46 0.03 2.98 4.71 0.71 -3.73 120.64 124.65 1xfw n GLU 172 Ca 0.16 0.28 -0.13 0.00 -0.01 0.00 0.00 57.16 57.47 1xfw n GLU 172 Cb 0.23 -1.42 -0.09 0.00 -1.01 0.00 0.00 31.44 29.15 1xfw n GLU 172 CO 0.00 0.00 0.00 0.97 0.09 0.00 0.00 177.13 178.19 1xfw h ILE 173 N -0.90 1.17 -1.89 -3.67 2.10 -0.72 0.78 117.51 114.39 1xfw h ILE 173 Ca 0.00 -0.94 0.55 0.00 1.08 0.00 0.00 64.86 65.55 1xfw h ILE 173 Cb 0.77 1.77 -0.08 0.00 -1.09 0.00 0.00 36.82 38.19 1xfw h ILE 173 CO 0.00 0.23 1.40 1.23 -1.08 0.00 0.00 178.15 179.93 1xfw h GLY 174 N -0.53 0.00 0.00 8.18 0.00 0.09 1.31 103.07 112.11 1xfw h GLY 174 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1xfw h GLY 174 CO 0.02 0.00 -0.20 1.70 0.00 0.00 0.00 176.54 178.05 1xfw h LYS 175 N 0.00 0.00 -1.03 4.80 3.64 -1.37 -3.35 116.57 119.26 1xfw h LYS 175 Ca 0.90 0.00 0.30 0.00 -1.27 0.00 0.00 60.65 60.58 1xfw h LYS 175 Cb 3.69 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 35.47 1xfw h LYS 175 CO -0.01 0.00 0.86 0.41 -2.27 0.00 0.00 179.45 178.44 1xfw n GLY 176 N 1.72 -0.57 0.00 5.01 0.00 0.44 0.30 105.19 112.08 1xfw n GLY 176 Ca -0.03 0.36 0.07 0.00 0.00 0.00 0.00 46.02 46.43 1xfw n GLY 176 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1xfw n ILE 177 N -2.95 0.00 -0.06 -0.61 -5.35 -0.36 -1.97 119.36 108.06 1xfw n ILE 177 Ca 0.23 0.00 -0.04 0.00 -0.27 0.00 0.00 62.75 62.67 1xfw n ILE 177 Cb 1.17 -0.69 -0.02 0.00 -1.74 0.00 0.00 39.64 38.35 1xfw n ILE 177 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1xfw h SER 178 N 0.00 0.00 0.28 7.28 4.64 0.44 -3.41 113.55 122.78 1xfw h SER 178 Ca 0.00 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 1xfw h SER 178 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1xfw h SER 178 CO 0.00 0.68 -0.19 0.00 -0.87 0.00 0.00 176.83 176.44 1xfw n LEU 179 N -4.70 0.82 0.00 5.97 -0.00 -0.95 -4.31 117.00 113.84 1xfw n LEU 179 Ca -0.05 -0.16 0.00 0.00 -0.00 0.00 0.00 56.01 55.80 1xfw n LEU 179 Cb 0.16 -0.14 0.00 0.00 -0.00 0.00 0.00 43.42 43.44 1xfw n LEU 179 CO 0.08 0.15 0.08 -0.90 -0.00 0.00 0.00 177.39 176.80 1xfw n ASP 180 N -0.75 0.00 0.00 1.45 5.75 -0.83 0.80 116.55 122.98 1xfw n ASP 180 Ca 0.13 0.15 0.00 0.00 -0.01 0.00 0.00 54.79 55.07 1xfw n ASP 180 Cb 0.32 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.41 1xfw n ASP 180 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xfw n ILE 181 N -0.22 0.20 0.00 2.12 3.06 -1.26 0.34 119.36 123.60 1xfw n ILE 181 Ca 0.00 0.20 0.00 0.00 -2.50 0.00 0.00 62.75 60.45 1xfw n ILE 181 Cb 0.00 -1.20 0.00 0.00 0.54 0.00 0.00 39.64 38.98 1xfw n ILE 181 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1xfw n ILE 182 N -0.83 0.00 0.00 9.51 0.00 -1.21 -4.20 119.36 122.63 1xfw n ILE 182 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 62.75 62.73 1xfw n ILE 182 Cb 0.15 0.43 0.00 0.00 0.00 0.00 0.00 39.64 40.22 1xfw n ILE 182 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1xfw n SER 183 N -0.16 0.00 0.00 9.51 2.88 4.35 -4.25 113.62 125.96 1xfw n SER 183 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1xfw n SER 183 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1xfw n SER 183 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1xfw n LYS 184 N 0.00 3.42 -0.23 -1.46 3.00 -1.24 -4.27 118.16 117.38 1xfw n LYS 184 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 58.31 58.34 1xfw n LYS 184 Cb 0.00 -0.70 0.14 0.00 0.00 0.00 0.00 35.03 34.46 1xfw n LYS 184 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 1xfw h ASP 185 N 0.00 -0.26 0.00 3.14 -0.00 -1.84 -3.37 116.42 114.09 1xfw h ASP 185 Ca 0.00 0.17 0.00 0.00 -0.00 0.00 0.00 57.03 57.20 1xfw h ASP 185 Cb 0.03 0.29 0.00 0.00 -0.00 0.00 0.00 39.33 39.65 1xfw h ASP 185 CO 0.00 -0.13 0.00 1.17 -0.00 0.00 0.00 179.24 180.28 1xfw n LYS 186 N -5.29 1.09 0.00 0.28 4.81 -1.25 -0.90 118.16 116.91 1xfw n LYS 186 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.56 1xfw n LYS 186 Cb 0.42 -0.09 0.00 0.00 0.02 0.00 0.00 35.03 35.38 1xfw n LYS 186 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1xfw n SER 187 N 0.00 0.00 -4.19 3.14 2.88 -1.26 -2.76 113.62 111.43 1xfw n SER 187 Ca 0.00 0.42 -0.29 0.00 -1.33 0.00 0.00 58.87 57.68 1xfw n SER 187 Cb 0.00 0.00 0.25 0.00 -0.75 0.00 0.00 64.21 63.71 1xfw n SER 187 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1xfw n LEU 188 N -0.63 -1.77 -4.95 2.46 -0.00 -1.26 -4.90 117.00 105.94 1xfw n LEU 188 Ca 0.00 -0.31 -0.29 0.00 -0.00 0.00 0.00 56.01 55.41 1xfw n LEU 188 Cb 0.00 -1.12 0.18 0.00 -0.00 0.00 0.00 43.42 42.48 1xfw n LEU 188 CO 0.00 -3.52 0.82 -1.81 -0.00 0.00 0.00 177.39 172.88 1xfw s ASP 189 N -2.35 3.25 -0.42 1.45 1.01 -1.11 -4.76 116.67 113.73 1xfw s ASP 189 Ca 0.65 0.08 -0.34 0.00 0.71 0.00 0.00 52.55 53.64 1xfw s ASP 189 Cb -0.20 -0.15 -0.12 0.00 1.01 0.00 0.00 42.92 43.46 1xfw s ASP 189 CO 0.63 -2.63 2.25 -2.65 0.21 0.00 0.00 175.17 172.98 1xfw n PRO 190 N -3.61 0.93 -3.51 8.23 -0.02 -0.08 -4.35 135.00 132.60 1xfw n PRO 190 Ca 0.16 0.23 -0.29 0.00 -2.02 0.00 0.00 63.50 61.57 1xfw n PRO 190 Cb 0.60 -2.42 -0.04 0.00 -0.02 0.00 0.00 33.50 31.61 1xfw n PRO 190 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1xfw s GLU 191 N 6.63 3.62 0.07 -0.52 0.41 -1.26 -4.68 118.70 122.97 1xfw s GLU 191 Ca 1.11 -0.06 0.03 0.00 -0.41 0.00 0.00 54.97 55.64 1xfw s GLU 191 Cb -0.86 -2.74 0.22 0.00 -1.78 0.00 0.00 34.13 28.97 1xfw s GLU 191 CO 0.48 0.33 0.31 1.19 -0.49 0.00 0.00 175.26 177.07 1xfw n PHE 192 N -0.54 0.19 -0.23 1.61 3.01 -1.26 0.12 117.46 120.36 1xfw n PHE 192 Ca -0.02 0.23 -0.06 0.00 1.01 0.00 0.00 57.45 58.61 1xfw n PHE 192 Cb 0.53 -0.69 -0.06 0.00 -0.01 0.00 0.00 39.48 39.26 1xfw n PHE 192 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1xfw n LEU 193 N -3.67 -0.59 0.08 4.37 4.77 -1.26 0.22 117.00 120.92 1xfw n LEU 193 Ca 0.06 1.30 0.12 0.00 -0.03 0.00 0.00 56.01 57.46 1xfw n LEU 193 Cb 0.21 -0.28 0.06 0.00 -2.33 0.00 0.00 43.42 41.08 1xfw n LEU 193 CO -0.00 -0.96 0.13 -3.20 -1.33 0.00 0.00 177.39 172.02 1xfw n ASN 194 N -4.28 0.76 0.06 -1.43 2.85 0.12 -2.02 115.26 111.32 1xfw n ASN 194 Ca 0.01 0.18 -0.07 0.00 -0.11 0.00 0.00 54.58 54.60 1xfw n ASN 194 Cb 0.14 0.40 0.09 0.00 1.24 0.00 0.00 39.78 41.66 1xfw n ASN 194 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 1xfw h LEU 195 N 0.00 0.40 0.01 1.20 5.85 0.02 -0.61 115.31 122.18 1xfw h LEU 195 Ca 0.00 -0.23 -0.30 0.00 0.84 0.00 0.00 57.88 58.19 1xfw h LEU 195 Cb 0.88 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.74 1xfw h LEU 195 CO 0.00 0.91 -1.76 -0.38 -0.34 0.00 0.00 178.44 176.87 1xfw n ILE 196 N -3.90 1.62 0.19 4.05 5.41 0.59 -3.42 119.36 123.90 1xfw n ILE 196 Ca -0.03 -0.79 0.06 0.00 1.00 0.00 0.00 62.75 62.99 1xfw n ILE 196 Cb 0.62 -1.07 0.37 0.00 -0.71 0.00 0.00 39.64 38.84 1xfw n ILE 196 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 1xfw h LYS 197 N 0.01 0.00 0.00 0.38 3.11 -1.36 -1.48 116.57 117.23 1xfw h LYS 197 Ca -0.31 0.00 -0.19 0.00 -2.81 0.00 0.00 60.65 57.34 1xfw h LYS 197 Cb 2.02 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 33.23 1xfw h LYS 197 CO 0.08 0.36 -0.90 1.03 -2.81 0.00 0.00 179.45 177.21 1xfw h SER 198 N 0.00 0.03 0.49 4.20 0.87 -1.23 -2.85 113.55 115.05 1xfw h SER 198 Ca -0.00 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1xfw h SER 198 Cb 0.84 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.79 1xfw h SER 198 CO 0.05 0.91 0.00 -0.07 -0.53 0.00 0.00 176.83 177.19 1xfw h LEU 199 N 0.01 0.00 -2.36 2.23 3.38 -1.30 -2.58 115.31 114.70 1xfw h LEU 199 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1xfw h LEU 199 Cb 1.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.33 1xfw h LEU 199 CO 0.12 0.00 0.00 -0.24 0.09 0.00 0.00 178.44 178.41 1xfw n SER 200 N -2.66 2.64 0.35 -0.43 2.88 -0.99 -3.54 113.62 111.87 1xfw n SER 200 Ca -0.00 -1.60 -0.18 0.00 -1.33 0.00 0.00 58.87 55.76 1xfw n SER 200 Cb 0.17 -0.49 -0.09 0.00 -0.75 0.00 0.00 64.21 63.06 1xfw n SER 200 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 1xfw h ASP 201 N 0.91 -0.93 0.00 -3.46 3.58 -1.70 -3.42 116.42 111.40 1xfw h ASP 201 Ca 0.00 0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.50 1xfw h ASP 201 Cb 0.72 0.27 0.00 0.00 1.72 0.00 0.00 39.33 42.04 1xfw h ASP 201 CO 0.00 -0.59 -0.23 -0.90 -2.88 0.00 0.00 179.24 174.65 1xfw n ASP 202 N -5.51 0.00 -0.04 2.28 5.68 -1.23 -4.59 116.55 113.13 1xfw n ASP 202 Ca -0.13 -1.45 -0.04 0.00 -0.50 0.00 0.00 54.79 52.67 1xfw n ASP 202 Cb 0.40 -0.09 -0.07 0.00 -1.14 0.00 0.00 41.12 40.22 1xfw n ASP 202 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1xfw n SER 203 N 0.00 2.92 0.00 -1.12 3.41 -1.25 -4.90 113.62 112.68 1xfw n SER 203 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1xfw n SER 203 Cb 0.59 0.73 0.00 0.00 -0.26 0.00 0.00 64.21 65.27 1xfw n SER 203 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1xfw n ASP 204 N -2.30 0.00 -4.91 4.04 8.00 -1.26 -4.96 116.55 115.16 1xfw n ASP 204 Ca -0.13 0.28 -0.28 0.00 0.71 0.00 0.00 54.79 55.36 1xfw n ASP 204 Cb 0.76 -0.15 -0.03 0.00 -0.02 0.00 0.00 41.12 41.68 1xfw n ASP 204 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1xfw s SER 205 N -1.71 6.42 0.00 -2.24 0.15 -1.26 -4.98 113.70 110.08 1xfw s SER 205 Ca 0.00 0.64 -0.01 0.00 0.70 0.00 0.00 55.95 57.28 1xfw s SER 205 Cb 0.00 -2.11 -0.03 0.00 -1.71 0.00 0.00 66.02 62.17 1xfw s SER 205 CO 0.00 -0.19 1.54 -1.20 1.20 0.00 0.00 173.24 174.60 1xfw n SER 206 N -1.00 3.61 -3.64 5.45 7.64 -1.26 -4.47 113.62 119.95 1xfw n SER 206 Ca -0.02 -1.99 -0.28 0.00 1.01 0.00 0.00 58.87 57.59 1xfw n SER 206 Cb 0.54 -0.79 -0.11 0.00 -1.01 0.00 0.00 64.21 62.84 1xfw n SER 206 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1xfw s ASP 207 N 2.05 3.10 0.00 6.43 1.01 -1.26 -4.96 116.67 123.04 1xfw s ASP 207 Ca 0.07 -3.42 -0.01 0.00 0.71 0.00 0.00 52.55 49.90 1xfw s ASP 207 Cb 0.03 -1.02 -0.04 0.00 1.01 0.00 0.00 42.92 42.90 1xfw s ASP 207 CO 0.00 -0.13 2.07 0.18 0.21 0.00 0.00 175.17 177.50 1xfw n LEU 208 N 2.46 4.83 -4.20 1.23 4.32 -1.26 -4.71 117.00 119.67 1xfw n LEU 208 Ca 0.24 -2.31 -0.40 0.00 -0.02 0.00 0.00 56.01 53.52 1xfw n LEU 208 Cb 0.41 -1.07 -0.09 0.00 -1.62 0.00 0.00 43.42 41.06 1xfw n LEU 208 CO 0.18 1.01 -0.02 -0.76 -1.22 0.00 0.00 177.39 176.58 1xfw s LEU 209 N 0.00 5.66 0.00 2.23 1.02 -1.26 -4.76 118.68 121.56 1xfw s LEU 209 Ca 0.10 -1.99 0.07 0.00 0.02 0.00 0.00 54.13 52.33 1xfw s LEU 209 Cb 0.05 -1.99 0.11 0.00 0.02 0.00 0.00 46.19 44.38 1xfw s LEU 209 CO 0.00 -0.66 0.99 2.22 0.02 0.00 0.00 176.35 178.92 1xfw n PHE 210 N 4.79 0.00 0.01 0.29 1.16 -1.26 -4.44 117.46 118.01 1xfw n PHE 210 Ca -0.06 -0.15 0.12 0.00 -1.87 0.00 0.00 57.45 55.49 1xfw n PHE 210 Cb 0.41 -0.02 0.56 0.00 -1.61 0.00 0.00 39.48 38.82 1xfw n PHE 210 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 1xfw h SER 211 N 0.26 0.23 -0.21 5.98 0.87 -1.86 -1.62 113.55 117.21 1xfw h SER 211 Ca -0.09 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.45 1xfw h SER 211 Cb 1.48 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 63.38 1xfw h SER 211 CO 0.01 0.15 0.03 0.00 -0.53 0.00 0.00 176.83 176.49 1xfw n GLN 212 N -4.47 2.11 0.00 2.24 10.64 -1.26 -4.06 117.38 122.59 1xfw n GLN 212 Ca 0.06 -1.00 0.00 0.00 -1.83 0.00 0.00 57.00 54.23 1xfw n GLN 212 Cb 0.32 -1.69 0.00 0.00 -0.86 0.00 0.00 30.24 28.02 1xfw n GLN 212 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59 1xfw n LYS 213 N 0.16 0.23 -3.76 2.61 2.85 -1.05 -4.99 118.16 114.22 1xfw n LYS 213 Ca 0.11 0.00 -0.30 0.00 -1.05 0.00 0.00 58.31 57.07 1xfw n LYS 213 Cb 0.61 -0.02 -0.14 0.00 -0.65 0.00 0.00 35.03 34.82 1xfw n LYS 213 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 1xfw s PHE 214 N 0.00 2.06 0.00 5.58 2.99 -0.64 -4.73 117.98 123.24 1xfw s PHE 214 Ca 0.00 -2.13 0.00 0.00 0.00 0.00 0.00 56.93 54.80 1xfw s PHE 214 Cb 0.00 -1.93 0.00 0.00 0.00 0.00 0.00 43.02 41.09 1xfw s PHE 214 CO 0.00 -0.86 0.00 1.17 -0.00 0.00 0.00 175.22 175.53 1xfw n LYS 215 N 4.33 0.00 0.33 0.44 3.00 -1.26 -4.16 118.16 120.85 1xfw n LYS 215 Ca 0.02 0.00 0.22 0.00 -0.00 0.00 0.00 58.31 58.56 1xfw n LYS 215 Cb 0.39 0.00 1.18 0.00 0.00 0.00 0.00 35.03 36.60 1xfw n LYS 215 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.40 178.45 1xfw h GLU 216 N 0.00 0.00 0.00 1.64 4.11 -1.98 0.23 114.58 118.58 1xfw h GLU 216 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1xfw h GLU 216 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1xfw h GLU 216 CO 0.00 0.00 -0.77 1.63 0.07 0.00 0.00 179.01 179.94 1xfw n LYS 217 N -3.12 2.67 -2.74 1.06 4.76 -1.26 -4.74 118.16 114.79 1xfw n LYS 217 Ca -0.03 -0.03 -0.03 0.00 -2.87 0.00 0.00 58.31 55.36 1xfw n LYS 217 Cb 0.09 -1.06 0.08 0.00 -1.84 0.00 0.00 35.03 32.29 1xfw n LYS 217 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1xfw n LEU 218 N -1.42 0.08 -0.50 -0.35 7.94 -1.01 -4.74 117.00 117.00 1xfw n LEU 218 Ca 0.01 -3.24 0.08 0.00 -1.11 0.00 0.00 56.01 51.75 1xfw n LEU 218 Cb 0.19 0.28 0.28 0.00 0.53 0.00 0.00 43.42 44.71 1xfw n LEU 218 CO 0.22 1.45 0.71 -1.84 -1.11 0.00 0.00 177.39 176.81 1xfw n GLU 219 N -0.85 1.65 -1.63 1.96 0.28 0.77 -4.47 120.64 118.34 1xfw n GLU 219 Ca -0.03 -0.99 -0.42 0.00 -0.16 0.00 0.00 57.16 55.57 1xfw n GLU 219 Cb 0.84 -1.31 -0.03 0.00 1.43 0.00 0.00 31.44 32.37 1xfw n GLU 219 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 1xfw n LEU 220 N 0.25 5.36 0.02 -1.84 7.94 -1.26 -4.64 117.00 122.82 1xfw n LEU 220 Ca 0.13 -3.59 0.10 0.00 -1.11 0.00 0.00 56.01 51.54 1xfw n LEU 220 Cb 0.27 -1.48 0.42 0.00 0.53 0.00 0.00 43.42 43.17 1xfw n LEU 220 CO 0.10 0.24 0.82 0.59 -1.11 0.00 0.00 177.39 178.03 1xfw n ASN 221 N 7.48 0.10 -3.82 1.96 3.02 -1.26 -3.89 115.26 118.84 1xfw n ASN 221 Ca 0.50 0.52 -0.38 0.00 -0.03 0.00 0.00 54.58 55.19 1xfw n ASN 221 Cb 0.41 -0.54 -0.02 0.00 -0.61 0.00 0.00 39.78 39.02 1xfw n ASN 221 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1xfw n ASN 222 N -1.61 5.69 -3.65 6.41 3.02 -1.26 -4.95 115.26 118.92 1xfw n ASN 222 Ca 0.04 -3.43 -0.03 0.00 -0.03 0.00 0.00 54.58 51.13 1xfw n ASN 222 Cb 0.24 -1.09 -0.07 0.00 -0.61 0.00 0.00 39.78 38.25 1xfw n ASN 222 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1xfw s LYS 223 N -2.75 0.22 -0.82 3.52 2.36 -1.25 -5.10 119.74 115.92 1xfw s LYS 223 Ca 0.34 0.30 -0.21 0.00 -2.55 0.00 0.00 55.97 53.84 1xfw s LYS 223 Cb 0.08 0.08 0.09 0.00 -1.05 0.00 0.00 37.83 37.04 1xfw s LYS 223 CO 0.07 -0.03 1.11 -1.12 1.55 0.00 0.00 175.35 176.92 1xfw s SER 224 N 0.51 6.39 -1.20 1.43 0.01 -1.26 -4.96 113.70 114.62 1xfw s SER 224 Ca 0.00 -1.44 -0.17 0.00 1.31 0.00 0.00 55.95 55.65 1xfw s SER 224 Cb -0.04 -2.44 -0.03 0.00 0.21 0.00 0.00 66.02 63.72 1xfw s SER 224 CO -0.12 -1.32 2.11 -0.38 0.41 0.00 0.00 173.24 173.94 1xfw n ILE 225 N 5.90 2.84 0.00 1.44 5.41 -1.26 -4.70 119.36 128.98 1xfw n ILE 225 Ca 0.12 -2.48 0.00 0.00 1.00 0.00 0.00 62.75 61.39 1xfw n ILE 225 Cb 0.48 -2.50 0.00 0.00 -0.71 0.00 0.00 39.64 36.91 1xfw n ILE 225 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1xfw n ASP 226 N 6.68 0.00 -0.13 4.38 4.64 -1.26 -4.38 116.55 126.48 1xfw n ASP 226 Ca 0.51 0.00 0.14 0.00 -1.38 0.00 0.00 54.79 54.06 1xfw n ASP 226 Cb 0.40 0.00 0.77 0.00 -1.04 0.00 0.00 41.12 41.25 1xfw n ASP 226 CO 0.00 0.00 0.00 -0.38 -0.82 0.00 0.00 177.20 176.00 1xfw n ILE 227 N 0.00 0.01 -0.06 5.18 5.41 -1.26 -3.31 119.36 125.33 1xfw n ILE 227 Ca 0.00 -0.07 -0.15 0.00 1.00 0.00 0.00 62.75 63.53 1xfw n ILE 227 Cb 0.00 -0.22 -0.06 0.00 -0.71 0.00 0.00 39.64 38.65 1xfw n ILE 227 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 1xfw h ASN 228 N 0.59 0.78 0.00 4.38 4.21 -1.91 -3.41 115.58 120.23 1xfw h ASN 228 Ca 0.00 -0.55 0.00 0.00 1.21 0.00 0.00 56.30 56.96 1xfw h ASN 228 Cb 0.13 -0.23 0.00 0.00 -1.12 0.00 0.00 38.32 37.10 1xfw h ASN 228 CO 0.00 1.19 0.00 0.33 -1.29 0.00 0.00 177.43 177.66 1xfw n PHE 229 N -4.17 0.00 0.59 1.19 7.35 -1.24 -4.79 117.46 116.39 1xfw n PHE 229 Ca -0.06 -0.06 0.13 0.00 -0.76 0.00 0.00 57.45 56.71 1xfw n PHE 229 Cb 0.57 -0.01 0.39 0.00 0.35 0.00 0.00 39.48 40.78 1xfw n PHE 229 CO 0.00 0.00 0.00 0.97 -0.76 0.00 0.00 176.76 176.97 1xfw h ILE 230 N 0.87 0.00 0.41 -2.13 2.10 -1.78 -3.34 117.51 113.65 1xfw h ILE 230 Ca 0.00 -0.52 -0.02 0.00 1.08 0.00 0.00 64.86 65.40 1xfw h ILE 230 Cb 0.42 1.51 0.00 0.00 -1.09 0.00 0.00 36.82 37.67 1xfw h ILE 230 CO 0.00 0.00 -0.20 0.11 -1.08 0.00 0.00 178.15 176.98 1xfw h LYS 231 N 0.00 -0.53 -0.33 2.19 1.57 -1.86 -3.33 116.57 114.28 1xfw h LYS 231 Ca 0.00 0.04 0.07 0.00 -1.87 0.00 0.00 60.65 58.88 1xfw h LYS 231 Cb 0.76 0.12 -0.06 0.00 0.08 0.00 0.00 32.23 33.12 1xfw h LYS 231 CO 0.00 -0.36 -0.07 -1.91 -0.57 0.00 0.00 179.45 176.54 1xfw n GLU 232 N -5.02 -0.03 -3.68 3.15 4.07 -1.25 -2.38 120.64 115.49 1xfw n GLU 232 Ca -0.07 0.51 -0.27 0.00 -0.06 0.00 0.00 57.16 57.27 1xfw n GLU 232 Cb 0.22 -0.77 -0.10 0.00 -0.06 0.00 0.00 31.44 30.73 1xfw n GLU 232 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1xfw n ASN 233 N -4.51 2.75 0.02 4.31 3.02 -1.25 -4.88 115.26 114.72 1xfw n ASN 233 Ca 0.05 -3.17 0.00 0.00 -0.03 0.00 0.00 54.58 51.43 1xfw n ASN 233 Cb 0.17 -0.71 0.31 0.00 -0.61 0.00 0.00 39.78 38.94 1xfw n ASN 233 CO 0.00 0.00 0.00 0.17 -2.62 0.00 0.00 177.26 174.81 1xfw h LEU 234 N 5.00 0.44 -0.31 3.41 -0.00 -1.61 -3.12 115.31 119.12 1xfw h LEU 234 Ca 0.17 -0.09 0.02 0.00 -0.00 0.00 0.00 57.88 57.99 1xfw h LEU 234 Cb 0.75 -0.12 -0.03 0.00 -0.00 0.00 0.00 40.66 41.27 1xfw h LEU 234 CO 0.71 0.53 0.15 0.71 -0.00 0.00 0.00 178.44 180.54 1xfw h THR 235 N 0.45 0.99 0.00 0.15 1.35 -1.89 -2.56 112.91 111.40 1xfw h THR 235 Ca 0.10 -0.11 -0.00 0.00 -0.55 0.00 0.00 66.41 65.84 1xfw h THR 235 Cb 0.35 0.64 -0.00 0.00 -1.73 0.00 0.00 68.15 67.40 1xfw h THR 235 CO 0.01 0.06 -0.02 -0.08 -0.25 0.00 0.00 175.52 175.24 1xfw h GLU 236 N 0.32 0.00 -0.63 4.72 4.81 -1.96 -0.13 114.58 121.70 1xfw h GLU 236 Ca 0.13 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1xfw h GLU 236 Cb 0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1xfw h GLU 236 CO -0.09 0.02 0.00 1.19 -0.73 0.00 0.00 179.01 179.40 1xfw n PHE 237 N -3.18 1.18 -0.06 0.92 3.72 -0.97 -3.36 117.46 115.71 1xfw n PHE 237 Ca -0.01 -0.45 -0.09 0.00 -0.05 0.00 0.00 57.45 56.84 1xfw n PHE 237 Cb 0.20 -0.24 -0.05 0.00 -0.94 0.00 0.00 39.48 38.45 1xfw n PHE 237 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1xfw n GLN 238 N 0.69 0.28 0.10 -1.08 6.02 -0.11 -3.81 117.38 119.46 1xfw n GLN 238 Ca 0.19 0.08 0.06 0.00 -0.01 0.00 0.00 57.00 57.32 1xfw n GLN 238 Cb 0.74 -1.16 0.31 0.00 1.02 0.00 0.00 30.24 31.15 1xfw n GLN 238 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1xfw n HIS 239 N -3.01 0.39 0.00 1.08 8.25 -0.89 -0.98 115.22 120.06 1xfw n HIS 239 Ca -0.21 0.20 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1xfw n HIS 239 Cb 0.71 -0.77 0.00 0.00 1.12 0.00 0.00 29.99 31.05 1xfw n HIS 239 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1xfw n ALA 240 N -1.60 0.00 -0.59 -1.41 0.00 -1.23 -3.27 120.51 112.41 1xfw n ALA 240 Ca -0.01 -0.11 0.47 0.00 0.00 0.00 0.00 53.44 53.79 1xfw n ALA 240 Cb 0.10 0.00 0.75 0.00 0.00 0.00 0.00 19.45 20.30 1xfw n ALA 240 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1xfw h PHE 241 N 0.00 0.24 -0.05 0.00 3.57 -1.59 1.05 116.94 120.16 1xfw h PHE 241 Ca 0.00 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 1xfw h PHE 241 Cb 0.00 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 38.68 1xfw h PHE 241 CO 0.00 -0.13 -0.07 0.77 -2.23 0.00 0.00 178.31 176.65 1xfw h SER 242 N 0.01 0.14 1.15 0.41 0.02 -1.25 -1.30 113.55 112.74 1xfw h SER 242 Ca 0.90 -0.53 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 1xfw h SER 242 Cb 3.28 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 65.78 1xfw h SER 242 CO -0.23 0.65 0.00 -0.07 -1.14 0.00 0.00 176.83 176.05 1xfw h LEU 243 N -0.36 0.00 0.00 5.07 3.38 0.94 0.10 115.31 124.44 1xfw h LEU 243 Ca 0.00 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 1xfw h LEU 243 Cb 0.62 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1xfw h LEU 243 CO 0.02 0.00 -0.84 0.00 0.09 0.00 0.00 178.44 177.71 1xfw h ALA 244 N 2.06 0.58 0.00 1.53 0.00 -0.29 -1.65 119.26 121.49 1xfw h ALA 244 Ca 0.00 -0.70 -0.01 0.00 0.00 0.00 0.00 54.91 54.21 1xfw h ALA 244 Cb 0.58 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1xfw h ALA 244 CO 0.00 0.90 -0.06 0.35 0.00 0.00 0.00 179.25 180.44 1xfw h PHE 245 N 0.00 0.00 -0.81 0.00 3.04 -0.61 -1.98 116.94 116.58 1xfw h PHE 245 Ca -0.04 0.00 0.12 0.00 3.98 0.00 0.00 57.97 62.03 1xfw h PHE 245 Cb 1.56 0.00 -0.06 0.00 2.56 0.00 0.00 35.95 40.01 1xfw h PHE 245 CO 0.00 0.65 0.53 0.66 -2.02 0.00 0.00 178.31 178.13 1xfw h SER 246 N -1.00 0.59 0.45 0.41 4.64 -0.92 0.17 113.55 117.89 1xfw h SER 246 Ca -0.01 0.03 -0.21 0.00 -0.47 0.00 0.00 61.79 61.12 1xfw h SER 246 Cb 0.65 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1xfw h SER 246 CO -0.01 0.33 -0.89 1.88 -0.87 0.00 0.00 176.83 177.26 1xfw h TYR 247 N 0.64 0.45 -0.24 4.77 -1.99 -1.37 -0.43 116.97 118.80 1xfw h TYR 247 Ca 0.39 -0.24 -0.17 0.00 2.00 0.00 0.00 58.73 60.70 1xfw h TYR 247 Cb 0.62 -0.05 0.00 0.00 2.00 0.00 0.00 36.73 39.30 1xfw h TYR 247 CO -0.00 1.05 -0.52 -0.92 -0.00 0.00 0.00 178.16 177.77 1xfw h TYR 248 N 0.17 0.98 -0.01 4.88 -0.00 0.02 -3.31 116.97 119.71 1xfw h TYR 248 Ca -0.06 -0.37 0.00 0.00 -0.00 0.00 0.00 58.73 58.30 1xfw h TYR 248 Cb 1.52 -0.18 0.00 0.00 -0.00 0.00 0.00 36.73 38.07 1xfw h TYR 248 CO 0.04 1.17 -0.50 1.19 -0.00 0.00 0.00 178.16 180.07 1xfw n PHE 249 N -4.09 0.00 -1.68 -3.82 3.01 0.18 -4.80 117.46 106.25 1xfw n PHE 249 Ca -0.05 0.00 -0.45 0.00 1.01 0.00 0.00 57.45 57.96 1xfw n PHE 249 Cb 0.61 -0.06 -0.04 0.00 -0.01 0.00 0.00 39.48 39.99 1xfw n PHE 249 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1xfw n ALA 250 N -0.55 1.70 0.20 4.37 0.00 -0.17 -4.80 120.51 121.25 1xfw n ALA 250 Ca 0.09 0.40 0.10 0.00 0.00 0.00 0.00 53.44 54.03 1xfw n ALA 250 Cb 0.40 -2.44 0.54 0.00 0.00 0.00 0.00 19.45 17.96 1xfw n ALA 250 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1xfw h PRO 251 N 6.87 0.00 0.00 0.00 0.13 -1.91 -3.33 132.00 133.76 1xfw h PRO 251 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1xfw h PRO 251 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1xfw h PRO 251 CO 0.92 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.29 1xfw n ASP 252 N -2.31 0.00 -4.52 1.44 5.75 -1.26 -4.92 116.55 110.73 1xfw n ASP 252 Ca -0.01 0.00 -0.42 0.00 -0.01 0.00 0.00 54.79 54.35 1xfw n ASP 252 Cb 0.25 -0.28 -0.03 0.00 -1.03 0.00 0.00 41.12 40.04 1xfw n ASP 252 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 1xfw s HIS 253 N -0.97 2.74 -0.25 2.11 -3.43 -1.25 -4.74 115.29 109.50 1xfw s HIS 253 Ca 0.00 -1.05 0.01 0.00 -0.80 0.00 0.00 55.06 53.21 1xfw s HIS 253 Cb 0.00 -4.56 -0.17 0.00 -1.43 0.00 0.00 32.58 26.42 1xfw s HIS 253 CO 0.00 -1.79 -0.21 2.89 -2.00 0.00 0.00 174.74 173.64 1xfw n ARG 254 N 8.09 0.65 0.22 -0.38 0.00 -1.26 -4.46 116.66 119.52 1xfw n ARG 254 Ca 0.31 0.16 0.12 0.00 -0.00 0.00 0.00 57.85 58.44 1xfw n ARG 254 Cb 0.50 -1.53 0.25 0.00 -0.00 0.00 0.00 32.46 31.68 1xfw n ARG 254 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.63 179.42 1xfw h THR 255 N -0.05 0.10 -0.92 8.89 1.35 -1.89 -3.24 112.91 117.14 1xfw h THR 255 Ca -0.58 -1.05 0.19 0.00 -0.55 0.00 0.00 66.41 64.43 1xfw h THR 255 Cb 1.89 1.96 -0.11 0.00 -1.73 0.00 0.00 68.15 70.16 1xfw h THR 255 CO -0.10 0.05 0.49 0.58 -0.25 0.00 0.00 175.52 176.29 1xfw h VAL 256 N 0.00 0.61 -0.00 6.82 2.07 -1.93 1.36 116.25 125.19 1xfw h VAL 256 Ca -0.00 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.32 1xfw h VAL 256 Cb 0.95 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1xfw h VAL 256 CO 0.01 0.11 -0.00 -0.11 0.02 0.00 0.00 177.57 177.59 1xfw n LEU 257 N -4.91 0.15 -0.09 2.57 7.94 -1.22 -1.30 117.00 120.14 1xfw n LEU 257 Ca 0.22 -0.00 -0.11 0.00 -1.11 0.00 0.00 56.01 55.00 1xfw n LEU 257 Cb 0.58 -0.05 -0.11 0.00 0.53 0.00 0.00 43.42 44.38 1xfw n LEU 257 CO 0.18 0.02 -1.10 1.21 -1.11 0.00 0.00 177.39 176.59 1xfw n GLU 258 N -0.94 0.94 -0.02 1.96 2.13 0.41 -3.70 120.64 121.42 1xfw n GLU 258 Ca 0.22 0.06 -0.09 0.00 0.66 0.00 0.00 57.16 58.01 1xfw n GLU 258 Cb 0.16 -1.42 -0.07 0.00 0.27 0.00 0.00 31.44 30.38 1xfw n GLU 258 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1xfw h LEU 259 N 0.00 -0.07 0.00 4.31 5.85 0.29 -3.41 115.31 122.28 1xfw h LEU 259 Ca -0.45 -0.47 -0.03 0.00 0.84 0.00 0.00 57.88 57.76 1xfw h LEU 259 Cb 1.86 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.91 1xfw h LEU 259 CO -0.02 0.63 -0.20 1.88 -0.34 0.00 0.00 178.44 180.38 1xfw h TYR 260 N -0.95 0.00 -3.58 1.25 -1.99 -1.38 -3.42 116.97 106.90 1xfw h TYR 260 Ca -0.01 0.00 -0.62 0.00 2.00 0.00 0.00 58.73 60.11 1xfw h TYR 260 Cb 0.53 0.00 -0.14 0.00 2.00 0.00 0.00 36.73 39.12 1xfw h TYR 260 CO 0.13 0.90 -0.43 0.00 -0.00 0.00 0.00 178.16 178.75 1xfw s ALA 261 N -2.31 3.60 -0.15 3.88 0.00 -1.24 -4.59 121.76 120.94 1xfw s ALA 261 Ca -0.18 -0.82 0.18 0.00 0.00 0.00 0.00 51.96 51.15 1xfw s ALA 261 Cb -0.01 -2.41 -0.10 0.00 0.00 0.00 0.00 23.12 20.61 1xfw s ALA 261 CO 0.56 -0.24 0.89 -0.35 0.00 0.00 0.00 175.76 176.62 1xfw n PRO 262 N 4.38 0.62 -0.12 0.00 -0.04 -1.26 -3.68 135.00 134.90 1xfw n PRO 262 Ca -0.13 0.20 -0.23 0.00 -0.04 0.00 0.00 63.50 63.29 1xfw n PRO 262 Cb 0.52 -1.82 -0.08 0.00 -0.04 0.00 0.00 33.50 32.08 1xfw n PRO 262 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1xfw n ASP 263 N -2.83 1.95 -0.41 3.54 -0.08 -1.26 -3.95 116.55 113.51 1xfw n ASP 263 Ca -0.07 0.35 0.34 0.00 -1.51 0.00 0.00 54.79 53.90 1xfw n ASP 263 Cb 0.76 -0.81 0.61 0.00 2.34 0.00 0.00 41.12 44.02 1xfw n ASP 263 CO 0.00 0.00 0.00 0.24 0.12 0.00 0.00 177.20 177.56 1xfw h MET 264 N -1.00 0.11 0.70 -0.67 2.86 -1.89 1.10 114.93 116.15 1xfw h MET 264 Ca -0.47 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.13 1xfw h MET 264 Cb 1.40 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 33.04 1xfw h MET 264 CO -0.29 0.08 -0.40 0.35 1.06 0.00 0.00 176.91 177.71 1xfw h PHE 265 N 0.12 -1.06 -0.74 -0.22 3.57 -1.75 0.18 116.94 117.04 1xfw h PHE 265 Ca 0.80 -0.01 0.16 0.00 3.53 0.00 0.00 57.97 62.45 1xfw h PHE 265 Cb 2.36 0.37 -0.11 0.00 2.79 0.00 0.00 35.95 41.36 1xfw h PHE 265 CO -0.01 -0.61 0.21 1.49 -2.23 0.00 0.00 178.31 177.16 1xfw h GLU 266 N -1.02 0.30 -0.16 1.11 4.57 0.75 0.17 114.58 120.30 1xfw h GLU 266 Ca -0.09 -0.02 0.03 0.00 -1.18 0.00 0.00 59.36 58.09 1xfw h GLU 266 Cb 0.81 -0.07 -0.05 0.00 -0.16 0.00 0.00 28.75 29.28 1xfw h GLU 266 CO 0.12 0.20 -0.40 -0.92 -1.18 0.00 0.00 179.01 176.82 1xfw h TYR 267 N 0.31 -1.20 -0.04 0.92 3.20 0.86 0.44 116.97 121.45 1xfw h TYR 267 Ca 0.42 0.05 0.03 0.00 3.14 0.00 0.00 58.73 62.37 1xfw h TYR 267 Cb 0.70 0.55 -0.04 0.00 1.54 0.00 0.00 36.73 39.47 1xfw h TYR 267 CO -0.24 -0.38 -0.17 0.52 -1.64 0.00 0.00 178.16 176.25 1xfw h MET 268 N -0.38 -0.25 -0.41 1.82 2.86 0.28 -1.54 114.93 117.32 1xfw h MET 268 Ca 0.03 0.02 0.09 0.00 -2.06 0.00 0.00 59.70 57.78 1xfw h MET 268 Cb 0.47 0.06 -0.09 0.00 0.06 0.00 0.00 31.60 32.10 1xfw h MET 268 CO -0.36 -0.17 -0.19 -0.97 1.06 0.00 0.00 176.91 176.29 1xfw h ASN 269 N -0.26 -0.65 -0.66 1.22 -0.73 0.02 0.57 115.58 115.09 1xfw h ASN 269 Ca 0.07 0.15 0.12 0.00 1.87 0.00 0.00 56.30 58.51 1xfw h ASN 269 Cb 0.35 0.36 -0.09 0.00 0.27 0.00 0.00 38.32 39.21 1xfw h ASN 269 CO -0.19 -0.22 0.22 0.50 -0.37 0.00 0.00 177.43 177.36 1xfw h LYS 270 N -0.11 0.36 -0.83 6.67 1.63 0.18 1.03 116.57 125.50 1xfw h LYS 270 Ca 0.20 -0.02 0.07 0.00 -0.85 0.00 0.00 60.65 60.05 1xfw h LYS 270 Cb 0.42 -0.08 -0.06 0.00 -0.60 0.00 0.00 32.23 31.91 1xfw h LYS 270 CO -0.48 0.24 0.50 -0.07 -3.45 0.00 0.00 179.45 176.19 1xfw h LEU 271 N 0.37 0.78 -0.52 5.20 3.38 0.98 0.11 115.31 125.61 1xfw h LEU 271 Ca 0.35 0.02 -0.16 0.00 0.09 0.00 0.00 57.88 58.18 1xfw h LEU 271 Cb 0.50 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1xfw h LEU 271 CO -0.38 0.49 -0.53 -0.08 0.09 0.00 0.00 178.44 178.03 1xfw h GLU 272 N 0.90 0.58 -0.64 1.13 4.81 0.25 0.33 114.58 121.94 1xfw h GLU 272 Ca 0.37 -0.36 0.13 0.00 -0.13 0.00 0.00 59.36 59.37 1xfw h GLU 272 Cb 0.21 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.59 1xfw h GLU 272 CO -0.19 0.96 0.43 0.87 -0.73 0.00 0.00 179.01 180.36 1xfw h LYS 273 N 0.45 0.31 0.00 1.92 1.57 0.33 -3.42 116.57 117.72 1xfw h LYS 273 Ca 0.01 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1xfw h LYS 273 Cb 1.08 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.32 1xfw h LYS 273 CO 0.10 0.20 0.00 0.41 -0.57 0.00 0.00 179.45 179.60 1xfw n GLY 274 N -1.55 0.00 0.17 3.86 0.00 -0.01 -5.04 105.19 102.63 1xfw n GLY 274 Ca 0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.01 1xfw n GLY 274 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1xfw h GLY 275 N 0.00 0.56 1.12 -0.02 0.00 -0.06 -2.41 103.07 102.26 1xfw h GLY 275 Ca 0.00 -0.55 0.04 0.00 0.00 0.00 0.00 47.33 46.83 1xfw h GLY 275 CO 0.00 0.49 0.48 0.74 0.00 0.00 0.00 176.54 178.25 1xfw h PHE 276 N 0.21 0.83 0.00 5.60 0.05 -1.33 0.42 116.94 122.72 1xfw h PHE 276 Ca 0.04 0.02 -0.04 0.00 3.82 0.00 0.00 57.97 61.81 1xfw h PHE 276 Cb 0.71 -0.28 -0.01 0.00 2.00 0.00 0.00 35.95 38.38 1xfw h PHE 276 CO 0.07 0.47 -0.20 1.49 -0.18 0.00 0.00 178.31 179.96 1xfw h GLU 277 N 0.85 0.00 0.00 1.51 4.81 -1.77 -0.02 114.58 119.95 1xfw h GLU 277 Ca 0.30 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.53 1xfw h GLU 277 Cb 0.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1xfw h GLU 277 CO -0.09 0.20 0.00 1.63 -0.73 0.00 0.00 179.01 180.02 1xfw n LYS 278 N -3.42 0.00 -0.03 1.92 5.02 0.14 -1.33 118.16 120.46 1xfw n LYS 278 Ca -0.00 0.44 0.05 0.00 -2.02 0.00 0.00 58.31 56.77 1xfw n LYS 278 Cb 0.39 -1.31 0.42 0.00 -0.02 0.00 0.00 35.03 34.51 1xfw n LYS 278 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1xfw h ILE 279 N 0.00 1.08 0.00 -0.18 1.08 -1.54 0.15 117.51 118.10 1xfw h ILE 279 Ca 0.00 -0.19 0.00 0.00 -0.39 0.00 0.00 64.86 64.28 1xfw h ILE 279 Cb 0.00 0.46 0.00 0.00 -3.07 0.00 0.00 36.82 34.21 1xfw h ILE 279 CO 0.00 0.10 0.00 -1.28 -0.69 0.00 0.00 178.15 176.28 1xfw h SER 280 N 0.56 0.00 -0.00 1.72 0.87 -0.86 0.66 113.55 116.50 1xfw h SER 280 Ca 0.18 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 1xfw h SER 280 Cb 0.02 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.98 1xfw h SER 280 CO -0.04 0.00 -0.63 -0.62 -0.53 0.00 0.00 176.83 175.01 1xfw n GLU 281 N -3.04 1.95 0.06 2.24 -0.58 0.44 -3.32 120.64 118.39 1xfw n GLU 281 Ca -0.02 -0.17 0.11 0.00 -0.42 0.00 0.00 57.16 56.65 1xfw n GLU 281 Cb 0.10 -1.22 -0.05 0.00 -0.57 0.00 0.00 31.44 29.70 1xfw n GLU 281 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1xfw n SER 282 N -1.09 0.58 0.00 1.62 3.41 -0.21 -2.45 113.62 115.48 1xfw n SER 282 Ca 0.04 0.19 -0.01 0.00 -0.26 0.00 0.00 58.87 58.82 1xfw n SER 282 Cb 0.26 0.93 -0.11 0.00 -0.26 0.00 0.00 64.21 65.03 1xfw n SER 282 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1xfw n LEU 283 N -2.49 0.61 -0.04 1.04 4.32 0.05 -3.18 117.00 117.32 1xfw n LEU 283 Ca -0.01 0.27 -0.14 0.00 -0.02 0.00 0.00 56.01 56.11 1xfw n LEU 283 Cb 0.55 0.14 -0.09 0.00 -1.62 0.00 0.00 43.42 42.40 1xfw n LEU 283 CO 0.42 0.20 0.54 0.50 -1.22 0.00 0.00 177.39 177.82 1xfw h LYS 284 N 0.00 0.26 -0.68 3.23 1.63 -1.64 -2.39 116.57 116.98 1xfw h LYS 284 Ca -0.22 -0.17 -0.04 0.00 -0.85 0.00 0.00 60.65 59.37 1xfw h LYS 284 Cb 1.65 0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 33.27 1xfw h LYS 284 CO 0.04 0.77 0.26 1.57 -3.45 0.00 0.00 179.45 178.64 1xfw h LYS 285 N -0.21 1.03 -0.82 1.90 2.10 -1.63 0.34 116.57 119.29 1xfw h LYS 285 Ca 0.00 -0.19 0.00 0.00 -2.00 0.00 0.00 60.65 58.46 1xfw h LYS 285 Cb 0.76 -0.16 0.00 0.00 -0.90 0.00 0.00 32.23 31.93 1xfw h LYS 285 CO 0.04 0.86 0.00 -1.91 -2.00 0.00 0.00 179.45 176.44 1xfw n GLU 286 N -4.37 1.08 0.07 0.07 2.13 -1.19 -2.77 120.64 115.66 1xfw n GLU 286 Ca 0.05 -0.07 -0.23 0.00 0.66 0.00 0.00 57.16 57.58 1xfw n GLU 286 Cb 0.18 -1.43 -0.15 0.00 0.27 0.00 0.00 31.44 30.32 1xfw n GLU 286 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1xfw h GLY 287 N 5.16 0.43 0.00 8.31 0.00 0.24 -3.18 103.07 114.02 1xfw h GLY 287 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 47.33 46.22 1xfw h GLY 287 CO 0.01 0.97 -0.23 -0.39 0.00 0.00 0.00 176.54 176.90 1xfw h VAL 288 N -0.07 0.00 -0.18 4.60 -1.51 -1.58 -3.29 116.25 114.22 1xfw h VAL 288 Ca -0.28 -0.66 0.05 0.00 -1.23 0.00 0.00 66.70 64.59 1xfw h VAL 288 Cb 1.96 0.00 -0.01 0.00 -2.13 0.00 0.00 31.29 31.11 1xfw h VAL 288 CO 0.17 0.00 0.78 -0.33 -1.23 0.00 0.00 177.57 176.96 1xfw h GLU 289 N -0.66 0.00 0.00 5.19 5.08 -1.75 -2.36 114.58 120.09 1xfw h GLU 289 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1xfw h GLU 289 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1xfw h GLU 289 CO 0.00 0.00 0.00 1.17 -1.00 0.00 0.00 179.01 179.18 1xfw n LYS 290 N -2.83 0.00 -2.80 2.33 4.81 -1.20 -4.67 118.16 113.80 1xfw n LYS 290 Ca 0.03 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.05 1xfw n LYS 290 Cb 0.86 -0.34 -0.04 0.00 0.02 0.00 0.00 35.03 35.53 1xfw n LYS 290 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1xfw s ASP 291 N -1.44 6.73 0.00 3.14 3.68 -0.89 -4.94 116.67 122.96 1xfw s ASP 291 Ca 0.00 0.71 0.00 0.00 2.13 0.00 0.00 52.55 55.39 1xfw s ASP 291 Cb 0.00 -2.47 0.00 0.00 -1.45 0.00 0.00 42.92 39.00 1xfw s ASP 291 CO 0.00 -0.80 0.00 0.54 0.13 0.00 0.00 175.17 175.04 1xfw n ARG 292 N 6.65 0.00 -3.19 4.34 5.12 -1.24 -4.61 116.66 123.73 1xfw n ARG 292 Ca 0.07 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.57 1xfw n ARG 292 Cb 0.48 0.00 -0.07 0.00 -1.16 0.00 0.00 32.46 31.70 1xfw n ARG 292 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1xfw s ILE 293 N -2.90 4.94 -0.57 0.55 1.01 -1.26 -4.99 121.20 117.98 1xfw s ILE 293 Ca 0.00 0.17 -0.26 0.00 0.00 0.00 0.00 60.65 60.56 1xfw s ILE 293 Cb 0.00 -4.08 -0.07 0.00 0.01 0.00 0.00 42.46 38.32 1xfw s ILE 293 CO 0.00 -0.41 2.29 -0.62 0.00 0.00 0.00 174.94 176.20 1xfw s ASP 294 N 1.86 4.54 -0.08 3.58 3.68 -1.26 -4.90 116.67 124.09 1xfw s ASP 294 Ca 0.20 0.72 0.02 0.00 2.13 0.00 0.00 52.55 55.61 1xfw s ASP 294 Cb -0.15 -2.52 0.01 0.00 -1.45 0.00 0.00 42.92 38.82 1xfw s ASP 294 CO 0.16 -2.93 -0.12 0.68 0.13 0.00 0.00 175.17 173.09 1xfw s VAL 295 N 11.92 1.16 -0.29 1.11 -7.23 -1.26 -4.70 120.40 121.10 1xfw s VAL 295 Ca 0.90 -0.47 -0.29 0.00 -1.81 0.00 0.00 61.98 60.31 1xfw s VAL 295 Cb -0.15 -1.07 -0.02 0.00 0.56 0.00 0.00 36.38 35.70 1xfw s VAL 295 CO 0.21 0.37 1.61 -1.48 -0.31 0.00 0.00 175.10 175.49 1xfw s LEU 296 N 0.84 3.73 0.00 1.32 2.34 -1.23 -4.82 118.68 120.86 1xfw s LEU 296 Ca -0.11 1.36 0.00 0.00 0.06 0.00 0.00 54.13 55.44 1xfw s LEU 296 Cb -0.15 -3.53 0.00 0.00 -0.56 0.00 0.00 46.19 41.95 1xfw s LEU 296 CO 0.02 -1.40 0.00 0.29 -1.06 0.00 0.00 176.35 174.20 1xfw n LYS 297 N 7.92 2.77 0.00 1.48 5.02 -1.26 -2.95 118.16 131.14 1xfw n LYS 297 Ca 0.19 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 1xfw n LYS 297 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.47 1xfw n LYS 297 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xfw n GLY 298 N 5.00 0.99 0.08 0.72 0.00 -0.91 -3.31 105.19 107.76 1xfw n GLY 298 Ca 0.00 -0.60 0.14 0.00 0.00 0.00 0.00 46.02 45.56 1xfw n GLY 298 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1xfw n GLU 299 N 0.01 0.42 0.24 1.61 2.13 -1.26 -3.62 120.64 120.18 1xfw n GLU 299 Ca 0.00 -0.16 0.09 0.00 0.66 0.00 0.00 57.16 57.75 1xfw n GLU 299 Cb 0.00 -1.50 0.62 0.00 0.27 0.00 0.00 31.44 30.83 1xfw n GLU 299 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1xfw h LYS 300 N 0.40 0.00 0.20 5.31 1.57 -1.86 -2.79 116.57 119.40 1xfw h LYS 300 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1xfw h LYS 300 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1xfw h LYS 300 CO 0.00 0.16 -0.10 0.00 -0.57 0.00 0.00 179.45 178.94 1xfw h ALA 301 N 1.84 -0.27 0.00 3.86 0.00 -1.64 -3.06 119.26 119.99 1xfw h ALA 301 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1xfw h ALA 301 Cb 0.34 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1xfw h ALA 301 CO 0.02 -0.27 0.81 1.25 0.00 0.00 0.00 179.25 181.06 1xfw h LEU 302 N -1.04 0.00 -0.01 0.00 5.85 -1.65 1.16 115.31 119.62 1xfw h LEU 302 Ca -0.03 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 1xfw h LEU 302 Cb 0.32 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.35 1xfw h LEU 302 CO 0.05 0.00 -0.13 0.11 -0.34 0.00 0.00 178.44 178.13 1xfw h LYS 303 N 0.00 0.10 -0.00 1.25 1.79 -1.39 -3.21 116.57 115.11 1xfw h LYS 303 Ca 0.00 -0.10 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 1xfw h LYS 303 Cb 1.62 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 32.29 1xfw h LYS 303 CO 0.00 0.83 -0.33 0.00 -1.08 0.00 0.00 179.45 178.87 1xfw n ALA 304 N -2.50 3.16 -0.06 3.86 0.00 0.36 -3.90 120.51 121.43 1xfw n ALA 304 Ca -0.09 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.05 1xfw n ALA 304 Cb 0.43 -1.22 0.29 0.00 0.00 0.00 0.00 19.45 18.95 1xfw n ALA 304 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1xfw h SER 305 N 0.18 0.60 0.00 0.00 0.87 -0.43 -3.43 113.55 111.33 1xfw h SER 305 Ca 0.00 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 1xfw h SER 305 Cb 0.49 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.29 1xfw h SER 305 CO 0.00 0.58 0.00 0.61 -0.53 0.00 0.00 176.83 177.49 1xfw n GLY 306 N -1.05 2.01 3.75 5.77 0.00 -1.24 -3.73 105.19 110.71 1xfw n GLY 306 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1xfw n GLY 306 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xfw s LEU 307 N 0.00 3.81 -0.45 0.99 1.02 -1.26 -4.35 118.68 118.43 1xfw s LEU 307 Ca 0.00 2.59 -0.28 0.00 0.02 0.00 0.00 54.13 56.46 1xfw s LEU 307 Cb 0.00 -4.38 -0.01 0.00 0.02 0.00 0.00 46.19 41.82 1xfw s LEU 307 CO 0.00 -1.51 1.70 -0.69 0.02 0.00 0.00 176.35 175.87 1xfw s VAL 308 N -1.42 3.56 0.05 -1.59 1.01 -1.26 -4.84 120.40 115.91 1xfw s VAL 308 Ca 0.73 0.51 -0.08 0.00 0.00 0.00 0.00 61.98 63.13 1xfw s VAL 308 Cb -0.36 -3.92 -0.00 0.00 0.00 0.00 0.00 36.38 32.09 1xfw s VAL 308 CO 0.41 -0.71 0.44 -2.65 0.00 0.00 0.00 175.10 172.60 1xfw n PRO 309 N 8.60 -0.12 0.11 2.72 -0.02 -1.26 0.26 135.00 145.30 1xfw n PRO 309 Ca 0.20 0.43 0.18 0.00 -2.02 0.00 0.00 63.50 62.29 1xfw n PRO 309 Cb 0.49 -0.64 0.75 0.00 -0.02 0.00 0.00 33.50 34.08 1xfw n PRO 309 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1xfw h GLU 310 N 0.00 0.00 0.05 -0.52 5.08 -1.98 0.23 114.58 117.43 1xfw h GLU 310 Ca 0.06 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1xfw h GLU 310 Cb 0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1xfw h GLU 310 CO -0.27 0.00 -0.02 0.45 -1.00 0.00 0.00 179.01 178.17 1xfw h HIS 311 N 0.00 -0.06 -0.38 4.33 3.86 0.32 0.87 115.15 124.10 1xfw h HIS 311 Ca 0.17 -0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.45 1xfw h HIS 311 Cb 0.78 0.02 -0.09 0.00 1.06 0.00 0.00 27.41 29.18 1xfw h HIS 311 CO 0.00 0.49 -0.32 0.00 0.86 0.00 0.00 177.93 178.96 1xfw h ALA 312 N -0.36 -0.18 -0.87 2.45 0.00 -0.41 0.94 119.26 120.83 1xfw h ALA 312 Ca -0.01 0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1xfw h ALA 312 Cb 0.57 0.69 -0.05 0.00 0.00 0.00 0.00 17.79 19.00 1xfw h ALA 312 CO 0.01 -0.72 0.57 -0.44 0.00 0.00 0.00 179.25 178.67 1xfw h ASP 313 N -0.26 0.93 -0.93 0.00 3.32 -0.68 0.39 116.42 119.19 1xfw h ASP 313 Ca 0.17 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1xfw h ASP 313 Cb 0.53 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.83 1xfw h ASP 313 CO -0.52 0.63 0.54 0.00 -1.72 0.00 0.00 179.24 178.17 1xfw h ALA 314 N 1.50 1.19 -0.37 3.45 0.00 0.28 -2.15 119.26 123.15 1xfw h ALA 314 Ca 0.35 -0.12 -0.15 0.00 0.00 0.00 0.00 54.91 54.99 1xfw h ALA 314 Cb 0.05 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1xfw h ALA 314 CO -0.11 0.67 -0.38 0.74 0.00 0.00 0.00 179.25 180.17 1xfw h PHE 315 N 1.29 1.06 -1.66 0.00 0.05 0.15 -3.17 116.94 114.66 1xfw h PHE 315 Ca 0.33 -0.31 0.52 0.00 3.82 0.00 0.00 57.97 62.33 1xfw h PHE 315 Cb -0.02 -0.23 -0.11 0.00 2.00 0.00 0.00 35.95 37.59 1xfw h PHE 315 CO 0.01 1.12 1.14 1.17 -0.18 0.00 0.00 178.31 181.57 1xfw n LYS 316 N -4.05 -0.02 0.08 1.51 4.81 0.04 0.63 118.16 121.14 1xfw n LYS 316 Ca -0.02 1.18 -0.11 0.00 -0.87 0.00 0.00 58.31 58.49 1xfw n LYS 316 Cb 0.54 -2.49 -0.13 0.00 0.02 0.00 0.00 35.03 32.97 1xfw n LYS 316 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 1xfw h LYS 317 N 0.00 0.12 -0.18 1.64 3.64 -1.60 -3.34 116.57 116.84 1xfw h LYS 317 Ca 0.91 -0.20 -0.15 0.00 -1.27 0.00 0.00 60.65 59.94 1xfw h LYS 317 Cb 3.28 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 35.18 1xfw h LYS 317 CO -0.26 1.08 -0.47 0.82 -2.27 0.00 0.00 179.45 178.35 1xfw h ILE 318 N 0.03 1.32 -1.00 2.00 5.03 0.03 -3.00 117.51 121.92 1xfw h ILE 318 Ca -0.08 -1.71 0.21 0.00 -0.12 0.00 0.00 64.86 63.16 1xfw h ILE 318 Cb 1.87 1.92 -0.11 0.00 -3.03 0.00 0.00 36.82 37.46 1xfw h ILE 318 CO 0.16 0.53 0.61 0.00 -0.68 0.00 0.00 178.15 178.77 1xfw h ALA 319 N 0.58 1.75 -2.01 1.87 0.00 -1.62 -2.67 119.26 117.15 1xfw h ALA 319 Ca -0.01 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1xfw h ALA 319 Cb 1.09 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1xfw h ALA 319 CO 0.10 -0.15 0.00 0.54 0.00 0.00 0.00 179.25 179.74 1xfw n ARG 320 N -4.79 0.00 -0.09 0.00 1.74 -1.18 0.11 116.66 112.45 1xfw n ARG 320 Ca 0.24 0.16 -0.02 0.00 -0.77 0.00 0.00 57.85 57.47 1xfw n ARG 320 Cb 0.64 -0.95 -0.02 0.00 -1.02 0.00 0.00 32.46 31.11 1xfw n ARG 320 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1xfw n GLU 321 N -0.99 -0.09 0.14 5.56 2.13 -1.14 0.68 120.64 126.93 1xfw n GLU 321 Ca 0.00 0.55 -0.01 0.00 0.66 0.00 0.00 57.16 58.36 1xfw n GLU 321 Cb 0.00 -0.82 0.17 0.00 0.27 0.00 0.00 31.44 31.06 1xfw n GLU 321 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1xfw h LEU 322 N 0.00 0.00 -2.59 4.31 3.38 -1.63 -3.49 115.31 115.29 1xfw h LEU 322 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1xfw h LEU 322 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1xfw h LEU 322 CO -0.19 0.61 -0.17 -3.20 0.09 0.00 0.00 178.44 175.58 1xfw n ASN 323 N -3.77 -5.53 -3.64 -0.43 4.05 0.29 -4.65 115.26 101.58 1xfw n ASN 323 Ca -0.01 0.17 -0.07 0.00 0.45 0.00 0.00 54.58 55.11 1xfw n ASN 323 Cb 0.62 -3.62 -0.07 0.00 1.23 0.00 0.00 39.78 37.94 1xfw n ASN 323 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 1xfw s THR 324 N -2.41 -0.03 0.33 -0.44 -4.23 -0.54 -1.32 115.64 106.99 1xfw s THR 324 Ca 0.08 0.01 -0.29 0.00 -1.18 0.00 0.00 61.69 60.31 1xfw s THR 324 Cb -0.02 -0.97 -0.11 0.00 1.34 0.00 0.00 72.50 72.74 1xfw s THR 324 CO 0.46 0.00 1.42 -0.31 -0.54 0.00 0.00 174.62 175.65 1xfw s TYR 325 N 1.66 2.84 -0.18 3.99 1.51 0.21 -4.52 117.35 122.86 1xfw s TYR 325 Ca -0.10 1.19 -0.02 0.00 -1.01 0.00 0.00 57.07 57.13 1xfw s TYR 325 Cb -0.06 -3.87 -0.01 0.00 -0.11 0.00 0.00 41.96 37.92 1xfw s TYR 325 CO -0.19 -2.59 -0.08 0.42 -1.11 0.00 0.00 175.55 172.00 1xfw s ILE 326 N -0.82 3.22 -0.15 2.71 1.01 -1.21 -1.17 121.20 124.80 1xfw s ILE 326 Ca 0.54 -0.57 0.02 0.00 0.00 0.00 0.00 60.65 60.63 1xfw s ILE 326 Cb -0.43 -2.42 0.01 0.00 0.01 0.00 0.00 42.46 39.63 1xfw s ILE 326 CO 0.54 0.47 -0.20 -0.76 0.00 0.00 0.00 174.94 175.00 1xfw s LEU 327 N 0.96 2.18 0.26 2.97 1.02 -0.59 -1.53 118.68 123.95 1xfw s LEU 327 Ca -0.01 -0.59 0.09 0.00 0.02 0.00 0.00 54.13 53.64 1xfw s LEU 327 Cb -0.15 -1.47 -0.04 0.00 0.02 0.00 0.00 46.19 44.55 1xfw s LEU 327 CO -0.00 0.07 0.03 -0.36 0.02 0.00 0.00 176.35 176.10 1xfw s PHE 328 N 0.91 2.78 0.42 0.29 0.40 -0.15 0.27 117.98 122.89 1xfw s PHE 328 Ca -0.04 -0.20 0.03 0.00 -0.60 0.00 0.00 56.93 56.12 1xfw s PHE 328 Cb -0.15 -1.24 0.00 0.00 0.51 0.00 0.00 43.02 42.14 1xfw s PHE 328 CO -0.04 0.60 0.60 1.03 0.70 0.00 0.00 175.22 178.11 1xfw s ARG 329 N -3.65 2.99 -0.09 0.44 0.52 -0.39 -2.92 118.95 115.86 1xfw s ARG 329 Ca 0.31 -0.78 -0.30 0.00 -0.52 0.00 0.00 55.73 54.44 1xfw s ARG 329 Cb -0.07 -2.66 -0.08 0.00 0.52 0.00 0.00 34.95 32.66 1xfw s ARG 329 CO 0.21 -0.21 2.06 -2.30 0.02 0.00 0.00 175.30 175.08 1xfw n PRO 330 N -1.94 2.38 -3.29 3.54 -0.02 -1.26 -4.73 135.00 129.68 1xfw n PRO 330 Ca 0.02 0.80 -0.40 0.00 -2.02 0.00 0.00 63.50 61.91 1xfw n PRO 330 Cb 0.58 -3.02 -0.08 0.00 -0.02 0.00 0.00 33.50 30.96 1xfw n PRO 330 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1xfw s VAL 331 N 5.93 5.10 0.19 -1.45 1.01 -1.24 -5.00 120.40 124.93 1xfw s VAL 331 Ca 0.95 0.73 -0.30 0.00 0.00 0.00 0.00 61.98 63.35 1xfw s VAL 331 Cb -0.45 -3.79 -0.16 0.00 0.00 0.00 0.00 36.38 31.97 1xfw s VAL 331 CO 0.41 0.09 0.80 -3.20 0.00 0.00 0.00 175.10 173.20 1xfw n ASN 332 N 5.48 -0.10 0.08 3.32 2.85 -1.26 -4.27 115.26 121.36 1xfw n ASN 332 Ca -0.06 1.15 -0.05 0.00 -0.11 0.00 0.00 54.58 55.51 1xfw n ASN 332 Cb 0.50 -1.07 0.13 0.00 1.24 0.00 0.00 39.78 40.58 1xfw n ASN 332 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 1xfw h LYS 333 N 1.83 0.27 -1.05 1.20 6.56 -1.95 -2.94 116.57 120.49 1xfw h LYS 333 Ca -0.36 -0.17 0.00 0.00 -1.06 0.00 0.00 60.65 59.06 1xfw h LYS 333 Cb 1.40 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 33.08 1xfw h LYS 333 CO 0.61 0.76 0.00 1.28 -2.06 0.00 0.00 179.45 180.04 1xfw n LEU 334 N -3.91 1.12 0.00 2.94 4.32 -1.26 -0.65 117.00 119.56 1xfw n LEU 334 Ca -0.02 -0.56 0.00 0.00 -0.02 0.00 0.00 56.01 55.41 1xfw n LEU 334 Cb 0.59 -0.27 0.00 0.00 -1.62 0.00 0.00 43.42 42.12 1xfw n LEU 334 CO 0.44 0.21 0.00 0.00 -1.22 0.00 0.00 177.39 176.82 1xfw n ALA 335 N 0.51 0.13 -0.43 -1.18 0.00 -1.12 -4.10 120.51 114.32 1xfw n ALA 335 Ca 0.00 0.00 0.36 0.00 0.00 0.00 0.00 53.44 53.80 1xfw n ALA 335 Cb 0.21 0.00 0.66 0.00 0.00 0.00 0.00 19.45 20.32 1xfw n ALA 335 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1xfw h THR 336 N 0.00 0.25 0.00 0.00 2.02 -0.83 -0.70 112.91 113.64 1xfw h THR 336 Ca 0.00 -0.04 -0.34 0.00 0.77 0.00 0.00 66.41 66.79 1xfw h THR 336 Cb 0.00 0.11 -0.06 0.00 -1.74 0.00 0.00 68.15 66.46 1xfw h THR 336 CO 0.00 0.02 -2.29 0.59 0.37 0.00 0.00 175.52 174.21 1xfw n ASN 337 N -4.47 1.24 0.27 4.18 3.02 -1.26 -3.81 115.26 114.42 1xfw n ASN 337 Ca 0.33 -0.06 0.17 0.00 -0.03 0.00 0.00 54.58 55.00 1xfw n ASN 337 Cb 1.36 0.36 0.84 0.00 -0.61 0.00 0.00 39.78 41.73 1xfw n ASN 337 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1xfw h LEU 338 N 0.00 0.00 0.00 3.41 3.38 -1.48 0.74 115.31 121.36 1xfw h LEU 338 Ca -0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.46 1xfw h LEU 338 Cb 1.99 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.74 1xfw h LEU 338 CO -0.02 0.00 0.00 -0.38 0.09 0.00 0.00 178.44 178.13 1xfw n ILE 339 N -3.20 0.00 -0.31 1.22 5.41 -0.47 -0.18 119.36 121.83 1xfw n ILE 339 Ca 0.00 0.46 0.17 0.00 1.00 0.00 0.00 62.75 64.38 1xfw n ILE 339 Cb 0.40 -1.39 0.32 0.00 -0.71 0.00 0.00 39.64 38.26 1xfw n ILE 339 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 1xfw n LYS 340 N -1.96 -0.07 -0.10 0.38 4.81 -0.86 0.21 118.16 120.59 1xfw n LYS 340 Ca 0.00 1.35 -0.13 0.00 -0.87 0.00 0.00 58.31 58.66 1xfw n LYS 340 Cb 0.00 -2.19 -0.09 0.00 0.02 0.00 0.00 35.03 32.77 1xfw n LYS 340 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1xfw h SER 341 N 0.00 -1.65 0.00 3.14 0.87 0.34 -3.46 113.55 112.78 1xfw h SER 341 Ca 0.59 0.21 0.00 0.00 -1.23 0.00 0.00 61.79 61.37 1xfw h SER 341 Cb 1.31 0.67 0.00 0.00 -0.44 0.00 0.00 62.40 63.94 1xfw h SER 341 CO -0.83 -0.38 0.00 0.61 -0.53 0.00 0.00 176.83 175.70 1xfw n GLY 342 N -1.35 -0.56 3.78 5.77 0.00 0.57 -4.87 105.19 108.53 1xfw n GLY 342 Ca -0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 1xfw n GLY 342 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xfw s VAL 343 N 0.00 3.65 0.99 1.61 1.01 0.75 -3.90 120.40 124.51 1xfw s VAL 343 Ca 0.00 1.29 -0.13 0.00 0.00 0.00 0.00 61.98 63.14 1xfw s VAL 343 Cb 0.00 -3.68 0.18 0.00 0.00 0.00 0.00 36.38 32.89 1xfw s VAL 343 CO 0.00 0.03 1.12 0.00 0.00 0.00 0.00 175.10 176.25 1xfw s ALA 344 N -1.61 1.22 -0.06 5.51 0.00 -0.47 -4.64 121.76 121.72 1xfw s ALA 344 Ca 0.57 -0.53 0.05 0.00 0.00 0.00 0.00 51.96 52.06 1xfw s ALA 344 Cb -0.23 -3.05 -0.02 0.00 0.00 0.00 0.00 23.12 19.82 1xfw s ALA 344 CO 0.29 -2.73 -0.21 0.95 0.00 0.00 0.00 175.76 174.06 1xfw s THR 345 N -3.12 2.44 0.04 0.00 -4.23 -1.26 -1.44 115.64 108.08 1xfw s THR 345 Ca 0.66 -0.94 -0.33 0.00 -1.18 0.00 0.00 61.69 59.90 1xfw s THR 345 Cb -0.16 -1.92 -0.12 0.00 1.34 0.00 0.00 72.50 71.64 1xfw s THR 345 CO 0.56 0.57 1.77 1.17 -0.54 0.00 0.00 174.62 178.15 1xfw n LYS 346 N 2.72 2.31 0.00 3.99 4.81 0.53 -4.86 118.16 127.67 1xfw n LYS 346 Ca -0.17 0.84 0.00 0.00 -0.87 0.00 0.00 58.31 58.11 1xfw n LYS 346 Cb 0.52 -2.67 0.00 0.00 0.02 0.00 0.00 35.03 32.89 1xfw n LYS 346 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1xfw n GLY 347 N 4.03 1.73 0.10 3.14 0.00 -1.26 -4.43 105.19 108.50 1xfw n GLY 347 Ca 0.20 -1.79 -0.14 0.00 0.00 0.00 0.00 46.02 44.29 1xfw n GLY 347 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1xfw h LEU 348 N 0.00 0.25 -2.18 0.99 3.38 -1.89 -3.32 115.31 112.54 1xfw h LEU 348 Ca 0.00 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1xfw h LEU 348 Cb 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1xfw h LEU 348 CO 0.00 1.31 0.06 -0.55 0.09 0.00 0.00 178.44 179.35 1xfw h ASN 349 N 0.04 0.00 -3.72 -0.43 -0.00 -1.95 -3.41 115.58 106.11 1xfw h ASN 349 Ca -0.23 0.00 -0.68 0.00 -0.00 0.00 0.00 56.30 55.39 1xfw h ASN 349 Cb 1.98 0.00 -0.24 0.00 -0.00 0.00 0.00 38.32 40.06 1xfw h ASN 349 CO 0.13 0.00 -0.76 -0.69 -0.00 0.00 0.00 177.43 176.12 1xfw s VAL 350 N -3.87 3.14 -0.09 6.14 1.01 -1.25 -4.71 120.40 120.76 1xfw s VAL 350 Ca -0.04 -0.67 0.17 0.00 0.00 0.00 0.00 61.98 61.45 1xfw s VAL 350 Cb 0.09 -2.27 0.38 0.00 0.00 0.00 0.00 36.38 34.58 1xfw s VAL 350 CO 0.30 0.57 1.17 1.41 0.00 0.00 0.00 175.10 178.55 1xfw n HIS 351 N 2.77 0.00 -1.57 5.22 8.25 -1.26 -4.76 115.22 123.88 1xfw n HIS 351 Ca -0.18 -0.90 -0.29 0.00 -0.26 0.00 0.00 57.72 56.09 1xfw n HIS 351 Cb 0.52 -0.18 0.16 0.00 1.12 0.00 0.00 29.99 31.61 1xfw n HIS 351 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1xfw s GLY 352 N -2.48 1.62 0.06 -1.41 0.00 -1.26 -4.91 107.32 98.94 1xfw s GLY 352 Ca 0.33 -0.76 0.02 0.00 0.00 0.00 0.00 44.72 44.30 1xfw s GLY 352 CO -0.10 -0.10 0.10 0.54 0.00 0.00 0.00 173.10 173.54 1xfw s LYS 353 N -5.46 3.02 0.00 2.90 -0.14 -1.26 -5.10 119.74 113.71 1xfw s LYS 353 Ca 0.67 -0.60 0.00 0.00 -1.36 0.00 0.00 55.97 54.68 1xfw s LYS 353 Cb -0.11 -2.81 0.00 0.00 -1.68 0.00 0.00 37.83 33.23 1xfw s LYS 353 CO 0.53 0.59 0.00 0.45 -0.76 0.00 0.00 175.35 176.17 1xfw n SER 354 N 0.58 0.00 -4.12 2.83 2.88 -1.26 -4.26 113.62 110.27 1xfw n SER 354 Ca -0.09 -0.75 -0.13 0.00 -1.33 0.00 0.00 58.87 56.58 1xfw n SER 354 Cb 0.52 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.87 1xfw n SER 354 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1xfw s SER 355 N -1.00 1.07 -0.21 -3.46 0.15 -1.20 -2.14 113.70 106.91 1xfw s SER 355 Ca 0.00 -0.73 0.16 0.00 0.70 0.00 0.00 55.95 56.08 1xfw s SER 355 Cb 0.00 0.04 0.46 0.00 -1.71 0.00 0.00 66.02 64.81 1xfw s SER 355 CO 0.00 -0.28 1.17 -0.90 1.20 0.00 0.00 173.24 174.43 1xfw n ASP 356 N 0.88 2.56 0.00 5.45 3.85 -1.26 -2.23 116.55 125.80 1xfw n ASP 356 Ca -0.19 -3.02 0.00 0.00 -0.71 0.00 0.00 54.79 50.87 1xfw n ASP 356 Cb 0.57 -0.41 0.00 0.00 -1.35 0.00 0.00 41.12 39.92 1xfw n ASP 356 CO 0.00 0.00 0.00 -2.67 -1.01 0.00 0.00 177.20 173.52 1xfw n TRP 357 N -0.55 0.00 -4.05 2.11 4.27 -1.26 -5.04 117.44 112.92 1xfw n TRP 357 Ca 0.21 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.82 1xfw n TRP 357 Cb 0.89 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.84 1xfw n TRP 357 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1xfw n GLY 358 N -0.01 -1.91 0.11 -1.67 0.00 -1.25 -2.79 105.19 97.67 1xfw n GLY 358 Ca 0.00 -1.38 -0.16 0.00 0.00 0.00 0.00 46.02 44.48 1xfw n GLY 358 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xfw h PRO 359 N 0.00 0.23 0.00 1.61 0.13 -1.98 -3.30 132.00 128.69 1xfw h PRO 359 Ca 0.00 -0.39 -0.01 0.00 -0.87 0.00 0.00 66.00 64.73 1xfw h PRO 359 Cb 0.00 0.15 -0.00 0.00 0.13 0.00 0.00 31.00 31.27 1xfw h PRO 359 CO 0.00 1.10 -0.04 -0.24 -0.23 0.00 0.00 178.00 178.60 1xfw h VAL 360 N 0.06 0.88 -0.84 1.56 3.04 -1.92 -3.45 116.25 115.58 1xfw h VAL 360 Ca -0.20 -0.13 -0.70 0.00 -1.01 0.00 0.00 66.70 64.65 1xfw h VAL 360 Cb 1.99 1.07 0.03 0.00 -2.01 0.00 0.00 31.29 32.37 1xfw h VAL 360 CO 0.17 0.04 0.31 0.00 -1.01 0.00 0.00 177.57 177.07 1xfw n ALA 361 N -2.46 -2.18 0.00 3.17 0.00 -1.12 -0.40 120.51 117.51 1xfw n ALA 361 Ca -0.03 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1xfw n ALA 361 Cb 0.12 -1.54 0.00 0.00 0.00 0.00 0.00 19.45 18.03 1xfw n ALA 361 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xfw n GLY 362 N 2.27 1.23 3.62 0.00 0.00 -0.94 -4.93 105.19 106.44 1xfw n GLY 362 Ca 0.21 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.99 1xfw n GLY 362 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xfw s TYR 363 N -2.29 2.53 -0.92 1.61 1.51 0.46 -4.45 117.35 115.80 1xfw s TYR 363 Ca 0.00 -0.44 -0.14 0.00 -1.01 0.00 0.00 57.07 55.49 1xfw s TYR 363 Cb 0.00 -1.46 0.22 0.00 -0.11 0.00 0.00 41.96 40.61 1xfw s TYR 363 CO 0.00 0.50 0.92 0.42 -1.11 0.00 0.00 175.55 176.28 1xfw s ILE 364 N -2.52 5.57 0.60 2.71 -1.09 -1.07 -3.27 121.20 122.13 1xfw s ILE 364 Ca 0.34 -2.58 -0.18 0.00 -2.23 0.00 0.00 60.65 56.00 1xfw s ILE 364 Cb -0.00 -4.56 -0.07 0.00 -1.58 0.00 0.00 42.46 36.25 1xfw s ILE 364 CO 0.19 -1.15 0.64 -0.81 -1.23 0.00 0.00 174.94 172.58 1xfw n PRO 365 N 4.08 0.57 0.04 2.79 -0.04 -1.26 -1.29 135.00 139.89 1xfw n PRO 365 Ca 0.18 0.23 -0.08 0.00 -0.04 0.00 0.00 63.50 63.79 1xfw n PRO 365 Cb 0.45 -1.84 -0.13 0.00 -0.04 0.00 0.00 33.50 31.94 1xfw n PRO 365 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 1xfw h PHE 366 N 0.20 0.05 -3.12 0.54 3.57 -0.97 -3.40 116.94 113.81 1xfw h PHE 366 Ca -0.46 -0.03 -0.59 0.00 3.53 0.00 0.00 57.97 60.41 1xfw h PHE 366 Cb 1.38 -0.00 -0.11 0.00 2.79 0.00 0.00 35.95 40.01 1xfw h PHE 366 CO 0.33 1.03 0.70 0.34 -2.23 0.00 0.00 178.31 178.48 1xfw s ASP 367 N -6.60 6.35 0.24 0.41 2.15 -1.26 -4.84 116.67 113.12 1xfw s ASP 367 Ca -0.01 -0.28 -0.07 0.00 0.43 0.00 0.00 52.55 52.63 1xfw s ASP 367 Cb 0.09 -2.47 0.25 0.00 -0.30 0.00 0.00 42.92 40.49 1xfw s ASP 367 CO 0.83 -1.34 1.92 1.56 -0.17 0.00 0.00 175.17 177.96 1xfw h GLN 368 N 9.43 1.24 0.00 4.34 1.08 -1.91 -2.03 115.11 127.26 1xfw h GLN 368 Ca -0.26 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 56.86 1xfw h GLN 368 Cb 1.07 -0.28 0.00 0.00 -0.05 0.00 0.00 27.48 28.22 1xfw h GLN 368 CO 1.13 0.82 0.00 -3.47 -0.95 0.00 0.00 178.83 176.36 1xfw n ASP 369 N -4.43 0.00 -1.45 1.46 2.03 -1.26 -0.50 116.55 112.40 1xfw n ASP 369 Ca 0.11 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.31 1xfw n ASP 369 Cb 0.02 0.00 0.16 0.00 -0.72 0.00 0.00 41.12 40.59 1xfw n ASP 369 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1xfw n LEU 370 N -0.87 4.72 -4.44 -2.67 4.77 -0.76 -4.70 117.00 113.04 1xfw n LEU 370 Ca 0.00 -3.96 -0.24 0.00 -0.03 0.00 0.00 56.01 51.78 1xfw n LEU 370 Cb 0.00 -0.64 -0.08 0.00 -2.33 0.00 0.00 43.42 40.37 1xfw n LEU 370 CO 0.00 1.40 -0.15 -0.94 -1.33 0.00 0.00 177.39 176.37 1xfw s SER 371 N -2.56 2.50 0.40 -1.43 1.04 0.35 -4.69 113.70 109.31 1xfw s SER 371 Ca 0.48 -1.76 0.22 0.00 0.48 0.00 0.00 55.95 55.37 1xfw s SER 371 Cb 0.42 0.61 1.24 0.00 0.10 0.00 0.00 66.02 68.39 1xfw s SER 371 CO 0.01 -1.03 1.67 0.07 0.98 0.00 0.00 173.24 174.94 1xfw h LYS 372 N 1.86 0.23 -2.20 4.02 2.10 -1.71 -2.17 116.57 118.69 1xfw h LYS 372 Ca -0.30 -0.01 -0.51 0.00 -2.00 0.00 0.00 60.65 57.83 1xfw h LYS 372 Cb 1.26 -0.05 -0.13 0.00 -0.90 0.00 0.00 32.23 32.41 1xfw h LYS 372 CO 0.46 0.15 0.93 1.63 -2.00 0.00 0.00 179.45 180.62 1xfw n LYS 373 N -4.79 2.90 -2.60 0.07 4.76 -1.26 -4.88 118.16 112.36 1xfw n LYS 373 Ca 0.32 -2.33 -0.42 0.00 -2.87 0.00 0.00 58.31 53.02 1xfw n LYS 373 Cb 1.15 -2.27 -0.03 0.00 -1.84 0.00 0.00 35.03 32.05 1xfw n LYS 373 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1xfw s HIS 374 N -0.82 2.63 0.00 2.13 5.65 -0.82 -3.82 115.29 120.25 1xfw s HIS 374 Ca 0.60 -1.01 0.00 0.00 0.25 0.00 0.00 55.06 54.90 1xfw s HIS 374 Cb 0.31 -4.66 0.00 0.00 -1.18 0.00 0.00 32.58 27.05 1xfw s HIS 374 CO -0.14 -1.87 0.00 0.41 -0.65 0.00 0.00 174.74 172.48 1xfw n GLY 375 N 6.53 4.16 3.54 1.59 0.00 -1.26 -5.05 105.19 114.70 1xfw n GLY 375 Ca 0.34 -0.70 -0.19 0.00 0.00 0.00 0.00 46.02 45.47 1xfw n GLY 375 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1xfw n GLN 376 N 0.00 0.49 0.00 1.61 3.00 -1.25 -4.66 117.38 116.56 1xfw n GLN 376 Ca 0.00 -0.52 0.00 0.00 -0.01 0.00 0.00 57.00 56.47 1xfw n GLN 376 Cb 0.00 -3.01 0.00 0.00 0.00 0.00 0.00 30.24 27.23 1xfw n GLN 376 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.06 178.00 1xfw n GLN 377 N 8.15 0.00 0.00 -1.09 7.27 -1.26 -1.48 117.38 128.97 1xfw n GLN 377 Ca 0.51 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.58 1xfw n GLN 377 Cb 0.37 -0.97 0.00 0.00 2.41 0.00 0.00 30.24 32.05 1xfw n GLN 377 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1xfw n LEU 378 N -0.16 0.15 0.21 1.69 4.32 -1.26 -3.92 117.00 118.03 1xfw n LEU 378 Ca 0.00 0.00 0.04 0.00 -0.02 0.00 0.00 56.01 56.03 1xfw n LEU 378 Cb 0.00 0.00 0.46 0.00 -1.62 0.00 0.00 43.42 42.26 1xfw n LEU 378 CO 0.00 0.02 0.85 0.00 -1.22 0.00 0.00 177.39 177.05 1xfw h ALA 379 N 0.00 1.61 0.06 -1.18 0.00 -1.60 0.65 119.26 118.79 1xfw h ALA 379 Ca 0.00 -0.21 -0.27 0.00 0.00 0.00 0.00 54.91 54.43 1xfw h ALA 379 Cb 0.24 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1xfw h ALA 379 CO 0.00 0.30 -1.45 0.28 0.00 0.00 0.00 179.25 178.37 1xfw h VAL 380 N 0.01 0.89 0.00 0.00 2.07 -1.70 0.13 116.25 117.64 1xfw h VAL 380 Ca -0.00 -2.27 0.00 0.00 0.82 0.00 0.00 66.70 65.24 1xfw h VAL 380 Cb 0.41 2.44 0.00 0.00 -1.52 0.00 0.00 31.29 32.62 1xfw h VAL 380 CO 0.03 0.56 0.00 -0.08 0.02 0.00 0.00 177.57 178.10 1xfw h GLU 381 N -0.56 0.00 0.00 1.57 4.57 -1.61 0.76 114.58 119.31 1xfw h GLU 381 Ca -0.35 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.83 1xfw h GLU 381 Cb 1.59 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.18 1xfw h GLU 381 CO -0.07 0.00 0.00 1.17 -1.18 0.00 0.00 179.01 178.93 1xfw n LYS 382 N -2.50 1.12 -0.11 1.92 4.81 0.22 -4.28 118.16 119.34 1xfw n LYS 382 Ca -0.00 -1.01 -0.23 0.00 -0.87 0.00 0.00 58.31 56.19 1xfw n LYS 382 Cb 0.15 -0.98 -0.10 0.00 0.02 0.00 0.00 35.03 34.12 1xfw n LYS 382 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1xfw n GLY 383 N -0.26 -0.71 0.12 3.14 0.00 0.13 -3.92 105.19 103.68 1xfw n GLY 383 Ca 0.00 0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 1xfw n GLY 383 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1xfw h ASN 384 N -1.00 0.26 0.00 1.61 2.35 0.04 -0.41 115.58 118.43 1xfw h ASN 384 Ca -0.45 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.25 1xfw h ASN 384 Cb 1.36 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.67 1xfw h ASN 384 CO -0.27 0.24 0.82 0.25 -1.65 0.00 0.00 177.43 176.82 1xfw h LEU 385 N 0.26 0.00 0.00 1.61 7.12 -1.73 0.95 115.31 123.51 1xfw h LEU 385 Ca 0.08 0.00 -0.08 0.00 0.13 0.00 0.00 57.88 58.00 1xfw h LEU 385 Cb 0.03 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.15 1xfw h LEU 385 CO -0.01 0.00 -0.56 -0.08 -0.13 0.00 0.00 178.44 177.66 1xfw h GLU 386 N 0.00 0.00 -0.15 1.25 4.57 -1.18 -3.32 114.58 115.75 1xfw h GLU 386 Ca 0.00 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.21 1xfw h GLU 386 Cb 1.65 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 30.21 1xfw h GLU 386 CO 0.00 0.62 -0.01 -0.91 -1.18 0.00 0.00 179.01 177.53 1xfw h ASN 387 N -1.00 -0.08 -0.75 1.04 -0.26 -0.82 -0.90 115.58 112.82 1xfw h ASN 387 Ca -0.13 0.04 0.11 0.00 -0.56 0.00 0.00 56.30 55.76 1xfw h ASN 387 Cb 0.84 0.07 -0.13 0.00 -1.06 0.00 0.00 38.32 38.04 1xfw h ASN 387 CO -0.08 -0.02 -0.42 0.11 -1.06 0.00 0.00 177.43 175.97 1xfw h LYS 388 N 0.03 -0.12 -0.36 0.81 1.57 -1.60 0.36 116.57 117.28 1xfw h LYS 388 Ca 0.07 0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.82 1xfw h LYS 388 Cb 0.09 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1xfw h LYS 388 CO -0.13 -0.08 0.05 -0.22 -0.57 0.00 0.00 179.45 178.50 1xfw h LYS 389 N -0.13 0.53 -0.97 3.15 3.64 -1.55 0.50 116.57 121.74 1xfw h LYS 389 Ca 0.24 -0.10 0.22 0.00 -1.27 0.00 0.00 60.65 59.74 1xfw h LYS 389 Cb 0.56 -0.09 -0.08 0.00 -0.41 0.00 0.00 32.23 32.21 1xfw h LYS 389 CO -0.80 0.52 0.63 0.77 -2.27 0.00 0.00 179.45 178.30 1xfw h SER 390 N 0.52 0.49 0.00 4.20 0.02 0.11 -0.13 113.55 118.76 1xfw h SER 390 Ca 0.12 0.06 -0.18 0.00 -0.84 0.00 0.00 61.79 60.95 1xfw h SER 390 Cb 0.26 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 1xfw h SER 390 CO 0.00 0.16 -1.30 -0.38 -1.14 0.00 0.00 176.83 174.18 1xfw n ILE 391 N -4.59 1.50 -0.38 3.27 5.41 -0.85 -3.44 119.36 120.27 1xfw n ILE 391 Ca 0.22 -0.01 0.30 0.00 1.00 0.00 0.00 62.75 64.26 1xfw n ILE 391 Cb 0.74 -2.15 0.49 0.00 -0.71 0.00 0.00 39.64 38.01 1xfw n ILE 391 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1xfw n THR 392 N -4.45 -0.11 0.00 1.39 -1.04 0.17 -2.41 114.28 107.84 1xfw n THR 392 Ca -0.27 1.14 0.00 0.00 -2.04 0.00 0.00 64.05 62.87 1xfw n THR 392 Cb 0.59 -1.87 0.00 0.00 -1.82 0.00 0.00 70.33 67.22 1xfw n THR 392 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1xfw n GLU 393 N -3.76 0.00 -1.36 -2.82 1.02 -0.10 -4.70 120.64 108.93 1xfw n GLU 393 Ca 0.28 0.02 -0.39 0.00 -0.02 0.00 0.00 57.16 57.05 1xfw n GLU 393 Cb 1.17 -0.21 -0.02 0.00 -0.02 0.00 0.00 31.44 32.36 1xfw n GLU 393 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1xfw n HIS 394 N -1.66 2.57 -2.76 -0.32 8.25 -1.12 -4.94 115.22 115.25 1xfw n HIS 394 Ca 0.00 -2.53 -0.40 0.00 -0.26 0.00 0.00 57.72 54.53 1xfw n HIS 394 Cb 0.00 -2.19 -0.06 0.00 1.12 0.00 0.00 29.99 28.87 1xfw n HIS 394 CO 0.00 0.00 0.00 -1.83 0.64 0.00 0.00 176.34 175.15 1xfw s GLU 395 N 3.56 4.79 0.00 -0.41 4.04 -1.01 -1.39 118.70 128.27 1xfw s GLU 395 Ca 0.53 1.45 0.00 0.00 0.04 0.00 0.00 54.97 56.99 1xfw s GLU 395 Cb 0.14 -3.31 0.00 0.00 0.02 0.00 0.00 34.13 30.98 1xfw s GLU 395 CO -0.02 0.43 0.00 0.41 -1.84 0.00 0.00 175.26 174.24 1xfw n GLY 396 N 1.73 3.09 0.13 -3.83 0.00 -1.26 -4.77 105.19 100.28 1xfw n GLY 396 Ca -0.01 -1.02 -0.22 0.00 0.00 0.00 0.00 46.02 44.77 1xfw n GLY 396 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1xfw n GLU 397 N 0.00 0.64 -3.95 1.61 4.07 -1.20 -4.62 120.64 117.19 1xfw n GLU 397 Ca 0.00 0.22 -0.35 0.00 -0.06 0.00 0.00 57.16 56.97 1xfw n GLU 397 Cb 0.00 -1.55 -0.14 0.00 -0.06 0.00 0.00 31.44 29.69 1xfw n GLU 397 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 1xfw s ILE 398 N -2.51 3.32 0.08 6.31 -1.09 -0.49 0.14 121.20 126.96 1xfw s ILE 398 Ca -0.34 -0.51 -0.00 0.00 -2.23 0.00 0.00 60.65 57.57 1xfw s ILE 398 Cb 0.10 -2.50 0.00 0.00 -1.58 0.00 0.00 42.46 38.48 1xfw s ILE 398 CO 0.59 0.43 0.11 0.61 -1.23 0.00 0.00 174.94 175.45 1xfw n GLY 399 N 4.72 3.07 3.24 6.18 0.00 0.76 -4.36 105.19 118.80 1xfw n GLY 399 Ca -0.18 -1.49 -0.31 0.00 0.00 0.00 0.00 46.02 44.04 1xfw n GLY 399 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xfw s LYS 400 N -2.21 2.57 0.12 1.61 0.00 -1.26 0.91 119.74 121.47 1xfw s LYS 400 Ca 0.07 -0.87 0.04 0.00 0.00 0.00 0.00 55.97 55.21 1xfw s LYS 400 Cb -0.00 -2.12 -0.04 0.00 0.00 0.00 0.00 37.83 35.67 1xfw s LYS 400 CO 0.05 0.32 -0.10 0.96 0.00 0.00 0.00 175.35 176.59 1xfw s ILE 401 N -0.03 1.01 0.44 3.79 -4.36 -0.74 -4.93 121.20 116.38 1xfw s ILE 401 Ca -0.07 -1.84 -0.24 0.00 -0.26 0.00 0.00 60.65 58.24 1xfw s ILE 401 Cb -0.14 -1.59 -0.08 0.00 1.25 0.00 0.00 42.46 41.90 1xfw s ILE 401 CO 0.05 -0.66 1.19 -2.84 0.24 0.00 0.00 174.94 172.92 1xfw s PRO 402 N -3.28 3.81 0.41 0.37 0.02 -1.26 -1.00 135.00 134.08 1xfw s PRO 402 Ca 0.11 1.87 -0.25 0.00 0.02 0.00 0.00 61.00 62.74 1xfw s PRO 402 Cb 0.00 -2.51 -0.08 0.00 0.02 0.00 0.00 34.50 31.93 1xfw s PRO 402 CO -0.00 -0.53 1.17 -1.17 -0.33 0.00 0.00 177.00 176.13 1xfw s LEU 403 N -2.86 4.17 -0.45 -5.54 2.96 0.16 -4.82 118.68 112.31 1xfw s LEU 403 Ca 0.62 2.34 0.06 0.00 -0.22 0.00 0.00 54.13 56.92 1xfw s LEU 403 Cb -0.31 -4.05 0.21 0.00 0.50 0.00 0.00 46.19 42.53 1xfw s LEU 403 CO 0.38 -0.70 0.58 0.29 -1.32 0.00 0.00 176.35 175.58 1xfw n LYS 404 N 0.01 0.50 -1.74 1.98 5.02 -1.26 -3.23 118.16 119.43 1xfw n LYS 404 Ca 0.05 -2.64 -0.42 0.00 -2.02 0.00 0.00 58.31 53.28 1xfw n LYS 404 Cb 0.47 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.97 1xfw n LYS 404 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1xfw s LEU 405 N -0.14 4.40 0.00 -0.35 1.02 -1.22 -4.96 118.68 117.43 1xfw s LEU 405 Ca 0.32 2.70 0.00 0.00 0.02 0.00 0.00 54.13 57.18 1xfw s LEU 405 Cb 0.09 -3.56 0.00 0.00 0.02 0.00 0.00 46.19 42.74 1xfw s LEU 405 CO -0.15 -0.99 0.00 -0.90 0.02 0.00 0.00 176.35 174.33 1xfw n ASP 406 N 5.96 -0.14 0.17 2.29 5.75 -1.26 -4.83 116.55 124.49 1xfw n ASP 406 Ca 0.18 -0.54 -0.07 0.00 -0.01 0.00 0.00 54.79 54.35 1xfw n ASP 406 Cb 0.39 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.45 1xfw n ASP 406 CO 0.00 0.00 0.00 0.45 -0.11 0.00 0.00 177.20 177.54 1xfw h HIS 407 N -0.72 -0.42 -0.20 2.11 3.86 -2.01 -3.22 115.15 114.55 1xfw h HIS 407 Ca 0.00 -0.01 0.06 0.00 -1.16 0.00 0.00 60.37 59.26 1xfw h HIS 407 Cb 0.00 0.14 -0.07 0.00 1.06 0.00 0.00 27.41 28.54 1xfw h HIS 407 CO 0.00 -0.26 -0.26 -0.07 0.86 0.00 0.00 177.93 178.21 1xfw h LEU 408 N -0.65 -0.81 -0.92 2.43 4.07 -2.00 -2.53 115.31 114.90 1xfw h LEU 408 Ca -0.05 0.14 0.20 0.00 0.08 0.00 0.00 57.88 58.25 1xfw h LEU 408 Cb 0.34 0.37 -0.17 0.00 1.08 0.00 0.00 40.66 42.28 1xfw h LEU 408 CO 0.08 -0.29 -0.17 -0.09 -1.08 0.00 0.00 178.44 176.88 1xfw h ARG 409 N -0.28 0.01 0.63 1.13 9.65 -1.96 -0.19 114.38 123.37 1xfw h ARG 409 Ca 0.12 -0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.98 1xfw h ARG 409 Cb 0.47 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.04 1xfw h ARG 409 CO -0.37 0.01 -0.50 0.82 2.80 0.00 0.00 179.97 182.72 1xfw h ILE 410 N 0.01 0.01 -0.48 1.20 1.08 -1.46 -0.67 117.51 117.20 1xfw h ILE 410 Ca 0.47 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 65.08 1xfw h ILE 410 Cb 0.77 0.01 -0.02 0.00 -3.07 0.00 0.00 36.82 34.51 1xfw h ILE 410 CO -0.93 0.00 0.51 -0.33 -0.69 0.00 0.00 178.15 176.72 1xfw h GLU 411 N -1.10 0.00 0.17 2.37 5.08 -1.02 -2.58 114.58 117.49 1xfw h GLU 411 Ca -0.08 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1xfw h GLU 411 Cb 0.92 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.17 1xfw h GLU 411 CO 0.01 0.00 -0.08 1.49 -1.00 0.00 0.00 179.01 179.42 1xfw h GLU 412 N 0.00 -0.22 0.00 2.33 4.81 0.14 -3.11 114.58 118.52 1xfw h GLU 412 Ca 0.23 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 1xfw h GLU 412 Cb 1.25 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.68 1xfw h GLU 412 CO -0.00 -0.15 0.02 1.28 -0.73 0.00 0.00 179.01 179.43 1xfw n LEU 413 N -4.56 0.00 0.00 1.64 4.77 -0.38 -2.18 117.00 116.29 1xfw n LEU 413 Ca -0.03 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1xfw n LEU 413 Cb 0.09 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1xfw n LEU 413 CO 0.07 -0.04 0.00 1.17 -1.33 0.00 0.00 177.39 177.26 1xfw n LYS 414 N -0.89 0.00 0.10 3.23 0.00 -1.02 0.45 118.16 120.04 1xfw n LYS 414 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 58.31 58.37 1xfw n LYS 414 Cb 0.02 -0.37 0.33 0.00 0.00 0.00 0.00 35.03 35.01 1xfw n LYS 414 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 1xfw n GLU 415 N -0.56 0.08 0.10 1.64 0.00 -1.01 0.29 120.64 121.17 1xfw n GLU 415 Ca 0.00 0.55 0.12 0.00 0.00 0.00 0.00 57.16 57.83 1xfw n GLU 415 Cb 0.00 -1.84 0.18 0.00 0.00 0.00 0.00 31.44 29.78 1xfw n GLU 415 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.13 176.16 1xfw h ASN 416 N 0.00 0.00 -1.91 -1.84 -0.73 -1.62 -3.48 115.58 106.00 1xfw h ASN 416 Ca 0.00 -0.11 -0.03 0.00 1.87 0.00 0.00 56.30 58.03 1xfw h ASN 416 Cb 0.15 0.00 0.01 0.00 0.27 0.00 0.00 38.32 38.75 1xfw h ASN 416 CO 0.00 0.06 -0.07 0.61 -0.37 0.00 0.00 177.43 177.66 1xfw n GLY 417 N 1.27 0.58 0.07 1.57 0.00 0.83 -5.00 105.19 104.51 1xfw n GLY 417 Ca 0.03 -0.51 -0.06 0.00 0.00 0.00 0.00 46.02 45.49 1xfw n GLY 417 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1xfw n ILE 418 N -1.96 0.91 -4.10 -0.61 2.08 0.17 -5.01 119.36 110.83 1xfw n ILE 418 Ca -0.01 -0.59 -0.08 0.00 0.56 0.00 0.00 62.75 62.63 1xfw n ILE 418 Cb 0.51 -0.55 -0.10 0.00 -0.75 0.00 0.00 39.64 38.75 1xfw n ILE 418 CO 0.00 0.00 0.00 0.27 0.56 0.00 0.00 176.55 177.38 1xfw s ILE 419 N -2.41 0.31 -0.23 1.39 -4.36 -0.84 -3.96 121.20 111.10 1xfw s ILE 419 Ca -0.07 -1.80 -0.02 0.00 -0.26 0.00 0.00 60.65 58.50 1xfw s ILE 419 Cb 0.05 -1.51 0.07 0.00 1.25 0.00 0.00 42.46 42.32 1xfw s ILE 419 CO 0.60 -0.96 0.03 -0.22 0.24 0.00 0.00 174.94 174.64 1xfw s LEU 420 N -2.89 1.64 -0.20 0.37 1.98 -0.72 -4.45 118.68 114.41 1xfw s LEU 420 Ca 0.07 -1.07 -0.29 0.00 -2.89 0.00 0.00 54.13 49.95 1xfw s LEU 420 Cb 0.07 -0.75 0.00 0.00 0.66 0.00 0.00 46.19 46.17 1xfw s LEU 420 CO -0.09 -0.32 1.09 -0.75 -1.89 0.00 0.00 176.35 174.40 1xfw s LYS 421 N 1.73 4.27 0.00 1.98 2.20 -1.26 -2.23 119.74 126.42 1xfw s LYS 421 Ca 0.01 1.44 0.00 0.00 -0.36 0.00 0.00 55.97 57.05 1xfw s LYS 421 Cb -0.17 -3.66 0.00 0.00 -1.51 0.00 0.00 37.83 32.49 1xfw s LYS 421 CO -0.12 -0.62 0.00 0.41 -0.36 0.00 0.00 175.35 174.66 1xfw n GLY 422 N 3.37 5.05 2.95 5.54 0.00 -1.08 -5.04 105.19 115.98 1xfw n GLY 422 Ca 0.12 -0.66 -0.38 0.00 0.00 0.00 0.00 46.02 45.10 1xfw n GLY 422 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1xfw n LYS 423 N 0.00 0.00 -3.10 1.61 4.81 -1.26 -4.10 118.16 116.12 1xfw n LYS 423 Ca 0.00 0.00 -0.18 0.00 -0.87 0.00 0.00 58.31 57.26 1xfw n LYS 423 Cb 0.00 -0.89 0.01 0.00 0.02 0.00 0.00 35.03 34.17 1xfw n LYS 423 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1xfw s LYS 424 N -0.89 2.73 0.25 1.64 1.02 -1.26 -1.52 119.74 121.70 1xfw s LYS 424 Ca 0.53 -1.33 -0.16 0.00 0.02 0.00 0.00 55.97 55.03 1xfw s LYS 424 Cb -0.58 -2.69 0.01 0.00 -0.52 0.00 0.00 37.83 34.05 1xfw s LYS 424 CO 0.56 -0.32 0.56 -2.00 -0.92 0.00 0.00 175.35 173.23 1xfw s GLU 425 N -4.35 1.59 -0.04 1.68 2.56 -0.42 -4.88 118.70 114.84 1xfw s GLU 425 Ca 0.55 -1.08 -0.01 0.00 0.00 0.00 0.00 54.97 54.42 1xfw s GLU 425 Cb -0.09 0.53 0.03 0.00 2.00 0.00 0.00 34.13 36.60 1xfw s GLU 425 CO 0.33 -0.69 0.08 0.42 -0.56 0.00 0.00 175.26 174.85 1xfw s ILE 426 N -3.95 -0.05 -0.02 -3.70 -1.09 -1.26 -2.14 121.20 108.98 1xfw s ILE 426 Ca 0.16 0.19 -0.02 0.00 -2.23 0.00 0.00 60.65 58.75 1xfw s ILE 426 Cb -0.02 -0.16 0.01 0.00 -1.58 0.00 0.00 42.46 40.71 1xfw s ILE 426 CO 0.06 0.08 0.05 -1.81 -1.23 0.00 0.00 174.94 172.09 1xfw s ASP 427 N 1.08 -0.05 0.00 3.58 -0.00 -1.10 -4.84 116.67 115.34 1xfw s ASP 427 Ca -0.09 0.11 0.00 0.00 -0.00 0.00 0.00 52.55 52.57 1xfw s ASP 427 Cb -0.12 0.10 0.00 0.00 -0.00 0.00 0.00 42.92 42.90 1xfw s ASP 427 CO -0.04 -0.03 0.00 0.59 -0.00 0.00 0.00 175.17 175.69 1xfw n ASN 428 N 3.15 0.00 0.00 0.27 3.02 -1.26 -1.08 115.26 119.35 1xfw n ASN 428 Ca -0.13 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.42 1xfw n ASN 428 Cb 0.59 -2.12 0.00 0.00 -0.61 0.00 0.00 39.78 37.64 1xfw n ASN 428 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xfw n GLY 429 N -1.69 1.37 3.90 7.41 0.00 -1.26 -5.10 105.19 109.81 1xfw n GLY 429 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1xfw n GLY 429 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xfw s LYS 430 N -0.28 3.58 0.29 1.61 1.02 -0.24 -5.09 119.74 120.63 1xfw s LYS 430 Ca 0.00 -0.16 -0.18 0.00 0.02 0.00 0.00 55.97 55.65 1xfw s LYS 430 Cb 0.00 -2.90 -0.09 0.00 -0.52 0.00 0.00 37.83 34.32 1xfw s LYS 430 CO 0.00 0.50 0.76 0.15 -0.92 0.00 0.00 175.35 175.84 1xfw s LYS 431 N -2.59 4.16 -0.15 1.68 1.02 -1.26 -2.72 119.74 119.88 1xfw s LYS 431 Ca 0.39 0.83 -0.04 0.00 0.02 0.00 0.00 55.97 57.17 1xfw s LYS 431 Cb -0.12 -2.62 0.07 0.00 -0.52 0.00 0.00 37.83 34.64 1xfw s LYS 431 CO 0.25 0.25 0.17 0.71 -0.92 0.00 0.00 175.35 175.81 1xfw s TYR 432 N -1.79 -0.13 0.20 3.18 4.12 -0.91 -3.13 117.35 118.89 1xfw s TYR 432 Ca 0.50 0.24 -0.28 0.00 0.02 0.00 0.00 57.07 57.54 1xfw s TYR 432 Cb -0.13 -0.40 -0.08 0.00 -1.52 0.00 0.00 41.96 39.82 1xfw s TYR 432 CO 0.19 -0.46 0.89 0.71 0.02 0.00 0.00 175.55 176.90 1xfw s TYR 433 N 2.27 3.93 -0.04 2.71 1.51 -1.24 -1.30 117.35 125.19 1xfw s TYR 433 Ca 0.04 1.81 -0.22 0.00 -1.01 0.00 0.00 57.07 57.69 1xfw s TYR 433 Cb -0.14 -2.92 -0.04 0.00 -0.11 0.00 0.00 41.96 38.74 1xfw s TYR 433 CO -0.09 0.44 0.65 -1.17 -1.11 0.00 0.00 175.55 174.26 1xfw s LEU 434 N -0.97 4.36 -0.26 -1.29 1.98 -0.57 -2.95 118.68 118.97 1xfw s LEU 434 Ca 0.40 1.16 -0.07 0.00 -2.89 0.00 0.00 54.13 52.73 1xfw s LEU 434 Cb -0.25 -3.00 -0.02 0.00 0.66 0.00 0.00 46.19 43.59 1xfw s LEU 434 CO 0.30 -0.02 0.07 -0.76 -1.89 0.00 0.00 176.35 174.05 1xfw s LEU 435 N 0.38 3.53 -0.13 -0.68 1.43 -1.04 -2.63 118.68 119.54 1xfw s LEU 435 Ca 0.34 -0.32 -0.07 0.00 -1.03 0.00 0.00 54.13 53.05 1xfw s LEU 435 Cb -0.18 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 1xfw s LEU 435 CO 0.17 -0.07 0.12 -0.70 0.23 0.00 0.00 176.35 176.11 1xfw s GLU 436 N 1.59 3.53 -0.08 1.70 2.56 -0.95 -3.63 118.70 123.43 1xfw s GLU 436 Ca 0.06 -0.18 -0.03 0.00 0.00 0.00 0.00 54.97 54.82 1xfw s GLU 436 Cb -0.16 -3.19 0.04 0.00 2.00 0.00 0.00 34.13 32.83 1xfw s GLU 436 CO 0.03 0.68 0.16 0.45 -0.56 0.00 0.00 175.26 176.02 1xfw s SER 437 N -0.76 0.40 0.00 -1.70 0.15 -1.26 -1.76 113.70 108.78 1xfw s SER 437 Ca 0.13 0.33 -0.00 0.00 0.70 0.00 0.00 55.95 57.11 1xfw s SER 437 Cb -0.12 0.26 -0.00 0.00 -1.71 0.00 0.00 66.02 64.44 1xfw s SER 437 CO 0.03 -0.21 0.47 -3.20 1.20 0.00 0.00 173.24 171.53 1xfw n ASN 438 N 4.89 1.09 -4.94 5.45 4.05 -1.26 -4.74 115.26 119.81 1xfw n ASN 438 Ca -0.13 -1.32 -0.24 0.00 0.45 0.00 0.00 54.58 53.33 1xfw n ASN 438 Cb 0.51 -0.24 0.03 0.00 1.23 0.00 0.00 39.78 41.31 1xfw n ASN 438 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 177.26 174.42 1xfw s ASN 439 N 2.07 5.46 -0.24 1.20 3.84 -1.26 -5.02 114.94 120.99 1xfw s ASN 439 Ca 0.01 0.38 0.10 0.00 0.21 0.00 0.00 52.86 53.56 1xfw s ASN 439 Cb 0.01 -1.37 0.43 0.00 -0.55 0.00 0.00 41.25 39.77 1xfw s ASN 439 CO 0.00 -1.07 1.21 0.00 -2.79 0.00 0.00 177.10 174.45 1xfw n GLN 440 N -2.44 2.26 0.00 0.43 10.64 -1.26 -4.73 117.38 122.28 1xfw n GLN 440 Ca 0.05 -3.59 0.00 0.00 -1.83 0.00 0.00 57.00 51.63 1xfw n GLN 440 Cb 0.59 -1.83 0.00 0.00 -0.86 0.00 0.00 30.24 28.13 1xfw n GLN 440 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.06 175.51 1xfw n VAL 441 N -0.98 0.00 -4.76 -0.39 0.31 -1.26 -4.94 118.33 106.31 1xfw n VAL 441 Ca 0.27 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 64.35 1xfw n VAL 441 Cb 0.78 0.00 -0.16 0.00 -0.91 0.00 0.00 33.84 33.56 1xfw n VAL 441 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 1xfw s TYR 442 N -0.44 1.59 -0.07 3.52 4.12 -1.26 -2.61 117.35 122.20 1xfw s TYR 442 Ca 0.00 -0.45 0.00 0.00 0.02 0.00 0.00 57.07 56.64 1xfw s TYR 442 Cb 0.00 -1.08 -0.03 0.00 -1.52 0.00 0.00 41.96 39.33 1xfw s TYR 442 CO 0.00 -0.16 -0.06 -1.21 0.02 0.00 0.00 175.55 174.14 1xfw s GLU 443 N 0.07 2.82 0.20 -0.62 2.02 -1.05 -4.77 118.70 117.37 1xfw s GLU 443 Ca -0.04 -0.54 0.11 0.00 0.02 0.00 0.00 54.97 54.53 1xfw s GLU 443 Cb -0.11 -2.62 -0.04 0.00 0.10 0.00 0.00 34.13 31.45 1xfw s GLU 443 CO 0.02 0.64 -0.23 -0.06 0.02 0.00 0.00 175.26 175.65 1xfw s PHE 444 N -0.74 2.24 -0.21 1.61 0.40 -1.24 -2.78 117.98 117.26 1xfw s PHE 444 Ca 0.11 -0.37 -0.14 0.00 -0.60 0.00 0.00 56.93 55.93 1xfw s PHE 444 Cb -0.11 -1.10 0.06 0.00 0.51 0.00 0.00 43.02 42.38 1xfw s PHE 444 CO 0.02 0.49 0.54 -0.98 0.70 0.00 0.00 175.22 175.99 1xfw s ARG 445 N -2.74 0.56 0.51 0.44 1.70 0.78 -2.50 118.95 117.70 1xfw s ARG 445 Ca 0.21 0.92 0.03 0.00 -0.47 0.00 0.00 55.73 56.41 1xfw s ARG 445 Cb -0.07 0.13 0.02 0.00 -0.57 0.00 0.00 34.95 34.46 1xfw s ARG 445 CO 0.10 -0.13 0.72 -1.50 -1.08 0.00 0.00 175.30 173.40 1xfw s ILE 446 N 1.14 2.92 0.00 4.99 2.07 -1.15 0.61 121.20 131.78 1xfw s ILE 446 Ca -0.07 -0.71 0.00 0.00 -1.41 0.00 0.00 60.65 58.46 1xfw s ILE 446 Cb -0.06 -3.07 0.00 0.00 0.13 0.00 0.00 42.46 39.46 1xfw s ILE 446 CO -0.11 -0.04 0.00 -0.24 -1.91 0.00 0.00 174.94 172.64 1xfw n SER 447 N -2.21 0.00 0.00 4.50 2.88 0.12 -3.69 113.62 115.23 1xfw n SER 447 Ca 0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 1xfw n SER 447 Cb 0.59 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.05 1xfw n SER 447 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1xfw n ASP 448 N 0.00 0.25 0.00 -3.46 -0.08 -1.18 -4.27 116.55 107.80 1xfw n ASP 448 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1xfw n ASP 448 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1xfw n ASP 448 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1xfw n GLU 449 N -2.08 0.00 -3.77 -0.67 2.13 -1.26 -4.51 120.64 110.48 1xfw n GLU 449 Ca 0.00 0.13 -0.36 0.00 0.66 0.00 0.00 57.16 57.59 1xfw n GLU 449 Cb 0.06 -1.08 -0.10 0.00 0.27 0.00 0.00 31.44 30.59 1xfw n GLU 449 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1xfw s ASN 450 N -1.96 5.90 0.00 4.31 4.22 -1.26 -4.97 114.94 121.18 1xfw s ASN 450 Ca 0.00 0.08 -0.00 0.00 -2.14 0.00 0.00 52.86 50.80 1xfw s ASN 450 Cb 0.00 -2.05 -0.02 0.00 1.28 0.00 0.00 41.25 40.46 1xfw s ASN 450 CO 0.00 0.09 0.74 0.59 -2.04 0.00 0.00 177.10 176.48 1xfw n ASN 451 N 4.09 1.41 -3.61 3.54 4.13 -1.26 -4.17 115.26 119.39 1xfw n ASN 451 Ca -0.16 -1.47 -0.30 0.00 1.68 0.00 0.00 54.58 54.33 1xfw n ASN 451 Cb 0.52 -0.32 0.29 0.00 -1.54 0.00 0.00 39.78 38.73 1xfw n ASN 451 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1xfw s GLU 452 N 1.73 -2.74 0.03 3.52 2.02 -1.26 -3.39 118.70 118.60 1xfw s GLU 452 Ca 0.05 0.28 -0.01 0.00 0.02 0.00 0.00 54.97 55.31 1xfw s GLU 452 Cb 0.02 -1.39 -0.03 0.00 0.10 0.00 0.00 34.13 32.84 1xfw s GLU 452 CO 0.00 -4.79 -0.02 0.08 0.02 0.00 0.00 175.26 170.55 1xfw s VAL 453 N -2.25 0.15 0.03 2.63 1.01 -1.20 0.12 120.40 120.91 1xfw s VAL 453 Ca 0.68 -1.27 -0.12 0.00 0.00 0.00 0.00 61.98 61.27 1xfw s VAL 453 Cb -0.16 -0.78 0.01 0.00 0.00 0.00 0.00 36.38 35.46 1xfw s VAL 453 CO 0.59 -0.70 0.26 -1.10 0.00 0.00 0.00 175.10 174.16 1xfw s GLN 454 N -2.47 0.74 0.31 2.72 -0.21 0.20 -1.84 119.66 119.12 1xfw s GLN 454 Ca -0.07 -0.49 0.03 0.00 0.02 0.00 0.00 55.36 54.86 1xfw s GLN 454 Cb -0.03 0.32 -0.04 0.00 1.00 0.00 0.00 33.01 34.26 1xfw s GLN 454 CO -0.05 -0.22 0.16 1.52 -2.12 0.00 0.00 175.29 174.58 1xfw s TYR 455 N -2.32 1.63 -0.16 0.91 -0.00 -0.86 -0.16 117.35 116.39 1xfw s TYR 455 Ca -0.07 -1.37 -0.32 0.00 -0.00 0.00 0.00 57.07 55.31 1xfw s TYR 455 Cb -0.02 -0.88 0.14 0.00 -0.00 0.00 0.00 41.96 41.20 1xfw s TYR 455 CO -0.02 -0.51 1.12 -1.59 -0.00 0.00 0.00 175.55 174.54 1xfw s LYS 456 N -3.79 0.44 0.26 -3.49 -2.85 -1.12 -1.25 119.74 107.94 1xfw s LYS 456 Ca 0.35 -0.07 -0.30 0.00 -1.00 0.00 0.00 55.97 54.95 1xfw s LYS 456 Cb 0.05 0.20 -0.09 0.00 -2.06 0.00 0.00 37.83 35.93 1xfw s LYS 456 CO 0.18 -0.17 1.03 0.95 0.10 0.00 0.00 175.35 177.43 1xfw s THR 457 N -2.04 3.77 0.71 3.79 -4.23 0.24 -2.51 115.64 115.36 1xfw s THR 457 Ca 0.06 1.77 -0.15 0.00 -1.18 0.00 0.00 61.69 62.19 1xfw s THR 457 Cb -0.01 -4.13 0.03 0.00 1.34 0.00 0.00 72.50 69.73 1xfw s THR 457 CO -0.05 0.42 1.16 -0.54 -0.54 0.00 0.00 174.62 175.07 1xfw s LYS 458 N -1.28 2.36 0.00 3.99 1.02 -1.07 -4.64 119.74 120.12 1xfw s LYS 458 Ca 0.43 1.57 0.02 0.00 0.02 0.00 0.00 55.97 58.01 1xfw s LYS 458 Cb -0.29 -1.88 0.11 0.00 -0.52 0.00 0.00 37.83 35.25 1xfw s LYS 458 CO 0.37 -1.62 0.44 0.39 -0.92 0.00 0.00 175.35 174.00 1xfw n GLU 459 N -2.70 0.10 -2.75 1.68 1.02 -1.26 -2.49 120.64 114.24 1xfw n GLU 459 Ca 0.12 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.16 1xfw n GLU 459 Cb 0.51 -1.30 0.06 0.00 -0.02 0.00 0.00 31.44 30.70 1xfw n GLU 459 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xfw n GLY 460 N -0.64 1.61 3.60 0.62 0.00 -1.26 -5.12 105.19 104.00 1xfw n GLY 460 Ca 0.01 -0.76 -0.03 0.00 0.00 0.00 0.00 46.02 45.24 1xfw n GLY 460 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xfw s LYS 461 N -1.43 0.35 0.36 1.61 2.47 -1.04 -5.05 119.74 117.02 1xfw s LYS 461 Ca 0.26 -0.15 0.04 0.00 -1.56 0.00 0.00 55.97 54.56 1xfw s LYS 461 Cb 0.40 0.15 -0.04 0.00 -1.46 0.00 0.00 37.83 36.89 1xfw s LYS 461 CO -0.03 -0.15 0.12 -1.50 0.16 0.00 0.00 175.35 173.94 1xfw s ILE 462 N -2.45 0.69 -0.12 5.43 2.07 -1.26 -4.50 121.20 121.06 1xfw s ILE 462 Ca 0.10 -2.00 -0.07 0.00 -1.41 0.00 0.00 60.65 57.27 1xfw s ILE 462 Cb 0.00 -2.50 -0.04 0.00 0.13 0.00 0.00 42.46 40.05 1xfw s ILE 462 CO -0.04 0.00 0.15 -0.89 -1.91 0.00 0.00 174.94 172.24 1xfw s THR 463 N -3.33 5.49 0.56 4.00 2.01 -0.50 -4.94 115.64 118.94 1xfw s THR 463 Ca 0.30 0.23 0.37 0.00 0.31 0.00 0.00 61.69 62.89 1xfw s THR 463 Cb 0.05 -3.41 0.54 0.00 0.01 0.00 0.00 72.50 69.69 1xfw s THR 463 CO 0.15 0.62 1.71 -0.37 -0.69 0.00 0.00 174.62 176.03 1xfw h VAL 464 N 3.98 0.27 0.00 3.82 -1.51 -1.92 1.41 116.25 122.30 1xfw h VAL 464 Ca -0.55 0.00 -0.07 0.00 -1.23 0.00 0.00 66.70 64.85 1xfw h VAL 464 Cb 1.23 0.31 -0.01 0.00 -2.13 0.00 0.00 31.29 30.69 1xfw h VAL 464 CO 0.58 0.00 -0.37 -0.07 -1.23 0.00 0.00 177.57 176.48 1xfw h LEU 465 N 0.00 0.00 0.00 4.19 4.07 -1.93 -3.48 115.31 118.16 1xfw h LEU 465 Ca 0.57 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.53 1xfw h LEU 465 Cb 2.47 0.00 0.00 0.00 1.08 0.00 0.00 40.66 44.21 1xfw h LEU 465 CO -0.01 0.32 0.00 0.61 -1.08 0.00 0.00 178.44 178.28 1xfw n GLY 466 N 1.19 1.84 3.70 0.83 0.00 0.48 -5.14 105.19 108.09 1xfw n GLY 466 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 1xfw n GLY 466 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xfw s GLU 467 N -0.35 2.44 -0.21 1.61 2.02 -1.23 -4.86 118.70 118.13 1xfw s GLU 467 Ca 0.00 -1.37 -0.11 0.00 0.02 0.00 0.00 54.97 53.51 1xfw s GLU 467 Cb 0.00 -2.25 0.07 0.00 0.10 0.00 0.00 34.13 32.05 1xfw s GLU 467 CO 0.00 0.31 0.50 0.21 0.02 0.00 0.00 175.26 176.30 1xfw s LYS 468 N -3.75 0.48 0.17 1.61 2.20 -1.26 -1.41 119.74 117.79 1xfw s LYS 468 Ca 0.33 0.95 -0.13 0.00 -0.36 0.00 0.00 55.97 56.76 1xfw s LYS 468 Cb -0.06 0.08 0.01 0.00 -1.51 0.00 0.00 37.83 36.35 1xfw s LYS 468 CO 0.22 -0.17 0.40 -0.59 -0.36 0.00 0.00 175.35 174.85 1xfw s PHE 469 N 1.62 0.10 0.69 4.03 -0.12 -1.26 -4.95 117.98 118.09 1xfw s PHE 469 Ca -0.09 -0.45 -0.00 0.00 -0.05 0.00 0.00 56.93 56.34 1xfw s PHE 469 Cb -0.08 0.18 0.11 0.00 -0.63 0.00 0.00 43.02 42.60 1xfw s PHE 469 CO -0.15 -0.80 0.96 -0.80 -0.05 0.00 0.00 175.22 174.38 1xfw s ASN 470 N -2.90 4.49 -0.22 1.98 0.01 -1.26 -0.59 114.94 116.44 1xfw s ASN 470 Ca 0.12 -0.32 -0.43 0.00 -0.71 0.00 0.00 52.86 51.51 1xfw s ASN 470 Cb 0.01 -0.13 -0.20 0.00 0.41 0.00 0.00 41.25 41.35 1xfw s ASN 470 CO -0.03 -1.75 1.33 0.79 -1.51 0.00 0.00 177.10 175.93 1xfw n TRP 471 N -2.76 1.21 -4.27 2.20 7.02 -1.24 -4.57 117.44 115.04 1xfw n TRP 471 Ca 0.14 1.06 -0.14 0.00 -1.02 0.00 0.00 57.50 57.54 1xfw n TRP 471 Cb 0.60 -2.17 -0.10 0.00 -2.42 0.00 0.00 31.31 27.22 1xfw n TRP 471 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1xfw s ARG 472 N 1.45 1.31 -0.00 -0.99 0.52 -0.38 -4.95 118.95 115.90 1xfw s ARG 472 Ca 0.97 -1.70 -0.19 0.00 -0.52 0.00 0.00 55.73 54.29 1xfw s ARG 472 Cb -1.35 -0.05 -0.05 0.00 0.52 0.00 0.00 34.95 34.02 1xfw s ARG 472 CO 0.68 -0.32 0.54 -0.80 0.02 0.00 0.00 175.30 175.42 1xfw s ASN 473 N -3.24 6.92 -0.07 0.23 -0.87 -1.26 -2.03 114.94 114.61 1xfw s ASN 473 Ca 0.37 1.10 -0.30 0.00 -1.57 0.00 0.00 52.86 52.47 1xfw s ASN 473 Cb 0.07 -2.33 -0.04 0.00 -0.02 0.00 0.00 41.25 38.93 1xfw s ASN 473 CO 0.12 0.16 1.34 -0.63 -2.57 0.00 0.00 177.10 175.52 1xfw s ILE 474 N -0.39 4.00 -0.17 0.60 1.01 -0.76 -4.89 121.20 120.59 1xfw s ILE 474 Ca 0.29 1.30 -0.08 0.00 0.00 0.00 0.00 60.65 62.16 1xfw s ILE 474 Cb -0.18 -3.84 -0.04 0.00 0.01 0.00 0.00 42.46 38.41 1xfw s ILE 474 CO 0.16 -0.05 0.10 -1.61 0.00 0.00 0.00 174.94 173.54 1xfw s GLU 475 N 2.91 3.89 0.39 2.79 2.02 -1.26 0.40 118.70 129.83 1xfw s GLU 475 Ca 0.60 -0.26 0.08 0.00 0.02 0.00 0.00 54.97 55.41 1xfw s GLU 475 Cb -0.27 -3.26 -0.04 0.00 0.10 0.00 0.00 34.13 30.67 1xfw s GLU 475 CO 0.22 0.41 0.26 0.14 0.02 0.00 0.00 175.26 176.31 1xfw s VAL 476 N 0.01 2.70 0.37 2.63 -7.23 -0.17 -0.37 120.40 118.34 1xfw s VAL 476 Ca 0.08 -1.53 -0.10 0.00 -1.81 0.00 0.00 61.98 58.62 1xfw s VAL 476 Cb -0.12 -3.01 -0.07 0.00 0.56 0.00 0.00 36.38 33.75 1xfw s VAL 476 CO 0.00 -0.05 0.72 -0.04 -0.31 0.00 0.00 175.10 175.42 1xfw s MET 477 N -3.99 3.78 -0.23 4.82 1.00 -0.41 -1.80 119.30 122.47 1xfw s MET 477 Ca 0.43 0.41 -0.10 0.00 0.00 0.00 0.00 55.69 56.44 1xfw s MET 477 Cb -0.01 -2.45 0.09 0.00 0.00 0.00 0.00 34.83 32.47 1xfw s MET 477 CO 0.25 0.04 0.51 0.00 0.00 0.00 0.00 175.02 175.82 1xfw s ALA 478 N -2.26 -1.46 0.97 3.03 0.00 0.26 0.13 121.76 122.42 1xfw s ALA 478 Ca 0.50 1.85 -0.11 0.00 0.00 0.00 0.00 51.96 54.21 1xfw s ALA 478 Cb -0.10 -1.37 0.16 0.00 0.00 0.00 0.00 23.12 21.81 1xfw s ALA 478 CO 0.29 -0.64 0.95 0.36 0.00 0.00 0.00 175.76 176.73 1xfw n LYS 479 N 5.00 -0.86 -3.65 0.00 2.85 -0.98 -0.17 118.16 120.35 1xfw n LYS 479 Ca -0.14 -1.55 -0.39 0.00 -1.05 0.00 0.00 58.31 55.18 1xfw n LYS 479 Cb 0.52 -0.95 -0.12 0.00 -0.65 0.00 0.00 35.03 33.83 1xfw n LYS 479 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 1xfw s ASN 480 N -4.51 5.58 -0.31 -5.58 3.04 0.36 -2.34 114.94 111.18 1xfw s ASN 480 Ca 0.55 -0.48 -0.01 0.00 0.04 0.00 0.00 52.86 52.96 1xfw s ASN 480 Cb -0.02 -2.01 0.06 0.00 -1.54 0.00 0.00 41.25 37.74 1xfw s ASN 480 CO 0.38 -0.18 0.01 -0.69 -3.04 0.00 0.00 177.10 173.58 1xfw s VAL 481 N 1.63 2.87 -1.19 -5.21 1.01 -0.87 -4.72 120.40 113.91 1xfw s VAL 481 Ca 0.05 -1.56 -0.18 0.00 0.00 0.00 0.00 61.98 60.29 1xfw s VAL 481 Cb -0.17 -2.72 -0.00 0.00 0.00 0.00 0.00 36.38 33.48 1xfw s VAL 481 CO 0.07 -0.20 0.73 -0.62 0.00 0.00 0.00 175.10 175.07 1xfw n GLU 482 N 4.57 -1.61 -2.73 2.72 -0.58 -1.26 -1.34 120.64 120.40 1xfw n GLU 482 Ca -0.11 0.43 -0.19 0.00 -0.42 0.00 0.00 57.16 56.87 1xfw n GLU 482 Cb 0.43 -4.13 0.01 0.00 -0.57 0.00 0.00 31.44 27.17 1xfw n GLU 482 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xfw n GLY 483 N -1.75 -0.50 2.84 0.62 0.00 -1.26 -4.97 105.19 100.17 1xfw n GLY 483 Ca -0.13 0.05 -0.16 0.00 0.00 0.00 0.00 46.02 45.77 1xfw n GLY 483 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xfw s VAL 484 N -2.95 -0.35 -0.63 1.61 1.01 -0.45 -5.08 120.40 113.54 1xfw s VAL 484 Ca 0.15 0.06 -0.26 0.00 0.00 0.00 0.00 61.98 61.93 1xfw s VAL 484 Cb -0.07 -0.56 -0.08 0.00 0.00 0.00 0.00 36.38 35.66 1xfw s VAL 484 CO 0.18 -0.06 2.31 -0.76 0.00 0.00 0.00 175.10 176.77 1xfw s LEU 485 N 2.36 3.20 0.22 3.92 1.02 -1.26 -2.06 118.68 126.08 1xfw s LEU 485 Ca 0.05 0.53 -0.10 0.00 0.02 0.00 0.00 54.13 54.63 1xfw s LEU 485 Cb -0.14 -2.52 -0.07 0.00 0.02 0.00 0.00 46.19 43.47 1xfw s LEU 485 CO -0.10 -3.14 0.54 -0.54 0.02 0.00 0.00 176.35 173.13 1xfw s LYS 486 N 8.24 3.81 0.82 1.70 1.02 -0.99 -4.92 119.74 129.42 1xfw s LYS 486 Ca 0.90 0.28 -0.11 0.00 0.02 0.00 0.00 55.97 57.07 1xfw s LYS 486 Cb -0.14 -2.68 0.08 0.00 -0.52 0.00 0.00 37.83 34.58 1xfw s LYS 486 CO 0.18 0.33 1.09 -1.25 -0.92 0.00 0.00 175.35 174.78 1xfw s PRO 487 N -2.74 1.87 -0.08 -1.68 0.04 -1.26 -2.33 135.00 128.81 1xfw s PRO 487 Ca 0.46 1.09 0.02 0.00 0.04 0.00 0.00 61.00 62.62 1xfw s PRO 487 Cb -0.12 -1.86 -0.02 0.00 0.04 0.00 0.00 34.50 32.55 1xfw s PRO 487 CO 0.21 -1.90 -0.13 -0.51 0.04 0.00 0.00 177.00 174.71 1xfw s LEU 488 N -6.06 2.76 0.32 -3.56 1.43 0.12 -1.36 118.68 112.33 1xfw s LEU 488 Ca 0.62 -0.23 0.03 0.00 -1.03 0.00 0.00 54.13 53.52 1xfw s LEU 488 Cb -0.18 -1.59 -0.04 0.00 0.03 0.00 0.00 46.19 44.42 1xfw s LEU 488 CO 0.56 0.28 0.15 0.28 0.23 0.00 0.00 176.35 177.85 1xfw s THR 489 N -0.32 0.42 0.70 5.49 -1.32 -0.52 -2.59 115.64 117.50 1xfw s THR 489 Ca 0.03 -2.00 -0.17 0.00 -1.21 0.00 0.00 61.69 58.35 1xfw s THR 489 Cb -0.13 -2.51 -0.05 0.00 -1.51 0.00 0.00 72.50 68.31 1xfw s THR 489 CO 0.02 0.00 0.51 0.00 -2.21 0.00 0.00 174.62 172.95 1xfw n ALA 490 N -0.64 -1.49 -2.37 11.08 0.00 -1.26 -0.34 120.51 125.48 1xfw n ALA 490 Ca -0.00 -0.21 -0.24 0.00 0.00 0.00 0.00 53.44 52.99 1xfw n ALA 490 Cb 0.65 -1.84 -0.05 0.00 0.00 0.00 0.00 19.45 18.21 1xfw n ALA 490 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1xfw s ASP 491 N -1.42 4.64 -0.39 0.00 3.84 -1.26 -4.43 116.67 117.65 1xfw s ASP 491 Ca 0.66 -1.04 -0.24 0.00 -0.00 0.00 0.00 52.55 51.93 1xfw s ASP 491 Cb -0.36 -0.28 0.01 0.00 -1.38 0.00 0.00 42.92 40.91 1xfw s ASP 491 CO 0.58 -0.71 0.81 -0.31 -0.00 0.00 0.00 175.17 175.54 1xfw s TYR 492 N -2.61 3.07 -0.40 2.11 2.02 -0.38 -4.92 117.35 116.24 1xfw s TYR 492 Ca 0.40 0.51 -0.16 0.00 -0.37 0.00 0.00 57.07 57.45 1xfw s TYR 492 Cb 0.00 -3.52 0.01 0.00 -0.40 0.00 0.00 41.96 38.05 1xfw s TYR 492 CO 0.23 -0.82 0.37 -0.51 -1.57 0.00 0.00 175.55 173.26 1xfw s ASP 493 N 1.93 6.16 0.07 2.29 -0.00 -1.26 -4.48 116.67 121.38 1xfw s ASP 493 Ca 0.32 -0.64 -0.31 0.00 -0.00 0.00 0.00 52.55 51.93 1xfw s ASP 493 Cb -0.13 -2.20 -0.08 0.00 -0.00 0.00 0.00 42.92 40.52 1xfw s ASP 493 CO 0.19 -0.48 1.56 -0.76 -0.00 0.00 0.00 175.17 175.68 1xfw s LEU 494 N 1.96 4.35 0.34 1.23 1.43 -1.26 -1.26 118.68 125.47 1xfw s LEU 494 Ca 0.10 2.39 0.18 0.00 -1.03 0.00 0.00 54.13 55.77 1xfw s LEU 494 Cb -0.18 -3.57 0.34 0.00 0.03 0.00 0.00 46.19 42.82 1xfw s LEU 494 CO 0.12 -0.82 1.57 0.15 0.23 0.00 0.00 176.35 177.61 1xfw h PHE 495 N 7.91 0.00 0.00 0.29 3.04 0.35 0.26 116.94 128.79 1xfw h PHE 495 Ca -0.41 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.54 1xfw h PHE 495 Cb 1.20 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.71 1xfw h PHE 495 CO 0.75 0.38 0.00 0.00 -2.02 0.00 0.00 178.31 177.41 1xfw n ALA 496 N -2.22 0.00 -3.78 2.41 0.00 -0.91 -3.71 120.51 112.29 1xfw n ALA 496 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.19 1xfw n ALA 496 Cb 0.62 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.91 1xfw n ALA 496 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1xfw s LEU 497 N 0.00 1.41 -0.33 0.00 1.43 -1.26 -1.55 118.68 118.38 1xfw s LEU 497 Ca 0.00 -0.33 -0.02 0.00 -1.03 0.00 0.00 54.13 52.74 1xfw s LEU 497 Cb 0.00 -0.90 0.07 0.00 0.03 0.00 0.00 46.19 45.39 1xfw s LEU 497 CO 0.00 -0.06 0.07 0.00 0.23 0.00 0.00 176.35 176.59 1xfw s ALA 498 N 1.35 2.93 0.13 4.21 0.00 -0.32 -4.86 121.76 125.20 1xfw s ALA 498 Ca -0.01 -2.01 -0.05 0.00 0.00 0.00 0.00 51.96 49.89 1xfw s ALA 498 Cb -0.14 -2.10 -0.06 0.00 0.00 0.00 0.00 23.12 20.83 1xfw s ALA 498 CO -0.05 -1.44 0.37 -1.25 0.00 0.00 0.00 175.76 173.39 1xfw s PRO 499 N 1.22 3.63 0.23 0.00 0.04 -1.25 0.65 135.00 139.51 1xfw s PRO 499 Ca -0.01 -0.07 -0.32 0.00 0.04 0.00 0.00 61.00 60.65 1xfw s PRO 499 Cb -0.21 -2.88 -0.13 0.00 0.04 0.00 0.00 34.50 31.32 1xfw s PRO 499 CO -0.02 0.49 1.53 0.45 0.04 0.00 0.00 177.00 179.49 1xfw n SER 500 N 0.24 3.23 0.24 6.66 2.88 -0.44 -1.68 113.62 124.75 1xfw n SER 500 Ca -0.04 1.12 0.14 0.00 -1.33 0.00 0.00 58.87 58.77 1xfw n SER 500 Cb 0.52 -1.48 0.61 0.00 -0.75 0.00 0.00 64.21 63.11 1xfw n SER 500 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1xfw h LEU 501 N 5.06 0.00 0.06 2.46 6.46 -1.26 0.52 115.31 128.61 1xfw h LEU 501 Ca -0.45 0.00 -0.30 0.00 -0.12 0.00 0.00 57.88 57.01 1xfw h LEU 501 Cb 1.25 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 41.15 1xfw h LEU 501 CO 0.82 0.00 -1.62 0.71 -0.62 0.00 0.00 178.44 177.73 1xfw h THR 502 N 0.00 1.00 -0.44 1.05 1.35 -1.86 -3.31 112.91 110.70 1xfw h THR 502 Ca 0.08 -2.75 0.13 0.00 -0.55 0.00 0.00 66.41 63.32 1xfw h THR 502 Cb 1.20 2.60 -0.02 0.00 -1.73 0.00 0.00 68.15 70.20 1xfw h THR 502 CO -0.00 0.72 0.37 -0.08 -0.25 0.00 0.00 175.52 176.28 1xfw h GLU 503 N 0.04 0.00 -0.24 4.72 4.57 -0.28 0.24 114.58 123.62 1xfw h GLU 503 Ca -0.27 0.00 -0.18 0.00 -1.18 0.00 0.00 59.36 57.73 1xfw h GLU 503 Cb 1.99 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 30.58 1xfw h GLU 503 CO 0.11 0.00 -0.58 0.82 -1.18 0.00 0.00 179.01 178.19 1xfw h ILE 504 N 0.00 1.29 -0.90 2.32 5.03 -1.63 -2.91 117.51 120.71 1xfw h ILE 504 Ca 0.21 -1.79 0.08 0.00 -0.12 0.00 0.00 64.86 63.24 1xfw h ILE 504 Cb 0.95 1.71 -0.07 0.00 -3.03 0.00 0.00 36.82 36.38 1xfw h ILE 504 CO -0.00 0.57 0.55 0.50 -0.68 0.00 0.00 178.15 179.09 1xfw h LYS 505 N 0.59 0.93 -1.55 2.37 1.63 -0.67 0.44 116.57 120.30 1xfw h LYS 505 Ca 0.00 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.75 1xfw h LYS 505 Cb 1.17 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 32.59 1xfw h LYS 505 CO 0.12 0.61 0.00 1.63 -3.45 0.00 0.00 179.45 178.36 1xfw n LYS 506 N -4.64 0.58 0.00 1.90 5.02 -1.02 -1.48 118.16 118.52 1xfw n LYS 506 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.43 1xfw n LYS 506 Cb 0.24 -1.21 0.00 0.00 -0.02 0.00 0.00 35.03 34.04 1xfw n LYS 506 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1xfw n GLN 507 N 0.93 1.51 -2.84 1.97 -0.06 0.15 -5.04 117.38 114.01 1xfw n GLN 507 Ca 0.00 0.00 -0.41 0.00 -2.00 0.00 0.00 57.00 54.59 1xfw n GLN 507 Cb 0.29 -0.69 -0.04 0.00 -4.06 0.00 0.00 30.24 25.74 1xfw n GLN 507 CO 0.00 0.00 0.00 0.42 -0.20 0.00 0.00 177.06 177.28 1xfw s ILE 508 N -1.39 4.92 -0.02 1.69 1.01 -0.55 -4.98 121.20 121.89 1xfw s ILE 508 Ca 0.00 1.79 -0.30 0.00 0.00 0.00 0.00 60.65 62.15 1xfw s ILE 508 Cb 0.00 -4.20 -0.08 0.00 0.01 0.00 0.00 42.46 38.19 1xfw s ILE 508 CO 0.00 0.15 1.94 -2.16 0.00 0.00 0.00 174.94 174.87 1xfw s PRO 509 N 1.22 4.01 0.38 2.79 0.04 -1.26 -4.81 135.00 137.38 1xfw s PRO 509 Ca 0.45 2.44 0.05 0.00 0.04 0.00 0.00 61.00 63.98 1xfw s PRO 509 Cb -0.19 -4.16 0.19 0.00 0.04 0.00 0.00 34.50 30.38 1xfw s PRO 509 CO 0.21 -1.09 0.66 1.04 0.04 0.00 0.00 177.00 177.86 1xfw n GLN 510 N 7.63 0.01 0.02 4.56 1.13 -1.26 0.12 117.38 129.59 1xfw n GLN 510 Ca 0.21 0.58 -0.22 0.00 -1.94 0.00 0.00 57.00 55.63 1xfw n GLN 510 Cb 0.42 -1.53 -0.14 0.00 0.11 0.00 0.00 30.24 29.10 1xfw n GLN 510 CO 0.00 0.00 0.00 1.57 -1.44 0.00 0.00 177.06 177.19 1xfw h LYS 511 N 0.00 0.29 0.60 -1.09 2.10 -1.98 -3.21 116.57 113.27 1xfw h LYS 511 Ca 0.10 -0.49 -0.03 0.00 -2.00 0.00 0.00 60.65 58.23 1xfw h LYS 511 Cb 1.39 0.18 0.01 0.00 -0.90 0.00 0.00 32.23 32.91 1xfw h LYS 511 CO -0.00 1.23 -0.29 0.93 -2.00 0.00 0.00 179.45 179.32 1xfw h GLU 512 N 0.01 -0.78 -0.01 0.07 5.08 -0.68 0.67 114.58 118.94 1xfw h GLU 512 Ca -0.39 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 1xfw h GLU 512 Cb 2.00 0.18 -0.00 0.00 0.50 0.00 0.00 28.75 31.43 1xfw h GLU 512 CO 0.10 -0.50 0.11 2.35 -1.00 0.00 0.00 179.01 180.07 1xfw h TRP 513 N -0.85 0.00 0.02 4.33 7.01 -1.74 -2.24 115.95 122.48 1xfw h TRP 513 Ca -0.08 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 60.92 1xfw h TRP 513 Cb 0.64 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.70 1xfw h TRP 513 CO -0.03 0.00 -0.01 -0.44 -2.79 0.00 0.00 178.44 175.17 1xfw h ASP 514 N 0.00 -0.02 0.00 2.65 3.45 -1.25 -3.12 116.42 118.13 1xfw h ASP 514 Ca 0.01 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.47 1xfw h ASP 514 Cb 0.23 0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.01 1xfw h ASP 514 CO -0.00 0.21 0.35 1.17 -1.57 0.00 0.00 179.24 179.40 1xfw n LYS 515 N -3.37 0.02 -0.10 3.56 4.81 0.22 -1.18 118.16 122.13 1xfw n LYS 515 Ca -0.00 0.29 -0.24 0.00 -0.87 0.00 0.00 58.31 57.49 1xfw n LYS 515 Cb 0.01 -1.90 -0.12 0.00 0.02 0.00 0.00 35.03 33.04 1xfw n LYS 515 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1xfw n VAL 516 N -1.41 1.57 0.16 3.15 0.31 -0.90 -4.44 118.33 116.78 1xfw n VAL 516 Ca -0.00 -0.24 0.02 0.00 -0.01 0.00 0.00 64.34 64.11 1xfw n VAL 516 Cb 0.35 -1.92 0.24 0.00 -0.91 0.00 0.00 33.84 31.60 1xfw n VAL 516 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 1xfw h VAL 517 N -0.79 1.16 0.00 2.52 -1.51 -1.08 -3.18 116.25 113.37 1xfw h VAL 517 Ca -0.47 -1.86 0.00 0.00 -1.23 0.00 0.00 66.70 63.15 1xfw h VAL 517 Cb 1.53 2.06 0.00 0.00 -2.13 0.00 0.00 31.29 32.75 1xfw h VAL 517 CO -0.22 0.49 0.00 0.59 -1.23 0.00 0.00 177.57 177.21 1xfw n ASN 518 N -3.64 4.22 -4.53 4.19 5.03 -0.87 -4.79 115.26 114.87 1xfw n ASN 518 Ca -0.01 -2.11 -0.30 0.00 0.87 0.00 0.00 54.58 53.03 1xfw n ASN 518 Cb 0.57 -0.88 -0.11 0.00 -1.02 0.00 0.00 39.78 38.34 1xfw n ASN 518 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 1xfw s THR 519 N 0.36 3.14 -0.03 3.41 -1.32 -1.21 -5.02 115.64 114.98 1xfw s THR 519 Ca 0.00 -1.21 -0.11 0.00 -1.21 0.00 0.00 61.69 59.16 1xfw s THR 519 Cb 0.00 -2.41 -0.06 0.00 -1.51 0.00 0.00 72.50 68.52 1xfw s THR 519 CO 0.00 0.22 0.57 1.55 -2.21 0.00 0.00 174.62 174.75 1xfw h PRO 520 N 4.05 -0.39 -5.86 7.08 0.13 -1.91 -3.45 132.00 131.63 1xfw h PRO 520 Ca -0.49 0.03 -0.67 0.00 -0.87 0.00 0.00 66.00 64.00 1xfw h PRO 520 Cb 1.16 0.09 -0.03 0.00 0.13 0.00 0.00 31.00 32.35 1xfw h PRO 520 CO 0.50 -0.26 1.44 -1.71 -0.23 0.00 0.00 178.00 177.74 1xfw n ASN 521 N -4.32 1.53 -0.15 1.44 2.85 -1.26 -4.82 115.26 110.53 1xfw n ASN 521 Ca -0.05 0.41 0.12 0.00 -0.11 0.00 0.00 54.58 54.95 1xfw n ASN 521 Cb 0.16 -1.14 0.46 0.00 1.24 0.00 0.00 39.78 40.50 1xfw n ASN 521 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 1xfw h SER 522 N 11.75 0.47 -0.01 1.20 0.02 -1.99 0.87 113.55 125.86 1xfw h SER 522 Ca -0.19 0.02 -0.16 0.00 -0.84 0.00 0.00 61.79 60.61 1xfw h SER 522 Cb 1.35 -0.08 0.01 0.00 0.14 0.00 0.00 62.40 63.82 1xfw h SER 522 CO 1.09 0.27 -0.62 0.25 -1.14 0.00 0.00 176.83 176.68 1xfw h LEU 523 N 0.51 0.56 -1.10 5.07 5.85 -1.99 -3.26 115.31 120.96 1xfw h LEU 523 Ca 0.34 -0.75 -0.04 0.00 0.84 0.00 0.00 57.88 58.28 1xfw h LEU 523 Cb 0.62 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1xfw h LEU 523 CO -0.11 1.23 -0.17 -0.08 -0.34 0.00 0.00 178.44 178.97 1xfw h GLU 524 N -0.05 0.00 0.00 1.25 4.81 -1.80 -2.27 114.58 116.52 1xfw h GLU 524 Ca -0.07 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1xfw h GLU 524 Cb 1.32 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.70 1xfw h GLU 524 CO 0.12 0.17 0.00 1.17 -0.73 0.00 0.00 179.01 179.74 1xfw n LYS 525 N -3.30 0.12 -0.08 1.92 0.00 0.25 -0.65 118.16 116.41 1xfw n LYS 525 Ca 0.01 0.28 -0.07 0.00 0.00 0.00 0.00 58.31 58.52 1xfw n LYS 525 Cb 0.42 -1.69 -0.03 0.00 0.00 0.00 0.00 35.03 33.72 1xfw n LYS 525 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 1xfw n GLN 526 N -1.90 0.47 -0.26 1.64 7.27 -0.88 -3.24 117.38 120.49 1xfw n GLN 526 Ca 0.04 0.52 0.03 0.00 0.07 0.00 0.00 57.00 57.66 1xfw n GLN 526 Cb 0.25 -1.69 0.12 0.00 2.41 0.00 0.00 30.24 31.34 1xfw n GLN 526 CO 0.00 0.00 0.00 -0.22 0.07 0.00 0.00 177.06 176.91 1xfw h LYS 527 N -1.00 0.04 -0.42 3.69 3.64 -1.42 0.53 116.57 121.62 1xfw h LYS 527 Ca -0.05 -0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.39 1xfw h LYS 527 Cb 0.65 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.40 1xfw h LYS 527 CO -0.03 0.03 0.10 0.78 -2.27 0.00 0.00 179.45 178.06 1xfw h GLY 528 N 0.04 0.52 0.40 5.01 0.00 -1.05 -0.96 103.07 107.03 1xfw h GLY 528 Ca 0.39 -0.04 -0.02 0.00 0.00 0.00 0.00 47.33 47.66 1xfw h GLY 528 CO -0.73 -0.03 -0.19 -2.08 0.00 0.00 0.00 176.54 173.51 1xfw h VAL 529 N 0.24 0.00 -0.95 4.60 2.07 -0.11 -2.08 116.25 120.03 1xfw h VAL 529 Ca 0.20 -0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.90 1xfw h VAL 529 Cb 0.24 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 29.84 1xfw h VAL 529 CO -0.25 0.00 -0.28 0.41 0.02 0.00 0.00 177.57 177.47 1xfw n THR 530 N -3.45 -0.43 -0.16 2.57 -1.04 0.71 0.19 114.28 112.67 1xfw n THR 530 Ca -0.07 2.18 0.05 0.00 -2.04 0.00 0.00 64.05 64.17 1xfw n THR 530 Cb 0.21 -2.97 0.34 0.00 -1.82 0.00 0.00 70.33 66.09 1xfw n THR 530 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 1xfw h ASN 531 N 0.00 0.67 -0.01 8.00 2.35 -1.12 0.43 115.58 125.91 1xfw h ASN 531 Ca 0.41 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 56.15 1xfw h ASN 531 Cb 0.65 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.86 1xfw h ASN 531 CO -0.96 0.46 0.00 -0.07 -1.65 0.00 0.00 177.43 175.21 1xfw h LEU 532 N 0.78 0.02 -0.79 1.61 3.38 0.28 0.87 115.31 121.46 1xfw h LEU 532 Ca 0.28 -0.25 0.12 0.00 0.09 0.00 0.00 57.88 58.11 1xfw h LEU 532 Cb 0.12 -0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.78 1xfw h LEU 532 CO -0.08 0.26 0.41 0.25 0.09 0.00 0.00 178.44 179.37 1xfw h LEU 533 N -0.23 0.52 0.29 1.67 6.46 0.10 0.27 115.31 124.38 1xfw h LEU 533 Ca 0.00 0.07 -0.01 0.00 -0.12 0.00 0.00 57.88 57.82 1xfw h LEU 533 Cb 0.25 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.17 1xfw h LEU 533 CO 0.00 0.26 -0.14 0.40 -0.62 0.00 0.00 178.44 178.35 1xfw h ILE 534 N 0.64 0.72 -0.77 4.05 2.04 0.21 0.41 117.51 124.82 1xfw h ILE 534 Ca 0.41 -0.65 0.02 0.00 1.00 0.00 0.00 64.86 65.63 1xfw h ILE 534 Cb 0.49 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 1xfw h ILE 534 CO -0.31 0.13 0.51 0.50 0.00 0.00 0.00 178.15 178.98 1xfw h LYS 535 N -0.76 0.97 0.00 2.37 3.11 0.13 0.13 116.57 122.52 1xfw h LYS 535 Ca -0.04 -0.06 0.00 0.00 -2.81 0.00 0.00 60.65 57.74 1xfw h LYS 535 Cb 0.50 -0.22 0.00 0.00 -1.00 0.00 0.00 32.23 31.51 1xfw h LYS 535 CO 0.06 0.64 -1.06 0.66 -2.81 0.00 0.00 179.45 176.95 1xfw n TYR 536 N -4.43 0.01 0.00 1.91 4.01 0.91 -4.65 117.16 114.91 1xfw n TYR 536 Ca 0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.83 1xfw n TYR 536 Cb 0.07 -0.06 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 1xfw n TYR 536 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1xfw n GLY 537 N 1.48 0.00 0.14 2.72 0.00 0.14 -4.81 105.19 104.86 1xfw n GLY 537 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.84 1xfw n GLY 537 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1xfw h ILE 538 N 0.00 0.82 -2.45 -0.61 2.04 -1.20 -3.48 117.51 112.63 1xfw h ILE 538 Ca 0.00 -2.46 -0.60 0.00 1.00 0.00 0.00 64.86 62.79 1xfw h ILE 538 Cb 0.78 2.66 0.14 0.00 -0.74 0.00 0.00 36.82 39.66 1xfw h ILE 538 CO 0.00 0.87 -0.33 1.21 0.00 0.00 0.00 178.15 179.90 1xfw n GLU 539 N -3.53 0.66 -3.58 2.37 2.13 -0.03 -4.96 120.64 113.70 1xfw n GLU 539 Ca -0.27 0.24 -0.25 0.00 0.66 0.00 0.00 57.16 57.55 1xfw n GLU 539 Cb 1.06 -1.58 -0.16 0.00 0.27 0.00 0.00 31.44 31.03 1xfw n GLU 539 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1xfw s ARG 540 N -1.66 0.09 0.37 5.31 0.52 -1.26 -4.46 118.95 117.87 1xfw s ARG 540 Ca 0.64 -0.04 0.01 0.00 -0.52 0.00 0.00 55.73 55.81 1xfw s ARG 540 Cb -0.59 -1.68 -0.02 0.00 0.52 0.00 0.00 34.95 33.18 1xfw s ARG 540 CO 0.58 -0.68 0.57 0.15 0.02 0.00 0.00 175.30 175.93 1xfw s LYS 541 N 2.18 3.32 0.03 3.54 -0.14 -1.24 -4.88 119.74 122.55 1xfw s LYS 541 Ca 0.03 -0.47 -0.01 0.00 -1.36 0.00 0.00 55.97 54.17 1xfw s LYS 541 Cb -0.16 -2.66 0.01 0.00 -1.68 0.00 0.00 37.83 33.34 1xfw s LYS 541 CO -0.11 0.02 0.05 -0.35 -0.76 0.00 0.00 175.35 174.20 1xfw n PRO 542 N -1.84 0.05 -3.62 -1.68 -0.04 -1.26 -2.50 135.00 124.10 1xfw n PRO 542 Ca -0.03 -0.08 -0.12 0.00 -0.04 0.00 0.00 63.50 63.24 1xfw n PRO 542 Cb 0.57 -0.05 -0.07 0.00 -0.04 0.00 0.00 33.50 33.91 1xfw n PRO 542 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1xfw s ASP 543 N -1.18 -0.57 0.25 3.54 -1.08 -0.25 -4.74 116.67 112.65 1xfw s ASP 543 Ca 0.03 1.06 -0.03 0.00 -0.52 0.00 0.00 52.55 53.08 1xfw s ASP 543 Cb -0.00 1.06 0.42 0.00 -1.46 0.00 0.00 42.92 42.94 1xfw s ASP 543 CO 0.02 -0.23 1.81 0.77 0.52 0.00 0.00 175.17 178.07 1xfw h SER 544 N 4.35 0.71 0.00 -0.34 4.64 -1.99 -3.36 113.55 117.55 1xfw h SER 544 Ca -0.28 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 1xfw h SER 544 Cb 1.17 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1xfw h SER 544 CO 0.11 0.40 -0.99 0.35 -0.87 0.00 0.00 176.83 175.83 1xfw n THR 545 N -4.73 0.00 -0.24 2.95 -2.24 -1.26 -4.86 114.28 103.90 1xfw n THR 545 Ca 0.14 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.81 1xfw n THR 545 Cb 0.29 -0.68 0.12 0.00 -2.10 0.00 0.00 70.33 67.96 1xfw n THR 545 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1xfw n LYS 546 N -2.58 1.94 0.00 -0.78 5.02 -1.26 -4.82 118.16 115.68 1xfw n LYS 546 Ca 0.00 -1.72 0.00 0.00 -2.02 0.00 0.00 58.31 54.57 1xfw n LYS 546 Cb 0.49 -1.71 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 1xfw n LYS 546 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xfw n GLY 547 N -0.31 0.51 3.10 0.72 0.00 -1.26 -1.22 105.19 106.73 1xfw n GLY 547 Ca 0.31 -0.90 -0.33 0.00 0.00 0.00 0.00 46.02 45.11 1xfw n GLY 547 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xfw s THR 548 N 0.00 2.36 0.19 2.61 2.01 -1.26 -1.09 115.64 120.46 1xfw s THR 548 Ca 0.00 -1.51 -0.14 0.00 0.31 0.00 0.00 61.69 60.35 1xfw s THR 548 Cb 0.00 -2.35 0.01 0.00 0.01 0.00 0.00 72.50 70.17 1xfw s THR 548 CO 0.00 0.01 0.43 -1.48 -0.69 0.00 0.00 174.62 172.89 1xfw s LEU 549 N 1.15 0.44 1.38 4.42 2.34 -1.04 -4.47 118.68 122.90 1xfw s LEU 549 Ca -0.07 -0.68 -0.22 0.00 0.06 0.00 0.00 54.13 53.22 1xfw s LEU 549 Cb -0.19 1.75 0.35 0.00 -0.56 0.00 0.00 46.19 47.54 1xfw s LEU 549 CO -0.05 -1.01 0.97 -0.55 -1.06 0.00 0.00 176.35 174.66 1xfw s SER 550 N -2.92 -0.69 -0.15 1.48 0.15 -1.26 -3.60 113.70 106.71 1xfw s SER 550 Ca 0.14 0.77 -0.16 0.00 0.70 0.00 0.00 55.95 57.39 1xfw s SER 550 Cb 0.01 -1.06 -0.13 0.00 -1.71 0.00 0.00 66.02 63.12 1xfw s SER 550 CO -0.00 -5.12 0.24 0.78 1.20 0.00 0.00 173.24 170.34 1xfw h ASN 551 N -3.26 0.00 -0.08 5.45 -0.26 -1.92 -3.12 115.58 112.39 1xfw h ASN 551 Ca -0.43 -0.42 -0.01 0.00 -0.56 0.00 0.00 56.30 54.88 1xfw h ASN 551 Cb 1.33 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.58 1xfw h ASN 551 CO 0.28 0.96 0.03 4.11 -1.06 0.00 0.00 177.43 181.75 1xfw h TRP 552 N -1.00 0.15 -0.86 1.19 5.08 -1.94 0.11 115.95 118.68 1xfw h TRP 552 Ca -0.09 -0.00 0.06 0.00 1.08 0.00 0.00 58.89 59.94 1xfw h TRP 552 Cb 0.74 -0.05 -0.06 0.00 -3.00 0.00 0.00 29.16 26.79 1xfw h TRP 552 CO 0.06 0.14 0.56 1.96 -1.28 0.00 0.00 178.44 179.88 1xfw h GLN 553 N 0.16 0.93 0.13 0.12 4.20 -1.93 0.76 115.11 119.48 1xfw h GLN 553 Ca 0.04 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 1xfw h GLN 553 Cb 0.06 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 27.63 1xfw h GLN 553 CO -0.00 0.62 -0.06 -0.22 -0.67 0.00 0.00 178.83 178.49 1xfw h LYS 554 N 0.96 -0.17 -0.84 1.46 3.64 -0.75 0.25 116.57 121.12 1xfw h LYS 554 Ca 0.37 0.01 0.18 0.00 -1.27 0.00 0.00 60.65 59.94 1xfw h LYS 554 Cb 0.21 0.04 -0.11 0.00 -0.41 0.00 0.00 32.23 31.96 1xfw h LYS 554 CO -0.13 0.25 0.35 -0.56 -2.27 0.00 0.00 179.45 177.08 1xfw h GLN 555 N -0.67 0.41 -0.32 1.90 3.07 -0.37 0.78 115.11 119.92 1xfw h GLN 555 Ca -0.02 -0.02 -0.01 0.00 0.09 0.00 0.00 58.65 58.68 1xfw h GLN 555 Cb 0.50 -0.09 -0.01 0.00 0.08 0.00 0.00 27.48 27.95 1xfw h GLN 555 CO 0.03 0.27 0.14 1.98 0.09 0.00 0.00 178.83 181.35 1xfw h MET 556 N 0.43 0.46 -0.16 0.06 4.05 0.65 -1.63 114.93 118.79 1xfw h MET 556 Ca 0.49 -0.07 0.05 0.00 -0.28 0.00 0.00 59.70 59.89 1xfw h MET 556 Cb 0.85 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.57 1xfw h MET 556 CO -0.48 0.44 0.18 1.25 0.23 0.00 0.00 176.91 178.54 1xfw h LEU 557 N 0.37 0.00 0.07 3.39 5.85 0.40 -2.29 115.31 123.10 1xfw h LEU 557 Ca 0.11 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 1xfw h LEU 557 Cb 0.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1xfw h LEU 557 CO -0.01 0.00 -0.04 0.44 -0.34 0.00 0.00 178.44 178.49 1xfw h ASP 558 N 0.00 -0.08 -1.65 1.25 3.32 0.37 -3.23 116.42 116.39 1xfw h ASP 558 Ca 0.08 0.00 0.48 0.00 0.02 0.00 0.00 57.03 57.61 1xfw h ASP 558 Cb 0.44 0.02 -0.07 0.00 0.22 0.00 0.00 39.33 39.95 1xfw h ASP 558 CO -0.00 0.24 1.28 0.03 -1.72 0.00 0.00 179.24 179.08 1xfw h ARG 559 N -0.71 0.00 -0.02 3.56 2.47 -1.08 0.73 114.38 119.34 1xfw h ARG 559 Ca -0.01 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.70 1xfw h ARG 559 Cb 0.08 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.40 1xfw h ARG 559 CO 0.02 0.00 -0.03 -0.07 0.56 0.00 0.00 179.97 180.45 1xfw h LEU 560 N 0.00 0.05 -0.39 3.04 3.38 -1.52 -1.95 115.31 117.92 1xfw h LEU 560 Ca 0.78 -0.56 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 1xfw h LEU 560 Cb 3.34 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 44.06 1xfw h LEU 560 CO -0.01 0.60 0.13 0.78 0.09 0.00 0.00 178.44 180.03 1xfw h ASN 561 N -0.49 0.57 0.73 -0.43 2.35 0.41 -1.69 115.58 117.02 1xfw h ASN 561 Ca 0.00 -0.20 -0.03 0.00 -0.55 0.00 0.00 56.30 55.52 1xfw h ASN 561 Cb 0.59 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.81 1xfw h ASN 561 CO 0.01 0.61 -0.16 1.05 -1.65 0.00 0.00 177.43 177.28 1xfw h GLU 562 N 0.49 0.00 0.00 0.81 4.11 -1.36 -2.68 114.58 115.96 1xfw h GLU 562 Ca 0.13 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.31 1xfw h GLU 562 Cb 0.24 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.51 1xfw h GLU 562 CO -0.01 0.16 -0.99 0.00 0.07 0.00 0.00 179.01 178.25 1xfw h ALA 563 N 1.84 0.12 -0.15 1.06 0.00 -0.98 -2.97 119.26 118.17 1xfw h ALA 563 Ca -0.00 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 54.23 1xfw h ALA 563 Cb 0.57 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1xfw h ALA 563 CO 0.02 0.64 0.00 1.33 0.00 0.00 0.00 179.25 181.24 1xfw n VAL 564 N -3.91 0.47 -0.07 0.00 0.24 -0.67 -3.42 118.33 110.97 1xfw n VAL 564 Ca -0.11 -0.28 -0.09 0.00 -2.04 0.00 0.00 64.34 61.82 1xfw n VAL 564 Cb 0.86 -0.22 -0.06 0.00 -1.47 0.00 0.00 33.84 32.94 1xfw n VAL 564 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1xfw n LYS 565 N 0.08 0.56 0.00 7.34 3.00 -1.05 -3.43 118.16 124.67 1xfw n LYS 565 Ca 0.06 0.07 0.04 0.00 -0.00 0.00 0.00 58.31 58.48 1xfw n LYS 565 Cb 0.33 -1.27 0.22 0.00 0.00 0.00 0.00 35.03 34.32 1xfw n LYS 565 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1xfw n TYR 566 N -2.84 0.00 -0.09 5.64 0.53 -1.13 -1.92 117.16 117.35 1xfw n TYR 566 Ca -0.23 0.00 -0.18 0.00 -1.02 0.00 0.00 57.90 56.47 1xfw n TYR 566 Cb 0.76 0.00 -0.13 0.00 -1.03 0.00 0.00 39.34 38.95 1xfw n TYR 566 CO 0.00 0.00 0.00 -2.37 -1.02 0.00 0.00 176.86 173.47 1xfw n THR 567 N -0.65 1.56 0.00 -0.72 5.66 -1.25 -5.02 114.28 113.86 1xfw n THR 567 Ca 0.06 -0.62 0.00 0.00 -3.05 0.00 0.00 64.05 60.44 1xfw n THR 567 Cb 0.03 -1.42 0.00 0.00 -1.55 0.00 0.00 70.33 67.38 1xfw n THR 567 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1xfw n GLY 568 N 2.14 0.29 3.82 1.09 0.00 -0.81 -5.14 105.19 106.59 1xfw n GLY 568 Ca -0.41 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.25 1xfw n GLY 568 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1xfw s TYR 569 N -0.29 3.65 -0.11 1.61 5.04 -1.22 -5.00 117.35 121.04 1xfw s TYR 569 Ca 0.00 1.27 0.15 0.00 -2.44 0.00 0.00 57.07 56.05 1xfw s TYR 569 Cb 0.00 -2.53 0.24 0.00 0.35 0.00 0.00 41.96 40.02 1xfw s TYR 569 CO 0.00 0.39 1.12 0.25 -1.34 0.00 0.00 175.55 175.98 1xfw n THR 570 N 0.86 1.49 -0.28 4.34 -2.24 -1.26 -4.69 114.28 112.50 1xfw n THR 570 Ca -0.04 -1.84 0.04 0.00 -2.27 0.00 0.00 64.05 59.94 1xfw n THR 570 Cb 0.51 -0.07 0.11 0.00 -2.10 0.00 0.00 70.33 68.78 1xfw n THR 570 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xfw n GLY 571 N -1.10 3.18 2.87 3.38 0.00 -1.25 -4.95 105.19 107.32 1xfw n GLY 571 Ca 0.13 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1xfw n GLY 571 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xfw n GLY 572 N -0.15 1.27 3.90 -0.02 0.00 -1.26 -4.65 105.19 104.27 1xfw n GLY 572 Ca 0.09 -0.92 -0.29 0.00 0.00 0.00 0.00 46.02 44.89 1xfw n GLY 572 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xfw s ASP 573 N -4.00 6.46 0.00 1.61 1.11 -1.26 -4.90 116.67 115.69 1xfw s ASP 573 Ca 0.00 0.78 0.00 0.00 0.18 0.00 0.00 52.55 53.51 1xfw s ASP 573 Cb 0.00 -2.17 0.00 0.00 1.07 0.00 0.00 42.92 41.82 1xfw s ASP 573 CO 0.00 -0.23 0.61 0.55 1.18 0.00 0.00 175.17 177.28 1xfw n VAL 574 N -0.98 0.33 -3.70 -1.27 3.14 -1.26 -4.54 118.33 110.04 1xfw n VAL 574 Ca -0.01 -0.57 -0.28 0.00 -2.96 0.00 0.00 64.34 60.52 1xfw n VAL 574 Cb 0.54 0.95 -0.16 0.00 -1.06 0.00 0.00 33.84 34.11 1xfw n VAL 574 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 1xfw s VAL 575 N -0.33 0.43 -0.62 1.55 1.01 -1.26 -1.25 120.40 119.93 1xfw s VAL 575 Ca 0.00 -0.60 0.22 0.00 0.00 0.00 0.00 61.98 61.60 1xfw s VAL 575 Cb 0.00 -1.03 -0.24 0.00 0.00 0.00 0.00 36.38 35.12 1xfw s VAL 575 CO 0.00 -0.30 0.80 0.59 0.00 0.00 0.00 175.10 176.19 1xfw n ASN 576 N 5.08 0.60 -3.90 3.32 5.03 -1.26 -4.96 115.26 119.17 1xfw n ASN 576 Ca -0.08 -0.51 -0.09 0.00 0.87 0.00 0.00 54.58 54.77 1xfw n ASN 576 Cb 0.47 1.26 -0.05 0.00 -1.02 0.00 0.00 39.78 40.44 1xfw n ASN 576 CO 0.00 0.00 0.00 -1.38 -1.83 0.00 0.00 177.26 174.05 1xfw s HIS 577 N -3.20 0.34 1.14 3.10 -3.43 -1.26 -4.43 115.29 107.55 1xfw s HIS 577 Ca 0.02 -0.72 -0.17 0.00 -0.80 0.00 0.00 55.06 53.40 1xfw s HIS 577 Cb 0.15 0.25 0.23 0.00 -1.43 0.00 0.00 32.58 31.78 1xfw s HIS 577 CO 0.87 -1.05 0.47 0.41 -2.00 0.00 0.00 174.74 173.44 1xfw n GLY 578 N -0.41 -2.84 3.73 -1.38 0.00 -0.36 -4.75 105.19 99.19 1xfw n GLY 578 Ca -0.02 -1.06 -0.41 0.00 0.00 0.00 0.00 46.02 44.53 1xfw n GLY 578 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1xfw s THR 579 N -2.11 3.77 0.61 2.61 -4.23 -1.26 -4.66 115.64 110.38 1xfw s THR 579 Ca 0.47 1.44 0.02 0.00 -1.18 0.00 0.00 61.69 62.43 1xfw s THR 579 Cb -0.09 -3.92 0.02 0.00 1.34 0.00 0.00 72.50 69.85 1xfw s THR 579 CO 0.43 0.21 1.01 -0.08 -0.54 0.00 0.00 174.62 175.64 1xfw h GLU 580 N 5.59 0.00 -0.96 3.99 4.57 -0.62 0.86 114.58 128.02 1xfw h GLU 580 Ca -0.44 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.74 1xfw h GLU 580 Cb 1.21 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.80 1xfw h GLU 580 CO 0.76 0.00 0.00 1.04 -1.18 0.00 0.00 179.01 179.63 1xfw n GLN 581 N -2.41 0.93 0.00 1.92 1.13 -1.24 -1.30 117.38 116.41 1xfw n GLN 581 Ca -0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1xfw n GLN 581 Cb 0.93 -1.40 0.00 0.00 0.11 0.00 0.00 30.24 29.88 1xfw n GLN 581 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1xfw n ASP 582 N 0.12 0.06 -3.49 1.08 8.00 0.29 -3.96 116.55 118.66 1xfw n ASP 582 Ca 0.00 -0.48 -0.39 0.00 0.71 0.00 0.00 54.79 54.63 1xfw n ASP 582 Cb 0.27 0.08 -0.02 0.00 -0.02 0.00 0.00 41.12 41.43 1xfw n ASP 582 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1xfw n ASN 583 N -0.08 5.76 -0.23 -2.24 5.15 -0.42 -4.53 115.26 118.67 1xfw n ASN 583 Ca 0.00 -2.66 -0.06 0.00 -0.60 0.00 0.00 54.58 51.26 1xfw n ASN 583 Cb 0.10 -1.50 0.09 0.00 -0.53 0.00 0.00 39.78 37.94 1xfw n ASN 583 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 1xfw h GLU 584 N 5.85 1.07 0.00 1.20 5.08 -1.89 -2.45 114.58 123.44 1xfw h GLU 584 Ca 0.67 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.79 1xfw h GLU 584 Cb 0.45 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1xfw h GLU 584 CO 1.81 0.93 0.00 0.39 -1.00 0.00 0.00 179.01 181.14 1xfw n GLU 585 N -4.25 0.00 -2.84 2.33 -0.58 -1.26 -4.26 120.64 109.78 1xfw n GLU 585 Ca 0.05 0.50 -0.29 0.00 -0.42 0.00 0.00 57.16 57.01 1xfw n GLU 585 Cb 0.24 -1.42 -0.03 0.00 -0.57 0.00 0.00 31.44 29.66 1xfw n GLU 585 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 1xfw n PHE 586 N -1.90 3.85 -1.69 -0.32 3.01 -1.25 -3.05 117.46 116.11 1xfw n PHE 586 Ca 0.00 -3.73 -0.41 0.00 1.01 0.00 0.00 57.45 54.31 1xfw n PHE 586 Cb 0.00 -0.52 0.01 0.00 -0.01 0.00 0.00 39.48 38.96 1xfw n PHE 586 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1xfw n PRO 587 N -0.26 1.95 -4.82 -1.08 -0.04 -0.92 -4.97 135.00 124.86 1xfw n PRO 587 Ca 0.34 0.69 -0.25 0.00 -0.04 0.00 0.00 63.50 64.24 1xfw n PRO 587 Cb 0.41 -2.34 -0.16 0.00 -0.04 0.00 0.00 33.50 31.37 1xfw n PRO 587 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1xfw s GLU 588 N -2.09 1.58 -0.79 0.54 0.41 -1.26 -4.99 118.70 112.09 1xfw s GLU 588 Ca 0.59 -0.60 -0.18 0.00 -0.41 0.00 0.00 54.97 54.37 1xfw s GLU 588 Cb -0.53 -1.44 0.13 0.00 -1.78 0.00 0.00 34.13 30.52 1xfw s GLU 588 CO 0.59 0.30 0.93 0.21 -0.49 0.00 0.00 175.26 176.80 1xfw s LYS 589 N -0.16 3.41 -0.03 1.61 2.20 -1.26 -5.04 119.74 120.47 1xfw s LYS 589 Ca 0.01 -1.69 -0.20 0.00 -0.36 0.00 0.00 55.97 53.73 1xfw s LYS 589 Cb -0.09 -4.58 -0.05 0.00 -1.51 0.00 0.00 37.83 31.60 1xfw s LYS 589 CO 0.01 -1.63 0.59 -0.51 -0.36 0.00 0.00 175.35 173.45 1xfw s ASP 590 N 3.35 6.93 0.00 1.43 1.01 -1.26 -5.01 116.67 123.12 1xfw s ASP 590 Ca 0.23 1.11 0.00 0.00 0.71 0.00 0.00 52.55 54.60 1xfw s ASP 590 Cb -0.12 -2.36 0.00 0.00 1.01 0.00 0.00 42.92 41.45 1xfw s ASP 590 CO -0.03 0.06 0.31 0.59 0.21 0.00 0.00 175.17 176.30 1xfw n ASN 591 N 3.02 0.00 -4.76 0.27 3.02 -1.26 -4.62 115.26 110.93 1xfw n ASN 591 Ca -0.06 0.38 -0.41 0.00 -0.03 0.00 0.00 54.58 54.46 1xfw n ASN 591 Cb 0.51 -0.14 -0.03 0.00 -0.61 0.00 0.00 39.78 39.52 1xfw n ASN 591 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1xfw s GLU 592 N -0.90 4.39 -0.08 3.52 2.02 -1.26 -3.93 118.70 122.47 1xfw s GLU 592 Ca 0.00 2.14 -0.03 0.00 0.02 0.00 0.00 54.97 57.10 1xfw s GLU 592 Cb 0.00 -3.11 0.04 0.00 0.10 0.00 0.00 34.13 31.15 1xfw s GLU 592 CO 0.00 -0.18 0.07 0.42 0.02 0.00 0.00 175.26 175.59 1xfw s ILE 593 N -0.77 -0.09 0.18 -1.63 -1.09 -1.25 -4.42 121.20 112.14 1xfw s ILE 593 Ca 0.51 0.25 -0.30 0.00 -2.23 0.00 0.00 60.65 58.88 1xfw s ILE 593 Cb -0.38 -0.28 -0.08 0.00 -1.58 0.00 0.00 42.46 40.14 1xfw s ILE 593 CO 0.47 0.04 1.12 0.12 -1.23 0.00 0.00 174.94 175.47 1xfw s PHE 594 N 2.16 3.55 0.28 3.97 5.36 -1.15 -1.23 117.98 130.92 1xfw s PHE 594 Ca 0.04 1.56 0.04 0.00 -0.96 0.00 0.00 56.93 57.62 1xfw s PHE 594 Cb -0.13 -3.31 -0.06 0.00 -0.34 0.00 0.00 43.02 39.18 1xfw s PHE 594 CO -0.05 -0.74 0.00 0.42 -1.46 0.00 0.00 175.22 173.40 1xfw s ILE 595 N -0.20 1.26 -0.38 3.12 1.01 0.28 -0.98 121.20 125.31 1xfw s ILE 595 Ca 0.50 -2.05 0.03 0.00 0.00 0.00 0.00 60.65 59.13 1xfw s ILE 595 Cb -0.30 -2.53 0.16 0.00 0.01 0.00 0.00 42.46 39.79 1xfw s ILE 595 CO 0.35 -0.20 0.36 -0.63 0.00 0.00 0.00 174.94 174.82 1xfw s ILE 596 N -3.26 -0.20 0.85 2.92 1.01 -0.58 -1.98 121.20 119.97 1xfw s ILE 596 Ca 0.32 -1.35 -0.14 0.00 0.00 0.00 0.00 60.65 59.47 1xfw s ILE 596 Cb 0.06 -0.78 0.02 0.00 0.01 0.00 0.00 42.46 41.77 1xfw s ILE 596 CO 0.12 -0.71 0.54 -0.46 0.00 0.00 0.00 174.94 174.43 1xfw n ASN 597 N 3.92 -1.41 -0.48 3.58 0.23 -1.16 -3.29 115.26 116.65 1xfw n ASN 597 Ca 0.14 0.45 0.00 0.00 -0.53 0.00 0.00 54.58 54.64 1xfw n ASN 597 Cb 0.45 -1.25 0.00 0.00 -2.08 0.00 0.00 39.78 36.90 1xfw n ASN 597 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 1xfw n PRO 598 N -1.55 0.00 0.00 -0.53 -0.04 -1.26 -2.07 135.00 129.55 1xfw n PRO 598 Ca 0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1xfw n PRO 598 Cb 0.52 -0.96 0.00 0.00 -0.04 0.00 0.00 33.50 33.01 1xfw n PRO 598 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1xfw n GLU 599 N 0.42 0.49 0.00 0.54 1.02 -1.26 -3.90 120.64 117.96 1xfw n GLU 599 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1xfw n GLU 599 Cb 0.00 -0.97 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 1xfw n GLU 599 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xfw n GLY 600 N 3.31 1.08 3.63 0.62 0.00 -0.88 -4.87 105.19 108.08 1xfw n GLY 600 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1xfw n GLY 600 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xfw s GLU 601 N 0.00 3.97 -0.24 1.61 2.02 -1.26 -4.99 118.70 119.81 1xfw s GLU 601 Ca 0.00 -0.35 -0.21 0.00 0.02 0.00 0.00 54.97 54.44 1xfw s GLU 601 Cb 0.00 -3.21 -0.02 0.00 0.10 0.00 0.00 34.13 31.00 1xfw s GLU 601 CO 0.00 0.27 0.65 -0.06 0.02 0.00 0.00 175.26 176.14 1xfw s PHE 602 N 0.37 3.31 -0.11 1.61 2.99 -1.26 -3.00 117.98 121.89 1xfw s PHE 602 Ca 0.03 0.88 0.01 0.00 0.00 0.00 0.00 56.93 57.85 1xfw s PHE 602 Cb -0.12 -2.85 0.02 0.00 0.00 0.00 0.00 43.02 40.06 1xfw s PHE 602 CO 0.00 -0.29 -0.14 0.42 -0.00 0.00 0.00 175.22 175.21 1xfw s ILE 603 N 2.37 1.42 -0.30 0.64 1.01 -0.83 -2.14 121.20 123.36 1xfw s ILE 603 Ca 0.28 -0.59 -0.03 0.00 0.00 0.00 0.00 60.65 60.31 1xfw s ILE 603 Cb -0.16 -1.31 0.04 0.00 0.01 0.00 0.00 42.46 41.05 1xfw s ILE 603 CO 0.09 0.43 0.02 -0.22 0.00 0.00 0.00 174.94 175.26 1xfw s LEU 604 N 1.06 3.94 0.00 2.97 2.96 -1.15 0.99 118.68 129.44 1xfw s LEU 604 Ca -0.05 -1.20 -0.14 0.00 -0.22 0.00 0.00 54.13 52.52 1xfw s LEU 604 Cb -0.15 -1.75 0.21 0.00 0.50 0.00 0.00 46.19 45.01 1xfw s LEU 604 CO -0.02 -0.26 0.62 0.35 -1.32 0.00 0.00 176.35 175.72 1xfw n THR 605 N 4.68 0.00 0.00 3.68 -2.24 -0.37 -3.48 114.28 116.55 1xfw n THR 605 Ca -0.13 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1xfw n THR 605 Cb 0.44 -0.91 0.00 0.00 -2.10 0.00 0.00 70.33 67.76 1xfw n THR 605 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1xfw n LYS 606 N -3.95 1.74 -4.38 -0.78 5.02 -1.26 -3.78 118.16 110.77 1xfw n LYS 606 Ca 0.09 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.19 1xfw n LYS 606 Cb 0.37 -0.16 -0.10 0.00 -0.02 0.00 0.00 35.03 35.12 1xfw n LYS 606 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1xfw s ASN 607 N -0.20 1.93 0.18 4.39 0.01 -1.25 -4.28 114.94 115.71 1xfw s ASN 607 Ca 0.00 -1.33 0.10 0.00 -0.71 0.00 0.00 52.86 50.91 1xfw s ASN 607 Cb 0.00 0.00 -0.10 0.00 0.41 0.00 0.00 41.25 41.56 1xfw s ASN 607 CO 0.00 -0.61 1.35 -0.25 -1.51 0.00 0.00 177.10 176.08 1xfw h TRP 608 N 2.28 0.00 0.12 2.20 2.91 -1.82 -1.73 115.95 119.90 1xfw h TRP 608 Ca -0.39 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 59.62 1xfw h TRP 608 Cb 1.24 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.89 1xfw h TRP 608 CO 0.55 0.83 -0.06 0.93 -1.03 0.00 0.00 178.44 179.66 1xfw h GLU 609 N 0.00 -0.15 -0.80 2.65 3.07 -1.94 -1.70 114.58 115.71 1xfw h GLU 609 Ca -0.01 0.01 0.18 0.00 -0.50 0.00 0.00 59.36 59.05 1xfw h GLU 609 Cb 1.62 0.03 -0.14 0.00 -0.84 0.00 0.00 28.75 29.42 1xfw h GLU 609 CO 0.11 -0.10 -0.02 1.98 -1.40 0.00 0.00 179.01 179.58 1xfw h MET 610 N -0.97 0.07 -0.40 2.33 4.05 -1.94 1.75 114.93 119.82 1xfw h MET 610 Ca -0.02 -0.00 0.05 0.00 -0.28 0.00 0.00 59.70 59.45 1xfw h MET 610 Cb 0.12 -0.02 -0.04 0.00 -0.80 0.00 0.00 31.60 30.86 1xfw h MET 610 CO 0.03 0.05 0.15 1.15 0.23 0.00 0.00 176.91 178.51 1xfw h THR 611 N 0.08 0.89 0.00 -0.77 2.02 -1.38 2.06 112.91 115.80 1xfw h THR 611 Ca 0.44 -0.11 -0.03 0.00 0.77 0.00 0.00 66.41 67.48 1xfw h THR 611 Cb 0.78 0.55 -0.00 0.00 -1.74 0.00 0.00 68.15 67.74 1xfw h THR 611 CO -0.73 0.06 -0.16 1.23 0.37 0.00 0.00 175.52 176.29 1xfw h GLY 612 N 0.31 0.00 1.31 2.16 0.00 0.15 -2.47 103.07 104.53 1xfw h GLY 612 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.19 1xfw h GLY 612 CO -0.18 0.00 -1.46 -0.09 0.00 0.00 0.00 176.54 174.81 1xfw h ARG 613 N 0.00 0.47 0.00 4.80 2.43 0.53 -2.95 114.38 119.67 1xfw h ARG 613 Ca -0.00 -0.81 -0.05 0.00 -0.81 0.00 0.00 59.98 58.30 1xfw h ARG 613 Cb 0.63 0.30 -0.01 0.00 -0.42 0.00 0.00 29.97 30.47 1xfw h ARG 613 CO 0.02 1.39 -0.25 0.35 -1.51 0.00 0.00 179.97 179.96 1xfw h PHE 614 N 0.13 0.00 0.15 2.20 3.57 0.33 -2.54 116.94 120.79 1xfw h PHE 614 Ca -0.24 0.00 -0.29 0.00 3.53 0.00 0.00 57.97 60.97 1xfw h PHE 614 Cb 2.13 0.00 0.02 0.00 2.79 0.00 0.00 35.95 40.89 1xfw h PHE 614 CO 0.11 0.25 -1.28 0.82 -2.23 0.00 0.00 178.31 175.99 1xfw h ILE 615 N 0.00 1.40 -0.23 1.41 2.04 -1.49 -2.32 117.51 118.32 1xfw h ILE 615 Ca -0.00 -2.83 -0.01 0.00 1.00 0.00 0.00 64.86 63.02 1xfw h ILE 615 Cb 0.84 2.89 -0.01 0.00 -0.74 0.00 0.00 36.82 39.80 1xfw h ILE 615 CO 0.03 0.84 0.09 -0.33 0.00 0.00 0.00 178.15 178.78 1xfw h GLU 616 N 0.14 0.35 -0.05 2.37 5.08 -1.38 0.77 114.58 121.85 1xfw h GLU 616 Ca -0.17 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.10 1xfw h GLU 616 Cb 1.98 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 31.18 1xfw h GLU 616 CO 0.23 0.40 -0.07 -0.22 -1.00 0.00 0.00 179.01 178.35 1xfw h LYS 617 N 0.21 0.13 0.00 2.33 3.64 -1.55 -1.20 116.57 120.13 1xfw h LYS 617 Ca 0.08 -0.08 -0.11 0.00 -1.27 0.00 0.00 60.65 59.27 1xfw h LYS 617 Cb 0.19 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 1xfw h LYS 617 CO -0.01 0.64 -2.11 0.09 -2.27 0.00 0.00 179.45 175.79 1xfw n ASN 618 N -4.71 0.00 0.00 4.20 4.13 -0.87 -4.52 115.26 113.48 1xfw n ASN 618 Ca -0.08 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.18 1xfw n ASN 618 Cb 0.32 1.71 0.00 0.00 -1.54 0.00 0.00 39.78 40.28 1xfw n ASN 618 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 1xfw n ILE 619 N -2.40 0.00 0.00 2.41 5.41 0.09 -4.41 119.36 120.46 1xfw n ILE 619 Ca -0.12 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.63 1xfw n ILE 619 Cb 0.74 -0.82 0.00 0.00 -0.71 0.00 0.00 39.64 38.84 1xfw n ILE 619 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1xfw n THR 620 N -1.27 0.00 -0.04 1.39 -1.04 0.25 -0.67 114.28 112.90 1xfw n THR 620 Ca 0.00 0.68 0.00 0.00 -2.04 0.00 0.00 64.05 62.69 1xfw n THR 620 Cb 0.00 -1.00 0.00 0.00 -1.82 0.00 0.00 70.33 67.51 1xfw n THR 620 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xfw n GLY 621 N -0.84 1.89 3.42 3.41 0.00 -0.45 -4.17 105.19 108.44 1xfw n GLY 621 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1xfw n GLY 621 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xfw s LYS 622 N 0.39 1.89 -1.10 1.61 2.47 0.15 -4.87 119.74 120.28 1xfw s LYS 622 Ca 0.00 -2.14 -0.06 0.00 -1.56 0.00 0.00 55.97 52.21 1xfw s LYS 622 Cb 0.00 -0.16 0.30 0.00 -1.46 0.00 0.00 37.83 36.51 1xfw s LYS 622 CO 0.00 -0.59 1.31 -0.25 0.16 0.00 0.00 175.35 175.98 1xfw n ASP 623 N -1.51 6.00 -4.16 1.43 8.00 -1.26 -4.88 116.55 120.17 1xfw n ASP 623 Ca 0.00 -3.24 -0.29 0.00 0.71 0.00 0.00 54.79 51.97 1xfw n ASP 623 Cb 0.63 -1.32 -0.17 0.00 -0.02 0.00 0.00 41.12 40.25 1xfw n ASP 623 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1xfw s TYR 624 N -2.11 2.14 -0.36 1.24 1.51 -1.21 -0.74 117.35 117.82 1xfw s TYR 624 Ca 0.31 -0.82 -0.29 0.00 -1.01 0.00 0.00 57.07 55.26 1xfw s TYR 624 Cb -0.02 -1.46 -0.00 0.00 -0.11 0.00 0.00 41.96 40.37 1xfw s TYR 624 CO 0.02 -0.34 1.52 -1.17 -1.11 0.00 0.00 175.55 174.48 1xfw s LEU 625 N 0.37 3.63 0.12 -1.29 2.96 -0.67 -4.39 118.68 119.41 1xfw s LEU 625 Ca -0.15 1.08 0.07 0.00 -0.22 0.00 0.00 54.13 54.91 1xfw s LEU 625 Cb -0.16 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 1xfw s LEU 625 CO 0.06 -1.45 -0.16 -0.47 -1.32 0.00 0.00 176.35 173.02 1xfw s TYR 626 N 5.66 1.50 -0.08 5.38 5.04 -1.26 -3.81 117.35 129.78 1xfw s TYR 626 Ca 0.67 -0.52 -0.05 0.00 -2.44 0.00 0.00 57.07 54.73 1xfw s TYR 626 Cb -0.18 -0.79 0.04 0.00 0.35 0.00 0.00 41.96 41.38 1xfw s TYR 626 CO 0.32 0.18 0.20 1.52 -1.34 0.00 0.00 175.55 176.42 1xfw s TYR 627 N -1.94 -0.25 0.08 4.97 -0.85 -1.26 -5.05 117.35 113.06 1xfw s TYR 627 Ca 0.09 0.61 -0.02 0.00 -0.52 0.00 0.00 57.07 57.24 1xfw s TYR 627 Cb -0.06 0.02 -0.05 0.00 0.38 0.00 0.00 41.96 42.25 1xfw s TYR 627 CO 0.04 -0.17 0.27 -0.59 -1.52 0.00 0.00 175.55 173.57 1xfw s PHE 628 N 0.86 3.51 -0.44 -3.49 -0.12 -1.26 -4.97 117.98 112.07 1xfw s PHE 628 Ca -0.06 0.36 -0.41 0.00 -0.05 0.00 0.00 56.93 56.77 1xfw s PHE 628 Cb -0.08 -1.85 -0.17 0.00 -0.63 0.00 0.00 43.02 40.29 1xfw s PHE 628 CO -0.05 0.54 1.43 -1.71 -0.05 0.00 0.00 175.22 175.38 1xfw n ASN 629 N 0.27 1.04 -0.20 1.98 4.05 -1.25 -4.82 115.26 116.32 1xfw n ASN 629 Ca -0.04 1.02 0.27 0.00 0.45 0.00 0.00 54.58 56.27 1xfw n ASN 629 Cb 0.51 -0.77 0.68 0.00 1.23 0.00 0.00 39.78 41.43 1xfw n ASN 629 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 177.26 174.24 1xfw h ARG 630 N 4.58 0.08 -0.53 1.20 2.47 -1.95 0.26 114.38 120.49 1xfw h ARG 630 Ca -0.37 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.35 1xfw h ARG 630 Cb 1.20 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.50 1xfw h ARG 630 CO 0.86 0.05 0.00 0.43 0.56 0.00 0.00 179.97 181.88 1xfw n SER 631 N -4.32 2.73 -4.73 7.04 7.64 -1.26 -4.83 113.62 115.89 1xfw n SER 631 Ca 0.19 -2.16 -0.41 0.00 1.01 0.00 0.00 58.87 57.51 1xfw n SER 631 Cb 0.94 -0.38 -0.05 0.00 -1.01 0.00 0.00 64.21 63.71 1xfw n SER 631 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1xfw s TYR 632 N -1.60 3.80 0.00 1.43 4.12 0.90 -2.89 117.35 123.11 1xfw s TYR 632 Ca 0.30 1.78 0.00 0.00 0.02 0.00 0.00 57.07 59.17 1xfw s TYR 632 Cb 0.18 -3.08 0.00 0.00 -1.52 0.00 0.00 41.96 37.54 1xfw s TYR 632 CO 0.17 0.11 0.00 0.09 0.02 0.00 0.00 175.55 175.94 1xfw n ASN 633 N 2.59 0.00 -4.77 2.29 3.02 0.82 -4.88 115.26 114.32 1xfw n ASN 633 Ca 0.02 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.25 1xfw n ASN 633 Cb 0.48 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.58 1xfw n ASN 633 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1xfw s LYS 634 N -0.21 2.19 -0.23 3.52 1.02 -1.14 -4.96 119.74 119.93 1xfw s LYS 634 Ca 0.00 -2.34 -0.13 0.00 0.02 0.00 0.00 55.97 53.52 1xfw s LYS 634 Cb 0.00 -1.60 -0.04 0.00 -0.52 0.00 0.00 37.83 35.66 1xfw s LYS 634 CO 0.00 -0.37 0.28 0.42 -0.92 0.00 0.00 175.35 174.77 1xfw s ILE 635 N -2.85 5.27 -0.30 2.17 1.09 -1.26 -4.12 121.20 121.19 1xfw s ILE 635 Ca 0.11 0.43 -0.29 0.00 -1.10 0.00 0.00 60.65 59.80 1xfw s ILE 635 Cb 0.02 -3.62 0.01 0.00 -1.06 0.00 0.00 42.46 37.81 1xfw s ILE 635 CO 0.06 0.27 1.12 0.00 -0.10 0.00 0.00 174.94 176.29 1xfw s ALA 636 N 1.37 3.50 0.04 9.38 0.00 0.12 -4.79 121.76 131.37 1xfw s ALA 636 Ca 0.13 0.01 -0.08 0.00 0.00 0.00 0.00 51.96 52.01 1xfw s ALA 636 Cb -0.14 -3.68 -0.02 0.00 0.00 0.00 0.00 23.12 19.27 1xfw s ALA 636 CO 0.07 -1.49 0.77 -2.30 0.00 0.00 0.00 175.76 172.81 1xfw n PRO 637 N 6.90 -0.12 0.00 0.00 -0.02 -1.26 0.21 135.00 140.71 1xfw n PRO 637 Ca 0.12 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 1xfw n PRO 637 Cb 0.47 -1.13 0.00 0.00 -0.02 0.00 0.00 33.50 32.82 1xfw n PRO 637 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xfw n GLY 638 N -1.07 -2.95 0.58 -1.23 0.00 -1.17 -2.78 105.19 96.57 1xfw n GLY 638 Ca 0.01 0.34 0.08 0.00 0.00 0.00 0.00 46.02 46.44 1xfw n GLY 638 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1xfw n ASN 639 N -2.05 1.71 -4.09 1.61 2.04 -1.20 -4.93 115.26 108.34 1xfw n ASN 639 Ca 0.00 -1.87 -0.38 0.00 -0.44 0.00 0.00 54.58 51.89 1xfw n ASN 639 Cb 0.00 -0.17 -0.02 0.00 -2.53 0.00 0.00 39.78 37.06 1xfw n ASN 639 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 1xfw n LYS 640 N 0.40 -0.93 -4.36 -3.83 5.02 0.57 -4.94 118.16 110.07 1xfw n LYS 640 Ca 0.13 0.16 -0.30 0.00 -2.02 0.00 0.00 58.31 56.29 1xfw n LYS 640 Cb 0.30 -3.27 -0.11 0.00 -0.02 0.00 0.00 35.03 31.93 1xfw n LYS 640 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xfw s ALA 641 N -3.84 2.73 -0.29 7.82 0.00 -1.09 -4.72 121.76 122.37 1xfw s ALA 641 Ca 0.28 -1.29 -0.03 0.00 0.00 0.00 0.00 51.96 50.93 1xfw s ALA 641 Cb -0.15 -0.73 0.04 0.00 0.00 0.00 0.00 23.12 22.28 1xfw s ALA 641 CO 0.96 0.60 0.01 -0.47 0.00 0.00 0.00 175.76 176.85 1xfw s TYR 642 N -1.11 3.19 -0.22 0.00 5.04 -1.26 0.13 117.35 123.12 1xfw s TYR 642 Ca 0.18 -1.60 0.01 0.00 -2.44 0.00 0.00 57.07 53.23 1xfw s TYR 642 Cb -0.11 -2.13 0.03 0.00 0.35 0.00 0.00 41.96 40.10 1xfw s TYR 642 CO 0.10 -0.74 -0.15 0.42 -1.34 0.00 0.00 175.55 173.84 1xfw s ILE 643 N 1.33 2.20 0.32 3.14 1.01 -1.26 -4.97 121.20 122.96 1xfw s ILE 643 Ca -0.02 -1.20 -0.27 0.00 0.00 0.00 0.00 60.65 59.16 1xfw s ILE 643 Cb -0.18 -2.08 -0.09 0.00 0.01 0.00 0.00 42.46 40.11 1xfw s ILE 643 CO -0.01 0.30 1.05 -1.61 0.00 0.00 0.00 174.94 174.66 1xfw s GLU 644 N 1.23 4.51 -0.29 2.79 2.02 -1.26 -0.13 118.70 127.57 1xfw s GLU 644 Ca -0.01 1.63 0.00 0.00 0.02 0.00 0.00 54.97 56.61 1xfw s GLU 644 Cb -0.16 -2.96 0.18 0.00 0.10 0.00 0.00 34.13 31.29 1xfw s GLU 644 CO -0.09 0.15 0.55 -0.46 0.02 0.00 0.00 175.26 175.43 1xfw s TRP 645 N -1.36 -1.51 -0.57 1.61 -0.11 -1.26 -4.89 118.94 110.85 1xfw s TRP 645 Ca 0.49 1.40 -0.21 0.00 1.22 0.00 0.00 56.10 58.99 1xfw s TRP 645 Cb -0.27 0.40 -0.14 0.00 -1.50 0.00 0.00 33.47 31.97 1xfw s TRP 645 CO 0.34 -0.90 1.64 0.25 -4.62 0.00 0.00 176.95 173.66 1xfw n THR 646 N 5.41 0.00 -3.65 5.86 -2.24 -1.26 -4.89 114.28 113.51 1xfw n THR 646 Ca -0.00 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.39 1xfw n THR 646 Cb 0.51 -0.32 -0.12 0.00 -2.10 0.00 0.00 70.33 68.31 1xfw n THR 646 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xfw s ASP 647 N 5.32 5.56 0.33 3.42 3.68 -1.26 -4.97 116.67 128.75 1xfw s ASP 647 Ca 0.84 -0.88 0.01 0.00 2.13 0.00 0.00 52.55 54.65 1xfw s ASP 647 Cb -0.83 -1.98 0.56 0.00 -1.45 0.00 0.00 42.92 39.22 1xfw s ASP 647 CO 0.33 -0.31 1.98 -0.65 0.13 0.00 0.00 175.17 176.65 1xfw h PRO 648 N 8.36 0.94 -0.25 4.34 0.11 -1.99 -2.25 132.00 141.26 1xfw h PRO 648 Ca -0.27 -0.06 0.05 0.00 0.11 0.00 0.00 66.00 65.83 1xfw h PRO 648 Cb 1.11 -0.21 -0.05 0.00 0.11 0.00 0.00 31.00 31.96 1xfw h PRO 648 CO 0.64 0.62 -0.07 0.82 -0.21 0.00 0.00 178.00 179.80 1xfw h ILE 649 N 0.97 0.72 -0.30 4.15 2.04 -1.99 0.32 117.51 123.42 1xfw h ILE 649 Ca 0.29 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.20 1xfw h ILE 649 Cb -0.03 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1xfw h ILE 649 CO -0.07 0.00 0.21 0.74 0.00 0.00 0.00 178.15 179.02 1xfw h THR 650 N -0.02 0.95 -0.22 -0.27 2.02 -1.87 -2.00 112.91 111.49 1xfw h THR 650 Ca 0.12 -0.06 0.05 0.00 0.77 0.00 0.00 66.41 67.29 1xfw h THR 650 Cb 0.21 0.75 -0.07 0.00 -1.74 0.00 0.00 68.15 67.29 1xfw h THR 650 CO -0.27 0.03 -0.39 0.50 0.37 0.00 0.00 175.52 175.77 1xfw h LYS 651 N 0.18 -0.39 -0.01 6.66 1.63 0.19 -1.19 116.57 123.64 1xfw h LYS 651 Ca 0.13 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.96 1xfw h LYS 651 Cb 0.30 0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.02 1xfw h LYS 651 CO -0.02 -0.26 0.00 0.00 -3.45 0.00 0.00 179.45 175.72 1xfw n ALA 652 N -2.95 2.56 -0.12 5.00 0.00 -0.78 -3.93 120.51 120.30 1xfw n ALA 652 Ca -0.03 -0.09 -0.12 0.00 0.00 0.00 0.00 53.44 53.20 1xfw n ALA 652 Cb 0.35 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.62 1xfw n ALA 652 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1xfw h LYS 653 N 0.09 0.93 -1.04 0.00 3.64 -0.95 -3.11 116.57 116.12 1xfw h LYS 653 Ca 0.00 -0.45 0.27 0.00 -1.27 0.00 0.00 60.65 59.20 1xfw h LYS 653 Cb 0.02 -0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 31.76 1xfw h LYS 653 CO 0.00 1.11 0.70 0.82 -2.27 0.00 0.00 179.45 179.81 1xfw h ILE 654 N 0.77 0.52 -0.78 2.00 2.04 -1.73 -0.88 117.51 119.45 1xfw h ILE 654 Ca 0.08 -0.09 -0.53 0.00 1.00 0.00 0.00 64.86 65.31 1xfw h ILE 654 Cb 0.91 0.22 -0.32 0.00 -0.74 0.00 0.00 36.82 36.90 1xfw h ILE 654 CO 0.08 0.05 0.01 0.59 0.00 0.00 0.00 178.15 178.89 1xfw n ASN 655 N -4.48 5.48 -3.97 1.72 5.03 -1.18 -4.44 115.26 113.43 1xfw n ASN 655 Ca 0.24 -3.77 -0.24 0.00 0.87 0.00 0.00 54.58 51.68 1xfw n ASN 655 Cb 0.94 -0.65 -0.17 0.00 -1.02 0.00 0.00 39.78 38.88 1xfw n ASN 655 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1xfw s THR 656 N -4.39 0.97 0.18 3.41 2.01 -0.34 -3.98 115.64 113.50 1xfw s THR 656 Ca 0.55 -0.35 -0.31 0.00 0.31 0.00 0.00 61.69 61.90 1xfw s THR 656 Cb 0.45 -0.93 -0.09 0.00 0.01 0.00 0.00 72.50 71.94 1xfw s THR 656 CO 0.02 0.33 1.40 -0.51 -0.69 0.00 0.00 174.62 175.16 1xfw s ILE 657 N 0.97 3.05 1.11 1.82 2.07 -1.26 -4.67 121.20 124.29 1xfw s ILE 657 Ca -0.09 0.81 -0.12 0.00 -1.41 0.00 0.00 60.65 59.83 1xfw s ILE 657 Cb -0.15 -3.52 0.25 0.00 0.13 0.00 0.00 42.46 39.18 1xfw s ILE 657 CO 0.00 0.10 1.05 -2.16 -1.91 0.00 0.00 174.94 172.02 1xfw s PRO 658 N 0.40 -0.51 0.12 3.50 0.04 -1.26 -5.03 135.00 132.26 1xfw s PRO 658 Ca 0.62 0.86 0.02 0.00 0.04 0.00 0.00 61.00 62.54 1xfw s PRO 658 Cb -0.39 -1.60 -0.04 0.00 0.04 0.00 0.00 34.50 32.52 1xfw s PRO 658 CO 0.36 -3.46 0.23 0.95 0.04 0.00 0.00 177.00 175.11 1xfw s THR 659 N -2.56 5.16 0.17 1.26 -4.23 -1.26 -4.82 115.64 109.36 1xfw s THR 659 Ca 0.68 -0.67 -0.26 0.00 -1.18 0.00 0.00 61.69 60.26 1xfw s THR 659 Cb -0.24 -3.61 0.03 0.00 1.34 0.00 0.00 72.50 70.03 1xfw s THR 659 CO 0.63 -0.02 1.56 -1.28 -0.54 0.00 0.00 174.62 174.97 1xfw h SER 660 N 2.51 -1.69 0.51 3.99 0.87 -1.84 0.39 113.55 118.30 1xfw h SER 660 Ca -0.47 0.28 -0.07 0.00 -1.23 0.00 0.00 61.79 60.30 1xfw h SER 660 Cb 1.18 0.77 -0.01 0.00 -0.44 0.00 0.00 62.40 63.91 1xfw h SER 660 CO 0.70 -0.31 -0.31 0.00 -0.53 0.00 0.00 176.83 176.38 1xfw h ALA 661 N 0.66 1.24 -0.13 6.23 0.00 -1.95 0.14 119.26 125.45 1xfw h ALA 661 Ca 0.19 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 1xfw h ALA 661 Cb 0.54 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1xfw h ALA 661 CO -0.80 0.39 -0.47 1.49 0.00 0.00 0.00 179.25 179.86 1xfw h GLU 662 N 0.00 0.32 0.33 0.00 4.81 -1.14 -2.17 114.58 116.73 1xfw h GLU 662 Ca -0.00 -0.17 -0.02 0.00 -0.13 0.00 0.00 59.36 59.04 1xfw h GLU 662 Cb 0.65 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.04 1xfw h GLU 662 CO 0.04 0.73 -0.16 0.35 -0.73 0.00 0.00 179.01 179.24 1xfw h PHE 663 N 0.26 -0.41 -0.57 0.92 3.57 0.54 -2.67 116.94 118.58 1xfw h PHE 663 Ca 0.02 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.60 1xfw h PHE 663 Cb 0.93 0.14 -0.11 0.00 2.79 0.00 0.00 35.95 39.69 1xfw h PHE 663 CO 0.02 -0.26 -0.37 0.82 -2.23 0.00 0.00 178.31 176.29 1xfw h ILE 664 N -1.00 0.14 -0.64 1.41 2.04 -0.84 -1.76 117.51 116.87 1xfw h ILE 664 Ca -0.05 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.87 1xfw h ILE 664 Cb 0.34 0.14 -0.08 0.00 -0.74 0.00 0.00 36.82 36.48 1xfw h ILE 664 CO 0.07 0.00 -0.40 0.11 0.00 0.00 0.00 178.15 177.93 1xfw h LYS 665 N -0.20 -0.04 -0.99 2.37 6.56 -1.45 0.19 116.57 123.01 1xfw h LYS 665 Ca 0.21 0.00 0.23 0.00 -1.06 0.00 0.00 60.65 60.03 1xfw h LYS 665 Cb 0.56 0.01 -0.09 0.00 -0.57 0.00 0.00 32.23 32.14 1xfw h LYS 665 CO -0.67 -0.02 0.63 -0.91 -2.06 0.00 0.00 179.45 176.42 1xfw h ASN 666 N -0.04 0.51 0.61 0.86 -0.26 -0.97 0.16 115.58 116.44 1xfw h ASN 666 Ca 0.10 0.07 -0.03 0.00 -0.56 0.00 0.00 56.30 55.89 1xfw h ASN 666 Cb 0.30 -0.02 0.01 0.00 -1.06 0.00 0.00 38.32 37.55 1xfw h ASN 666 CO -0.62 0.15 -0.29 -0.07 -1.06 0.00 0.00 177.43 175.54 1xfw h LEU 667 N 0.48 -0.69 -1.70 1.61 3.38 -0.15 -2.36 115.31 115.88 1xfw h LEU 667 Ca 0.55 -0.03 0.32 0.00 0.09 0.00 0.00 57.88 58.82 1xfw h LEU 667 Cb 1.27 0.18 -0.04 0.00 0.09 0.00 0.00 40.66 42.15 1xfw h LEU 667 CO -0.28 -0.34 0.98 -1.28 0.09 0.00 0.00 178.44 177.62 1xfw h SER 668 N -1.07 0.00 0.05 -0.43 0.87 0.18 -1.91 113.55 111.24 1xfw h SER 668 Ca -0.08 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.47 1xfw h SER 668 Cb 0.68 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.64 1xfw h SER 668 CO 0.14 0.00 -0.02 -1.28 -0.53 0.00 0.00 176.83 175.13 1xfw h SER 669 N 0.00 -0.05 -1.04 6.23 0.87 -0.34 -3.29 113.55 115.93 1xfw h SER 669 Ca 0.53 0.00 0.30 0.00 -1.23 0.00 0.00 61.79 61.39 1xfw h SER 669 Cb 2.49 0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 64.42 1xfw h SER 669 CO -0.01 0.05 1.02 0.40 -0.53 0.00 0.00 176.83 177.77 1xfw h ILE 670 N -0.25 0.14 0.55 2.23 2.04 -0.90 0.40 117.51 121.72 1xfw h ILE 670 Ca -0.01 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.83 1xfw h ILE 670 Cb 0.05 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 36.34 1xfw h ILE 670 CO 0.01 0.00 -0.29 -0.09 0.00 0.00 0.00 178.15 177.78 1xfw h ARG 671 N 0.00 -0.74 0.00 2.37 2.43 -1.48 0.75 114.38 117.71 1xfw h ARG 671 Ca 0.50 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.72 1xfw h ARG 671 Cb 2.53 0.17 0.00 0.00 -0.42 0.00 0.00 29.97 32.25 1xfw h ARG 671 CO -0.01 -0.49 0.01 0.54 -1.51 0.00 0.00 179.97 178.51 1xfw n ARG 672 N -4.16 0.00 0.00 0.20 5.12 0.14 -3.29 116.66 114.67 1xfw n ARG 672 Ca -0.09 0.22 0.00 0.00 -1.93 0.00 0.00 57.85 56.04 1xfw n ARG 672 Cb 0.31 -1.51 0.00 0.00 -1.16 0.00 0.00 32.46 30.10 1xfw n ARG 672 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1xfw n SER 673 N -1.20 0.00 -4.70 0.55 2.88 -0.40 -4.78 113.62 105.97 1xfw n SER 673 Ca 0.00 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.12 1xfw n SER 673 Cb 0.01 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.44 1xfw n SER 673 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1xfw s SER 674 N -1.00 7.02 0.00 -3.46 1.04 0.12 -4.84 113.70 112.58 1xfw s SER 674 Ca 0.00 1.97 0.00 0.00 0.48 0.00 0.00 55.95 58.40 1xfw s SER 674 Cb 0.00 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.55 1xfw s SER 674 CO 0.00 -0.56 0.63 -3.20 0.98 0.00 0.00 173.24 171.08 1xfw n ASN 675 N 4.64 1.77 -3.89 7.02 5.15 -1.21 -4.04 115.26 124.71 1xfw n ASN 675 Ca 0.10 -1.19 -0.22 0.00 -0.60 0.00 0.00 54.58 52.68 1xfw n ASN 675 Cb 0.46 -0.34 -0.17 0.00 -0.53 0.00 0.00 39.78 39.20 1xfw n ASN 675 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1xfw s VAL 676 N 0.75 0.64 0.47 3.44 -7.23 -1.25 -5.01 120.40 112.22 1xfw s VAL 676 Ca 0.00 -0.15 -0.04 0.00 -1.81 0.00 0.00 61.98 59.98 1xfw s VAL 676 Cb 0.00 -0.67 -0.03 0.00 0.56 0.00 0.00 36.38 36.24 1xfw s VAL 676 CO 0.00 0.26 0.75 -0.83 -0.31 0.00 0.00 175.10 174.97 1xfw s GLY 677 N 1.11 1.49 0.34 2.32 0.00 -1.26 -4.54 107.32 106.78 1xfw s GLY 677 Ca -0.08 -0.64 0.11 0.00 0.00 0.00 0.00 44.72 44.12 1xfw s GLY 677 CO -0.01 -0.47 1.59 -2.08 0.00 0.00 0.00 173.10 172.13 1xfw h VAL 678 N 0.27 0.07 -3.93 1.40 2.07 -1.98 -3.37 116.25 110.79 1xfw h VAL 678 Ca -0.47 -0.02 -0.50 0.00 0.82 0.00 0.00 66.70 66.53 1xfw h VAL 678 Cb 1.22 0.01 -0.31 0.00 -1.52 0.00 0.00 31.29 30.69 1xfw h VAL 678 CO 0.61 0.01 -0.81 -0.72 0.02 0.00 0.00 177.57 176.68 1xfw s TYR 679 N -5.75 1.35 0.29 1.57 -0.85 -1.26 -4.87 117.35 107.82 1xfw s TYR 679 Ca -0.11 -0.35 -0.02 0.00 -0.52 0.00 0.00 57.07 56.08 1xfw s TYR 679 Cb 0.31 -0.91 -0.04 0.00 0.38 0.00 0.00 41.96 41.69 1xfw s TYR 679 CO 0.78 -0.11 0.51 0.21 -1.52 0.00 0.00 175.55 175.42 1xfw s LYS 680 N 0.03 3.55 -0.72 -3.49 2.20 -1.26 -5.01 119.74 115.04 1xfw s LYS 680 Ca -0.02 -0.21 -0.22 0.00 -0.36 0.00 0.00 55.97 55.16 1xfw s LYS 680 Cb -0.09 -2.70 0.08 0.00 -1.51 0.00 0.00 37.83 33.60 1xfw s LYS 680 CO 0.01 0.23 1.02 0.34 -0.36 0.00 0.00 175.35 176.60 1xfw s ASP 681 N -3.50 6.25 0.20 1.43 2.15 -1.26 -4.78 116.67 117.17 1xfw s ASP 681 Ca 0.41 -1.15 -0.01 0.00 0.43 0.00 0.00 52.55 52.23 1xfw s ASP 681 Cb -0.10 -2.43 0.01 0.00 -0.30 0.00 0.00 42.92 40.10 1xfw s ASP 681 CO 0.32 -1.41 0.28 -1.54 -0.17 0.00 0.00 175.17 172.66 1xfw n SER 682 N 7.65 -0.78 0.01 -0.34 3.41 -1.26 -5.06 113.62 117.24 1xfw n SER 682 Ca 0.02 -2.04 0.01 0.00 -0.26 0.00 0.00 58.87 56.60 1xfw n SER 682 Cb 0.46 1.45 -0.10 0.00 -0.26 0.00 0.00 64.21 65.76 1xfw n SER 682 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xfw n GLY 683 N -0.32 -1.16 3.55 5.00 0.00 -1.26 -4.91 105.19 106.09 1xfw n GLY 683 Ca 0.00 -0.23 -0.48 0.00 0.00 0.00 0.00 46.02 45.31 1xfw n GLY 683 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1xfw n ASP 684 N -2.75 0.84 -0.54 1.61 5.68 -1.26 -4.79 116.55 115.34 1xfw n ASP 684 Ca -0.11 1.15 0.11 0.00 -0.50 0.00 0.00 54.79 55.44 1xfw n ASP 684 Cb 0.82 -1.18 0.41 0.00 -1.14 0.00 0.00 41.12 40.03 1xfw n ASP 684 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1xfw n LYS 685 N 1.33 1.71 -0.02 0.11 4.76 -1.26 -3.53 118.16 121.26 1xfw n LYS 685 Ca 0.14 -1.06 -0.11 0.00 -2.87 0.00 0.00 58.31 54.41 1xfw n LYS 685 Cb 0.26 -1.41 -0.14 0.00 -1.84 0.00 0.00 35.03 31.89 1xfw n LYS 685 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1xfw n ASP 686 N 0.29 1.06 0.10 4.39 10.43 -1.26 -2.72 116.55 128.84 1xfw n ASP 686 Ca 0.17 0.35 -0.13 0.00 2.57 0.00 0.00 54.79 57.75 1xfw n ASP 686 Cb 0.34 -0.16 -0.07 0.00 1.84 0.00 0.00 41.12 43.07 1xfw n ASP 686 CO 0.00 0.00 0.00 -0.08 -1.07 0.00 0.00 177.20 176.05 1xfw h GLU 687 N 0.01 -0.23 -0.09 -1.24 4.57 -1.92 0.24 114.58 115.92 1xfw h GLU 687 Ca -0.33 0.02 0.03 0.00 -1.18 0.00 0.00 59.36 57.89 1xfw h GLU 687 Cb 2.03 0.05 -0.06 0.00 -0.16 0.00 0.00 28.75 30.61 1xfw h GLU 687 CO 0.08 -0.15 -0.50 0.35 -1.18 0.00 0.00 179.01 177.60 1xfw h PHE 688 N -0.24 -1.50 -0.50 0.92 3.57 -1.67 0.26 116.94 117.79 1xfw h PHE 688 Ca 0.00 0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.60 1xfw h PHE 688 Cb 0.22 0.66 -0.06 0.00 2.79 0.00 0.00 35.95 39.57 1xfw h PHE 688 CO -0.11 -0.51 -0.29 0.00 -2.23 0.00 0.00 178.31 175.16 1xfw n ALA 689 N -2.96 -0.32 -0.13 2.41 0.00 -0.77 0.12 120.51 118.86 1xfw n ALA 689 Ca -0.06 0.42 -0.05 0.00 0.00 0.00 0.00 53.44 53.75 1xfw n ALA 689 Cb 0.36 0.05 0.01 0.00 0.00 0.00 0.00 19.45 19.86 1xfw n ALA 689 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1xfw h LYS 690 N 0.00 -0.14 0.00 0.00 1.57 0.22 0.12 116.57 118.34 1xfw h LYS 690 Ca 0.08 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1xfw h LYS 690 Cb 0.20 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1xfw h LYS 690 CO -0.47 -0.09 0.00 1.17 -0.57 0.00 0.00 179.45 179.49 1xfw n LYS 691 N -5.39 0.00 -0.30 3.15 4.81 0.32 -1.24 118.16 119.50 1xfw n LYS 691 Ca 0.02 0.71 0.29 0.00 -0.87 0.00 0.00 58.31 58.47 1xfw n LYS 691 Cb 0.30 -1.47 0.53 0.00 0.02 0.00 0.00 35.03 34.41 1xfw n LYS 691 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1xfw n GLU 692 N -2.38 -0.05 -0.06 1.64 4.07 0.14 -0.04 120.64 123.95 1xfw n GLU 692 Ca 0.00 1.18 -0.11 0.00 -0.06 0.00 0.00 57.16 58.17 1xfw n GLU 692 Cb 0.00 -2.16 -0.05 0.00 -0.06 0.00 0.00 31.44 29.17 1xfw n GLU 692 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 1xfw h SER 693 N 0.00 0.32 0.09 4.31 0.87 0.64 -2.40 113.55 117.39 1xfw h SER 693 Ca 0.75 -0.26 -0.09 0.00 -1.23 0.00 0.00 61.79 60.96 1xfw h SER 693 Cb 2.06 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 63.92 1xfw h SER 693 CO -0.62 0.50 -0.28 -0.37 -0.53 0.00 0.00 176.83 175.53 1xfw h VAL 694 N 0.13 1.26 0.00 2.23 -1.51 0.59 0.99 116.25 119.94 1xfw h VAL 694 Ca 0.06 -1.24 -0.00 0.00 -1.23 0.00 0.00 66.70 64.29 1xfw h VAL 694 Cb 0.32 1.45 -0.00 0.00 -2.13 0.00 0.00 31.29 30.93 1xfw h VAL 694 CO 0.00 0.38 -0.02 0.50 -1.23 0.00 0.00 177.57 177.20 1xfw h LYS 695 N 0.27 0.00 0.17 5.19 3.64 -1.18 0.11 116.57 124.77 1xfw h LYS 695 Ca 0.04 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 59.14 1xfw h LYS 695 Cb 0.65 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 32.50 1xfw h LYS 695 CO 0.05 0.02 -1.22 0.87 -2.27 0.00 0.00 179.45 176.90 1xfw h LYS 696 N 0.00 0.53 -0.34 1.90 1.57 -0.31 -3.10 116.57 116.82 1xfw h LYS 696 Ca -0.00 -0.79 -0.16 0.00 -1.87 0.00 0.00 60.65 57.83 1xfw h LYS 696 Cb 0.17 0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 1xfw h LYS 696 CO 0.00 1.37 -0.42 0.82 -0.57 0.00 0.00 179.45 180.64 1xfw h ILE 697 N 0.09 1.28 -0.80 1.86 2.04 -0.75 -2.46 117.51 118.76 1xfw h ILE 697 Ca -0.20 -1.60 0.21 0.00 1.00 0.00 0.00 64.86 64.27 1xfw h ILE 697 Cb 1.93 1.46 -0.04 0.00 -0.74 0.00 0.00 36.82 39.43 1xfw h ILE 697 CO 0.23 0.53 0.56 0.00 0.00 0.00 0.00 178.15 179.47 1xfw h ALA 698 N 0.82 2.57 -1.27 1.87 0.00 -0.88 -0.27 119.26 122.09 1xfw h ALA 698 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1xfw h ALA 698 Cb 1.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1xfw h ALA 698 CO 0.10 -0.80 0.00 0.41 0.00 0.00 0.00 179.25 178.96 1xfw n GLY 699 N -1.64 -0.12 0.15 0.00 0.00 -0.96 -2.87 105.19 99.76 1xfw n GLY 699 Ca 0.16 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.22 1xfw n GLY 699 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1xfw n TYR 700 N -1.37 0.20 0.47 1.61 0.53 -0.99 0.26 117.16 117.88 1xfw n TYR 700 Ca 0.00 0.53 -0.19 0.00 -1.02 0.00 0.00 57.90 57.22 1xfw n TYR 700 Cb 0.00 -0.78 -0.09 0.00 -1.03 0.00 0.00 39.34 37.44 1xfw n TYR 700 CO 0.00 0.00 0.00 -0.07 -1.02 0.00 0.00 176.86 175.77 1xfw h LEU 701 N 0.00 -1.02 -1.85 7.72 3.38 -1.21 -1.17 115.31 121.16 1xfw h LEU 701 Ca 0.23 0.03 0.14 0.00 0.09 0.00 0.00 57.88 58.37 1xfw h LEU 701 Cb 0.41 0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 1xfw h LEU 701 CO -0.43 -0.67 0.55 -1.28 0.09 0.00 0.00 178.44 176.69 1xfw h SER 702 N -1.30 0.00 1.09 -0.43 0.87 0.38 0.38 113.55 114.55 1xfw h SER 702 Ca -0.12 0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 60.25 1xfw h SER 702 Cb 0.92 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.85 1xfw h SER 702 CO 0.20 0.00 -0.91 0.44 -0.53 0.00 0.00 176.83 176.03 1xfw h ASP 703 N 0.00 0.00 0.10 6.23 3.45 0.71 -3.28 116.42 123.63 1xfw h ASP 703 Ca 0.23 0.00 0.01 0.00 0.43 0.00 0.00 57.03 57.69 1xfw h ASP 703 Cb 1.32 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 40.07 1xfw h ASP 703 CO -0.00 0.89 -0.12 0.22 -1.57 0.00 0.00 179.24 178.66 1xfw h TYR 704 N 0.00 -0.31 -0.55 4.55 3.20 0.97 -3.18 116.97 121.66 1xfw h TYR 704 Ca -0.01 0.00 -0.72 0.00 3.14 0.00 0.00 58.73 61.14 1xfw h TYR 704 Cb 1.69 0.12 -0.06 0.00 1.54 0.00 0.00 36.73 40.02 1xfw h TYR 704 CO 0.00 -0.18 2.93 0.66 -1.64 0.00 0.00 178.16 179.93 1xfw n TYR 705 N -5.24 2.92 -3.97 -3.82 4.02 -1.16 -4.95 117.16 104.96 1xfw n TYR 705 Ca -0.07 -2.93 -0.35 0.00 -0.01 0.00 0.00 57.90 54.53 1xfw n TYR 705 Cb 0.16 -2.26 -0.08 0.00 -0.02 0.00 0.00 39.34 37.14 1xfw n TYR 705 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1xfw s ASN 706 N 1.83 5.86 0.33 7.72 3.84 -1.20 -4.98 114.94 128.34 1xfw s ASN 706 Ca 0.52 0.21 0.26 0.00 0.21 0.00 0.00 52.86 54.06 1xfw s ASN 706 Cb 0.15 -1.95 1.04 0.00 -0.55 0.00 0.00 41.25 39.94 1xfw s ASN 706 CO -0.06 0.25 1.78 0.28 -2.79 0.00 0.00 177.10 176.56 1xfw h SER 707 N 6.11 0.00 -0.23 -4.21 0.02 -1.93 -2.41 113.55 110.89 1xfw h SER 707 Ca -0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 1xfw h SER 707 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1xfw h SER 707 CO 0.67 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 176.36 1xfw n ALA 708 N -1.86 2.68 1.64 3.77 0.00 -1.26 -3.31 120.51 122.17 1xfw n ALA 708 Ca 0.02 -0.54 0.13 0.00 0.00 0.00 0.00 53.44 53.05 1xfw n ALA 708 Cb 0.27 -1.01 0.78 0.00 0.00 0.00 0.00 19.45 19.49 1xfw n ALA 708 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1xfw n ASN 709 N 0.24 0.00 0.06 0.00 5.03 -0.91 -3.42 115.26 116.27 1xfw n ASN 709 Ca 0.09 -0.82 -0.09 0.00 0.87 0.00 0.00 54.58 54.63 1xfw n ASN 709 Cb 0.37 -0.00 -0.13 0.00 -1.02 0.00 0.00 39.78 39.00 1xfw n ASN 709 CO 0.00 0.00 0.00 1.12 -1.83 0.00 0.00 177.26 176.55 1xfw h HIS 710 N 0.00 0.10 0.00 3.10 2.07 -1.82 -3.24 115.15 115.36 1xfw h HIS 710 Ca 0.00 -0.08 0.00 0.00 -2.85 0.00 0.00 60.37 57.44 1xfw h HIS 710 Cb 0.00 -0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 1xfw h HIS 710 CO 0.00 1.06 0.00 0.44 -3.07 0.00 0.00 177.93 176.36 1xfw n ILE 711 N -3.37 0.00 -4.28 6.12 -5.35 -1.22 -4.76 119.36 106.51 1xfw n ILE 711 Ca -0.03 0.00 -0.27 0.00 -0.27 0.00 0.00 62.75 62.18 1xfw n ILE 711 Cb 0.96 -0.25 -0.06 0.00 -1.74 0.00 0.00 39.64 38.55 1xfw n ILE 711 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1xfw s PHE 712 N -1.51 2.22 0.04 4.28 2.99 -1.23 -5.13 117.98 119.65 1xfw s PHE 712 Ca 0.00 -0.73 -0.11 0.00 0.00 0.00 0.00 56.93 56.09 1xfw s PHE 712 Cb 0.00 -1.85 -0.06 0.00 0.00 0.00 0.00 43.02 41.11 1xfw s PHE 712 CO 0.00 0.09 0.37 -1.54 -0.00 0.00 0.00 175.22 174.14 1xfw s SER 713 N -3.96 6.66 0.28 1.36 1.04 -1.26 -4.92 113.70 112.90 1xfw s SER 713 Ca 0.31 0.80 0.09 0.00 0.48 0.00 0.00 55.95 57.62 1xfw s SER 713 Cb 0.03 -2.18 0.85 0.00 0.10 0.00 0.00 66.02 64.82 1xfw s SER 713 CO 0.17 0.24 1.32 1.67 0.98 0.00 0.00 173.24 177.62 1xfw n GLN 714 N 1.25 -0.06 0.06 4.02 -0.06 -1.26 -0.73 117.38 120.60 1xfw n GLN 714 Ca -0.11 1.21 -0.05 0.00 -2.00 0.00 0.00 57.00 56.05 1xfw n GLN 714 Cb 0.53 -2.03 -0.03 0.00 -4.06 0.00 0.00 30.24 24.65 1xfw n GLN 714 CO 0.00 0.00 0.00 1.49 -0.20 0.00 0.00 177.06 178.35 1xfw h GLU 715 N 0.00 -0.25 -0.35 3.69 4.57 -2.01 -2.91 114.58 117.32 1xfw h GLU 715 Ca 0.60 0.02 0.08 0.00 -1.18 0.00 0.00 59.36 58.87 1xfw h GLU 715 Cb 1.41 0.06 -0.08 0.00 -0.16 0.00 0.00 28.75 29.97 1xfw h GLU 715 CO -0.73 -0.16 -0.26 -0.22 -1.18 0.00 0.00 179.01 176.46 1xfw h LYS 716 N -0.26 -0.20 -0.74 1.92 3.64 -1.32 -0.88 116.57 118.73 1xfw h LYS 716 Ca -0.01 0.01 0.16 0.00 -1.27 0.00 0.00 60.65 59.55 1xfw h LYS 716 Cb 0.24 0.05 -0.14 0.00 -0.41 0.00 0.00 32.23 31.96 1xfw h LYS 716 CO -0.05 -0.14 -0.14 1.63 -2.27 0.00 0.00 179.45 178.49 1xfw n LYS 717 N -5.40 -0.06 0.02 1.90 5.02 -0.69 0.11 118.16 119.06 1xfw n LYS 717 Ca 0.01 1.14 -0.13 0.00 -2.02 0.00 0.00 58.31 57.32 1xfw n LYS 717 Cb 0.31 -1.73 -0.08 0.00 -0.02 0.00 0.00 35.03 33.51 1xfw n LYS 717 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xfw h ARG 718 N 0.00 -0.02 0.00 1.97 3.08 -0.97 -1.53 114.38 116.91 1xfw h ARG 718 Ca 0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.43 1xfw h ARG 718 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.69 1xfw h ARG 718 CO -0.74 0.21 0.00 1.63 -1.07 0.00 0.00 179.97 179.99 1xfw n LYS 719 N -4.99 0.00 -0.25 0.04 5.02 0.30 0.08 118.16 118.36 1xfw n LYS 719 Ca -0.08 0.40 0.23 0.00 -2.02 0.00 0.00 58.31 56.84 1xfw n LYS 719 Cb 0.14 -1.40 0.42 0.00 -0.02 0.00 0.00 35.03 34.16 1xfw n LYS 719 CO 0.00 0.00 0.00 1.51 -0.52 0.00 0.00 177.40 178.39 1xfw n ILE 720 N -1.71 -0.33 0.11 -0.18 0.13 0.25 0.90 119.36 118.53 1xfw n ILE 720 Ca 0.00 1.59 -0.18 0.00 -1.10 0.00 0.00 62.75 63.07 1xfw n ILE 720 Cb 0.00 -2.55 -0.14 0.00 -0.84 0.00 0.00 39.64 36.11 1xfw n ILE 720 CO 0.00 0.00 0.00 0.28 2.80 0.00 0.00 176.55 179.63 1xfw h SER 721 N 0.00 0.51 -0.12 9.51 0.02 -1.14 -2.83 113.55 119.49 1xfw h SER 721 Ca 0.63 -0.56 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 1xfw h SER 721 Cb 1.62 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 63.99 1xfw h SER 721 CO -0.62 1.44 0.06 0.40 -1.14 0.00 0.00 176.83 176.98 1xfw h ILE 722 N 0.09 1.06 0.23 3.27 2.04 0.45 0.57 117.51 125.22 1xfw h ILE 722 Ca -0.17 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 1xfw h ILE 722 Cb 2.02 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 38.98 1xfw h ILE 722 CO 0.21 0.07 -0.11 0.15 0.00 0.00 0.00 178.15 178.48 1xfw h PHE 723 N 0.21 -0.28 -0.84 1.37 3.57 -1.31 -0.10 116.94 119.56 1xfw h PHE 723 Ca 0.05 -0.01 0.21 0.00 3.53 0.00 0.00 57.97 61.76 1xfw h PHE 723 Cb 0.04 0.09 -0.14 0.00 2.79 0.00 0.00 35.95 38.73 1xfw h PHE 723 CO 0.00 0.06 0.12 0.00 -2.23 0.00 0.00 178.31 176.26 1xfw h ARG 724 N -0.96 0.14 0.06 1.11 2.47 -1.20 0.60 114.38 116.60 1xfw h ARG 724 Ca -0.03 -0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.68 1xfw h ARG 724 Cb 0.47 -0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 28.75 1xfw h ARG 724 CO 0.05 0.09 -0.06 0.78 0.56 0.00 0.00 179.97 181.39 1xfw h GLY 725 N 0.15 -0.75 -0.81 0.04 0.00 0.20 -2.61 103.07 99.28 1xfw h GLY 725 Ca 0.50 0.33 0.28 0.00 0.00 0.00 0.00 47.33 48.44 1xfw h GLY 725 CO -0.69 -0.27 0.16 -2.22 0.00 0.00 0.00 176.54 173.52 1xfw h ILE 726 N -0.12 0.11 -0.88 2.60 2.04 0.12 0.62 117.51 121.99 1xfw h ILE 726 Ca -0.01 -0.02 0.14 0.00 1.00 0.00 0.00 64.86 65.97 1xfw h ILE 726 Cb 0.11 0.04 -0.09 0.00 -0.74 0.00 0.00 36.82 36.13 1xfw h ILE 726 CO -0.01 0.01 0.49 1.56 0.00 0.00 0.00 178.15 180.20 1xfw h GLN 727 N 0.06 0.70 0.39 2.37 4.20 0.22 -0.94 115.11 122.12 1xfw h GLN 727 Ca 0.62 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 59.27 1xfw h GLN 727 Cb 1.34 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1xfw h GLN 727 CO -0.82 0.47 -0.19 0.00 -0.67 0.00 0.00 178.83 177.62 1xfw h ALA 728 N 1.54 -0.52 -0.00 3.87 0.00 0.62 -2.11 119.26 122.65 1xfw h ALA 728 Ca 0.46 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1xfw h ALA 728 Cb 0.59 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1xfw h ALA 728 CO -0.32 -0.72 0.46 -0.92 0.00 0.00 0.00 179.25 177.74 1xfw h TYR 729 N -0.67 0.00 0.00 0.00 3.20 -0.81 -1.14 116.97 117.55 1xfw h TYR 729 Ca -0.05 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.82 1xfw h TYR 729 Cb 0.48 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.75 1xfw h TYR 729 CO -0.01 0.00 0.00 -1.71 -1.64 0.00 0.00 178.16 174.80 1xfw n ASN 730 N -2.82 0.00 0.20 -2.11 2.85 -0.45 -1.66 115.26 111.27 1xfw n ASN 730 Ca -0.02 0.30 0.05 0.00 -0.11 0.00 0.00 54.58 54.80 1xfw n ASN 730 Cb 0.50 -0.29 0.27 0.00 1.24 0.00 0.00 39.78 41.49 1xfw n ASN 730 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 1xfw h GLU 731 N 0.00 0.00 0.00 1.20 4.39 -1.12 2.38 114.58 121.43 1xfw h GLU 731 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 1xfw h GLU 731 Cb 0.00 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1xfw h GLU 731 CO 0.00 0.00 -0.16 0.82 -1.16 0.00 0.00 179.01 178.51 1xfw h ILE 732 N 0.00 1.24 -0.39 3.13 1.08 -1.31 -3.03 117.51 118.24 1xfw h ILE 732 Ca 0.00 -1.98 0.11 0.00 -0.39 0.00 0.00 64.86 62.60 1xfw h ILE 732 Cb 1.05 2.40 -0.02 0.00 -3.07 0.00 0.00 36.82 37.18 1xfw h ILE 732 CO 0.00 0.42 0.40 -0.08 -0.69 0.00 0.00 178.15 178.20 1xfw h GLU 733 N -1.00 0.00 -0.05 2.37 4.57 0.47 -0.54 114.58 120.40 1xfw h GLU 733 Ca -0.04 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.07 1xfw h GLU 733 Cb 0.80 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.39 1xfw h GLU 733 CO -0.02 0.00 -0.26 -0.97 -1.18 0.00 0.00 179.01 176.57 1xfw h ASN 734 N 0.00 0.32 0.23 1.04 -1.24 -0.40 -3.22 115.58 112.31 1xfw h ASN 734 Ca 0.18 -0.66 -0.21 0.00 0.71 0.00 0.00 56.30 56.32 1xfw h ASN 734 Cb 0.98 -0.09 0.00 0.00 0.73 0.00 0.00 38.32 39.93 1xfw h ASN 734 CO -0.00 0.93 -0.85 0.58 -1.29 0.00 0.00 177.43 176.80 1xfw h VAL 735 N -0.26 1.37 -0.13 2.57 2.07 -1.02 -2.97 116.25 117.87 1xfw h VAL 735 Ca -0.02 -2.27 0.04 0.00 0.82 0.00 0.00 66.70 65.27 1xfw h VAL 735 Cb 0.92 2.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.94 1xfw h VAL 735 CO 0.05 0.68 0.16 0.25 0.02 0.00 0.00 177.57 178.74 1xfw h LEU 736 N 0.29 0.00 -4.91 2.57 5.85 -1.34 0.41 115.31 118.18 1xfw h LEU 736 Ca -0.06 0.00 -0.68 0.00 0.84 0.00 0.00 57.88 57.98 1xfw h LEU 736 Cb 1.46 0.00 -0.35 0.00 0.37 0.00 0.00 40.66 42.14 1xfw h LEU 736 CO 0.15 0.00 0.10 0.29 -0.34 0.00 0.00 178.44 178.64 1xfw n LYS 737 N -3.75 3.32 0.00 1.25 4.76 -1.12 -4.96 118.16 117.65 1xfw n LYS 737 Ca 0.00 -4.19 0.00 0.00 -2.87 0.00 0.00 58.31 51.26 1xfw n LYS 737 Cb 0.27 -2.27 0.00 0.00 -1.84 0.00 0.00 35.03 31.19 1xfw n LYS 737 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1xfw n SER 738 N -0.45 0.00 -2.12 4.39 2.88 0.14 -4.93 113.62 113.54 1xfw n SER 738 Ca 0.44 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.98 1xfw n SER 738 Cb 0.44 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.90 1xfw n SER 738 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1xfw n LYS 739 N 0.00 2.39 -1.15 -1.46 4.81 -1.26 -4.90 118.16 116.59 1xfw n LYS 739 Ca 0.00 0.00 -0.26 0.00 -0.87 0.00 0.00 58.31 57.18 1xfw n LYS 739 Cb 0.00 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 34.95 1xfw n LYS 739 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1xfw n GLN 740 N 0.00 2.85 -1.96 1.64 1.13 -1.26 -4.91 117.38 114.88 1xfw n GLN 740 Ca 0.00 -1.60 -0.42 0.00 -1.94 0.00 0.00 57.00 53.04 1xfw n GLN 740 Cb 0.00 -2.40 -0.03 0.00 0.11 0.00 0.00 30.24 27.92 1xfw n GLN 740 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 1xfw s ILE 741 N 1.60 3.21 1.04 5.09 -4.36 -1.26 -4.92 121.20 121.59 1xfw s ILE 741 Ca 0.68 0.57 -0.24 0.00 -0.26 0.00 0.00 60.65 61.40 1xfw s ILE 741 Cb 0.25 -3.37 -0.10 0.00 1.25 0.00 0.00 42.46 40.49 1xfw s ILE 741 CO -0.03 -0.01 -1.01 0.00 0.24 0.00 0.00 174.94 174.13 1xfw n ALA 742 N 5.95 -5.25 0.04 2.27 0.00 -1.26 -4.53 120.51 117.73 1xfw n ALA 742 Ca 0.16 -1.32 -0.15 0.00 0.00 0.00 0.00 53.44 52.13 1xfw n ALA 742 Cb 0.41 -1.05 -0.05 0.00 0.00 0.00 0.00 19.45 18.77 1xfw n ALA 742 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1xfw h PRO 743 N -1.34 0.53 -0.97 0.00 0.13 -1.97 -0.54 132.00 127.85 1xfw h PRO 743 Ca -0.44 -0.52 0.29 0.00 -0.87 0.00 0.00 66.00 64.46 1xfw h PRO 743 Cb 1.38 0.13 -0.17 0.00 0.13 0.00 0.00 31.00 32.47 1xfw h PRO 743 CO 0.27 1.15 0.17 1.05 -0.23 0.00 0.00 178.00 180.40 1xfw h GLU 744 N 0.32 0.05 0.00 0.86 9.09 -1.99 2.01 114.58 124.92 1xfw h GLU 744 Ca -0.08 -0.00 -0.25 0.00 0.05 0.00 0.00 59.36 59.08 1xfw h GLU 744 Cb 1.52 -0.01 -0.04 0.00 -1.65 0.00 0.00 28.75 28.57 1xfw h GLU 744 CO 0.16 0.03 -1.35 1.88 0.05 0.00 0.00 179.01 179.79 1xfw h TYR 745 N 0.05 0.00 -0.88 2.06 -1.99 -1.87 -2.97 116.97 111.38 1xfw h TYR 745 Ca 0.63 -0.00 0.06 0.00 2.00 0.00 0.00 58.73 61.42 1xfw h TYR 745 Cb 1.39 -0.00 -0.06 0.00 2.00 0.00 0.00 36.73 40.06 1xfw h TYR 745 CO -0.36 1.00 0.55 -0.22 -0.00 0.00 0.00 178.16 179.14 1xfw h LYS 746 N 0.00 0.99 0.62 4.88 3.11 0.42 -2.05 116.57 124.53 1xfw h LYS 746 Ca -0.15 -0.06 -0.03 0.00 -2.81 0.00 0.00 60.65 57.60 1xfw h LYS 746 Cb 1.89 -0.22 0.01 0.00 -1.00 0.00 0.00 32.23 32.90 1xfw h LYS 746 CO 0.11 0.65 -0.30 -0.91 -2.81 0.00 0.00 179.45 176.19 1xfw h ASN 747 N 1.02 -0.70 -0.80 4.20 -0.26 0.18 -0.60 115.58 118.61 1xfw h ASN 747 Ca 0.37 0.02 0.07 0.00 -0.56 0.00 0.00 56.30 56.21 1xfw h ASN 747 Cb 0.13 0.18 -0.10 0.00 -1.06 0.00 0.00 38.32 37.47 1xfw h ASN 747 CO -0.16 -0.40 -0.52 0.22 -1.06 0.00 0.00 177.43 175.51 1xfw h TYR 748 N -1.04 -1.67 -0.63 1.19 3.20 -1.42 0.99 116.97 117.60 1xfw h TYR 748 Ca -0.08 0.11 0.12 0.00 3.14 0.00 0.00 58.73 62.01 1xfw h TYR 748 Cb 0.64 0.83 -0.09 0.00 1.54 0.00 0.00 36.73 39.65 1xfw h TYR 748 CO 0.03 -0.35 0.14 0.74 -1.64 0.00 0.00 178.16 177.08 1xfw h PHE 749 N -0.06 0.22 -1.02 -3.82 0.04 -1.44 0.86 116.94 111.71 1xfw h PHE 749 Ca 0.13 0.04 0.28 0.00 2.80 0.00 0.00 57.97 61.22 1xfw h PHE 749 Cb 0.39 -0.00 -0.13 0.00 2.20 0.00 0.00 35.95 38.41 1xfw h PHE 749 CO -0.97 -0.03 0.61 1.96 -0.60 0.00 0.00 178.31 179.28 1xfw h GLN 750 N 0.27 0.43 0.11 1.51 1.08 0.25 -0.99 115.11 117.77 1xfw h GLN 750 Ca 0.33 -0.03 -0.17 0.00 -1.45 0.00 0.00 58.65 57.33 1xfw h GLN 750 Cb 0.50 -0.10 0.02 0.00 -0.05 0.00 0.00 27.48 27.86 1xfw h GLN 750 CO -0.42 0.29 -0.75 -0.92 -0.95 0.00 0.00 178.83 176.08 1xfw h TYR 751 N 0.45 0.55 -0.01 2.96 3.20 0.36 -3.24 116.97 121.24 1xfw h TYR 751 Ca 0.68 -0.37 0.00 0.00 3.14 0.00 0.00 58.73 62.17 1xfw h TYR 751 Cb 1.48 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 39.72 1xfw h TYR 751 CO -0.01 1.26 0.26 -0.07 -1.64 0.00 0.00 178.16 177.97 1xfw h LEU 752 N -0.32 0.00 0.29 2.82 3.38 0.12 -1.51 115.31 120.09 1xfw h LEU 752 Ca -0.12 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1xfw h LEU 752 Cb 1.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.30 1xfw h LEU 752 CO 0.14 0.00 -0.14 0.11 0.09 0.00 0.00 178.44 178.64 1xfw h LYS 753 N 0.00 -0.37 -1.18 1.13 1.57 -1.39 -2.84 116.57 113.50 1xfw h LYS 753 Ca 0.00 0.03 0.34 0.00 -1.87 0.00 0.00 60.65 59.15 1xfw h LYS 753 Cb 0.52 0.08 -0.10 0.00 0.08 0.00 0.00 32.23 32.81 1xfw h LYS 753 CO -0.00 -0.18 0.77 1.49 -0.57 0.00 0.00 179.45 180.96 1xfw h GLU 754 N -1.07 0.22 0.00 3.15 4.81 -1.37 0.11 114.58 120.42 1xfw h GLU 754 Ca -0.04 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1xfw h GLU 754 Cb 0.36 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.69 1xfw h GLU 754 CO 0.06 0.15 0.00 0.54 -0.73 0.00 0.00 179.01 179.03 1xfw n ARG 755 N -4.60 0.00 -0.11 1.92 5.12 -1.03 -0.89 116.66 117.06 1xfw n ARG 755 Ca 0.30 0.02 -0.03 0.00 -1.93 0.00 0.00 57.85 56.21 1xfw n ARG 755 Cb 1.15 -0.97 -0.03 0.00 -1.16 0.00 0.00 32.46 31.45 1xfw n ARG 755 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 1xfw n ILE 756 N -0.55 -0.19 -0.16 0.55 2.08 -0.71 0.85 119.36 121.24 1xfw n ILE 756 Ca 0.00 0.94 -0.04 0.00 0.56 0.00 0.00 62.75 64.20 1xfw n ILE 756 Cb 0.00 -1.18 -0.04 0.00 -0.75 0.00 0.00 39.64 37.67 1xfw n ILE 756 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 176.55 177.52 1xfw n THR 757 N -3.72 -0.26 -0.12 1.39 -1.04 0.29 0.18 114.28 110.99 1xfw n THR 757 Ca 0.01 1.80 -0.05 0.00 -2.04 0.00 0.00 64.05 63.77 1xfw n THR 757 Cb 0.07 -2.31 0.01 0.00 -1.82 0.00 0.00 70.33 66.29 1xfw n THR 757 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 1xfw h ASN 758 N 0.00 -0.47 -0.70 8.00 2.35 0.24 0.92 115.58 125.91 1xfw h ASN 758 Ca 0.06 0.13 0.05 0.00 -0.55 0.00 0.00 56.30 56.00 1xfw h ASN 758 Cb 0.16 0.29 -0.05 0.00 0.05 0.00 0.00 38.32 38.76 1xfw h ASN 758 CO -0.36 -0.17 0.41 -0.61 -1.65 0.00 0.00 177.43 175.05 1xfw h GLN 759 N -0.04 0.74 0.00 0.81 5.75 0.10 0.45 115.11 122.92 1xfw h GLN 759 Ca 0.20 -0.04 -0.11 0.00 -0.15 0.00 0.00 58.65 58.54 1xfw h GLN 759 Cb 0.34 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 28.71 1xfw h GLN 759 CO -0.44 0.49 -0.53 0.28 -2.65 0.00 0.00 178.83 175.97 1xfw h VAL 760 N 0.76 1.29 -0.12 2.39 2.07 0.32 -1.67 116.25 121.29 1xfw h VAL 760 Ca 0.31 -1.88 -0.10 0.00 0.82 0.00 0.00 66.70 65.85 1xfw h VAL 760 Cb 0.15 2.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1xfw h VAL 760 CO -0.17 0.52 -0.31 -0.61 0.02 0.00 0.00 177.57 177.03 1xfw h GLN 761 N 0.00 0.42 -0.54 1.57 5.75 0.24 -3.08 115.11 119.48 1xfw h GLN 761 Ca -0.01 -0.29 0.03 0.00 -0.15 0.00 0.00 58.65 58.23 1xfw h GLN 761 Cb 1.00 0.04 -0.04 0.00 1.07 0.00 0.00 27.48 29.55 1xfw h GLN 761 CO 0.07 0.91 0.31 1.25 -2.65 0.00 0.00 178.83 178.71 1xfw h LEU 762 N 0.01 0.48 -1.00 -2.39 5.85 -0.06 -0.37 115.31 117.83 1xfw h LEU 762 Ca -0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1xfw h LEU 762 Cb 0.92 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.86 1xfw h LEU 762 CO 0.07 0.34 0.00 0.18 -0.34 0.00 0.00 178.44 178.68 1xfw n LEU 763 N -4.81 0.53 -0.07 2.25 4.77 -0.64 -2.64 117.00 116.39 1xfw n LEU 763 Ca 0.04 0.70 -0.06 0.00 -0.03 0.00 0.00 56.01 56.66 1xfw n LEU 763 Cb 0.10 -0.70 -0.03 0.00 -2.33 0.00 0.00 43.42 40.46 1xfw n LEU 763 CO 0.31 -0.75 -0.31 -0.07 -1.33 0.00 0.00 177.39 175.25 1xfw h LEU 764 N 0.00 0.00 -0.26 2.23 3.38 -1.02 -3.36 115.31 116.29 1xfw h LEU 764 Ca 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1xfw h LEU 764 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1xfw h LEU 764 CO 0.00 0.81 0.00 0.35 0.09 0.00 0.00 178.44 179.69 1xfw n THR 765 N -4.62 0.00 -0.02 0.22 -2.24 -0.56 0.10 114.28 107.16 1xfw n THR 765 Ca -0.09 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.67 1xfw n THR 765 Cb 0.28 -0.37 -0.13 0.00 -2.10 0.00 0.00 70.33 68.02 1xfw n THR 765 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1xfw n HIS 766 N -0.25 0.47 0.02 4.78 8.25 -1.14 -4.88 115.22 122.48 1xfw n HIS 766 Ca 0.00 0.16 -0.00 0.00 -0.26 0.00 0.00 57.72 57.62 1xfw n HIS 766 Cb 0.00 -0.95 -0.00 0.00 1.12 0.00 0.00 29.99 30.16 1xfw n HIS 766 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 1xfw n GLN 767 N -2.72 0.01 -3.77 -0.41 7.27 0.29 -5.04 117.38 113.01 1xfw n GLN 767 Ca -0.16 0.01 -0.29 0.00 0.07 0.00 0.00 57.00 56.62 1xfw n GLN 767 Cb 0.90 -0.31 -0.16 0.00 2.41 0.00 0.00 30.24 33.08 1xfw n GLN 767 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 1xfw s LYS 768 N -1.57 0.83 -0.68 3.69 -0.14 -1.16 -5.10 119.74 115.61 1xfw s LYS 768 Ca -0.01 -0.78 0.03 0.00 -1.36 0.00 0.00 55.97 53.85 1xfw s LYS 768 Cb 0.00 -2.13 0.35 0.00 -1.68 0.00 0.00 37.83 34.36 1xfw s LYS 768 CO 0.01 -0.78 1.22 0.45 -0.76 0.00 0.00 175.35 175.49 1xfw n SER 769 N 4.91 5.31 -0.00 2.83 2.88 -1.26 -4.46 113.62 123.83 1xfw n SER 769 Ca -0.07 -3.70 0.04 0.00 -1.33 0.00 0.00 58.87 53.81 1xfw n SER 769 Cb 0.44 -0.71 -0.05 0.00 -0.75 0.00 0.00 64.21 63.14 1xfw n SER 769 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1xfw n ASN 770 N -0.25 1.53 -4.81 -3.46 4.05 -1.26 -5.00 115.26 106.06 1xfw n ASN 770 Ca 0.37 -0.40 -0.39 0.00 0.45 0.00 0.00 54.58 54.61 1xfw n ASN 770 Cb 0.38 1.15 -0.06 0.00 1.23 0.00 0.00 39.78 42.48 1xfw n ASN 770 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1xfw s ILE 771 N -2.06 4.78 0.08 -1.44 -1.09 -1.26 -5.10 121.20 115.11 1xfw s ILE 771 Ca 0.01 1.17 0.08 0.00 -2.23 0.00 0.00 60.65 59.68 1xfw s ILE 771 Cb 0.05 -3.87 -0.04 0.00 -1.58 0.00 0.00 42.46 37.02 1xfw s ILE 771 CO 0.32 0.55 -0.20 -1.61 -1.23 0.00 0.00 174.94 172.77 1xfw s GLU 772 N -1.07 1.86 0.12 2.79 2.02 -1.26 -4.99 118.70 118.17 1xfw s GLU 772 Ca 0.28 -1.11 -0.32 0.00 0.02 0.00 0.00 54.97 53.85 1xfw s GLU 772 Cb -0.19 -2.11 -0.10 0.00 0.10 0.00 0.00 34.13 31.83 1xfw s GLU 772 CO 0.18 0.51 1.58 0.35 0.02 0.00 0.00 175.26 177.89 1xfw h PHE 773 N 4.19 -1.31 -0.88 1.61 3.57 -1.94 0.15 116.94 122.32 1xfw h PHE 773 Ca -0.49 0.04 0.16 0.00 3.53 0.00 0.00 57.97 61.22 1xfw h PHE 773 Cb 1.16 0.57 -0.16 0.00 2.79 0.00 0.00 35.95 40.31 1xfw h PHE 773 CO 0.56 -0.53 -0.27 -0.22 -2.23 0.00 0.00 178.31 175.62 1xfw h LYS 774 N -0.62 -0.02 0.43 1.11 3.64 -2.00 0.43 116.57 119.55 1xfw h LYS 774 Ca 0.03 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 1xfw h LYS 774 Cb 0.69 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1xfw h LYS 774 CO -0.32 -0.01 -0.21 -0.07 -2.27 0.00 0.00 179.45 176.57 1xfw h LEU 775 N -0.02 -0.49 -1.28 5.20 3.38 -1.87 -2.80 115.31 117.43 1xfw h LEU 775 Ca 0.39 0.02 0.46 0.00 0.09 0.00 0.00 57.88 58.84 1xfw h LEU 775 Cb 0.63 0.13 -0.15 0.00 0.09 0.00 0.00 40.66 41.36 1xfw h LEU 775 CO -0.91 -0.18 0.80 -0.11 0.09 0.00 0.00 178.44 178.13 1xfw n LEU 776 N -4.50 0.24 0.35 1.67 0.00 0.48 0.46 117.00 115.70 1xfw n LEU 776 Ca -0.07 1.43 -0.15 0.00 0.00 0.00 0.00 56.01 57.22 1xfw n LEU 776 Cb 0.23 -0.70 -0.07 0.00 0.00 0.00 0.00 43.42 42.87 1xfw n LEU 776 CO 0.17 -1.57 0.41 0.22 0.00 0.00 0.00 177.39 176.62 1xfw h TYR 777 N 0.00 -0.85 -0.73 1.96 3.20 -0.89 -3.27 116.97 116.39 1xfw h TYR 777 Ca 0.87 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.78 1xfw h TYR 777 Cb 2.68 0.28 -0.09 0.00 1.54 0.00 0.00 36.73 41.14 1xfw h TYR 777 CO -0.01 -0.51 -0.43 1.63 -1.64 0.00 0.00 178.16 177.20 1xfw n LYS 778 N -5.39 -0.32 0.00 1.82 4.76 0.17 0.28 118.16 119.48 1xfw n LYS 778 Ca -0.12 1.14 0.00 0.00 -2.87 0.00 0.00 58.31 56.47 1xfw n LYS 778 Cb 0.37 -1.68 0.00 0.00 -1.84 0.00 0.00 35.03 31.88 1xfw n LYS 778 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1xfw n GLN 779 N -4.84 0.00 -2.98 1.97 6.02 -1.03 -4.70 117.38 111.83 1xfw n GLN 779 Ca 0.01 0.13 -0.22 0.00 -0.01 0.00 0.00 57.00 56.92 1xfw n GLN 779 Cb 0.19 -1.56 0.01 0.00 1.02 0.00 0.00 30.24 29.90 1xfw n GLN 779 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1xfw s LEU 780 N -2.08 3.61 -0.43 1.08 2.01 0.14 -5.00 118.68 118.02 1xfw s LEU 780 Ca 0.00 0.12 0.02 0.00 0.01 0.00 0.00 54.13 54.28 1xfw s LEU 780 Cb 0.00 -3.01 0.15 0.00 0.01 0.00 0.00 46.19 43.33 1xfw s LEU 780 CO 0.00 -0.76 0.28 0.21 1.01 0.00 0.00 176.35 177.09 1xfw s ASN 781 N -4.26 3.01 -1.12 2.29 3.04 -1.26 -5.02 114.94 111.62 1xfw s ASN 781 Ca 0.50 -2.73 -0.05 0.00 0.04 0.00 0.00 52.86 50.62 1xfw s ASN 781 Cb -0.10 -0.76 0.28 0.00 -1.54 0.00 0.00 41.25 39.13 1xfw s ASN 781 CO 0.37 -0.24 1.54 0.49 -3.04 0.00 0.00 177.10 176.22 1xfw n PHE 782 N 3.36 2.48 0.00 0.43 3.01 -1.26 -4.70 117.46 120.78 1xfw n PHE 782 Ca 0.16 -2.66 0.00 0.00 1.01 0.00 0.00 57.45 55.96 1xfw n PHE 782 Cb 0.39 -1.40 0.00 0.00 -0.01 0.00 0.00 39.48 38.46 1xfw n PHE 782 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 1xfw n THR 783 N 1.73 0.00 0.11 4.37 -1.04 -1.26 -5.00 114.28 113.19 1xfw n THR 783 Ca 0.28 0.00 0.05 0.00 -2.04 0.00 0.00 64.05 62.35 1xfw n THR 783 Cb 0.34 -0.17 -0.08 0.00 -1.82 0.00 0.00 70.33 68.61 1xfw n THR 783 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 1xfw n GLU 784 N 0.00 1.07 -3.81 -2.82 0.28 -1.26 -4.96 120.64 109.14 1xfw n GLU 784 Ca 0.00 -0.08 -0.26 0.00 -0.16 0.00 0.00 57.16 56.66 1xfw n GLU 784 Cb 0.00 -1.19 -0.17 0.00 1.43 0.00 0.00 31.44 31.51 1xfw n GLU 784 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1xfw s ASN 785 N -2.94 2.33 0.03 -1.84 2.20 -1.26 -4.99 114.94 108.47 1xfw s ASN 785 Ca -0.02 -0.45 0.16 0.00 -0.94 0.00 0.00 52.86 51.61 1xfw s ASN 785 Cb 0.07 -0.66 -0.16 0.00 -2.00 0.00 0.00 41.25 38.50 1xfw s ASN 785 CO 0.44 -0.21 0.75 1.21 -2.94 0.00 0.00 177.10 176.35 1xfw n GLU 786 N 5.02 0.63 0.00 3.55 4.07 -1.26 -4.54 120.64 128.11 1xfw n GLU 786 Ca -0.10 0.22 0.00 0.00 -0.06 0.00 0.00 57.16 57.22 1xfw n GLU 786 Cb 0.49 -1.79 0.00 0.00 -0.06 0.00 0.00 31.44 30.08 1xfw n GLU 786 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1xfw n THR 787 N -2.90 0.00 0.60 6.31 -2.24 -1.26 -0.31 114.28 114.49 1xfw n THR 787 Ca -0.12 0.22 0.08 0.00 -2.27 0.00 0.00 64.05 61.97 1xfw n THR 787 Cb 0.89 -0.37 0.37 0.00 -2.10 0.00 0.00 70.33 69.12 1xfw n THR 787 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1xfw n ASP 788 N -0.36 0.00 -0.32 3.42 5.75 -1.26 -3.27 116.55 120.52 1xfw n ASP 788 Ca 0.00 0.46 -0.02 0.00 -0.01 0.00 0.00 54.79 55.22 1xfw n ASP 788 Cb 0.00 -0.48 0.11 0.00 -1.03 0.00 0.00 41.12 39.72 1xfw n ASP 788 CO 0.00 0.00 0.00 -1.13 -0.11 0.00 0.00 177.20 175.96 1xfw h ASN 789 N 0.00 0.93 -0.48 -1.12 -0.73 -0.90 1.24 115.58 114.51 1xfw h ASN 789 Ca 0.00 -0.01 -0.07 0.00 1.87 0.00 0.00 56.30 58.09 1xfw h ASN 789 Cb 0.28 -0.21 -0.02 0.00 0.27 0.00 0.00 38.32 38.64 1xfw h ASN 789 CO 0.00 0.64 0.02 0.15 -0.37 0.00 0.00 177.43 177.88 1xfw h PHE 790 N 1.09 0.91 -0.81 0.67 3.57 -1.51 0.16 116.94 121.02 1xfw h PHE 790 Ca 0.34 -0.15 0.07 0.00 3.53 0.00 0.00 57.97 61.76 1xfw h PHE 790 Cb -0.01 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 38.44 1xfw h PHE 790 CO -0.02 0.86 0.53 0.93 -2.23 0.00 0.00 178.31 178.38 1xfw h GLU 791 N 0.70 0.85 -0.40 1.11 5.08 -1.05 0.55 114.58 121.42 1xfw h GLU 791 Ca 0.14 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.41 1xfw h GLU 791 Cb 0.48 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1xfw h GLU 791 CO 0.02 0.56 0.11 0.28 -1.00 0.00 0.00 179.01 178.97 1xfw h VAL 792 N 0.87 1.23 -0.41 3.13 2.07 0.25 -3.04 116.25 120.35 1xfw h VAL 792 Ca 0.35 -0.76 0.06 0.00 0.82 0.00 0.00 66.70 67.17 1xfw h VAL 792 Cb 0.26 0.96 -0.05 0.00 -1.52 0.00 0.00 31.29 30.94 1xfw h VAL 792 CO -0.13 0.27 0.09 0.15 0.02 0.00 0.00 177.57 177.97 1xfw h PHE 793 N 0.50 0.15 -0.18 1.57 3.57 0.14 -2.55 116.94 120.15 1xfw h PHE 793 Ca 0.13 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.69 1xfw h PHE 793 Cb 0.30 -0.01 -0.07 0.00 2.79 0.00 0.00 35.95 38.96 1xfw h PHE 793 CO 0.02 0.02 -0.46 0.37 -2.23 0.00 0.00 178.31 176.03 1xfw h GLN 794 N 0.23 -0.47 0.00 1.11 -0.00 -1.12 0.12 115.11 114.97 1xfw h GLN 794 Ca 0.20 0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.88 1xfw h GLN 794 Cb 0.23 0.11 0.00 0.00 0.00 0.00 0.00 27.48 27.82 1xfw h GLN 794 CO -0.25 -0.32 0.00 0.87 0.00 0.00 0.00 178.83 179.13 1xfw h LYS 795 N -0.49 0.00 0.00 1.69 1.57 -1.48 -0.47 116.57 117.38 1xfw h LYS 795 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1xfw h LYS 795 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 1xfw h LYS 795 CO -0.44 0.00 0.00 -0.89 -0.57 0.00 0.00 179.45 177.55 1xfw n ILE 796 N -2.45 0.72 -3.81 1.86 2.08 0.42 -3.98 119.36 114.20 1xfw n ILE 796 Ca -0.02 0.16 -0.28 0.00 0.56 0.00 0.00 62.75 63.18 1xfw n ILE 796 Cb 0.05 -0.88 -0.12 0.00 -0.75 0.00 0.00 39.64 37.94 1xfw n ILE 796 CO 0.00 0.00 0.00 0.27 0.56 0.00 0.00 176.55 177.38 1xfw s ILE 797 N -3.04 2.37 0.00 1.39 -4.36 -0.19 -5.06 121.20 112.32 1xfw s ILE 797 Ca 0.09 -3.85 0.00 0.00 -0.26 0.00 0.00 60.65 56.62 1xfw s ILE 797 Cb 0.12 -2.58 0.00 0.00 1.25 0.00 0.00 42.46 41.25 1xfw s ILE 797 CO 0.36 -1.02 0.00 0.47 0.24 0.00 0.00 174.94 174.98