#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 6.53 -0.08 6.41 -0.87 -1.26 -4.95 114.94 120.71 1xfw s ASN 65 Ca 0.00 2.54 -0.16 0.00 -1.57 0.00 0.00 52.86 53.67 1xfw s ASN 65 Cb 0.00 -2.54 -0.13 0.00 -0.02 0.00 0.00 41.25 38.56 1xfw s ASN 65 CO 0.00 -0.98 0.57 0.25 -2.57 0.00 0.00 177.10 174.37 1xfw h LEU 66 N 9.87 -0.12 -9.60 0.60 5.85 -1.97 -3.46 115.31 116.48 1xfw h LEU 66 Ca -0.45 -0.35 -0.57 0.00 0.84 0.00 0.00 57.88 57.35 1xfw h LEU 66 Cb 1.21 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.22 1xfw h LEU 66 CO 0.94 0.49 -0.04 0.54 -0.34 0.00 0.00 178.44 180.03 1xfw s VAL 67 N -2.62 4.86 -0.09 1.05 0.11 -1.26 -1.11 120.40 121.34 1xfw s VAL 67 Ca -0.10 1.19 0.05 0.00 -2.93 0.00 0.00 61.98 60.18 1xfw s VAL 67 Cb -0.00 -3.89 -0.00 0.00 -1.53 0.00 0.00 36.38 30.95 1xfw s VAL 67 CO 0.36 0.49 -0.24 -0.54 -3.33 0.00 0.00 175.10 171.83 1xfw s LYS 68 N -0.61 2.90 -0.36 1.54 3.01 -0.51 -4.94 119.74 120.75 1xfw s LYS 68 Ca 0.29 -0.88 -0.07 0.00 -1.01 0.00 0.00 55.97 54.30 1xfw s LYS 68 Cb -0.18 -2.26 0.05 0.00 -1.01 0.00 0.00 37.83 34.43 1xfw s LYS 68 CO 0.17 0.25 0.15 0.95 0.51 0.00 0.00 175.35 177.38 1xfw s THR 69 N 0.18 3.88 0.00 2.17 -4.23 -1.26 -1.53 115.64 114.85 1xfw s THR 69 Ca -0.14 -1.24 0.00 0.00 -1.18 0.00 0.00 61.69 59.13 1xfw s THR 69 Cb -0.17 -3.27 0.00 0.00 1.34 0.00 0.00 72.50 70.41 1xfw s THR 69 CO 0.07 -0.29 0.75 1.21 -0.54 0.00 0.00 174.62 175.83 1xfw n GLU 70 N 4.83 0.00 -3.44 3.99 4.07 0.12 -4.59 120.64 125.61 1xfw n GLU 70 Ca -0.11 0.34 -0.43 0.00 -0.06 0.00 0.00 57.16 56.90 1xfw n GLU 70 Cb 0.44 -1.29 -0.09 0.00 -0.06 0.00 0.00 31.44 30.44 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 -2.19 3.24 -1.39 4.31 5.99 -1.26 -4.92 117.98 121.75 1xfw s PHE 71 Ca 0.00 -0.69 -0.09 0.00 0.00 0.00 0.00 56.93 56.15 1xfw s PHE 71 Cb 0.00 -2.75 -0.10 0.00 0.00 0.00 0.00 43.02 40.18 1xfw s PHE 71 CO 0.00 -0.65 3.01 0.25 -0.00 0.00 0.00 175.22 177.84 1xfw n THR 72 N 5.17 4.21 -0.13 0.12 -2.24 -1.26 -4.39 114.28 115.75 1xfw n THR 72 Ca -0.11 -2.56 -0.28 0.00 -2.27 0.00 0.00 64.05 58.83 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 -4.99 115.26 119.98 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 55.98 1xfw n GLU 74 Cb 0.85 -0.57 0.00 0.00 -1.01 0.00 0.00 31.44 30.70 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 -0.15 2.62 -2.24 -1.26 -4.81 114.28 105.23 1xfw n THR 75 Ca 0.06 0.00 0.28 0.00 -2.27 0.00 0.00 64.05 62.11 1xfw n THR 75 Cb 0.21 -0.19 0.72 0.00 -2.10 0.00 0.00 70.33 68.98 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 -0.87 3.22 -0.00 -1.97 -1.50 115.31 114.18 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 0.28 0.44 -0.00 0.00 0.00 178.44 179.16 1xfw h ASP 77 N 0.00 0.10 0.00 -0.43 3.45 -1.92 3.05 116.42 120.66 1xfw h ASP 77 Ca 0.40 0.18 -0.02 0.00 0.43 0.00 0.00 57.03 58.02 1xfw h ASP 77 Cb 1.65 0.22 -0.00 0.00 -0.56 0.00 0.00 39.33 40.64 1xfw h ASP 77 CO -0.00 -0.11 -0.15 0.50 -1.57 0.00 0.00 179.24 177.91 1xfw h LYS 78 N 0.26 0.00 0.11 3.56 1.63 -1.59 -3.26 116.57 117.28 1xfw h LYS 78 Ca 0.55 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 60.35 1xfw h LYS 78 Cb 1.08 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.70 1xfw h LYS 78 CO -0.61 0.55 -0.20 0.82 -3.45 0.00 0.00 179.45 176.56 1xfw h ILE 79 N -1.00 0.00 0.00 2.00 2.04 -1.24 -0.12 117.51 119.19 1xfw h ILE 79 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1xfw h ILE 79 Cb 0.61 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 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 -3.55 0.00 -0.05 2.37 -0.06 1.01 -0.22 117.38 116.88 1xfw n GLN 80 Ca -0.04 0.00 -0.07 0.00 -2.00 0.00 0.00 57.00 54.90 1xfw n GLN 80 Cb 0.17 -1.02 -0.06 0.00 -4.06 0.00 0.00 30.24 25.27 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 -0.47 1.16 0.15 3.69 7.27 -0.15 -3.58 117.38 125.44 1xfw n GLN 81 Ca 0.00 0.04 0.00 0.00 0.07 0.00 0.00 57.00 57.11 1xfw n GLN 81 Cb 0.00 -1.23 0.20 0.00 2.41 0.00 0.00 30.24 31.62 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 1.30 0.40 1.69 1.35 0.37 -2.09 112.91 115.93 1xfw h THR 82 Ca -0.25 -2.03 -0.02 0.00 -0.55 0.00 0.00 66.41 63.56 1xfw h THR 82 Cb 1.46 2.13 0.00 0.00 -1.73 0.00 0.00 68.15 70.01 1xfw h THR 82 CO -0.02 0.56 -0.19 1.56 -0.25 0.00 0.00 175.52 177.18 1xfw h GLN 83 N 0.00 -0.51 0.00 4.72 4.20 -1.44 -1.76 115.11 120.31 1xfw h GLN 83 Ca -0.01 0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1xfw h GLN 83 Cb 1.08 0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.98 1xfw h GLN 83 CO 0.07 -0.33 0.32 -0.25 -0.67 0.00 0.00 178.83 177.98 1xfw n ASP 84 N -5.13 0.02 -0.11 1.46 8.00 -1.19 -0.61 116.55 118.99 1xfw n ASP 84 Ca -0.07 0.22 -0.20 0.00 0.71 0.00 0.00 54.79 55.45 1xfw n ASP 84 Cb 0.22 -0.20 -0.09 0.00 -0.02 0.00 0.00 41.12 41.03 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 -1.26 1.88 0.15 0.64 7.94 -0.79 -4.49 117.00 121.07 1xfw n LEU 85 Ca -0.00 0.43 0.02 0.00 -1.11 0.00 0.00 56.01 55.34 1xfw n LEU 85 Cb 0.32 -0.90 0.21 0.00 0.53 0.00 0.00 43.42 43.59 1xfw n LEU 85 CO 0.00 0.19 0.55 -0.07 -1.11 0.00 0.00 177.39 176.95 1xfw h LEU 86 N -1.00 0.00 0.00 -1.96 3.38 0.01 -3.06 115.31 112.68 1xfw h LEU 86 Ca -0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1xfw h LEU 86 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1xfw h LEU 86 CO -0.22 0.53 0.00 2.29 0.09 0.00 0.00 178.44 181.14 1xfw n LYS 87 N -3.62 0.09 -0.07 1.13 2.85 -0.52 -1.45 118.16 116.59 1xfw n LYS 87 Ca -0.00 0.24 -0.03 0.00 -1.05 0.00 0.00 58.31 57.46 1xfw n LYS 87 Cb 0.60 -1.50 -0.15 0.00 -0.65 0.00 0.00 35.03 33.33 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 -1.32 0.80 -2.83 -1.58 0.00 -1.16 -4.90 118.16 107.17 1xfw n LYS 88 Ca 0.03 -0.07 -0.41 0.00 0.00 0.00 0.00 58.31 57.87 1xfw n LYS 88 Cb 0.07 -1.49 -0.05 0.00 0.00 0.00 0.00 35.03 33.56 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 -2.79 4.60 -0.14 3.15 1.01 -0.53 -4.96 121.20 121.53 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 38.25 1xfw s ILE 89 CO 0.81 0.33 2.10 -2.16 0.00 0.00 0.00 174.94 176.02 1xfw s PRO 90 N 0.00 3.49 0.05 2.79 0.04 -1.26 -4.86 135.00 135.25 1xfw s PRO 90 Ca 0.44 2.18 -0.03 0.00 0.04 0.00 0.00 61.00 63.62 1xfw s PRO 90 Cb -0.22 -4.29 0.06 0.00 0.04 0.00 0.00 34.50 30.09 1xfw s PRO 90 CO 0.27 -1.70 0.33 1.17 0.04 0.00 0.00 177.00 177.11 1xfw n LYS 91 N 8.31 -0.04 -0.35 4.56 3.00 -1.26 0.17 118.16 132.56 1xfw n LYS 91 Ca 0.26 0.33 -0.03 0.00 -0.00 0.00 0.00 58.31 58.86 1xfw n LYS 91 Cb 0.44 -0.49 0.09 0.00 0.00 0.00 0.00 35.03 35.07 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 1.14 -0.02 3.14 3.32 -1.96 -0.44 116.42 121.60 1xfw h ASP 92 Ca 0.08 -0.09 0.01 0.00 0.02 0.00 0.00 57.03 57.05 1xfw h ASP 92 Cb 0.13 -0.29 -0.00 0.00 0.22 0.00 0.00 39.33 39.39 1xfw h ASP 92 CO -0.21 0.89 0.19 1.62 -1.72 0.00 0.00 179.24 180.01 1xfw h VAL 93 N 1.29 0.05 0.07 -1.35 3.04 0.14 0.40 116.25 119.89 1xfw h VAL 93 Ca 0.33 0.00 -0.11 0.00 -1.01 0.00 0.00 66.70 65.91 1xfw h VAL 93 Cb -0.01 0.81 0.01 0.00 -2.01 0.00 0.00 31.29 30.09 1xfw h VAL 93 CO -0.06 0.00 -0.50 -0.07 -1.01 0.00 0.00 177.57 175.93 1xfw h LEU 94 N 0.00 0.24 -2.54 3.16 3.38 -1.05 -2.95 115.31 115.55 1xfw h LEU 94 Ca 0.01 -0.95 0.01 0.00 0.09 0.00 0.00 57.88 57.04 1xfw h LEU 94 Cb 0.40 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 1xfw h LEU 94 CO -0.00 1.23 0.14 -0.33 0.09 0.00 0.00 178.44 179.57 1xfw h GLU 95 N -0.67 0.00 0.00 1.13 4.39 0.06 1.25 114.58 120.74 1xfw h GLU 95 Ca -0.09 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 -0.02 0.00 -0.10 0.00 0.00 28.75 29.98 1xfw h GLU 95 CO 0.07 0.00 -0.82 0.82 -1.16 0.00 0.00 179.01 177.92 1xfw h ILE 96 N 0.00 1.43 0.05 3.13 2.04 -0.75 -2.88 117.51 120.54 1xfw h ILE 96 Ca 0.02 -2.97 -0.00 0.00 1.00 0.00 0.00 64.86 62.90 1xfw h ILE 96 Cb 0.29 2.67 0.00 0.00 -0.74 0.00 0.00 36.82 39.04 1xfw h ILE 96 CO -0.00 0.80 -0.03 0.22 0.00 0.00 0.00 178.15 179.15 1xfw h TYR 97 N 0.00 -0.07 -1.54 1.37 -0.00 0.15 -3.08 116.97 113.81 1xfw h TYR 97 Ca -0.01 -0.00 0.45 0.00 -0.00 0.00 0.00 58.73 59.17 1xfw h TYR 97 Cb 1.61 0.02 -0.07 0.00 -0.00 0.00 0.00 36.73 38.29 1xfw h TYR 97 CO 0.00 -0.04 1.10 0.66 -0.00 0.00 0.00 178.16 179.88 1xfw h SER 98 N -0.47 0.03 -0.18 -2.11 4.64 -0.67 1.27 113.55 116.05 1xfw h SER 98 Ca -0.01 0.01 -0.06 0.00 -0.47 0.00 0.00 61.79 61.27 1xfw h SER 98 Cb 0.05 0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1xfw h SER 98 CO 0.01 -0.01 -0.10 -0.08 -0.87 0.00 0.00 176.83 175.78 1xfw h GLU 99 N 0.02 0.39 -0.91 4.77 4.57 -1.59 -1.44 114.58 120.39 1xfw h GLU 99 Ca 0.75 -0.18 0.00 0.00 -1.18 0.00 0.00 59.36 58.75 1xfw h GLU 99 Cb 2.93 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 31.51 1xfw h GLU 99 CO -0.04 0.70 0.00 1.28 -1.18 0.00 0.00 179.01 179.77 1xfw n LEU 100 N -4.57 0.99 -1.04 1.64 4.77 0.43 -4.71 117.00 114.51 1xfw n LEU 100 Ca -0.05 -0.50 -0.12 0.00 -0.03 0.00 0.00 56.01 55.31 1xfw n LEU 100 Cb 0.32 -0.27 -0.05 0.00 -2.33 0.00 0.00 43.42 41.09 1xfw n LEU 100 CO 0.39 0.19 -0.12 0.61 -1.33 0.00 0.00 177.39 177.14 1xfw n GLY 101 N 0.43 1.15 3.66 -0.72 0.00 -0.54 -4.10 105.19 105.08 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 -2.23 1.56 -0.23 -0.02 0.00 -1.03 -4.69 107.32 100.68 1xfw s GLY 102 Ca 0.00 -0.48 -0.12 0.00 0.00 0.00 0.00 44.72 44.12 1xfw s GLY 102 CO 0.00 0.19 0.56 -0.54 0.00 0.00 0.00 173.10 173.31 1xfw s GLU 103 N -5.04 0.55 -0.09 2.90 2.02 -1.14 -4.47 118.70 113.44 1xfw s GLU 103 Ca 0.66 1.07 -0.16 0.00 0.02 0.00 0.00 54.97 56.56 1xfw s GLU 103 Cb -0.17 0.15 -0.05 0.00 0.10 0.00 0.00 34.13 34.16 1xfw s GLU 103 CO 0.57 -0.16 0.40 0.42 0.02 0.00 0.00 175.26 176.50 1xfw s ILE 104 N 1.73 5.17 -0.26 -1.63 1.01 -0.27 -2.66 121.20 124.29 1xfw s ILE 104 Ca -0.09 0.79 -0.06 0.00 0.00 0.00 0.00 60.65 61.29 1xfw s ILE 104 Cb -0.07 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.67 1xfw s ILE 104 CO -0.17 0.44 0.03 -0.31 0.00 0.00 0.00 174.94 174.93 1xfw s TYR 105 N -0.04 3.08 -0.14 3.97 4.12 0.79 -1.43 117.35 127.71 1xfw s TYR 105 Ca 0.22 -0.94 -0.03 0.00 0.02 0.00 0.00 57.07 56.34 1xfw s TYR 105 Cb -0.15 -2.19 -0.03 0.00 -1.52 0.00 0.00 41.96 38.07 1xfw s TYR 105 CO 0.09 -0.55 -0.04 -0.06 0.02 0.00 0.00 175.55 175.01 1xfw s PHE 106 N 1.49 3.01 0.34 2.71 0.08 -0.58 0.32 117.98 125.35 1xfw s PHE 106 Ca 0.04 -0.26 0.03 0.00 0.12 0.00 0.00 56.93 56.86 1xfw s PHE 106 Cb -0.16 -1.92 -0.01 0.00 -0.57 0.00 0.00 43.02 40.36 1xfw s PHE 106 CO 0.00 0.02 0.12 0.25 -0.10 0.00 0.00 175.22 175.51 1xfw n THR 107 N 3.33 0.00 0.00 0.64 -2.24 0.18 0.10 114.28 116.29 1xfw n THR 107 Ca -0.18 -1.96 0.00 0.00 -2.27 0.00 0.00 64.05 59.64 1xfw n THR 107 Cb 0.53 0.70 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 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 -1.61 0.00 -3.74 3.42 4.64 -1.26 -3.42 116.55 114.58 1xfw n ASP 108 Ca -0.05 0.00 -0.28 0.00 -1.38 0.00 0.00 54.79 53.08 1xfw n ASP 108 Cb 0.50 0.00 -0.12 0.00 -1.04 0.00 0.00 41.12 40.47 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 -3.87 121.20 123.88 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 -0.02 3.58 1.11 -1.26 -5.00 116.67 118.39 1xfw s ASP 110 Ca 0.25 -1.54 -0.01 0.00 0.18 0.00 0.00 52.55 51.42 1xfw s ASP 110 Cb -0.09 -0.79 -0.00 0.00 1.07 0.00 0.00 42.92 43.11 1xfw s ASP 110 CO -0.12 -0.41 -0.03 0.18 1.18 0.00 0.00 175.17 175.97 1xfw n LEU 111 N 4.91 0.20 0.00 1.23 4.77 -1.26 -4.75 117.00 122.10 1xfw n LEU 111 Ca -0.03 0.16 -0.24 0.00 -0.03 0.00 0.00 56.01 55.87 1xfw n LEU 111 Cb 0.42 -0.53 0.23 0.00 -2.33 0.00 0.00 43.42 41.21 1xfw n LEU 111 CO 0.11 -0.49 0.27 0.52 -1.33 0.00 0.00 177.39 176.47 1xfw n VAL 112 N -2.61 0.00 -0.22 4.08 0.31 -1.26 -4.63 118.33 113.99 1xfw n VAL 112 Ca -0.01 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.14 1xfw n VAL 112 Cb 0.04 -0.76 -0.04 0.00 -0.91 0.00 0.00 33.84 32.16 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 -4.59 0.08 -0.00 5.55 1.02 -1.26 -3.77 120.64 117.66 1xfw n GLU 113 Ca 0.11 -0.73 0.01 0.00 -0.02 0.00 0.00 57.16 56.53 1xfw n GLU 113 Cb 0.47 -2.21 -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 6.46 0.00 -2.02 -0.32 -0.00 -1.26 -4.82 115.22 113.25 1xfw n HIS 114 Ca 0.19 0.00 -0.39 0.00 0.46 0.00 0.00 57.72 57.98 1xfw n HIS 114 Cb 0.16 -0.06 0.00 0.00 -0.12 0.00 0.00 29.99 29.97 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 -2.17 3.85 0.00 1.57 1.02 -1.25 -4.81 119.74 117.95 1xfw s LYS 115 Ca -0.01 2.15 0.00 0.00 0.02 0.00 0.00 55.97 58.13 1xfw s LYS 115 Cb 0.02 -2.67 0.00 0.00 -0.52 0.00 0.00 37.83 34.66 1xfw s LYS 115 CO 0.11 -0.59 0.00 -0.85 -0.92 0.00 0.00 175.35 173.09 1xfw n GLU 116 N -0.06 0.00 -0.22 1.68 0.28 -1.26 -0.15 120.64 120.91 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 32.31 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 0.05 0.00 -1.47 -1.84 7.99 -1.26 -4.94 117.00 115.54 1xfw n LEU 117 Ca 0.00 -0.64 0.06 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 0.54 0.82 0.00 -1.51 0.00 0.00 177.39 177.24 1xfw n GLN 118 N 0.00 3.90 0.00 3.23 1.13 0.79 -4.99 117.38 121.45 1xfw n GLN 118 Ca 0.00 -3.03 0.00 0.00 -1.94 0.00 0.00 57.00 52.03 1xfw n GLN 118 Cb 0.52 -2.08 0.00 0.00 0.11 0.00 0.00 30.24 28.79 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 0.03 0.00 -4.17 1.08 10.43 -1.26 -4.66 116.55 118.00 1xfw n ASP 119 Ca 0.27 0.00 -0.43 0.00 2.57 0.00 0.00 54.79 57.20 1xfw n ASP 119 Cb 1.09 0.00 0.00 0.00 1.84 0.00 0.00 41.12 44.05 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 6.56 0.00 -4.04 1.96 7.64 -1.26 -4.91 113.62 119.56 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 -5.06 118.70 117.62 1xfw s GLU 122 Ca 0.00 -3.04 0.00 0.00 0.03 0.00 0.00 54.97 51.96 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 -2.45 -4.83 0.00 -1.26 -4.50 120.64 113.72 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 2.35 3.53 0.00 3.44 2.56 -1.26 -4.92 118.70 124.41 1xfw s GLU 124 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 54.97 55.60 1xfw s GLU 124 Cb 0.00 -4.02 0.00 0.00 2.00 0.00 0.00 34.13 32.11 1xfw s GLU 124 CO 0.00 -1.63 0.00 1.63 -0.56 0.00 0.00 175.26 174.70 1xfw n LYS 125 N 8.22 0.00 -3.85 4.30 4.76 -1.26 -4.99 118.16 125.33 1xfw n LYS 125 Ca 0.13 0.02 -0.35 0.00 -2.87 0.00 0.00 58.31 55.24 1xfw n LYS 125 Cb 0.49 -0.18 -0.08 0.00 -1.84 0.00 0.00 35.03 33.41 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 -1.52 6.03 -1.02 4.39 -0.87 -1.26 -5.06 114.94 115.63 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 -2.03 0.04 0.00 -0.02 0.00 0.00 41.25 39.24 1xfw s ASN 126 CO 0.00 0.22 1.54 -0.44 -2.57 0.00 0.00 177.10 175.84 1xfw s SER 127 N 0.12 6.32 -0.31 -1.22 0.01 -1.26 -4.84 113.70 112.52 1xfw s SER 127 Ca 0.08 -1.40 -0.01 0.00 1.31 0.00 0.00 55.95 55.93 1xfw s SER 127 Cb -0.12 -2.57 0.13 0.00 0.21 0.00 0.00 66.02 63.67 1xfw s SER 127 CO -0.00 -1.67 0.25 0.00 0.41 0.00 0.00 173.24 172.22 1xfw s MET 128 N 5.23 0.36 0.00 12.44 0.23 -1.26 -4.99 119.30 131.31 1xfw s MET 128 Ca 0.50 -0.50 0.00 0.00 -1.03 0.00 0.00 55.69 54.66 1xfw s MET 128 Cb -0.01 -0.88 0.00 0.00 -1.53 0.00 0.00 34.83 32.41 1xfw s MET 128 CO -0.08 -1.07 0.00 0.09 -2.03 0.00 0.00 175.02 171.93 1xfw n ASN 129 N 4.99 0.00 -2.80 -1.18 5.03 -1.26 -5.06 115.26 114.99 1xfw n ASN 129 Ca 0.00 0.00 -0.06 0.00 0.87 0.00 0.00 54.58 55.39 1xfw n ASN 129 Cb 0.44 -0.15 0.03 0.00 -1.02 0.00 0.00 39.78 39.08 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 -2.39 0.48 -0.21 6.41 3.41 -1.26 -4.97 113.62 115.10 1xfw n SER 130 Ca 0.00 -1.38 -0.05 0.00 -0.26 0.00 0.00 58.87 57.18 1xfw n SER 130 Cb 0.00 -0.17 -0.05 0.00 -0.26 0.00 0.00 64.21 63.73 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 -1.48 -0.22 0.00 4.33 0.63 -1.26 -4.36 116.66 114.30 1xfw n ARG 131 Ca 0.05 0.85 0.00 0.00 -0.92 0.00 0.00 57.85 57.83 1xfw n ARG 131 Cb 0.18 -1.25 0.00 0.00 0.45 0.00 0.00 32.46 31.83 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 -1.12 1.69 2.81 5.14 0.00 -1.26 -5.09 105.19 107.36 1xfw n GLY 132 Ca 0.01 -1.75 -0.20 0.00 0.00 0.00 0.00 46.02 44.08 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 3.43 0.54 0.00 1.61 2.56 -1.26 -4.22 118.70 121.35 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 4.53 0.00 -3.67 4.30 4.81 -1.26 -4.97 118.16 121.91 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 -0.70 0.02 0.00 0.02 0.00 0.00 35.03 34.87 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 -2.02 -1.68 -1.22 3.15 3.14 -1.26 -4.91 118.33 113.52 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 -2.59 0.17 0.00 -1.06 0.00 0.00 33.84 30.59 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 -4.34 2.29 0.00 1.45 -0.04 -1.26 -4.91 135.00 128.19 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 -1.11 0.00 0.00 0.54 -0.00 -1.26 -1.72 117.46 113.91 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 1.55 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 41.03 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 0.79 0.00 0.00 0.00 0.00 19.45 20.24 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 -4.06 0.00 4.64 -1.75 -3.40 113.55 108.98 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 -2.67 -0.32 0.00 4.77 5.12 0.60 -4.98 116.66 119.17 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 29.27 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 -3.95 0.00 -4.38 -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 -0.28 1.22 0.04 1.97 1.01 -1.26 -2.20 120.40 120.90 1xfw s VAL 142 Ca 0.00 -0.48 -0.07 0.00 0.00 0.00 0.00 61.98 61.43 1xfw s VAL 142 Cb 0.00 -1.14 -0.01 0.00 0.00 0.00 0.00 36.38 35.23 1xfw s VAL 142 CO 0.00 0.38 0.12 0.12 0.00 0.00 0.00 175.10 175.73 1xfw s PHE 143 N 1.01 0.16 -0.12 5.22 5.36 -0.22 -5.00 117.98 124.40 1xfw s PHE 143 Ca -0.07 -0.44 -0.01 0.00 -0.96 0.00 0.00 56.93 55.45 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 -0.38 -0.05 -2.00 -1.46 0.00 0.00 175.22 171.31 1xfw s GLU 144 N -2.60 1.31 -0.72 10.12 2.56 -1.26 0.43 118.70 128.54 1xfw s GLU 144 Ca -0.05 -0.25 -0.27 0.00 0.00 0.00 0.00 54.97 54.41 1xfw s GLU 144 Cb -0.01 -1.58 0.02 0.00 2.00 0.00 0.00 34.13 34.56 1xfw s GLU 144 CO -0.04 -0.32 1.44 0.21 -0.56 0.00 0.00 175.26 175.98 1xfw s LYS 145 N 1.75 3.06 0.55 4.30 2.20 -0.42 -4.92 119.74 126.26 1xfw s LYS 145 Ca 0.04 -0.07 0.28 0.00 -0.36 0.00 0.00 55.97 55.86 1xfw s LYS 145 Cb -0.13 -4.29 1.60 0.00 -1.51 0.00 0.00 37.83 33.49 1xfw s LYS 145 CO -0.08 -2.31 2.14 1.57 -0.36 0.00 0.00 175.35 176.32 1xfw h LYS 146 N 11.24 0.00 0.13 4.03 2.10 -1.89 -3.22 116.57 128.96 1xfw h LYS 146 Ca -0.25 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 58.08 1xfw h LYS 146 Cb 1.08 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.40 1xfw h LYS 146 CO 1.27 0.07 -1.61 0.00 -2.00 0.00 0.00 179.45 177.18 1xfw h ARG 147 N 0.00 0.28 0.00 0.07 3.08 -1.91 -3.44 114.38 112.45 1xfw h ARG 147 Ca -0.00 -0.47 0.00 0.00 0.07 0.00 0.00 59.98 59.58 1xfw h ARG 147 Cb 0.20 0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1xfw h ARG 147 CO 0.01 1.14 0.00 -1.91 -1.07 0.00 0.00 179.97 178.14 1xfw n GLU 148 N -3.47 0.00 -3.28 0.04 4.07 -1.26 -4.98 120.64 111.76 1xfw n GLU 148 Ca -0.19 0.00 -0.45 0.00 -0.06 0.00 0.00 57.16 56.46 1xfw n GLU 148 Cb 1.05 0.00 -0.06 0.00 -0.06 0.00 0.00 31.44 32.37 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 5.10 0.18 6.31 -1.32 -1.26 -5.02 115.64 119.64 1xfw s THR 149 Ca 0.00 -1.14 -0.32 0.00 -1.21 0.00 0.00 61.69 59.02 1xfw s THR 149 Cb 0.00 -4.30 -0.16 0.00 -1.51 0.00 0.00 72.50 66.53 1xfw s THR 149 CO 0.00 -0.82 1.03 -0.81 -2.21 0.00 0.00 174.62 171.82 1xfw n PRO 150 N 5.56 0.93 -3.76 7.08 -0.04 -1.26 -4.83 135.00 138.68 1xfw n PRO 150 Ca -0.12 0.33 -0.29 0.00 -0.04 0.00 0.00 63.50 63.38 1xfw n PRO 150 Cb 0.42 -1.73 -0.16 0.00 -0.04 0.00 0.00 33.50 31.99 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 -0.64 0.80 -0.10 0.54 1.02 -1.21 -2.88 119.74 117.27 1xfw s LYS 151 Ca 0.71 -0.73 -0.17 0.00 0.02 0.00 0.00 55.97 55.80 1xfw s LYS 151 Cb -0.87 -2.11 -0.05 0.00 -0.52 0.00 0.00 37.83 34.28 1xfw s LYS 151 CO 0.54 -0.76 0.45 -1.17 -0.92 0.00 0.00 175.35 173.49 1xfw s LEU 152 N 1.72 4.31 -0.10 3.17 0.20 -1.09 -1.30 118.68 125.59 1xfw s LEU 152 Ca 0.02 0.82 0.02 0.00 0.69 0.00 0.00 54.13 55.69 1xfw s LEU 152 Cb -0.17 -2.65 0.01 0.00 -0.43 0.00 0.00 46.19 42.94 1xfw s LEU 152 CO -0.14 0.07 -0.16 -0.63 -0.29 0.00 0.00 176.35 175.19 1xfw s ILE 153 N 0.29 1.55 -0.02 6.68 1.01 0.17 0.28 121.20 131.16 1xfw s ILE 153 Ca 0.25 -0.69 0.02 0.00 0.00 0.00 0.00 60.65 60.22 1xfw s ILE 153 Cb -0.15 -1.40 0.01 0.00 0.01 0.00 0.00 42.46 40.92 1xfw s ILE 153 CO 0.10 0.45 -0.05 -0.63 0.00 0.00 0.00 174.94 174.81 1xfw s ILE 154 N 0.83 0.47 0.10 2.92 -1.09 0.94 -1.05 121.20 124.32 1xfw s ILE 154 Ca -0.10 -0.19 0.10 0.00 -2.23 0.00 0.00 60.65 58.23 1xfw s ILE 154 Cb -0.16 -0.45 -0.03 0.00 -1.58 0.00 0.00 42.46 40.24 1xfw s ILE 154 CO 0.01 0.17 -0.25 0.54 -1.23 0.00 0.00 174.94 174.18 1xfw s ASN 155 N 0.28 3.00 0.06 3.58 4.22 -0.93 0.49 114.94 125.64 1xfw s ASN 155 Ca -0.03 -0.67 0.06 0.00 -2.14 0.00 0.00 52.86 50.08 1xfw s ASN 155 Cb -0.07 -0.21 -0.03 0.00 1.28 0.00 0.00 41.25 42.22 1xfw s ASN 155 CO -0.00 0.17 -0.18 -0.63 -2.04 0.00 0.00 177.10 174.42 1xfw s ILE 156 N -1.00 1.43 0.00 0.54 1.09 -1.22 -4.88 121.20 117.16 1xfw s ILE 156 Ca 0.11 -1.25 0.00 0.00 -1.10 0.00 0.00 60.65 58.41 1xfw s ILE 156 Cb -0.10 -1.29 0.00 0.00 -1.06 0.00 0.00 42.46 40.01 1xfw s ILE 156 CO 0.04 0.01 0.00 1.17 -0.10 0.00 0.00 174.94 176.06 1xfw n LYS 157 N 1.58 0.00 -2.37 2.79 3.00 -1.26 -4.68 118.16 117.21 1xfw n LYS 157 Ca -0.19 0.00 -0.12 0.00 -0.00 0.00 0.00 58.31 58.00 1xfw n LYS 157 Cb 0.54 0.00 0.02 0.00 0.00 0.00 0.00 35.03 35.59 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 1.49 -0.26 3.14 9.92 -1.26 -4.95 116.55 124.63 1xfw n ASP 158 Ca 0.00 -1.92 0.11 0.00 -0.53 0.00 0.00 54.79 52.45 1xfw n ASP 158 Cb 0.00 -0.14 0.22 0.00 -0.64 0.00 0.00 41.12 40.56 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 -1.48 0.49 -3.73 1.24 4.02 -1.26 -4.79 117.16 111.64 1xfw n TYR 159 Ca 0.05 0.91 -0.12 0.00 -0.01 0.00 0.00 57.90 58.73 1xfw n TYR 159 Cb 0.33 -1.07 -0.12 0.00 -0.02 0.00 0.00 39.34 38.46 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 -5.67 -0.72 -0.44 -0.72 0.00 -1.26 -4.87 121.76 108.08 1xfw s ALA 160 Ca -0.10 1.11 0.23 0.00 0.00 0.00 0.00 51.96 53.20 1xfw s ALA 160 Cb 0.22 -0.68 0.07 0.00 0.00 0.00 0.00 23.12 22.73 1xfw s ALA 160 CO 0.59 -0.20 1.06 -0.89 0.00 0.00 0.00 175.76 176.31 1xfw n ILE 161 N 4.00 0.36 0.74 0.00 5.41 -1.26 -4.40 119.36 124.21 1xfw n ILE 161 Ca -0.23 -0.38 0.13 0.00 1.00 0.00 0.00 62.75 63.27 1xfw n ILE 161 Cb 0.54 -0.08 0.32 0.00 -0.71 0.00 0.00 39.64 39.71 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 -2.28 0.57 0.10 4.38 3.02 -1.26 -2.83 115.26 116.95 1xfw n ASN 162 Ca 0.01 0.22 -0.05 0.00 -0.03 0.00 0.00 54.58 54.73 1xfw n ASN 162 Cb 0.49 -0.16 -0.02 0.00 -0.61 0.00 0.00 39.78 39.48 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 -0.25 -2.90 6.41 0.02 -1.99 -3.38 113.55 111.45 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 0.65 0.07 -0.42 0.00 0.14 0.00 0.00 62.40 62.84 1xfw h SER 163 CO 0.00 0.05 -0.58 1.21 -1.14 0.00 0.00 176.83 176.37 1xfw n GLU 164 N -4.08 1.98 0.00 3.45 2.13 -1.26 -4.93 120.64 117.93 1xfw n GLU 164 Ca -0.04 -4.53 0.00 0.00 0.66 0.00 0.00 57.16 53.25 1xfw n GLU 164 Cb 0.12 -2.28 0.00 0.00 0.27 0.00 0.00 31.44 29.55 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 1.72 0.00 0.00 5.31 6.02 -1.13 -2.41 117.38 126.89 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 -1.60 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 -0.89 0.00 -0.11 1.08 2.88 -1.26 -1.37 113.62 113.95 1xfw n SER 166 Ca 0.00 -0.02 -0.21 0.00 -1.33 0.00 0.00 58.87 57.31 1xfw n SER 166 Cb 0.10 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.47 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 -0.85 0.51 0.23 -1.46 2.85 -1.01 -4.46 118.16 113.96 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 0.55 0.00 -0.65 0.00 0.00 35.03 33.57 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 -0.51 0.00 -0.98 -1.58 4.81 -1.47 -2.73 114.58 112.12 1xfw h GLU 168 Ca -0.55 0.00 0.23 0.00 -0.13 0.00 0.00 59.36 58.91 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 -0.25 0.22 0.64 -0.24 -0.73 0.00 0.00 179.01 178.65 1xfw h VAL 169 N 0.00 0.61 0.00 0.32 3.04 -1.64 0.41 116.25 118.99 1xfw h VAL 169 Ca -0.00 -0.15 -0.01 0.00 -1.01 0.00 0.00 66.70 65.52 1xfw h VAL 169 Cb 0.51 0.13 -0.00 0.00 -2.01 0.00 0.00 31.29 29.92 1xfw h VAL 169 CO 0.03 0.08 -0.06 1.88 -1.01 0.00 0.00 177.57 178.49 1xfw h TYR 170 N 0.44 0.00 -0.00 3.17 -1.99 -1.74 0.31 116.97 117.15 1xfw h TYR 170 Ca 0.54 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.27 1xfw h TYR 170 Cb 1.31 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.04 1xfw h TYR 170 CO -0.00 0.06 -0.03 0.98 -0.00 0.00 0.00 178.16 179.17 1xfw n TYR 171 N -3.16 0.00 -0.08 4.88 9.36 0.14 0.68 117.16 128.98 1xfw n TYR 171 Ca 0.01 0.00 -0.08 0.00 3.32 0.00 0.00 57.90 61.16 1xfw n TYR 171 Cb 0.39 -0.19 -0.03 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 -1.10 0.49 0.03 2.98 4.71 0.77 -3.76 120.64 124.76 1xfw n GLU 172 Ca 0.16 0.29 -0.13 0.00 -0.01 0.00 0.00 57.16 57.48 1xfw n GLU 172 Cb 0.23 -1.48 -0.09 0.00 -1.01 0.00 0.00 31.44 29.09 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 -0.97 1.19 -1.98 -3.67 2.10 -0.76 0.75 117.51 114.16 1xfw h ILE 173 Ca 0.00 -1.01 0.57 0.00 1.08 0.00 0.00 64.86 65.51 1xfw h ILE 173 Cb 0.84 1.83 -0.08 0.00 -1.09 0.00 0.00 36.82 38.32 1xfw h ILE 173 CO 0.00 0.25 1.42 1.23 -1.08 0.00 0.00 178.15 179.97 1xfw h GLY 174 N -0.56 0.02 0.00 8.18 0.00 0.07 1.20 103.07 111.99 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 -0.01 -0.17 1.70 0.00 0.00 0.00 176.54 178.08 1xfw h LYS 175 N 0.00 0.00 -0.99 4.80 3.64 -1.41 -3.35 116.57 119.25 1xfw h LYS 175 Ca 0.94 0.00 0.29 0.00 -1.27 0.00 0.00 60.65 60.61 1xfw h LYS 175 Cb 3.78 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 35.56 1xfw h LYS 175 CO -0.02 0.00 0.82 0.41 -2.27 0.00 0.00 179.45 178.39 1xfw n GLY 176 N 1.74 -0.55 0.00 5.01 0.00 0.40 0.30 105.19 112.10 1xfw n GLY 176 Ca -0.02 0.35 0.07 0.00 0.00 0.00 0.00 46.02 46.42 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 -2.90 0.00 -0.06 -0.61 -5.35 -0.32 -2.19 119.36 107.92 1xfw n ILE 177 Ca 0.22 0.00 -0.04 0.00 -0.27 0.00 0.00 62.75 62.66 1xfw n ILE 177 Cb 1.12 -0.69 -0.03 0.00 -1.74 0.00 0.00 39.64 38.30 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 0.27 7.28 4.64 0.44 -3.41 113.55 122.77 1xfw h SER 178 Ca 0.00 -0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 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 0.69 -0.21 0.00 -0.87 0.00 0.00 176.83 176.44 1xfw n LEU 179 N -4.69 0.87 0.00 5.97 -0.00 -0.98 -4.30 117.00 113.86 1xfw n LEU 179 Ca -0.05 -0.19 0.00 0.00 -0.00 0.00 0.00 56.01 55.77 1xfw n LEU 179 Cb 0.17 -0.14 0.00 0.00 -0.00 0.00 0.00 43.42 43.45 1xfw n LEU 179 CO 0.08 0.16 0.10 -0.90 -0.00 0.00 0.00 177.39 176.83 1xfw n ASP 180 N -0.72 0.00 0.00 1.45 5.75 -0.93 0.90 116.55 123.00 1xfw n ASP 180 Ca 0.13 0.20 0.00 0.00 -0.01 0.00 0.00 54.79 55.11 1xfw n ASP 180 Cb 0.33 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.42 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 -0.29 0.28 0.00 2.12 3.06 -1.26 0.33 119.36 123.60 1xfw n ILE 181 Ca 0.00 0.22 0.00 0.00 -2.50 0.00 0.00 62.75 60.47 1xfw n ILE 181 Cb 0.00 -1.22 0.00 0.00 0.54 0.00 0.00 39.64 38.96 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 -0.88 0.00 0.00 9.51 0.00 -1.20 -4.23 119.36 122.56 1xfw n ILE 182 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 62.75 62.72 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 -0.19 0.00 0.00 9.51 2.88 5.42 -4.28 113.62 126.95 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 3.65 -0.23 -1.46 3.00 -1.24 -4.30 118.16 117.58 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 -0.68 0.14 0.00 0.00 0.00 0.00 35.03 34.49 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 -0.25 0.00 3.14 -0.00 -1.84 -3.37 116.42 114.11 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 0.02 0.29 0.00 0.00 -0.00 0.00 0.00 39.33 39.64 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 -5.28 1.09 0.00 0.28 4.81 -1.25 -0.84 118.16 116.97 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 0.43 -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 -0.64 -1.77 -4.95 2.46 -0.00 -1.26 -4.91 117.00 105.94 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 0.19 0.00 -0.00 0.00 0.00 43.42 42.49 1xfw n LEU 188 CO 0.00 -3.52 0.85 -1.81 -0.00 0.00 0.00 177.39 172.91 1xfw s ASP 189 N -2.35 3.03 -0.33 1.45 1.01 -1.11 -4.76 116.67 113.61 1xfw s ASP 189 Ca 0.65 0.06 -0.36 0.00 0.71 0.00 0.00 52.55 53.60 1xfw s ASP 189 Cb -0.20 -0.05 -0.12 0.00 1.01 0.00 0.00 42.92 43.56 1xfw s ASP 189 CO 0.63 -2.77 2.11 -2.65 0.21 0.00 0.00 175.17 172.71 1xfw n PRO 190 N -3.71 1.13 -3.73 8.23 -0.02 -0.02 -4.32 135.00 132.55 1xfw n PRO 190 Ca 0.17 0.33 -0.29 0.00 -2.02 0.00 0.00 63.50 61.69 1xfw n PRO 190 Cb 0.59 -2.40 -0.04 0.00 -0.02 0.00 0.00 33.50 31.64 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 5.74 3.53 0.05 -0.52 0.41 -1.26 -4.72 118.70 121.93 1xfw s GLU 191 Ca 1.07 -0.31 0.02 0.00 -0.41 0.00 0.00 54.97 55.34 1xfw s GLU 191 Cb -0.89 -2.87 0.16 0.00 -1.78 0.00 0.00 34.13 28.74 1xfw s GLU 191 CO 0.52 0.45 0.23 1.19 -0.49 0.00 0.00 175.26 177.16 1xfw n PHE 192 N -0.38 0.13 -0.25 1.61 3.01 -1.26 0.33 117.46 120.66 1xfw n PHE 192 Ca -0.04 0.18 -0.06 0.00 1.01 0.00 0.00 57.45 58.53 1xfw n PHE 192 Cb 0.53 -0.64 -0.06 0.00 -0.01 0.00 0.00 39.48 39.31 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 -3.63 -0.62 0.07 4.37 4.77 -1.26 0.21 117.00 120.91 1xfw n LEU 193 Ca 0.05 1.33 0.12 0.00 -0.03 0.00 0.00 56.01 57.47 1xfw n LEU 193 Cb 0.15 -0.28 0.05 0.00 -2.33 0.00 0.00 43.42 41.02 1xfw n LEU 193 CO -0.00 -0.99 0.10 -3.20 -1.33 0.00 0.00 177.39 171.96 1xfw n ASN 194 N -4.37 0.74 0.05 -1.43 2.85 0.15 -2.07 115.26 111.18 1xfw n ASN 194 Ca 0.01 0.15 -0.07 0.00 -0.11 0.00 0.00 54.58 54.56 1xfw n ASN 194 Cb 0.15 0.46 0.09 0.00 1.24 0.00 0.00 39.78 41.72 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 0.43 0.01 1.20 5.85 0.27 -0.57 115.31 122.49 1xfw h LEU 195 Ca 0.00 -0.24 -0.30 0.00 0.84 0.00 0.00 57.88 58.18 1xfw h LEU 195 Cb 0.87 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.73 1xfw h LEU 195 CO 0.00 0.92 -1.74 -0.38 -0.34 0.00 0.00 178.44 176.90 1xfw n ILE 196 N -3.91 1.62 0.19 4.05 5.41 0.57 -3.39 119.36 123.90 1xfw n ILE 196 Ca -0.03 -0.79 0.05 0.00 1.00 0.00 0.00 62.75 62.98 1xfw n ILE 196 Cb 0.62 -1.07 0.34 0.00 -0.71 0.00 0.00 39.64 38.82 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 0.00 0.00 0.00 0.38 3.11 -1.37 -1.57 116.57 117.13 1xfw h LYS 197 Ca -0.30 0.00 -0.19 0.00 -2.81 0.00 0.00 60.65 57.36 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 0.38 -0.88 1.03 -2.81 0.00 0.00 179.45 177.25 1xfw h SER 198 N 0.00 0.03 0.49 4.20 0.87 -1.22 -2.81 113.55 115.11 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 0.87 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.82 1xfw h SER 198 CO 0.05 0.89 0.00 -0.07 -0.53 0.00 0.00 176.83 177.17 1xfw h LEU 199 N 0.01 0.00 -2.47 2.23 3.38 -1.31 -2.60 115.31 114.55 1xfw h LEU 199 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1xfw h LEU 199 Cb 1.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.30 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 -2.62 2.77 0.40 -0.43 2.88 -1.00 -3.48 113.62 112.14 1xfw n SER 200 Ca -0.00 -1.65 -0.18 0.00 -1.33 0.00 0.00 58.87 55.71 1xfw n SER 200 Cb 0.17 -0.52 -0.09 0.00 -0.75 0.00 0.00 64.21 63.01 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 1.04 -0.86 0.00 -3.46 3.58 -1.70 -3.42 116.42 111.60 1xfw h ASP 201 Ca 0.00 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.48 1xfw h ASP 201 Cb 0.72 0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.99 1xfw h ASP 201 CO 0.00 -0.61 -0.22 -0.90 -2.88 0.00 0.00 179.24 174.63 1xfw n ASP 202 N -5.52 0.00 -0.03 2.28 5.68 -1.23 -4.61 116.55 113.12 1xfw n ASP 202 Ca -0.14 -1.45 -0.02 0.00 -0.50 0.00 0.00 54.79 52.68 1xfw n ASP 202 Cb 0.40 -0.09 -0.07 0.00 -1.14 0.00 0.00 41.12 40.23 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 2.93 0.00 -1.12 3.41 -1.25 -4.90 113.62 112.69 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 0.86 0.00 0.00 -0.26 0.00 0.00 64.21 65.40 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 -2.20 0.00 -4.92 4.04 8.00 -1.26 -4.97 116.55 115.24 1xfw n ASP 204 Ca -0.11 0.25 -0.28 0.00 0.71 0.00 0.00 54.79 55.37 1xfw n ASP 204 Cb 0.66 -0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 41.55 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 -1.75 6.41 0.00 -2.24 0.15 -1.26 -4.98 113.70 110.02 1xfw s SER 205 Ca 0.00 0.60 -0.01 0.00 0.70 0.00 0.00 55.95 57.24 1xfw s SER 205 Cb 0.00 -2.09 -0.03 0.00 -1.71 0.00 0.00 66.02 62.19 1xfw s SER 205 CO 0.00 -0.17 1.56 -1.20 1.20 0.00 0.00 173.24 174.63 1xfw n SER 206 N -0.97 3.65 -3.64 5.45 7.64 -1.26 -4.47 113.62 120.01 1xfw n SER 206 Ca -0.03 -2.00 -0.28 0.00 1.01 0.00 0.00 58.87 57.58 1xfw n SER 206 Cb 0.54 -0.80 -0.11 0.00 -1.01 0.00 0.00 64.21 62.83 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 3.09 0.00 6.43 1.01 -1.26 -4.96 116.67 123.03 1xfw s ASP 207 Ca 0.07 -3.45 -0.01 0.00 0.71 0.00 0.00 52.55 49.87 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 2.03 0.18 0.21 0.00 0.00 175.17 177.47 1xfw n LEU 208 N 2.42 4.74 -4.20 1.23 4.32 -1.26 -4.71 117.00 119.54 1xfw n LEU 208 Ca 0.25 -2.27 -0.40 0.00 -0.02 0.00 0.00 56.01 53.57 1xfw n LEU 208 Cb 0.42 -1.05 -0.09 0.00 -1.62 0.00 0.00 43.42 41.08 1xfw n LEU 208 CO 0.17 0.99 -0.02 -0.76 -1.22 0.00 0.00 177.39 176.55 1xfw s LEU 209 N 0.00 5.67 0.00 2.23 1.02 -1.26 -4.77 118.68 121.57 1xfw s LEU 209 Ca 0.10 -1.98 0.07 0.00 0.02 0.00 0.00 54.13 52.34 1xfw s LEU 209 Cb 0.05 -1.99 0.11 0.00 0.02 0.00 0.00 46.19 44.37 1xfw s LEU 209 CO 0.00 -0.67 0.99 2.22 0.02 0.00 0.00 176.35 178.91 1xfw n PHE 210 N 4.80 0.00 -0.01 0.29 1.16 -1.26 -4.44 117.46 118.00 1xfw n PHE 210 Ca -0.06 -0.15 0.11 0.00 -1.87 0.00 0.00 57.45 55.48 1xfw n PHE 210 Cb 0.41 -0.01 0.53 0.00 -1.61 0.00 0.00 39.48 38.79 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 0.25 0.29 -0.20 5.98 0.87 -1.86 -1.61 113.55 117.27 1xfw h SER 211 Ca -0.09 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.44 1xfw h SER 211 Cb 1.48 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 63.36 1xfw h SER 211 CO 0.01 0.18 0.05 0.00 -0.53 0.00 0.00 176.83 176.54 1xfw n GLN 212 N -4.47 1.99 0.00 2.24 10.64 -1.26 -4.04 117.38 122.48 1xfw n GLN 212 Ca 0.07 -0.94 0.00 0.00 -1.83 0.00 0.00 57.00 54.30 1xfw n GLN 212 Cb 0.31 -1.64 0.00 0.00 -0.86 0.00 0.00 30.24 28.05 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 0.15 0.12 -3.76 2.61 2.85 -1.05 -4.99 118.16 114.09 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 -0.01 -0.14 0.00 -0.65 0.00 0.00 35.03 34.84 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 2.04 0.00 5.58 2.99 -0.63 -4.73 117.98 123.23 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 -1.92 0.00 0.00 0.00 0.00 0.00 43.02 41.10 1xfw s PHE 214 CO 0.00 -0.85 0.00 1.17 -0.00 0.00 0.00 175.22 175.54 1xfw n LYS 215 N 4.32 0.00 0.33 0.44 3.00 -1.26 -4.15 118.16 120.84 1xfw n LYS 215 Ca 0.02 0.00 0.21 0.00 -0.00 0.00 0.00 58.31 58.55 1xfw n LYS 215 Cb 0.39 0.00 1.15 0.00 0.00 0.00 0.00 35.03 36.57 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 -0.80 1.63 0.07 0.00 0.00 179.01 179.91 1xfw n LYS 217 N -3.24 2.50 -2.74 1.06 4.76 -1.26 -4.73 118.16 114.51 1xfw n LYS 217 Ca -0.03 -0.03 -0.03 0.00 -2.87 0.00 0.00 58.31 55.35 1xfw n LYS 217 Cb 0.08 -1.10 0.08 0.00 -1.84 0.00 0.00 35.03 32.26 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 -1.44 0.04 -0.52 -0.35 7.94 -1.01 -4.74 117.00 116.93 1xfw n LEU 218 Ca 0.01 -3.25 0.08 0.00 -1.11 0.00 0.00 56.01 51.74 1xfw n LEU 218 Cb 0.21 0.28 0.27 0.00 0.53 0.00 0.00 43.42 44.71 1xfw n LEU 218 CO 0.23 1.46 0.70 -1.84 -1.11 0.00 0.00 177.39 176.83 1xfw n GLU 219 N -0.86 1.67 -1.67 1.96 0.28 0.79 -4.47 120.64 118.34 1xfw n GLU 219 Ca -0.03 -1.02 -0.42 0.00 -0.16 0.00 0.00 57.16 55.53 1xfw n GLU 219 Cb 0.84 -1.31 -0.02 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 0.28 5.42 0.01 -1.84 7.94 -1.26 -4.64 117.00 122.91 1xfw n LEU 220 Ca 0.13 -3.63 0.10 0.00 -1.11 0.00 0.00 56.01 51.50 1xfw n LEU 220 Cb 0.28 -1.50 0.42 0.00 0.53 0.00 0.00 43.42 43.15 1xfw n LEU 220 CO 0.10 0.28 0.82 0.59 -1.11 0.00 0.00 177.39 178.06 1xfw n ASN 221 N 7.48 0.06 -3.83 1.96 3.02 -1.26 -3.89 115.26 118.80 1xfw n ASN 221 Ca 0.50 0.51 -0.38 0.00 -0.03 0.00 0.00 54.58 55.18 1xfw n ASN 221 Cb 0.41 -0.53 -0.02 0.00 -0.61 0.00 0.00 39.78 39.04 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 -1.56 5.64 -3.65 6.41 3.02 -1.26 -4.95 115.26 118.92 1xfw n ASN 222 Ca 0.05 -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 -2.71 0.22 -0.82 3.52 2.36 -1.25 -5.10 119.74 115.96 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 0.09 0.09 0.00 -1.05 0.00 0.00 37.83 37.04 1xfw s LYS 223 CO 0.07 -0.03 1.10 -1.12 1.55 0.00 0.00 175.35 176.92 1xfw s SER 224 N 0.46 6.40 -1.19 1.43 0.01 -1.26 -4.96 113.70 114.59 1xfw s SER 224 Ca 0.01 -1.47 -0.17 0.00 1.31 0.00 0.00 55.95 55.63 1xfw s SER 224 Cb -0.04 -2.43 -0.04 0.00 0.21 0.00 0.00 66.02 63.72 1xfw s SER 224 CO -0.12 -1.30 2.12 -0.38 0.41 0.00 0.00 173.24 173.97 1xfw n ILE 225 N 5.87 2.83 0.00 1.44 5.41 -1.26 -4.70 119.36 128.94 1xfw n ILE 225 Ca 0.12 -2.45 0.00 0.00 1.00 0.00 0.00 62.75 61.42 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 6.59 0.00 -0.08 4.38 4.64 -1.26 -4.39 116.55 126.43 1xfw n ASP 226 Ca 0.51 0.00 0.15 0.00 -1.38 0.00 0.00 54.79 54.07 1xfw n ASP 226 Cb 0.39 0.00 0.79 0.00 -1.04 0.00 0.00 41.12 41.26 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 0.00 -0.12 5.18 5.41 -1.26 -3.30 119.36 125.27 1xfw n ILE 227 Ca 0.00 -0.04 -0.12 0.00 1.00 0.00 0.00 62.75 63.58 1xfw n ILE 227 Cb 0.00 -0.29 -0.03 0.00 -0.71 0.00 0.00 39.64 38.61 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 0.41 0.82 0.00 4.38 4.21 -1.91 -3.41 115.58 120.07 1xfw h ASN 228 Ca 0.00 -0.43 0.00 0.00 1.21 0.00 0.00 56.30 57.08 1xfw h ASN 228 Cb 0.19 -0.23 0.00 0.00 -1.12 0.00 0.00 38.32 37.16 1xfw h ASN 228 CO 0.00 1.07 0.00 0.33 -1.29 0.00 0.00 177.43 177.54 1xfw n PHE 229 N -4.25 0.00 0.60 1.19 7.35 -1.24 -4.80 117.46 116.30 1xfw n PHE 229 Ca -0.02 -0.06 0.13 0.00 -0.76 0.00 0.00 57.45 56.74 1xfw n PHE 229 Cb 0.44 -0.01 0.39 0.00 0.35 0.00 0.00 39.48 40.65 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 0.88 0.00 0.42 -2.13 2.10 -1.78 -3.34 117.51 113.66 1xfw h ILE 230 Ca 0.00 -0.51 -0.02 0.00 1.08 0.00 0.00 64.86 65.41 1xfw h ILE 230 Cb 0.42 1.51 0.00 0.00 -1.09 0.00 0.00 36.82 37.66 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 -0.54 -0.34 2.19 1.57 -1.86 -3.33 116.57 114.26 1xfw h LYS 231 Ca 0.00 0.04 0.07 0.00 -1.87 0.00 0.00 60.65 58.89 1xfw h LYS 231 Cb 0.75 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 -0.08 -1.91 -0.57 0.00 0.00 179.45 176.53 1xfw n GLU 232 N -5.06 -0.03 -3.70 3.15 4.07 -1.25 -2.41 120.64 115.41 1xfw n GLU 232 Ca -0.07 0.53 -0.27 0.00 -0.06 0.00 0.00 57.16 57.28 1xfw n GLU 232 Cb 0.22 -0.79 -0.11 0.00 -0.06 0.00 0.00 31.44 30.71 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 -4.54 2.74 0.01 4.31 3.02 -1.25 -4.88 115.26 114.67 1xfw n ASN 233 Ca 0.06 -3.17 -0.00 0.00 -0.03 0.00 0.00 54.58 51.44 1xfw n ASN 233 Cb 0.17 -0.71 0.29 0.00 -0.61 0.00 0.00 39.78 38.92 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 5.06 0.46 -0.29 3.41 -0.00 -1.61 -3.14 115.31 119.20 1xfw h LEU 234 Ca 0.17 -0.10 0.02 0.00 -0.00 0.00 0.00 57.88 57.97 1xfw h LEU 234 Cb 0.75 -0.12 -0.03 0.00 -0.00 0.00 0.00 40.66 41.26 1xfw h LEU 234 CO 0.70 0.57 0.13 0.71 -0.00 0.00 0.00 178.44 180.56 1xfw h THR 235 N 0.46 0.98 0.00 0.15 1.35 -1.89 -2.55 112.91 111.40 1xfw h THR 235 Ca 0.09 -0.10 -0.00 0.00 -0.55 0.00 0.00 66.41 65.85 1xfw h THR 235 Cb 0.39 0.66 -0.00 0.00 -1.73 0.00 0.00 68.15 67.48 1xfw h THR 235 CO 0.02 0.05 -0.02 -0.08 -0.25 0.00 0.00 175.52 175.24 1xfw h GLU 236 N 0.29 0.00 -0.63 4.72 4.81 -1.96 0.05 114.58 121.85 1xfw h GLU 236 Ca 0.12 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1xfw h GLU 236 Cb 0.05 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.43 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 1.13 -0.06 0.92 3.72 -0.97 -3.34 117.46 115.69 1xfw n PHE 237 Ca -0.01 -0.44 -0.09 0.00 -0.05 0.00 0.00 57.45 56.85 1xfw n PHE 237 Cb 0.19 -0.22 -0.05 0.00 -0.94 0.00 0.00 39.48 38.46 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 0.70 0.29 0.10 -1.08 6.02 -0.05 -3.80 117.38 119.55 1xfw n GLN 238 Ca 0.19 0.08 0.06 0.00 -0.01 0.00 0.00 57.00 57.31 1xfw n GLN 238 Cb 0.71 -1.17 0.32 0.00 1.02 0.00 0.00 30.24 31.12 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 0.40 0.00 1.08 8.25 -0.87 -1.04 115.22 120.02 1xfw n HIS 239 Ca -0.22 0.21 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1xfw n HIS 239 Cb 0.71 -0.78 0.00 0.00 1.12 0.00 0.00 29.99 31.04 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 -1.61 0.00 -0.58 -1.41 0.00 -1.23 -3.30 120.51 112.39 1xfw n ALA 240 Ca -0.01 -0.10 0.46 0.00 0.00 0.00 0.00 53.44 53.79 1xfw n ALA 240 Cb 0.09 0.00 0.75 0.00 0.00 0.00 0.00 19.45 20.28 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 0.27 -0.06 0.00 3.57 -1.60 1.06 116.94 120.18 1xfw h PHE 241 Ca 0.00 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 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 -0.14 -0.09 0.77 -2.23 0.00 0.00 178.31 176.61 1xfw h SER 242 N 0.01 0.18 1.18 0.41 0.02 -1.28 -1.35 113.55 112.71 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 3.25 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 65.73 1xfw h SER 242 CO -0.25 0.68 0.00 -0.07 -1.14 0.00 0.00 176.83 176.05 1xfw h LEU 243 N -0.31 0.00 0.00 5.07 3.38 0.94 0.11 115.31 124.50 1xfw h LEU 243 Ca 0.01 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.83 1xfw h LEU 243 Cb 0.64 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 1xfw h LEU 243 CO 0.02 0.00 -0.83 0.00 0.09 0.00 0.00 178.44 177.72 1xfw h ALA 244 N 2.09 0.59 0.00 1.53 0.00 -0.24 -1.69 119.26 121.54 1xfw h ALA 244 Ca 0.00 -0.68 -0.01 0.00 0.00 0.00 0.00 54.91 54.22 1xfw h ALA 244 Cb 0.59 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1xfw h ALA 244 CO 0.00 0.88 -0.06 0.35 0.00 0.00 0.00 179.25 180.41 1xfw h PHE 245 N 0.00 0.00 -0.79 0.00 3.04 -0.61 -1.97 116.94 116.61 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 1.54 0.00 -0.06 0.00 2.56 0.00 0.00 35.95 40.00 1xfw h PHE 245 CO 0.00 0.65 0.52 0.66 -2.02 0.00 0.00 178.31 178.12 1xfw h SER 246 N -1.00 0.56 0.51 0.41 4.64 -0.90 0.18 113.55 117.95 1xfw h SER 246 Ca -0.01 0.02 -0.21 0.00 -0.47 0.00 0.00 61.79 61.12 1xfw h SER 246 Cb 0.66 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.65 1xfw h SER 246 CO -0.01 0.31 -0.92 1.88 -0.87 0.00 0.00 176.83 177.23 1xfw h TYR 247 N 0.61 0.40 -0.21 4.77 -1.99 -1.38 -0.46 116.97 118.71 1xfw h TYR 247 Ca 0.38 -0.22 -0.19 0.00 2.00 0.00 0.00 58.73 60.70 1xfw h TYR 247 Cb 0.62 -0.04 0.00 0.00 2.00 0.00 0.00 36.73 39.31 1xfw h TYR 247 CO -0.00 1.04 -0.59 -0.92 -0.00 0.00 0.00 178.16 177.69 1xfw h TYR 248 N 0.14 1.00 -0.01 4.88 -0.00 0.04 -3.31 116.97 119.71 1xfw h TYR 248 Ca -0.06 -0.39 0.00 0.00 -0.00 0.00 0.00 58.73 58.28 1xfw h TYR 248 Cb 1.55 -0.17 0.00 0.00 -0.00 0.00 0.00 36.73 38.11 1xfw h TYR 248 CO 0.04 1.21 -0.52 1.19 -0.00 0.00 0.00 178.16 180.08 1xfw n PHE 249 N -4.05 0.00 -1.68 -3.82 3.01 0.13 -4.81 117.46 106.24 1xfw n PHE 249 Ca -0.06 0.00 -0.45 0.00 1.01 0.00 0.00 57.45 57.95 1xfw n PHE 249 Cb 0.65 -0.06 -0.04 0.00 -0.01 0.00 0.00 39.48 40.02 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 -0.64 1.65 0.21 4.37 0.00 -0.18 -4.80 120.51 121.12 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 0.39 -2.43 0.55 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 6.90 0.00 0.00 0.00 0.13 -1.91 -3.33 132.00 133.79 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 -2.32 0.00 -4.52 1.44 5.75 -1.26 -4.92 116.55 110.72 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 0.26 -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 -0.95 2.73 -0.26 2.11 -3.43 -1.25 -4.74 115.29 109.49 1xfw s HIS 253 Ca 0.00 -1.03 0.01 0.00 -0.80 0.00 0.00 55.06 53.24 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 -0.22 2.89 -2.00 0.00 0.00 174.74 173.62 1xfw n ARG 254 N 8.11 0.65 0.22 -0.38 0.00 -1.26 -4.47 116.66 119.53 1xfw n ARG 254 Ca 0.30 0.16 0.12 0.00 -0.00 0.00 0.00 57.85 58.43 1xfw n ARG 254 Cb 0.50 -1.52 0.24 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 -0.07 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 0.20 0.00 -0.55 0.00 0.00 66.41 64.42 1xfw h THR 255 Cb 1.88 1.96 -0.11 0.00 -1.73 0.00 0.00 68.15 70.15 1xfw h THR 255 CO -0.11 0.06 0.48 0.58 -0.25 0.00 0.00 175.52 176.27 1xfw h VAL 256 N 0.00 0.60 -0.00 6.82 2.07 -1.93 1.52 116.25 125.33 1xfw h VAL 256 Ca -0.00 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.33 1xfw h VAL 256 Cb 0.96 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1xfw h VAL 256 CO 0.01 0.10 -0.00 -0.11 0.02 0.00 0.00 177.57 177.59 1xfw n LEU 257 N -4.92 0.18 -0.09 2.57 7.94 -1.22 -1.44 117.00 120.02 1xfw n LEU 257 Ca 0.22 -0.03 -0.11 0.00 -1.11 0.00 0.00 56.01 54.97 1xfw n LEU 257 Cb 0.59 -0.03 -0.11 0.00 0.53 0.00 0.00 43.42 44.40 1xfw n LEU 257 CO 0.17 0.03 -1.09 1.21 -1.11 0.00 0.00 177.39 176.60 1xfw n GLU 258 N -0.89 0.97 -0.04 1.96 2.13 0.45 -3.73 120.64 121.49 1xfw n GLU 258 Ca 0.22 0.05 -0.11 0.00 0.66 0.00 0.00 57.16 57.98 1xfw n GLU 258 Cb 0.15 -1.41 -0.10 0.00 0.27 0.00 0.00 31.44 30.36 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 -0.03 0.00 4.31 5.85 0.46 -3.42 115.31 122.48 1xfw h LEU 259 Ca -0.44 -0.68 -0.09 0.00 0.84 0.00 0.00 57.88 57.51 1xfw h LEU 259 Cb 1.84 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.87 1xfw h LEU 259 CO -0.02 0.75 -0.51 1.88 -0.34 0.00 0.00 178.44 180.20 1xfw h TYR 260 N -0.91 0.00 -3.65 1.25 -1.99 -1.43 -3.42 116.97 106.82 1xfw h TYR 260 Ca -0.00 0.00 -0.62 0.00 2.00 0.00 0.00 58.73 60.10 1xfw h TYR 260 Cb 0.71 0.00 -0.15 0.00 2.00 0.00 0.00 36.73 39.29 1xfw h TYR 260 CO 0.18 1.00 -0.43 0.00 -0.00 0.00 0.00 178.16 178.91 1xfw s ALA 261 N -2.35 3.58 -0.16 3.88 0.00 -1.24 -4.59 121.76 120.88 1xfw s ALA 261 Ca -0.20 -0.87 0.18 0.00 0.00 0.00 0.00 51.96 51.07 1xfw s ALA 261 Cb 0.01 -2.45 -0.07 0.00 0.00 0.00 0.00 23.12 20.61 1xfw s ALA 261 CO 0.55 -0.34 0.96 -1.00 0.00 0.00 0.00 175.76 175.93 1xfw h PRO 262 N 7.74 0.00 0.00 0.00 0.13 -1.80 -3.31 132.00 134.76 1xfw h PRO 262 Ca -0.36 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.46 1xfw h PRO 262 Cb 1.17 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.26 1xfw h PRO 262 CO 0.64 0.23 -1.99 -3.47 -0.23 0.00 0.00 178.00 173.18 1xfw n ASP 263 N -2.88 1.95 -0.40 1.44 -0.08 -1.26 -3.92 116.55 111.40 1xfw n ASP 263 Ca -0.06 0.35 0.33 0.00 -1.51 0.00 0.00 54.79 53.90 1xfw n ASP 263 Cb 0.75 -0.81 0.60 0.00 2.34 0.00 0.00 41.12 44.00 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 0.67 -0.67 2.86 -1.89 1.14 114.93 116.16 1xfw h MET 264 Ca -0.47 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.14 1xfw h MET 264 Cb 1.40 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 33.03 1xfw h MET 264 CO -0.28 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 -0.77 -0.22 3.57 -1.74 0.17 116.94 117.01 1xfw h PHE 265 Ca 0.81 -0.01 0.16 0.00 3.53 0.00 0.00 57.97 62.46 1xfw h PHE 265 Cb 2.32 0.37 -0.11 0.00 2.79 0.00 0.00 35.95 41.32 1xfw h PHE 265 CO -0.01 -0.60 0.26 1.49 -2.23 0.00 0.00 178.31 177.22 1xfw h GLU 266 N -1.00 0.35 -0.12 1.11 4.57 0.82 0.16 114.58 120.47 1xfw h GLU 266 Ca -0.09 -0.02 0.02 0.00 -1.18 0.00 0.00 59.36 58.09 1xfw h GLU 266 Cb 0.79 -0.08 -0.05 0.00 -0.16 0.00 0.00 28.75 29.25 1xfw h GLU 266 CO 0.10 0.23 -0.44 -0.92 -1.18 0.00 0.00 179.01 176.81 1xfw h TYR 267 N 0.36 -1.30 -0.04 0.92 3.20 0.92 0.41 116.97 121.44 1xfw h TYR 267 Ca 0.44 0.05 0.03 0.00 3.14 0.00 0.00 58.73 62.39 1xfw h TYR 267 Cb 0.74 0.58 -0.03 0.00 1.54 0.00 0.00 36.73 39.55 1xfw h TYR 267 CO -0.20 -0.44 -0.14 0.52 -1.64 0.00 0.00 178.16 176.26 1xfw h MET 268 N -0.46 -0.21 -0.39 1.82 2.86 0.27 -1.57 114.93 117.25 1xfw h MET 268 Ca 0.03 0.01 0.08 0.00 -2.06 0.00 0.00 59.70 57.76 1xfw h MET 268 Cb 0.54 0.05 -0.08 0.00 0.06 0.00 0.00 31.60 32.17 1xfw h MET 268 CO -0.36 -0.14 -0.19 -0.97 1.06 0.00 0.00 176.91 176.32 1xfw h ASN 269 N -0.22 -0.64 -0.66 1.22 -0.73 -0.10 0.54 115.58 115.00 1xfw h ASN 269 Ca 0.06 0.15 0.12 0.00 1.87 0.00 0.00 56.30 58.50 1xfw h ASN 269 Cb 0.30 0.35 -0.09 0.00 0.27 0.00 0.00 38.32 39.15 1xfw h ASN 269 CO -0.17 -0.22 0.21 0.50 -0.37 0.00 0.00 177.43 177.38 1xfw h LYS 270 N -0.12 0.34 -0.80 6.67 1.63 0.11 1.04 116.57 125.45 1xfw h LYS 270 Ca 0.19 -0.02 0.07 0.00 -0.85 0.00 0.00 60.65 60.04 1xfw h LYS 270 Cb 0.41 -0.08 -0.06 0.00 -0.60 0.00 0.00 32.23 31.90 1xfw h LYS 270 CO -0.46 0.23 0.48 -0.07 -3.45 0.00 0.00 179.45 176.17 1xfw h LEU 271 N 0.35 0.72 -0.54 5.20 3.38 0.89 0.12 115.31 125.44 1xfw h LEU 271 Ca 0.35 0.03 -0.16 0.00 0.09 0.00 0.00 57.88 58.19 1xfw h LEU 271 Cb 0.51 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1xfw h LEU 271 CO -0.39 0.45 -0.52 -0.08 0.09 0.00 0.00 178.44 178.00 1xfw h GLU 272 N 0.85 0.58 -0.67 1.13 4.81 0.24 0.34 114.58 121.87 1xfw h GLU 272 Ca 0.36 -0.35 0.13 0.00 -0.13 0.00 0.00 59.36 59.37 1xfw h GLU 272 Cb 0.22 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.59 1xfw h GLU 272 CO -0.19 0.95 0.45 0.87 -0.73 0.00 0.00 179.01 180.36 1xfw h LYS 273 N 0.45 0.37 0.00 1.92 1.57 0.34 -3.42 116.57 117.80 1xfw h LYS 273 Ca 0.02 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1xfw h LYS 273 Cb 1.06 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.28 1xfw h LYS 273 CO 0.10 0.24 0.00 0.41 -0.57 0.00 0.00 179.45 179.63 1xfw n GLY 274 N -1.53 0.00 0.16 3.86 0.00 0.06 -5.04 105.19 102.70 1xfw n GLY 274 Ca 0.12 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 0.53 1.01 -0.02 0.00 -0.02 -2.39 103.07 102.20 1xfw h GLY 275 Ca 0.00 -0.51 0.06 0.00 0.00 0.00 0.00 47.33 46.88 1xfw h GLY 275 CO 0.00 0.46 0.52 0.74 0.00 0.00 0.00 176.54 178.25 1xfw h PHE 276 N 0.19 0.88 0.00 5.60 0.05 -1.33 0.45 116.94 122.78 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 0.67 -0.29 -0.01 0.00 2.00 0.00 0.00 35.95 38.32 1xfw h PHE 276 CO 0.07 0.48 -0.20 1.49 -0.18 0.00 0.00 178.31 179.96 1xfw h GLU 277 N 0.88 0.00 0.00 1.51 4.81 -1.77 0.09 114.58 120.10 1xfw h GLU 277 Ca 0.33 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.56 1xfw h GLU 277 Cb 0.18 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.56 1xfw h GLU 277 CO -0.11 0.20 0.00 1.63 -0.73 0.00 0.00 179.01 180.00 1xfw n LYS 278 N -3.46 0.00 -0.02 1.92 5.02 0.16 -1.36 118.16 120.41 1xfw n LYS 278 Ca -0.00 0.42 0.07 0.00 -2.02 0.00 0.00 58.31 56.77 1xfw n LYS 278 Cb 0.38 -1.28 0.45 0.00 -0.02 0.00 0.00 35.03 34.56 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 1.04 0.00 -0.18 1.08 -1.53 0.19 117.51 118.10 1xfw h ILE 279 Ca 0.00 -0.17 0.00 0.00 -0.39 0.00 0.00 64.86 64.30 1xfw h ILE 279 Cb 0.00 0.50 0.00 0.00 -3.07 0.00 0.00 36.82 34.25 1xfw h ILE 279 CO 0.00 0.09 0.00 -1.28 -0.69 0.00 0.00 178.15 176.27 1xfw h SER 280 N 0.49 0.00 -0.00 1.72 0.87 -0.83 0.42 113.55 116.21 1xfw h SER 280 Ca 0.19 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 1xfw h SER 280 Cb 0.13 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1xfw h SER 280 CO -0.05 0.00 -0.65 -0.62 -0.53 0.00 0.00 176.83 174.98 1xfw n GLU 281 N -3.03 1.97 0.06 2.24 -0.58 0.57 -3.32 120.64 118.55 1xfw n GLU 281 Ca -0.02 -0.12 0.11 0.00 -0.42 0.00 0.00 57.16 56.71 1xfw n GLU 281 Cb 0.11 -1.22 -0.04 0.00 -0.57 0.00 0.00 31.44 29.72 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 -1.17 0.59 0.00 1.62 3.41 -0.31 -2.41 113.62 115.35 1xfw n SER 282 Ca 0.03 0.19 -0.01 0.00 -0.26 0.00 0.00 58.87 58.82 1xfw n SER 282 Cb 0.25 0.91 -0.11 0.00 -0.26 0.00 0.00 64.21 65.00 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 0.59 -0.04 1.04 4.32 -0.02 -3.15 117.00 117.26 1xfw n LEU 283 Ca -0.01 0.26 -0.14 0.00 -0.02 0.00 0.00 56.01 56.10 1xfw n LEU 283 Cb 0.54 0.14 -0.09 0.00 -1.62 0.00 0.00 43.42 42.40 1xfw n LEU 283 CO 0.42 0.19 0.53 0.50 -1.22 0.00 0.00 177.39 177.81 1xfw h LYS 284 N 0.00 0.28 -0.66 3.23 1.63 -1.64 -2.38 116.57 117.03 1xfw h LYS 284 Ca -0.21 -0.18 -0.04 0.00 -0.85 0.00 0.00 60.65 59.36 1xfw h LYS 284 Cb 1.64 0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 33.26 1xfw h LYS 284 CO 0.04 0.78 0.24 1.57 -3.45 0.00 0.00 179.45 178.63 1xfw h LYS 285 N -0.19 1.00 -0.83 1.90 2.10 -1.62 0.31 116.57 119.23 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 0.78 -0.16 0.00 0.00 -0.90 0.00 0.00 32.23 31.96 1xfw h LYS 285 CO 0.04 0.85 0.00 -1.91 -2.00 0.00 0.00 179.45 176.43 1xfw n GLU 286 N -4.39 1.01 0.08 0.07 2.13 -1.19 -2.75 120.64 115.60 1xfw n GLU 286 Ca 0.05 -0.01 -0.23 0.00 0.66 0.00 0.00 57.16 57.63 1xfw n GLU 286 Cb 0.19 -1.41 -0.15 0.00 0.27 0.00 0.00 31.44 30.33 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 5.17 0.45 0.00 8.31 0.00 0.17 -3.18 103.07 114.00 1xfw h GLY 287 Ca 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 47.33 46.17 1xfw h GLY 287 CO 0.00 1.02 -0.24 -0.39 0.00 0.00 0.00 176.54 176.92 1xfw h VAL 288 N -0.03 0.00 -0.29 4.60 -1.51 -1.58 -3.29 116.25 114.15 1xfw h VAL 288 Ca -0.29 -0.66 0.08 0.00 -1.23 0.00 0.00 66.70 64.60 1xfw h VAL 288 Cb 2.00 0.00 -0.01 0.00 -2.13 0.00 0.00 31.29 31.14 1xfw h VAL 288 CO 0.18 0.00 0.81 -0.33 -1.23 0.00 0.00 177.57 177.00 1xfw h GLU 289 N -0.66 0.00 0.00 5.19 5.08 -1.75 -2.34 114.58 120.10 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 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 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 -2.93 0.00 -2.73 2.33 4.81 -1.20 -4.63 118.16 113.81 1xfw n LYS 290 Ca 0.06 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 57.07 1xfw n LYS 290 Cb 0.92 -0.36 -0.03 0.00 0.02 0.00 0.00 35.03 35.58 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 -1.48 6.67 0.00 3.14 3.68 -0.88 -4.94 116.67 122.85 1xfw s ASP 291 Ca 0.00 0.52 0.00 0.00 2.13 0.00 0.00 52.55 55.20 1xfw s ASP 291 Cb 0.00 -2.49 0.00 0.00 -1.45 0.00 0.00 42.92 38.98 1xfw s ASP 291 CO 0.00 -1.00 0.00 0.54 0.13 0.00 0.00 175.17 174.84 1xfw n ARG 292 N 7.14 0.00 -3.18 4.34 5.12 -1.24 -4.62 116.66 124.22 1xfw n ARG 292 Ca 0.09 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.59 1xfw n ARG 292 Cb 0.48 0.00 -0.07 0.00 -1.16 0.00 0.00 32.46 31.71 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 -2.72 4.93 -0.63 0.55 1.01 -1.26 -4.98 121.20 118.10 1xfw s ILE 293 Ca 0.00 0.21 -0.26 0.00 0.00 0.00 0.00 60.65 60.60 1xfw s ILE 293 Cb 0.00 -4.08 -0.08 0.00 0.01 0.00 0.00 42.46 38.31 1xfw s ILE 293 CO 0.00 -0.40 2.27 -0.62 0.00 0.00 0.00 174.94 176.19 1xfw s ASP 294 N 1.86 4.49 -0.08 3.58 3.68 -1.26 -4.89 116.67 124.04 1xfw s ASP 294 Ca 0.20 0.51 0.02 0.00 2.13 0.00 0.00 52.55 55.41 1xfw s ASP 294 Cb -0.15 -2.52 0.01 0.00 -1.45 0.00 0.00 42.92 38.81 1xfw s ASP 294 CO 0.16 -3.06 -0.14 0.68 0.13 0.00 0.00 175.17 172.93 1xfw s VAL 295 N 12.21 1.36 -0.23 1.11 -7.23 -1.26 -4.70 120.40 121.65 1xfw s VAL 295 Ca 0.88 -0.59 -0.29 0.00 -1.81 0.00 0.00 61.98 60.18 1xfw s VAL 295 Cb -0.14 -1.23 -0.02 0.00 0.56 0.00 0.00 36.38 35.54 1xfw s VAL 295 CO 0.18 0.41 1.57 -1.48 -0.31 0.00 0.00 175.10 175.46 1xfw s LEU 296 N 0.77 3.90 0.00 1.32 2.34 -1.23 -4.83 118.68 120.95 1xfw s LEU 296 Ca -0.12 1.56 0.00 0.00 0.06 0.00 0.00 54.13 55.63 1xfw s LEU 296 Cb -0.16 -3.53 0.00 0.00 -0.56 0.00 0.00 46.19 41.94 1xfw s LEU 296 CO 0.02 -1.23 0.00 0.29 -1.06 0.00 0.00 176.35 174.37 1xfw n LYS 297 N 7.60 2.95 0.00 1.48 5.02 -1.26 -2.96 118.16 130.99 1xfw n LYS 297 Ca 0.18 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.47 1xfw n LYS 297 Cb 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.46 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 -3.32 105.19 107.76 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 0.00 0.43 0.24 1.61 2.13 -1.26 -3.63 120.64 120.16 1xfw n GLU 299 Ca 0.00 -0.17 0.09 0.00 0.66 0.00 0.00 57.16 57.74 1xfw n GLU 299 Cb 0.00 -1.50 0.62 0.00 0.27 0.00 0.00 31.44 30.84 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 0.41 0.00 0.21 5.31 1.57 -1.87 -2.81 116.57 119.39 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 0.15 -0.10 0.00 -0.57 0.00 0.00 179.45 178.94 1xfw h ALA 301 N 1.85 -0.28 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 0.33 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 0.79 1.25 0.00 0.00 0.00 179.25 181.04 1xfw h LEU 302 N -1.04 0.00 -0.01 0.00 5.85 -1.66 1.15 115.31 119.61 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 0.31 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 -0.10 0.11 -0.34 0.00 0.00 178.44 178.16 1xfw h LYS 303 N 0.00 0.08 -0.00 1.25 1.79 -1.39 -3.22 116.57 115.08 1xfw h LYS 303 Ca 0.00 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.39 1xfw h LYS 303 Cb 1.58 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 32.25 1xfw h LYS 303 CO 0.00 0.81 -0.32 0.00 -1.08 0.00 0.00 179.45 178.86 1xfw n ALA 304 N -2.50 3.15 -0.05 3.86 0.00 0.36 -3.88 120.51 121.44 1xfw n ALA 304 Ca -0.09 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.06 1xfw n ALA 304 Cb 0.42 -1.22 0.30 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 0.16 0.58 0.00 0.00 0.87 -0.43 -3.43 113.55 111.31 1xfw h SER 305 Ca 0.00 -0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.49 1xfw h SER 305 Cb 0.49 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 1xfw h SER 305 CO 0.00 0.55 0.00 0.61 -0.53 0.00 0.00 176.83 177.46 1xfw n GLY 306 N -1.07 1.98 3.75 5.77 0.00 -1.24 -3.71 105.19 110.67 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 3.79 -0.46 0.99 1.02 -1.26 -4.35 118.68 118.41 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 -4.39 -0.01 0.00 0.02 0.00 0.00 46.19 41.80 1xfw s LEU 307 CO 0.00 -1.55 1.70 -0.69 0.02 0.00 0.00 176.35 175.84 1xfw s VAL 308 N -1.42 3.55 0.05 -1.59 1.01 -1.26 -4.84 120.40 115.90 1xfw s VAL 308 Ca 0.73 0.49 -0.08 0.00 0.00 0.00 0.00 61.98 63.13 1xfw s VAL 308 Cb -0.36 -3.94 -0.00 0.00 0.00 0.00 0.00 36.38 32.08 1xfw s VAL 308 CO 0.41 -0.73 0.45 -2.65 0.00 0.00 0.00 175.10 172.58 1xfw n PRO 309 N 8.64 -0.12 0.10 2.72 -0.02 -1.26 0.26 135.00 145.32 1xfw n PRO 309 Ca 0.20 0.44 0.19 0.00 -2.02 0.00 0.00 63.50 62.30 1xfw n PRO 309 Cb 0.49 -0.65 0.74 0.00 -0.02 0.00 0.00 33.50 34.06 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 0.21 114.58 117.42 1xfw h GLU 310 Ca 0.06 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 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 -0.28 0.00 -0.03 0.45 -1.00 0.00 0.00 179.01 178.16 1xfw h HIS 311 N 0.00 -0.07 -0.42 4.33 3.86 0.32 0.68 115.15 123.86 1xfw h HIS 311 Ca 0.17 -0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.47 1xfw h HIS 311 Cb 0.81 0.02 -0.09 0.00 1.06 0.00 0.00 27.41 29.21 1xfw h HIS 311 CO 0.00 0.44 -0.32 0.00 0.86 0.00 0.00 177.93 178.91 1xfw h ALA 312 N -0.41 -0.16 -0.89 2.45 0.00 -0.42 0.96 119.26 120.79 1xfw h ALA 312 Ca -0.01 0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.05 1xfw h ALA 312 Cb 0.54 0.70 -0.05 0.00 0.00 0.00 0.00 17.79 18.98 1xfw h ALA 312 CO 0.01 -0.71 0.58 -0.44 0.00 0.00 0.00 179.25 178.69 1xfw h ASP 313 N -0.24 0.95 -0.93 0.00 3.32 -0.72 0.68 116.42 119.48 1xfw h ASP 313 Ca 0.18 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 1xfw h ASP 313 Cb 0.54 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.83 1xfw h ASP 313 CO -0.55 0.64 0.56 0.00 -1.72 0.00 0.00 179.24 178.17 1xfw h ALA 314 N 1.49 1.22 -0.37 3.45 0.00 0.27 -2.12 119.26 123.21 1xfw h ALA 314 Ca 0.36 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 55.00 1xfw h ALA 314 Cb 0.06 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1xfw h ALA 314 CO -0.11 0.66 -0.40 0.74 0.00 0.00 0.00 179.25 180.14 1xfw h PHE 315 N 1.29 1.10 -1.61 0.00 0.05 0.16 -3.18 116.94 114.75 1xfw h PHE 315 Ca 0.33 -0.34 0.51 0.00 3.82 0.00 0.00 57.97 62.30 1xfw h PHE 315 Cb -0.05 -0.23 -0.11 0.00 2.00 0.00 0.00 35.95 37.56 1xfw h PHE 315 CO 0.01 1.16 1.10 1.17 -0.18 0.00 0.00 178.31 181.57 1xfw n LYS 316 N -4.05 -0.02 0.07 1.51 4.81 0.13 0.70 118.16 121.30 1xfw n LYS 316 Ca -0.02 1.16 -0.10 0.00 -0.87 0.00 0.00 58.31 58.48 1xfw n LYS 316 Cb 0.55 -2.44 -0.13 0.00 0.02 0.00 0.00 35.03 33.04 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 0.07 -0.16 1.64 3.64 -1.60 -3.34 116.57 116.83 1xfw h LYS 317 Ca 0.89 -0.13 -0.17 0.00 -1.27 0.00 0.00 60.65 59.97 1xfw h LYS 317 Cb 3.20 0.05 0.01 0.00 -0.41 0.00 0.00 32.23 35.07 1xfw h LYS 317 CO -0.26 1.04 -0.58 0.82 -2.27 0.00 0.00 179.45 178.19 1xfw h ILE 318 N 0.02 1.32 -1.00 2.00 5.03 0.11 -3.02 117.51 121.96 1xfw h ILE 318 Ca -0.06 -1.83 0.20 0.00 -0.12 0.00 0.00 64.86 63.05 1xfw h ILE 318 Cb 1.84 2.00 -0.11 0.00 -3.03 0.00 0.00 36.82 37.52 1xfw h ILE 318 CO 0.15 0.57 0.61 0.00 -0.68 0.00 0.00 178.15 178.80 1xfw h ALA 319 N 0.54 1.72 -2.07 1.87 0.00 -1.63 -2.66 119.26 117.04 1xfw h ALA 319 Ca -0.03 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1xfw h ALA 319 Cb 1.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1xfw h ALA 319 CO 0.12 -0.11 0.00 0.54 0.00 0.00 0.00 179.25 179.80 1xfw n ARG 320 N -4.77 0.00 -0.08 0.00 1.74 -1.19 0.11 116.66 112.47 1xfw n ARG 320 Ca 0.24 0.15 -0.02 0.00 -0.77 0.00 0.00 57.85 57.45 1xfw n ARG 320 Cb 0.61 -0.95 -0.02 0.00 -1.02 0.00 0.00 32.46 31.08 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 -0.96 -0.09 0.14 5.56 2.13 -1.15 0.58 120.64 126.85 1xfw n GLU 321 Ca 0.00 0.56 -0.01 0.00 0.66 0.00 0.00 57.16 58.37 1xfw n GLU 321 Cb 0.00 -0.83 0.18 0.00 0.27 0.00 0.00 31.44 31.05 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 -0.18 -3.20 0.09 0.00 0.00 178.44 175.57 1xfw n ASN 323 N -3.79 -5.50 -3.65 -0.43 4.05 0.30 -4.65 115.26 101.59 1xfw n ASN 323 Ca -0.01 0.18 -0.07 0.00 0.45 0.00 0.00 54.58 55.12 1xfw n ASN 323 Cb 0.61 -3.59 -0.07 0.00 1.23 0.00 0.00 39.78 37.96 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 -2.37 -0.06 0.35 -0.44 -4.23 -0.50 -1.31 115.64 107.08 1xfw s THR 324 Ca 0.09 0.01 -0.29 0.00 -1.18 0.00 0.00 61.69 60.33 1xfw s THR 324 Cb -0.03 -0.95 -0.11 0.00 1.34 0.00 0.00 72.50 72.76 1xfw s THR 324 CO 0.45 0.00 1.40 -0.31 -0.54 0.00 0.00 174.62 175.63 1xfw s TYR 325 N 1.68 2.83 -0.17 3.99 1.51 0.23 -4.52 117.35 122.90 1xfw s TYR 325 Ca -0.10 1.26 -0.01 0.00 -1.01 0.00 0.00 57.07 57.21 1xfw s TYR 325 Cb -0.06 -3.85 -0.01 0.00 -0.11 0.00 0.00 41.96 37.93 1xfw s TYR 325 CO -0.19 -2.46 -0.11 0.42 -1.11 0.00 0.00 175.55 172.10 1xfw s ILE 326 N -1.03 3.04 -0.16 2.71 1.01 -1.21 -1.20 121.20 124.36 1xfw s ILE 326 Ca 0.52 -0.63 0.02 0.00 0.00 0.00 0.00 60.65 60.55 1xfw s ILE 326 Cb -0.43 -2.32 0.01 0.00 0.01 0.00 0.00 42.46 39.73 1xfw s ILE 326 CO 0.57 0.49 -0.20 -0.76 0.00 0.00 0.00 174.94 175.03 1xfw s LEU 327 N 0.93 2.16 0.25 2.97 1.02 -0.61 -1.57 118.68 123.83 1xfw s LEU 327 Ca -0.02 -0.60 0.08 0.00 0.02 0.00 0.00 54.13 53.61 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 -0.01 0.05 0.06 -0.36 0.02 0.00 0.00 176.35 176.12 1xfw s PHE 328 N 0.99 2.85 0.44 0.29 0.40 -0.15 0.28 117.98 123.08 1xfw s PHE 328 Ca -0.02 -0.17 0.03 0.00 -0.60 0.00 0.00 56.93 56.16 1xfw s PHE 328 Cb -0.15 -1.28 0.00 0.00 0.51 0.00 0.00 43.02 42.10 1xfw s PHE 328 CO -0.06 0.58 0.63 1.03 0.70 0.00 0.00 175.22 178.10 1xfw s ARG 329 N -3.63 2.95 -0.06 0.44 0.52 -0.33 -2.92 118.95 115.92 1xfw s ARG 329 Ca 0.31 -0.77 -0.30 0.00 -0.52 0.00 0.00 55.73 54.46 1xfw s ARG 329 Cb -0.07 -2.64 -0.08 0.00 0.52 0.00 0.00 34.95 32.68 1xfw s ARG 329 CO 0.21 -0.27 2.06 -2.30 0.02 0.00 0.00 175.30 175.02 1xfw n PRO 330 N -1.99 2.52 -3.32 3.54 -0.02 -1.26 -4.74 135.00 129.73 1xfw n PRO 330 Ca 0.03 0.86 -0.40 0.00 -2.02 0.00 0.00 63.50 61.98 1xfw n PRO 330 Cb 0.58 -3.05 -0.08 0.00 -0.02 0.00 0.00 33.50 30.92 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 5.72 5.12 0.19 -1.45 1.01 -1.24 -5.00 120.40 124.75 1xfw s VAL 331 Ca 0.93 0.65 -0.30 0.00 0.00 0.00 0.00 61.98 63.26 1xfw s VAL 331 Cb -0.43 -3.77 -0.17 0.00 0.00 0.00 0.00 36.38 32.02 1xfw s VAL 331 CO 0.41 0.09 0.78 -3.20 0.00 0.00 0.00 175.10 173.17 1xfw n ASN 332 N 5.45 -0.21 0.08 3.32 2.85 -1.26 -4.26 115.26 121.22 1xfw n ASN 332 Ca -0.06 1.15 -0.05 0.00 -0.11 0.00 0.00 54.58 55.50 1xfw n ASN 332 Cb 0.50 -1.05 0.13 0.00 1.24 0.00 0.00 39.78 40.60 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 1.78 0.27 -1.02 1.20 6.56 -1.95 -2.96 116.57 120.45 1xfw h LYS 333 Ca -0.35 -0.18 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 33.09 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 1.10 0.00 2.94 4.32 -1.26 -0.68 117.00 119.51 1xfw n LEU 334 Ca -0.02 -0.55 0.00 0.00 -0.02 0.00 0.00 56.01 55.42 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 0.20 0.00 0.00 -1.22 0.00 0.00 177.39 176.82 1xfw n ALA 335 N 0.49 0.19 -0.43 -1.18 0.00 -1.12 -4.09 120.51 114.37 1xfw n ALA 335 Ca 0.00 0.00 0.35 0.00 0.00 0.00 0.00 53.44 53.79 1xfw n ALA 335 Cb 0.20 0.00 0.65 0.00 0.00 0.00 0.00 19.45 20.30 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 0.22 0.00 0.00 2.02 -0.85 -0.65 112.91 113.66 1xfw h THR 336 Ca 0.00 -0.04 -0.35 0.00 0.77 0.00 0.00 66.41 66.78 1xfw h THR 336 Cb 0.00 0.08 -0.07 0.00 -1.74 0.00 0.00 68.15 66.43 1xfw h THR 336 CO 0.00 0.02 -2.33 0.59 0.37 0.00 0.00 175.52 174.17 1xfw n ASN 337 N -4.55 1.19 0.26 4.18 3.02 -1.26 -3.81 115.26 114.29 1xfw n ASN 337 Ca 0.34 -0.06 0.17 0.00 -0.03 0.00 0.00 54.58 55.00 1xfw n ASN 337 Cb 1.36 0.32 0.82 0.00 -0.61 0.00 0.00 39.78 41.67 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 -1.46 0.67 115.31 121.31 1xfw h LEU 338 Ca -0.53 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.44 1xfw h LEU 338 Cb 2.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.76 1xfw h LEU 338 CO -0.03 0.00 0.00 -0.38 0.09 0.00 0.00 178.44 178.12 1xfw n ILE 339 N -3.20 0.00 -0.31 1.22 5.41 -0.49 -0.17 119.36 121.82 1xfw n ILE 339 Ca 0.01 0.47 0.15 0.00 1.00 0.00 0.00 62.75 64.38 1xfw n ILE 339 Cb 0.43 -1.41 0.29 0.00 -0.71 0.00 0.00 39.64 38.24 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 -1.98 -0.07 -0.12 0.38 4.81 -0.87 0.21 118.16 120.53 1xfw n LYS 340 Ca 0.00 1.33 -0.13 0.00 -0.87 0.00 0.00 58.31 58.64 1xfw n LYS 340 Cb 0.00 -2.15 -0.09 0.00 0.02 0.00 0.00 35.03 32.81 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 -1.71 0.00 3.14 0.87 0.21 -3.46 113.55 112.59 1xfw h SER 341 Ca 0.57 0.22 0.00 0.00 -1.23 0.00 0.00 61.79 61.35 1xfw h SER 341 Cb 1.22 0.70 0.00 0.00 -0.44 0.00 0.00 62.40 63.88 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 -0.53 3.78 5.77 0.00 0.55 -4.87 105.19 108.54 1xfw n GLY 342 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 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 3.74 0.99 1.61 1.01 0.76 -3.92 120.40 124.59 1xfw s VAL 343 Ca 0.00 1.38 -0.13 0.00 0.00 0.00 0.00 61.98 63.23 1xfw s VAL 343 Cb 0.00 -3.74 0.18 0.00 0.00 0.00 0.00 36.38 32.82 1xfw s VAL 343 CO 0.00 0.06 1.12 0.00 0.00 0.00 0.00 175.10 176.28 1xfw s ALA 344 N -1.60 1.23 -0.05 5.51 0.00 -0.46 -4.63 121.76 121.75 1xfw s ALA 344 Ca 0.56 -0.52 0.05 0.00 0.00 0.00 0.00 51.96 52.05 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 -2.72 -0.20 0.95 0.00 0.00 0.00 175.76 174.07 1xfw s THR 345 N -3.12 2.51 0.05 0.00 -4.23 -1.26 -1.47 115.64 108.12 1xfw s THR 345 Ca 0.66 -0.91 -0.33 0.00 -1.18 0.00 0.00 61.69 59.92 1xfw s THR 345 Cb -0.16 -1.95 -0.12 0.00 1.34 0.00 0.00 72.50 71.62 1xfw s THR 345 CO 0.56 0.57 1.79 1.17 -0.54 0.00 0.00 174.62 178.18 1xfw n LYS 346 N 2.67 2.39 0.00 3.99 4.81 0.63 -4.86 118.16 127.79 1xfw n LYS 346 Ca -0.17 0.87 0.00 0.00 -0.87 0.00 0.00 58.31 58.14 1xfw n LYS 346 Cb 0.52 -2.72 0.00 0.00 0.02 0.00 0.00 35.03 32.85 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 4.10 1.69 0.09 3.14 0.00 -1.26 -4.43 105.19 108.52 1xfw n GLY 347 Ca 0.20 -1.79 -0.12 0.00 0.00 0.00 0.00 46.02 44.31 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 0.18 -2.19 0.99 3.38 -1.89 -3.32 115.31 112.46 1xfw h LEU 348 Ca 0.00 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1xfw h LEU 348 Cb 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1xfw h LEU 348 CO 0.00 1.23 0.02 -0.55 0.09 0.00 0.00 178.44 179.23 1xfw h ASN 349 N 0.03 0.00 -3.75 -0.43 -0.00 -1.95 -3.41 115.58 106.08 1xfw h ASN 349 Ca -0.21 0.00 -0.68 0.00 -0.00 0.00 0.00 56.30 55.41 1xfw h ASN 349 Cb 1.96 0.00 -0.24 0.00 -0.00 0.00 0.00 38.32 40.04 1xfw h ASN 349 CO 0.13 0.00 -0.76 -0.69 -0.00 0.00 0.00 177.43 176.11 1xfw s VAL 350 N -3.85 3.14 -0.09 6.14 1.01 -1.25 -4.71 120.40 120.79 1xfw s VAL 350 Ca -0.04 -0.67 0.18 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 34.59 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 2.72 0.00 -1.54 5.22 8.25 -1.26 -4.76 115.22 123.85 1xfw n HIS 351 Ca -0.18 -0.88 -0.29 0.00 -0.26 0.00 0.00 57.72 56.11 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 -2.46 1.61 0.06 -1.41 0.00 -1.26 -4.91 107.32 98.95 1xfw s GLY 352 Ca 0.33 -0.71 0.02 0.00 0.00 0.00 0.00 44.72 44.35 1xfw s GLY 352 CO -0.10 -0.07 0.11 0.54 0.00 0.00 0.00 173.10 173.58 1xfw s LYS 353 N -5.41 3.06 0.00 2.90 -0.14 -1.26 -5.09 119.74 113.79 1xfw s LYS 353 Ca 0.67 -0.59 0.00 0.00 -1.36 0.00 0.00 55.97 54.69 1xfw s LYS 353 Cb -0.12 -2.83 0.00 0.00 -1.68 0.00 0.00 37.83 33.20 1xfw s LYS 353 CO 0.54 0.59 0.00 0.45 -0.76 0.00 0.00 175.35 176.17 1xfw n SER 354 N 0.57 0.00 -4.16 2.83 2.88 -1.26 -4.28 113.62 110.20 1xfw n SER 354 Ca -0.09 -0.98 -0.15 0.00 -1.33 0.00 0.00 58.87 56.32 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 1.45 -0.21 -3.46 0.15 -1.20 -2.12 113.70 107.31 1xfw s SER 355 Ca 0.00 -0.74 0.16 0.00 0.70 0.00 0.00 55.95 56.06 1xfw s SER 355 Cb 0.00 -0.00 0.46 0.00 -1.71 0.00 0.00 66.02 64.76 1xfw s SER 355 CO 0.00 -0.21 1.17 -0.90 1.20 0.00 0.00 173.24 174.50 1xfw n ASP 356 N 0.81 2.55 -3.62 5.45 3.85 -1.26 -2.21 116.55 122.12 1xfw n ASP 356 Ca -0.18 -3.03 -0.00 0.00 -0.71 0.00 0.00 54.79 50.87 1xfw n ASP 356 Cb 0.57 -0.41 -0.01 0.00 -1.35 0.00 0.00 41.12 39.91 1xfw n ASP 356 CO 0.00 0.00 0.00 -1.66 -1.01 0.00 0.00 177.20 174.53 1xfw s TRP 357 N -2.87 -0.00 0.00 2.11 1.48 -1.26 -5.04 118.94 113.36 1xfw s TRP 357 Ca 0.39 0.00 0.00 0.00 -1.06 0.00 0.00 56.10 55.43 1xfw s TRP 357 Cb 0.37 0.50 0.00 0.00 -1.16 0.00 0.00 33.47 33.18 1xfw s TRP 357 CO -0.05 -0.00 0.00 0.41 -4.06 0.00 0.00 176.95 173.25 1xfw n GLY 358 N -0.16 -1.90 0.11 3.67 0.00 -1.25 -2.79 105.19 102.86 1xfw n GLY 358 Ca 0.01 -1.38 -0.16 0.00 0.00 0.00 0.00 46.02 44.49 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 0.24 0.00 1.61 0.13 -1.98 -3.30 132.00 128.71 1xfw h PRO 359 Ca 0.00 -0.42 -0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1xfw h PRO 359 Cb 0.00 0.16 -0.00 0.00 0.13 0.00 0.00 31.00 31.28 1xfw h PRO 359 CO 0.00 1.12 -0.02 -0.24 -0.23 0.00 0.00 178.00 178.63 1xfw h VAL 360 N 0.07 0.79 -0.88 1.56 3.04 -1.92 -3.45 116.25 115.45 1xfw h VAL 360 Ca -0.21 -0.09 -0.73 0.00 -1.01 0.00 0.00 66.70 64.66 1xfw h VAL 360 Cb 2.00 1.05 0.03 0.00 -2.01 0.00 0.00 31.29 32.36 1xfw h VAL 360 CO 0.17 0.02 0.28 0.00 -1.01 0.00 0.00 177.57 177.04 1xfw n ALA 361 N -2.43 -2.41 0.00 3.17 0.00 -1.12 -0.31 120.51 117.41 1xfw n ALA 361 Ca -0.03 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1xfw n ALA 361 Cb 0.11 -1.61 0.00 0.00 0.00 0.00 0.00 19.45 17.95 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 2.24 1.31 3.63 0.00 0.00 -0.94 -4.93 105.19 106.50 1xfw n GLY 362 Ca 0.22 0.00 -0.24 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 -2.31 2.55 -0.94 1.61 1.51 0.58 -4.45 117.35 115.90 1xfw s TYR 363 Ca 0.00 -0.42 -0.13 0.00 -1.01 0.00 0.00 57.07 55.50 1xfw s TYR 363 Cb 0.00 -1.47 0.22 0.00 -0.11 0.00 0.00 41.96 40.60 1xfw s TYR 363 CO 0.00 0.49 0.94 0.42 -1.11 0.00 0.00 175.55 176.28 1xfw s ILE 364 N -2.51 5.59 0.61 2.71 -1.09 -1.06 -3.24 121.20 122.21 1xfw s ILE 364 Ca 0.35 -2.63 -0.18 0.00 -2.23 0.00 0.00 60.65 55.95 1xfw s ILE 364 Cb -0.00 -4.56 -0.07 0.00 -1.58 0.00 0.00 42.46 36.24 1xfw s ILE 364 CO 0.19 -1.16 0.57 -0.81 -1.23 0.00 0.00 174.94 172.51 1xfw n PRO 365 N 4.01 0.51 0.04 2.79 -0.04 -1.26 -1.37 135.00 139.68 1xfw n PRO 365 Ca 0.19 0.20 -0.08 0.00 -0.04 0.00 0.00 63.50 63.77 1xfw n PRO 365 Cb 0.45 -1.78 -0.13 0.00 -0.04 0.00 0.00 33.50 32.00 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 0.12 0.03 -3.16 0.54 3.57 -0.95 -3.40 116.94 113.70 1xfw h PHE 366 Ca -0.46 -0.02 -0.60 0.00 3.53 0.00 0.00 57.97 60.42 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 1.02 0.67 0.34 -2.23 0.00 0.00 178.31 178.44 1xfw s ASP 367 N -6.57 6.35 0.24 0.41 2.15 -1.26 -4.84 116.67 113.16 1xfw s ASP 367 Ca -0.01 -0.28 -0.06 0.00 0.43 0.00 0.00 52.55 52.63 1xfw s ASP 367 Cb 0.09 -2.46 0.25 0.00 -0.30 0.00 0.00 42.92 40.49 1xfw s ASP 367 CO 0.82 -1.31 1.92 1.56 -0.17 0.00 0.00 175.17 177.99 1xfw h GLN 368 N 9.39 1.30 0.00 4.34 1.08 -1.91 -2.07 115.11 127.24 1xfw h GLN 368 Ca -0.26 -0.09 0.00 0.00 -1.45 0.00 0.00 58.65 56.85 1xfw h GLN 368 Cb 1.07 -0.29 0.00 0.00 -0.05 0.00 0.00 27.48 28.21 1xfw h GLN 368 CO 1.12 0.87 0.00 -3.47 -0.95 0.00 0.00 178.83 176.40 1xfw n ASP 369 N -4.38 0.00 -1.47 1.46 2.03 -1.26 -0.56 116.55 112.37 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 -0.89 4.76 0.00 -2.67 4.77 -0.78 -4.70 117.00 117.49 1xfw n LEU 370 Ca 0.00 -3.97 -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 -0.14 -1.54 -1.33 0.00 0.00 177.39 175.78 1xfw n SER 371 N -1.05 0.47 -0.38 -1.43 3.41 0.28 -4.69 113.62 110.23 1xfw n SER 371 Ca 0.39 -3.25 0.30 0.00 -0.26 0.00 0.00 58.87 56.05 1xfw n SER 371 Cb 1.04 1.32 0.57 0.00 -0.26 0.00 0.00 64.21 66.88 1xfw n SER 371 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1xfw h LYS 372 N 0.00 0.23 -2.19 4.33 2.10 -1.71 -2.17 116.57 117.15 1xfw h LYS 372 Ca -0.29 -0.01 -0.51 0.00 -2.00 0.00 0.00 60.65 57.83 1xfw h LYS 372 Cb 1.25 -0.05 -0.13 0.00 -0.90 0.00 0.00 32.23 32.39 1xfw h LYS 372 CO 0.45 0.15 0.90 1.63 -2.00 0.00 0.00 179.45 180.58 1xfw n LYS 373 N -4.74 2.89 -2.61 0.07 4.76 -1.26 -4.88 118.16 112.39 1xfw n LYS 373 Ca 0.32 -2.34 -0.42 0.00 -2.87 0.00 0.00 58.31 53.00 1xfw n LYS 373 Cb 1.16 -2.26 -0.03 0.00 -1.84 0.00 0.00 35.03 32.06 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 -0.88 2.64 0.00 2.13 5.65 -0.82 -3.81 115.29 120.20 1xfw s HIS 374 Ca 0.60 -1.00 0.00 0.00 0.25 0.00 0.00 55.06 54.91 1xfw s HIS 374 Cb 0.32 -4.65 0.00 0.00 -1.18 0.00 0.00 32.58 27.07 1xfw s HIS 374 CO -0.15 -1.87 0.00 0.41 -0.65 0.00 0.00 174.74 172.49 1xfw n GLY 375 N 6.55 4.17 3.54 1.59 0.00 -1.26 -5.05 105.19 114.73 1xfw n GLY 375 Ca 0.34 -0.70 -0.19 0.00 0.00 0.00 0.00 46.02 45.46 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 0.48 0.00 1.61 3.00 -1.25 -4.67 117.38 116.56 1xfw n GLN 376 Ca 0.00 -0.53 0.00 0.00 -0.01 0.00 0.00 57.00 56.46 1xfw n GLN 376 Cb 0.00 -3.02 0.00 0.00 0.00 0.00 0.00 30.24 27.22 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 -1.49 117.38 128.96 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 -0.15 0.13 0.21 1.69 4.32 -1.26 -3.92 117.00 118.03 1xfw n LEU 378 Ca 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 56.01 56.04 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 0.00 177.39 177.04 1xfw h ALA 379 N 0.00 1.61 0.06 -1.18 0.00 -1.60 0.63 119.26 118.77 1xfw h ALA 379 Ca 0.00 -0.21 -0.27 0.00 0.00 0.00 0.00 54.91 54.42 1xfw h ALA 379 Cb 0.22 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1xfw h ALA 379 CO 0.00 0.29 -1.48 0.28 0.00 0.00 0.00 179.25 178.35 1xfw h VAL 380 N 0.00 0.87 0.00 0.00 2.07 -1.69 0.12 116.25 117.61 1xfw h VAL 380 Ca -0.00 -2.27 0.00 0.00 0.82 0.00 0.00 66.70 65.25 1xfw h VAL 380 Cb 0.42 2.42 0.00 0.00 -1.52 0.00 0.00 31.29 32.61 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 0.70 114.58 119.25 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 1.60 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.19 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 -2.46 1.22 -0.11 1.92 4.81 0.22 -4.28 118.16 119.47 1xfw n LYS 382 Ca -0.00 -1.03 -0.23 0.00 -0.87 0.00 0.00 58.31 56.17 1xfw n LYS 382 Cb 0.15 -0.97 -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 -0.27 -0.70 0.11 3.14 0.00 0.13 -3.94 105.19 103.66 1xfw n GLY 383 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 0.25 0.00 1.61 2.35 -0.08 -0.24 115.58 118.47 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 1.37 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.67 1xfw h ASN 384 CO -0.27 0.23 0.82 0.25 -1.65 0.00 0.00 177.43 176.81 1xfw h LEU 385 N 0.25 0.00 0.00 1.61 7.12 -1.74 0.92 115.31 123.47 1xfw h LEU 385 Ca 0.07 0.00 -0.09 0.00 0.13 0.00 0.00 57.88 58.00 1xfw h LEU 385 Cb 0.02 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.14 1xfw h LEU 385 CO -0.01 0.00 -0.57 -0.08 -0.13 0.00 0.00 178.44 177.65 1xfw h GLU 386 N 0.00 0.00 -0.13 1.25 4.57 -1.16 -3.32 114.58 115.79 1xfw h GLU 386 Ca 0.00 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.20 1xfw h GLU 386 Cb 1.65 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 30.22 1xfw h GLU 386 CO 0.00 0.66 0.01 -0.91 -1.18 0.00 0.00 179.01 177.59 1xfw h ASN 387 N -1.00 -0.02 -0.75 1.04 -0.26 -0.82 -0.92 115.58 112.85 1xfw h ASN 387 Ca -0.13 0.02 0.11 0.00 -0.56 0.00 0.00 56.30 55.74 1xfw h ASN 387 Cb 0.87 0.04 -0.12 0.00 -1.06 0.00 0.00 38.32 38.04 1xfw h ASN 387 CO -0.08 0.01 -0.43 0.11 -1.06 0.00 0.00 177.43 175.98 1xfw h LYS 388 N 0.06 -0.12 -0.35 0.81 1.57 -1.59 0.39 116.57 117.34 1xfw h LYS 388 Ca 0.06 0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.81 1xfw h LYS 388 Cb 0.06 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 1xfw h LYS 388 CO -0.09 -0.08 0.06 -0.22 -0.57 0.00 0.00 179.45 178.55 1xfw h LYS 389 N -0.13 0.52 -0.92 3.15 3.64 -1.56 0.50 116.57 121.77 1xfw h LYS 389 Ca 0.23 -0.09 0.21 0.00 -1.27 0.00 0.00 60.65 59.73 1xfw h LYS 389 Cb 0.55 -0.09 -0.07 0.00 -0.41 0.00 0.00 32.23 32.22 1xfw h LYS 389 CO -0.80 0.50 0.61 0.77 -2.27 0.00 0.00 179.45 178.26 1xfw h SER 390 N 0.51 0.40 0.00 4.20 0.02 0.12 -0.29 113.55 118.50 1xfw h SER 390 Ca 0.12 0.04 -0.18 0.00 -0.84 0.00 0.00 61.79 60.93 1xfw h SER 390 Cb 0.24 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.72 1xfw h SER 390 CO 0.00 0.15 -1.36 -0.38 -1.14 0.00 0.00 176.83 174.10 1xfw n ILE 391 N -4.51 1.50 -0.36 3.27 5.41 -0.83 -3.49 119.36 120.35 1xfw n ILE 391 Ca 0.20 -0.02 0.29 0.00 1.00 0.00 0.00 62.75 64.21 1xfw n ILE 391 Cb 0.73 -2.16 0.47 0.00 -0.71 0.00 0.00 39.64 37.97 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 -4.44 -0.11 0.00 1.39 -1.04 0.17 -2.39 114.28 107.86 1xfw n THR 392 Ca -0.28 1.11 0.00 0.00 -2.04 0.00 0.00 64.05 62.84 1xfw n THR 392 Cb 0.60 -1.83 0.00 0.00 -1.82 0.00 0.00 70.33 67.28 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 -1.39 -2.82 1.02 -0.15 -4.70 120.64 108.84 1xfw n GLU 393 Ca 0.27 0.02 -0.39 0.00 -0.02 0.00 0.00 57.16 57.04 1xfw n GLU 393 Cb 1.11 -0.23 -0.02 0.00 -0.02 0.00 0.00 31.44 32.29 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 -1.67 2.65 -2.76 -0.32 8.25 -1.11 -4.94 115.22 115.32 1xfw n HIS 394 Ca 0.00 -2.58 -0.40 0.00 -0.26 0.00 0.00 57.72 54.47 1xfw n HIS 394 Cb 0.00 -2.23 -0.05 0.00 1.12 0.00 0.00 29.99 28.83 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 3.50 4.78 0.00 -0.41 4.04 -1.00 -1.46 118.70 128.15 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 0.42 0.00 0.41 -1.84 0.00 0.00 175.26 174.22 1xfw n GLY 396 N 1.76 3.09 0.13 -3.83 0.00 -1.26 -4.78 105.19 100.31 1xfw n GLY 396 Ca -0.01 -1.03 -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 0.65 -3.99 1.61 4.07 -1.20 -4.62 120.64 117.16 1xfw n GLU 397 Ca 0.00 0.23 -0.35 0.00 -0.06 0.00 0.00 57.16 56.98 1xfw n GLU 397 Cb 0.00 -1.56 -0.14 0.00 -0.06 0.00 0.00 31.44 29.68 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 3.36 0.08 6.31 -1.09 -0.53 0.14 121.20 126.96 1xfw s ILE 398 Ca -0.34 -0.50 -0.00 0.00 -2.23 0.00 0.00 60.65 57.58 1xfw s ILE 398 Cb 0.10 -2.52 0.00 0.00 -1.58 0.00 0.00 42.46 38.46 1xfw s ILE 398 CO 0.60 0.43 0.10 0.61 -1.23 0.00 0.00 174.94 175.45 1xfw n GLY 399 N 4.65 3.07 3.25 6.18 0.00 0.68 -4.38 105.19 118.64 1xfw n GLY 399 Ca -0.18 -1.48 -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 -2.20 2.54 0.12 1.61 0.00 -1.26 0.87 119.74 121.41 1xfw s LYS 400 Ca 0.07 -0.88 0.04 0.00 0.00 0.00 0.00 55.97 55.20 1xfw s LYS 400 Cb -0.00 -2.13 -0.04 0.00 0.00 0.00 0.00 37.83 35.66 1xfw s LYS 400 CO 0.05 0.35 -0.10 0.96 0.00 0.00 0.00 175.35 176.62 1xfw s ILE 401 N -0.10 1.00 0.43 3.79 -4.36 -0.68 -4.92 121.20 116.35 1xfw s ILE 401 Ca -0.05 -1.84 -0.24 0.00 -0.26 0.00 0.00 60.65 58.25 1xfw s ILE 401 Cb -0.14 -1.60 -0.08 0.00 1.25 0.00 0.00 42.46 41.90 1xfw s ILE 401 CO 0.04 -0.67 1.18 -2.84 0.24 0.00 0.00 174.94 172.89 1xfw s PRO 402 N -3.31 3.88 0.40 0.37 0.02 -1.26 -1.03 135.00 134.07 1xfw s PRO 402 Ca 0.11 1.84 -0.25 0.00 0.02 0.00 0.00 61.00 62.71 1xfw s PRO 402 Cb 0.00 -2.54 -0.08 0.00 0.02 0.00 0.00 34.50 31.90 1xfw s PRO 402 CO -0.00 -0.47 1.18 -1.17 -0.33 0.00 0.00 177.00 176.21 1xfw s LEU 403 N -2.78 4.18 -0.45 -5.54 2.96 0.15 -4.83 118.68 112.38 1xfw s LEU 403 Ca 0.61 2.37 0.06 0.00 -0.22 0.00 0.00 54.13 56.94 1xfw s LEU 403 Cb -0.30 -4.03 0.21 0.00 0.50 0.00 0.00 46.19 42.57 1xfw s LEU 403 CO 0.38 -0.71 0.59 0.29 -1.32 0.00 0.00 176.35 175.58 1xfw n LYS 404 N 0.04 0.51 -1.72 1.98 5.02 -1.26 -3.22 118.16 119.51 1xfw n LYS 404 Ca 0.04 -2.62 -0.42 0.00 -2.02 0.00 0.00 58.31 53.30 1xfw n LYS 404 Cb 0.46 -1.47 -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 -0.18 4.40 0.00 -0.35 1.02 -1.22 -4.96 118.68 117.39 1xfw s LEU 405 Ca 0.33 2.72 0.00 0.00 0.02 0.00 0.00 54.13 57.19 1xfw s LEU 405 Cb 0.10 -3.56 0.00 0.00 0.02 0.00 0.00 46.19 42.75 1xfw s LEU 405 CO -0.15 -1.01 0.00 -0.90 0.02 0.00 0.00 176.35 174.31 1xfw n ASP 406 N 6.05 -0.13 0.17 2.29 5.75 -1.26 -4.83 116.55 124.59 1xfw n ASP 406 Ca 0.18 -0.51 -0.07 0.00 -0.01 0.00 0.00 54.79 54.38 1xfw n ASP 406 Cb 0.39 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.44 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 -0.69 -0.43 -0.19 2.11 3.86 -2.01 -3.22 115.15 114.58 1xfw h HIS 407 Ca 0.00 -0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.25 1xfw h HIS 407 Cb 0.00 0.14 -0.07 0.00 1.06 0.00 0.00 27.41 28.55 1xfw h HIS 407 CO 0.00 -0.27 -0.26 -0.07 0.86 0.00 0.00 177.93 178.20 1xfw h LEU 408 N -0.68 -0.81 -0.92 2.43 4.07 -2.00 -2.55 115.31 114.84 1xfw h LEU 408 Ca -0.05 0.14 0.19 0.00 0.08 0.00 0.00 57.88 58.24 1xfw h LEU 408 Cb 0.36 0.37 -0.17 0.00 1.08 0.00 0.00 40.66 42.29 1xfw h LEU 408 CO 0.08 -0.30 -0.21 -0.09 -1.08 0.00 0.00 178.44 176.84 1xfw h ARG 409 N -0.29 0.00 0.57 1.13 9.65 -1.96 -0.31 114.38 123.18 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 0.48 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.04 1xfw h ARG 409 CO -0.36 0.00 -0.49 0.82 2.80 0.00 0.00 179.97 182.74 1xfw h ILE 410 N 0.00 0.00 -0.51 1.20 1.08 -1.46 -0.56 117.51 117.26 1xfw h ILE 410 Ca 0.45 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 65.07 1xfw h ILE 410 Cb 0.71 0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 34.44 1xfw h ILE 410 CO -0.94 0.00 0.54 -0.33 -0.69 0.00 0.00 178.15 176.72 1xfw h GLU 411 N -1.04 0.00 0.17 2.37 5.08 -1.05 -2.56 114.58 117.54 1xfw h GLU 411 Ca -0.07 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1xfw h GLU 411 Cb 0.88 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.13 1xfw h GLU 411 CO -0.01 0.00 -0.08 1.49 -1.00 0.00 0.00 179.01 179.40 1xfw h GLU 412 N 0.00 -0.22 0.00 2.33 4.81 0.20 -3.12 114.58 118.59 1xfw h GLU 412 Ca 0.24 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 1xfw h GLU 412 Cb 1.31 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.74 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 -4.54 0.00 0.00 1.64 4.77 -0.35 -2.18 117.00 116.34 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 0.11 3.23 0.00 -1.01 0.44 118.16 120.03 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 0.34 0.00 0.00 0.00 0.00 35.03 35.02 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 -0.54 0.08 0.10 1.64 0.00 -1.01 0.28 120.64 121.19 1xfw n GLU 415 Ca 0.00 0.56 0.12 0.00 0.00 0.00 0.00 57.16 57.84 1xfw n GLU 415 Cb 0.00 -1.84 0.17 0.00 0.00 0.00 0.00 31.44 29.77 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 -1.88 -1.84 -0.73 -1.61 -3.48 115.58 106.03 1xfw h ASN 416 Ca 0.00 -0.10 -0.03 0.00 1.87 0.00 0.00 56.30 58.04 1xfw h ASN 416 Cb 0.16 0.00 0.01 0.00 0.27 0.00 0.00 38.32 38.76 1xfw h ASN 416 CO 0.00 0.05 -0.06 0.61 -0.37 0.00 0.00 177.43 177.66 1xfw n GLY 417 N 1.26 0.59 0.07 1.57 0.00 0.80 -5.00 105.19 104.48 1xfw n GLY 417 Ca 0.03 -0.51 -0.06 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.95 0.90 -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 -0.54 -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 -2.42 0.32 -0.23 1.39 -4.36 -0.85 -3.95 121.20 111.10 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 -0.95 0.04 -0.22 0.24 0.00 0.00 174.94 174.64 1xfw s LEU 420 N -2.89 1.65 -0.20 0.37 1.98 -0.73 -4.45 118.68 114.42 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 46.16 1xfw s LEU 420 CO -0.09 -0.32 1.10 -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 -2.24 119.74 126.41 1xfw s LYS 421 Ca 0.01 1.44 0.00 0.00 -0.36 0.00 0.00 55.97 57.06 1xfw s LYS 421 Cb -0.17 -3.66 0.00 0.00 -1.51 0.00 0.00 37.83 32.48 1xfw s LYS 421 CO -0.12 -0.63 0.00 0.41 -0.36 0.00 0.00 175.35 174.66 1xfw n GLY 422 N 3.38 5.07 2.95 5.54 0.00 -1.08 -5.04 105.19 116.00 1xfw n GLY 422 Ca 0.12 -0.67 -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 -3.08 1.61 4.81 -1.26 -4.11 118.16 116.13 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 2.72 0.25 1.64 1.02 -1.26 -1.52 119.74 121.69 1xfw s LYS 424 Ca 0.53 -1.34 -0.17 0.00 0.02 0.00 0.00 55.97 55.02 1xfw s LYS 424 Cb -0.58 -2.70 0.01 0.00 -0.52 0.00 0.00 37.83 34.04 1xfw s LYS 424 CO 0.56 -0.36 0.57 -2.00 -0.92 0.00 0.00 175.35 173.21 1xfw s GLU 425 N -4.38 1.59 -0.04 1.68 2.56 -0.45 -4.87 118.70 114.79 1xfw s GLU 425 Ca 0.55 -1.06 -0.01 0.00 0.00 0.00 0.00 54.97 54.44 1xfw s GLU 425 Cb -0.09 0.53 0.03 0.00 2.00 0.00 0.00 34.13 36.61 1xfw s GLU 425 CO 0.33 -0.69 0.08 0.42 -0.56 0.00 0.00 175.26 174.84 1xfw s ILE 426 N -3.95 -0.05 -0.02 -3.70 -1.09 -1.26 -2.12 121.20 109.00 1xfw s ILE 426 Ca 0.15 0.19 -0.02 0.00 -2.23 0.00 0.00 60.65 58.75 1xfw s ILE 426 Cb -0.03 -0.15 0.01 0.00 -1.58 0.00 0.00 42.46 40.71 1xfw s ILE 426 CO 0.05 0.08 0.05 -1.81 -1.23 0.00 0.00 174.94 172.08 1xfw s ASP 427 N 1.07 -0.05 0.00 3.58 -0.00 -1.10 -4.84 116.67 115.33 1xfw s ASP 427 Ca -0.09 0.10 0.00 0.00 -0.00 0.00 0.00 52.55 52.57 1xfw s ASP 427 Cb -0.12 0.09 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 3.17 0.00 0.00 0.27 3.02 -1.26 -1.09 115.26 119.37 1xfw n ASN 428 Ca -0.14 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.41 1xfw n ASN 428 Cb 0.59 -2.14 0.00 0.00 -0.61 0.00 0.00 39.78 37.62 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 -1.70 1.34 3.90 7.41 0.00 -1.26 -5.10 105.19 109.78 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 -0.29 3.59 0.29 1.61 1.02 -0.25 -5.09 119.74 120.62 1xfw s LYS 430 Ca 0.00 -0.14 -0.18 0.00 0.02 0.00 0.00 55.97 55.67 1xfw s LYS 430 Cb 0.00 -2.89 -0.09 0.00 -0.52 0.00 0.00 37.83 34.33 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 4.15 -0.15 1.68 1.02 -1.26 -2.72 119.74 119.86 1xfw s LYS 431 Ca 0.39 0.81 -0.04 0.00 0.02 0.00 0.00 55.97 57.16 1xfw s LYS 431 Cb -0.12 -2.61 0.07 0.00 -0.52 0.00 0.00 37.83 34.65 1xfw s LYS 431 CO 0.25 0.24 0.16 0.71 -0.92 0.00 0.00 175.35 175.80 1xfw s TYR 432 N -1.80 -0.12 0.20 3.18 4.12 -0.90 -3.14 117.35 118.89 1xfw s TYR 432 Ca 0.50 0.20 -0.29 0.00 0.02 0.00 0.00 57.07 57.50 1xfw s TYR 432 Cb -0.13 -0.42 -0.08 0.00 -1.52 0.00 0.00 41.96 39.81 1xfw s TYR 432 CO 0.19 -0.47 0.91 0.71 0.02 0.00 0.00 175.55 176.91 1xfw s TYR 433 N 2.26 3.94 -0.04 2.71 1.51 -1.24 -1.34 117.35 125.15 1xfw s TYR 433 Ca 0.04 1.84 -0.22 0.00 -1.01 0.00 0.00 57.07 57.72 1xfw s TYR 433 Cb -0.15 -2.95 -0.04 0.00 -0.11 0.00 0.00 41.96 38.71 1xfw s TYR 433 CO -0.09 0.43 0.66 -1.17 -1.11 0.00 0.00 175.55 174.26 1xfw s LEU 434 N -0.96 4.36 -0.26 -1.29 1.98 -0.57 -2.89 118.68 119.04 1xfw s LEU 434 Ca 0.41 1.18 -0.07 0.00 -2.89 0.00 0.00 54.13 52.76 1xfw s LEU 434 Cb -0.25 -3.02 -0.02 0.00 0.66 0.00 0.00 46.19 43.56 1xfw s LEU 434 CO 0.30 -0.03 0.07 -0.76 -1.89 0.00 0.00 176.35 174.05 1xfw s LEU 435 N 0.39 3.49 -0.13 -0.68 1.43 -1.05 -2.64 118.68 119.49 1xfw s LEU 435 Ca 0.35 -0.29 -0.07 0.00 -1.03 0.00 0.00 54.13 53.09 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 0.18 -0.06 0.12 -0.70 0.23 0.00 0.00 176.35 176.12 1xfw s GLU 436 N 1.59 3.51 -0.08 1.70 2.56 -0.95 -3.64 118.70 123.40 1xfw s GLU 436 Ca 0.06 -0.17 -0.03 0.00 0.00 0.00 0.00 54.97 54.82 1xfw s GLU 436 Cb -0.15 -3.18 0.05 0.00 2.00 0.00 0.00 34.13 32.84 1xfw s GLU 436 CO 0.03 0.70 0.17 0.45 -0.56 0.00 0.00 175.26 176.05 1xfw s SER 437 N -0.80 0.36 0.00 -1.70 0.15 -1.26 -1.77 113.70 108.68 1xfw s SER 437 Ca 0.14 0.36 -0.00 0.00 0.70 0.00 0.00 55.95 57.14 1xfw s SER 437 Cb -0.12 0.29 -0.01 0.00 -1.71 0.00 0.00 66.02 64.48 1xfw s SER 437 CO 0.03 -0.21 0.49 -3.20 1.20 0.00 0.00 173.24 171.56 1xfw n ASN 438 N 4.88 1.12 -4.94 5.45 4.05 -1.26 -4.74 115.26 119.82 1xfw n ASN 438 Ca -0.13 -1.34 -0.24 0.00 0.45 0.00 0.00 54.58 53.32 1xfw n ASN 438 Cb 0.51 -0.24 0.03 0.00 1.23 0.00 0.00 39.78 41.30 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 2.08 5.51 -0.24 1.20 3.84 -1.26 -5.02 114.94 121.04 1xfw s ASN 439 Ca 0.01 0.39 0.10 0.00 0.21 0.00 0.00 52.86 53.57 1xfw s ASN 439 Cb 0.01 -1.40 0.43 0.00 -0.55 0.00 0.00 41.25 39.74 1xfw s ASN 439 CO 0.00 -1.02 1.22 0.00 -2.79 0.00 0.00 177.10 174.50 1xfw n GLN 440 N -2.40 2.24 0.00 0.43 10.64 -1.26 -4.73 117.38 122.30 1xfw n GLN 440 Ca 0.05 -3.58 0.00 0.00 -1.83 0.00 0.00 57.00 51.63 1xfw n GLN 440 Cb 0.58 -1.84 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 -0.99 0.00 -4.77 -0.39 0.31 -1.26 -4.94 118.33 106.30 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 0.79 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 -0.45 1.59 -0.07 3.52 4.12 -1.26 -2.57 117.35 122.23 1xfw s TYR 442 Ca 0.00 -0.45 0.01 0.00 0.02 0.00 0.00 57.07 56.65 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 -0.15 -0.07 -1.21 0.02 0.00 0.00 175.55 174.14 1xfw s GLU 443 N 0.05 2.76 0.19 -0.62 2.02 -1.05 -4.77 118.70 117.29 1xfw s GLU 443 Ca -0.03 -0.54 0.11 0.00 0.02 0.00 0.00 54.97 54.52 1xfw s GLU 443 Cb -0.11 -2.60 -0.04 0.00 0.10 0.00 0.00 34.13 31.48 1xfw s GLU 443 CO 0.02 0.66 -0.23 -0.06 0.02 0.00 0.00 175.26 175.67 1xfw s PHE 444 N -0.80 2.21 -0.22 1.61 0.40 -1.24 -2.77 117.98 117.17 1xfw s PHE 444 Ca 0.12 -0.38 -0.13 0.00 -0.60 0.00 0.00 56.93 55.94 1xfw s PHE 444 Cb -0.11 -1.08 0.07 0.00 0.51 0.00 0.00 43.02 42.40 1xfw s PHE 444 CO 0.01 0.49 0.55 -0.98 0.70 0.00 0.00 175.22 175.99 1xfw s ARG 445 N -2.76 0.56 0.55 0.44 1.70 0.85 -2.52 118.95 117.77 1xfw s ARG 445 Ca 0.20 0.99 0.00 0.00 -0.47 0.00 0.00 55.73 56.46 1xfw s ARG 445 Cb -0.07 0.07 0.03 0.00 -0.57 0.00 0.00 34.95 34.41 1xfw s ARG 445 CO 0.10 -0.15 0.78 -1.50 -1.08 0.00 0.00 175.30 173.45 1xfw s ILE 446 N 1.43 2.81 0.00 4.99 2.07 -1.14 0.65 121.20 132.01 1xfw s ILE 446 Ca -0.09 -0.60 0.00 0.00 -1.41 0.00 0.00 60.65 58.55 1xfw s ILE 446 Cb -0.07 -3.07 0.00 0.00 0.13 0.00 0.00 42.46 39.46 1xfw s ILE 446 CO -0.15 -0.05 0.00 -0.24 -1.91 0.00 0.00 174.94 172.59 1xfw n SER 447 N -2.36 0.00 0.00 4.50 2.88 0.10 -3.63 113.62 115.11 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 0.31 0.00 -3.46 -0.08 -1.19 -4.26 116.55 107.88 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 -2.11 0.00 -3.74 -0.67 2.13 -1.26 -4.51 120.64 110.47 1xfw n GLU 449 Ca 0.00 0.12 -0.36 0.00 0.66 0.00 0.00 57.16 57.58 1xfw n GLU 449 Cb 0.08 -1.07 -0.10 0.00 0.27 0.00 0.00 31.44 30.62 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 -1.95 5.92 0.00 4.31 4.22 -1.26 -4.96 114.94 121.21 1xfw s ASN 450 Ca 0.00 0.08 -0.00 0.00 -2.14 0.00 0.00 52.86 50.79 1xfw s ASN 450 Cb 0.00 -2.06 -0.02 0.00 1.28 0.00 0.00 41.25 40.46 1xfw s ASN 450 CO 0.00 0.08 0.68 0.59 -2.04 0.00 0.00 177.10 176.41 1xfw n ASN 451 N 4.17 1.28 -3.52 3.54 4.13 -1.26 -4.20 115.26 119.40 1xfw n ASN 451 Ca -0.15 -1.44 -0.30 0.00 1.68 0.00 0.00 54.58 54.36 1xfw n ASN 451 Cb 0.52 -0.29 0.29 0.00 -1.54 0.00 0.00 39.78 38.76 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 1.78 -2.95 0.03 3.52 2.02 -1.26 -3.42 118.70 118.42 1xfw s GLU 452 Ca 0.04 0.25 -0.01 0.00 0.02 0.00 0.00 54.97 55.27 1xfw s GLU 452 Cb 0.02 -1.36 -0.02 0.00 0.10 0.00 0.00 34.13 32.86 1xfw s GLU 452 CO 0.00 -4.92 -0.01 0.08 0.02 0.00 0.00 175.26 170.44 1xfw s VAL 453 N -2.20 0.14 0.03 2.63 1.01 -1.20 0.02 120.40 120.84 1xfw s VAL 453 Ca 0.68 -1.19 -0.11 0.00 0.00 0.00 0.00 61.98 61.36 1xfw s VAL 453 Cb -0.15 -0.72 0.01 0.00 0.00 0.00 0.00 36.38 35.52 1xfw s VAL 453 CO 0.59 -0.65 0.24 -1.10 0.00 0.00 0.00 175.10 174.17 1xfw s GLN 454 N -2.33 0.71 0.32 2.72 -0.21 0.21 -1.82 119.66 119.27 1xfw s GLN 454 Ca -0.08 -0.52 0.04 0.00 0.02 0.00 0.00 55.36 54.81 1xfw s GLN 454 Cb -0.04 0.30 -0.04 0.00 1.00 0.00 0.00 33.01 34.24 1xfw s GLN 454 CO -0.04 -0.21 0.17 1.52 -2.12 0.00 0.00 175.29 174.61 1xfw s TYR 455 N -2.33 1.65 -0.17 0.91 -0.00 -0.84 -0.10 117.35 116.47 1xfw s TYR 455 Ca -0.07 -1.38 -0.32 0.00 -0.00 0.00 0.00 57.07 55.30 1xfw s TYR 455 Cb -0.02 -0.89 0.14 0.00 -0.00 0.00 0.00 41.96 41.18 1xfw s TYR 455 CO -0.02 -0.52 1.13 -1.59 -0.00 0.00 0.00 175.55 174.55 1xfw s LYS 456 N -3.76 0.42 0.26 -3.49 -2.85 -1.11 -1.23 119.74 107.97 1xfw s LYS 456 Ca 0.34 -0.07 -0.30 0.00 -1.00 0.00 0.00 55.97 54.95 1xfw s LYS 456 Cb 0.04 0.20 -0.09 0.00 -2.06 0.00 0.00 37.83 35.92 1xfw s LYS 456 CO 0.18 -0.17 1.03 0.95 0.10 0.00 0.00 175.35 177.44 1xfw s THR 457 N -2.02 3.76 0.71 3.79 -4.23 0.21 -2.52 115.64 115.33 1xfw s THR 457 Ca 0.06 1.76 -0.15 0.00 -1.18 0.00 0.00 61.69 62.18 1xfw s THR 457 Cb -0.01 -4.12 0.03 0.00 1.34 0.00 0.00 72.50 69.74 1xfw s THR 457 CO -0.04 0.42 1.16 -0.54 -0.54 0.00 0.00 174.62 175.07 1xfw s LYS 458 N -1.29 2.38 0.00 3.99 1.02 -1.06 -4.64 119.74 120.14 1xfw s LYS 458 Ca 0.43 1.58 0.02 0.00 0.02 0.00 0.00 55.97 58.01 1xfw s LYS 458 Cb -0.29 -1.88 0.10 0.00 -0.52 0.00 0.00 37.83 35.23 1xfw s LYS 458 CO 0.37 -1.61 0.42 0.39 -0.92 0.00 0.00 175.35 174.00 1xfw n GLU 459 N -2.66 0.09 -2.74 1.68 1.02 -1.26 -2.48 120.64 114.28 1xfw n GLU 459 Ca 0.12 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.17 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 -0.66 1.60 3.60 0.62 0.00 -1.26 -5.12 105.19 103.97 1xfw n GLY 460 Ca 0.01 -0.77 -0.03 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.47 0.36 0.36 1.61 2.47 -1.03 -5.05 119.74 116.98 1xfw s LYS 461 Ca 0.26 -0.15 0.03 0.00 -1.56 0.00 0.00 55.97 54.55 1xfw s LYS 461 Cb 0.41 0.15 -0.04 0.00 -1.46 0.00 0.00 37.83 36.89 1xfw s LYS 461 CO -0.03 -0.16 0.11 -1.50 0.16 0.00 0.00 175.35 173.93 1xfw s ILE 462 N -2.46 0.71 -0.11 5.43 2.07 -1.26 -4.50 121.20 121.08 1xfw s ILE 462 Ca 0.10 -2.00 -0.08 0.00 -1.41 0.00 0.00 60.65 57.26 1xfw s ILE 462 Cb 0.00 -2.52 -0.04 0.00 0.13 0.00 0.00 42.46 40.03 1xfw s ILE 462 CO -0.05 0.00 0.17 -0.89 -1.91 0.00 0.00 174.94 172.27 1xfw s THR 463 N -3.34 5.45 0.56 4.00 2.01 -0.49 -4.94 115.64 118.88 1xfw s THR 463 Ca 0.30 0.28 0.38 0.00 0.31 0.00 0.00 61.69 62.96 1xfw s THR 463 Cb 0.05 -3.44 0.56 0.00 0.01 0.00 0.00 72.50 69.68 1xfw s THR 463 CO 0.15 0.61 1.70 -0.37 -0.69 0.00 0.00 174.62 176.02 1xfw h VAL 464 N 3.98 0.26 0.00 3.82 -1.51 -1.92 1.44 116.25 122.31 1xfw h VAL 464 Ca -0.54 0.00 -0.07 0.00 -1.23 0.00 0.00 66.70 64.86 1xfw h VAL 464 Cb 1.23 0.29 -0.01 0.00 -2.13 0.00 0.00 31.29 30.66 1xfw h VAL 464 CO 0.59 0.00 -0.38 -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 0.60 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.56 1xfw h LEU 465 Cb 2.57 0.00 0.00 0.00 1.08 0.00 0.00 40.66 44.31 1xfw h LEU 465 CO -0.01 0.31 0.00 0.61 -1.08 0.00 0.00 178.44 178.27 1xfw n GLY 466 N 1.19 1.82 3.70 0.83 0.00 0.49 -5.14 105.19 108.08 1xfw n GLY 466 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.34 2.42 -0.21 1.61 2.02 -1.23 -4.86 118.70 118.12 1xfw s GLU 467 Ca 0.00 -1.40 -0.11 0.00 0.02 0.00 0.00 54.97 53.48 1xfw s GLU 467 Cb 0.00 -2.23 0.07 0.00 0.10 0.00 0.00 34.13 32.07 1xfw s GLU 467 CO 0.00 0.29 0.51 0.21 0.02 0.00 0.00 175.26 176.29 1xfw s LYS 468 N -3.76 0.50 0.19 1.61 2.20 -1.26 -1.39 119.74 117.82 1xfw s LYS 468 Ca 0.34 0.98 -0.13 0.00 -0.36 0.00 0.00 55.97 56.79 1xfw s LYS 468 Cb -0.05 0.09 0.01 0.00 -1.51 0.00 0.00 37.83 36.36 1xfw s LYS 468 CO 0.22 -0.16 0.41 -0.59 -0.36 0.00 0.00 175.35 174.86 1xfw s PHE 469 N 1.63 0.15 0.67 4.03 -0.12 -1.26 -4.95 117.98 118.13 1xfw s PHE 469 Ca -0.09 -0.51 0.01 0.00 -0.05 0.00 0.00 56.93 56.29 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 -0.84 0.92 -0.80 -0.05 0.00 0.00 175.22 174.30 1xfw s ASN 470 N -2.93 4.61 -0.32 1.98 0.01 -1.26 -0.62 114.94 116.42 1xfw s ASN 470 Ca 0.14 -0.39 -0.44 0.00 -0.71 0.00 0.00 52.86 51.45 1xfw s ASN 470 Cb 0.01 -0.10 -0.20 0.00 0.41 0.00 0.00 41.25 41.38 1xfw s ASN 470 CO -0.00 -1.66 1.44 0.79 -1.51 0.00 0.00 177.10 176.15 1xfw n TRP 471 N -2.66 1.42 -4.30 2.20 7.02 -1.24 -4.55 117.44 115.33 1xfw n TRP 471 Ca 0.14 1.08 -0.16 0.00 -1.02 0.00 0.00 57.50 57.54 1xfw n TRP 471 Cb 0.61 -2.20 -0.10 0.00 -2.42 0.00 0.00 31.31 27.19 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 2.03 1.36 -0.00 -0.99 0.52 -0.37 -4.94 118.95 116.57 1xfw s ARG 472 Ca 1.00 -1.73 -0.19 0.00 -0.52 0.00 0.00 55.73 54.29 1xfw s ARG 472 Cb -1.39 -0.26 -0.06 0.00 0.52 0.00 0.00 34.95 33.76 1xfw s ARG 472 CO 0.73 -0.27 0.55 -0.80 0.02 0.00 0.00 175.30 175.53 1xfw s ASN 473 N -3.29 6.94 -0.07 0.23 -0.87 -1.26 -1.99 114.94 114.62 1xfw s ASN 473 Ca 0.36 1.11 -0.30 0.00 -1.57 0.00 0.00 52.86 52.46 1xfw s ASN 473 Cb 0.08 -2.34 -0.04 0.00 -0.02 0.00 0.00 41.25 38.93 1xfw s ASN 473 CO 0.12 0.15 1.36 -0.63 -2.57 0.00 0.00 177.10 175.53 1xfw s ILE 474 N -0.39 3.97 -0.17 0.60 1.01 -0.76 -4.90 121.20 120.57 1xfw s ILE 474 Ca 0.29 1.27 -0.08 0.00 0.00 0.00 0.00 60.65 62.13 1xfw s ILE 474 Cb -0.18 -3.82 -0.04 0.00 0.01 0.00 0.00 42.46 38.43 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 2.93 3.88 0.38 2.79 2.02 -1.26 0.30 118.70 129.75 1xfw s GLU 475 Ca 0.61 -0.27 0.08 0.00 0.02 0.00 0.00 54.97 55.41 1xfw s GLU 475 Cb -0.27 -3.25 -0.03 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 0.02 2.80 0.38 2.63 -7.23 -0.20 -0.33 120.40 118.46 1xfw s VAL 476 Ca 0.08 -1.52 -0.10 0.00 -1.81 0.00 0.00 61.98 58.62 1xfw s VAL 476 Cb -0.12 -3.02 -0.07 0.00 0.56 0.00 0.00 36.38 33.74 1xfw s VAL 476 CO 0.00 -0.07 0.74 -0.04 -0.31 0.00 0.00 175.10 175.42 1xfw s MET 477 N -3.98 3.79 -0.23 4.82 1.00 -0.47 -1.69 119.30 122.53 1xfw s MET 477 Ca 0.43 0.44 -0.09 0.00 0.00 0.00 0.00 55.69 56.46 1xfw s MET 477 Cb -0.02 -2.43 0.09 0.00 0.00 0.00 0.00 34.83 32.48 1xfw s MET 477 CO 0.25 0.01 0.51 0.00 0.00 0.00 0.00 175.02 175.80 1xfw s ALA 478 N -2.29 -1.45 0.97 3.03 0.00 0.25 0.07 121.76 122.34 1xfw s ALA 478 Ca 0.51 1.84 -0.12 0.00 0.00 0.00 0.00 51.96 54.19 1xfw s ALA 478 Cb -0.10 -1.37 0.17 0.00 0.00 0.00 0.00 23.12 21.81 1xfw s ALA 478 CO 0.30 -0.65 0.99 0.36 0.00 0.00 0.00 175.76 176.75 1xfw n LYS 479 N 5.04 -0.91 -3.65 0.00 2.85 -0.98 -0.23 118.16 120.28 1xfw n LYS 479 Ca -0.14 -1.59 -0.38 0.00 -1.05 0.00 0.00 58.31 55.15 1xfw n LYS 479 Cb 0.52 -1.00 -0.12 0.00 -0.65 0.00 0.00 35.03 33.79 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 -4.63 5.61 -0.31 -5.58 3.04 0.38 -2.36 114.94 111.09 1xfw s ASN 480 Ca 0.56 -0.43 -0.01 0.00 0.04 0.00 0.00 52.86 53.03 1xfw s ASN 480 Cb -0.02 -2.02 0.06 0.00 -1.54 0.00 0.00 41.25 37.74 1xfw s ASN 480 CO 0.39 -0.17 0.02 -0.69 -3.04 0.00 0.00 177.10 173.61 1xfw s VAL 481 N 1.64 2.83 -1.20 -5.21 1.01 -0.83 -4.72 120.40 113.92 1xfw s VAL 481 Ca 0.05 -1.61 -0.16 0.00 0.00 0.00 0.00 61.98 60.26 1xfw s VAL 481 Cb -0.17 -2.72 -0.01 0.00 0.00 0.00 0.00 36.38 33.49 1xfw s VAL 481 CO 0.07 -0.22 0.72 -0.62 0.00 0.00 0.00 175.10 175.04 1xfw n GLU 482 N 4.55 -1.84 -2.80 2.72 -0.58 -1.26 -1.41 120.64 120.03 1xfw n GLU 482 Ca -0.10 0.45 -0.20 0.00 -0.42 0.00 0.00 57.16 56.89 1xfw n GLU 482 Cb 0.43 -4.25 0.01 0.00 -0.57 0.00 0.00 31.44 27.05 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 -1.73 -0.51 2.85 0.62 0.00 -1.26 -4.97 105.19 100.19 1xfw n GLY 483 Ca -0.15 0.06 -0.16 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.99 -0.35 -0.65 1.61 1.01 -0.50 -5.08 120.40 113.45 1xfw s VAL 484 Ca 0.18 0.09 -0.26 0.00 0.00 0.00 0.00 61.98 61.99 1xfw s VAL 484 Cb -0.09 -0.55 -0.08 0.00 0.00 0.00 0.00 36.38 35.67 1xfw s VAL 484 CO 0.22 -0.04 2.27 -0.76 0.00 0.00 0.00 175.10 176.79 1xfw s LEU 485 N 2.36 3.20 0.22 3.92 1.02 -1.26 -1.97 118.68 126.17 1xfw s LEU 485 Ca 0.05 0.46 -0.10 0.00 0.02 0.00 0.00 54.13 54.56 1xfw s LEU 485 Cb -0.14 -2.53 -0.07 0.00 0.02 0.00 0.00 46.19 43.47 1xfw s LEU 485 CO -0.10 -3.10 0.55 -0.54 0.02 0.00 0.00 176.35 173.18 1xfw s LYS 486 N 8.14 3.81 0.81 1.70 1.02 -0.99 -4.92 119.74 129.31 1xfw s LYS 486 Ca 0.88 0.28 -0.11 0.00 0.02 0.00 0.00 55.97 57.04 1xfw s LYS 486 Cb -0.14 -2.66 0.08 0.00 -0.52 0.00 0.00 37.83 34.59 1xfw s LYS 486 CO 0.17 0.33 1.09 -1.25 -0.92 0.00 0.00 175.35 174.77 1xfw s PRO 487 N -2.78 1.92 -0.08 -1.68 0.04 -1.26 -2.33 135.00 128.83 1xfw s PRO 487 Ca 0.47 1.09 0.02 0.00 0.04 0.00 0.00 61.00 62.61 1xfw s PRO 487 Cb -0.11 -1.86 -0.02 0.00 0.04 0.00 0.00 34.50 32.54 1xfw s PRO 487 CO 0.21 -1.86 -0.13 -0.51 0.04 0.00 0.00 177.00 174.75 1xfw s LEU 488 N -6.04 2.76 0.32 -3.56 1.43 0.11 -1.36 118.68 112.34 1xfw s LEU 488 Ca 0.62 -0.24 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 0.27 0.15 0.28 0.23 0.00 0.00 176.35 177.84 1xfw s THR 489 N -0.28 0.43 0.69 5.49 -1.32 -0.54 -2.57 115.64 117.54 1xfw s THR 489 Ca 0.02 -2.00 -0.17 0.00 -1.21 0.00 0.00 61.69 58.33 1xfw s THR 489 Cb -0.13 -2.51 -0.06 0.00 -1.51 0.00 0.00 72.50 68.29 1xfw s THR 489 CO 0.03 0.00 0.48 0.00 -2.21 0.00 0.00 174.62 172.92 1xfw n ALA 490 N -0.63 -1.55 -2.38 11.08 0.00 -1.26 -0.27 120.51 125.50 1xfw n ALA 490 Ca -0.00 -0.19 -0.24 0.00 0.00 0.00 0.00 53.44 53.00 1xfw n ALA 490 Cb 0.65 -1.82 -0.05 0.00 0.00 0.00 0.00 19.45 18.23 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 -1.38 4.61 -0.38 0.00 3.84 -1.26 -4.43 116.67 117.67 1xfw s ASP 491 Ca 0.65 -1.04 -0.24 0.00 -0.00 0.00 0.00 52.55 51.93 1xfw s ASP 491 Cb -0.37 -0.33 0.01 0.00 -1.38 0.00 0.00 42.92 40.85 1xfw s ASP 491 CO 0.58 -0.67 0.82 -0.31 -0.00 0.00 0.00 175.17 175.58 1xfw s TYR 492 N -2.60 3.08 -0.41 2.11 2.02 -0.35 -4.93 117.35 116.26 1xfw s TYR 492 Ca 0.41 0.53 -0.16 0.00 -0.37 0.00 0.00 57.07 57.48 1xfw s TYR 492 Cb 0.01 -3.51 0.02 0.00 -0.40 0.00 0.00 41.96 38.08 1xfw s TYR 492 CO 0.23 -0.80 0.37 -0.51 -1.57 0.00 0.00 175.55 173.27 1xfw s ASP 493 N 1.91 6.16 0.08 2.29 -0.00 -1.26 -4.48 116.67 121.37 1xfw s ASP 493 Ca 0.33 -0.73 -0.31 0.00 -0.00 0.00 0.00 52.55 51.84 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 0.18 -0.51 1.58 -0.76 -0.00 0.00 0.00 175.17 175.67 1xfw s LEU 494 N 1.94 4.36 0.34 1.23 1.43 -1.26 -1.19 118.68 125.52 1xfw s LEU 494 Ca 0.09 2.44 0.18 0.00 -1.03 0.00 0.00 54.13 55.81 1xfw s LEU 494 Cb -0.18 -3.57 0.30 0.00 0.03 0.00 0.00 46.19 42.77 1xfw s LEU 494 CO 0.12 -0.83 1.56 0.15 0.23 0.00 0.00 176.35 177.58 1xfw h PHE 495 N 7.82 0.00 0.00 0.29 3.04 0.39 0.24 116.94 128.72 1xfw h PHE 495 Ca -0.42 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.53 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 0.74 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 -3.76 2.41 0.00 -0.91 -3.73 120.51 112.31 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 0.64 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.92 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 1.44 -0.33 0.00 1.43 -1.26 -1.58 118.68 118.38 1xfw s LEU 497 Ca 0.00 -0.34 -0.02 0.00 -1.03 0.00 0.00 54.13 52.74 1xfw s LEU 497 Cb 0.00 -0.91 0.07 0.00 0.03 0.00 0.00 46.19 45.38 1xfw s LEU 497 CO 0.00 -0.05 0.06 0.00 0.23 0.00 0.00 176.35 176.59 1xfw s ALA 498 N 1.30 2.93 0.12 4.21 0.00 -0.34 -4.86 121.76 125.11 1xfw s ALA 498 Ca -0.02 -2.02 -0.05 0.00 0.00 0.00 0.00 51.96 49.87 1xfw s ALA 498 Cb -0.14 -2.09 -0.05 0.00 0.00 0.00 0.00 23.12 20.84 1xfw s ALA 498 CO -0.04 -1.45 0.36 -1.25 0.00 0.00 0.00 175.76 173.38 1xfw s PRO 499 N 1.21 3.62 0.24 0.00 0.04 -1.25 0.78 135.00 139.64 1xfw s PRO 499 Ca -0.00 -0.07 -0.31 0.00 0.04 0.00 0.00 61.00 60.65 1xfw s PRO 499 Cb -0.21 -2.89 -0.13 0.00 0.04 0.00 0.00 34.50 31.31 1xfw s PRO 499 CO -0.02 0.50 1.50 0.45 0.04 0.00 0.00 177.00 179.47 1xfw n SER 500 N 0.27 3.14 0.25 6.66 2.88 -0.42 -1.72 113.62 124.68 1xfw n SER 500 Ca -0.04 1.13 0.14 0.00 -1.33 0.00 0.00 58.87 58.77 1xfw n SER 500 Cb 0.52 -1.47 0.63 0.00 -0.75 0.00 0.00 64.21 63.14 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 4.79 0.00 0.06 2.46 6.46 -1.18 0.44 115.31 128.33 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 1.26 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 41.16 1xfw h LEU 501 CO 0.80 0.00 -1.61 0.71 -0.62 0.00 0.00 178.44 177.72 1xfw h THR 502 N 0.00 1.01 -0.38 1.05 1.35 -1.86 -3.31 112.91 110.77 1xfw h THR 502 Ca 0.07 -2.76 0.11 0.00 -0.55 0.00 0.00 66.41 63.28 1xfw h THR 502 Cb 1.13 2.60 -0.02 0.00 -1.73 0.00 0.00 68.15 70.13 1xfw h THR 502 CO -0.00 0.72 0.33 -0.08 -0.25 0.00 0.00 175.52 176.24 1xfw h GLU 503 N 0.03 0.00 -0.21 4.72 4.57 -0.45 0.20 114.58 123.44 1xfw h GLU 503 Ca -0.26 0.00 -0.19 0.00 -1.18 0.00 0.00 59.36 57.72 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 -0.64 0.82 -1.18 0.00 0.00 179.01 178.13 1xfw h ILE 504 N 0.00 1.29 -0.84 2.32 5.03 -1.63 -2.96 117.51 120.73 1xfw h ILE 504 Ca 0.18 -1.85 0.09 0.00 -0.12 0.00 0.00 64.86 63.15 1xfw h ILE 504 Cb 0.84 1.80 -0.07 0.00 -3.03 0.00 0.00 36.82 36.37 1xfw h ILE 504 CO -0.00 0.59 0.50 0.50 -0.68 0.00 0.00 178.15 179.06 1xfw h LYS 505 N 0.55 0.83 -1.55 2.37 1.63 -0.75 0.44 116.57 120.09 1xfw h LYS 505 Ca -0.01 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1xfw h LYS 505 Cb 1.24 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 32.68 1xfw h LYS 505 CO 0.13 0.55 0.00 1.63 -3.45 0.00 0.00 179.45 178.31 1xfw n LYS 506 N -4.70 0.55 0.00 1.90 5.02 -1.03 -1.36 118.16 118.54 1xfw n LYS 506 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 1xfw n LYS 506 Cb 0.25 -1.23 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 0.90 1.61 -2.83 1.97 -0.06 0.15 -5.04 117.38 114.09 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 0.27 -0.70 -0.04 0.00 -4.06 0.00 0.00 30.24 25.71 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 -1.41 4.91 -0.01 1.69 1.01 -0.46 -4.98 121.20 121.96 1xfw s ILE 508 Ca 0.00 1.83 -0.30 0.00 0.00 0.00 0.00 60.65 62.18 1xfw s ILE 508 Cb 0.00 -4.22 -0.08 0.00 0.01 0.00 0.00 42.46 38.18 1xfw s ILE 508 CO 0.00 0.15 1.92 -2.16 0.00 0.00 0.00 174.94 174.86 1xfw s PRO 509 N 1.18 4.04 0.39 2.79 0.04 -1.26 -4.82 135.00 137.37 1xfw s PRO 509 Ca 0.46 2.45 0.06 0.00 0.04 0.00 0.00 61.00 64.00 1xfw s PRO 509 Cb -0.19 -4.15 0.20 0.00 0.04 0.00 0.00 34.50 30.40 1xfw s PRO 509 CO 0.22 -1.05 0.67 1.04 0.04 0.00 0.00 177.00 177.92 1xfw n GLN 510 N 7.58 0.01 0.02 4.56 1.13 -1.26 0.00 117.38 129.43 1xfw n GLN 510 Ca 0.20 0.59 -0.22 0.00 -1.94 0.00 0.00 57.00 55.64 1xfw n GLN 510 Cb 0.42 -1.55 -0.14 0.00 0.11 0.00 0.00 30.24 29.08 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 0.28 0.59 -1.09 2.10 -1.98 -3.21 116.57 113.26 1xfw h LYS 511 Ca 0.11 -0.48 -0.03 0.00 -2.00 0.00 0.00 60.65 58.25 1xfw h LYS 511 Cb 1.42 0.18 0.01 0.00 -0.90 0.00 0.00 32.23 32.93 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 -0.77 -0.02 0.07 5.08 -0.79 0.65 114.58 118.80 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 1.99 0.17 -0.00 0.00 0.50 0.00 0.00 28.75 31.41 1xfw h GLU 512 CO 0.09 -0.50 0.12 2.35 -1.00 0.00 0.00 179.01 180.07 1xfw h TRP 513 N -0.83 0.00 0.02 4.33 7.01 -1.74 -2.25 115.95 122.48 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 0.63 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.69 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 -1.26 -3.12 116.42 118.11 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 0.24 0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.02 1xfw h ASP 514 CO -0.00 0.22 0.35 1.17 -1.57 0.00 0.00 179.24 179.41 1xfw n LYS 515 N -3.39 0.02 -0.10 3.56 4.81 0.22 -1.22 118.16 122.06 1xfw n LYS 515 Ca -0.00 0.30 -0.24 0.00 -0.87 0.00 0.00 58.31 57.50 1xfw n LYS 515 Cb 0.01 -1.91 -0.12 0.00 0.02 0.00 0.00 35.03 33.03 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 -1.43 1.57 0.16 3.15 0.31 -0.90 -4.44 118.33 116.75 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 1.18 0.00 2.52 -1.51 -1.10 -3.18 116.25 113.37 1xfw h VAL 517 Ca -0.46 -1.85 0.00 0.00 -1.23 0.00 0.00 66.70 63.15 1xfw h VAL 517 Cb 1.52 2.05 0.00 0.00 -2.13 0.00 0.00 31.29 32.73 1xfw h VAL 517 CO -0.22 0.50 0.00 0.59 -1.23 0.00 0.00 177.57 177.21 1xfw n ASN 518 N -3.67 4.24 -4.53 4.19 5.03 -0.87 -4.78 115.26 114.87 1xfw n ASN 518 Ca -0.01 -2.12 -0.30 0.00 0.87 0.00 0.00 54.58 53.02 1xfw n ASN 518 Cb 0.57 -0.89 -0.11 0.00 -1.02 0.00 0.00 39.78 38.33 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 0.35 3.18 -0.03 3.41 -1.32 -1.20 -5.02 115.64 115.01 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 -2.43 -0.06 0.00 -1.51 0.00 0.00 72.50 68.50 1xfw s THR 519 CO 0.00 0.21 0.56 1.55 -2.21 0.00 0.00 174.62 174.73 1xfw h PRO 520 N 4.01 -0.38 -5.88 7.08 0.13 -1.91 -3.45 132.00 131.59 1xfw h PRO 520 Ca -0.49 0.03 -0.68 0.00 -0.87 0.00 0.00 66.00 63.99 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 -0.25 1.43 -1.71 -0.23 0.00 0.00 178.00 177.74 1xfw n ASN 521 N -4.31 1.53 -0.16 1.44 2.85 -1.26 -4.82 115.26 110.54 1xfw n ASN 521 Ca -0.05 0.43 0.12 0.00 -0.11 0.00 0.00 54.58 54.97 1xfw n ASN 521 Cb 0.16 -1.13 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 11.64 0.47 -0.00 1.20 0.02 -1.99 0.77 113.55 125.67 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 1.08 0.27 -0.62 0.25 -1.14 0.00 0.00 176.83 176.67 1xfw h LEU 523 N 0.52 0.56 -1.11 5.07 5.85 -1.99 -3.26 115.31 120.94 1xfw h LEU 523 Ca 0.34 -0.76 -0.04 0.00 0.84 0.00 0.00 57.88 58.27 1xfw h LEU 523 Cb 0.61 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1xfw h LEU 523 CO -0.11 1.24 -0.17 -0.08 -0.34 0.00 0.00 178.44 178.97 1xfw h GLU 524 N -0.07 0.00 0.00 1.25 4.81 -1.81 -2.29 114.58 116.47 1xfw h GLU 524 Ca -0.08 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1xfw h GLU 524 Cb 1.33 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.71 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 -3.31 0.11 -0.08 1.92 0.00 0.22 -0.62 118.16 116.40 1xfw n LYS 525 Ca 0.00 0.28 -0.08 0.00 0.00 0.00 0.00 58.31 58.51 1xfw n LYS 525 Cb 0.41 -1.68 -0.03 0.00 0.00 0.00 0.00 35.03 33.73 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 -1.88 0.48 -0.25 1.64 7.27 -0.88 -3.24 117.38 120.52 1xfw n GLN 526 Ca 0.04 0.51 0.02 0.00 0.07 0.00 0.00 57.00 57.64 1xfw n GLN 526 Cb 0.25 -1.68 0.11 0.00 2.41 0.00 0.00 30.24 31.33 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 0.03 -0.39 3.69 3.64 -1.42 0.45 116.57 121.57 1xfw h LYS 527 Ca -0.07 -0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.38 1xfw h LYS 527 Cb 0.70 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.45 1xfw h LYS 527 CO -0.04 0.02 0.03 0.78 -2.27 0.00 0.00 179.45 177.96 1xfw h GLY 528 N 0.03 0.41 0.52 5.01 0.00 -1.04 -0.89 103.07 107.12 1xfw h GLY 528 Ca 0.37 0.02 -0.03 0.00 0.00 0.00 0.00 47.33 47.69 1xfw h GLY 528 CO -0.72 -0.07 -0.26 -2.08 0.00 0.00 0.00 176.54 173.41 1xfw h VAL 529 N 0.14 0.00 -0.96 4.60 2.07 -0.27 -2.00 116.25 119.82 1xfw h VAL 529 Ca 0.19 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.90 1xfw h VAL 529 Cb 0.25 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 29.85 1xfw h VAL 529 CO -0.29 0.00 -0.27 0.74 0.02 0.00 0.00 177.57 177.77 1xfw h THR 530 N -0.71 0.03 -0.72 2.57 2.02 -0.40 1.26 112.91 116.97 1xfw h THR 530 Ca -0.07 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.14 1xfw h THR 530 Cb 0.55 0.03 -0.04 0.00 -1.74 0.00 0.00 68.15 66.95 1xfw h THR 530 CO 0.11 0.00 0.47 0.78 0.37 0.00 0.00 175.52 177.26 1xfw h ASN 531 N -0.00 0.75 0.02 4.18 2.35 -1.11 0.40 115.58 122.17 1xfw h ASN 531 Ca 0.44 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 56.18 1xfw h ASN 531 Cb 0.68 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.88 1xfw h ASN 531 CO -0.99 0.52 -0.01 -0.07 -1.65 0.00 0.00 177.43 175.24 1xfw h LEU 532 N 0.88 -0.02 -0.84 1.61 3.38 0.23 0.85 115.31 121.40 1xfw h LEU 532 Ca 0.28 -0.20 0.12 0.00 0.09 0.00 0.00 57.88 58.18 1xfw h LEU 532 Cb 0.04 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 40.71 1xfw h LEU 532 CO -0.08 0.18 0.46 0.25 0.09 0.00 0.00 178.44 179.34 1xfw h LEU 533 N -0.23 0.60 0.21 1.67 6.46 -0.04 0.30 115.31 124.28 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 0.22 -0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.11 1xfw h LEU 533 CO 0.00 0.30 -0.10 0.40 -0.62 0.00 0.00 178.44 178.43 1xfw h ILE 534 N 0.71 0.86 -0.75 4.05 2.04 0.15 0.39 117.51 124.96 1xfw h ILE 534 Ca 0.43 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.54 1xfw h ILE 534 Cb 0.51 1.28 -0.04 0.00 -0.74 0.00 0.00 36.82 37.83 1xfw h ILE 534 CO -0.30 0.16 0.48 0.50 0.00 0.00 0.00 178.15 178.99 1xfw h LYS 535 N -0.69 1.00 0.00 2.37 3.11 0.13 0.32 116.57 122.80 1xfw h LYS 535 Ca -0.03 -0.07 0.00 0.00 -2.81 0.00 0.00 60.65 57.74 1xfw h LYS 535 Cb 0.48 -0.22 0.00 0.00 -1.00 0.00 0.00 32.23 31.49 1xfw h LYS 535 CO 0.05 0.67 -1.01 0.66 -2.81 0.00 0.00 179.45 177.01 1xfw n TYR 536 N -4.41 0.00 0.00 1.91 4.01 0.99 -4.65 117.16 115.01 1xfw n TYR 536 Ca 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.82 1xfw n TYR 536 Cb 0.04 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.05 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 1.49 0.00 0.13 2.72 0.00 0.14 -4.82 105.19 104.86 1xfw n GLY 537 Ca 0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 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 0.84 -2.44 -0.61 2.04 -1.23 -3.48 117.51 112.63 1xfw h ILE 538 Ca 0.00 -2.50 -0.60 0.00 1.00 0.00 0.00 64.86 62.76 1xfw h ILE 538 Cb 0.78 2.64 0.14 0.00 -0.74 0.00 0.00 36.82 39.64 1xfw h ILE 538 CO 0.00 0.85 -0.26 1.21 0.00 0.00 0.00 178.15 179.95 1xfw n GLU 539 N -3.50 0.74 -3.62 2.37 2.13 0.05 -4.96 120.64 113.86 1xfw n GLU 539 Ca -0.26 0.27 -0.26 0.00 0.66 0.00 0.00 57.16 57.57 1xfw n GLU 539 Cb 1.06 -1.61 -0.17 0.00 0.27 0.00 0.00 31.44 30.99 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 -1.65 0.08 0.35 5.31 0.52 -1.26 -4.46 118.95 117.84 1xfw s ARG 540 Ca 0.63 -0.08 0.02 0.00 -0.52 0.00 0.00 55.73 55.78 1xfw s ARG 540 Cb -0.62 -1.81 -0.02 0.00 0.52 0.00 0.00 34.95 33.02 1xfw s ARG 540 CO 0.58 -0.66 0.53 0.15 0.02 0.00 0.00 175.30 175.92 1xfw s LYS 541 N 2.13 3.35 0.00 3.54 -0.14 -1.24 -4.89 119.74 122.49 1xfw s LYS 541 Ca 0.02 -0.52 0.00 0.00 -1.36 0.00 0.00 55.97 54.11 1xfw s LYS 541 Cb -0.16 -2.70 0.00 0.00 -1.68 0.00 0.00 37.83 33.29 1xfw s LYS 541 CO -0.09 0.10 0.00 -0.35 -0.76 0.00 0.00 175.35 174.25 1xfw n PRO 542 N -1.77 0.13 -3.62 -1.68 -0.04 -1.26 -2.50 135.00 124.27 1xfw n PRO 542 Ca -0.04 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.31 1xfw n PRO 542 Cb 0.57 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.96 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 -1.00 -0.56 0.25 3.54 -1.08 -0.21 -4.73 116.67 112.89 1xfw s ASP 543 Ca 0.00 1.00 -0.03 0.00 -0.52 0.00 0.00 52.55 53.00 1xfw s ASP 543 Cb 0.00 0.99 0.41 0.00 -1.46 0.00 0.00 42.92 42.86 1xfw s ASP 543 CO 0.00 -0.24 1.84 0.77 0.52 0.00 0.00 175.17 178.05 1xfw h SER 544 N 4.19 0.82 0.00 -0.34 4.64 -1.99 -3.36 113.55 117.50 1xfw h SER 544 Ca -0.27 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 1xfw h SER 544 Cb 1.17 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1xfw h SER 544 CO 0.13 0.49 -0.97 0.35 -0.87 0.00 0.00 176.83 175.96 1xfw n THR 545 N -4.65 0.00 -0.24 2.95 -2.24 -1.26 -4.87 114.28 103.98 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 0.25 -0.64 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 -2.55 1.90 0.00 -0.78 5.02 -1.26 -4.82 118.16 115.67 1xfw n LYS 546 Ca 0.00 -1.71 0.00 0.00 -2.02 0.00 0.00 58.31 54.58 1xfw n LYS 546 Cb 0.49 -1.70 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 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 -0.33 0.60 3.10 0.72 0.00 -1.26 -1.29 105.19 106.74 1xfw n GLY 547 Ca 0.32 -0.88 -0.33 0.00 0.00 0.00 0.00 46.02 45.13 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 2.40 0.19 2.61 2.01 -1.26 -1.05 115.64 120.54 1xfw s THR 548 Ca 0.00 -1.50 -0.14 0.00 0.31 0.00 0.00 61.69 60.36 1xfw s THR 548 Cb 0.00 -2.37 0.01 0.00 0.01 0.00 0.00 72.50 70.15 1xfw s THR 548 CO 0.00 -0.00 0.43 -1.48 -0.69 0.00 0.00 174.62 172.88 1xfw s LEU 549 N 1.16 0.42 1.39 4.42 2.34 -1.04 -4.47 118.68 122.91 1xfw s LEU 549 Ca -0.07 -0.68 -0.23 0.00 0.06 0.00 0.00 54.13 53.21 1xfw s LEU 549 Cb -0.19 1.76 0.35 0.00 -0.56 0.00 0.00 46.19 47.55 1xfw s LEU 549 CO -0.04 -1.01 0.97 -0.55 -1.06 0.00 0.00 176.35 174.66 1xfw s SER 550 N -2.93 -0.73 -0.15 1.48 0.15 -1.26 -3.59 113.70 106.67 1xfw s SER 550 Ca 0.14 0.75 -0.15 0.00 0.70 0.00 0.00 55.95 57.38 1xfw s SER 550 Cb 0.01 -1.04 -0.13 0.00 -1.71 0.00 0.00 66.02 63.15 1xfw s SER 550 CO -0.00 -5.15 0.22 0.78 1.20 0.00 0.00 173.24 170.30 1xfw h ASN 551 N -3.27 0.00 -0.17 5.45 -0.26 -1.92 -3.13 115.58 112.27 1xfw h ASN 551 Ca -0.42 -0.40 -0.01 0.00 -0.56 0.00 0.00 56.30 54.91 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 0.95 0.10 4.11 -1.06 0.00 0.00 177.43 181.81 1xfw h TRP 552 N -1.00 0.26 -0.85 1.19 5.08 -1.94 0.13 115.95 118.82 1xfw h TRP 552 Ca -0.09 0.00 0.08 0.00 1.08 0.00 0.00 58.89 59.96 1xfw h TRP 552 Cb 0.72 -0.09 -0.06 0.00 -3.00 0.00 0.00 29.16 26.74 1xfw h TRP 552 CO 0.05 0.20 0.55 1.96 -1.28 0.00 0.00 178.44 179.92 1xfw h GLN 553 N 0.27 0.86 0.11 0.12 4.20 -1.93 0.72 115.11 119.45 1xfw h GLN 553 Ca 0.07 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 1xfw h GLN 553 Cb 0.03 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.62 1xfw h GLN 553 CO -0.01 0.57 -0.05 -0.22 -0.67 0.00 0.00 178.83 178.44 1xfw h LYS 554 N 0.88 -0.14 -0.82 1.46 3.64 -0.73 0.19 116.57 121.06 1xfw h LYS 554 Ca 0.38 0.01 0.17 0.00 -1.27 0.00 0.00 60.65 59.94 1xfw h LYS 554 Cb 0.32 0.03 -0.11 0.00 -0.41 0.00 0.00 32.23 32.06 1xfw h LYS 554 CO -0.15 0.31 0.34 -0.56 -2.27 0.00 0.00 179.45 177.13 1xfw h GLN 555 N -0.66 0.43 -0.34 1.90 3.07 -0.23 0.77 115.11 120.05 1xfw h GLN 555 Ca -0.01 -0.03 -0.01 0.00 0.09 0.00 0.00 58.65 58.69 1xfw h GLN 555 Cb 0.51 -0.10 -0.02 0.00 0.08 0.00 0.00 27.48 27.96 1xfw h GLN 555 CO 0.02 0.28 0.16 1.98 0.09 0.00 0.00 178.83 181.37 1xfw h MET 556 N 0.44 0.50 -0.17 0.06 4.05 0.52 -1.63 114.93 118.69 1xfw h MET 556 Ca 0.47 -0.08 0.05 0.00 -0.28 0.00 0.00 59.70 59.87 1xfw h MET 556 Cb 0.78 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.49 1xfw h MET 556 CO -0.45 0.46 0.19 1.25 0.23 0.00 0.00 176.91 178.58 1xfw h LEU 557 N 0.41 0.00 0.09 3.39 5.85 0.36 -2.23 115.31 123.19 1xfw h LEU 557 Ca 0.12 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 1xfw h LEU 557 Cb 0.13 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.16 1xfw h LEU 557 CO -0.01 0.00 -0.05 0.44 -0.34 0.00 0.00 178.44 178.48 1xfw h ASP 558 N 0.00 -0.11 -1.61 1.25 3.32 0.39 -3.24 116.42 116.43 1xfw h ASP 558 Ca 0.08 0.00 0.47 0.00 0.02 0.00 0.00 57.03 57.60 1xfw h ASP 558 Cb 0.46 0.03 -0.06 0.00 0.22 0.00 0.00 39.33 39.97 1xfw h ASP 558 CO -0.00 0.24 1.25 0.03 -1.72 0.00 0.00 179.24 179.03 1xfw h ARG 559 N -0.76 0.00 -0.02 3.56 2.47 -1.05 0.73 114.38 119.32 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 0.10 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.42 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 -0.38 3.04 3.38 -1.51 -1.96 115.31 117.92 1xfw h LEU 560 Ca 0.76 -0.56 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 1xfw h LEU 560 Cb 3.25 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 43.97 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 0.55 0.74 -0.43 2.35 0.40 -1.58 115.58 117.12 1xfw h ASN 561 Ca 0.00 -0.19 -0.03 0.00 -0.55 0.00 0.00 56.30 55.52 1xfw h ASN 561 Cb 0.59 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.81 1xfw h ASN 561 CO 0.01 0.60 -0.15 1.05 -1.65 0.00 0.00 177.43 177.28 1xfw h GLU 562 N 0.47 0.00 0.00 0.81 4.11 -1.33 -2.66 114.58 115.99 1xfw h GLU 562 Ca 0.12 0.00 -0.26 0.00 0.07 0.00 0.00 59.36 59.30 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 0.15 -1.01 0.00 0.07 0.00 0.00 179.01 178.21 1xfw h ALA 563 N 1.85 0.12 -0.16 1.06 0.00 -0.95 -2.97 119.26 118.21 1xfw h ALA 563 Ca -0.00 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.22 1xfw h ALA 563 Cb 0.56 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1xfw h ALA 563 CO 0.02 0.65 0.00 1.33 0.00 0.00 0.00 179.25 181.25 1xfw n VAL 564 N -3.89 0.50 -0.07 0.00 0.24 -0.63 -3.44 118.33 111.04 1xfw n VAL 564 Ca -0.11 -0.30 -0.09 0.00 -2.04 0.00 0.00 64.34 61.80 1xfw n VAL 564 Cb 0.87 -0.22 -0.06 0.00 -1.47 0.00 0.00 33.84 32.96 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 0.10 0.53 0.00 7.34 3.00 -1.04 -3.44 118.16 124.66 1xfw n LYS 565 Ca 0.06 0.07 0.03 0.00 -0.00 0.00 0.00 58.31 58.48 1xfw n LYS 565 Cb 0.35 -1.27 0.19 0.00 0.00 0.00 0.00 35.03 34.29 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 -0.10 5.64 0.53 -1.13 -1.90 117.16 117.35 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 -0.63 1.54 0.00 -0.72 5.66 -1.25 -5.02 114.28 113.87 1xfw n THR 567 Ca 0.05 -0.62 0.00 0.00 -3.05 0.00 0.00 64.05 60.42 1xfw n THR 567 Cb 0.02 -1.37 0.00 0.00 -1.55 0.00 0.00 70.33 67.43 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 0.32 3.82 1.09 0.00 -0.80 -5.14 105.19 106.61 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 -0.32 3.65 -0.11 1.61 5.04 -1.22 -5.00 117.35 121.01 1xfw s TYR 569 Ca 0.00 1.30 0.15 0.00 -2.44 0.00 0.00 57.07 56.08 1xfw s TYR 569 Cb 0.00 -2.55 0.25 0.00 0.35 0.00 0.00 41.96 40.01 1xfw s TYR 569 CO 0.00 0.38 1.13 0.25 -1.34 0.00 0.00 175.55 175.97 1xfw n THR 570 N 0.82 1.51 -0.24 4.34 -2.24 -1.26 -4.69 114.28 112.51 1xfw n THR 570 Ca -0.04 -1.91 0.04 0.00 -2.27 0.00 0.00 64.05 59.88 1xfw n THR 570 Cb 0.51 -0.06 0.09 0.00 -2.10 0.00 0.00 70.33 68.77 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 -1.08 3.14 2.70 3.38 0.00 -1.25 -4.95 105.19 107.13 1xfw n GLY 571 Ca 0.13 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.17 1.31 3.90 -0.02 0.00 -1.26 -4.65 105.19 104.31 1xfw n GLY 572 Ca 0.08 -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 -4.89 116.67 115.70 1xfw s ASP 573 Ca 0.00 0.73 0.00 0.00 0.18 0.00 0.00 52.55 53.46 1xfw s ASP 573 Cb 0.00 -2.15 0.00 0.00 1.07 0.00 0.00 42.92 41.84 1xfw s ASP 573 CO 0.00 -0.17 0.63 0.55 1.18 0.00 0.00 175.17 177.36 1xfw n VAL 574 N -0.82 0.36 -3.69 -1.27 3.14 -1.26 -4.54 118.33 110.25 1xfw n VAL 574 Ca -0.02 -0.60 -0.28 0.00 -2.96 0.00 0.00 64.34 60.49 1xfw n VAL 574 Cb 0.54 0.92 -0.16 0.00 -1.06 0.00 0.00 33.84 34.07 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 -0.36 0.37 -0.58 1.55 1.01 -1.26 -1.22 120.40 119.91 1xfw s VAL 575 Ca 0.00 -0.55 0.22 0.00 0.00 0.00 0.00 61.98 61.65 1xfw s VAL 575 Cb 0.00 -0.97 -0.24 0.00 0.00 0.00 0.00 36.38 35.16 1xfw s VAL 575 CO 0.00 -0.30 0.78 0.59 0.00 0.00 0.00 175.10 176.17 1xfw n ASN 576 N 5.10 0.57 -3.91 3.32 5.03 -1.26 -4.96 115.26 119.14 1xfw n ASN 576 Ca -0.08 -0.48 -0.09 0.00 0.87 0.00 0.00 54.58 54.80 1xfw n ASN 576 Cb 0.47 1.31 -0.05 0.00 -1.02 0.00 0.00 39.78 40.49 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 -3.22 0.36 1.16 3.10 -3.43 -1.26 -4.42 115.29 107.58 1xfw s HIS 577 Ca 0.01 -0.73 -0.17 0.00 -0.80 0.00 0.00 55.06 53.38 1xfw s HIS 577 Cb 0.15 0.23 0.24 0.00 -1.43 0.00 0.00 32.58 31.77 1xfw s HIS 577 CO 0.87 -1.04 0.51 0.41 -2.00 0.00 0.00 174.74 173.50 1xfw n GLY 578 N -0.40 -2.91 3.73 -1.38 0.00 -0.41 -4.76 105.19 99.06 1xfw n GLY 578 Ca -0.02 -1.11 -0.41 0.00 0.00 0.00 0.00 46.02 44.48 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 3.85 0.56 2.61 -4.23 -1.26 -4.66 115.64 110.40 1xfw s THR 579 Ca 0.48 1.46 0.01 0.00 -1.18 0.00 0.00 61.69 62.46 1xfw s THR 579 Cb -0.09 -3.94 0.01 0.00 1.34 0.00 0.00 72.50 69.82 1xfw s THR 579 CO 0.43 0.19 0.95 -0.08 -0.54 0.00 0.00 174.62 175.57 1xfw h GLU 580 N 5.87 0.00 -0.98 3.99 4.57 -0.67 0.71 114.58 128.07 1xfw h GLU 580 Ca -0.43 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.75 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 0.77 0.00 0.00 1.04 -1.18 0.00 0.00 179.01 179.64 1xfw n GLN 581 N -2.28 0.97 0.00 1.92 1.13 -1.24 -1.33 117.38 116.54 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 0.91 -1.39 0.00 0.00 0.11 0.00 0.00 30.24 29.87 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 0.11 0.07 -3.52 1.08 8.00 0.24 -3.95 116.55 118.58 1xfw n ASP 582 Ca 0.00 -0.58 -0.40 0.00 0.71 0.00 0.00 54.79 54.52 1xfw n ASP 582 Cb 0.29 0.06 -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 -0.06 5.93 -0.24 -2.24 5.15 -0.44 -4.54 115.26 118.82 1xfw n ASN 583 Ca 0.00 -2.69 -0.06 0.00 -0.60 0.00 0.00 54.58 51.23 1xfw n ASN 583 Cb 0.12 -1.56 0.08 0.00 -0.53 0.00 0.00 39.78 37.89 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 5.70 1.09 0.00 1.20 5.08 -1.89 -2.46 114.58 123.30 1xfw h GLU 584 Ca 0.69 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.80 1xfw h GLU 584 Cb 0.46 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1xfw h GLU 584 CO 1.83 0.96 0.00 0.39 -1.00 0.00 0.00 179.01 181.19 1xfw n GLU 585 N -4.24 0.00 -2.80 2.33 -0.58 -1.26 -4.26 120.64 109.82 1xfw n GLU 585 Ca 0.05 0.47 -0.29 0.00 -0.42 0.00 0.00 57.16 56.98 1xfw n GLU 585 Cb 0.25 -1.39 -0.02 0.00 -0.57 0.00 0.00 31.44 29.71 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 -1.82 3.79 -1.69 -0.32 3.01 -1.25 -3.04 117.46 116.14 1xfw n PHE 586 Ca 0.00 -3.65 -0.42 0.00 1.01 0.00 0.00 57.45 54.39 1xfw n PHE 586 Cb 0.00 -0.52 0.00 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 -0.27 1.90 -4.84 -1.08 -0.04 -0.93 -4.97 135.00 124.77 1xfw n PRO 587 Ca 0.35 0.67 -0.26 0.00 -0.04 0.00 0.00 63.50 64.23 1xfw n PRO 587 Cb 0.42 -2.30 -0.16 0.00 -0.04 0.00 0.00 33.50 31.41 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 -2.06 1.62 -0.76 0.54 0.41 -1.26 -4.98 118.70 112.20 1xfw s GLU 588 Ca 0.59 -0.62 -0.18 0.00 -0.41 0.00 0.00 54.97 54.35 1xfw s GLU 588 Cb -0.54 -1.47 0.13 0.00 -1.78 0.00 0.00 34.13 30.47 1xfw s GLU 588 CO 0.59 0.31 0.89 0.21 -0.49 0.00 0.00 175.26 176.77 1xfw s LYS 589 N -0.18 3.36 -0.03 1.61 2.20 -1.26 -5.04 119.74 120.40 1xfw s LYS 589 Ca 0.01 -1.66 -0.20 0.00 -0.36 0.00 0.00 55.97 53.77 1xfw s LYS 589 Cb -0.09 -4.52 -0.05 0.00 -1.51 0.00 0.00 37.83 31.65 1xfw s LYS 589 CO 0.01 -1.60 0.56 -0.51 -0.36 0.00 0.00 175.35 173.45 1xfw s ASP 590 N 3.34 6.91 0.00 1.43 1.01 -1.26 -5.01 116.67 123.09 1xfw s ASP 590 Ca 0.21 1.08 0.00 0.00 0.71 0.00 0.00 52.55 54.55 1xfw s ASP 590 Cb -0.14 -2.34 0.00 0.00 1.01 0.00 0.00 42.92 41.45 1xfw s ASP 590 CO -0.02 0.10 0.28 0.59 0.21 0.00 0.00 175.17 176.33 1xfw n ASN 591 N 2.85 0.00 -4.76 0.27 3.02 -1.26 -4.62 115.26 110.76 1xfw n ASN 591 Ca -0.07 0.38 -0.41 0.00 -0.03 0.00 0.00 54.58 54.45 1xfw n ASN 591 Cb 0.51 -0.17 -0.03 0.00 -0.61 0.00 0.00 39.78 39.49 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 4.40 -0.08 3.52 2.02 -1.26 -3.93 118.70 122.46 1xfw s GLU 592 Ca 0.00 2.13 -0.03 0.00 0.02 0.00 0.00 54.97 57.09 1xfw s GLU 592 Cb 0.00 -3.12 0.04 0.00 0.10 0.00 0.00 34.13 31.15 1xfw s GLU 592 CO 0.00 -0.16 0.07 0.42 0.02 0.00 0.00 175.26 175.60 1xfw s ILE 593 N -0.77 -0.08 0.17 -1.63 -1.09 -1.25 -4.41 121.20 112.14 1xfw s ILE 593 Ca 0.51 0.23 -0.30 0.00 -2.23 0.00 0.00 60.65 58.85 1xfw s ILE 593 Cb -0.38 -0.30 -0.07 0.00 -1.58 0.00 0.00 42.46 40.12 1xfw s ILE 593 CO 0.47 0.04 1.12 0.12 -1.23 0.00 0.00 174.94 175.46 1xfw s PHE 594 N 2.15 3.56 0.27 3.97 5.36 -1.15 -1.25 117.98 130.90 1xfw s PHE 594 Ca 0.04 1.55 0.05 0.00 -0.96 0.00 0.00 56.93 57.61 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 -0.01 0.42 -1.46 0.00 0.00 175.22 173.38 1xfw s ILE 595 N -0.10 1.32 -0.38 3.12 1.01 0.28 -0.98 121.20 125.46 1xfw s ILE 595 Ca 0.51 -2.06 0.03 0.00 0.00 0.00 0.00 60.65 59.12 1xfw s ILE 595 Cb -0.30 -2.50 0.16 0.00 0.01 0.00 0.00 42.46 39.83 1xfw s ILE 595 CO 0.35 -0.23 0.36 -0.63 0.00 0.00 0.00 174.94 174.78 1xfw s ILE 596 N -3.22 -0.18 0.84 2.92 1.01 -0.61 -1.95 121.20 120.00 1xfw s ILE 596 Ca 0.31 -1.39 -0.14 0.00 0.00 0.00 0.00 60.65 59.42 1xfw s ILE 596 Cb 0.06 -0.80 0.01 0.00 0.01 0.00 0.00 42.46 41.74 1xfw s ILE 596 CO 0.12 -0.73 0.57 -0.46 0.00 0.00 0.00 174.94 174.44 1xfw n ASN 597 N 3.89 -1.27 -0.46 3.58 0.23 -1.16 -3.29 115.26 116.78 1xfw n ASN 597 Ca 0.15 0.47 0.00 0.00 -0.53 0.00 0.00 54.58 54.67 1xfw n ASN 597 Cb 0.45 -1.26 0.00 0.00 -2.08 0.00 0.00 39.78 36.89 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 -1.54 0.00 0.00 -0.53 -0.04 -1.26 -1.98 135.00 129.65 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 -0.95 0.00 0.00 -0.04 0.00 0.00 33.50 33.03 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 0.38 0.54 0.00 0.54 1.02 -1.26 -3.88 120.64 117.97 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 1.12 3.63 0.62 0.00 -0.84 -4.87 105.19 108.16 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 3.96 -0.24 1.61 2.02 -1.26 -4.99 118.70 119.80 1xfw s GLU 601 Ca 0.00 -0.35 -0.21 0.00 0.02 0.00 0.00 54.97 54.43 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 0.26 0.67 -0.06 0.02 0.00 0.00 175.26 176.15 1xfw s PHE 602 N 0.40 3.31 -0.11 1.61 2.99 -1.26 -3.01 117.98 121.91 1xfw s PHE 602 Ca 0.03 0.91 0.01 0.00 0.00 0.00 0.00 56.93 57.88 1xfw s PHE 602 Cb -0.12 -2.87 0.02 0.00 0.00 0.00 0.00 43.02 40.04 1xfw s PHE 602 CO 0.00 -0.30 -0.14 0.42 -0.00 0.00 0.00 175.22 175.20 1xfw s ILE 603 N 2.41 1.42 -0.30 0.64 1.01 -0.82 -2.13 121.20 123.43 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 -1.32 0.04 0.00 0.01 0.00 0.00 42.46 41.04 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 1.09 3.88 0.00 2.97 2.96 -1.16 1.00 118.68 129.43 1xfw s LEU 604 Ca -0.05 -1.12 -0.13 0.00 -0.22 0.00 0.00 54.13 52.61 1xfw s LEU 604 Cb -0.14 -1.76 0.20 0.00 0.50 0.00 0.00 46.19 44.98 1xfw s LEU 604 CO -0.03 -0.25 0.59 0.35 -1.32 0.00 0.00 176.35 175.70 1xfw n THR 605 N 4.70 0.00 0.00 3.68 -2.24 -0.38 -3.48 114.28 116.56 1xfw n THR 605 Ca -0.14 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1xfw n THR 605 Cb 0.45 -0.94 0.00 0.00 -2.10 0.00 0.00 70.33 67.74 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 -3.74 1.58 -4.38 -0.78 5.02 -1.26 -3.78 118.16 110.81 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 0.35 -0.14 -0.10 0.00 -0.02 0.00 0.00 35.03 35.11 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 -0.17 1.85 0.19 4.39 0.01 -1.25 -4.30 114.94 115.66 1xfw s ASN 607 Ca 0.00 -1.34 0.10 0.00 -0.71 0.00 0.00 52.86 50.91 1xfw s ASN 607 Cb 0.00 0.02 -0.08 0.00 0.41 0.00 0.00 41.25 41.60 1xfw s ASN 607 CO 0.00 -0.62 1.35 -0.25 -1.51 0.00 0.00 177.10 176.07 1xfw h TRP 608 N 2.29 0.00 0.11 2.20 2.91 -1.82 -1.70 115.95 119.94 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 0.54 0.80 -0.05 0.93 -1.03 0.00 0.00 178.44 179.62 1xfw h GLU 609 N 0.00 -0.14 -0.78 2.65 3.07 -1.94 -1.67 114.58 115.77 1xfw h GLU 609 Ca -0.01 0.01 0.17 0.00 -0.50 0.00 0.00 59.36 59.03 1xfw h GLU 609 Cb 1.60 0.03 -0.14 0.00 -0.84 0.00 0.00 28.75 29.40 1xfw h GLU 609 CO 0.10 -0.09 -0.08 1.98 -1.40 0.00 0.00 179.01 179.52 1xfw h MET 610 N -0.96 0.05 -0.42 2.33 4.05 -1.94 1.78 114.93 119.82 1xfw h MET 610 Ca -0.01 -0.00 0.06 0.00 -0.28 0.00 0.00 59.70 59.46 1xfw h MET 610 Cb 0.11 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 30.85 1xfw h MET 610 CO 0.02 0.03 0.13 1.15 0.23 0.00 0.00 176.91 178.48 1xfw h THR 611 N 0.05 0.85 0.00 -0.77 2.02 -1.38 2.00 112.91 115.67 1xfw h THR 611 Ca 0.41 -0.10 -0.03 0.00 0.77 0.00 0.00 66.41 67.46 1xfw h THR 611 Cb 0.70 0.54 -0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1xfw h THR 611 CO -0.74 0.05 -0.16 1.23 0.37 0.00 0.00 175.52 176.27 1xfw h GLY 612 N 0.29 0.00 1.29 2.16 0.00 0.15 -2.42 103.07 104.54 1xfw h GLY 612 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.20 1xfw h GLY 612 CO -0.21 0.00 -1.47 -0.09 0.00 0.00 0.00 176.54 174.77 1xfw h ARG 613 N 0.00 0.50 0.00 4.80 2.43 0.56 -2.96 114.38 119.71 1xfw h ARG 613 Ca -0.00 -0.85 -0.06 0.00 -0.81 0.00 0.00 59.98 58.27 1xfw h ARG 613 Cb 0.62 0.32 -0.01 0.00 -0.42 0.00 0.00 29.97 30.48 1xfw h ARG 613 CO 0.02 1.40 -0.27 0.35 -1.51 0.00 0.00 179.97 179.97 1xfw h PHE 614 N 0.14 0.00 0.13 2.20 3.57 0.32 -2.52 116.94 120.77 1xfw h PHE 614 Ca -0.25 0.00 -0.28 0.00 3.53 0.00 0.00 57.97 60.97 1xfw h PHE 614 Cb 2.14 0.00 0.01 0.00 2.79 0.00 0.00 35.95 40.90 1xfw h PHE 614 CO 0.12 0.27 -1.23 0.82 -2.23 0.00 0.00 178.31 176.05 1xfw h ILE 615 N 0.00 1.42 -0.19 1.41 2.04 -1.49 -2.33 117.51 118.38 1xfw h ILE 615 Ca -0.00 -2.82 -0.01 0.00 1.00 0.00 0.00 64.86 63.03 1xfw h ILE 615 Cb 0.84 2.84 -0.01 0.00 -0.74 0.00 0.00 36.82 39.75 1xfw h ILE 615 CO 0.03 0.83 0.06 -0.33 0.00 0.00 0.00 178.15 178.75 1xfw h GLU 616 N 0.14 0.29 -0.04 2.37 5.08 -1.37 0.77 114.58 121.83 1xfw h GLU 616 Ca -0.15 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.13 1xfw h GLU 616 Cb 1.93 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 31.14 1xfw h GLU 616 CO 0.21 0.39 -0.05 -0.22 -1.00 0.00 0.00 179.01 178.34 1xfw h LYS 617 N 0.14 0.11 0.00 2.33 3.64 -1.55 -1.05 116.57 120.18 1xfw h LYS 617 Ca 0.06 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 59.26 1xfw h LYS 617 Cb 0.22 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 1xfw h LYS 617 CO -0.00 0.59 -2.10 0.09 -2.27 0.00 0.00 179.45 175.76 1xfw n ASN 618 N -4.75 0.02 0.00 4.20 4.13 -0.87 -4.53 115.26 113.46 1xfw n ASN 618 Ca -0.08 0.01 0.00 0.00 1.68 0.00 0.00 54.58 56.19 1xfw n ASN 618 Cb 0.30 1.64 0.00 0.00 -1.54 0.00 0.00 39.78 40.18 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 -2.43 0.00 0.00 2.41 5.41 0.03 -4.45 119.36 120.33 1xfw n ILE 619 Ca -0.13 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.62 1xfw n ILE 619 Cb 0.76 -0.86 0.00 0.00 -0.71 0.00 0.00 39.64 38.83 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 -1.35 0.00 -0.39 1.39 -1.04 0.25 -0.95 114.28 112.18 1xfw n THR 620 Ca 0.00 0.72 -0.00 0.00 -2.04 0.00 0.00 64.05 62.72 1xfw n THR 620 Cb 0.00 -1.06 -0.00 0.00 -1.82 0.00 0.00 70.33 67.45 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 -0.86 2.03 0.27 3.41 0.00 -0.40 -3.40 105.19 106.24 1xfw n GLY 621 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1xfw n GLY 621 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1xfw n LYS 622 N 1.64 0.00 -1.78 1.61 3.00 -0.13 -4.87 118.16 117.64 1xfw n LYS 622 Ca 0.01 -0.67 0.00 0.00 -0.00 0.00 0.00 58.31 57.65 1xfw n LYS 622 Cb 0.39 -0.43 0.00 0.00 0.00 0.00 0.00 35.03 34.98 1xfw n LYS 622 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1xfw n ASP 623 N 0.00 -0.90 -4.36 3.14 8.00 -1.22 -4.98 116.55 116.23 1xfw n ASP 623 Ca 0.00 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.17 1xfw n ASP 623 Cb 0.59 -0.45 -0.15 0.00 -0.02 0.00 0.00 41.12 41.10 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 -2.00 2.75 -0.36 1.24 1.51 -1.20 -0.61 117.35 118.67 1xfw s TYR 624 Ca 0.00 -0.62 -0.29 0.00 -1.01 0.00 0.00 57.07 55.15 1xfw s TYR 624 Cb 0.00 -1.79 -0.00 0.00 -0.11 0.00 0.00 41.96 40.06 1xfw s TYR 624 CO 0.00 -0.18 1.55 -1.17 -1.11 0.00 0.00 175.55 174.64 1xfw s LEU 625 N 0.17 3.60 0.12 -1.29 2.96 -0.70 -4.41 118.68 119.13 1xfw s LEU 625 Ca -0.08 1.07 0.07 0.00 -0.22 0.00 0.00 54.13 54.96 1xfw s LEU 625 Cb -0.15 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 1xfw s LEU 625 CO 0.05 -1.48 -0.16 -0.47 -1.32 0.00 0.00 176.35 172.97 1xfw s TYR 626 N 5.80 1.52 -0.08 5.38 5.04 -1.26 -3.83 117.35 129.92 1xfw s TYR 626 Ca 0.68 -0.50 -0.05 0.00 -2.44 0.00 0.00 57.07 54.76 1xfw s TYR 626 Cb -0.18 -0.80 0.04 0.00 0.35 0.00 0.00 41.96 41.37 1xfw s TYR 626 CO 0.32 0.18 0.19 1.52 -1.34 0.00 0.00 175.55 176.42 1xfw s TYR 627 N -1.84 -0.23 0.09 4.97 -0.85 -1.26 -5.05 117.35 113.17 1xfw s TYR 627 Ca 0.08 0.59 -0.03 0.00 -0.52 0.00 0.00 57.07 57.20 1xfw s TYR 627 Cb -0.07 0.01 -0.05 0.00 0.38 0.00 0.00 41.96 42.23 1xfw s TYR 627 CO 0.04 -0.17 0.28 -0.59 -1.52 0.00 0.00 175.55 173.59 1xfw s PHE 628 N 0.90 3.51 -0.44 -3.49 -0.12 -1.26 -4.98 117.98 112.10 1xfw s PHE 628 Ca -0.07 0.41 -0.41 0.00 -0.05 0.00 0.00 56.93 56.82 1xfw s PHE 628 Cb -0.08 -1.89 -0.17 0.00 -0.63 0.00 0.00 43.02 40.25 1xfw s PHE 628 CO -0.05 0.53 1.40 -1.71 -0.05 0.00 0.00 175.22 175.34 1xfw n ASN 629 N 0.30 1.05 -0.18 1.98 4.05 -1.25 -4.81 115.26 116.39 1xfw n ASN 629 Ca -0.05 1.03 0.28 0.00 0.45 0.00 0.00 54.58 56.29 1xfw n ASN 629 Cb 0.51 -0.77 0.71 0.00 1.23 0.00 0.00 39.78 41.46 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 4.42 0.03 -0.56 1.20 2.47 -1.95 0.22 114.38 120.20 1xfw h ARG 630 Ca -0.38 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.34 1xfw h ARG 630 Cb 1.19 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.51 1xfw h ARG 630 CO 0.86 0.02 0.00 0.43 0.56 0.00 0.00 179.97 181.84 1xfw n SER 631 N -4.29 3.00 -4.73 7.04 7.64 -1.26 -4.83 113.62 116.19 1xfw n SER 631 Ca 0.18 -2.21 -0.41 0.00 1.01 0.00 0.00 58.87 57.45 1xfw n SER 631 Cb 0.93 -0.42 -0.05 0.00 -1.01 0.00 0.00 64.21 63.67 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 -1.64 3.82 0.00 1.43 4.12 0.75 -2.93 117.35 122.91 1xfw s TYR 632 Ca 0.32 1.80 0.00 0.00 0.02 0.00 0.00 57.07 59.21 1xfw s TYR 632 Cb 0.20 -3.07 0.00 0.00 -1.52 0.00 0.00 41.96 37.57 1xfw s TYR 632 CO 0.17 0.16 0.00 0.09 0.02 0.00 0.00 175.55 176.00 1xfw n ASN 633 N 2.58 0.00 -4.78 2.29 3.02 0.98 -4.88 115.26 114.46 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 0.49 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.59 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 2.21 -0.23 3.52 1.02 -1.15 -4.95 119.74 119.94 1xfw s LYS 634 Ca 0.00 -2.35 -0.13 0.00 0.02 0.00 0.00 55.97 53.50 1xfw s LYS 634 Cb 0.00 -1.61 -0.04 0.00 -0.52 0.00 0.00 37.83 35.66 1xfw s LYS 634 CO 0.00 -0.40 0.28 0.42 -0.92 0.00 0.00 175.35 174.73 1xfw s ILE 635 N -2.87 5.27 -0.31 2.17 1.09 -1.26 -4.12 121.20 121.18 1xfw s ILE 635 Ca 0.09 0.43 -0.29 0.00 -1.10 0.00 0.00 60.65 59.78 1xfw s ILE 635 Cb 0.01 -3.61 0.01 0.00 -1.06 0.00 0.00 42.46 37.81 1xfw s ILE 635 CO 0.05 0.28 1.10 0.00 -0.10 0.00 0.00 174.94 176.27 1xfw s ALA 636 N 1.32 3.50 0.04 9.38 0.00 0.13 -4.79 121.76 131.34 1xfw s ALA 636 Ca 0.13 -0.01 -0.08 0.00 0.00 0.00 0.00 51.96 52.00 1xfw s ALA 636 Cb -0.14 -3.67 -0.02 0.00 0.00 0.00 0.00 23.12 19.29 1xfw s ALA 636 CO 0.07 -1.47 0.74 -2.30 0.00 0.00 0.00 175.76 172.80 1xfw n PRO 637 N 6.86 -0.11 0.00 0.00 -0.02 -1.26 0.21 135.00 140.69 1xfw n PRO 637 Ca 0.12 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 1xfw n PRO 637 Cb 0.47 -1.09 0.00 0.00 -0.02 0.00 0.00 33.50 32.86 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 -1.06 -2.97 0.58 -1.23 0.00 -1.17 -2.73 105.19 96.61 1xfw n GLY 638 Ca 0.00 0.35 0.07 0.00 0.00 0.00 0.00 46.02 46.45 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 -2.06 1.71 -4.10 1.61 2.04 -1.20 -4.94 115.26 108.32 1xfw n ASN 639 Ca 0.00 -1.88 -0.39 0.00 -0.44 0.00 0.00 54.58 51.88 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 0.39 -0.84 -4.39 -3.83 5.02 0.56 -4.94 118.16 110.14 1xfw n LYS 640 Ca 0.13 0.15 -0.30 0.00 -2.02 0.00 0.00 58.31 56.27 1xfw n LYS 640 Cb 0.30 -3.18 -0.11 0.00 -0.02 0.00 0.00 35.03 32.01 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 -3.82 2.70 -0.30 7.82 0.00 -1.10 -4.72 121.76 122.35 1xfw s ALA 641 Ca 0.30 -1.29 -0.04 0.00 0.00 0.00 0.00 51.96 50.93 1xfw s ALA 641 Cb -0.16 -0.71 0.04 0.00 0.00 0.00 0.00 23.12 22.29 1xfw s ALA 641 CO 0.96 0.59 0.02 -0.47 0.00 0.00 0.00 175.76 176.87 1xfw s TYR 642 N -1.09 3.20 -0.21 0.00 5.04 -1.26 0.18 117.35 123.21 1xfw s TYR 642 Ca 0.17 -1.56 0.01 0.00 -2.44 0.00 0.00 57.07 53.26 1xfw s TYR 642 Cb -0.11 -2.15 0.03 0.00 0.35 0.00 0.00 41.96 40.08 1xfw s TYR 642 CO 0.09 -0.73 -0.17 0.42 -1.34 0.00 0.00 175.55 173.82 1xfw s ILE 643 N 1.34 2.13 0.31 3.14 1.01 -1.26 -4.97 121.20 122.91 1xfw s ILE 643 Ca -0.02 -1.15 -0.27 0.00 0.00 0.00 0.00 60.65 59.20 1xfw s ILE 643 Cb -0.19 -2.01 -0.09 0.00 0.01 0.00 0.00 42.46 40.18 1xfw s ILE 643 CO -0.00 0.36 1.03 -1.61 0.00 0.00 0.00 174.94 174.72 1xfw s GLU 644 N 1.23 4.53 -0.29 2.79 2.02 -1.26 -0.02 118.70 127.71 1xfw s GLU 644 Ca 0.01 1.60 0.00 0.00 0.02 0.00 0.00 54.97 56.60 1xfw s GLU 644 Cb -0.15 -2.96 0.18 0.00 0.10 0.00 0.00 34.13 31.30 1xfw s GLU 644 CO -0.10 0.17 0.56 -0.46 0.02 0.00 0.00 175.26 175.45 1xfw s TRP 645 N -1.37 -1.51 -0.59 1.61 -0.11 -1.26 -4.88 118.94 110.82 1xfw s TRP 645 Ca 0.48 1.42 -0.20 0.00 1.22 0.00 0.00 56.10 59.01 1xfw s TRP 645 Cb -0.26 0.41 -0.14 0.00 -1.50 0.00 0.00 33.47 31.98 1xfw s TRP 645 CO 0.33 -0.90 1.66 0.25 -4.62 0.00 0.00 176.95 173.67 1xfw n THR 646 N 5.42 0.00 -3.64 5.86 -2.24 -1.26 -4.89 114.28 113.52 1xfw n THR 646 Ca -0.00 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.38 1xfw n THR 646 Cb 0.51 -0.31 -0.11 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 5.43 5.60 0.34 3.42 3.68 -1.26 -4.97 116.67 128.91 1xfw s ASP 647 Ca 0.84 -0.83 0.02 0.00 2.13 0.00 0.00 52.55 54.71 1xfw s ASP 647 Cb -0.81 -1.99 0.61 0.00 -1.45 0.00 0.00 42.92 39.28 1xfw s ASP 647 CO 0.32 -0.31 2.00 -0.65 0.13 0.00 0.00 175.17 176.66 1xfw h PRO 648 N 8.38 0.87 -0.20 4.34 0.11 -1.99 -2.28 132.00 141.23 1xfw h PRO 648 Ca -0.28 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 65.82 1xfw h PRO 648 Cb 1.12 -0.20 -0.04 0.00 0.11 0.00 0.00 31.00 31.99 1xfw h PRO 648 CO 0.64 0.58 -0.06 0.82 -0.21 0.00 0.00 178.00 179.77 1xfw h ILE 649 N 0.90 0.78 -0.35 4.15 2.04 -1.99 0.26 117.51 123.29 1xfw h ILE 649 Ca 0.26 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.18 1xfw h ILE 649 Cb -0.06 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 36.78 1xfw h ILE 649 CO -0.06 0.00 0.24 0.74 0.00 0.00 0.00 178.15 179.07 1xfw h THR 650 N -0.01 0.93 -0.23 -0.27 2.02 -1.88 -1.96 112.91 111.51 1xfw h THR 650 Ca 0.10 -0.07 0.06 0.00 0.77 0.00 0.00 66.41 67.27 1xfw h THR 650 Cb 0.16 0.71 -0.07 0.00 -1.74 0.00 0.00 68.15 67.21 1xfw h THR 650 CO -0.22 0.04 -0.36 0.50 0.37 0.00 0.00 175.52 175.85 1xfw h LYS 651 N 0.21 -0.37 -0.02 6.66 1.63 0.05 -1.25 116.57 123.49 1xfw h LYS 651 Ca 0.16 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.98 1xfw h LYS 651 Cb 0.35 0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.07 1xfw h LYS 651 CO -0.03 -0.24 0.00 0.00 -3.45 0.00 0.00 179.45 175.73 1xfw n ALA 652 N -2.93 2.57 -0.13 5.00 0.00 -0.76 -3.93 120.51 120.32 1xfw n ALA 652 Ca -0.02 -0.11 -0.13 0.00 0.00 0.00 0.00 53.44 53.18 1xfw n ALA 652 Cb 0.34 -1.19 -0.02 0.00 0.00 0.00 0.00 19.45 18.59 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 0.15 0.96 -1.07 0.00 3.64 -0.94 -3.12 116.57 116.19 1xfw h LYS 653 Ca 0.00 -0.48 0.29 0.00 -1.27 0.00 0.00 60.65 59.19 1xfw h LYS 653 Cb 0.03 0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 31.78 1xfw h LYS 653 CO 0.00 1.15 0.72 0.82 -2.27 0.00 0.00 179.45 179.87 1xfw h ILE 654 N 0.79 0.49 -0.77 2.00 2.04 -1.73 -0.82 117.51 119.51 1xfw h ILE 654 Ca 0.07 -0.09 -0.52 0.00 1.00 0.00 0.00 64.86 65.33 1xfw h ILE 654 Cb 0.94 0.22 -0.31 0.00 -0.74 0.00 0.00 36.82 36.93 1xfw h ILE 654 CO 0.09 0.05 0.02 0.59 0.00 0.00 0.00 178.15 178.89 1xfw n ASN 655 N -4.48 5.36 -3.95 1.72 5.03 -1.18 -4.43 115.26 113.33 1xfw n ASN 655 Ca 0.25 -3.77 -0.24 0.00 0.87 0.00 0.00 54.58 51.69 1xfw n ASN 655 Cb 1.00 -0.66 -0.17 0.00 -1.02 0.00 0.00 39.78 38.93 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 -4.34 0.94 0.19 3.41 2.01 -0.32 -3.98 115.64 113.55 1xfw s THR 656 Ca 0.55 -0.32 -0.31 0.00 0.31 0.00 0.00 61.69 61.92 1xfw s THR 656 Cb 0.45 -0.91 -0.09 0.00 0.01 0.00 0.00 72.50 71.96 1xfw s THR 656 CO 0.02 0.32 1.42 -0.51 -0.69 0.00 0.00 174.62 175.18 1xfw s ILE 657 N 1.05 2.95 1.10 1.82 2.07 -1.26 -4.67 121.20 124.25 1xfw s ILE 657 Ca -0.08 0.74 -0.12 0.00 -1.41 0.00 0.00 60.65 59.78 1xfw s ILE 657 Cb -0.14 -3.47 0.25 0.00 0.13 0.00 0.00 42.46 39.22 1xfw s ILE 657 CO -0.01 0.09 1.05 -2.16 -1.91 0.00 0.00 174.94 172.01 1xfw s PRO 658 N 0.31 -0.43 0.13 3.50 0.04 -1.26 -5.03 135.00 132.25 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 -0.40 -1.61 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 1xfw s PRO 658 CO 0.37 -3.40 0.24 0.95 0.04 0.00 0.00 177.00 175.19 1xfw s THR 659 N -2.58 5.19 0.18 1.26 -4.23 -1.26 -4.83 115.64 109.37 1xfw s THR 659 Ca 0.68 -0.67 -0.26 0.00 -1.18 0.00 0.00 61.69 60.25 1xfw s THR 659 Cb -0.23 -3.63 0.04 0.00 1.34 0.00 0.00 72.50 70.02 1xfw s THR 659 CO 0.62 -0.03 1.56 -1.28 -0.54 0.00 0.00 174.62 174.95 1xfw h SER 660 N 2.46 -1.70 0.53 3.99 0.87 -1.84 0.37 113.55 118.23 1xfw h SER 660 Ca -0.47 0.28 -0.08 0.00 -1.23 0.00 0.00 61.79 60.29 1xfw h SER 660 Cb 1.19 0.78 -0.01 0.00 -0.44 0.00 0.00 62.40 63.91 1xfw h SER 660 CO 0.70 -0.30 -0.36 0.00 -0.53 0.00 0.00 176.83 176.33 1xfw h ALA 661 N 0.69 1.21 -0.21 6.23 0.00 -1.95 0.14 119.26 125.38 1xfw h ALA 661 Ca 0.20 -0.33 -0.11 0.00 0.00 0.00 0.00 54.91 54.66 1xfw h ALA 661 Cb 0.53 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1xfw h ALA 661 CO -0.81 0.45 -0.36 1.49 0.00 0.00 0.00 179.25 180.03 1xfw h GLU 662 N 0.00 0.46 0.37 0.00 4.81 -1.17 -2.05 114.58 116.99 1xfw h GLU 662 Ca -0.00 -0.21 -0.02 0.00 -0.13 0.00 0.00 59.36 59.00 1xfw h GLU 662 Cb 0.73 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.10 1xfw h GLU 662 CO 0.05 0.75 -0.18 0.35 -0.73 0.00 0.00 179.01 179.25 1xfw h PHE 663 N 0.39 -0.46 -0.60 0.92 3.57 0.38 -2.55 116.94 118.58 1xfw h PHE 663 Ca 0.04 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.63 1xfw h PHE 663 Cb 0.81 0.15 -0.11 0.00 2.79 0.00 0.00 35.95 39.59 1xfw h PHE 663 CO 0.03 -0.29 -0.36 0.82 -2.23 0.00 0.00 178.31 176.28 1xfw h ILE 664 N -0.96 0.15 -0.57 1.41 2.04 -0.81 -1.58 117.51 117.18 1xfw h ILE 664 Ca -0.05 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.86 1xfw h ILE 664 Cb 0.38 0.15 -0.07 0.00 -0.74 0.00 0.00 36.82 36.53 1xfw h ILE 664 CO 0.08 0.00 -0.40 0.11 0.00 0.00 0.00 178.15 177.94 1xfw h LYS 665 N -0.17 -0.08 -1.00 2.37 6.56 -1.42 0.18 116.57 123.01 1xfw h LYS 665 Ca 0.22 0.01 0.23 0.00 -1.06 0.00 0.00 60.65 60.05 1xfw h LYS 665 Cb 0.56 0.02 -0.10 0.00 -0.57 0.00 0.00 32.23 32.14 1xfw h LYS 665 CO -0.69 -0.05 0.63 -0.91 -2.06 0.00 0.00 179.45 176.37 1xfw h ASN 666 N -0.08 0.56 0.66 0.86 -0.26 -0.87 0.17 115.58 116.62 1xfw h ASN 666 Ca 0.09 0.09 -0.03 0.00 -0.56 0.00 0.00 56.30 55.89 1xfw h ASN 666 Cb 0.32 -0.01 0.01 0.00 -1.06 0.00 0.00 38.32 37.58 1xfw h ASN 666 CO -0.58 0.16 -0.32 -0.07 -1.06 0.00 0.00 177.43 175.56 1xfw h LEU 667 N 0.52 -0.75 -1.65 1.61 3.38 -0.27 -2.27 115.31 115.89 1xfw h LEU 667 Ca 0.57 -0.01 0.31 0.00 0.09 0.00 0.00 57.88 58.84 1xfw h LEU 667 Cb 1.24 0.19 -0.04 0.00 0.09 0.00 0.00 40.66 42.14 1xfw h LEU 667 CO -0.32 -0.41 0.97 -1.28 0.09 0.00 0.00 178.44 177.49 1xfw h SER 668 N -1.09 0.00 0.04 -0.43 0.87 0.19 -1.88 113.55 111.25 1xfw h SER 668 Ca -0.09 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.47 1xfw h SER 668 Cb 0.72 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 1xfw h SER 668 CO 0.15 0.00 -0.02 -1.28 -0.53 0.00 0.00 176.83 175.15 1xfw h SER 669 N 0.00 -0.04 -1.13 6.23 0.87 -0.33 -3.29 113.55 115.86 1xfw h SER 669 Ca 0.50 0.00 0.33 0.00 -1.23 0.00 0.00 61.79 61.39 1xfw h SER 669 Cb 2.44 0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 64.37 1xfw h SER 669 CO -0.01 0.05 1.06 0.40 -0.53 0.00 0.00 176.83 177.81 1xfw h ILE 670 N -0.22 0.13 0.51 2.23 2.04 -0.89 0.42 117.51 121.73 1xfw h ILE 670 Ca -0.01 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 1xfw h ILE 670 Cb 0.04 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.31 1xfw h ILE 670 CO 0.01 0.00 -0.28 -0.09 0.00 0.00 0.00 178.15 177.79 1xfw h ARG 671 N 0.00 -0.70 0.00 2.37 2.43 -1.48 0.89 114.38 117.89 1xfw h ARG 671 Ca 0.54 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.76 1xfw h ARG 671 Cb 2.65 0.16 0.00 0.00 -0.42 0.00 0.00 29.97 32.36 1xfw h ARG 671 CO -0.01 -0.47 0.01 0.54 -1.51 0.00 0.00 179.97 178.54 1xfw n ARG 672 N -4.11 0.00 0.00 0.20 5.12 0.14 -3.30 116.66 114.72 1xfw n ARG 672 Ca -0.09 0.17 0.00 0.00 -1.93 0.00 0.00 57.85 56.00 1xfw n ARG 672 Cb 0.30 -1.51 0.00 0.00 -1.16 0.00 0.00 32.46 30.08 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 -1.15 0.00 -4.70 0.55 2.88 -0.41 -4.78 113.62 106.01 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 -0.96 7.02 0.00 -3.46 1.04 0.18 -4.84 113.70 112.68 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 0.62 -3.20 0.98 0.00 0.00 173.24 171.08 1xfw n ASN 675 N 4.64 1.76 -3.90 7.02 5.15 -1.21 -4.05 115.26 124.67 1xfw n ASN 675 Ca 0.10 -1.18 -0.22 0.00 -0.60 0.00 0.00 54.58 52.69 1xfw n ASN 675 Cb 0.46 -0.33 -0.17 0.00 -0.53 0.00 0.00 39.78 39.21 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 0.65 0.45 3.44 -7.23 -1.25 -5.01 120.40 112.20 1xfw s VAL 676 Ca 0.00 -0.16 -0.03 0.00 -1.81 0.00 0.00 61.98 59.97 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 0.73 -0.83 -0.31 0.00 0.00 175.10 174.95 1xfw s GLY 677 N 1.05 1.47 0.33 2.32 0.00 -1.26 -4.54 107.32 106.68 1xfw s GLY 677 Ca -0.09 -0.65 0.10 0.00 0.00 0.00 0.00 44.72 44.08 1xfw s GLY 677 CO -0.01 -0.50 1.59 -2.08 0.00 0.00 0.00 173.10 172.10 1xfw h VAL 678 N 0.34 0.07 -3.95 1.40 2.07 -1.98 -3.37 116.25 110.83 1xfw h VAL 678 Ca -0.48 -0.02 -0.52 0.00 0.82 0.00 0.00 66.70 66.51 1xfw h VAL 678 Cb 1.21 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 -0.82 -0.72 0.02 0.00 0.00 177.57 176.67 1xfw s TYR 679 N -5.80 1.48 0.31 1.57 -0.85 -1.26 -4.87 117.35 107.93 1xfw s TYR 679 Ca -0.11 -0.39 -0.02 0.00 -0.52 0.00 0.00 57.07 56.03 1xfw s TYR 679 Cb 0.31 -1.00 -0.04 0.00 0.38 0.00 0.00 41.96 41.61 1xfw s TYR 679 CO 0.78 -0.12 0.53 0.21 -1.52 0.00 0.00 175.55 175.43 1xfw s LYS 680 N -0.00 3.55 -0.70 -3.49 2.20 -1.26 -5.01 119.74 115.03 1xfw s LYS 680 Ca -0.02 -0.19 -0.22 0.00 -0.36 0.00 0.00 55.97 55.18 1xfw s LYS 680 Cb -0.10 -2.68 0.07 0.00 -1.51 0.00 0.00 37.83 33.62 1xfw s LYS 680 CO 0.01 0.20 1.01 0.34 -0.36 0.00 0.00 175.35 176.55 1xfw s ASP 681 N -3.57 6.22 0.20 1.43 2.15 -1.26 -4.78 116.67 117.06 1xfw s ASP 681 Ca 0.41 -1.08 -0.02 0.00 0.43 0.00 0.00 52.55 52.30 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 0.33 -1.43 0.29 -1.54 -0.17 0.00 0.00 175.17 172.65 1xfw n SER 682 N 7.70 -0.80 0.01 -0.34 3.41 -1.26 -5.06 113.62 117.27 1xfw n SER 682 Ca -0.00 -2.03 0.02 0.00 -0.26 0.00 0.00 58.87 56.60 1xfw n SER 682 Cb 0.46 1.48 -0.10 0.00 -0.26 0.00 0.00 64.21 65.79 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 3.56 5.00 0.00 -1.26 -4.91 105.19 106.10 1xfw n GLY 683 Ca -0.00 -0.23 -0.48 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.73 1.03 -0.47 1.61 5.75 -1.26 -4.79 116.55 115.68 1xfw n ASP 684 Ca -0.11 1.15 0.12 0.00 -0.01 0.00 0.00 54.79 55.93 1xfw n ASP 684 Cb 0.81 -1.19 0.46 0.00 -1.03 0.00 0.00 41.12 40.16 1xfw n ASP 684 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1xfw n LYS 685 N 1.46 1.63 -0.03 0.11 4.76 -1.26 -3.47 118.16 121.36 1xfw n LYS 685 Ca 0.14 -0.93 -0.10 0.00 -2.87 0.00 0.00 58.31 54.55 1xfw n LYS 685 Cb 0.25 -1.42 -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 0.14 0.94 0.13 4.39 10.43 -1.26 -2.70 116.55 128.62 1xfw n ASP 686 Ca 0.17 0.37 -0.13 0.00 2.57 0.00 0.00 54.79 57.76 1xfw n ASP 686 Cb 0.31 -0.07 -0.07 0.00 1.84 0.00 0.00 41.12 43.13 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 -0.27 -0.12 -1.24 4.57 -1.92 0.11 114.58 115.71 1xfw h GLU 687 Ca -0.32 0.02 0.03 0.00 -1.18 0.00 0.00 59.36 57.91 1xfw h GLU 687 Cb 2.03 0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 30.63 1xfw h GLU 687 CO 0.08 -0.18 -0.48 0.35 -1.18 0.00 0.00 179.01 177.60 1xfw h PHE 688 N -0.28 -1.42 -0.47 0.92 3.57 -1.67 0.23 116.94 117.81 1xfw h PHE 688 Ca -0.02 0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.58 1xfw h PHE 688 Cb 0.24 0.64 -0.06 0.00 2.79 0.00 0.00 35.95 39.56 1xfw h PHE 688 CO -0.09 -0.48 -0.28 0.00 -2.23 0.00 0.00 178.31 175.24 1xfw n ALA 689 N -2.95 -0.30 -0.13 2.41 0.00 -0.84 0.11 120.51 118.81 1xfw n ALA 689 Ca -0.05 0.40 -0.05 0.00 0.00 0.00 0.00 53.44 53.74 1xfw n ALA 689 Cb 0.33 0.06 0.01 0.00 0.00 0.00 0.00 19.45 19.85 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 -0.12 0.00 0.00 1.57 0.22 0.10 116.57 118.35 1xfw h LYS 690 Ca 0.07 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1xfw h LYS 690 Cb 0.19 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.53 1xfw h LYS 690 CO -0.44 -0.08 0.00 1.17 -0.57 0.00 0.00 179.45 179.53 1xfw n LYS 691 N -5.39 0.00 -0.30 3.15 4.81 0.31 -1.33 118.16 119.42 1xfw n LYS 691 Ca 0.03 0.69 0.29 0.00 -0.87 0.00 0.00 58.31 58.44 1xfw n LYS 691 Cb 0.30 -1.47 0.52 0.00 0.02 0.00 0.00 35.03 34.40 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 -2.33 -0.05 -0.08 1.64 4.07 0.13 0.17 120.64 124.20 1xfw n GLU 692 Ca 0.00 1.15 -0.11 0.00 -0.06 0.00 0.00 57.16 58.14 1xfw n GLU 692 Cb 0.00 -2.11 -0.04 0.00 -0.06 0.00 0.00 31.44 29.23 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 0.40 0.15 4.31 0.87 0.51 -2.42 113.55 117.36 1xfw h SER 693 Ca 0.73 -0.28 -0.10 0.00 -1.23 0.00 0.00 61.79 60.92 1xfw h SER 693 Cb 2.01 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 63.85 1xfw h SER 693 CO -0.60 0.58 -0.34 -0.37 -0.53 0.00 0.00 176.83 175.56 1xfw h VAL 694 N 0.21 1.28 0.00 2.23 -1.51 0.75 0.80 116.25 120.01 1xfw h VAL 694 Ca 0.07 -1.38 -0.00 0.00 -1.23 0.00 0.00 66.70 64.17 1xfw h VAL 694 Cb 0.35 1.56 -0.00 0.00 -2.13 0.00 0.00 31.29 31.07 1xfw h VAL 694 CO 0.01 0.42 -0.01 0.50 -1.23 0.00 0.00 177.57 177.25 1xfw h LYS 695 N 0.25 0.00 0.25 5.19 3.64 -1.18 0.12 116.57 124.83 1xfw h LYS 695 Ca 0.03 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.09 1xfw h LYS 695 Cb 0.73 0.00 0.04 0.00 -0.41 0.00 0.00 32.23 32.59 1xfw h LYS 695 CO 0.06 0.01 -1.43 0.87 -2.27 0.00 0.00 179.45 176.69 1xfw h LYS 696 N 0.00 0.52 -0.30 1.90 1.57 -0.36 -3.14 116.57 116.76 1xfw h LYS 696 Ca -0.00 -0.89 -0.17 0.00 -1.87 0.00 0.00 60.65 57.72 1xfw h LYS 696 Cb 0.17 0.33 -0.00 0.00 0.08 0.00 0.00 32.23 32.81 1xfw h LYS 696 CO 0.00 1.43 -0.49 0.82 -0.57 0.00 0.00 179.45 180.64 1xfw h ILE 697 N 0.10 1.28 -0.76 1.86 2.04 -0.74 -2.46 117.51 118.82 1xfw h ILE 697 Ca -0.25 -1.68 0.22 0.00 1.00 0.00 0.00 64.86 64.15 1xfw h ILE 697 Cb 2.12 1.56 -0.03 0.00 -0.74 0.00 0.00 36.82 39.73 1xfw h ILE 697 CO 0.26 0.55 0.55 0.00 0.00 0.00 0.00 178.15 179.51 1xfw h ALA 698 N 0.78 2.68 -1.29 1.87 0.00 -0.87 -0.26 119.26 122.17 1xfw h ALA 698 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1xfw h ALA 698 Cb 1.08 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1xfw h ALA 698 CO 0.11 -0.90 0.00 0.41 0.00 0.00 0.00 179.25 178.87 1xfw n GLY 699 N -1.67 0.02 0.16 0.00 0.00 -0.96 -2.91 105.19 99.82 1xfw n GLY 699 Ca 0.15 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.21 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 -1.36 0.20 0.47 1.61 0.53 -1.00 0.26 117.16 117.88 1xfw n TYR 700 Ca 0.00 0.54 -0.19 0.00 -1.02 0.00 0.00 57.90 57.23 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 -1.88 7.72 3.38 -1.21 -1.10 115.31 121.20 1xfw h LEU 701 Ca 0.23 0.03 0.11 0.00 0.09 0.00 0.00 57.88 58.35 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 -0.44 -0.68 0.49 -1.28 0.09 0.00 0.00 178.44 176.62 1xfw h SER 702 N -1.30 0.00 1.15 -0.43 0.87 0.37 0.41 113.55 114.63 1xfw h SER 702 Ca -0.12 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.26 1xfw h SER 702 Cb 0.93 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.86 1xfw h SER 702 CO 0.20 0.00 -0.85 0.44 -0.53 0.00 0.00 176.83 176.09 1xfw h ASP 703 N 0.00 0.00 0.16 6.23 3.45 0.88 -3.28 116.42 123.85 1xfw h ASP 703 Ca 0.19 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.65 1xfw h ASP 703 Cb 1.17 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.94 1xfw h ASP 703 CO -0.00 0.82 -0.12 0.22 -1.57 0.00 0.00 179.24 178.58 1xfw h TYR 704 N 0.00 -0.32 -0.47 4.55 3.20 0.11 -3.19 116.97 120.85 1xfw h TYR 704 Ca -0.02 -0.00 -0.71 0.00 3.14 0.00 0.00 58.73 61.14 1xfw h TYR 704 Cb 1.64 0.12 -0.06 0.00 1.54 0.00 0.00 36.73 39.97 1xfw h TYR 704 CO 0.00 -0.19 3.00 0.66 -1.64 0.00 0.00 178.16 179.99 1xfw n TYR 705 N -5.24 2.94 -3.98 -3.82 4.02 -1.17 -4.94 117.16 104.97 1xfw n TYR 705 Ca -0.08 -2.95 -0.35 0.00 -0.01 0.00 0.00 57.90 54.51 1xfw n TYR 705 Cb 0.16 -2.30 -0.08 0.00 -0.02 0.00 0.00 39.34 37.10 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 1.96 5.87 0.36 7.72 3.84 -1.21 -4.98 114.94 128.50 1xfw s ASN 706 Ca 0.53 0.21 0.27 0.00 0.21 0.00 0.00 52.86 54.09 1xfw s ASN 706 Cb 0.15 -1.94 1.07 0.00 -0.55 0.00 0.00 41.25 39.97 1xfw s ASN 706 CO -0.06 0.26 1.80 0.28 -2.79 0.00 0.00 177.10 176.59 1xfw h SER 707 N 6.04 0.00 -0.21 -4.21 0.02 -1.94 -2.47 113.55 110.79 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 0.66 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 176.35 1xfw n ALA 708 N -1.89 2.63 1.54 3.77 0.00 -1.26 -3.35 120.51 121.93 1xfw n ALA 708 Ca 0.02 -0.46 0.12 0.00 0.00 0.00 0.00 53.44 53.13 1xfw n ALA 708 Cb 0.29 -1.00 0.73 0.00 0.00 0.00 0.00 19.45 19.47 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 0.17 0.00 0.07 0.00 5.03 -0.93 -3.36 115.26 116.23 1xfw n ASN 709 Ca 0.08 -0.74 -0.09 0.00 0.87 0.00 0.00 54.58 54.69 1xfw n ASN 709 Cb 0.31 -0.01 -0.13 0.00 -1.02 0.00 0.00 39.78 38.93 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 0.11 0.00 3.10 2.07 -1.82 -3.24 115.15 115.37 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 0.01 -0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.99 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 -3.38 0.00 -4.27 6.12 -5.35 -1.21 -4.76 119.36 106.52 1xfw n ILE 711 Ca -0.03 0.00 -0.28 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 -1.49 2.12 0.02 4.28 2.99 -1.22 -5.13 117.98 119.55 1xfw s PHE 712 Ca 0.00 -0.76 -0.09 0.00 0.00 0.00 0.00 56.93 56.07 1xfw s PHE 712 Cb 0.00 -1.84 -0.05 0.00 0.00 0.00 0.00 43.02 41.13 1xfw s PHE 712 CO 0.00 0.03 0.33 -1.54 -0.00 0.00 0.00 175.22 174.04 1xfw s SER 713 N -3.99 6.60 0.28 1.36 1.04 -1.26 -4.92 113.70 112.81 1xfw s SER 713 Ca 0.29 0.71 0.08 0.00 0.48 0.00 0.00 55.95 57.52 1xfw s SER 713 Cb 0.02 -2.15 0.84 0.00 0.10 0.00 0.00 66.02 64.83 1xfw s SER 713 CO 0.16 0.25 1.31 1.67 0.98 0.00 0.00 173.24 177.61 1xfw n GLN 714 N 1.22 -0.06 0.05 4.02 -0.06 -1.26 -0.78 117.38 120.51 1xfw n GLN 714 Ca -0.11 1.21 -0.04 0.00 -2.00 0.00 0.00 57.00 56.06 1xfw n GLN 714 Cb 0.53 -2.02 -0.02 0.00 -4.06 0.00 0.00 30.24 24.66 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 -0.19 -0.36 3.69 4.57 -2.01 -2.93 114.58 117.36 1xfw h GLU 715 Ca 0.59 0.01 0.08 0.00 -1.18 0.00 0.00 59.36 58.86 1xfw h GLU 715 Cb 1.39 0.04 -0.09 0.00 -0.16 0.00 0.00 28.75 29.94 1xfw h GLU 715 CO -0.73 -0.12 -0.29 -0.22 -1.18 0.00 0.00 179.01 176.46 1xfw h LYS 716 N -0.19 -0.24 -0.71 1.92 3.64 -1.35 -0.75 116.57 118.89 1xfw h LYS 716 Ca -0.01 0.02 0.16 0.00 -1.27 0.00 0.00 60.65 59.55 1xfw h LYS 716 Cb 0.18 0.05 -0.13 0.00 -0.41 0.00 0.00 32.23 31.92 1xfw h LYS 716 CO -0.04 -0.16 -0.11 1.63 -2.27 0.00 0.00 179.45 178.51 1xfw n LYS 717 N -5.41 -0.06 -0.00 1.90 5.02 -0.68 0.13 118.16 119.06 1xfw n LYS 717 Ca 0.01 1.09 -0.12 0.00 -2.02 0.00 0.00 58.31 57.26 1xfw n LYS 717 Cb 0.32 -1.66 -0.08 0.00 -0.02 0.00 0.00 35.03 33.59 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 0.05 0.00 1.97 3.08 -0.95 -1.56 114.38 116.97 1xfw h ARG 718 Ca 0.37 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.41 1xfw h ARG 718 Cb 0.65 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.69 1xfw h ARG 718 CO -0.71 0.29 0.00 1.63 -1.07 0.00 0.00 179.97 180.12 1xfw n LYS 719 N -4.93 0.00 -0.25 0.04 5.02 0.35 0.06 118.16 118.46 1xfw n LYS 719 Ca -0.07 0.41 0.24 0.00 -2.02 0.00 0.00 58.31 56.86 1xfw n LYS 719 Cb 0.15 -1.39 0.44 0.00 -0.02 0.00 0.00 35.03 34.21 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 -1.72 -0.32 0.10 -0.18 0.13 0.24 0.96 119.36 118.56 1xfw n ILE 720 Ca 0.00 1.58 -0.17 0.00 -1.10 0.00 0.00 62.75 63.06 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 0.46 -0.10 9.51 0.02 -1.16 -2.82 113.55 119.46 1xfw h SER 721 Ca 0.64 -0.53 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 1xfw h SER 721 Cb 1.69 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 64.07 1xfw h SER 721 CO -0.61 1.42 0.04 0.40 -1.14 0.00 0.00 176.83 176.95 1xfw h ILE 722 N 0.08 1.07 0.22 3.27 2.04 0.46 0.49 117.51 125.14 1xfw h ILE 722 Ca -0.18 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 1xfw h ILE 722 Cb 2.01 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 39.01 1xfw h ILE 722 CO 0.20 0.08 -0.11 0.15 0.00 0.00 0.00 178.15 178.47 1xfw h PHE 723 N 0.19 -0.28 -0.86 1.37 3.57 -1.32 -0.31 116.94 119.29 1xfw h PHE 723 Ca 0.05 -0.01 0.22 0.00 3.53 0.00 0.00 57.97 61.77 1xfw h PHE 723 Cb 0.06 0.09 -0.14 0.00 2.79 0.00 0.00 35.95 38.75 1xfw h PHE 723 CO 0.00 0.06 0.17 0.00 -2.23 0.00 0.00 178.31 176.31 1xfw h ARG 724 N -0.96 0.16 0.01 1.11 2.47 -1.20 0.63 114.38 116.59 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 0.46 -0.04 -0.00 0.00 -1.65 0.00 0.00 29.97 28.74 1xfw h ARG 724 CO 0.05 0.11 -0.01 0.78 0.56 0.00 0.00 179.97 181.46 1xfw h GLY 725 N 0.17 -0.60 -0.89 0.04 0.00 0.05 -2.64 103.07 99.19 1xfw h GLY 725 Ca 0.53 0.26 0.28 0.00 0.00 0.00 0.00 47.33 48.40 1xfw h GLY 725 CO -0.68 -0.23 0.11 -2.22 0.00 0.00 0.00 176.54 173.53 1xfw h ILE 726 N -0.02 0.06 -0.90 2.60 2.04 0.11 0.71 117.51 122.11 1xfw h ILE 726 Ca -0.00 -0.01 0.15 0.00 1.00 0.00 0.00 64.86 65.99 1xfw h ILE 726 Cb 0.02 0.02 -0.09 0.00 -0.74 0.00 0.00 36.82 36.03 1xfw h ILE 726 CO -0.00 0.01 0.50 1.56 0.00 0.00 0.00 178.15 180.22 1xfw h GLN 727 N 0.03 0.70 0.37 2.37 4.20 0.27 -0.87 115.11 122.18 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 1.33 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.96 1xfw h GLN 727 CO -0.87 0.46 -0.18 0.00 -0.67 0.00 0.00 178.83 177.58 1xfw h ALA 728 N 1.56 -0.50 0.00 3.87 0.00 0.80 -2.09 119.26 122.90 1xfw h ALA 728 Ca 0.48 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1xfw h ALA 728 Cb 0.65 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1xfw h ALA 728 CO -0.34 -0.70 0.46 -0.92 0.00 0.00 0.00 179.25 177.75 1xfw h TYR 729 N -0.66 0.00 0.00 0.00 3.20 -0.75 -1.29 116.97 117.47 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 0.47 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.74 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 -2.77 0.00 0.19 -2.11 2.85 -0.45 -1.70 115.26 111.28 1xfw n ASN 730 Ca -0.02 0.28 0.04 0.00 -0.11 0.00 0.00 54.58 54.78 1xfw n ASN 730 Cb 0.50 -0.28 0.24 0.00 1.24 0.00 0.00 39.78 41.47 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 -1.11 2.19 114.58 121.25 1xfw h GLU 731 Ca 0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 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 -0.15 0.82 -1.16 0.00 0.00 179.01 178.52 1xfw h ILE 732 N 0.00 1.09 -0.44 3.13 1.08 -1.34 -3.01 117.51 118.02 1xfw h ILE 732 Ca 0.00 -1.87 0.13 0.00 -0.39 0.00 0.00 64.86 62.73 1xfw h ILE 732 Cb 1.04 2.12 -0.02 0.00 -3.07 0.00 0.00 36.82 36.89 1xfw h ILE 732 CO 0.00 0.37 0.44 -0.08 -0.69 0.00 0.00 178.15 178.19 1xfw h GLU 733 N -1.00 0.00 -0.06 2.37 4.57 0.43 -0.33 114.58 120.56 1xfw h GLU 733 Ca -0.04 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.06 1xfw h GLU 733 Cb 0.71 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.31 1xfw h GLU 733 CO -0.02 0.00 -0.29 -0.97 -1.18 0.00 0.00 179.01 176.55 1xfw h ASN 734 N 0.00 0.35 0.29 1.04 -1.24 -0.43 -3.22 115.58 112.37 1xfw h ASN 734 Ca 0.21 -0.66 -0.22 0.00 0.71 0.00 0.00 56.30 56.35 1xfw h ASN 734 Cb 1.10 -0.10 0.00 0.00 0.73 0.00 0.00 38.32 40.04 1xfw h ASN 734 CO -0.00 0.95 -0.88 0.58 -1.29 0.00 0.00 177.43 176.79 1xfw h VAL 735 N -0.22 1.39 -0.11 2.57 2.07 -0.97 -3.00 116.25 117.98 1xfw h VAL 735 Ca -0.02 -2.35 0.03 0.00 0.82 0.00 0.00 66.70 65.19 1xfw h VAL 735 Cb 0.95 2.32 -0.00 0.00 -1.52 0.00 0.00 31.29 33.03 1xfw h VAL 735 CO 0.06 0.70 0.14 0.25 0.02 0.00 0.00 177.57 178.74 1xfw h LEU 736 N 0.26 0.00 -4.89 2.57 5.85 -1.32 0.37 115.31 118.15 1xfw h LEU 736 Ca -0.07 0.00 -0.67 0.00 0.84 0.00 0.00 57.88 57.98 1xfw h LEU 736 Cb 1.51 0.00 -0.35 0.00 0.37 0.00 0.00 40.66 42.18 1xfw h LEU 736 CO 0.15 0.00 0.08 0.29 -0.34 0.00 0.00 178.44 178.62 1xfw n LYS 737 N -3.71 3.30 0.00 1.25 4.76 -1.13 -4.97 118.16 117.65 1xfw n LYS 737 Ca -0.00 -4.18 0.00 0.00 -2.87 0.00 0.00 58.31 51.26 1xfw n LYS 737 Cb 0.24 -2.27 0.00 0.00 -1.84 0.00 0.00 35.03 31.16 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 -2.11 4.39 2.88 0.13 -4.93 113.62 113.52 1xfw n SER 738 Ca 0.45 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.99 1xfw n SER 738 Cb 0.45 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.91 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 -1.24 -1.46 4.81 -1.26 -4.89 118.16 116.51 1xfw n LYS 739 Ca 0.00 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 57.11 1xfw n LYS 739 Cb 0.00 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 34.99 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 3.34 -2.11 1.64 1.13 -1.26 -4.90 117.38 115.22 1xfw n GLN 740 Ca 0.00 -1.94 -0.42 0.00 -1.94 0.00 0.00 57.00 52.70 1xfw n GLN 740 Cb 0.00 -2.63 -0.03 0.00 0.11 0.00 0.00 30.24 27.69 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 1.93 3.54 1.03 5.09 -4.36 -1.26 -4.93 121.20 122.25 1xfw s ILE 741 Ca 0.69 0.88 -0.24 0.00 -0.26 0.00 0.00 60.65 61.71 1xfw s ILE 741 Cb 0.21 -3.56 -0.10 0.00 1.25 0.00 0.00 42.46 40.25 1xfw s ILE 741 CO -0.05 -0.02 -1.04 0.00 0.24 0.00 0.00 174.94 174.07 1xfw n ALA 742 N 5.91 -5.29 0.04 2.27 0.00 -1.26 -4.52 120.51 117.66 1xfw n ALA 742 Ca 0.15 -1.32 -0.15 0.00 0.00 0.00 0.00 53.44 52.12 1xfw n ALA 742 Cb 0.43 -1.04 -0.05 0.00 0.00 0.00 0.00 19.45 18.79 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 -1.32 0.54 -0.97 0.00 0.13 -1.97 -0.52 132.00 127.90 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 0.14 -0.17 0.00 0.13 0.00 0.00 31.00 32.47 1xfw h PRO 743 CO 0.26 1.15 0.17 1.05 -0.23 0.00 0.00 178.00 180.41 1xfw h GLU 744 N 0.33 0.05 0.01 0.86 9.09 -2.00 1.91 114.58 124.83 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 -1.36 1.88 0.05 0.00 0.00 179.01 179.77 1xfw h TYR 745 N 0.05 0.02 -0.85 2.06 -1.99 -1.87 -2.99 116.97 111.40 1xfw h TYR 745 Ca 0.64 -0.02 0.06 0.00 2.00 0.00 0.00 58.73 61.41 1xfw h TYR 745 Cb 1.41 -0.00 -0.06 0.00 2.00 0.00 0.00 36.73 40.08 1xfw h TYR 745 CO -0.35 1.02 0.53 -0.22 -0.00 0.00 0.00 178.16 179.14 1xfw h LYS 746 N 0.00 0.94 0.63 4.88 3.11 0.41 -2.00 116.57 124.54 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 1.90 -0.21 0.01 0.00 -1.00 0.00 0.00 32.23 32.92 1xfw h LYS 746 CO 0.11 0.62 -0.30 -0.91 -2.81 0.00 0.00 179.45 176.16 1xfw h ASN 747 N 0.97 -0.72 -0.83 4.20 -0.26 0.15 -0.64 115.58 118.46 1xfw h ASN 747 Ca 0.37 0.02 0.08 0.00 -0.56 0.00 0.00 56.30 56.21 1xfw h ASN 747 Cb 0.15 0.19 -0.11 0.00 -1.06 0.00 0.00 38.32 37.49 1xfw h ASN 747 CO -0.17 -0.42 -0.55 0.22 -1.06 0.00 0.00 177.43 175.46 1xfw h TYR 748 N -1.04 -1.75 -0.61 1.19 3.20 -1.42 0.98 116.97 117.52 1xfw h TYR 748 Ca -0.09 0.11 0.11 0.00 3.14 0.00 0.00 58.73 62.01 1xfw h TYR 748 Cb 0.65 0.87 -0.09 0.00 1.54 0.00 0.00 36.73 39.70 1xfw h TYR 748 CO 0.03 -0.37 0.14 0.74 -1.64 0.00 0.00 178.16 177.07 1xfw h PHE 749 N -0.07 0.23 -1.03 -3.82 0.04 -1.43 0.85 116.94 111.71 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 0.42 -0.01 -0.13 0.00 2.20 0.00 0.00 35.95 38.43 1xfw h PHE 749 CO -0.97 -0.02 0.62 1.96 -0.60 0.00 0.00 178.31 179.30 1xfw h GLN 750 N 0.28 0.43 0.11 1.51 1.08 0.25 -0.99 115.11 117.78 1xfw h GLN 750 Ca 0.32 -0.03 -0.16 0.00 -1.45 0.00 0.00 58.65 57.33 1xfw h GLN 750 Cb 0.48 -0.10 0.02 0.00 -0.05 0.00 0.00 27.48 27.83 1xfw h GLN 750 CO -0.40 0.29 -0.70 -0.92 -0.95 0.00 0.00 178.83 176.14 1xfw h TYR 751 N 0.45 0.50 -0.01 2.96 3.20 0.36 -3.26 116.97 121.17 1xfw h TYR 751 Ca 0.67 -0.35 0.00 0.00 3.14 0.00 0.00 58.73 62.19 1xfw h TYR 751 Cb 1.48 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 39.73 1xfw h TYR 751 CO -0.01 1.25 0.29 -0.07 -1.64 0.00 0.00 178.16 177.99 1xfw h LEU 752 N -0.38 0.00 0.25 2.82 3.38 0.12 -1.33 115.31 120.18 1xfw h LEU 752 Ca -0.12 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1xfw h LEU 752 Cb 1.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.28 1xfw h LEU 752 CO 0.13 0.00 -0.12 0.11 0.09 0.00 0.00 178.44 178.65 1xfw h LYS 753 N 0.00 -0.33 -1.15 1.13 1.57 -1.41 -2.85 116.57 113.53 1xfw h LYS 753 Ca 0.00 0.02 0.34 0.00 -1.87 0.00 0.00 60.65 59.14 1xfw h LYS 753 Cb 0.59 0.07 -0.11 0.00 0.08 0.00 0.00 32.23 32.86 1xfw h LYS 753 CO -0.00 -0.11 0.74 1.49 -0.57 0.00 0.00 179.45 181.00 1xfw h GLU 754 N -1.05 0.25 0.00 3.15 4.81 -1.34 0.11 114.58 120.50 1xfw h GLU 754 Ca -0.03 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1xfw h GLU 754 Cb 0.36 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.69 1xfw h GLU 754 CO 0.06 0.16 0.00 0.54 -0.73 0.00 0.00 179.01 179.04 1xfw n ARG 755 N -4.64 0.00 -0.12 1.92 5.12 -1.04 -0.87 116.66 117.03 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 1.11 -0.98 -0.03 0.00 -1.16 0.00 0.00 32.46 31.40 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 -0.57 -0.19 -0.14 0.55 2.08 -0.74 0.71 119.36 121.06 1xfw n ILE 756 Ca 0.00 0.94 -0.04 0.00 0.56 0.00 0.00 62.75 64.21 1xfw n ILE 756 Cb 0.00 -1.18 -0.03 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 -3.74 -0.23 -0.13 1.39 -1.04 0.29 0.18 114.28 111.01 1xfw n THR 757 Ca 0.01 1.76 -0.05 0.00 -2.04 0.00 0.00 64.05 63.73 1xfw n THR 757 Cb 0.07 -2.27 0.02 0.00 -1.82 0.00 0.00 70.33 66.33 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 -0.49 -0.75 8.00 2.35 0.23 0.98 115.58 125.89 1xfw h ASN 758 Ca 0.05 0.14 0.06 0.00 -0.55 0.00 0.00 56.30 56.00 1xfw h ASN 758 Cb 0.14 0.30 -0.06 0.00 0.05 0.00 0.00 38.32 38.75 1xfw h ASN 758 CO -0.32 -0.17 0.45 -0.61 -1.65 0.00 0.00 177.43 175.13 1xfw h GLN 759 N -0.04 0.80 0.00 0.81 5.75 0.11 0.45 115.11 122.99 1xfw h GLN 759 Ca 0.20 -0.05 -0.12 0.00 -0.15 0.00 0.00 58.65 58.53 1xfw h GLN 759 Cb 0.35 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.71 1xfw h GLN 759 CO -0.46 0.53 -0.59 0.28 -2.65 0.00 0.00 178.83 175.95 1xfw h VAL 760 N 0.83 1.37 -0.13 2.39 2.07 0.33 -1.75 116.25 121.37 1xfw h VAL 760 Ca 0.33 -2.04 -0.09 0.00 0.82 0.00 0.00 66.70 65.71 1xfw h VAL 760 Cb 0.16 2.12 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 1xfw h VAL 760 CO -0.17 0.58 -0.27 -0.61 0.02 0.00 0.00 177.57 177.11 1xfw h GLN 761 N 0.00 0.41 -0.55 1.57 5.75 0.25 -3.07 115.11 119.47 1xfw h GLN 761 Ca -0.01 -0.27 0.04 0.00 -0.15 0.00 0.00 58.65 58.26 1xfw h GLN 761 Cb 1.07 0.04 -0.04 0.00 1.07 0.00 0.00 27.48 29.62 1xfw h GLN 761 CO 0.08 0.88 0.31 1.25 -2.65 0.00 0.00 178.83 178.70 1xfw h LEU 762 N -0.00 0.49 -1.03 -2.39 5.85 -0.07 -0.30 115.31 117.85 1xfw h LEU 762 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1xfw h LEU 762 Cb 0.87 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.82 1xfw h LEU 762 CO 0.06 0.34 0.00 0.18 -0.34 0.00 0.00 178.44 178.68 1xfw n LEU 763 N -4.81 0.55 -0.07 2.25 4.77 -0.67 -2.66 117.00 116.37 1xfw n LEU 763 Ca 0.05 0.70 -0.06 0.00 -0.03 0.00 0.00 56.01 56.67 1xfw n LEU 763 Cb 0.11 -0.71 -0.03 0.00 -2.33 0.00 0.00 43.42 40.46 1xfw n LEU 763 CO 0.31 -0.76 -0.29 -0.07 -1.33 0.00 0.00 177.39 175.26 1xfw h LEU 764 N 0.00 0.00 -0.30 2.23 3.38 -1.00 -3.35 115.31 116.28 1xfw h LEU 764 Ca 0.00 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1xfw h LEU 764 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 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 -0.03 0.22 -2.24 -0.59 0.15 114.28 107.16 1xfw n THR 765 Ca -0.09 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.67 1xfw n THR 765 Cb 0.27 -0.35 -0.13 0.00 -2.10 0.00 0.00 70.33 68.03 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 -0.21 0.40 0.02 4.78 8.25 -1.12 -4.89 115.22 122.45 1xfw n HIS 766 Ca 0.00 0.14 -0.00 0.00 -0.26 0.00 0.00 57.72 57.59 1xfw n HIS 766 Cb 0.00 -0.93 -0.00 0.00 1.12 0.00 0.00 29.99 30.18 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 -2.70 0.01 -3.77 -0.41 7.27 0.38 -5.04 117.38 113.13 1xfw n GLN 767 Ca -0.17 0.01 -0.29 0.00 0.07 0.00 0.00 57.00 56.61 1xfw n GLN 767 Cb 0.91 -0.31 -0.16 0.00 2.41 0.00 0.00 30.24 33.09 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 -1.58 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 -2.14 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 -4.45 113.62 123.83 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 63.15 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 1.00 -4.83 -3.46 4.05 -1.26 -4.99 115.26 105.53 1xfw n ASN 770 Ca 0.37 -0.53 -0.38 0.00 0.45 0.00 0.00 54.58 54.49 1xfw n ASN 770 Cb 0.38 1.08 -0.06 0.00 1.23 0.00 0.00 39.78 42.42 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 -1.91 4.92 0.08 -1.44 -1.09 -1.26 -5.10 121.20 115.41 1xfw s ILE 771 Ca 0.02 0.99 0.09 0.00 -2.23 0.00 0.00 60.65 59.51 1xfw s ILE 771 Cb 0.06 -3.78 -0.04 0.00 -1.58 0.00 0.00 42.46 37.12 1xfw s ILE 771 CO 0.32 0.57 -0.20 -1.61 -1.23 0.00 0.00 174.94 172.78 1xfw s GLU 772 N -1.08 1.84 0.12 2.79 2.02 -1.26 -4.99 118.70 118.14 1xfw s GLU 772 Ca 0.26 -1.12 -0.32 0.00 0.02 0.00 0.00 54.97 53.80 1xfw s GLU 772 Cb -0.18 -2.10 -0.11 0.00 0.10 0.00 0.00 34.13 31.85 1xfw s GLU 772 CO 0.16 0.50 1.57 0.35 0.02 0.00 0.00 175.26 177.86 1xfw h PHE 773 N 4.16 -1.35 -0.89 1.61 3.57 -1.94 0.14 116.94 122.23 1xfw h PHE 773 Ca -0.49 0.04 0.17 0.00 3.53 0.00 0.00 57.97 61.22 1xfw h PHE 773 Cb 1.16 0.59 -0.16 0.00 2.79 0.00 0.00 35.95 40.32 1xfw h PHE 773 CO 0.56 -0.54 -0.27 -0.22 -2.23 0.00 0.00 178.31 175.61 1xfw h LYS 774 N -0.65 -0.02 0.45 1.11 3.64 -2.00 0.60 116.57 119.71 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 0.70 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1xfw h LYS 774 CO -0.31 -0.01 -0.22 -0.07 -2.27 0.00 0.00 179.45 176.57 1xfw h LEU 775 N -0.02 -0.52 -1.33 5.20 3.38 -1.87 -2.80 115.31 117.36 1xfw h LEU 775 Ca 0.40 0.02 0.47 0.00 0.09 0.00 0.00 57.88 58.85 1xfw h LEU 775 Cb 0.64 0.13 -0.15 0.00 0.09 0.00 0.00 40.66 41.38 1xfw h LEU 775 CO -0.92 -0.18 0.83 0.25 0.09 0.00 0.00 178.44 178.51 1xfw h LEU 776 N -0.98 0.22 0.68 1.67 6.46 -0.21 0.50 115.31 123.65 1xfw h LEU 776 Ca -0.06 0.17 -0.03 0.00 -0.12 0.00 0.00 57.88 57.84 1xfw h LEU 776 Cb 0.47 0.18 0.01 0.00 -0.73 0.00 0.00 40.66 40.58 1xfw h LEU 776 CO 0.10 -0.28 -0.32 0.22 -0.62 0.00 0.00 178.44 177.54 1xfw h TYR 777 N 0.01 -0.84 -0.76 1.25 3.20 -0.87 -3.27 116.97 115.70 1xfw h TYR 777 Ca 0.87 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.79 1xfw h TYR 777 Cb 2.72 0.28 -0.09 0.00 1.54 0.00 0.00 36.73 41.18 1xfw h TYR 777 CO -0.01 -0.50 -0.45 1.63 -1.64 0.00 0.00 178.16 177.19 1xfw n LYS 778 N -5.39 -0.33 0.00 1.82 4.76 0.17 0.24 118.16 119.43 1xfw n LYS 778 Ca -0.12 1.16 0.00 0.00 -2.87 0.00 0.00 58.31 56.48 1xfw n LYS 778 Cb 0.37 -1.71 0.00 0.00 -1.84 0.00 0.00 35.03 31.85 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 -4.93 0.00 -2.95 1.97 6.02 -1.02 -4.70 117.38 111.77 1xfw n GLN 779 Ca 0.02 0.14 -0.22 0.00 -0.01 0.00 0.00 57.00 56.93 1xfw n GLN 779 Cb 0.20 -1.56 0.02 0.00 1.02 0.00 0.00 30.24 29.91 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 -2.11 3.59 -0.43 1.08 2.01 0.14 -5.00 118.68 117.96 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 -0.79 0.28 0.21 1.01 0.00 0.00 176.35 177.06 1xfw s ASN 781 N -4.27 3.02 -1.11 2.29 3.04 -1.26 -5.02 114.94 111.62 1xfw s ASN 781 Ca 0.51 -2.70 -0.05 0.00 0.04 0.00 0.00 52.86 50.65 1xfw s ASN 781 Cb -0.10 -0.75 0.29 0.00 -1.54 0.00 0.00 41.25 39.15 1xfw s ASN 781 CO 0.37 -0.24 1.53 0.49 -3.04 0.00 0.00 177.10 176.21 1xfw n PHE 782 N 3.40 2.50 0.00 0.43 3.01 -1.26 -4.70 117.46 120.84 1xfw n PHE 782 Ca 0.16 -2.67 0.00 0.00 1.01 0.00 0.00 57.45 55.95 1xfw n PHE 782 Cb 0.38 -1.39 0.00 0.00 -0.01 0.00 0.00 39.48 38.47 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 1.70 0.00 0.10 4.37 -1.04 -1.26 -5.00 114.28 113.15 1xfw n THR 783 Ca 0.28 0.00 0.05 0.00 -2.04 0.00 0.00 64.05 62.34 1xfw n THR 783 Cb 0.34 -0.17 -0.08 0.00 -1.82 0.00 0.00 70.33 68.60 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 1.01 -3.81 -2.82 0.28 -1.26 -4.96 120.64 109.08 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 -1.20 -0.17 0.00 1.43 0.00 0.00 31.44 31.50 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 -2.96 2.30 0.02 -1.84 2.20 -1.26 -4.98 114.94 108.42 1xfw s ASN 785 Ca -0.02 -0.44 0.16 0.00 -0.94 0.00 0.00 52.86 51.62 1xfw s ASN 785 Cb 0.07 -0.65 -0.17 0.00 -2.00 0.00 0.00 41.25 38.50 1xfw s ASN 785 CO 0.44 -0.21 0.74 1.21 -2.94 0.00 0.00 177.10 176.35 1xfw n GLU 786 N 5.03 0.63 0.00 3.55 4.07 -1.26 -4.54 120.64 128.11 1xfw n GLU 786 Ca -0.09 0.22 0.00 0.00 -0.06 0.00 0.00 57.16 57.22 1xfw n GLU 786 Cb 0.49 -1.78 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 0.61 6.31 -2.24 -1.26 -0.34 114.28 114.46 1xfw n THR 787 Ca -0.12 0.22 0.08 0.00 -2.27 0.00 0.00 64.05 61.96 1xfw n THR 787 Cb 0.89 -0.37 0.37 0.00 -2.10 0.00 0.00 70.33 69.13 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 0.45 -0.02 0.00 -0.01 0.00 0.00 54.79 55.21 1xfw n ASP 788 Cb 0.00 -0.48 0.10 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 0.94 -0.48 -1.12 -0.73 -0.92 1.22 115.58 114.48 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 -0.22 -0.02 0.00 0.27 0.00 0.00 38.32 38.63 1xfw h ASN 789 CO 0.00 0.65 0.04 0.15 -0.37 0.00 0.00 177.43 177.90 1xfw h PHE 790 N 1.10 0.88 -0.83 0.67 3.57 -1.51 0.16 116.94 120.98 1xfw h PHE 790 Ca 0.34 -0.14 0.08 0.00 3.53 0.00 0.00 57.97 61.78 1xfw h PHE 790 Cb -0.03 -0.24 -0.06 0.00 2.79 0.00 0.00 35.95 38.42 1xfw h PHE 790 CO -0.02 0.83 0.54 0.93 -2.23 0.00 0.00 178.31 178.36 1xfw h GLU 791 N 0.68 0.84 -0.41 1.11 5.08 -1.07 0.74 114.58 121.55 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 0.45 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 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 -3.02 116.25 120.36 1xfw h VAL 792 Ca 0.37 -0.78 0.06 0.00 0.82 0.00 0.00 66.70 67.17 1xfw h VAL 792 Cb 0.31 0.95 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 1xfw h VAL 792 CO -0.14 0.27 0.10 0.15 0.02 0.00 0.00 177.57 177.97 1xfw h PHE 793 N 0.53 0.16 -0.20 1.57 3.57 0.16 -2.56 116.94 120.17 1xfw h PHE 793 Ca 0.13 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.70 1xfw h PHE 793 Cb 0.31 -0.01 -0.07 0.00 2.79 0.00 0.00 35.95 38.96 1xfw h PHE 793 CO 0.02 0.03 -0.46 0.37 -2.23 0.00 0.00 178.31 176.04 1xfw h GLN 794 N 0.23 -0.46 0.00 1.11 -0.00 -1.10 0.14 115.11 115.03 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 0.22 0.10 0.00 0.00 0.00 0.00 0.00 27.48 27.81 1xfw h GLN 794 CO -0.24 -0.31 0.00 0.87 0.00 0.00 0.00 178.83 179.15 1xfw h LYS 795 N -0.48 0.00 0.00 1.69 1.57 -1.48 -0.46 116.57 117.41 1xfw h LYS 795 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1xfw h LYS 795 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.94 1xfw h LYS 795 CO -0.45 0.00 0.00 -0.89 -0.57 0.00 0.00 179.45 177.54 1xfw n ILE 796 N -2.40 0.71 -3.82 1.86 2.08 0.48 -3.98 119.36 114.30 1xfw n ILE 796 Ca -0.01 0.16 -0.28 0.00 0.56 0.00 0.00 62.75 63.17 1xfw n ILE 796 Cb 0.05 -0.88 -0.12 0.00 -0.75 0.00 0.00 39.64 37.95 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 -3.05 2.40 0.00 1.39 -4.36 -0.18 -5.06 121.20 112.34 1xfw s ILE 797 Ca 0.09 -3.87 0.00 0.00 -0.26 0.00 0.00 60.65 56.60 1xfw s ILE 797 Cb 0.12 -2.59 0.00 0.00 1.25 0.00 0.00 42.46 41.24 1xfw s ILE 797 CO 0.37 -1.02 0.00 0.47 0.24 0.00 0.00 174.94 174.99