#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i43 s ALA 51 N 0.00 3.21 0.33 2.98 0.00 -1.26 -5.01 121.76 122.01 1i43 s ALA 51 Ca 0.00 -0.83 0.17 0.00 0.00 0.00 0.00 51.96 51.29 1i43 s ALA 51 Cb 0.00 -1.41 0.83 0.00 0.00 0.00 0.00 23.12 22.54 1i43 s ALA 51 CO 0.00 0.59 1.84 0.66 0.00 0.00 0.00 175.76 178.85 1i43 h SER 52 N 5.14 0.00 1.04 0.00 4.64 -2.06 -2.80 113.55 119.51 1i43 h SER 52 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1i43 h SER 52 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1i43 h SER 52 CO 0.54 0.34 -0.03 2.22 -0.87 0.00 0.00 176.83 179.03 1i43 n PHE 53 N -3.88 0.12 -3.70 4.77 1.16 -1.26 -4.57 117.46 110.11 1i43 n PHE 53 Ca -0.01 0.04 -0.38 0.00 -1.87 0.00 0.00 57.45 55.22 1i43 n PHE 53 Cb 0.41 -0.55 -0.11 0.00 -1.61 0.00 0.00 39.48 37.62 1i43 n PHE 53 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1i43 s LEU 54 N -3.20 5.14 0.00 5.98 1.43 -1.06 -4.93 118.68 122.04 1i43 s LEU 54 Ca 0.13 -1.75 0.15 0.00 -1.03 0.00 0.00 54.13 51.63 1i43 s LEU 54 Cb 0.18 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 1i43 s LEU 54 CO 0.55 -0.54 0.77 0.59 0.23 0.00 0.00 176.35 177.95 1i43 n ASN 55 N 4.76 1.35 -4.70 2.29 3.02 -1.26 -4.67 115.26 116.04 1i43 n ASN 55 Ca -0.07 -1.18 -0.26 0.00 -0.03 0.00 0.00 54.58 53.04 1i43 n ASN 55 Cb 0.42 0.59 -0.07 0.00 -0.61 0.00 0.00 39.78 40.11 1i43 n ASN 55 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1i43 s SER 56 N -1.92 4.99 0.18 6.41 0.15 -1.26 -5.03 113.70 117.21 1i43 s SER 56 Ca 0.11 -0.32 -0.12 0.00 0.70 0.00 0.00 55.95 56.32 1i43 s SER 56 Cb 0.12 -1.14 0.10 0.00 -1.71 0.00 0.00 66.02 63.38 1i43 s SER 56 CO 0.42 0.08 1.80 0.44 1.20 0.00 0.00 173.24 177.18 1i43 h ASP 57 N 2.61 0.78 -0.24 5.45 3.32 -1.99 -2.50 116.42 123.85 1i43 h ASP 57 Ca -0.47 -0.09 0.05 0.00 0.02 0.00 0.00 57.03 56.54 1i43 h ASP 57 Cb 1.20 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 40.50 1i43 h ASP 57 CO 0.60 0.65 -0.11 1.23 -1.72 0.00 0.00 179.24 179.89 1i43 h GLY 58 N 0.85 0.10 1.37 2.75 0.00 -1.97 0.27 103.07 106.45 1i43 h GLY 58 Ca 0.22 0.14 -0.02 0.00 0.00 0.00 0.00 47.33 47.67 1i43 h GLY 58 CO -0.04 -0.13 0.30 1.76 0.00 0.00 0.00 176.54 178.44 1i43 h SER 59 N -0.07 0.74 -0.17 0.19 0.02 -1.96 -2.77 113.55 109.53 1i43 h SER 59 Ca 0.13 -0.06 -0.06 0.00 -0.84 0.00 0.00 61.79 60.96 1i43 h SER 59 Cb 0.27 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.61 1i43 h SER 59 CO -0.29 0.61 -0.11 0.58 -1.14 0.00 0.00 176.83 176.48 1i43 h VAL 60 N 0.83 1.32 0.00 2.27 2.07 -0.84 -1.12 116.25 120.78 1i43 h VAL 60 Ca 0.21 -1.21 0.00 0.00 0.82 0.00 0.00 66.70 66.52 1i43 h VAL 60 Cb 0.06 1.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1i43 h VAL 60 CO -0.03 0.36 0.05 0.00 0.02 0.00 0.00 177.57 177.97 1i43 n ALA 61 N -2.40 0.96 -0.13 1.67 0.00 0.85 -0.31 120.51 121.15 1i43 n ALA 61 Ca -0.05 0.14 -0.24 0.00 0.00 0.00 0.00 53.44 53.29 1i43 n ALA 61 Cb 0.33 -1.15 -0.08 0.00 0.00 0.00 0.00 19.45 18.55 1i43 n ALA 61 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1i43 n ILE 62 N -2.04 1.51 0.85 0.00 5.41 -1.02 -4.10 119.36 119.97 1i43 n ILE 62 Ca -0.01 -0.24 0.10 0.00 1.00 0.00 0.00 62.75 63.60 1i43 n ILE 62 Cb 0.07 -2.00 -0.07 0.00 -0.71 0.00 0.00 39.64 36.93 1i43 n ILE 62 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1i43 n HIS 63 N -4.30 0.03 -1.65 1.39 8.25 -0.46 -4.89 115.22 113.59 1i43 n HIS 63 Ca -0.44 0.01 -0.43 0.00 -0.26 0.00 0.00 57.72 56.60 1i43 n HIS 63 Cb 0.79 -0.12 -0.03 0.00 1.12 0.00 0.00 29.99 31.74 1i43 n HIS 63 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1i43 n ALA 64 N -1.62 1.52 -0.63 -1.41 0.00 0.58 -1.59 120.51 117.37 1i43 n ALA 64 Ca 0.03 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1i43 n ALA 64 Cb 0.37 -2.69 0.00 0.00 0.00 0.00 0.00 19.45 17.12 1i43 n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i43 n GLY 65 N 4.72 0.65 2.05 0.00 0.00 -1.26 -4.10 105.19 107.25 1i43 n GLY 65 Ca 0.22 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1i43 n GLY 65 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1i43 n GLU 66 N -2.63 0.00 -0.35 1.61 1.02 -0.62 -4.70 120.64 114.98 1i43 n GLU 66 Ca 0.00 0.00 0.22 0.00 -0.02 0.00 0.00 57.16 57.36 1i43 n GLU 66 Cb 0.00 0.00 0.47 0.00 -0.02 0.00 0.00 31.44 31.89 1i43 n GLU 66 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1i43 h ARG 67 N 0.00 0.41 0.00 3.49 9.65 -1.73 -1.66 114.38 124.54 1i43 h ARG 67 Ca 0.00 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 1i43 h ARG 67 Cb 0.00 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 28.49 1i43 h ARG 67 CO 0.00 0.27 -1.34 1.28 2.80 0.00 0.00 179.97 182.98 1i43 n LEU 68 N -4.83 0.50 0.00 3.80 4.77 -1.26 -5.05 117.00 114.92 1i43 n LEU 68 Ca 0.29 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 1i43 n LEU 68 Cb 0.90 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.94 1i43 n LEU 68 CO 0.18 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.81 1i43 n GLY 69 N 1.28 1.03 0.00 -0.72 0.00 -0.63 -5.07 105.19 101.09 1i43 n GLY 69 Ca -0.01 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.97 1i43 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i43 n ARG 70 N -0.65 2.96 0.00 1.61 1.74 -1.26 -3.49 116.66 117.56 1i43 n ARG 70 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1i43 n ARG 70 Cb 0.00 -0.25 0.00 0.00 -1.02 0.00 0.00 32.46 31.19 1i43 n ARG 70 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1i43 n GLY 71 N 0.00 2.94 2.89 -0.13 0.00 -1.26 -4.84 105.19 104.79 1i43 n GLY 71 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1i43 n GLY 71 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1i43 s ILE 72 N -1.31 2.83 0.26 -0.61 -1.16 -1.26 -5.09 121.20 114.86 1i43 s ILE 72 Ca 0.00 -4.19 -0.28 0.00 -0.51 0.00 0.00 60.65 55.67 1i43 s ILE 72 Cb 0.00 -2.87 -0.15 0.00 0.61 0.00 0.00 42.46 40.05 1i43 s ILE 72 CO 0.00 -1.00 0.87 0.52 -2.81 0.00 0.00 174.94 172.53 1i43 n VAL 73 N 2.06 1.94 -3.55 4.00 0.31 -1.26 -4.94 118.33 116.89 1i43 n VAL 73 Ca 0.19 -0.49 -0.08 0.00 -0.01 0.00 0.00 64.34 63.96 1i43 n VAL 73 Cb 0.35 -0.70 -0.03 0.00 -0.91 0.00 0.00 33.84 32.56 1i43 n VAL 73 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1i43 s THR 74 N -1.00 0.00 -0.52 2.52 -4.23 -1.26 -5.00 115.64 106.14 1i43 s THR 74 Ca 0.61 0.00 0.16 0.00 -1.18 0.00 0.00 61.69 61.27 1i43 s THR 74 Cb -0.78 -1.00 0.78 0.00 1.34 0.00 0.00 72.50 72.84 1i43 s THR 74 CO 0.58 0.00 1.70 -0.90 -0.54 0.00 0.00 174.62 175.47 1i43 n ASP 75 N 0.06 5.37 -4.87 3.99 5.75 -1.26 -4.93 116.55 120.65 1i43 n ASP 75 Ca -0.07 -2.79 -0.31 0.00 -0.01 0.00 0.00 54.79 51.62 1i43 n ASP 75 Cb 0.60 -0.65 -0.04 0.00 -1.03 0.00 0.00 41.12 40.00 1i43 n ASP 75 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1i43 s ALA 76 N -2.48 3.40 0.07 2.12 0.00 -1.26 -5.01 121.76 118.60 1i43 s ALA 76 Ca 0.53 -0.21 -0.10 0.00 0.00 0.00 0.00 51.96 52.18 1i43 s ALA 76 Cb 0.39 -2.64 -0.27 0.00 0.00 0.00 0.00 23.12 20.60 1i43 s ALA 76 CO 0.18 0.13 1.12 0.82 0.00 0.00 0.00 175.76 178.02 1i43 h ILE 77 N 1.37 1.38 -2.01 0.00 2.04 -2.03 -3.47 117.51 114.79 1i43 h ILE 77 Ca -0.47 -2.73 -0.46 0.00 1.00 0.00 0.00 64.86 62.19 1i43 h ILE 77 Cb 1.18 2.83 0.06 0.00 -0.74 0.00 0.00 36.82 40.16 1i43 h ILE 77 CO 0.65 0.81 0.03 0.42 0.00 0.00 0.00 178.15 180.07 1i43 s THR 78 N -2.82 2.28 -0.10 -0.27 -4.23 -1.26 -4.98 115.64 104.26 1i43 s THR 78 Ca -0.07 -0.68 -0.20 0.00 -1.18 0.00 0.00 61.69 59.57 1i43 s THR 78 Cb 0.06 -2.60 -0.04 0.00 1.34 0.00 0.00 72.50 71.26 1i43 s THR 78 CO 0.91 0.00 0.54 -0.89 -0.54 0.00 0.00 174.62 174.64 1i43 s THR 79 N -2.97 5.15 0.11 3.99 2.01 -1.26 -5.05 115.64 117.63 1i43 s THR 79 Ca 0.63 1.08 -0.30 0.00 0.31 0.00 0.00 61.69 63.42 1i43 s THR 79 Cb -0.07 -3.88 -0.06 0.00 0.01 0.00 0.00 72.50 68.51 1i43 s THR 79 CO 0.42 0.31 1.01 -2.16 -0.69 0.00 0.00 174.62 173.51 1i43 s PRO 80 N 0.66 4.65 -0.24 4.92 0.05 -1.26 -5.01 135.00 138.78 1i43 s PRO 80 Ca 0.29 1.53 -0.29 0.00 0.05 0.00 0.00 61.00 62.58 1i43 s PRO 80 Cb -0.16 -3.36 0.00 0.00 0.05 0.00 0.00 34.50 31.04 1i43 s PRO 80 CO 0.12 0.13 1.12 0.08 0.05 0.00 0.00 177.00 178.51 1i43 s VAL 81 N 0.09 4.50 -0.51 -0.36 1.01 -1.26 -4.41 120.40 119.47 1i43 s VAL 81 Ca 0.49 1.79 -0.14 0.00 0.00 0.00 0.00 61.98 64.12 1i43 s VAL 81 Cb -0.25 -4.24 0.12 0.00 0.00 0.00 0.00 36.38 32.01 1i43 s VAL 81 CO 0.31 -0.25 0.44 -0.69 0.00 0.00 0.00 175.10 174.91 1i43 s VAL 82 N 3.46 4.97 -1.19 2.92 1.01 -1.26 -5.00 120.40 125.31 1i43 s VAL 82 Ca 0.48 -1.48 -0.12 0.00 0.00 0.00 0.00 61.98 60.86 1i43 s VAL 82 Cb -0.16 -4.15 0.20 0.00 0.00 0.00 0.00 36.38 32.27 1i43 s VAL 82 CO 0.11 -0.78 1.38 0.59 0.00 0.00 0.00 175.10 176.40 1i43 n ASN 83 N 5.16 5.33 -4.08 3.32 3.02 -1.26 -4.76 115.26 121.98 1i43 n ASN 83 Ca -0.12 -3.02 -0.16 0.00 -0.03 0.00 0.00 54.58 51.25 1i43 n ASN 83 Cb 0.41 -1.51 -0.12 0.00 -0.61 0.00 0.00 39.78 37.95 1i43 n ASN 83 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1i43 s THR 84 N 0.60 0.73 -0.11 3.41 -1.32 -1.26 -5.03 115.64 112.66 1i43 s THR 84 Ca 0.39 -0.98 0.21 0.00 -1.21 0.00 0.00 61.69 60.10 1i43 s THR 84 Cb -0.04 -0.73 -0.23 0.00 -1.51 0.00 0.00 72.50 69.99 1i43 s THR 84 CO -0.02 -0.21 0.56 -1.54 -2.21 0.00 0.00 174.62 171.21 1i43 n SER 85 N 1.72 0.29 -3.88 8.08 3.41 -1.26 -4.72 113.62 117.27 1i43 n SER 85 Ca -0.20 0.12 -0.13 0.00 -0.26 0.00 0.00 58.87 58.40 1i43 n SER 85 Cb 0.55 1.27 -0.07 0.00 -0.26 0.00 0.00 64.21 65.69 1i43 n SER 85 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i43 s ALA 86 N -3.23 0.79 -0.06 7.33 0.00 -1.26 -1.45 121.76 123.88 1i43 s ALA 86 Ca -0.06 -1.48 0.00 0.00 0.00 0.00 0.00 51.96 50.42 1i43 s ALA 86 Cb 0.11 1.27 0.02 0.00 0.00 0.00 0.00 23.12 24.52 1i43 s ALA 86 CO 0.86 -0.71 -0.04 0.71 0.00 0.00 0.00 175.76 176.58 1i43 s TYR 87 N -3.84 0.91 0.83 0.00 1.51 -0.67 -4.89 117.35 111.20 1i43 s TYR 87 Ca 0.33 -0.31 -0.11 0.00 -1.01 0.00 0.00 57.07 55.97 1i43 s TYR 87 Cb 0.03 -0.83 0.12 0.00 -0.11 0.00 0.00 41.96 41.17 1i43 s TYR 87 CO 0.14 -0.29 1.17 -0.59 -1.11 0.00 0.00 175.55 174.88 1i43 s PHE 88 N 1.31 2.30 0.04 2.71 -0.12 -1.26 -4.70 117.98 118.25 1i43 s PHE 88 Ca -0.04 0.41 0.04 0.00 -0.05 0.00 0.00 56.93 57.28 1i43 s PHE 88 Cb -0.14 -3.61 -0.02 0.00 -0.63 0.00 0.00 43.02 38.63 1i43 s PHE 88 CO -0.02 -2.01 -0.11 -0.06 -0.05 0.00 0.00 175.22 172.97 1i43 s PHE 89 N -3.57 0.95 0.18 3.49 0.40 -1.26 -5.04 117.98 113.12 1i43 s PHE 89 Ca 0.66 -0.38 -0.08 0.00 -0.60 0.00 0.00 56.93 56.53 1i43 s PHE 89 Cb -0.08 -0.56 0.07 0.00 0.51 0.00 0.00 43.02 42.97 1i43 s PHE 89 CO 0.49 -0.00 1.58 -0.91 0.70 0.00 0.00 175.22 177.07 1i43 h ASN 90 N 4.82 0.95 -5.00 1.36 2.35 -1.99 -3.46 115.58 114.60 1i43 h ASN 90 Ca -0.36 -0.35 -0.07 0.00 -0.55 0.00 0.00 56.30 54.96 1i43 h ASN 90 Cb 1.19 -0.26 -0.19 0.00 0.05 0.00 0.00 38.32 39.11 1i43 h ASN 90 CO 0.43 1.12 0.09 -1.59 -1.65 0.00 0.00 177.43 175.83 1i43 s LYS 91 N -4.65 0.98 0.35 0.81 -2.85 -1.26 -5.03 119.74 108.09 1i43 s LYS 91 Ca -0.11 0.14 0.16 0.00 -1.00 0.00 0.00 55.97 55.17 1i43 s LYS 91 Cb 0.13 0.46 1.15 0.00 -2.06 0.00 0.00 37.83 37.50 1i43 s LYS 91 CO 0.86 -0.30 1.65 1.15 0.10 0.00 0.00 175.35 178.81 1i43 h THR 92 N 3.16 0.25 -0.41 3.79 2.02 -1.99 0.23 112.91 119.95 1i43 h THR 92 Ca -0.28 -0.09 0.09 0.00 0.77 0.00 0.00 66.41 66.90 1i43 h THR 92 Cb 1.15 -0.04 -0.09 0.00 -1.74 0.00 0.00 68.15 67.43 1i43 h THR 92 CO 0.39 0.05 -0.22 -1.28 0.37 0.00 0.00 175.52 174.83 1i43 h SER 93 N 0.26 -0.74 -0.18 4.18 0.87 -2.00 -0.26 113.55 115.68 1i43 h SER 93 Ca 0.76 0.16 -0.07 0.00 -1.23 0.00 0.00 61.79 61.41 1i43 h SER 93 Cb 1.81 0.39 -0.02 0.00 -0.44 0.00 0.00 62.40 64.14 1i43 h SER 93 CO -0.62 -0.24 -0.09 -0.33 -0.53 0.00 0.00 176.83 175.01 1i43 h GLU 94 N -0.14 0.53 -0.48 2.24 5.08 -0.97 -2.11 114.58 118.73 1i43 h GLU 94 Ca 0.20 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1i43 h GLU 94 Cb 0.45 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 1i43 h GLU 94 CO -0.50 0.63 0.31 1.25 -1.00 0.00 0.00 179.01 179.70 1i43 h LEU 95 N 0.50 0.52 -0.52 1.33 5.85 -0.61 -0.95 115.31 121.43 1i43 h LEU 95 Ca 0.10 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1i43 h LEU 95 Cb 0.47 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 1i43 h LEU 95 CO 0.03 0.37 0.28 0.40 -0.34 0.00 0.00 178.44 179.18 1i43 h ILE 96 N 0.62 1.18 -0.47 4.05 2.04 -0.78 -1.07 117.51 123.08 1i43 h ILE 96 Ca 0.18 -0.46 0.09 0.00 1.00 0.00 0.00 64.86 65.67 1i43 h ILE 96 Cb -0.04 0.54 -0.08 0.00 -0.74 0.00 0.00 36.82 36.50 1i43 h ILE 96 CO -0.06 0.19 -0.04 0.44 0.00 0.00 0.00 178.15 178.69 1i43 h ASP 97 N 0.69 -0.27 -0.52 1.72 3.32 -0.69 0.25 116.42 120.92 1i43 h ASP 97 Ca 0.18 0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.34 1i43 h ASP 97 Cb 0.06 0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 1i43 h ASP 97 CO -0.03 -0.09 0.27 0.15 -1.72 0.00 0.00 179.24 177.82 1i43 h PHE 98 N 0.07 0.72 0.00 4.55 3.57 -0.80 0.16 116.94 125.21 1i43 h PHE 98 Ca 0.23 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.69 1i43 h PHE 98 Cb 0.35 -0.23 -0.00 0.00 2.79 0.00 0.00 35.95 38.86 1i43 h PHE 98 CO -0.33 0.55 -0.08 0.87 -2.23 0.00 0.00 178.31 177.09 1i43 h LYS 99 N 0.69 0.00 -0.64 1.11 1.79 0.11 -1.71 116.57 117.92 1i43 h LYS 99 Ca 0.18 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.53 1i43 h LYS 99 Cb 0.07 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.65 1i43 h LYS 99 CO -0.03 0.08 0.15 0.39 -1.08 0.00 0.00 179.45 178.96 1i43 n GLU 100 N -3.53 4.10 -2.35 3.15 1.02 0.75 -4.94 120.64 118.85 1i43 n GLU 100 Ca -0.02 -3.11 -0.18 0.00 -0.02 0.00 0.00 57.16 53.82 1i43 n GLU 100 Cb 0.20 -2.21 -0.01 0.00 -0.02 0.00 0.00 31.44 29.40 1i43 n GLU 100 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1i43 n LYS 101 N 0.09 -1.82 -0.00 3.49 4.01 -0.64 -4.85 118.16 118.44 1i43 n LYS 101 Ca 0.35 0.90 0.08 0.00 -0.51 0.00 0.00 58.31 59.13 1i43 n LYS 101 Cb 1.29 -5.53 -0.10 0.00 -0.51 0.00 0.00 35.03 30.17 1i43 n LYS 101 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1i43 n ARG 102 N -2.90 1.36 -4.13 1.97 1.74 0.46 -4.98 116.66 110.18 1i43 n ARG 102 Ca -0.22 -0.04 -0.11 0.00 -0.77 0.00 0.00 57.85 56.72 1i43 n ARG 102 Cb 0.66 -1.30 -0.10 0.00 -1.02 0.00 0.00 32.46 30.70 1i43 n ARG 102 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1i43 s ARG 103 N -2.68 0.71 -0.05 5.56 3.52 -1.18 -4.88 118.95 119.94 1i43 s ARG 103 Ca 0.03 -1.14 -0.03 0.00 -0.13 0.00 0.00 55.73 54.46 1i43 s ARG 103 Cb 0.12 -0.18 -0.04 0.00 -1.56 0.00 0.00 34.95 33.29 1i43 s ARG 103 CO 0.68 -0.01 0.10 0.00 -0.81 0.00 0.00 175.30 175.26 1i43 s ALA 104 N -2.96 3.67 -0.30 6.12 0.00 -1.26 -4.47 121.76 122.55 1i43 s ALA 104 Ca 0.04 -0.78 -0.27 0.00 0.00 0.00 0.00 51.96 50.96 1i43 s ALA 104 Cb 0.01 -1.71 0.20 0.00 0.00 0.00 0.00 23.12 21.61 1i43 s ALA 104 CO -0.04 0.66 1.45 0.45 0.00 0.00 0.00 175.76 178.28 1i43 s SER 105 N -1.42 -0.01 0.41 0.00 0.15 -1.26 -5.02 113.70 106.56 1i43 s SER 105 Ca 0.20 0.01 0.23 0.00 0.70 0.00 0.00 55.95 57.08 1i43 s SER 105 Cb -0.12 0.01 0.30 0.00 -1.71 0.00 0.00 66.02 64.50 1i43 s SER 105 CO 0.10 -0.00 1.55 -0.26 1.20 0.00 0.00 173.24 175.82 1i43 h PHE 106 N 2.56 0.00 0.00 3.44 0.04 -1.94 -3.47 116.94 117.58 1i43 h PHE 106 Ca -0.18 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.59 1i43 h PHE 106 Cb 1.20 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.35 1i43 h PHE 106 CO 0.20 0.01 0.00 -1.91 -0.60 0.00 0.00 178.31 176.01 1i43 n GLU 107 N -3.06 0.00 -4.62 1.51 2.13 -1.26 -4.59 120.64 110.75 1i43 n GLU 107 Ca 0.04 0.00 -0.28 0.00 0.66 0.00 0.00 57.16 57.57 1i43 n GLU 107 Cb 0.54 0.00 -0.14 0.00 0.27 0.00 0.00 31.44 32.11 1i43 n GLU 107 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1i43 s TYR 108 N 0.00 2.20 0.41 4.31 5.04 -1.26 -1.68 117.35 126.37 1i43 s TYR 108 Ca 0.00 -0.40 0.13 0.00 -2.44 0.00 0.00 57.07 54.37 1i43 s TYR 108 Cb 0.00 -1.26 0.98 0.00 0.35 0.00 0.00 41.96 42.03 1i43 s TYR 108 CO 0.00 0.21 1.93 0.78 -1.34 0.00 0.00 175.55 177.13 1i43 h GLY 109 N 4.40 0.77 2.00 8.97 0.00 -1.46 0.17 103.07 117.92 1i43 h GLY 109 Ca -0.48 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.65 1i43 h GLY 109 CO 0.42 0.09 0.00 -2.13 0.00 0.00 0.00 176.54 174.92 1i43 n ARG 110 N -4.49 0.18 -0.09 4.80 0.63 -1.26 -1.93 116.66 114.51 1i43 n ARG 110 Ca 0.13 0.53 0.10 0.00 -0.92 0.00 0.00 57.85 57.70 1i43 n ARG 110 Cb 0.45 -1.93 0.14 0.00 0.45 0.00 0.00 32.46 31.57 1i43 n ARG 110 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1i43 n TYR 111 N -2.28 0.22 0.00 -0.14 4.01 0.04 -4.73 117.16 114.29 1i43 n TYR 111 Ca 0.00 -0.13 0.00 0.00 -0.16 0.00 0.00 57.90 57.62 1i43 n TYR 111 Cb 0.14 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 1i43 n TYR 111 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i43 n GLY 112 N 1.24 0.71 3.64 2.72 0.00 -0.81 -4.95 105.19 107.74 1i43 n GLY 112 Ca 0.15 -1.60 -0.07 0.00 0.00 0.00 0.00 46.02 44.50 1i43 n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1i43 s ASN 113 N 0.00 -0.43 0.21 1.61 3.84 -1.26 -4.42 114.94 114.48 1i43 s ASN 113 Ca 0.00 0.80 -0.10 0.00 0.21 0.00 0.00 52.86 53.77 1i43 s ASN 113 Cb 0.00 0.88 0.27 0.00 -0.55 0.00 0.00 41.25 41.85 1i43 s ASN 113 CO 0.00 -0.14 1.73 1.55 -2.79 0.00 0.00 177.10 177.46 1i43 h PRO 114 N 4.45 0.35 0.00 0.43 0.13 -1.96 -0.04 132.00 135.36 1i43 h PRO 114 Ca -0.28 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1i43 h PRO 114 Cb 1.18 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1i43 h PRO 114 CO 0.13 0.23 0.00 -2.37 -0.23 0.00 0.00 178.00 175.76 1i43 n THR 115 N -5.03 0.49 -0.02 1.56 5.66 -1.26 -3.37 114.28 112.31 1i43 n THR 115 Ca 0.08 0.10 -0.22 0.00 -3.05 0.00 0.00 64.05 60.96 1i43 n THR 115 Cb 0.28 -0.75 -0.13 0.00 -1.55 0.00 0.00 70.33 68.18 1i43 n THR 115 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1i43 n THR 116 N -1.59 1.74 -0.10 1.09 -1.04 -0.15 -4.17 114.28 110.04 1i43 n THR 116 Ca 0.05 -0.52 0.05 0.00 -2.04 0.00 0.00 64.05 61.58 1i43 n THR 116 Cb 0.27 -1.81 0.37 0.00 -1.82 0.00 0.00 70.33 67.35 1i43 n THR 116 CO 0.00 0.00 0.00 -0.37 -0.64 0.00 0.00 175.07 174.06 1i43 h VAL 117 N -0.16 1.08 -0.51 12.58 -1.51 -1.23 -2.02 116.25 124.49 1i43 h VAL 117 Ca -0.41 -0.24 0.10 0.00 -1.23 0.00 0.00 66.70 64.92 1i43 h VAL 117 Cb 1.88 0.32 -0.08 0.00 -2.13 0.00 0.00 31.29 31.28 1i43 h VAL 117 CO 0.03 0.13 0.01 0.58 -1.23 0.00 0.00 177.57 177.08 1i43 h VAL 118 N 0.70 0.60 -0.01 7.19 2.07 -1.72 0.23 116.25 125.31 1i43 h VAL 118 Ca 0.23 -0.04 -0.07 0.00 0.82 0.00 0.00 66.70 67.64 1i43 h VAL 118 Cb 0.07 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1i43 h VAL 118 CO -0.06 0.02 -0.32 0.25 0.02 0.00 0.00 177.57 177.48 1i43 h LEU 119 N 0.13 0.01 -0.10 2.57 5.85 -1.56 -0.46 115.31 121.75 1i43 h LEU 119 Ca 0.26 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 1i43 h LEU 119 Cb 0.39 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.42 1i43 h LEU 119 CO -0.42 0.33 -0.01 -0.33 -0.34 0.00 0.00 178.44 177.67 1i43 h GLU 120 N 0.01 0.19 -0.08 1.25 5.08 -0.25 -1.69 114.58 119.08 1i43 h GLU 120 Ca -0.00 -0.06 -0.13 0.00 -1.00 0.00 0.00 59.36 58.16 1i43 h GLU 120 Cb 0.57 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1i43 h GLU 120 CO 0.04 0.47 -0.54 0.93 -1.00 0.00 0.00 179.01 178.91 1i43 h GLU 121 N -0.12 0.23 0.16 2.33 5.08 -0.73 -0.87 114.58 120.67 1i43 h GLU 121 Ca 0.03 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1i43 h GLU 121 Cb 0.39 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1i43 h GLU 121 CO 0.01 0.71 -0.08 -0.22 -1.00 0.00 0.00 179.01 178.43 1i43 h LYS 122 N 0.18 -0.21 -0.35 2.33 3.64 -0.98 -0.97 116.57 120.21 1i43 h LYS 122 Ca 0.00 0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.29 1i43 h LYS 122 Cb 1.01 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 1i43 h LYS 122 CO 0.08 -0.07 -0.24 0.82 -2.27 0.00 0.00 179.45 177.78 1i43 h ILE 123 N -0.31 1.27 -0.34 2.00 2.04 -1.30 -2.48 117.51 118.40 1i43 h ILE 123 Ca -0.02 -1.33 0.04 0.00 1.00 0.00 0.00 64.86 64.55 1i43 h ILE 123 Cb 0.24 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 1i43 h ILE 123 CO 0.04 0.44 0.23 0.28 0.00 0.00 0.00 178.15 179.13 1i43 h SER 124 N 0.60 0.27 -0.03 1.72 0.02 -0.90 -1.63 113.55 113.60 1i43 h SER 124 Ca 0.08 -0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.94 1i43 h SER 124 Cb 0.72 -0.06 0.01 0.00 0.14 0.00 0.00 62.40 63.20 1i43 h SER 124 CO 0.06 0.18 -0.32 0.00 -1.14 0.00 0.00 176.83 175.61 1i43 h ALA 125 N 1.81 0.08 -0.20 3.77 0.00 -0.73 0.52 119.26 124.52 1i43 h ALA 125 Ca 0.14 -0.46 0.01 0.00 0.00 0.00 0.00 54.91 54.60 1i43 h ALA 125 Cb 0.17 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1i43 h ALA 125 CO -0.03 0.16 0.10 -0.07 0.00 0.00 0.00 179.25 179.41 1i43 h LEU 126 N -0.29 0.16 0.00 0.00 3.38 -1.18 -1.21 115.31 116.18 1i43 h LEU 126 Ca -0.03 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1i43 h LEU 126 Cb 1.02 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.74 1i43 h LEU 126 CO 0.07 0.12 0.00 -0.62 0.09 0.00 0.00 178.44 178.10 1i43 n GLU 127 N -4.99 0.50 -2.98 1.13 -0.58 -0.65 -4.88 120.64 108.19 1i43 n GLU 127 Ca -0.03 0.02 -0.22 0.00 -0.42 0.00 0.00 57.16 56.50 1i43 n GLU 127 Cb 0.05 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 29.44 1i43 n GLU 127 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1i43 n GLY 128 N 1.06 -0.52 3.95 0.62 0.00 -0.46 -4.77 105.19 105.08 1i43 n GLY 128 Ca 0.15 0.11 -0.24 0.00 0.00 0.00 0.00 46.02 46.04 1i43 n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i43 s ALA 129 N -3.13 3.41 0.03 4.61 0.00 0.17 -5.00 121.76 121.87 1i43 s ALA 129 Ca 0.28 -1.09 0.08 0.00 0.00 0.00 0.00 51.96 51.22 1i43 s ALA 129 Cb -0.13 -2.40 -0.23 0.00 0.00 0.00 0.00 23.12 20.36 1i43 s ALA 129 CO 0.34 -1.14 0.94 1.49 0.00 0.00 0.00 175.76 177.39 1i43 h GLU 130 N -0.39 0.03 -1.72 0.00 4.81 -1.80 -3.44 114.58 112.08 1i43 h GLU 130 Ca -0.43 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 58.77 1i43 h GLU 130 Cb 1.31 0.02 -0.22 0.00 0.63 0.00 0.00 28.75 30.49 1i43 h GLU 130 CO 0.56 0.79 0.40 0.45 -0.73 0.00 0.00 179.01 180.49 1i43 s SER 131 N -6.47 -0.49 -0.01 1.04 0.15 -0.82 -4.78 113.70 102.33 1i43 s SER 131 Ca -0.03 0.64 0.05 0.00 0.70 0.00 0.00 55.95 57.30 1i43 s SER 131 Cb 0.09 0.54 -0.01 0.00 -1.71 0.00 0.00 66.02 64.92 1i43 s SER 131 CO 0.83 -0.38 -0.15 -0.89 1.20 0.00 0.00 173.24 173.85 1i43 s THR 132 N -0.82 1.14 -0.05 6.45 2.01 -1.26 -1.77 115.64 121.35 1i43 s THR 132 Ca -0.03 -0.66 0.05 0.00 0.31 0.00 0.00 61.69 61.35 1i43 s THR 132 Cb -0.01 -0.96 -0.02 0.00 0.01 0.00 0.00 72.50 71.51 1i43 s THR 132 CO 0.03 0.29 -0.17 -0.22 -0.69 0.00 0.00 174.62 173.85 1i43 s LEU 133 N -0.43 2.55 -0.05 4.42 2.96 0.51 -4.82 118.68 123.82 1i43 s LEU 133 Ca 0.05 -0.28 0.04 0.00 -0.22 0.00 0.00 54.13 53.73 1i43 s LEU 133 Cb -0.06 -1.50 -0.02 0.00 0.50 0.00 0.00 46.19 45.11 1i43 s LEU 133 CO -0.00 0.33 -0.17 -0.76 -1.32 0.00 0.00 176.35 174.42 1i43 s LEU 134 N -0.62 2.56 0.00 -0.68 1.43 -1.26 -1.91 118.68 118.20 1i43 s LEU 134 Ca 0.09 -0.28 0.01 0.00 -1.03 0.00 0.00 54.13 52.92 1i43 s LEU 134 Cb -0.11 -1.51 -0.00 0.00 0.03 0.00 0.00 46.19 44.60 1i43 s LEU 134 CO 0.01 0.31 0.03 0.23 0.23 0.00 0.00 176.35 177.15 1i43 n MET 135 N 2.53 1.20 0.20 1.70 2.81 -0.89 -4.58 117.12 120.08 1i43 n MET 135 Ca -0.17 -1.24 0.06 0.00 -1.81 0.00 0.00 57.70 54.54 1i43 n MET 135 Cb 0.52 0.50 0.40 0.00 -0.71 0.00 0.00 33.22 33.93 1i43 n MET 135 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1i43 h ALA 136 N 1.16 1.15 -2.18 3.04 0.00 -1.15 -2.49 119.26 118.80 1i43 h ALA 136 Ca -0.13 -0.31 0.19 0.00 0.00 0.00 0.00 54.91 54.66 1i43 h ALA 136 Cb 0.43 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.07 1i43 h ALA 136 CO 0.21 0.43 0.54 -1.54 0.00 0.00 0.00 179.25 178.89 1i43 s SER 137 N -6.55 -0.18 0.26 0.00 1.04 -1.26 -3.24 113.70 103.76 1i43 s SER 137 Ca -0.01 -0.31 -0.05 0.00 0.48 0.00 0.00 55.95 56.05 1i43 s SER 137 Cb 0.12 0.42 0.29 0.00 0.10 0.00 0.00 66.02 66.95 1i43 s SER 137 CO 0.68 -0.77 1.93 1.23 0.98 0.00 0.00 173.24 177.30 1i43 h GLY 138 N 2.00 1.39 1.03 7.32 0.00 -1.75 -2.03 103.07 111.03 1i43 h GLY 138 Ca -0.25 -0.52 -0.04 0.00 0.00 0.00 0.00 47.33 46.53 1i43 h GLY 138 CO 0.26 0.50 0.33 -0.33 0.00 0.00 0.00 176.54 177.31 1i43 h MET 139 N 1.33 1.10 -0.78 4.80 2.86 -1.92 -2.44 114.93 119.88 1i43 h MET 139 Ca 0.36 -0.18 0.02 0.00 -2.06 0.00 0.00 59.70 57.84 1i43 h MET 139 Cb -0.15 -0.19 -0.04 0.00 0.06 0.00 0.00 31.60 31.28 1i43 h MET 139 CO -0.08 0.88 0.51 0.00 1.06 0.00 0.00 176.91 179.27 1i43 h ALA 141 N 1.31 -1.15 -0.07 0.00 0.00 -0.95 0.85 119.26 119.25 1i43 h ALA 141 Ca 0.30 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1i43 h ALA 141 Cb -0.05 0.50 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1i43 h ALA 141 CO -0.09 -1.13 -0.34 0.77 0.00 0.00 0.00 179.25 178.47 1i43 h SER 142 N -0.85 -1.03 -0.27 0.00 0.02 -1.40 0.22 113.55 110.23 1i43 h SER 142 Ca -0.07 0.14 0.04 0.00 -0.84 0.00 0.00 61.79 61.06 1i43 h SER 142 Cb 0.69 0.43 -0.07 0.00 0.14 0.00 0.00 62.40 63.58 1i43 h SER 142 CO 0.05 -0.38 -0.55 0.74 -1.14 0.00 0.00 176.83 175.55 1i43 h THR 143 N -0.45 0.01 -0.79 -2.27 2.02 -1.07 0.12 112.91 110.48 1i43 h THR 143 Ca 0.08 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.24 1i43 h THR 143 Cb 0.57 0.01 -0.04 0.00 -1.74 0.00 0.00 68.15 66.95 1i43 h THR 143 CO -0.32 0.00 0.42 0.58 0.37 0.00 0.00 175.52 176.57 1i43 h VAL 144 N -0.49 1.23 -0.36 3.16 2.07 -0.57 -1.57 116.25 119.71 1i43 h VAL 144 Ca 0.06 -0.60 0.01 0.00 0.82 0.00 0.00 66.70 66.99 1i43 h VAL 144 Cb 0.64 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1i43 h VAL 144 CO -0.52 0.27 0.22 -0.03 0.02 0.00 0.00 177.57 177.53 1i43 h MET 145 N 1.10 0.44 0.20 1.57 -1.53 0.43 -1.52 114.93 115.62 1i43 h MET 145 Ca 0.28 -0.03 -0.01 0.00 -3.44 0.00 0.00 59.70 56.50 1i43 h MET 145 Cb 0.04 -0.10 0.00 0.00 -0.55 0.00 0.00 31.60 31.00 1i43 h MET 145 CO -0.04 0.29 -0.10 -0.07 0.14 0.00 0.00 176.91 177.13 1i43 h LEU 146 N 0.45 -0.23 -2.07 3.39 3.38 -0.43 -1.53 115.31 118.27 1i43 h LEU 146 Ca 0.14 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1i43 h LEU 146 Cb -0.01 0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1i43 h LEU 146 CO -0.06 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.41 1i43 h LEU 147 N -0.46 0.00 0.03 1.67 3.38 -1.19 -2.16 115.31 116.59 1i43 h LEU 147 Ca -0.03 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.57 1i43 h LEU 147 Cb 0.35 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 1i43 h LEU 147 CO 0.05 0.00 -2.15 0.00 0.09 0.00 0.00 178.44 176.43 1i43 n ALA 148 N -1.91 1.11 0.05 1.53 0.00 -0.58 -4.70 120.51 116.01 1i43 n ALA 148 Ca -0.02 -0.86 -0.22 0.00 0.00 0.00 0.00 53.44 52.34 1i43 n ALA 148 Cb 0.06 -0.27 -0.14 0.00 0.00 0.00 0.00 19.45 19.10 1i43 n ALA 148 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1i43 h LEU 149 N -0.44 0.52 -9.06 0.00 3.38 -1.21 -3.45 115.31 105.05 1i43 h LEU 149 Ca -0.53 -0.90 -0.58 0.00 0.09 0.00 0.00 57.88 55.95 1i43 h LEU 149 Cb 1.75 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 42.26 1i43 h LEU 149 CO -0.16 1.67 0.75 -0.69 0.09 0.00 0.00 178.44 180.11 1i43 s VAL 150 N -2.52 4.69 1.08 1.22 1.01 -0.82 -5.04 120.40 120.02 1i43 s VAL 150 Ca -0.17 1.94 -0.18 0.00 0.00 0.00 0.00 61.98 63.57 1i43 s VAL 150 Cb 0.04 -4.29 0.25 0.00 0.00 0.00 0.00 36.38 32.38 1i43 s VAL 150 CO 0.82 -0.19 1.25 -2.84 0.00 0.00 0.00 175.10 174.15 1i43 s PRO 151 N 3.18 -0.26 0.24 2.72 0.02 -1.26 -4.77 135.00 134.87 1i43 s PRO 151 Ca 0.43 -0.35 -0.30 0.00 0.02 0.00 0.00 61.00 60.80 1i43 s PRO 151 Cb -0.15 -1.74 -0.09 0.00 0.02 0.00 0.00 34.50 32.55 1i43 s PRO 151 CO 0.07 -3.03 1.11 0.00 -0.33 0.00 0.00 177.00 174.82 1i43 s ALA 152 N -3.58 3.40 0.00 -1.55 0.00 -1.26 -2.79 121.76 115.98 1i43 s ALA 152 Ca 0.74 0.88 0.00 0.00 0.00 0.00 0.00 51.96 53.58 1i43 s ALA 152 Cb -0.05 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.73 1i43 s ALA 152 CO 0.54 -0.20 0.00 0.41 0.00 0.00 0.00 175.76 176.52 1i43 n GLY 153 N 1.54 2.06 3.62 0.00 0.00 0.30 -4.92 105.19 107.78 1i43 n GLY 153 Ca 0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1i43 n GLY 153 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i43 s GLY 154 N -2.00 1.55 0.06 -0.02 0.00 -1.12 -4.61 107.32 101.18 1i43 s GLY 154 Ca 0.00 -0.35 0.08 0.00 0.00 0.00 0.00 44.72 44.44 1i43 s GLY 154 CO 0.00 0.31 -0.19 -1.58 0.00 0.00 0.00 173.10 171.64 1i43 s HIS 155 N -2.83 2.53 0.08 1.90 5.65 -1.26 -1.58 115.29 119.79 1i43 s HIS 155 Ca 0.66 -0.27 0.05 0.00 0.25 0.00 0.00 55.06 55.75 1i43 s HIS 155 Cb -0.20 -1.43 -0.03 0.00 -1.18 0.00 0.00 32.58 29.74 1i43 s HIS 155 CO 0.60 0.27 -0.13 -1.50 -0.65 0.00 0.00 174.74 173.33 1i43 s ILE 156 N -0.97 1.10 -0.06 0.89 2.07 -0.20 -0.52 121.20 123.51 1i43 s ILE 156 Ca 0.15 -1.40 0.03 0.00 -1.41 0.00 0.00 60.65 58.02 1i43 s ILE 156 Cb -0.10 -1.15 0.01 0.00 0.13 0.00 0.00 42.46 41.34 1i43 s ILE 156 CO 0.06 -0.30 -0.14 -0.69 -1.91 0.00 0.00 174.94 171.96 1i43 s VAL 157 N -1.55 1.24 0.33 4.00 1.01 -0.79 -0.06 120.40 124.57 1i43 s VAL 157 Ca 0.00 -0.57 -0.00 0.00 0.00 0.00 0.00 61.98 61.41 1i43 s VAL 157 Cb -0.08 -1.10 -0.01 0.00 0.00 0.00 0.00 36.38 35.19 1i43 s VAL 157 CO 0.02 0.37 0.40 0.42 0.00 0.00 0.00 175.10 176.31 1i43 s THR 158 N 0.41 0.00 0.55 3.92 -4.23 -0.59 -0.55 115.64 115.15 1i43 s THR 158 Ca -0.10 -1.73 0.05 0.00 -1.18 0.00 0.00 61.69 58.72 1i43 s THR 158 Cb -0.14 -2.58 0.06 0.00 1.34 0.00 0.00 72.50 71.18 1i43 s THR 158 CO 0.03 0.00 0.77 0.42 -0.54 0.00 0.00 174.62 175.30 1i43 s THR 159 N -3.27 2.54 -0.42 3.99 -4.23 -1.26 -0.75 115.64 112.25 1i43 s THR 159 Ca 0.34 -0.82 0.23 0.00 -1.18 0.00 0.00 61.69 60.26 1i43 s THR 159 Cb 0.01 -2.72 0.26 0.00 1.34 0.00 0.00 72.50 71.38 1i43 s THR 159 CO 0.21 0.00 1.49 0.71 -0.54 0.00 0.00 174.62 176.50 1i43 h THR 160 N 0.13 0.00 -0.38 3.99 1.35 -1.11 -3.26 112.91 113.63 1i43 h THR 160 Ca -0.38 -0.95 0.00 0.00 -0.55 0.00 0.00 66.41 64.53 1i43 h THR 160 Cb 1.28 1.84 0.00 0.00 -1.73 0.00 0.00 68.15 69.54 1i43 h THR 160 CO 0.45 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 176.19 1i43 n ASP 161 N -2.93 2.20 -4.41 5.36 9.92 -1.26 -4.97 116.55 120.45 1i43 n ASP 161 Ca 0.03 -1.96 -0.37 0.00 -0.53 0.00 0.00 54.79 51.97 1i43 n ASP 161 Cb 0.53 -0.25 0.05 0.00 -0.64 0.00 0.00 41.12 40.81 1i43 n ASP 161 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1i43 s TYR 163 N -1.90 2.85 0.04 0.00 5.04 -1.26 -4.82 117.35 117.30 1i43 s TYR 163 Ca 0.63 0.77 -0.10 0.00 -2.44 0.00 0.00 57.07 55.93 1i43 s TYR 163 Cb -0.37 -4.02 -0.03 0.00 0.35 0.00 0.00 41.96 37.89 1i43 s TYR 163 CO 0.60 -3.48 1.17 -0.09 -1.34 0.00 0.00 175.55 172.41 1i43 h ARG 164 N 5.26 -0.07 -0.70 4.97 2.43 -1.94 -0.43 114.38 123.90 1i43 h ARG 164 Ca -0.46 0.00 0.15 0.00 -0.81 0.00 0.00 59.98 58.87 1i43 h ARG 164 Cb 1.22 0.02 -0.12 0.00 -0.42 0.00 0.00 29.97 30.66 1i43 h ARG 164 CO 0.82 -0.05 0.00 0.87 -1.51 0.00 0.00 179.97 180.10 1i43 h LYS 165 N -0.07 0.11 -0.94 0.20 6.56 -1.99 0.20 116.57 120.63 1i43 h LYS 165 Ca 0.03 -0.01 0.05 0.00 -1.06 0.00 0.00 60.65 59.67 1i43 h LYS 165 Cb 0.16 -0.02 -0.06 0.00 -0.57 0.00 0.00 32.23 31.74 1i43 h LYS 165 CO -0.23 0.07 0.61 1.15 -2.06 0.00 0.00 179.45 178.99 1i43 h THR 166 N 0.11 1.11 -0.11 -0.16 2.02 -1.77 -1.48 112.91 112.63 1i43 h THR 166 Ca 0.38 -0.39 0.02 0.00 0.77 0.00 0.00 66.41 67.19 1i43 h THR 166 Cb 0.64 -0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.90 1i43 h THR 166 CO -0.61 0.21 -0.04 -0.09 0.37 0.00 0.00 175.52 175.36 1i43 h ARG 167 N 1.14 -0.02 -0.46 6.66 9.65 0.10 -1.84 114.38 129.60 1i43 h ARG 167 Ca 0.39 0.00 0.06 0.00 -1.10 0.00 0.00 59.98 59.34 1i43 h ARG 167 Cb 0.09 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 28.62 1i43 h ARG 167 CO -0.15 -0.01 0.15 0.82 2.80 0.00 0.00 179.97 183.58 1i43 h ILE 168 N -0.02 0.83 -0.94 1.20 2.04 -0.50 0.93 117.51 121.04 1i43 h ILE 168 Ca 0.06 -0.11 0.06 0.00 1.00 0.00 0.00 64.86 65.87 1i43 h ILE 168 Cb 0.11 0.49 -0.06 0.00 -0.74 0.00 0.00 36.82 36.61 1i43 h ILE 168 CO -0.12 0.06 0.60 0.15 0.00 0.00 0.00 178.15 178.83 1i43 h PHE 169 N 0.31 1.11 -0.00 1.37 3.57 -0.89 0.17 116.94 122.57 1i43 h PHE 169 Ca 0.22 0.03 -0.17 0.00 3.53 0.00 0.00 57.97 61.58 1i43 h PHE 169 Cb 0.24 -0.36 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 1i43 h PHE 169 CO -0.17 0.57 -0.80 0.82 -2.23 0.00 0.00 178.31 176.50 1i43 h ILE 170 N 1.08 1.52 -0.00 1.41 2.04 -0.51 -1.67 117.51 121.38 1i43 h ILE 170 Ca 0.41 -2.58 0.00 0.00 1.00 0.00 0.00 64.86 63.68 1i43 h ILE 170 Cb 0.17 2.41 0.00 0.00 -0.74 0.00 0.00 36.82 38.66 1i43 h ILE 170 CO -0.17 0.74 -0.50 -0.62 0.00 0.00 0.00 178.15 177.60 1i43 n GLU 171 N -3.65 0.40 0.00 2.37 1.02 0.24 -4.25 120.64 116.76 1i43 n GLU 171 Ca -0.02 -0.27 0.00 0.00 -0.02 0.00 0.00 57.16 56.86 1i43 n GLU 171 Cb 0.76 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.68 1i43 n GLU 171 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1i43 n THR 172 N -1.07 0.00 -0.09 2.62 -2.24 0.52 -4.84 114.28 109.18 1i43 n THR 172 Ca 0.08 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.75 1i43 n THR 172 Cb 0.35 -0.52 -0.04 0.00 -2.10 0.00 0.00 70.33 68.03 1i43 n THR 172 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1i43 n ILE 173 N -1.38 1.49 -0.30 2.28 2.08 -0.66 -4.60 119.36 118.28 1i43 n ILE 173 Ca 0.00 0.10 0.13 0.00 0.56 0.00 0.00 62.75 63.54 1i43 n ILE 173 Cb 0.28 -2.31 0.29 0.00 -0.75 0.00 0.00 39.64 37.15 1i43 n ILE 173 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 1i43 h LEU 174 N -1.00 0.04 -2.14 1.39 3.38 -1.67 0.19 115.31 115.51 1i43 h LEU 174 Ca -0.07 0.19 0.04 0.00 0.09 0.00 0.00 57.88 58.13 1i43 h LEU 174 Cb 1.00 0.25 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 1i43 h LEU 174 CO -0.04 -0.14 0.30 1.55 0.09 0.00 0.00 178.44 180.20 1i43 h PRO 175 N 0.23 0.00 0.00 1.13 0.13 -1.73 0.42 132.00 132.17 1i43 h PRO 175 Ca 0.55 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.63 1i43 h PRO 175 Cb 1.11 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 1i43 h PRO 175 CO -0.64 0.00 -0.25 0.87 -0.23 0.00 0.00 178.00 177.75 1i43 h LYS 176 N 0.00 0.00 -0.61 0.86 1.57 -0.86 0.50 116.57 118.03 1i43 h LYS 176 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1i43 h LYS 176 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.98 1i43 h LYS 176 CO -0.00 0.25 0.00 -1.33 -0.57 0.00 0.00 179.45 177.79 1i43 n MET 177 N -3.96 2.85 -0.99 3.15 0.00 0.14 -4.90 117.12 113.41 1i43 n MET 177 Ca -0.02 -2.24 0.00 0.00 0.00 0.00 0.00 57.70 55.44 1i43 n MET 177 Cb 0.32 -1.64 0.00 0.00 0.00 0.00 0.00 33.22 31.90 1i43 n MET 177 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1i43 n GLY 178 N 1.19 0.46 3.63 3.03 0.00 0.17 -0.54 105.19 113.13 1i43 n GLY 178 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 1i43 n GLY 178 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i43 s ILE 179 N -2.03 4.28 0.12 -0.61 1.01 -0.96 -3.44 121.20 119.57 1i43 s ILE 179 Ca 0.00 1.46 -0.01 0.00 0.00 0.00 0.00 60.65 62.10 1i43 s ILE 179 Cb 0.00 -4.25 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 1i43 s ILE 179 CO 0.00 -0.47 0.29 0.28 0.00 0.00 0.00 174.94 175.04 1i43 s THR 180 N 4.07 5.30 0.09 2.92 -1.32 -0.61 -3.48 115.64 122.59 1i43 s THR 180 Ca 0.52 -0.35 0.04 0.00 -1.21 0.00 0.00 61.69 60.69 1i43 s THR 180 Cb -0.15 -3.67 -0.03 0.00 -1.51 0.00 0.00 72.50 67.14 1i43 s THR 180 CO 0.20 0.02 -0.10 0.00 -2.21 0.00 0.00 174.62 172.52 1i43 s ALA 181 N -1.65 1.05 -0.22 11.08 0.00 -1.26 -1.04 121.76 129.72 1i43 s ALA 181 Ca 0.37 -1.10 0.01 0.00 0.00 0.00 0.00 51.96 51.24 1i43 s ALA 181 Cb -0.12 0.01 0.04 0.00 0.00 0.00 0.00 23.12 23.05 1i43 s ALA 181 CO 0.28 -0.00 -0.14 0.99 0.00 0.00 0.00 175.76 176.88 1i43 s THR 182 N -2.10 2.22 -0.28 0.00 2.01 0.91 -4.94 115.64 113.46 1i43 s THR 182 Ca 0.02 -1.23 -0.14 0.00 0.31 0.00 0.00 61.69 60.65 1i43 s THR 182 Cb -0.05 -2.11 -0.04 0.00 0.01 0.00 0.00 72.50 70.31 1i43 s THR 182 CO 0.00 0.26 0.32 -0.69 -0.69 0.00 0.00 174.62 173.82 1i43 s VAL 183 N 1.22 5.21 0.46 3.82 1.01 -1.26 -1.55 120.40 129.31 1i43 s VAL 183 Ca -0.01 0.39 0.04 0.00 0.00 0.00 0.00 61.98 62.40 1i43 s VAL 183 Cb -0.16 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.50 1i43 s VAL 183 CO -0.09 0.15 0.01 0.27 0.00 0.00 0.00 175.10 175.45 1i43 s ILE 184 N 1.97 1.59 0.29 2.22 -4.36 0.07 -4.88 121.20 118.11 1i43 s ILE 184 Ca 0.12 -2.00 -0.21 0.00 -0.26 0.00 0.00 60.65 58.30 1i43 s ILE 184 Cb -0.16 -2.60 -0.09 0.00 1.25 0.00 0.00 42.46 40.86 1i43 s ILE 184 CO 0.10 0.00 0.82 -0.62 0.24 0.00 0.00 174.94 175.48 1i43 s ASP 185 N -3.79 7.09 0.40 4.36 2.15 -1.26 -0.47 116.67 125.15 1i43 s ASP 185 Ca 0.21 1.56 0.16 0.00 0.43 0.00 0.00 52.55 54.90 1i43 s ASP 185 Cb 0.06 -2.48 1.02 0.00 -0.30 0.00 0.00 42.92 41.23 1i43 s ASP 185 CO 0.11 -0.08 1.83 -0.65 -0.17 0.00 0.00 175.17 176.22 1i43 h PRO 186 N 3.01 0.46 0.09 4.34 0.11 -1.94 -2.43 132.00 135.64 1i43 h PRO 186 Ca -0.48 -0.03 -0.31 0.00 0.11 0.00 0.00 66.00 65.29 1i43 h PRO 186 Cb 1.19 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1i43 h PRO 186 CO 0.65 0.30 -1.67 0.00 -0.21 0.00 0.00 178.00 177.07 1i43 h ALA 187 N 1.61 0.42 -0.21 -0.75 0.00 -1.93 -3.45 119.26 114.97 1i43 h ALA 187 Ca 0.50 -1.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.12 1i43 h ALA 187 Cb 1.15 0.42 -0.01 0.00 0.00 0.00 0.00 17.79 19.35 1i43 h ALA 187 CO -0.22 1.28 0.29 -3.47 0.00 0.00 0.00 179.25 177.13 1i43 n ASP 188 N -3.37 1.07 0.10 0.00 -0.08 -0.91 -4.70 116.55 108.65 1i43 n ASP 188 Ca -0.20 -1.67 -0.05 0.00 -1.51 0.00 0.00 54.79 51.35 1i43 n ASP 188 Cb 1.04 -1.50 0.05 0.00 2.34 0.00 0.00 41.12 43.06 1i43 n ASP 188 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1i43 h VAL 189 N 7.29 1.50 -0.77 5.18 2.07 -1.86 -3.12 116.25 126.53 1i43 h VAL 189 Ca 0.00 -2.51 -0.01 0.00 0.82 0.00 0.00 66.70 65.00 1i43 h VAL 189 Cb 1.01 2.37 -0.04 0.00 -1.52 0.00 0.00 31.29 33.11 1i43 h VAL 189 CO 1.07 0.73 0.44 1.23 0.02 0.00 0.00 177.57 181.06 1i43 h GLY 190 N 2.00 1.14 0.88 2.17 0.00 -1.98 0.35 103.07 107.63 1i43 h GLY 190 Ca -0.02 -0.50 0.03 0.00 0.00 0.00 0.00 47.33 46.85 1i43 h GLY 190 CO 0.11 0.48 0.54 0.00 0.00 0.00 0.00 176.54 177.67 1i43 h ALA 191 N 1.23 1.11 -0.22 3.60 0.00 -1.94 0.25 119.26 123.29 1i43 h ALA 191 Ca 0.27 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1i43 h ALA 191 Cb -0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1i43 h ALA 191 CO -0.05 0.38 0.06 1.25 0.00 0.00 0.00 179.25 180.89 1i43 h LEU 192 N 1.06 0.34 -0.67 0.00 5.85 -1.32 0.22 115.31 120.77 1i43 h LEU 192 Ca 0.34 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1i43 h LEU 192 Cb 0.00 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 1i43 h LEU 192 CO -0.11 0.47 0.39 -0.08 -0.34 0.00 0.00 178.44 178.77 1i43 h GLU 193 N 0.19 0.93 0.74 1.25 4.81 -0.30 0.25 114.58 122.44 1i43 h GLU 193 Ca 0.07 -0.10 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 1i43 h GLU 193 Cb 0.26 -0.19 0.01 0.00 0.63 0.00 0.00 28.75 29.46 1i43 h GLU 193 CO -0.00 0.68 -0.35 1.25 -0.73 0.00 0.00 179.01 179.85 1i43 h LEU 194 N 0.92 -0.84 -2.05 1.64 5.85 -0.36 -2.55 115.31 117.92 1i43 h LEU 194 Ca 0.24 0.01 0.11 0.00 0.84 0.00 0.00 57.88 59.08 1i43 h LEU 194 Cb 0.00 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 1i43 h LEU 194 CO -0.04 -0.54 0.32 0.00 -0.34 0.00 0.00 178.44 177.84 1i43 h ALA 195 N -0.90 2.25 0.00 1.25 0.00 -0.85 0.40 119.26 121.41 1i43 h ALA 195 Ca -0.10 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1i43 h ALA 195 Cb 0.78 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1i43 h ALA 195 CO 0.17 -0.51 -0.17 -0.07 0.00 0.00 0.00 179.25 178.66 1i43 h LEU 196 N 0.00 0.00 0.01 0.00 -0.00 -0.55 -3.18 115.31 111.59 1i43 h LEU 196 Ca 0.18 0.00 -0.39 0.00 -0.00 0.00 0.00 57.88 57.68 1i43 h LEU 196 Cb 0.81 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 41.41 1i43 h LEU 196 CO -0.00 0.17 -2.44 0.59 -0.00 0.00 0.00 178.44 176.76 1i43 n ASN 197 N -3.43 1.89 0.00 -0.43 3.02 0.13 -4.67 115.26 111.77 1i43 n ASN 197 Ca -0.00 -0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.44 1i43 n ASN 197 Cb 0.35 -0.37 0.00 0.00 -0.61 0.00 0.00 39.78 39.15 1i43 n ASN 197 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i43 n GLN 198 N -3.25 0.00 -2.39 3.52 6.02 -0.23 -4.83 117.38 116.22 1i43 n GLN 198 Ca -0.44 0.06 -0.25 0.00 -0.01 0.00 0.00 57.00 56.35 1i43 n GLN 198 Cb 1.00 -1.01 0.05 0.00 1.02 0.00 0.00 30.24 31.30 1i43 n GLN 198 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1i43 s LYS 199 N -1.13 2.59 -0.88 -1.09 3.01 -1.20 -5.01 119.74 116.03 1i43 s LYS 199 Ca 0.00 -0.24 -0.17 0.00 -1.01 0.00 0.00 55.97 54.55 1i43 s LYS 199 Cb 0.00 -2.28 0.16 0.00 -1.01 0.00 0.00 37.83 34.70 1i43 s LYS 199 CO 0.00 -0.89 0.99 0.21 0.51 0.00 0.00 175.35 176.17 1i43 s LYS 200 N -5.03 3.57 0.23 1.68 2.20 -1.26 -4.59 119.74 116.53 1i43 s LYS 200 Ca 0.56 -1.95 -0.31 0.00 -0.36 0.00 0.00 55.97 53.91 1i43 s LYS 200 Cb -0.11 -4.72 -0.11 0.00 -1.51 0.00 0.00 37.83 31.39 1i43 s LYS 200 CO 0.44 -1.61 1.57 0.08 -0.36 0.00 0.00 175.35 175.47 1i43 s VAL 201 N 1.90 2.37 -0.13 4.02 1.01 -1.26 -4.17 120.40 124.14 1i43 s VAL 201 Ca 0.27 0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.54 1i43 s VAL 201 Cb -0.08 -3.18 -0.24 0.00 0.00 0.00 0.00 36.38 32.88 1i43 s VAL 201 CO -0.08 0.03 0.34 0.59 0.00 0.00 0.00 175.10 175.98 1i43 n ASN 202 N 3.10 1.69 -3.61 3.32 4.13 0.32 -4.24 115.26 119.97 1i43 n ASN 202 Ca 0.11 0.20 -0.12 0.00 1.68 0.00 0.00 54.58 56.45 1i43 n ASN 202 Cb 0.38 -0.51 -0.07 0.00 -1.54 0.00 0.00 39.78 38.05 1i43 n ASN 202 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1i43 s LEU 203 N -6.66 -0.57 -0.29 3.41 0.20 -1.24 -2.04 118.68 111.48 1i43 s LEU 203 Ca -0.19 1.00 -0.08 0.00 0.69 0.00 0.00 54.13 55.55 1i43 s LEU 203 Cb 0.07 2.17 -0.01 0.00 -0.43 0.00 0.00 46.19 48.00 1i43 s LEU 203 CO 0.76 -0.27 0.10 0.12 -0.29 0.00 0.00 176.35 176.78 1i43 s PHE 204 N -0.06 3.14 -0.08 5.38 5.36 0.51 -1.89 117.98 130.33 1i43 s PHE 204 Ca -0.00 -0.66 0.02 0.00 -0.96 0.00 0.00 56.93 55.33 1i43 s PHE 204 Cb -0.04 -2.28 -0.02 0.00 -0.34 0.00 0.00 43.02 40.34 1i43 s PHE 204 CO -0.01 -0.46 -0.14 0.12 -1.46 0.00 0.00 175.22 173.27 1i43 s PHE 205 N 1.58 2.75 -0.07 10.12 5.36 0.29 -1.43 117.98 136.57 1i43 s PHE 205 Ca 0.05 -0.36 -0.31 0.00 -0.96 0.00 0.00 56.93 55.35 1i43 s PHE 205 Cb -0.16 -1.72 0.12 0.00 -0.34 0.00 0.00 43.02 40.91 1i43 s PHE 205 CO 0.04 0.02 1.01 -0.08 -1.46 0.00 0.00 175.22 174.75 1i43 s THR 206 N -0.29 0.00 0.18 0.12 -1.32 -0.74 -4.01 115.64 109.58 1i43 s THR 206 Ca 0.02 0.00 0.06 0.00 -1.21 0.00 0.00 61.69 60.56 1i43 s THR 206 Cb -0.13 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.82 1i43 s THR 206 CO 0.03 0.00 0.10 -1.83 -2.21 0.00 0.00 174.62 170.70 1i43 s GLU 207 N -2.85 2.73 -0.30 7.08 -1.05 -1.26 -0.96 118.70 122.10 1i43 s GLU 207 Ca 0.07 -0.98 -0.06 0.00 -0.15 0.00 0.00 54.97 53.84 1i43 s GLU 207 Cb -0.01 -2.53 0.17 0.00 -0.44 0.00 0.00 34.13 31.32 1i43 s GLU 207 CO -0.07 0.46 0.70 0.45 0.95 0.00 0.00 175.26 177.75 1i43 s SER 208 N -3.16 -1.13 1.06 0.83 0.15 -1.13 -4.19 113.70 106.13 1i43 s SER 208 Ca 0.30 1.02 -0.12 0.00 0.70 0.00 0.00 55.95 57.85 1i43 s SER 208 Cb -0.09 2.07 0.22 0.00 -1.71 0.00 0.00 66.02 66.51 1i43 s SER 208 CO 0.22 -0.21 1.04 -2.65 1.20 0.00 0.00 173.24 172.84 1i43 n PRO 209 N 5.40 -1.57 -3.03 5.44 -0.02 -1.26 -4.47 135.00 135.48 1i43 n PRO 209 Ca -0.06 -0.41 -0.20 0.00 -2.02 0.00 0.00 63.50 60.81 1i43 n PRO 209 Cb 0.51 -2.24 0.01 0.00 -0.02 0.00 0.00 33.50 31.76 1i43 n PRO 209 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1i43 s THR 210 N -2.50 3.43 -0.09 3.45 -1.32 0.02 -4.68 115.64 113.94 1i43 s THR 210 Ca 0.67 -0.80 0.03 0.00 -1.21 0.00 0.00 61.69 60.38 1i43 s THR 210 Cb -0.24 -3.22 -0.01 0.00 -1.51 0.00 0.00 72.50 67.52 1i43 s THR 210 CO 0.62 -0.12 -0.18 0.21 -2.21 0.00 0.00 174.62 172.95 1i43 s ASN 211 N -4.29 3.66 0.00 8.08 2.47 -1.26 -0.39 114.94 123.22 1i43 s ASN 211 Ca 0.51 -0.37 0.21 0.00 0.42 0.00 0.00 52.86 53.64 1i43 s ASN 211 Cb -0.10 -1.19 0.24 0.00 -1.45 0.00 0.00 41.25 38.74 1i43 s ASN 211 CO 0.35 0.23 1.22 -0.81 -3.72 0.00 0.00 177.10 174.37 1i43 n PRO 212 N 3.07 2.08 -0.06 0.43 -0.04 -1.26 -4.73 135.00 134.49 1i43 n PRO 212 Ca -0.18 -1.89 0.10 0.00 -0.04 0.00 0.00 63.50 61.48 1i43 n PRO 212 Cb 0.52 -1.42 0.40 0.00 -0.04 0.00 0.00 33.50 32.96 1i43 n PRO 212 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1i43 n PHE 213 N 1.23 0.16 -4.02 0.54 3.72 -1.25 -4.55 117.46 113.28 1i43 n PHE 213 Ca 0.14 -0.08 -0.28 0.00 -0.05 0.00 0.00 57.45 57.18 1i43 n PHE 213 Cb 0.54 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.06 1i43 n PHE 213 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1i43 n LEU 214 N -0.01 -2.12 -4.73 4.37 4.77 0.48 -4.70 117.00 115.07 1i43 n LEU 214 Ca 0.15 -0.99 -0.41 0.00 -0.03 0.00 0.00 56.01 54.72 1i43 n LEU 214 Cb 0.24 -2.21 -0.04 0.00 -2.33 0.00 0.00 43.42 39.08 1i43 n LEU 214 CO 0.12 0.40 0.75 -0.13 -1.33 0.00 0.00 177.39 177.19 1i43 s ARG 215 N -6.66 4.63 0.12 3.23 1.81 -1.25 -4.26 118.95 116.56 1i43 s ARG 215 Ca 0.24 1.62 0.04 0.00 -1.72 0.00 0.00 55.73 55.91 1i43 s ARG 215 Cb -0.13 -3.32 -0.04 0.00 -0.45 0.00 0.00 34.95 31.02 1i43 s ARG 215 CO 0.89 0.12 0.10 0.00 -0.68 0.00 0.00 175.30 175.73 1i43 s VAL 217 N -1.54 2.45 -0.91 0.00 1.01 -1.26 -4.77 120.40 115.37 1i43 s VAL 217 Ca 0.30 -0.90 -0.25 0.00 0.00 0.00 0.00 61.98 61.13 1i43 s VAL 217 Cb -0.11 -1.95 -0.08 0.00 0.00 0.00 0.00 36.38 34.24 1i43 s VAL 217 CO 0.22 0.56 2.06 -0.62 0.00 0.00 0.00 175.10 177.32 1i43 s ASP 218 N 0.07 4.77 0.17 3.32 -1.08 -1.26 -4.79 116.67 117.88 1i43 s ASP 218 Ca -0.09 -0.62 -0.18 0.00 -0.52 0.00 0.00 52.55 51.14 1i43 s ASP 218 Cb -0.15 -2.56 0.11 0.00 -1.46 0.00 0.00 42.92 38.85 1i43 s ASP 218 CO 0.05 -3.12 1.65 0.40 0.52 0.00 0.00 175.17 174.67 1i43 h ILE 219 N 7.23 0.50 -0.45 4.11 2.04 -1.96 -0.57 117.51 128.42 1i43 h ILE 219 Ca 0.08 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.02 1i43 h ILE 219 Cb 1.00 0.50 -0.07 0.00 -0.74 0.00 0.00 36.82 37.51 1i43 h ILE 219 CO 1.16 0.00 0.03 -0.08 0.00 0.00 0.00 178.15 179.26 1i43 h GLU 220 N -0.06 0.15 0.66 2.37 4.81 -1.86 0.23 114.58 120.87 1i43 h GLU 220 Ca 0.20 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.39 1i43 h GLU 220 Cb 0.37 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.72 1i43 h GLU 220 CO -0.45 0.10 -0.32 1.25 -0.73 0.00 0.00 179.01 178.86 1i43 h LEU 221 N 0.15 -0.75 -1.00 1.64 5.85 -1.74 -2.87 115.31 116.60 1i43 h LEU 221 Ca 0.22 0.03 0.26 0.00 0.84 0.00 0.00 57.88 59.22 1i43 h LEU 221 Cb 0.31 0.19 -0.13 0.00 0.37 0.00 0.00 40.66 41.40 1i43 h LEU 221 CO -0.34 -0.40 0.57 0.58 -0.34 0.00 0.00 178.44 178.52 1i43 h VAL 222 N -1.16 0.49 -0.10 1.05 2.07 -1.02 -0.04 116.25 117.54 1i43 h VAL 222 Ca -0.09 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 1i43 h VAL 222 Cb 0.68 -0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1i43 h VAL 222 CO 0.15 0.10 0.05 0.28 0.02 0.00 0.00 177.57 178.16 1i43 h SER 223 N 0.52 0.13 0.17 0.57 0.02 -0.96 -2.09 113.55 111.91 1i43 h SER 223 Ca 0.66 -0.13 0.02 0.00 -0.84 0.00 0.00 61.79 61.49 1i43 h SER 223 Cb 1.29 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 63.76 1i43 h SER 223 CO -0.50 0.22 -0.34 0.50 -1.14 0.00 0.00 176.83 175.57 1i43 h LYS 224 N 0.03 -0.57 -0.66 3.45 3.64 -0.79 0.16 116.57 121.82 1i43 h LYS 224 Ca 0.03 0.04 0.13 0.00 -1.27 0.00 0.00 60.65 59.58 1i43 h LYS 224 Cb 0.13 0.13 -0.09 0.00 -0.41 0.00 0.00 32.23 31.99 1i43 h LYS 224 CO -0.00 -0.38 0.17 -0.07 -2.27 0.00 0.00 179.45 176.90 1i43 h LEU 225 N -0.60 0.06 -0.24 5.20 3.38 -1.35 -1.21 115.31 120.56 1i43 h LEU 225 Ca 0.02 0.12 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 1i43 h LEU 225 Cb 0.60 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 1i43 h LEU 225 CO -0.17 0.02 -0.04 0.00 0.09 0.00 0.00 178.44 178.34 1i43 h HIS 227 N 0.21 0.00 -0.51 0.00 3.86 -0.24 0.11 115.15 118.58 1i43 h HIS 227 Ca 0.06 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.19 1i43 h HIS 227 Cb 0.49 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.95 1i43 h HIS 227 CO 0.05 0.11 -0.01 1.49 0.86 0.00 0.00 177.93 180.43 1i43 h GLU 228 N 0.00 0.90 -0.35 2.45 4.81 -1.07 -2.92 114.58 118.40 1i43 h GLU 228 Ca -0.00 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1i43 h GLU 228 Cb 0.30 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.61 1i43 h GLU 228 CO 0.01 0.93 0.00 1.63 -0.73 0.00 0.00 179.01 180.86 1i43 n LYS 229 N -4.30 2.09 -0.87 1.92 4.76 -0.79 -4.94 118.16 116.03 1i43 n LYS 229 Ca 0.01 -1.66 0.00 0.00 -2.87 0.00 0.00 58.31 53.79 1i43 n LYS 229 Cb 0.32 -1.42 0.00 0.00 -1.84 0.00 0.00 35.03 32.09 1i43 n LYS 229 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1i43 n GLY 230 N 1.28 0.58 3.87 0.72 0.00 -0.58 -4.89 105.19 106.17 1i43 n GLY 230 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1i43 n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i43 s ALA 231 N -2.07 3.17 0.06 4.61 0.00 0.28 -4.92 121.76 122.90 1i43 s ALA 231 Ca 0.00 -0.09 0.01 0.00 0.00 0.00 0.00 51.96 51.87 1i43 s ALA 231 Cb 0.00 -2.96 -0.04 0.00 0.00 0.00 0.00 23.12 20.12 1i43 s ALA 231 CO 0.00 -0.41 0.18 -0.51 0.00 0.00 0.00 175.76 175.02 1i43 s LEU 232 N -4.61 4.25 -0.14 0.00 1.43 -0.87 -4.01 118.68 114.73 1i43 s LEU 232 Ca 0.54 0.21 0.03 0.00 -1.03 0.00 0.00 54.13 53.88 1i43 s LEU 232 Cb -0.10 -2.86 0.01 0.00 0.03 0.00 0.00 46.19 43.27 1i43 s LEU 232 CO 0.43 0.17 -0.22 -0.69 0.23 0.00 0.00 176.35 176.27 1i43 s VAL 233 N -1.48 2.06 -0.12 -1.59 1.01 -1.26 0.19 120.40 119.21 1i43 s VAL 233 Ca 0.34 -0.98 -0.00 0.00 0.00 0.00 0.00 61.98 61.33 1i43 s VAL 233 Cb -0.13 -1.82 0.02 0.00 0.00 0.00 0.00 36.38 34.46 1i43 s VAL 233 CO 0.27 0.55 -0.09 0.00 0.00 0.00 0.00 175.10 175.83 1i43 s ILE 235 N 1.66 4.17 -0.79 0.00 -1.09 -0.53 -1.80 121.20 122.82 1i43 s ILE 235 Ca 0.05 -0.47 -0.09 0.00 -2.23 0.00 0.00 60.65 57.91 1i43 s ILE 235 Cb -0.13 -2.81 0.20 0.00 -1.58 0.00 0.00 42.46 38.15 1i43 s ILE 235 CO -0.09 0.48 0.68 -0.62 -1.23 0.00 0.00 174.94 174.16 1i43 s ASP 236 N -1.26 6.23 -0.03 3.58 -1.08 -0.13 -0.82 116.67 123.16 1i43 s ASP 236 Ca 0.17 -2.89 0.00 0.00 -0.52 0.00 0.00 52.55 49.31 1i43 s ASP 236 Cb -0.11 -2.07 0.05 0.00 -1.46 0.00 0.00 42.92 39.33 1i43 s ASP 236 CO 0.07 -0.45 0.97 0.61 0.52 0.00 0.00 175.17 176.88 1i43 n GLY 237 N 3.59 2.07 0.44 2.66 0.00 -0.94 -2.82 105.19 110.20 1i43 n GLY 237 Ca 0.13 -0.08 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 1i43 n GLY 237 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1i43 h THR 238 N 0.13 0.07 -0.34 2.61 2.02 -1.88 0.18 112.91 115.69 1i43 h THR 238 Ca 0.04 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.19 1i43 h THR 238 Cb 1.03 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.49 1i43 h THR 238 CO 0.08 0.00 0.10 -0.26 0.37 0.00 0.00 175.52 175.81 1i43 h PHE 239 N -0.60 0.49 0.02 3.16 0.04 -1.84 -3.23 116.94 114.99 1i43 h PHE 239 Ca 0.04 -0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.79 1i43 h PHE 239 Cb 0.68 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.68 1i43 h PHE 239 CO -0.50 0.42 -0.01 0.00 -0.60 0.00 0.00 178.31 177.62 1i43 h ALA 240 N 1.63 -0.02 0.00 2.45 0.00 -1.59 -3.41 119.26 118.30 1i43 h ALA 240 Ca 0.12 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1i43 h ALA 240 Cb 0.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1i43 h ALA 240 CO -0.01 -0.14 0.00 2.41 0.00 0.00 0.00 179.25 181.51 1i43 n THR 241 N -4.75 -0.47 0.43 0.00 -1.04 0.56 -3.83 114.28 105.17 1i43 n THR 241 Ca -0.09 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 61.96 1i43 n THR 241 Cb 0.35 0.00 0.20 0.00 -1.82 0.00 0.00 70.33 69.06 1i43 n THR 241 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1i43 n PRO 242 N -0.44 0.21 -0.04 -2.82 -0.04 -1.26 -2.12 135.00 128.48 1i43 n PRO 242 Ca 0.00 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.30 1i43 n PRO 242 Cb 0.00 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 31.82 1i43 n PRO 242 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1i43 n LEU 243 N -1.00 1.91 0.16 1.53 4.77 -1.26 -4.34 117.00 118.76 1i43 n LEU 243 Ca 0.05 0.16 0.09 0.00 -0.03 0.00 0.00 56.01 56.28 1i43 n LEU 243 Cb 0.02 -0.53 0.08 0.00 -2.33 0.00 0.00 43.42 40.66 1i43 n LEU 243 CO 0.04 0.71 0.45 0.78 -1.33 0.00 0.00 177.39 178.03 1i43 h ASN 244 N 0.03 0.00 -4.80 -1.43 2.35 -1.53 -3.46 115.58 106.74 1i43 h ASN 244 Ca -0.44 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.26 1i43 h ASN 244 Cb 2.03 0.00 -0.19 0.00 0.05 0.00 0.00 38.32 40.21 1i43 h ASN 244 CO 0.04 0.16 0.17 0.00 -1.65 0.00 0.00 177.43 176.15 1i43 s GLN 245 N -3.17 1.01 -0.79 0.81 -2.07 -1.15 -0.92 119.66 113.37 1i43 s GLN 245 Ca 0.04 0.40 0.02 0.00 -1.82 0.00 0.00 55.36 54.00 1i43 s GLN 245 Cb 0.07 0.48 0.21 0.00 -1.09 0.00 0.00 33.01 32.68 1i43 s GLN 245 CO 0.73 -0.28 0.72 1.63 -1.32 0.00 0.00 175.29 176.77 1i43 n LYS 246 N 1.27 2.46 -0.33 9.60 4.76 -1.26 -4.41 118.16 130.24 1i43 n LYS 246 Ca -0.18 -4.53 0.21 0.00 -2.87 0.00 0.00 58.31 50.94 1i43 n LYS 246 Cb 0.57 -2.34 0.47 0.00 -1.84 0.00 0.00 35.03 31.88 1i43 n LYS 246 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1i43 h ALA 247 N 5.36 2.10 -0.31 7.82 0.00 -1.93 0.13 119.26 132.42 1i43 h ALA 247 Ca 0.17 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 1i43 h ALA 247 Cb 0.74 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1i43 h ALA 247 CO 0.84 -0.53 -0.03 -0.07 0.00 0.00 0.00 179.25 179.46 1i43 h LEU 248 N 0.45 0.46 -0.30 0.00 3.38 -1.86 -2.11 115.31 115.33 1i43 h LEU 248 Ca 0.61 -0.09 -0.16 0.00 0.09 0.00 0.00 57.88 58.34 1i43 h LEU 248 Cb 1.43 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.04 1i43 h LEU 248 CO -0.36 0.55 -0.75 0.00 0.09 0.00 0.00 178.44 177.97 1i43 h ALA 249 N 1.51 0.64 0.00 1.53 0.00 -1.08 -3.10 119.26 118.75 1i43 h ALA 249 Ca 0.10 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1i43 h ALA 249 Cb 0.35 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1i43 h ALA 249 CO 0.01 0.94 0.00 1.28 0.00 0.00 0.00 179.25 181.48 1i43 n LEU 250 N -3.47 0.00 0.00 0.00 4.77 -0.78 -4.89 117.00 112.64 1i43 n LEU 250 Ca -0.00 0.43 0.00 0.00 -0.03 0.00 0.00 56.01 56.41 1i43 n LEU 250 Cb 0.78 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1i43 n LEU 250 CO 0.44 -0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1i43 n GLY 251 N 0.84 1.64 3.54 -0.72 0.00 -1.07 -3.55 105.19 105.87 1i43 n GLY 251 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 1i43 n GLY 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i43 n ALA 252 N 0.00 -0.51 0.01 4.61 0.00 -0.85 -4.93 120.51 118.84 1i43 n ALA 252 Ca 0.00 -0.01 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 1i43 n ALA 252 Cb 0.00 -1.96 -0.14 0.00 0.00 0.00 0.00 19.45 17.35 1i43 n ALA 252 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1i43 h ASP 253 N 0.37 0.35 -4.40 0.00 3.32 -1.63 -3.42 116.42 111.01 1i43 h ASP 253 Ca -0.47 -0.86 -0.37 0.00 0.02 0.00 0.00 57.03 55.35 1i43 h ASP 253 Cb 1.38 -0.12 -0.24 0.00 0.22 0.00 0.00 39.33 40.58 1i43 h ASP 253 CO 0.49 1.52 -0.77 -0.76 -1.72 0.00 0.00 179.24 178.00 1i43 s LEU 254 N -7.69 2.18 -0.08 1.55 1.43 -0.88 -4.02 118.68 111.16 1i43 s LEU 254 Ca -0.19 -0.44 0.01 0.00 -1.03 0.00 0.00 54.13 52.48 1i43 s LEU 254 Cb 0.03 -0.40 0.02 0.00 0.03 0.00 0.00 46.19 45.87 1i43 s LEU 254 CO 0.77 -0.04 -0.09 0.54 0.23 0.00 0.00 176.35 177.76 1i43 s VAL 255 N -0.92 0.96 0.06 -1.59 0.11 -0.40 -1.46 120.40 117.16 1i43 s VAL 255 Ca -0.02 -0.32 0.09 0.00 -2.93 0.00 0.00 61.98 58.80 1i43 s VAL 255 Cb -0.08 -0.94 -0.03 0.00 -1.53 0.00 0.00 36.38 33.80 1i43 s VAL 255 CO 0.01 0.33 -0.25 -1.48 -3.33 0.00 0.00 175.10 170.39 1i43 s LEU 256 N 1.19 2.20 0.00 2.54 0.05 0.00 -0.88 118.68 123.77 1i43 s LEU 256 Ca -0.05 -0.61 0.02 0.00 0.05 0.00 0.00 54.13 53.54 1i43 s LEU 256 Cb -0.14 -1.16 -0.01 0.00 -2.05 0.00 0.00 46.19 42.83 1i43 s LEU 256 CO -0.02 0.20 0.08 1.41 -0.55 0.00 0.00 176.35 177.47 1i43 n HIS 257 N 1.60 0.67 -3.70 3.48 8.25 0.31 -2.21 115.22 123.62 1i43 n HIS 257 Ca -0.17 -2.67 -0.29 0.00 -0.26 0.00 0.00 57.72 54.32 1i43 n HIS 257 Cb 0.53 -0.17 -0.13 0.00 1.12 0.00 0.00 29.99 31.34 1i43 n HIS 257 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1i43 s SER 258 N -3.76 3.55 0.60 0.41 0.15 -1.26 -1.90 113.70 111.49 1i43 s SER 258 Ca 0.11 -2.87 0.18 0.00 0.70 0.00 0.00 55.95 54.08 1i43 s SER 258 Cb 0.01 -1.06 1.00 0.00 -1.71 0.00 0.00 66.02 64.25 1i43 s SER 258 CO 0.08 -0.23 1.53 0.00 1.20 0.00 0.00 173.24 175.83 1i43 h ALA 259 N 6.40 1.49 0.00 5.45 0.00 -1.72 0.15 119.26 131.02 1i43 h ALA 259 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1i43 h ALA 259 Cb 0.90 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1i43 h ALA 259 CO 0.51 -0.49 -0.01 1.15 0.00 0.00 0.00 179.25 180.41 1i43 h THR 260 N 0.00 0.20 0.00 0.00 2.02 -1.74 0.25 112.91 113.63 1i43 h THR 260 Ca 0.00 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.14 1i43 h THR 260 Cb 1.04 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.48 1i43 h THR 260 CO 0.00 0.01 0.00 0.29 0.37 0.00 0.00 175.52 176.19 1i43 n LYS 261 N -3.35 0.00 0.10 6.66 4.76 0.51 -4.67 118.16 122.17 1i43 n LYS 261 Ca -0.03 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.19 1i43 n LYS 261 Cb 0.09 0.00 -0.15 0.00 -1.84 0.00 0.00 35.03 33.13 1i43 n LYS 261 CO 0.00 0.00 0.00 0.74 -1.37 0.00 0.00 177.40 176.77 1i43 h PHE 262 N 0.00 0.76 -0.46 2.13 0.04 -1.74 -2.11 116.94 115.56 1i43 h PHE 262 Ca 0.00 -0.55 0.06 0.00 2.80 0.00 0.00 57.97 60.27 1i43 h PHE 262 Cb 0.00 -0.03 -0.05 0.00 2.20 0.00 0.00 35.95 38.07 1i43 h PHE 262 CO 0.00 1.44 0.16 -0.07 -0.60 0.00 0.00 178.31 179.24 1i43 h LEU 263 N -0.12 0.17 0.01 1.54 3.38 -1.81 -2.12 115.31 116.35 1i43 h LEU 263 Ca -0.20 0.05 -0.27 0.00 0.09 0.00 0.00 57.88 57.56 1i43 h LEU 263 Cb 1.90 0.04 0.01 0.00 0.09 0.00 0.00 40.66 42.70 1i43 h LEU 263 CO 0.21 0.13 -1.13 1.23 0.09 0.00 0.00 178.44 178.97 1i43 h GLY 264 N 0.34 0.52 0.00 0.83 0.00 -0.65 -3.32 103.07 100.78 1i43 h GLY 264 Ca 0.21 -1.05 0.00 0.00 0.00 0.00 0.00 47.33 46.49 1i43 h GLY 264 CO -0.22 0.93 0.00 0.61 0.00 0.00 0.00 176.54 177.86 1i43 n GLY 265 N 1.25 0.00 0.00 4.60 0.00 -0.79 -4.62 105.19 105.62 1i43 n GLY 265 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1i43 n GLY 265 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1i43 n HIS 266 N -0.98 0.00 -3.62 1.61 8.25 -1.26 -1.14 115.22 118.07 1i43 n HIS 266 Ca 0.00 -0.28 -0.21 0.00 -0.26 0.00 0.00 57.72 56.97 1i43 n HIS 266 Cb 0.21 -0.03 0.05 0.00 1.12 0.00 0.00 29.99 31.34 1i43 n HIS 266 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1i43 n ASN 267 N -0.28 -1.76 -0.49 0.41 3.02 -1.26 -4.81 115.26 110.09 1i43 n ASN 267 Ca 0.00 -0.78 0.00 0.00 -0.03 0.00 0.00 54.58 53.77 1i43 n ASN 267 Cb 0.20 -4.30 0.00 0.00 -0.61 0.00 0.00 39.78 35.07 1i43 n ASN 267 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1i43 n ASP 268 N -3.06 0.00 -3.61 6.41 5.75 -1.26 -5.12 116.55 115.66 1i43 n ASP 268 Ca -0.28 -1.52 -0.09 0.00 -0.01 0.00 0.00 54.79 52.89 1i43 n ASP 268 Cb 0.67 -0.10 -0.06 0.00 -1.03 0.00 0.00 41.12 40.60 1i43 n ASP 268 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1i43 s VAL 269 N 0.00 0.00 0.06 2.12 0.11 -1.26 -5.11 120.40 116.32 1i43 s VAL 269 Ca 0.00 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.08 1i43 s VAL 269 Cb 0.00 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.81 1i43 s VAL 269 CO 0.00 0.00 0.02 -0.76 -3.33 0.00 0.00 175.10 171.03 1i43 s LEU 270 N -0.50 3.58 -0.20 2.54 1.43 -1.26 -4.27 118.68 120.01 1i43 s LEU 270 Ca 0.01 -0.07 -0.30 0.00 -1.03 0.00 0.00 54.13 52.74 1i43 s LEU 270 Cb -0.03 -2.22 0.15 0.00 0.03 0.00 0.00 46.19 44.13 1i43 s LEU 270 CO -0.03 0.21 1.13 0.00 0.23 0.00 0.00 176.35 177.90 1i43 s ALA 271 N -1.26 -2.00 0.13 4.21 0.00 -1.20 -4.67 121.76 116.97 1i43 s ALA 271 Ca 0.25 1.68 0.06 0.00 0.00 0.00 0.00 51.96 53.94 1i43 s ALA 271 Cb -0.12 -0.93 -0.04 0.00 0.00 0.00 0.00 23.12 22.03 1i43 s ALA 271 CO 0.17 -0.31 0.00 0.20 0.00 0.00 0.00 175.76 175.82 1i43 s GLY 272 N -1.18 1.82 -0.03 0.00 0.00 -0.94 -2.02 107.32 104.97 1i43 s GLY 272 Ca 0.03 -1.23 0.00 0.00 0.00 0.00 0.00 44.72 43.53 1i43 s GLY 272 CO -0.02 -1.22 -0.01 0.00 0.00 0.00 0.00 173.10 171.85 1i43 s ILE 274 N 1.03 -0.13 0.12 0.00 1.01 -0.80 -0.53 121.20 121.90 1i43 s ILE 274 Ca -0.10 0.05 0.10 0.00 0.00 0.00 0.00 60.65 60.71 1i43 s ILE 274 Cb -0.14 -0.44 -0.04 0.00 0.01 0.00 0.00 42.46 41.85 1i43 s ILE 274 CO -0.01 -0.11 -0.26 -0.44 0.00 0.00 0.00 174.94 174.11 1i43 s SER 275 N 2.18 3.19 0.00 3.58 0.01 -0.06 -0.36 113.70 122.23 1i43 s SER 275 Ca 0.03 -0.72 0.00 0.00 1.31 0.00 0.00 55.95 56.57 1i43 s SER 275 Cb -0.15 -0.22 0.00 0.00 0.21 0.00 0.00 66.02 65.87 1i43 s SER 275 CO -0.07 0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.36 1i43 n GLY 276 N 1.04 -0.96 3.70 3.44 0.00 -0.73 -1.28 105.19 110.40 1i43 n GLY 276 Ca -0.18 -1.04 -0.31 0.00 0.00 0.00 0.00 46.02 44.48 1i43 n GLY 276 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1i43 s PRO 277 N -1.43 1.46 0.02 1.61 0.04 -1.26 -1.94 135.00 133.49 1i43 s PRO 277 Ca 0.00 1.49 -0.27 0.00 0.04 0.00 0.00 61.00 62.26 1i43 s PRO 277 Cb 0.00 -1.78 -0.16 0.00 0.04 0.00 0.00 34.50 32.60 1i43 s PRO 277 CO 0.00 -2.29 1.19 1.25 0.04 0.00 0.00 177.00 177.19 1i43 h LEU 278 N -1.49 -0.68 -1.40 -3.56 6.46 -1.90 -0.92 115.31 111.82 1i43 h LEU 278 Ca -0.44 -0.03 0.48 0.00 -0.12 0.00 0.00 57.88 57.77 1i43 h LEU 278 Cb 1.26 0.18 -0.14 0.00 -0.73 0.00 0.00 40.66 41.23 1i43 h LEU 278 CO 0.45 -0.32 0.89 0.50 -0.62 0.00 0.00 178.44 179.34 1i43 h LYS 279 N -1.09 0.02 0.00 1.25 3.64 -1.99 0.16 116.57 118.56 1i43 h LYS 279 Ca -0.08 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1i43 h LYS 279 Cb 0.67 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 1i43 h LYS 279 CO 0.14 0.01 -0.13 -0.07 -2.27 0.00 0.00 179.45 177.13 1i43 h LEU 280 N 0.02 0.00 -1.46 5.20 3.38 -1.91 -3.34 115.31 117.19 1i43 h LEU 280 Ca 0.88 0.00 0.29 0.00 0.09 0.00 0.00 57.88 59.13 1i43 h LEU 280 Cb 2.82 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 43.48 1i43 h LEU 280 CO -0.46 0.25 0.70 1.62 0.09 0.00 0.00 178.44 180.65 1i43 h VAL 281 N -0.38 0.48 -0.20 1.22 3.04 -0.80 0.32 116.25 119.93 1i43 h VAL 281 Ca 0.00 -0.11 -0.06 0.00 -1.01 0.00 0.00 66.70 65.53 1i43 h VAL 281 Cb 0.13 0.14 -0.01 0.00 -2.01 0.00 0.00 31.29 29.53 1i43 h VAL 281 CO 0.00 0.06 -0.12 0.77 -1.01 0.00 0.00 177.57 177.27 1i43 h SER 282 N 0.31 0.31 -0.76 3.17 4.64 -0.89 -0.80 113.55 119.53 1i43 h SER 282 Ca 0.60 -0.07 -0.05 0.00 -0.47 0.00 0.00 61.79 61.81 1i43 h SER 282 Cb 1.68 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 63.66 1i43 h SER 282 CO -0.26 0.46 0.30 -0.33 -0.87 0.00 0.00 176.83 176.13 1i43 h GLU 283 N 0.31 1.14 -0.31 4.77 4.39 -0.47 -2.07 114.58 122.34 1i43 h GLU 283 Ca 0.06 -0.21 -0.14 0.00 0.34 0.00 0.00 59.36 59.42 1i43 h GLU 283 Cb 0.41 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 28.87 1i43 h GLU 283 CO 0.02 0.93 -0.34 0.82 -1.16 0.00 0.00 179.01 179.28 1i43 h ILE 284 N 1.10 1.29 -0.44 3.13 2.04 -1.33 -2.98 117.51 120.32 1i43 h ILE 284 Ca 0.25 -1.52 0.10 0.00 1.00 0.00 0.00 64.86 64.69 1i43 h ILE 284 Cb 0.22 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 1i43 h ILE 284 CO -0.02 0.49 0.31 -0.09 0.00 0.00 0.00 178.15 178.84 1i43 h ARG 285 N 0.53 0.16 -0.26 2.37 2.43 -0.78 0.90 114.38 119.73 1i43 h ARG 285 Ca 0.04 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.11 1i43 h ARG 285 Cb 0.92 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.43 1i43 h ARG 285 CO 0.08 0.11 -0.22 -0.91 -1.51 0.00 0.00 179.97 177.52 1i43 h ASN 286 N 0.17 0.65 0.58 -3.80 4.21 -1.23 -1.45 115.58 114.71 1i43 h ASN 286 Ca 0.21 -0.46 -0.13 0.00 1.21 0.00 0.00 56.30 57.13 1i43 h ASN 286 Cb 0.60 -0.18 -0.02 0.00 -1.12 0.00 0.00 38.32 37.60 1i43 h ASN 286 CO -0.03 0.97 -0.59 0.25 -1.29 0.00 0.00 177.43 176.74 1i43 h LEU 287 N 0.33 0.02 -0.48 1.61 5.85 -1.34 -2.96 115.31 118.35 1i43 h LEU 287 Ca 0.05 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.76 1i43 h LEU 287 Cb 0.77 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 1i43 h LEU 287 CO 0.06 0.60 0.31 -0.74 -0.34 0.00 0.00 178.44 178.33 1i43 h HIS 288 N 0.01 0.59 0.00 1.25 2.76 -0.61 0.08 115.15 119.23 1i43 h HIS 288 Ca -0.01 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 1i43 h HIS 288 Cb 1.05 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 29.81 1i43 h HIS 288 CO 0.00 0.37 0.00 0.45 -1.30 0.00 0.00 177.93 177.45 1i43 h HIS 289 N 0.64 0.00 0.01 5.26 3.86 -1.09 -0.05 115.15 123.77 1i43 h HIS 289 Ca 0.18 0.00 -0.41 0.00 -1.16 0.00 0.00 60.37 58.97 1i43 h HIS 289 Cb -0.07 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.34 1i43 h HIS 289 CO -0.04 0.00 -2.31 -0.89 0.86 0.00 0.00 177.93 175.55 1i43 n ILE 290 N -2.68 1.54 0.26 2.45 5.41 -0.60 -4.36 119.36 121.38 1i43 n ILE 290 Ca -0.02 -0.37 0.10 0.00 1.00 0.00 0.00 62.75 63.46 1i43 n ILE 290 Cb 0.06 -1.83 0.68 0.00 -0.71 0.00 0.00 39.64 37.84 1i43 n ILE 290 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1i43 h LEU 291 N -0.80 0.00 -2.49 1.39 3.38 -0.77 -3.47 115.31 112.55 1i43 h LEU 291 Ca -0.62 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.19 1i43 h LEU 291 Cb 1.63 0.00 0.13 0.00 0.09 0.00 0.00 40.66 42.51 1i43 h LEU 291 CO -0.32 0.09 -0.57 0.61 0.09 0.00 0.00 178.44 178.35 1i43 n GLY 292 N -1.10 -1.00 2.17 0.83 0.00 -0.05 -4.96 105.19 101.08 1i43 n GLY 292 Ca -0.03 0.47 -0.28 0.00 0.00 0.00 0.00 46.02 46.19 1i43 n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i43 n GLY 293 N -1.37 6.20 3.61 -0.02 0.00 -1.26 -5.06 105.19 107.29 1i43 n GLY 293 Ca -0.05 -2.56 -0.39 0.00 0.00 0.00 0.00 46.02 43.03 1i43 n GLY 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i43 n ALA 294 N -0.76 0.15 -2.72 4.61 0.00 -1.26 -0.77 120.51 119.75 1i43 n ALA 294 Ca 0.50 0.07 -0.37 0.00 0.00 0.00 0.00 53.44 53.64 1i43 n ALA 294 Cb 0.84 -2.09 -0.07 0.00 0.00 0.00 0.00 19.45 18.13 1i43 n ALA 294 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1i43 s LEU 295 N -1.46 4.31 0.15 0.00 2.96 -1.26 -4.34 118.68 119.04 1i43 s LEU 295 Ca 0.71 0.53 -0.30 0.00 -0.22 0.00 0.00 54.13 54.85 1i43 s LEU 295 Cb -0.45 -2.29 -0.08 0.00 0.50 0.00 0.00 46.19 43.87 1i43 s LEU 295 CO 0.50 0.22 1.24 0.21 -1.32 0.00 0.00 176.35 177.21 1i43 s ASN 296 N -0.15 7.01 0.43 3.68 3.84 -1.26 -4.89 114.94 123.61 1i43 s ASN 296 Ca 0.16 2.23 0.21 0.00 0.21 0.00 0.00 52.86 55.67 1i43 s ASN 296 Cb -0.13 -2.60 1.18 0.00 -0.55 0.00 0.00 41.25 39.15 1i43 s ASN 296 CO 0.05 -0.46 1.82 -0.65 -2.79 0.00 0.00 177.10 175.07 1i43 h PRO 297 N 5.82 0.31 -0.59 0.43 0.11 -1.96 0.33 132.00 136.44 1i43 h PRO 297 Ca -0.44 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.59 1i43 h PRO 297 Cb 1.21 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 1i43 h PRO 297 CO 0.78 0.21 0.11 -0.91 -0.21 0.00 0.00 178.00 177.97 1i43 h ASN 298 N 0.32 0.89 -0.21 -2.05 2.35 -1.91 -1.70 115.58 113.27 1i43 h ASN 298 Ca 0.52 -0.19 -0.10 0.00 -0.55 0.00 0.00 56.30 55.99 1i43 h ASN 298 Cb 1.47 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 39.60 1i43 h ASN 298 CO -0.19 0.89 -0.24 0.00 -1.65 0.00 0.00 177.43 176.24 1i43 h ALA 299 N 1.22 0.31 -0.87 -0.83 0.00 -0.81 -2.68 119.26 115.61 1i43 h ALA 299 Ca 0.19 -0.38 0.15 0.00 0.00 0.00 0.00 54.91 54.87 1i43 h ALA 299 Cb 0.37 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.03 1i43 h ALA 299 CO 0.01 0.28 0.56 0.00 0.00 0.00 0.00 179.25 180.10 1i43 h ALA 300 N 0.64 1.94 -0.08 0.00 0.00 -0.66 -1.12 119.26 119.98 1i43 h ALA 300 Ca 0.03 0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.75 1i43 h ALA 300 Cb 0.80 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.51 1i43 h ALA 300 CO 0.06 -0.18 -0.74 -0.92 0.00 0.00 0.00 179.25 177.46 1i43 h TYR 301 N 0.60 0.90 -0.33 0.00 3.20 -1.25 -1.80 116.97 118.28 1i43 h TYR 301 Ca 0.44 -0.43 0.10 0.00 3.14 0.00 0.00 58.73 61.97 1i43 h TYR 301 Cb 0.82 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.95 1i43 h TYR 301 CO -0.00 1.25 0.27 -0.07 -1.64 0.00 0.00 178.16 177.97 1i43 h LEU 302 N 0.29 0.00 0.03 2.82 3.38 -0.88 0.18 115.31 121.13 1i43 h LEU 302 Ca -0.07 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.77 1i43 h LEU 302 Cb 1.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.13 1i43 h LEU 302 CO 0.15 0.00 -0.68 0.40 0.09 0.00 0.00 178.44 178.40 1i43 h ILE 303 N 0.00 1.37 -0.83 1.22 2.04 -1.28 -2.68 117.51 117.36 1i43 h ILE 303 Ca 0.16 -2.31 0.17 0.00 1.00 0.00 0.00 64.86 63.87 1i43 h ILE 303 Cb 0.70 2.89 -0.10 0.00 -0.74 0.00 0.00 36.82 39.57 1i43 h ILE 303 CO -0.00 0.53 0.36 0.40 0.00 0.00 0.00 178.15 179.44 1i43 h ILE 304 N -0.86 0.62 -0.26 -0.67 2.04 -0.47 0.58 117.51 118.49 1i43 h ILE 304 Ca -0.17 -0.16 -0.04 0.00 1.00 0.00 0.00 64.86 65.48 1i43 h ILE 304 Cb 1.25 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 1i43 h ILE 304 CO -0.05 0.09 -0.01 -0.09 0.00 0.00 0.00 178.15 178.09 1i43 h ARG 305 N 0.48 0.46 0.00 2.37 2.43 -0.79 -3.05 114.38 116.27 1i43 h ARG 305 Ca 0.47 -0.15 -0.04 0.00 -0.81 0.00 0.00 59.98 59.45 1i43 h ARG 305 Cb 0.77 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.27 1i43 h ARG 305 CO -0.44 0.63 -0.19 0.78 -1.51 0.00 0.00 179.97 179.25 1i43 h GLY 306 N 0.23 0.00 1.78 2.80 0.00 -0.76 -2.17 103.07 104.94 1i43 h GLY 306 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1i43 h GLY 306 CO 0.01 0.00 0.00 1.03 0.00 0.00 0.00 176.54 177.58 1i43 n MET 307 N -4.32 0.19 0.25 4.80 2.81 0.04 -2.93 117.12 117.97 1i43 n MET 307 Ca -0.02 0.06 0.17 0.00 -1.81 0.00 0.00 57.70 56.09 1i43 n MET 307 Cb 0.25 -1.50 0.75 0.00 -0.71 0.00 0.00 33.22 32.01 1i43 n MET 307 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1i43 h LYS 308 N 0.00 0.00 0.00 0.03 1.79 -1.39 -2.62 116.57 114.39 1i43 h LYS 308 Ca 0.00 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 1i43 h LYS 308 Cb 0.33 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.96 1i43 h LYS 308 CO 0.00 0.00 -0.26 0.25 -1.08 0.00 0.00 179.45 178.36 1i43 n THR 309 N -2.87 1.35 0.12 -0.16 -2.24 -1.15 -4.76 114.28 104.57 1i43 n THR 309 Ca 0.00 -1.77 -0.08 0.00 -2.27 0.00 0.00 64.05 59.93 1i43 n THR 309 Cb 0.22 0.02 -0.05 0.00 -2.10 0.00 0.00 70.33 68.43 1i43 n THR 309 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1i43 h LEU 310 N 0.20 -0.65 -1.40 3.22 5.85 -1.52 0.39 115.31 121.40 1i43 h LEU 310 Ca -0.01 0.05 0.28 0.00 0.84 0.00 0.00 57.88 59.04 1i43 h LEU 310 Cb 1.16 0.22 -0.09 0.00 0.37 0.00 0.00 40.66 42.31 1i43 h LEU 310 CO 0.01 -0.30 0.68 1.12 -0.34 0.00 0.00 178.44 179.61 1i43 h HIS 311 N -0.45 0.61 -0.08 1.25 2.07 -1.89 0.17 115.15 116.84 1i43 h HIS 311 Ca -0.03 0.02 -0.02 0.00 -2.85 0.00 0.00 60.37 57.50 1i43 h HIS 311 Cb 0.39 -0.18 -0.00 0.00 2.57 0.00 0.00 27.41 30.19 1i43 h HIS 311 CO -0.18 0.05 -0.02 -0.07 -3.07 0.00 0.00 177.93 174.63 1i43 h LEU 312 N 0.36 0.15 0.52 6.12 3.38 -1.79 -2.26 115.31 121.78 1i43 h LEU 312 Ca 0.60 -0.38 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 1i43 h LEU 312 Cb 1.58 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 42.30 1i43 h LEU 312 CO -0.28 0.50 -0.25 0.03 0.09 0.00 0.00 178.44 178.53 1i43 h ARG 313 N -0.20 -0.67 -0.65 1.13 3.08 0.92 -3.05 114.38 114.95 1i43 h ARG 313 Ca 0.02 0.05 0.14 0.00 0.07 0.00 0.00 59.98 60.25 1i43 h ARG 313 Cb 0.43 0.15 -0.11 0.00 0.08 0.00 0.00 29.97 30.52 1i43 h ARG 313 CO 0.01 -0.36 -0.04 0.28 -1.07 0.00 0.00 179.97 178.79 1i43 h VAL 314 N -0.95 0.43 -0.36 2.04 2.07 -0.85 -0.58 116.25 118.05 1i43 h VAL 314 Ca -0.07 -0.03 0.08 0.00 0.82 0.00 0.00 66.70 67.50 1i43 h VAL 314 Cb 0.61 0.34 -0.09 0.00 -1.52 0.00 0.00 31.29 30.64 1i43 h VAL 314 CO 0.12 0.01 -0.27 1.56 0.02 0.00 0.00 177.57 179.02 1i43 h GLN 315 N 0.08 -0.21 -0.32 1.57 4.20 -1.42 0.16 115.11 119.17 1i43 h GLN 315 Ca 0.33 0.01 -0.02 0.00 0.06 0.00 0.00 58.65 59.04 1i43 h GLN 315 Cb 0.55 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 1i43 h GLN 315 CO -0.59 -0.14 0.14 0.37 -0.67 0.00 0.00 178.83 177.95 1i43 h GLN 316 N -0.22 0.47 -0.81 1.46 5.75 -1.11 -2.80 115.11 117.86 1i43 h GLN 316 Ca 0.17 -0.08 -0.03 0.00 -0.15 0.00 0.00 58.65 58.57 1i43 h GLN 316 Cb 0.49 -0.08 -0.04 0.00 1.07 0.00 0.00 27.48 28.92 1i43 h GLN 316 CO -0.49 0.46 0.39 1.96 -2.65 0.00 0.00 178.83 178.51 1i43 h GLN 317 N 0.38 1.16 -0.82 1.69 4.20 -0.66 -2.03 115.11 119.04 1i43 h GLN 317 Ca 0.11 -0.17 0.06 0.00 0.06 0.00 0.00 58.65 58.71 1i43 h GLN 317 Cb 0.15 -0.21 -0.06 0.00 0.30 0.00 0.00 27.48 27.66 1i43 h GLN 317 CO -0.01 0.90 0.50 -0.91 -0.67 0.00 0.00 178.83 178.63 1i43 h ASN 318 N 1.15 0.77 0.06 1.46 2.35 -0.55 -0.83 115.58 119.99 1i43 h ASN 318 Ca 0.28 0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 56.05 1i43 h ASN 318 Cb 0.11 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.35 1i43 h ASN 318 CO -0.04 0.49 -0.03 0.28 -1.65 0.00 0.00 177.43 176.48 1i43 h SER 319 N 0.90 -0.07 -0.98 5.81 0.02 -1.20 -2.61 113.55 115.43 1i43 h SER 319 Ca 0.36 0.00 0.26 0.00 -0.84 0.00 0.00 61.79 61.57 1i43 h SER 319 Cb 0.20 0.02 -0.18 0.00 0.14 0.00 0.00 62.40 62.57 1i43 h SER 319 CO -0.18 -0.03 -0.01 0.74 -1.14 0.00 0.00 176.83 176.21 1i43 h THR 320 N -0.13 0.03 0.39 -2.27 2.02 -1.39 0.25 112.91 111.82 1i43 h THR 320 Ca -0.01 -0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 1i43 h THR 320 Cb 0.07 0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.48 1i43 h THR 320 CO 0.01 0.00 -0.40 0.00 0.37 0.00 0.00 175.52 175.51 1i43 h ALA 321 N 1.97 -1.07 0.14 6.16 0.00 -1.21 -0.05 119.26 125.21 1i43 h ALA 321 Ca 0.57 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1i43 h ALA 321 Cb 1.14 0.63 -0.02 0.00 0.00 0.00 0.00 17.79 19.54 1i43 h ALA 321 CO -0.92 -1.09 -0.32 1.25 0.00 0.00 0.00 179.25 178.17 1i43 h LEU 322 N -0.79 -0.94 -0.83 0.00 5.85 -0.60 0.31 115.31 118.32 1i43 h LEU 322 Ca -0.05 0.09 0.21 0.00 0.84 0.00 0.00 57.88 58.97 1i43 h LEU 322 Cb 0.68 0.34 -0.13 0.00 0.37 0.00 0.00 40.66 41.92 1i43 h LEU 322 CO -0.05 -0.36 0.22 0.03 -0.34 0.00 0.00 178.44 177.94 1i43 h ARG 323 N -0.50 0.24 -0.11 1.25 3.08 -1.21 0.35 114.38 117.47 1i43 h ARG 323 Ca -0.01 -0.01 -0.11 0.00 0.07 0.00 0.00 59.98 59.91 1i43 h ARG 323 Cb 0.48 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 1i43 h ARG 323 CO -0.14 0.16 -0.44 0.52 -1.07 0.00 0.00 179.97 179.00 1i43 h MET 324 N 0.25 0.26 -0.01 0.04 2.86 -0.56 -2.48 114.93 115.29 1i43 h MET 324 Ca 0.50 -0.13 0.01 0.00 -2.06 0.00 0.00 59.70 58.02 1i43 h MET 324 Cb 0.96 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.61 1i43 h MET 324 CO -0.60 0.66 -0.04 0.00 1.06 0.00 0.00 176.91 177.99 1i43 h ALA 325 N 1.33 -0.04 0.68 6.32 0.00 0.36 -0.19 119.26 127.71 1i43 h ALA 325 Ca 0.02 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1i43 h ALA 325 Cb 0.87 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1i43 h ALA 325 CO 0.07 -0.54 -0.44 0.93 0.00 0.00 0.00 179.25 179.27 1i43 h GLU 326 N -0.08 -1.02 -0.76 0.00 5.08 -1.20 0.42 114.58 117.03 1i43 h GLU 326 Ca 0.02 0.07 0.17 0.00 -1.00 0.00 0.00 59.36 58.63 1i43 h GLU 326 Cb 0.10 0.23 -0.13 0.00 0.50 0.00 0.00 28.75 29.46 1i43 h GLU 326 CO -0.05 -0.68 0.06 0.82 -1.00 0.00 0.00 179.01 178.16 1i43 h ILE 327 N -1.06 0.38 -0.53 3.13 2.04 -1.35 0.85 117.51 120.97 1i43 h ILE 327 Ca -0.09 -0.05 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 1i43 h ILE 327 Cb 0.86 0.22 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 1i43 h ILE 327 CO 0.07 0.03 0.32 -0.07 0.00 0.00 0.00 178.15 178.50 1i43 h LEU 328 N 0.14 0.63 -0.81 1.44 3.38 -0.58 -2.14 115.31 117.37 1i43 h LEU 328 Ca 0.42 -0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.38 1i43 h LEU 328 Cb 0.75 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.30 1i43 h LEU 328 CO -0.63 0.49 0.52 -0.08 0.09 0.00 0.00 178.44 178.83 1i43 h GLU 329 N 0.71 0.96 0.00 1.13 4.81 0.14 -1.43 114.58 120.89 1i43 h GLU 329 Ca 0.19 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1i43 h GLU 329 Cb -0.02 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.14 1i43 h GLU 329 CO -0.04 0.64 0.00 0.00 -0.73 0.00 0.00 179.01 178.88 1i43 n ALA 330 N -2.34 2.48 -2.16 2.92 0.00 -0.58 -4.83 120.51 116.00 1i43 n ALA 330 Ca 0.10 -0.15 -0.41 0.00 0.00 0.00 0.00 53.44 52.98 1i43 n ALA 330 Cb 0.10 -1.48 -0.04 0.00 0.00 0.00 0.00 19.45 18.03 1i43 n ALA 330 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1i43 s HIS 331 N -2.51 3.63 0.36 0.00 5.04 -0.54 -4.94 115.29 116.33 1i43 s HIS 331 Ca 0.30 1.62 0.27 0.00 -1.54 0.00 0.00 55.06 55.71 1i43 s HIS 331 Cb 0.20 -3.24 1.36 0.00 0.04 0.00 0.00 32.58 30.95 1i43 s HIS 331 CO 0.44 -0.47 2.03 -1.00 -2.34 0.00 0.00 174.74 173.40 1i43 h PRO 332 N 5.43 0.00 -0.00 2.88 0.13 -1.88 -2.57 132.00 136.00 1i43 h PRO 332 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1i43 h PRO 332 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1i43 h PRO 332 CO 0.73 0.14 -0.27 1.63 -0.23 0.00 0.00 178.00 180.00 1i43 n LYS 333 N -3.59 0.54 -3.70 0.86 4.01 -1.26 -4.76 118.16 110.26 1i43 n LYS 333 Ca -0.01 -0.28 -0.37 0.00 -0.51 0.00 0.00 58.31 57.14 1i43 n LYS 333 Cb 0.27 -1.49 -0.12 0.00 -0.51 0.00 0.00 35.03 33.18 1i43 n LYS 333 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1i43 s VAL 334 N -2.65 4.74 -0.06 -0.18 1.01 -0.97 -0.09 120.40 122.19 1i43 s VAL 334 Ca 0.21 -0.02 -0.25 0.00 0.00 0.00 0.00 61.98 61.92 1i43 s VAL 334 Cb 0.19 -3.23 -0.24 0.00 0.00 0.00 0.00 36.38 33.10 1i43 s VAL 334 CO 0.56 0.31 1.00 -0.09 0.00 0.00 0.00 175.10 176.88 1i43 h ARG 335 N 8.21 0.13 -3.21 2.72 2.43 -1.49 -3.45 114.38 119.72 1i43 h ARG 335 Ca -0.37 -0.15 -0.14 0.00 -0.81 0.00 0.00 59.98 58.51 1i43 h ARG 335 Cb 1.18 0.04 -0.22 0.00 -0.42 0.00 0.00 29.97 30.55 1i43 h ARG 335 CO 0.57 0.90 -0.39 -1.58 -1.51 0.00 0.00 179.97 177.97 1i43 s HIS 336 N -3.06 -0.15 -0.07 2.20 5.04 -1.19 -5.00 115.29 113.06 1i43 s HIS 336 Ca -0.16 0.28 0.03 0.00 -1.54 0.00 0.00 55.06 53.67 1i43 s HIS 336 Cb 0.00 0.05 0.01 0.00 0.04 0.00 0.00 32.58 32.69 1i43 s HIS 336 CO 0.73 -0.27 -0.13 0.08 -2.34 0.00 0.00 174.74 172.80 1i43 s VAL 337 N -0.86 1.23 -0.23 0.89 1.01 -1.26 -0.79 120.40 120.40 1i43 s VAL 337 Ca -0.09 -0.54 -0.06 0.00 0.00 0.00 0.00 61.98 61.29 1i43 s VAL 337 Cb -0.05 -1.11 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 1i43 s VAL 337 CO 0.02 0.37 0.03 -0.31 0.00 0.00 0.00 175.10 175.22 1i43 s TYR 338 N 0.59 3.06 -0.30 5.22 1.51 0.31 -4.88 117.35 122.87 1i43 s TYR 338 Ca -0.14 -0.49 -0.16 0.00 -1.01 0.00 0.00 57.07 55.27 1i43 s TYR 338 Cb -0.16 -2.16 0.17 0.00 -0.11 0.00 0.00 41.96 39.70 1i43 s TYR 338 CO 0.04 -0.33 1.09 -0.47 -1.11 0.00 0.00 175.55 174.77 1i43 s TYR 339 N 1.35 -0.44 0.58 2.71 5.04 -1.26 -2.45 117.35 122.87 1i43 s TYR 339 Ca 0.05 0.80 0.28 0.00 -2.44 0.00 0.00 57.07 55.76 1i43 s TYR 339 Cb -0.15 0.27 1.56 0.00 0.35 0.00 0.00 41.96 43.98 1i43 s TYR 339 CO 0.02 -0.22 2.01 -1.35 -1.34 0.00 0.00 175.55 174.67 1i43 h PRO 340 N 6.73 0.00 0.00 4.97 0.11 -1.85 -1.04 132.00 140.93 1i43 h PRO 340 Ca -0.20 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.84 1i43 h PRO 340 Cb 1.14 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1i43 h PRO 340 CO 0.13 0.00 -0.33 0.78 -0.21 0.00 0.00 178.00 178.36 1i43 h GLY 341 N 0.00 0.00 -1.71 -0.55 0.00 -1.94 -3.42 103.07 95.44 1i43 h GLY 341 Ca 0.15 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.99 1i43 h GLY 341 CO -0.00 0.00 0.38 1.08 0.00 0.00 0.00 176.54 178.00 1i43 s LEU 342 N -7.10 3.51 0.33 3.11 1.43 -0.39 -4.97 118.68 114.60 1i43 s LEU 342 Ca -0.00 1.74 0.17 0.00 -1.03 0.00 0.00 54.13 55.01 1i43 s LEU 342 Cb 0.11 -4.52 0.34 0.00 0.03 0.00 0.00 46.19 42.14 1i43 s LEU 342 CO 0.67 -1.02 1.57 1.56 0.23 0.00 0.00 176.35 179.36 1i43 h GLN 343 N 0.50 0.00 0.00 1.70 4.20 -1.87 -3.07 115.11 116.57 1i43 h GLN 343 Ca -0.47 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.24 1i43 h GLN 343 Cb 1.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.99 1i43 h GLN 343 CO 0.58 0.43 0.00 -1.13 -0.67 0.00 0.00 178.83 178.05 1i43 n SER 344 N -3.32 0.00 -4.70 1.46 3.41 -1.26 -4.80 113.62 104.40 1i43 n SER 344 Ca 0.01 0.15 -0.42 0.00 -0.26 0.00 0.00 58.87 58.35 1i43 n SER 344 Cb 0.64 -0.36 -0.03 0.00 -0.26 0.00 0.00 64.21 64.20 1i43 n SER 344 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1i43 s HIS 345 N -2.71 3.26 0.24 7.33 5.04 -1.16 -4.94 115.29 122.35 1i43 s HIS 345 Ca 0.17 1.16 -0.15 0.00 -1.54 0.00 0.00 55.06 54.70 1i43 s HIS 345 Cb 0.14 -3.49 0.31 0.00 0.04 0.00 0.00 32.58 29.57 1i43 s HIS 345 CO 0.35 -1.62 1.56 -1.35 -2.34 0.00 0.00 174.74 171.33 1i43 h PRO 346 N 7.12 -0.01 -0.81 2.88 0.11 -1.92 -0.24 132.00 139.14 1i43 h PRO 346 Ca -0.39 0.00 -0.40 0.00 0.11 0.00 0.00 66.00 65.32 1i43 h PRO 346 Cb 1.20 0.00 -0.24 0.00 0.11 0.00 0.00 31.00 32.07 1i43 h PRO 346 CO 0.85 -0.00 0.43 -0.85 -0.21 0.00 0.00 178.00 178.22 1i43 n GLU 347 N -5.52 2.31 0.14 1.05 0.00 -1.26 -4.64 120.64 112.73 1i43 n GLU 347 Ca 0.12 -3.06 0.18 0.00 0.00 0.00 0.00 57.16 54.40 1i43 n GLU 347 Cb 0.43 -2.09 0.77 0.00 0.00 0.00 0.00 31.44 30.55 1i43 n GLU 347 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 1i43 h HIS 348 N 1.19 0.00 0.00 -1.84 2.76 -1.29 0.17 115.15 116.14 1i43 h HIS 348 Ca 0.49 0.00 -0.20 0.00 -2.20 0.00 0.00 60.37 58.46 1i43 h HIS 348 Cb 2.51 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 31.46 1i43 h HIS 348 CO 1.42 0.00 -0.89 1.12 -1.30 0.00 0.00 177.93 178.28 1i43 h HIS 349 N 0.00 0.30 -0.02 5.26 2.07 -1.82 -2.31 115.15 118.64 1i43 h HIS 349 Ca 0.14 -0.17 -0.04 0.00 -2.85 0.00 0.00 60.37 57.45 1i43 h HIS 349 Cb 0.69 -0.03 0.00 0.00 2.57 0.00 0.00 27.41 30.64 1i43 h HIS 349 CO 0.00 0.98 -0.16 0.82 -3.07 0.00 0.00 177.93 176.51 1i43 h ILE 350 N 0.11 1.53 -0.79 6.12 2.04 -1.13 -2.67 117.51 122.71 1i43 h ILE 350 Ca -0.05 -1.77 0.09 0.00 1.00 0.00 0.00 64.86 64.14 1i43 h ILE 350 Cb 1.52 2.63 -0.07 0.00 -0.74 0.00 0.00 36.82 40.16 1i43 h ILE 350 CO 0.14 0.48 0.44 0.00 0.00 0.00 0.00 178.15 179.21 1i43 h ALA 351 N 0.31 1.10 0.00 1.87 0.00 -1.04 -0.02 119.26 121.49 1i43 h ALA 351 Ca -0.01 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1i43 h ALA 351 Cb 0.86 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1i43 h ALA 351 CO 0.03 0.08 -0.24 -0.22 0.00 0.00 0.00 179.25 178.89 1i43 h LYS 352 N 0.75 0.00 0.00 0.00 3.64 -1.45 0.42 116.57 119.94 1i43 h LYS 352 Ca 0.37 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.55 1i43 h LYS 352 Cb 0.33 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.11 1i43 h LYS 352 CO -0.24 0.24 -1.29 -0.22 -2.27 0.00 0.00 179.45 175.67 1i43 h LYS 353 N 0.00 0.00 -0.02 1.90 3.64 -0.70 -3.39 116.57 118.00 1i43 h LYS 353 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1i43 h LYS 353 Cb 0.56 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.38 1i43 h LYS 353 CO 0.03 0.51 0.00 0.00 -2.27 0.00 0.00 179.45 177.72 1i43 n GLN 354 N -3.07 0.17 -4.30 1.90 10.64 -0.35 -5.04 117.38 117.33 1i43 n GLN 354 Ca -0.08 -0.89 -0.22 0.00 -1.83 0.00 0.00 57.00 53.98 1i43 n GLN 354 Cb 0.91 -1.06 -0.12 0.00 -0.86 0.00 0.00 30.24 29.11 1i43 n GLN 354 CO 0.00 0.00 0.00 -1.64 -1.83 0.00 0.00 177.06 173.59 1i43 s MET 355 N -0.41 1.18 -0.01 2.61 -1.94 0.13 -4.59 119.30 116.28 1i43 s MET 355 Ca 0.04 -1.28 0.13 0.00 -1.71 0.00 0.00 55.69 52.87 1i43 s MET 355 Cb 0.03 -1.33 -0.16 0.00 2.01 0.00 0.00 34.83 35.38 1i43 s MET 355 CO 0.04 0.29 0.47 0.25 -0.01 0.00 0.00 175.02 176.06 1i43 n THR 356 N 0.69 0.00 -4.08 2.05 -2.24 -0.10 -4.71 114.28 105.90 1i43 n THR 356 Ca -0.16 -0.23 -0.12 0.00 -2.27 0.00 0.00 64.05 61.27 1i43 n THR 356 Cb 0.55 0.78 -0.06 0.00 -2.10 0.00 0.00 70.33 69.50 1i43 n THR 356 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1i43 s GLY 357 N -2.58 1.08 -0.10 3.38 0.00 -1.25 -5.04 107.32 102.81 1i43 s GLY 357 Ca 0.02 -1.29 0.14 0.00 0.00 0.00 0.00 44.72 43.59 1i43 s GLY 357 CO 0.53 -0.93 1.12 0.69 0.00 0.00 0.00 173.10 174.51 1i43 n PHE 358 N -0.42 0.00 -0.22 1.90 3.72 -1.26 -4.93 117.46 116.24 1i43 n PHE 358 Ca 0.00 -0.80 0.03 0.00 -0.05 0.00 0.00 57.45 56.63 1i43 n PHE 358 Cb 0.63 -0.14 -0.01 0.00 -0.94 0.00 0.00 39.48 39.02 1i43 n PHE 358 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1i43 n GLY 359 N -1.00 -2.03 0.98 1.37 0.00 -1.26 -4.67 105.19 98.58 1i43 n GLY 359 Ca 0.12 -1.44 0.11 0.00 0.00 0.00 0.00 46.02 44.81 1i43 n GLY 359 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i43 n GLY 360 N -2.73 1.31 3.77 -0.02 0.00 -1.26 -4.26 105.19 102.00 1i43 n GLY 360 Ca -0.01 -0.66 -0.37 0.00 0.00 0.00 0.00 46.02 44.98 1i43 n GLY 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i43 s ALA 361 N -1.55 3.61 -0.05 4.61 0.00 -1.26 -1.88 121.76 125.23 1i43 s ALA 361 Ca 0.31 -0.31 -0.02 0.00 0.00 0.00 0.00 51.96 51.94 1i43 s ALA 361 Cb 0.20 -2.44 0.03 0.00 0.00 0.00 0.00 23.12 20.91 1i43 s ALA 361 CO 0.28 0.22 0.05 0.08 0.00 0.00 0.00 175.76 176.40 1i43 s VAL 362 N -0.08 -0.03 -0.06 0.00 1.01 -0.35 -4.92 120.40 115.96 1i43 s VAL 362 Ca 0.21 0.36 -0.04 0.00 0.00 0.00 0.00 61.98 62.52 1i43 s VAL 362 Cb -0.15 -0.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.97 1i43 s VAL 362 CO 0.09 0.18 0.12 -0.44 0.00 0.00 0.00 175.10 175.05 1i43 s SER 363 N 2.14 6.04 -0.19 3.32 0.01 -1.03 -0.85 113.70 123.13 1i43 s SER 363 Ca 0.05 0.31 -0.27 0.00 1.31 0.00 0.00 55.95 57.35 1i43 s SER 363 Cb -0.12 -1.86 0.07 0.00 0.21 0.00 0.00 66.02 64.32 1i43 s SER 363 CO -0.04 0.33 0.71 0.72 0.41 0.00 0.00 173.24 175.38 1i43 s PHE 364 N -1.12 -0.74 -0.15 2.43 -0.71 -0.53 0.12 117.98 117.27 1i43 s PHE 364 Ca 0.20 1.63 -0.11 0.00 -1.04 0.00 0.00 56.93 57.61 1i43 s PHE 364 Cb -0.12 0.32 -0.05 0.00 -1.21 0.00 0.00 43.02 41.96 1i43 s PHE 364 CO 0.10 -0.46 0.22 -1.21 -1.34 0.00 0.00 175.22 172.53 1i43 s GLU 365 N -0.18 4.05 0.45 1.99 2.02 0.03 -1.54 118.70 125.53 1i43 s GLU 365 Ca -0.04 -0.02 -0.07 0.00 0.02 0.00 0.00 54.97 54.86 1i43 s GLU 365 Cb -0.03 -3.36 -0.05 0.00 0.10 0.00 0.00 34.13 30.79 1i43 s GLU 365 CO 0.04 0.40 0.77 0.08 0.02 0.00 0.00 175.26 176.57 1i43 s VAL 366 N 0.02 4.86 -1.34 2.63 1.01 -1.06 -1.42 120.40 125.11 1i43 s VAL 366 Ca 0.14 0.37 -0.14 0.00 0.00 0.00 0.00 61.98 62.35 1i43 s VAL 366 Cb -0.12 -3.81 0.10 0.00 0.00 0.00 0.00 36.38 32.54 1i43 s VAL 366 CO 0.03 -0.71 1.89 -0.67 0.00 0.00 0.00 175.10 175.64 1i43 n ASP 367 N -1.85 4.65 0.00 3.32 2.03 0.86 -4.60 116.55 120.97 1i43 n ASP 367 Ca 0.01 -2.94 0.00 0.00 0.52 0.00 0.00 54.79 52.38 1i43 n ASP 367 Cb 0.55 -1.63 0.00 0.00 -0.72 0.00 0.00 41.12 39.31 1i43 n ASP 367 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1i43 n GLY 368 N 4.20 2.25 3.52 0.27 0.00 -1.26 -5.01 105.19 109.15 1i43 n GLY 368 Ca 0.46 -0.32 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 1i43 n GLY 368 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1i43 s ASP 369 N 2.00 2.82 0.31 1.61 -4.77 -1.26 -4.86 116.67 112.52 1i43 s ASP 369 Ca 0.00 -1.68 0.05 0.00 -3.30 0.00 0.00 52.55 47.62 1i43 s ASP 369 Cb 0.00 0.51 0.82 0.00 -1.09 0.00 0.00 42.92 43.16 1i43 s ASP 369 CO 0.00 -0.93 1.61 0.25 0.70 0.00 0.00 175.17 176.80 1i43 h LEU 370 N 1.78 -0.12 -0.14 2.11 7.12 -1.98 0.49 115.31 124.57 1i43 h LEU 370 Ca -0.35 0.23 -0.12 0.00 0.13 0.00 0.00 57.88 57.78 1i43 h LEU 370 Cb 1.27 0.34 0.00 0.00 -0.53 0.00 0.00 40.66 41.75 1i43 h LEU 370 CO 0.57 -0.27 -0.36 -0.07 -0.13 0.00 0.00 178.44 178.18 1i43 h LEU 371 N 0.11 0.56 -0.15 2.25 -0.00 -1.96 -2.84 115.31 113.28 1i43 h LEU 371 Ca 0.61 -0.58 -0.04 0.00 -0.00 0.00 0.00 57.88 57.87 1i43 h LEU 371 Cb 1.32 -0.16 -0.00 0.00 -0.00 0.00 0.00 40.66 41.82 1i43 h LEU 371 CO -0.76 1.04 -0.07 0.74 -0.00 0.00 0.00 178.44 179.39 1i43 h THR 372 N 0.10 1.31 -0.74 0.22 2.02 -1.38 -2.41 112.91 112.03 1i43 h THR 372 Ca -0.01 -1.11 0.09 0.00 0.77 0.00 0.00 66.41 66.16 1i43 h THR 372 Cb 0.98 1.72 -0.07 0.00 -1.74 0.00 0.00 68.15 69.04 1i43 h THR 372 CO 0.08 0.33 0.39 0.74 0.37 0.00 0.00 175.52 177.42 1i43 h THR 373 N -0.01 0.88 -0.78 3.16 2.02 -0.23 -0.03 112.91 117.92 1i43 h THR 373 Ca 0.03 -0.23 0.01 0.00 0.77 0.00 0.00 66.41 67.00 1i43 h THR 373 Cb 0.54 0.16 -0.04 0.00 -1.74 0.00 0.00 68.15 67.07 1i43 h THR 373 CO 0.02 0.12 0.51 0.00 0.37 0.00 0.00 175.52 176.55 1i43 h ALA 374 N 1.43 1.00 -0.79 6.16 0.00 -1.44 -1.12 119.26 124.50 1i43 h ALA 374 Ca 0.36 -0.05 0.14 0.00 0.00 0.00 0.00 54.91 55.36 1i43 h ALA 374 Cb 0.35 -0.30 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 1i43 h ALA 374 CO -0.25 0.38 0.52 -0.22 0.00 0.00 0.00 179.25 179.68 1i43 h LYS 375 N 1.03 0.50 0.20 0.00 3.64 -0.50 0.20 116.57 121.64 1i43 h LYS 375 Ca 0.29 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.63 1i43 h LYS 375 Cb -0.08 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.63 1i43 h LYS 375 CO -0.08 0.33 -0.10 0.35 -2.27 0.00 0.00 179.45 177.69 1i43 h PHE 376 N 0.51 -0.25 -0.02 1.91 3.57 -0.58 -2.56 116.94 119.53 1i43 h PHE 376 Ca 0.39 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.86 1i43 h PHE 376 Cb 0.79 0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.61 1i43 h PHE 376 CO -0.00 0.12 -0.10 -0.39 -2.23 0.00 0.00 178.31 175.71 1i43 h VAL 377 N -0.68 1.08 0.00 1.41 -1.51 -0.95 -0.33 116.25 115.28 1i43 h VAL 377 Ca -0.03 -0.38 0.00 0.00 -1.23 0.00 0.00 66.70 65.06 1i43 h VAL 377 Cb 0.48 1.18 0.00 0.00 -2.13 0.00 0.00 31.29 30.82 1i43 h VAL 377 CO 0.04 0.11 0.00 0.44 -1.23 0.00 0.00 177.57 176.94 1i43 h ASP 378 N 0.03 0.00 0.76 4.19 5.19 -0.56 -3.10 116.42 122.92 1i43 h ASP 378 Ca 0.01 0.00 -0.25 0.00 -0.62 0.00 0.00 57.03 56.17 1i43 h ASP 378 Cb 0.19 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.67 1i43 h ASP 378 CO 0.01 0.00 -1.27 0.00 -3.12 0.00 0.00 179.24 174.86 1i43 h ALA 379 N 2.04 0.41 -2.83 3.45 0.00 -0.63 -3.47 119.26 118.24 1i43 h ALA 379 Ca 0.00 -1.07 -0.57 0.00 0.00 0.00 0.00 54.91 53.27 1i43 h ALA 379 Cb 0.59 0.08 0.17 0.00 0.00 0.00 0.00 17.79 18.62 1i43 h ALA 379 CO 0.00 1.29 0.13 1.28 0.00 0.00 0.00 179.25 181.94 1i43 n LEU 380 N -3.31 3.79 0.00 0.00 4.77 -1.12 -4.83 117.00 116.30 1i43 n LEU 380 Ca -0.07 0.78 0.00 0.00 -0.03 0.00 0.00 56.01 56.68 1i43 n LEU 380 Cb 0.99 -1.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.68 1i43 n LEU 380 CO 0.48 -1.89 -0.47 0.29 -1.33 0.00 0.00 177.39 174.47 1i43 n LYS 381 N -1.21 0.62 -0.10 3.23 5.02 -1.26 -4.88 118.16 119.59 1i43 n LYS 381 Ca 0.14 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.25 1i43 n LYS 381 Cb 0.48 -0.97 -0.09 0.00 -0.02 0.00 0.00 35.03 34.43 1i43 n LYS 381 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1i43 h ILE 382 N 0.00 0.70 -4.21 -0.18 2.04 -1.96 -3.48 117.51 110.42 1i43 h ILE 382 Ca 0.00 -1.89 -0.49 0.00 1.00 0.00 0.00 64.86 63.48 1i43 h ILE 382 Cb 0.08 1.68 0.06 0.00 -0.74 0.00 0.00 36.82 37.90 1i43 h ILE 382 CO 0.00 0.24 0.38 -2.16 0.00 0.00 0.00 178.15 176.60 1i43 s PRO 383 N -2.33 3.43 0.17 2.37 0.04 -1.26 -4.70 135.00 132.73 1i43 s PRO 383 Ca -0.25 1.13 -0.07 0.00 0.04 0.00 0.00 61.00 61.84 1i43 s PRO 383 Cb 0.05 -2.05 -0.06 0.00 0.04 0.00 0.00 34.50 32.47 1i43 s PRO 383 CO 0.50 -0.71 0.45 0.71 0.04 0.00 0.00 177.00 177.99 1i43 s TYR 384 N -2.54 3.47 -0.81 0.56 2.02 -0.10 -4.81 117.35 115.13 1i43 s TYR 384 Ca 0.62 0.72 -0.18 0.00 -0.37 0.00 0.00 57.07 57.86 1i43 s TYR 384 Cb -0.14 -2.13 0.14 0.00 -0.40 0.00 0.00 41.96 39.42 1i43 s TYR 384 CO 0.37 0.38 0.95 0.42 -1.57 0.00 0.00 175.55 176.10 1i43 s ILE 385 N -1.69 4.89 0.34 2.71 1.01 -1.26 -0.52 121.20 126.68 1i43 s ILE 385 Ca 0.43 -1.52 -0.17 0.00 0.00 0.00 0.00 60.65 59.39 1i43 s ILE 385 Cb -0.12 -4.65 0.04 0.00 0.01 0.00 0.00 42.46 37.74 1i43 s ILE 385 CO 0.22 -1.33 0.74 0.00 0.00 0.00 0.00 174.94 174.57 1i43 s ALA 386 N 2.31 -0.84 1.00 9.38 0.00 -1.11 -4.97 121.76 127.53 1i43 s ALA 386 Ca 0.24 -0.62 -0.02 0.00 0.00 0.00 0.00 51.96 51.57 1i43 s ALA 386 Cb -0.11 0.78 0.02 0.00 0.00 0.00 0.00 23.12 23.81 1i43 s ALA 386 CO -0.04 -0.99 0.13 -0.35 0.00 0.00 0.00 175.76 174.50 1i43 n PRO 387 N -0.50 -0.18 -0.96 0.00 -0.05 -1.26 -4.48 135.00 127.57 1i43 n PRO 387 Ca -0.06 -0.20 0.13 0.00 -0.05 0.00 0.00 63.50 63.32 1i43 n PRO 387 Cb 0.60 -0.14 -0.03 0.00 -0.05 0.00 0.00 33.50 33.88 1i43 n PRO 387 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 175.50 175.90 1i43 n SER 388 N -3.09 -5.72 -3.62 3.54 2.88 -1.26 -5.00 113.62 101.35 1i43 n SER 388 Ca 0.02 0.43 0.00 0.00 -1.33 0.00 0.00 58.87 57.98 1i43 n SER 388 Cb 0.06 -2.94 -0.01 0.00 -0.75 0.00 0.00 64.21 60.57 1i43 n SER 388 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1i43 s PHE 389 N -1.96 -0.06 0.00 0.66 -0.12 -1.26 -4.94 117.98 110.29 1i43 s PHE 389 Ca 0.00 -0.04 0.00 0.00 -0.05 0.00 0.00 56.93 56.84 1i43 s PHE 389 Cb 0.00 0.54 0.00 0.00 -0.63 0.00 0.00 43.02 42.93 1i43 s PHE 389 CO 0.00 -0.28 0.00 0.41 -0.05 0.00 0.00 175.22 175.30 1i43 n GLY 390 N -0.41 1.94 3.90 1.99 0.00 -1.26 -4.22 105.19 107.12 1i43 n GLY 390 Ca -0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.67 1i43 n GLY 390 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i43 s GLY 391 N -2.45 1.62 0.44 -0.02 0.00 -1.25 -4.41 107.32 101.25 1i43 s GLY 391 Ca 0.00 -0.57 0.16 0.00 0.00 0.00 0.00 44.72 44.30 1i43 s GLY 391 CO 0.00 -0.19 1.97 0.00 0.00 0.00 0.00 173.10 174.88 1i43 s GLU 393 N -5.35 4.61 0.46 0.00 8.01 -1.26 -0.74 118.70 124.43 1i43 s GLU 393 Ca -0.07 1.28 -0.21 0.00 0.01 0.00 0.00 54.97 55.97 1i43 s GLU 393 Cb 0.20 -3.37 -0.08 0.00 -4.31 0.00 0.00 34.13 26.57 1i43 s GLU 393 CO 0.75 0.25 1.06 -1.12 0.01 0.00 0.00 175.26 176.21 1i43 s SER 394 N -0.06 6.39 0.01 -0.19 0.01 -1.26 -4.42 113.70 114.18 1i43 s SER 394 Ca 0.43 2.01 0.00 0.00 1.31 0.00 0.00 55.95 59.71 1i43 s SER 394 Cb -0.22 -2.57 -0.01 0.00 0.21 0.00 0.00 66.02 63.43 1i43 s SER 394 CO 0.27 -0.75 -0.03 -0.63 0.41 0.00 0.00 173.24 172.51 1i43 s ILE 395 N -1.83 0.14 0.02 1.44 1.01 -0.48 -0.93 121.20 120.57 1i43 s ILE 395 Ca 0.65 -0.50 0.02 0.00 0.00 0.00 0.00 60.65 60.81 1i43 s ILE 395 Cb -0.20 -0.20 -0.01 0.00 0.01 0.00 0.00 42.46 42.05 1i43 s ILE 395 CO 0.24 -0.23 -0.07 0.68 0.00 0.00 0.00 174.94 175.56 1i43 s VAL 396 N -0.75 0.48 0.12 2.92 -7.23 0.32 -0.58 120.40 115.68 1i43 s VAL 396 Ca -0.07 -0.68 -0.24 0.00 -1.81 0.00 0.00 61.98 59.17 1i43 s VAL 396 Cb -0.05 -0.49 0.08 0.00 0.56 0.00 0.00 36.38 36.48 1i43 s VAL 396 CO -0.00 -0.15 0.65 1.51 -0.31 0.00 0.00 175.10 176.80 1i43 s ASP 397 N -0.91 -0.54 -0.57 4.85 -4.77 -1.12 -2.74 116.67 110.87 1i43 s ASP 397 Ca -0.04 0.05 -0.07 0.00 -3.30 0.00 0.00 52.55 49.18 1i43 s ASP 397 Cb -0.06 0.56 0.15 0.00 -1.09 0.00 0.00 42.92 42.48 1i43 s ASP 397 CO 0.00 -0.89 0.43 -1.10 0.70 0.00 0.00 175.17 174.31 1i43 s GLN 398 N -3.48 2.62 0.43 2.11 -0.21 -1.26 -1.54 119.66 118.32 1i43 s GLN 398 Ca 0.01 -2.13 0.31 0.00 0.02 0.00 0.00 55.36 53.57 1i43 s GLN 398 Cb -0.01 -3.90 1.45 0.00 1.00 0.00 0.00 33.01 31.55 1i43 s GLN 398 CO -0.11 -1.19 1.52 -2.30 -2.12 0.00 0.00 175.29 171.09 1i43 n PRO 399 N 4.26 -0.04 -0.20 2.91 -0.02 -1.26 0.82 135.00 141.47 1i43 n PRO 399 Ca 0.01 1.23 -0.02 0.00 -2.02 0.00 0.00 63.50 62.70 1i43 n PRO 399 Cb 0.41 -2.41 0.09 0.00 -0.02 0.00 0.00 33.50 31.57 1i43 n PRO 399 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1i43 h ALA 400 N 1.57 0.79 0.00 3.55 0.00 -1.83 -0.46 119.26 122.89 1i43 h ALA 400 Ca 0.86 0.04 -0.20 0.00 0.00 0.00 0.00 54.91 55.60 1i43 h ALA 400 Cb 2.74 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 20.45 1i43 h ALA 400 CO -0.47 -0.07 -1.10 0.82 0.00 0.00 0.00 179.25 178.44 1i43 h ILE 401 N 0.54 1.03 -0.99 0.00 2.04 0.08 -2.00 117.51 118.22 1i43 h ILE 401 Ca 0.28 -2.20 0.07 0.00 1.00 0.00 0.00 64.86 64.01 1i43 h ILE 401 Cb 0.24 2.38 -0.07 0.00 -0.74 0.00 0.00 36.82 38.63 1i43 h ILE 401 CO -0.22 0.36 0.64 0.24 0.00 0.00 0.00 178.15 179.17 1i43 h MET 402 N -0.99 1.11 0.00 2.37 2.86 -0.69 -3.27 114.93 116.31 1i43 h MET 402 Ca -0.30 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.27 1i43 h MET 402 Cb 1.27 -0.25 0.00 0.00 0.06 0.00 0.00 31.60 32.68 1i43 h MET 402 CO -0.18 0.73 0.00 -1.13 1.06 0.00 0.00 176.91 177.39 1i43 n SER 403 N -4.53 0.53 -0.39 1.22 3.41 -0.22 -4.84 113.62 108.79 1i43 n SER 403 Ca 0.16 -1.23 0.00 0.00 -0.26 0.00 0.00 58.87 57.54 1i43 n SER 403 Cb 0.21 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.16 1i43 n SER 403 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1i43 n TYR 404 N -0.11 0.00 0.29 7.33 4.02 -0.94 -4.85 117.16 122.90 1i43 n TYR 404 Ca 0.00 0.00 0.18 0.00 -0.01 0.00 0.00 57.90 58.07 1i43 n TYR 404 Cb 0.37 -0.03 0.82 0.00 -0.02 0.00 0.00 39.34 40.47 1i43 n TYR 404 CO 0.00 0.00 0.00 2.35 -1.01 0.00 0.00 176.86 178.20 1i43 h TRP 405 N 0.00 0.00 0.00 -0.72 -0.00 -1.41 -2.33 115.95 111.50 1i43 h TRP 405 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.89 1i43 h TRP 405 Cb 1.30 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.46 1i43 h TRP 405 CO 0.07 0.01 0.00 -0.40 -0.00 0.00 0.00 178.44 178.12 1i43 n ASP 406 N -3.13 0.59 -4.96 2.65 5.75 -1.26 -4.79 116.55 111.41 1i43 n ASP 406 Ca -0.00 0.60 -0.23 0.00 -0.01 0.00 0.00 54.79 55.14 1i43 n ASP 406 Cb 0.25 -0.74 -0.02 0.00 -1.03 0.00 0.00 41.12 39.57 1i43 n ASP 406 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1i43 s LEU 407 N -4.21 4.31 0.35 -2.12 1.43 -0.88 -5.09 118.68 112.47 1i43 s LEU 407 Ca 0.08 0.13 -0.25 0.00 -1.03 0.00 0.00 54.13 53.06 1i43 s LEU 407 Cb 0.11 -2.90 -0.10 0.00 0.03 0.00 0.00 46.19 43.33 1i43 s LEU 407 CO 0.47 -0.03 0.96 -0.94 0.23 0.00 0.00 176.35 177.03 1i43 s SER 408 N -3.69 7.21 0.37 2.29 1.04 -1.26 -4.80 113.70 114.87 1i43 s SER 408 Ca 0.35 1.84 0.21 0.00 0.48 0.00 0.00 55.95 58.83 1i43 s SER 408 Cb -0.10 -2.57 1.33 0.00 0.10 0.00 0.00 66.02 64.78 1i43 s SER 408 CO 0.29 -0.16 1.59 -0.61 0.98 0.00 0.00 173.24 175.33 1i43 h GLN 409 N 2.90 0.03 -0.33 4.02 4.15 -1.96 0.72 115.11 124.65 1i43 h GLN 409 Ca -0.47 -0.00 -0.14 0.00 0.77 0.00 0.00 58.65 58.81 1i43 h GLN 409 Cb 1.19 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 28.87 1i43 h GLN 409 CO 0.64 0.02 -0.34 0.66 -1.93 0.00 0.00 178.83 177.89 1i43 h SER 410 N 0.03 0.86 0.57 -0.69 4.64 -1.99 -1.90 113.55 115.08 1i43 h SER 410 Ca 0.84 -0.47 -0.10 0.00 -0.47 0.00 0.00 61.79 61.59 1i43 h SER 410 Cb 2.22 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 64.06 1i43 h SER 410 CO -0.73 1.16 -0.47 0.44 -0.87 0.00 0.00 176.83 176.35 1i43 h ASP 411 N 0.58 0.00 0.12 4.97 3.32 -0.06 -1.97 116.42 123.38 1i43 h ASP 411 Ca 0.05 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 1i43 h ASP 411 Cb 0.92 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.47 1i43 h ASP 411 CO 0.08 0.47 -0.06 0.03 -1.72 0.00 0.00 179.24 178.05 1i43 h ARG 412 N 0.00 -0.15 0.00 3.56 3.08 -0.59 -2.93 114.38 117.35 1i43 h ARG 412 Ca -0.00 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1i43 h ARG 412 Cb 0.89 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.97 1i43 h ARG 412 CO 0.06 0.28 -0.02 0.00 -1.07 0.00 0.00 179.97 179.23 1i43 h ALA 413 N 0.10 1.21 0.00 0.04 0.00 -1.31 -0.66 119.26 118.64 1i43 h ALA 413 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1i43 h ALA 413 Cb 0.51 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1i43 h ALA 413 CO 0.03 0.02 0.05 1.17 0.00 0.00 0.00 179.25 180.52 1i43 n LYS 414 N -3.40 0.13 -2.72 0.00 4.81 -0.75 -2.65 118.16 113.58 1i43 n LYS 414 Ca -0.03 0.63 -0.06 0.00 -0.87 0.00 0.00 58.31 57.98 1i43 n LYS 414 Cb 0.11 -1.99 0.04 0.00 0.02 0.00 0.00 35.03 33.21 1i43 n LYS 414 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1i43 n TYR 415 N -2.23 1.20 0.00 5.64 4.01 -0.26 -5.01 117.16 120.51 1i43 n TYR 415 Ca -0.01 -2.56 0.00 0.00 -0.16 0.00 0.00 57.90 55.17 1i43 n TYR 415 Cb 0.08 -0.33 0.00 0.00 -0.31 0.00 0.00 39.34 38.79 1i43 n TYR 415 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i43 n GLY 416 N -0.26 1.84 3.63 2.72 0.00 -1.09 -4.96 105.19 107.09 1i43 n GLY 416 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 1i43 n GLY 416 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i43 s ILE 417 N 0.00 3.19 0.15 -0.61 -1.09 -1.20 -4.93 121.20 116.71 1i43 s ILE 417 Ca 0.00 0.22 0.09 0.00 -2.23 0.00 0.00 60.65 58.73 1i43 s ILE 417 Cb 0.00 -3.19 -0.04 0.00 -1.58 0.00 0.00 42.46 37.65 1i43 s ILE 417 CO 0.00 -0.07 -0.15 -0.04 -1.23 0.00 0.00 174.94 173.44 1i43 s MET 418 N 5.15 1.86 0.00 2.79 -1.94 -1.26 -3.42 119.30 122.48 1i43 s MET 418 Ca 0.88 -1.24 0.08 0.00 -1.71 0.00 0.00 55.69 53.70 1i43 s MET 418 Cb -0.35 -2.11 0.48 0.00 2.01 0.00 0.00 34.83 34.86 1i43 s MET 418 CO 0.36 0.46 0.92 -0.25 -0.01 0.00 0.00 175.02 176.50 1i43 n ASP 419 N 0.48 0.00 -0.06 3.03 9.92 -1.26 -1.38 116.55 127.28 1i43 n ASP 419 Ca -0.14 -0.29 -0.11 0.00 -0.53 0.00 0.00 54.79 53.72 1i43 n ASP 419 Cb 0.54 0.00 -0.15 0.00 -0.64 0.00 0.00 41.12 40.87 1i43 n ASP 419 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1i43 n ASN 420 N -0.96 0.73 -4.71 -2.24 5.03 -1.26 -3.69 115.26 108.16 1i43 n ASN 420 Ca 0.06 0.17 -0.43 0.00 0.87 0.00 0.00 54.58 55.25 1i43 n ASN 420 Cb 0.03 0.28 -0.03 0.00 -1.02 0.00 0.00 39.78 39.03 1i43 n ASN 420 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 1i43 n LEU 421 N -2.98 3.78 -3.85 3.41 7.94 -0.48 -2.57 117.00 122.26 1i43 n LEU 421 Ca -0.28 1.08 -0.23 0.00 -1.11 0.00 0.00 56.01 55.48 1i43 n LEU 421 Cb 1.09 -1.53 -0.17 0.00 0.53 0.00 0.00 43.42 43.34 1i43 n LEU 421 CO 0.42 0.03 -0.41 -0.69 -1.11 0.00 0.00 177.39 175.63 1i43 s VAL 422 N 0.87 0.58 -0.35 1.96 1.01 -0.59 -4.16 120.40 119.72 1i43 s VAL 422 Ca 0.74 -0.06 -0.12 0.00 0.00 0.00 0.00 61.98 62.54 1i43 s VAL 422 Cb -0.56 -0.66 -0.00 0.00 0.00 0.00 0.00 36.38 35.16 1i43 s VAL 422 CO 0.37 0.27 0.23 -0.60 0.00 0.00 0.00 175.10 175.37 1i43 s ARG 423 N 1.53 3.30 -0.31 2.72 3.52 -0.59 -1.45 118.95 127.67 1i43 s ARG 423 Ca -0.01 -0.77 -0.10 0.00 -0.13 0.00 0.00 55.73 54.73 1i43 s ARG 423 Cb -0.13 -3.78 -0.01 0.00 -1.56 0.00 0.00 34.95 29.48 1i43 s ARG 423 CO -0.04 -0.52 0.15 0.12 -0.81 0.00 0.00 175.30 174.21 1i43 s PHE 424 N 1.67 3.18 -0.53 5.12 2.19 -0.03 -2.78 117.98 126.80 1i43 s PHE 424 Ca 0.05 -0.57 -0.17 0.00 0.33 0.00 0.00 56.93 56.57 1i43 s PHE 424 Cb -0.18 -2.35 0.11 0.00 -1.31 0.00 0.00 43.02 39.29 1i43 s PHE 424 CO 0.09 -0.45 0.52 0.45 1.83 0.00 0.00 175.22 177.66 1i43 s SER 425 N 1.61 6.18 -0.02 6.13 0.15 0.25 -1.22 113.70 126.79 1i43 s SER 425 Ca 0.05 -1.60 -0.30 0.00 0.70 0.00 0.00 55.95 54.80 1i43 s SER 425 Cb -0.17 -2.22 -0.06 0.00 -1.71 0.00 0.00 66.02 61.86 1i43 s SER 425 CO 0.06 -0.86 1.58 -0.36 1.20 0.00 0.00 173.24 174.86 1i43 s PHE 426 N 1.83 2.31 0.00 3.44 0.08 -0.79 -1.38 117.98 123.48 1i43 s PHE 426 Ca 0.05 0.40 0.00 0.00 0.12 0.00 0.00 56.93 57.50 1i43 s PHE 426 Cb -0.27 -3.85 0.00 0.00 -0.57 0.00 0.00 43.02 38.32 1i43 s PHE 426 CO 0.05 -3.45 0.00 0.41 -0.10 0.00 0.00 175.22 172.13 1i43 n GLY 427 N 3.97 -1.37 0.00 4.36 0.00 -1.26 -4.85 105.19 106.03 1i43 n GLY 427 Ca 0.16 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1i43 n GLY 427 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1i43 n VAL 428 N 0.00 0.10 -0.58 1.61 3.14 0.08 -4.55 118.33 118.13 1i43 n VAL 428 Ca 0.00 -0.35 -0.30 0.00 -2.96 0.00 0.00 64.34 60.72 1i43 n VAL 428 Cb 0.00 1.28 0.21 0.00 -1.06 0.00 0.00 33.84 34.27 1i43 n VAL 428 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1i43 n GLU 429 N -0.05 -1.91 -2.02 1.45 4.71 -1.26 -4.89 120.64 116.67 1i43 n GLU 429 Ca 0.00 -0.53 -0.41 0.00 -0.01 0.00 0.00 57.16 56.21 1i43 n GLU 429 Cb 0.14 -1.99 -0.02 0.00 -1.01 0.00 0.00 31.44 28.56 1i43 n GLU 429 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1i43 s ASP 430 N -2.18 6.66 0.14 1.62 2.15 -1.26 -4.89 116.67 118.91 1i43 s ASP 430 Ca 0.63 2.66 -0.28 0.00 0.43 0.00 0.00 52.55 55.99 1i43 s ASP 430 Cb -0.20 -2.62 -0.03 0.00 -0.30 0.00 0.00 42.92 39.77 1i43 s ASP 430 CO 0.65 -0.70 1.58 0.15 -0.17 0.00 0.00 175.17 176.69 1i43 h PHE 431 N 5.05 -1.21 -0.77 -5.34 3.57 -1.99 -1.18 116.94 115.06 1i43 h PHE 431 Ca -0.46 0.06 0.16 0.00 3.53 0.00 0.00 57.97 61.26 1i43 h PHE 431 Cb 1.22 0.57 -0.10 0.00 2.79 0.00 0.00 35.95 40.42 1i43 h PHE 431 CO 0.60 -0.46 0.28 -0.44 -2.23 0.00 0.00 178.31 176.07 1i43 h ASP 432 N -0.41 0.21 -0.39 0.41 3.32 -1.98 0.63 116.42 118.22 1i43 h ASP 432 Ca 0.11 0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.26 1i43 h ASP 432 Cb 0.60 0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.26 1i43 h ASP 432 CO -0.48 0.05 0.16 0.44 -1.72 0.00 0.00 179.24 177.69 1i43 h ASP 433 N 0.39 0.53 0.42 6.45 3.32 -1.74 -0.76 116.42 125.02 1i43 h ASP 433 Ca 0.44 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 57.31 1i43 h ASP 433 Cb 0.72 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.14 1i43 h ASP 433 CO -0.45 0.54 -0.20 -0.07 -1.72 0.00 0.00 179.24 177.34 1i43 h LEU 434 N 0.48 -0.48 -0.35 1.55 3.38 0.01 -2.51 115.31 117.40 1i43 h LEU 434 Ca 0.13 -0.10 0.07 0.00 0.09 0.00 0.00 57.88 58.07 1i43 h LEU 434 Cb 0.17 0.12 -0.09 0.00 0.09 0.00 0.00 40.66 40.96 1i43 h LEU 434 CO -0.01 -0.14 -0.31 0.50 0.09 0.00 0.00 178.44 178.57 1i43 h LYS 435 N -0.85 -0.26 -0.94 1.13 3.64 0.22 0.35 116.57 119.87 1i43 h LYS 435 Ca -0.06 0.02 0.16 0.00 -1.27 0.00 0.00 60.65 59.50 1i43 h LYS 435 Cb 0.55 0.06 -0.08 0.00 -0.41 0.00 0.00 32.23 32.35 1i43 h LYS 435 CO 0.09 -0.17 0.60 0.00 -2.27 0.00 0.00 179.45 177.70 1i43 h ALA 436 N 0.73 1.79 0.11 5.00 0.00 -1.16 -0.06 119.26 125.67 1i43 h ALA 436 Ca 0.16 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1i43 h ALA 436 Cb 0.53 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1i43 h ALA 436 CO -0.50 -0.07 -0.05 0.22 0.00 0.00 0.00 179.25 178.85 1i43 h ASP 437 N 0.73 -0.13 -0.93 0.00 3.58 -0.52 -0.58 116.42 118.56 1i43 h ASP 437 Ca 0.49 -0.30 0.04 0.00 0.42 0.00 0.00 57.03 57.67 1i43 h ASP 437 Cb 0.78 0.03 -0.06 0.00 1.72 0.00 0.00 39.33 41.80 1i43 h ASP 437 CO -0.25 0.25 0.60 0.40 -2.88 0.00 0.00 179.24 177.36 1i43 h ILE 438 N -0.52 1.14 0.43 2.25 2.04 -0.51 -0.75 117.51 121.59 1i43 h ILE 438 Ca -0.02 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.43 1i43 h ILE 438 Cb 0.42 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.39 1i43 h ILE 438 CO 0.03 0.21 -0.21 -0.07 0.00 0.00 0.00 178.15 178.11 1i43 h LEU 439 N 1.15 -0.49 -1.57 1.44 3.38 -0.99 -2.28 115.31 115.96 1i43 h LEU 439 Ca 0.38 -0.11 0.21 0.00 0.09 0.00 0.00 57.88 58.45 1i43 h LEU 439 Cb 0.03 0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.84 1i43 h LEU 439 CO -0.13 -0.13 0.60 -0.61 0.09 0.00 0.00 178.44 178.26 1i43 h GLN 440 N -0.89 0.34 -0.25 1.13 -0.00 -0.95 -0.95 115.11 113.54 1i43 h GLN 440 Ca -0.06 -0.02 -0.18 0.00 -0.00 0.00 0.00 58.65 58.39 1i43 h GLN 440 Cb 0.56 -0.08 -0.00 0.00 0.00 0.00 0.00 27.48 27.97 1i43 h GLN 440 CO 0.10 0.22 -0.55 0.00 0.00 0.00 0.00 178.83 178.60 1i43 h ALA 441 N 1.61 0.55 0.00 3.38 0.00 -1.01 -3.16 119.26 120.63 1i43 h ALA 441 Ca 0.47 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1i43 h ALA 441 Cb 1.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1i43 h ALA 441 CO -0.16 0.68 0.00 -0.07 0.00 0.00 0.00 179.25 179.71 1i43 h LEU 442 N 0.59 0.00 -0.49 0.00 3.38 -0.57 -3.04 115.31 115.17 1i43 h LEU 442 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1i43 h LEU 442 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1i43 h LEU 442 CO 0.12 0.00 0.00 0.44 0.09 0.00 0.00 178.44 179.09 1i43 h ASP 443 N 0.00 0.00 -0.28 -0.43 5.19 -1.47 -2.99 116.42 116.44 1i43 h ASP 443 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1i43 h ASP 443 Cb 0.44 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.95 1i43 h ASP 443 CO 0.00 0.00 0.00 -1.20 -3.12 0.00 0.00 179.24 174.92 1i43 n SER 444 N -2.57 1.63 -0.92 6.45 7.64 -1.15 -5.15 113.62 119.55 1i43 n SER 444 Ca 0.03 -1.95 0.11 0.00 1.01 0.00 0.00 58.87 58.08 1i43 n SER 444 Cb 0.36 -0.19 0.10 0.00 -1.01 0.00 0.00 64.21 63.47 1i43 n SER 444 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65