#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 3.97 -0.21 2.98 0.00 -1.26 -5.02 121.76 122.22 1i43 s ALA 51 Ca 0.00 -0.93 0.22 0.00 0.00 0.00 0.00 51.96 51.25 1i43 s ALA 51 Cb 0.00 -1.83 -0.04 0.00 0.00 0.00 0.00 23.12 21.25 1i43 s ALA 51 CO 0.00 0.64 0.98 -1.13 0.00 0.00 0.00 175.76 176.25 1i43 n SER 52 N -0.24 0.80 -0.70 0.00 3.41 -1.26 -3.89 113.62 111.74 1i43 n SER 52 Ca -0.06 0.31 0.11 0.00 -0.26 0.00 0.00 58.87 58.97 1i43 n SER 52 Cb 0.53 0.52 0.33 0.00 -0.26 0.00 0.00 64.21 65.33 1i43 n SER 52 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 1i43 n PHE 53 N -2.67 0.25 -3.83 7.33 1.16 -1.26 -4.69 117.46 113.75 1i43 n PHE 53 Ca -0.01 -0.13 -0.29 0.00 -1.87 0.00 0.00 57.45 55.15 1i43 n PHE 53 Cb 0.58 0.00 -0.16 0.00 -1.61 0.00 0.00 39.48 38.29 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 -1.59 1.75 0.00 5.98 1.43 -1.25 -4.98 118.68 120.02 1i43 s LEU 54 Ca 0.34 -0.94 0.06 0.00 -1.03 0.00 0.00 54.13 52.56 1i43 s LEU 54 Cb 0.19 -0.84 0.03 0.00 0.03 0.00 0.00 46.19 45.60 1i43 s LEU 54 CO 0.28 -0.27 0.62 0.59 0.23 0.00 0.00 176.35 177.80 1i43 n ASN 55 N 4.89 1.30 -4.88 2.29 3.02 -1.26 -4.66 115.26 115.97 1i43 n ASN 55 Ca -0.10 -1.15 -0.35 0.00 -0.03 0.00 0.00 54.58 52.95 1i43 n ASN 55 Cb 0.46 0.19 -0.06 0.00 -0.61 0.00 0.00 39.78 39.76 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 -0.72 6.28 0.26 6.41 0.15 -1.26 -5.00 113.70 119.81 1i43 s SER 56 Ca 0.06 0.37 -0.05 0.00 0.70 0.00 0.00 55.95 57.03 1i43 s SER 56 Cb 0.05 -1.98 0.29 0.00 -1.71 0.00 0.00 66.02 62.67 1i43 s SER 56 CO 0.11 0.32 1.91 0.44 1.20 0.00 0.00 173.24 177.22 1i43 h ASP 57 N 4.32 1.09 -0.14 5.45 3.32 -1.99 -2.11 116.42 126.37 1i43 h ASP 57 Ca -0.51 -0.06 0.05 0.00 0.02 0.00 0.00 57.03 56.53 1i43 h ASP 57 Cb 1.20 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 40.42 1i43 h ASP 57 CO 0.64 0.83 -0.19 1.23 -1.72 0.00 0.00 179.24 180.03 1i43 h GLY 58 N 1.27 -0.13 1.60 2.75 0.00 -1.99 0.55 103.07 107.12 1i43 h GLY 58 Ca 0.33 0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.88 1i43 h GLY 58 CO -0.07 -0.17 0.17 1.76 0.00 0.00 0.00 176.54 178.23 1i43 h SER 59 N -0.23 0.47 0.13 0.19 0.02 -1.93 -2.69 113.55 109.52 1i43 h SER 59 Ca 0.10 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 1i43 h SER 59 Cb 0.38 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.80 1i43 h SER 59 CO -0.28 0.41 -0.06 0.58 -1.14 0.00 0.00 176.83 176.34 1i43 h VAL 60 N 0.53 1.04 0.00 2.27 2.07 -0.46 -1.15 116.25 120.55 1i43 h VAL 60 Ca 0.13 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 66.88 1i43 h VAL 60 Cb 0.08 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1i43 h VAL 60 CO -0.02 0.18 0.24 0.00 0.02 0.00 0.00 177.57 178.00 1i43 h ALA 61 N 0.26 1.23 0.00 1.67 0.00 0.33 0.47 119.26 123.22 1i43 h ALA 61 Ca -0.02 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1i43 h ALA 61 Cb 0.43 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1i43 h ALA 61 CO 0.03 -0.23 -0.87 -0.89 0.00 0.00 0.00 179.25 177.29 1i43 n ILE 62 N -2.70 1.46 0.67 0.00 5.41 -1.04 -4.22 119.36 118.94 1i43 n ILE 62 Ca -0.02 0.12 0.11 0.00 1.00 0.00 0.00 62.75 63.96 1i43 n ILE 62 Cb 0.29 -2.29 -0.01 0.00 -0.71 0.00 0.00 39.64 36.92 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 -4.53 0.14 -1.68 1.39 8.25 -0.46 -4.88 115.22 113.45 1i43 n HIS 63 Ca -0.16 0.04 -0.51 0.00 -0.26 0.00 0.00 57.72 56.83 1i43 n HIS 63 Cb 0.43 -0.31 -0.06 0.00 1.12 0.00 0.00 29.99 31.17 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 -1.75 0.55 -0.93 -1.41 0.00 0.16 -0.63 120.51 116.50 1i43 n ALA 64 Ca 0.02 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1i43 n ALA 64 Cb 0.41 -2.42 0.00 0.00 0.00 0.00 0.00 19.45 17.44 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 4.45 0.46 1.65 0.00 0.00 -1.26 -4.14 105.19 106.35 1i43 n GLY 65 Ca 0.25 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.93 0.00 -0.32 1.61 1.02 0.20 -4.68 120.64 115.54 1i43 n GLU 66 Ca 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.19 1i43 n GLU 66 Cb 0.00 -0.07 0.24 0.00 -0.02 0.00 0.00 31.44 31.59 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 1.00 0.00 3.49 9.65 -1.71 -2.74 114.38 124.07 1i43 h ARG 67 Ca 0.00 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 1i43 h ARG 67 Cb 0.00 -0.23 0.00 0.00 -1.39 0.00 0.00 29.97 28.35 1i43 h ARG 67 CO 0.00 0.66 -0.72 -0.07 2.80 0.00 0.00 179.97 182.65 1i43 h LEU 68 N 1.03 0.00 0.00 3.80 3.38 -1.92 -3.50 115.31 118.10 1i43 h LEU 68 Ca 0.41 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1i43 h LEU 68 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1i43 h LEU 68 CO -0.17 0.10 0.00 0.61 0.09 0.00 0.00 178.44 179.08 1i43 n GLY 69 N 1.32 1.98 0.00 0.83 0.00 -1.04 -5.07 105.19 103.21 1i43 n GLY 69 Ca 0.03 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.85 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 -1.12 4.87 0.00 1.61 1.74 -1.26 -3.65 116.66 118.85 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 -0.58 0.00 0.00 -1.02 0.00 0.00 32.46 30.86 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 0.40 3.10 2.75 -0.13 0.00 -1.26 -4.89 105.19 105.16 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 4.51 0.00 0.00 0.00 173.32 177.83 1i43 n ILE 72 N -2.00 0.98 -1.53 -0.61 0.00 -1.26 -5.10 119.36 109.84 1i43 n ILE 72 Ca 0.00 -4.54 -0.49 0.00 0.00 0.00 0.00 62.75 57.72 1i43 n ILE 72 Cb 0.00 -2.06 -0.04 0.00 0.00 0.00 0.00 39.64 37.55 1i43 n ILE 72 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1i43 n VAL 73 N 2.10 1.32 -3.56 9.51 0.31 -1.26 -4.93 118.33 121.81 1i43 n VAL 73 Ca 0.23 -0.33 -0.07 0.00 -0.01 0.00 0.00 64.34 64.16 1i43 n VAL 73 Cb 0.39 -0.56 -0.02 0.00 -0.91 0.00 0.00 33.84 32.73 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 -0.57 0.00 -0.36 2.52 -4.23 -1.26 -5.00 115.64 106.74 1i43 s THR 74 Ca 0.70 -0.15 0.16 0.00 -1.18 0.00 0.00 61.69 61.22 1i43 s THR 74 Cb -0.89 -1.24 0.63 0.00 1.34 0.00 0.00 72.50 72.34 1i43 s THR 74 CO 0.55 0.00 1.54 -0.90 -0.54 0.00 0.00 174.62 175.27 1i43 n ASP 75 N -0.29 4.49 -4.85 3.99 5.75 -1.26 -4.95 116.55 119.43 1i43 n ASP 75 Ca -0.08 -2.86 -0.34 0.00 -0.01 0.00 0.00 54.79 51.50 1i43 n ASP 75 Cb 0.61 -0.57 -0.06 0.00 -1.03 0.00 0.00 41.12 40.08 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 -2.57 3.54 0.14 2.12 0.00 -1.26 -5.01 121.76 118.73 1i43 s ALA 76 Ca 0.46 -0.12 -0.08 0.00 0.00 0.00 0.00 51.96 52.21 1i43 s ALA 76 Cb 0.35 -2.55 -0.03 0.00 0.00 0.00 0.00 23.12 20.88 1i43 s ALA 76 CO 0.13 0.45 1.40 0.82 0.00 0.00 0.00 175.76 178.56 1i43 h ILE 77 N 2.56 1.30 -2.08 0.00 2.04 -2.02 -3.46 117.51 115.86 1i43 h ILE 77 Ca -0.48 -1.90 -0.44 0.00 1.00 0.00 0.00 64.86 63.04 1i43 h ILE 77 Cb 1.19 1.86 0.04 0.00 -0.74 0.00 0.00 36.82 39.17 1i43 h ILE 77 CO 0.66 0.60 -0.07 0.42 0.00 0.00 0.00 178.15 179.76 1i43 s THR 78 N -3.89 2.63 0.13 -0.27 -4.23 -1.26 -5.00 115.64 103.76 1i43 s THR 78 Ca -0.09 -0.76 -0.27 0.00 -1.18 0.00 0.00 61.69 59.40 1i43 s THR 78 Cb 0.10 -2.87 -0.07 0.00 1.34 0.00 0.00 72.50 71.00 1i43 s THR 78 CO 0.87 0.00 0.83 -0.89 -0.54 0.00 0.00 174.62 174.89 1i43 s THR 79 N -2.71 4.46 0.25 3.99 2.01 -1.26 -5.04 115.64 117.33 1i43 s THR 79 Ca 0.58 1.80 -0.27 0.00 0.31 0.00 0.00 61.69 64.11 1i43 s THR 79 Cb -0.09 -4.19 -0.09 0.00 0.01 0.00 0.00 72.50 68.14 1i43 s THR 79 CO 0.38 0.44 0.89 -2.16 -0.69 0.00 0.00 174.62 173.48 1i43 s PRO 80 N -0.62 4.69 -0.18 4.92 0.05 -1.26 -5.02 135.00 137.57 1i43 s PRO 80 Ca 0.39 1.34 -0.25 0.00 0.05 0.00 0.00 61.00 62.53 1i43 s PRO 80 Cb -0.23 -3.12 -0.02 0.00 0.05 0.00 0.00 34.50 31.18 1i43 s PRO 80 CO 0.27 0.46 0.80 0.08 0.05 0.00 0.00 177.00 178.66 1i43 s VAL 81 N -1.31 4.90 -0.51 -0.36 1.01 -1.26 -4.44 120.40 118.43 1i43 s VAL 81 Ca 0.42 1.57 -0.09 0.00 0.00 0.00 0.00 61.98 63.88 1i43 s VAL 81 Cb -0.23 -4.11 0.13 0.00 0.00 0.00 0.00 36.38 32.17 1i43 s VAL 81 CO 0.28 0.03 0.38 -0.69 0.00 0.00 0.00 175.10 175.11 1i43 s VAL 82 N 2.16 4.31 -1.14 2.92 1.01 -1.26 -5.01 120.40 123.38 1i43 s VAL 82 Ca 0.37 -1.89 -0.15 0.00 0.00 0.00 0.00 61.98 60.30 1i43 s VAL 82 Cb -0.16 -3.82 0.16 0.00 0.00 0.00 0.00 36.38 32.55 1i43 s VAL 82 CO 0.12 -0.80 1.37 0.20 0.00 0.00 0.00 175.10 175.98 1i43 s ASN 83 N 2.56 6.96 0.00 3.32 0.01 -1.26 -4.81 114.94 121.73 1i43 s ASN 83 Ca 0.07 -2.76 0.00 0.00 -0.71 0.00 0.00 52.86 49.46 1i43 s ASN 83 Cb -0.25 -2.40 -0.00 0.00 0.41 0.00 0.00 41.25 39.00 1i43 s ASN 83 CO -0.01 -0.83 -0.01 0.28 -1.51 0.00 0.00 177.10 175.02 1i43 s THR 84 N 1.90 0.03 -0.13 1.60 -1.32 -1.26 -5.04 115.64 111.42 1i43 s THR 84 Ca 0.41 -0.21 0.17 0.00 -1.21 0.00 0.00 61.69 60.85 1i43 s THR 84 Cb -0.03 -0.07 -0.11 0.00 -1.51 0.00 0.00 72.50 70.78 1i43 s THR 84 CO -0.02 -0.11 0.89 0.77 -2.21 0.00 0.00 174.62 173.94 1i43 h SER 85 N 5.81 0.00 -5.45 8.08 4.64 -1.98 -3.43 113.55 121.23 1i43 h SER 85 Ca -0.26 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 60.89 1i43 h SER 85 Cb 1.21 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.17 1i43 h SER 85 CO 0.49 0.53 -0.46 0.00 -0.87 0.00 0.00 176.83 176.52 1i43 s ALA 86 N -2.96 0.64 -0.03 5.18 0.00 -1.26 -1.00 121.76 122.34 1i43 s ALA 86 Ca -0.02 -1.38 0.05 0.00 0.00 0.00 0.00 51.96 50.62 1i43 s ALA 86 Cb 0.09 1.20 -0.01 0.00 0.00 0.00 0.00 23.12 24.40 1i43 s ALA 86 CO 0.80 -0.66 -0.19 0.71 0.00 0.00 0.00 175.76 176.43 1i43 s TYR 87 N -4.09 1.76 0.56 0.00 2.02 -0.40 -4.88 117.35 112.31 1i43 s TYR 87 Ca 0.31 -0.40 0.03 0.00 -0.37 0.00 0.00 57.07 56.64 1i43 s TYR 87 Cb 0.05 -1.15 0.05 0.00 -0.40 0.00 0.00 41.96 40.51 1i43 s TYR 87 CO 0.09 -0.08 0.78 -0.59 -1.57 0.00 0.00 175.55 174.18 1i43 s PHE 88 N -0.28 2.43 0.01 2.71 -0.12 -1.26 -4.74 117.98 116.73 1i43 s PHE 88 Ca 0.03 -0.22 0.03 0.00 -0.05 0.00 0.00 56.93 56.72 1i43 s PHE 88 Cb -0.09 -2.67 -0.01 0.00 -0.63 0.00 0.00 43.02 39.62 1i43 s PHE 88 CO 0.00 -0.98 -0.11 -0.06 -0.05 0.00 0.00 175.22 174.02 1i43 s PHE 89 N -2.75 0.95 0.24 3.49 0.40 -1.26 -5.04 117.98 114.01 1i43 s PHE 89 Ca 0.59 -0.24 -0.04 0.00 -0.60 0.00 0.00 56.93 56.65 1i43 s PHE 89 Cb -0.09 -0.59 0.27 0.00 0.51 0.00 0.00 43.02 43.12 1i43 s PHE 89 CO 0.39 -0.01 1.75 -0.91 0.70 0.00 0.00 175.22 177.14 1i43 h ASN 90 N 5.57 0.87 -5.01 1.36 2.35 -2.00 -3.46 115.58 115.26 1i43 h ASN 90 Ca -0.33 -0.20 -0.07 0.00 -0.55 0.00 0.00 56.30 55.15 1i43 h ASN 90 Cb 1.18 -0.23 -0.18 0.00 0.05 0.00 0.00 38.32 39.14 1i43 h ASN 90 CO 0.48 0.89 0.04 -1.59 -1.65 0.00 0.00 177.43 175.59 1i43 s LYS 91 N -5.11 0.99 0.49 0.81 -2.85 -1.26 -5.03 119.74 107.77 1i43 s LYS 91 Ca -0.10 -0.07 0.29 0.00 -1.00 0.00 0.00 55.97 55.09 1i43 s LYS 91 Cb 0.15 0.45 1.38 0.00 -2.06 0.00 0.00 37.83 37.75 1i43 s LYS 91 CO 0.82 -0.33 1.79 1.15 0.10 0.00 0.00 175.35 178.89 1i43 h THR 92 N 3.02 0.45 -0.33 3.79 2.02 -1.99 0.11 112.91 119.97 1i43 h THR 92 Ca -0.29 -0.05 0.02 0.00 0.77 0.00 0.00 66.41 66.86 1i43 h THR 92 Cb 1.18 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 1i43 h THR 92 CO 0.40 0.03 0.17 -1.28 0.37 0.00 0.00 175.52 175.21 1i43 h SER 93 N 0.15 0.26 -0.35 4.18 0.87 -2.00 -1.46 113.55 115.21 1i43 h SER 93 Ca 0.57 0.01 -0.13 0.00 -1.23 0.00 0.00 61.79 61.02 1i43 h SER 93 Cb 1.95 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 63.86 1i43 h SER 93 CO -0.12 0.20 -0.24 -0.33 -0.53 0.00 0.00 176.83 175.80 1i43 h GLU 94 N 0.36 0.86 -0.95 2.24 5.08 -1.22 -1.99 114.58 118.95 1i43 h GLU 94 Ca 0.14 -0.37 0.08 0.00 -1.00 0.00 0.00 59.36 58.21 1i43 h GLU 94 Cb 0.04 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.19 1i43 h GLU 94 CO -0.09 1.01 0.60 1.25 -1.00 0.00 0.00 179.01 180.78 1i43 h LEU 95 N 0.74 0.93 -0.41 1.33 5.85 -0.94 -0.81 115.31 121.99 1i43 h LEU 95 Ca 0.09 0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.73 1i43 h LEU 95 Cb 0.79 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 1i43 h LEU 95 CO 0.07 0.57 -0.18 0.40 -0.34 0.00 0.00 178.44 178.96 1i43 h ILE 96 N 1.05 1.28 -0.44 4.05 2.04 -0.99 -2.10 117.51 122.40 1i43 h ILE 96 Ca 0.43 -1.31 0.07 0.00 1.00 0.00 0.00 64.86 65.05 1i43 h ILE 96 Cb 0.26 1.25 -0.06 0.00 -0.74 0.00 0.00 36.82 37.53 1i43 h ILE 96 CO -0.20 0.44 0.07 0.44 0.00 0.00 0.00 178.15 178.90 1i43 h ASP 97 N 0.66 -0.03 -0.79 1.72 3.32 -0.44 0.57 116.42 121.43 1i43 h ASP 97 Ca 0.09 0.08 -0.05 0.00 0.02 0.00 0.00 57.03 57.18 1i43 h ASP 97 Cb 0.73 0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.36 1i43 h ASP 97 CO 0.06 0.02 0.32 0.15 -1.72 0.00 0.00 179.24 178.06 1i43 h PHE 98 N 0.20 1.21 0.00 4.55 3.57 -1.13 0.21 116.94 125.55 1i43 h PHE 98 Ca 0.21 -0.09 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 1i43 h PHE 98 Cb 0.28 -0.36 -0.00 0.00 2.79 0.00 0.00 35.95 38.65 1i43 h PHE 98 CO -0.22 0.91 -0.04 0.87 -2.23 0.00 0.00 178.31 177.60 1i43 h LYS 99 N 1.15 0.00 -0.50 1.11 1.79 -0.61 -2.22 116.57 117.29 1i43 h LYS 99 Ca 0.26 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.68 1i43 h LYS 99 Cb 0.22 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.83 1i43 h LYS 99 CO -0.02 0.04 0.06 0.39 -1.08 0.00 0.00 179.45 178.83 1i43 n GLU 100 N -3.17 3.87 -2.23 3.15 1.02 0.11 -4.95 120.64 118.43 1i43 n GLU 100 Ca -0.00 -3.05 -0.20 0.00 -0.02 0.00 0.00 57.16 53.88 1i43 n GLU 100 Cb 0.28 -2.10 -0.03 0.00 -0.02 0.00 0.00 31.44 29.57 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 -0.00 -1.66 -0.00 3.49 4.01 -0.84 -4.86 118.16 118.29 1i43 n LYS 101 Ca 0.29 1.03 0.10 0.00 -0.51 0.00 0.00 58.31 59.22 1i43 n LYS 101 Cb 1.14 -5.64 -0.13 0.00 -0.51 0.00 0.00 35.03 29.89 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 -2.86 0.61 -4.18 1.97 1.74 0.67 -4.98 116.66 109.63 1i43 n ARG 102 Ca -0.23 -0.09 -0.12 0.00 -0.77 0.00 0.00 57.85 56.64 1i43 n ARG 102 Cb 0.68 -1.44 -0.10 0.00 -1.02 0.00 0.00 32.46 30.58 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 -3.09 0.86 -0.08 5.56 3.52 -1.18 -4.88 118.95 119.64 1i43 s ARG 103 Ca 0.00 -1.31 -0.02 0.00 -0.13 0.00 0.00 55.73 54.27 1i43 s ARG 103 Cb 0.14 -0.31 -0.03 0.00 -1.56 0.00 0.00 34.95 33.18 1i43 s ARG 103 CO 0.81 0.01 0.02 0.00 -0.81 0.00 0.00 175.30 175.33 1i43 s ALA 104 N -3.34 3.37 -0.22 6.12 0.00 -1.26 -4.46 121.76 121.98 1i43 s ALA 104 Ca 0.11 -0.79 -0.31 0.00 0.00 0.00 0.00 51.96 50.96 1i43 s ALA 104 Cb 0.03 -1.54 0.16 0.00 0.00 0.00 0.00 23.12 21.77 1i43 s ALA 104 CO -0.03 0.60 1.21 0.45 0.00 0.00 0.00 175.76 177.98 1i43 s SER 105 N -0.96 -0.16 0.22 0.00 0.15 -1.26 -5.03 113.70 106.66 1i43 s SER 105 Ca 0.14 0.12 0.23 0.00 0.70 0.00 0.00 55.95 57.14 1i43 s SER 105 Cb -0.11 0.14 0.02 0.00 -1.71 0.00 0.00 66.02 64.36 1i43 s SER 105 CO 0.03 -0.19 1.08 -0.26 1.20 0.00 0.00 173.24 175.10 1i43 h PHE 106 N 2.17 0.00 0.00 3.44 0.04 -1.92 -3.48 116.94 117.20 1i43 h PHE 106 Ca -0.11 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.66 1i43 h PHE 106 Cb 1.17 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.32 1i43 h PHE 106 CO 0.25 0.00 0.00 -1.91 -0.60 0.00 0.00 178.31 176.05 1i43 n GLU 107 N -2.70 0.00 -4.81 1.51 2.13 -1.26 -4.57 120.64 110.94 1i43 n GLU 107 Ca 0.00 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.57 1i43 n GLU 107 Cb 0.55 0.00 -0.15 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 1.69 0.61 4.31 5.04 -1.26 -1.28 117.35 126.45 1i43 s TYR 108 Ca 0.00 -0.33 0.28 0.00 -2.44 0.00 0.00 57.07 54.58 1i43 s TYR 108 Cb 0.00 -1.06 1.47 0.00 0.35 0.00 0.00 41.96 42.72 1i43 s TYR 108 CO 0.00 0.00 1.88 0.78 -1.34 0.00 0.00 175.55 176.87 1i43 h GLY 109 N 5.44 0.00 1.92 8.97 0.00 -1.27 0.33 103.07 118.46 1i43 h GLY 109 Ca -0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.94 1i43 h GLY 109 CO 0.47 0.00 0.00 -2.13 0.00 0.00 0.00 176.54 174.88 1i43 n ARG 110 N -3.51 0.07 -0.10 4.80 0.63 -1.26 -3.07 116.66 114.22 1i43 n ARG 110 Ca 0.06 0.08 0.07 0.00 -0.92 0.00 0.00 57.85 57.14 1i43 n ARG 110 Cb 0.63 -1.50 0.12 0.00 0.45 0.00 0.00 32.46 32.15 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 -1.46 0.27 0.00 -0.14 4.01 0.12 -4.72 117.16 115.23 1i43 n TYR 111 Ca 0.07 -0.24 0.00 0.00 -0.16 0.00 0.00 57.90 57.57 1i43 n TYR 111 Cb 0.27 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.29 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 0.75 2.88 3.63 2.72 0.00 -1.17 -4.93 105.19 109.06 1i43 n GLY 112 Ca 0.11 -1.47 -0.13 0.00 0.00 0.00 0.00 46.02 44.53 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 -0.74 0.18 1.61 3.84 -1.26 -4.39 114.94 114.18 1i43 s ASN 113 Ca 0.00 1.39 -0.13 0.00 0.21 0.00 0.00 52.86 54.33 1i43 s ASN 113 Cb 0.00 1.40 0.18 0.00 -0.55 0.00 0.00 41.25 42.28 1i43 s ASN 113 CO 0.00 -0.24 1.73 1.55 -2.79 0.00 0.00 177.10 177.35 1i43 h PRO 114 N 5.19 0.27 0.00 0.43 0.13 -1.96 -0.41 132.00 135.64 1i43 h PRO 114 Ca -0.29 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1i43 h PRO 114 Cb 1.17 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1i43 h PRO 114 CO 0.07 0.18 0.00 -2.37 -0.23 0.00 0.00 178.00 175.65 1i43 n THR 115 N -5.07 0.58 -0.06 1.56 5.66 -1.26 -3.34 114.28 112.35 1i43 n THR 115 Ca 0.05 0.13 -0.22 0.00 -3.05 0.00 0.00 64.05 60.96 1i43 n THR 115 Cb 0.22 -0.79 -0.13 0.00 -1.55 0.00 0.00 70.33 68.08 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 -1.56 1.64 -0.13 1.09 -1.04 -0.30 -4.20 114.28 109.78 1i43 n THR 116 Ca 0.05 -0.32 0.12 0.00 -2.04 0.00 0.00 64.05 61.86 1i43 n THR 116 Cb 0.25 -1.89 0.48 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 -0.52 0.87 -0.72 12.58 -1.51 -1.18 -0.40 116.25 125.37 1i43 h VAL 117 Ca -0.40 -0.16 0.09 0.00 -1.23 0.00 0.00 66.70 64.99 1i43 h VAL 117 Cb 1.65 0.36 -0.07 0.00 -2.13 0.00 0.00 31.29 31.10 1i43 h VAL 117 CO -0.09 0.09 0.37 0.58 -1.23 0.00 0.00 177.57 177.29 1i43 h VAL 118 N 0.47 0.88 -0.14 7.19 2.07 -1.72 0.39 116.25 125.38 1i43 h VAL 118 Ca 0.32 -0.22 -0.12 0.00 0.82 0.00 0.00 66.70 67.51 1i43 h VAL 118 Cb 0.62 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 1i43 h VAL 118 CO -0.10 0.12 -0.42 0.25 0.02 0.00 0.00 177.57 177.43 1i43 h LEU 119 N 0.64 0.33 -0.38 2.57 5.85 -1.28 -0.24 115.31 122.80 1i43 h LEU 119 Ca 0.35 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 1i43 h LEU 119 Cb 0.33 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1i43 h LEU 119 CO -0.25 0.72 0.11 -0.33 -0.34 0.00 0.00 178.44 178.35 1i43 h GLU 120 N 0.26 0.59 -0.03 1.25 5.08 -0.05 -2.02 114.58 119.66 1i43 h GLU 120 Ca 0.02 -0.13 -0.15 0.00 -1.00 0.00 0.00 59.36 58.10 1i43 h GLU 120 Cb 0.86 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 1i43 h GLU 120 CO 0.07 0.61 -0.66 0.93 -1.00 0.00 0.00 179.01 178.96 1i43 h GLU 121 N 0.47 0.14 0.16 2.33 5.08 -0.18 -2.11 114.58 120.46 1i43 h GLU 121 Ca 0.12 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1i43 h GLU 121 Cb 0.27 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1i43 h GLU 121 CO -0.00 0.74 -0.08 -0.22 -1.00 0.00 0.00 179.01 178.46 1i43 h LYS 122 N 0.10 -0.20 -0.22 2.33 3.64 -0.87 -1.72 116.57 119.63 1i43 h LYS 122 Ca -0.01 0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.30 1i43 h LYS 122 Cb 1.18 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 33.03 1i43 h LYS 122 CO 0.10 0.05 -0.23 0.82 -2.27 0.00 0.00 179.45 177.91 1i43 h ILE 123 N -0.44 1.25 -0.78 2.00 2.04 -1.42 -2.60 117.51 117.56 1i43 h ILE 123 Ca -0.02 -1.18 0.03 0.00 1.00 0.00 0.00 64.86 64.68 1i43 h ILE 123 Cb 0.34 1.34 -0.05 0.00 -0.74 0.00 0.00 36.82 37.72 1i43 h ILE 123 CO 0.04 0.37 0.50 0.28 0.00 0.00 0.00 178.15 179.34 1i43 h SER 124 N 0.36 0.84 -0.17 1.72 0.02 -1.21 -0.87 113.55 114.25 1i43 h SER 124 Ca 0.06 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 1i43 h SER 124 Cb 0.61 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 1i43 h SER 124 CO 0.04 0.59 0.03 0.00 -1.14 0.00 0.00 176.83 176.35 1i43 h ALA 125 N 1.32 0.22 -0.34 3.77 0.00 -0.97 0.29 119.26 123.55 1i43 h ALA 125 Ca 0.31 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.10 1i43 h ALA 125 Cb -0.02 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 1i43 h ALA 125 CO -0.10 -0.12 0.06 -0.07 0.00 0.00 0.00 179.25 179.02 1i43 h LEU 126 N 0.06 -0.00 -0.04 0.00 3.38 -1.10 -0.64 115.31 116.97 1i43 h LEU 126 Ca 0.05 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1i43 h LEU 126 Cb 0.30 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1i43 h LEU 126 CO 0.00 0.04 -0.03 -0.62 0.09 0.00 0.00 178.44 177.92 1i43 n GLU 127 N -5.10 0.38 -2.27 1.13 -0.58 -0.37 -4.89 120.64 108.94 1i43 n GLU 127 Ca 0.01 -0.04 -0.20 0.00 -0.42 0.00 0.00 57.16 56.52 1i43 n GLU 127 Cb 0.15 -1.50 -0.02 0.00 -0.57 0.00 0.00 31.44 29.50 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 1.33 -0.14 3.94 0.62 0.00 0.73 -4.77 105.19 106.91 1i43 n GLY 128 Ca 0.13 -0.06 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.95 3.01 -0.00 4.61 0.00 0.38 -5.00 121.76 121.80 1i43 s ALA 129 Ca 0.00 -1.15 -0.01 0.00 0.00 0.00 0.00 51.96 50.80 1i43 s ALA 129 Cb 0.00 -2.54 -0.27 0.00 0.00 0.00 0.00 23.12 20.31 1i43 s ALA 129 CO 0.00 -1.64 0.83 1.49 0.00 0.00 0.00 175.76 176.44 1i43 h GLU 130 N -0.87 0.22 -1.86 0.00 4.81 -1.82 -3.44 114.58 111.62 1i43 h GLU 130 Ca -0.43 -0.37 -0.01 0.00 -0.13 0.00 0.00 59.36 58.42 1i43 h GLU 130 Cb 1.29 0.14 -0.21 0.00 0.63 0.00 0.00 28.75 30.60 1i43 h GLU 130 CO 0.51 1.06 0.30 0.45 -0.73 0.00 0.00 179.01 180.59 1i43 s SER 131 N -6.89 -0.57 0.01 1.04 0.15 -0.84 -4.81 113.70 101.80 1i43 s SER 131 Ca -0.09 0.68 0.05 0.00 0.70 0.00 0.00 55.95 57.30 1i43 s SER 131 Cb 0.07 0.54 -0.02 0.00 -1.71 0.00 0.00 66.02 64.91 1i43 s SER 131 CO 0.84 -0.49 -0.16 -0.89 1.20 0.00 0.00 173.24 173.74 1i43 s THR 132 N -1.01 1.30 -0.06 6.45 2.01 -1.26 -1.95 115.64 121.11 1i43 s THR 132 Ca -0.07 -0.88 0.04 0.00 0.31 0.00 0.00 61.69 61.09 1i43 s THR 132 Cb -0.01 -1.12 -0.02 0.00 0.01 0.00 0.00 72.50 71.37 1i43 s THR 132 CO 0.06 0.22 -0.19 -0.22 -0.69 0.00 0.00 174.62 173.81 1i43 s LEU 133 N -0.76 2.41 -0.08 4.42 2.96 -0.04 -4.82 118.68 122.77 1i43 s LEU 133 Ca 0.05 -0.37 0.03 0.00 -0.22 0.00 0.00 54.13 53.62 1i43 s LEU 133 Cb -0.07 -1.47 -0.02 0.00 0.50 0.00 0.00 46.19 45.13 1i43 s LEU 133 CO 0.00 0.27 -0.17 -0.76 -1.32 0.00 0.00 176.35 174.37 1i43 s LEU 134 N -0.30 2.53 0.00 -0.68 1.43 -1.26 -2.10 118.68 118.30 1i43 s LEU 134 Ca 0.01 -0.34 0.01 0.00 -1.03 0.00 0.00 54.13 52.78 1i43 s LEU 134 Cb -0.13 -1.52 -0.00 0.00 0.03 0.00 0.00 46.19 44.57 1i43 s LEU 134 CO 0.03 0.25 0.02 0.23 0.23 0.00 0.00 176.35 177.10 1i43 n MET 135 N 2.97 1.11 0.20 1.70 2.81 -0.91 -4.48 117.12 120.53 1i43 n MET 135 Ca -0.18 -2.25 0.05 0.00 -1.81 0.00 0.00 57.70 53.51 1i43 n MET 135 Cb 0.52 0.75 0.43 0.00 -0.71 0.00 0.00 33.22 34.21 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 1.22 1.36 -2.70 3.04 0.00 -0.87 -2.15 119.26 119.17 1i43 h ALA 136 Ca -0.25 -0.29 0.10 0.00 0.00 0.00 0.00 54.91 54.48 1i43 h ALA 136 Cb 0.78 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.44 1i43 h ALA 136 CO 0.40 0.39 0.34 -1.54 0.00 0.00 0.00 179.25 178.85 1i43 s SER 137 N -6.77 -0.29 0.19 0.00 1.04 -1.26 -3.30 113.70 103.31 1i43 s SER 137 Ca -0.03 -0.39 -0.12 0.00 0.48 0.00 0.00 55.95 55.89 1i43 s SER 137 Cb 0.14 0.59 0.12 0.00 0.10 0.00 0.00 66.02 66.97 1i43 s SER 137 CO 0.70 -1.07 1.85 1.23 0.98 0.00 0.00 173.24 176.93 1i43 h GLY 138 N 2.00 0.89 0.83 7.32 0.00 -1.81 -2.11 103.07 110.19 1i43 h GLY 138 Ca -0.23 -0.32 0.05 0.00 0.00 0.00 0.00 47.33 46.82 1i43 h GLY 138 CO 0.27 0.30 0.65 -0.33 0.00 0.00 0.00 176.54 177.43 1i43 h MET 139 N 0.83 1.20 -0.04 4.80 2.86 -1.92 -2.08 114.93 120.58 1i43 h MET 139 Ca 0.24 -0.07 0.01 0.00 -2.06 0.00 0.00 59.70 57.82 1i43 h MET 139 Cb -0.07 -0.27 -0.01 0.00 0.06 0.00 0.00 31.60 31.31 1i43 h MET 139 CO -0.06 0.79 -0.04 0.00 1.06 0.00 0.00 176.91 178.66 1i43 h ALA 141 N 0.99 -0.66 0.07 0.00 0.00 -0.83 0.18 119.26 119.01 1i43 h ALA 141 Ca 0.03 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1i43 h ALA 141 Cb 0.09 0.59 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1i43 h ALA 141 CO -0.07 -0.93 -0.11 0.77 0.00 0.00 0.00 179.25 178.91 1i43 h SER 142 N -0.62 -0.31 -0.05 0.00 0.02 -1.35 0.29 113.55 111.53 1i43 h SER 142 Ca 0.02 0.04 0.04 0.00 -0.84 0.00 0.00 61.79 61.04 1i43 h SER 142 Cb 0.63 0.12 -0.06 0.00 0.14 0.00 0.00 62.40 63.23 1i43 h SER 142 CO -0.19 -0.17 -0.34 0.74 -1.14 0.00 0.00 176.83 175.73 1i43 h THR 143 N -0.23 0.26 -0.71 -2.27 2.02 -0.82 0.12 112.91 111.28 1i43 h THR 143 Ca 0.02 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.14 1i43 h THR 143 Cb 0.24 0.26 -0.03 0.00 -1.74 0.00 0.00 68.15 66.88 1i43 h THR 143 CO -0.06 0.00 0.23 0.58 0.37 0.00 0.00 175.52 176.64 1i43 h VAL 144 N -0.46 1.26 -0.20 3.16 2.07 -0.56 -0.63 116.25 120.88 1i43 h VAL 144 Ca 0.07 -0.88 -0.06 0.00 0.82 0.00 0.00 66.70 66.66 1i43 h VAL 144 Cb 0.57 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1i43 h VAL 144 CO -0.31 0.34 -0.13 -0.03 0.02 0.00 0.00 177.57 177.46 1i43 h MET 145 N 1.05 0.33 -0.02 1.57 -1.53 -0.57 -1.21 114.93 114.54 1i43 h MET 145 Ca 0.23 -0.08 -0.04 0.00 -3.44 0.00 0.00 59.70 56.37 1i43 h MET 145 Cb 0.29 -0.04 0.00 0.00 -0.55 0.00 0.00 31.60 31.30 1i43 h MET 145 CO -0.01 0.47 -0.13 -0.07 0.14 0.00 0.00 176.91 177.30 1i43 h LEU 146 N 0.31 0.15 -0.96 3.39 3.38 -0.36 -2.31 115.31 118.91 1i43 h LEU 146 Ca 0.06 -0.70 0.00 0.00 0.09 0.00 0.00 57.88 57.33 1i43 h LEU 146 Cb 0.43 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1i43 h LEU 146 CO 0.02 0.82 0.00 0.18 0.09 0.00 0.00 178.44 179.56 1i43 n LEU 147 N -4.62 0.64 -0.10 1.67 4.77 -0.28 -2.32 117.00 116.76 1i43 n LEU 147 Ca -0.09 0.70 -0.11 0.00 -0.03 0.00 0.00 56.01 56.48 1i43 n LEU 147 Cb 0.42 -0.67 -0.15 0.00 -2.33 0.00 0.00 43.42 40.69 1i43 n LEU 147 CO 0.37 -0.70 -1.18 0.00 -1.33 0.00 0.00 177.39 174.55 1i43 n ALA 148 N -1.78 1.50 -0.04 -1.18 0.00 -0.47 -4.71 120.51 113.83 1i43 n ALA 148 Ca 0.01 -1.27 -0.20 0.00 0.00 0.00 0.00 53.44 51.97 1i43 n ALA 148 Cb 0.16 -0.16 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 1i43 n ALA 148 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1i43 n LEU 149 N -2.82 2.72 -4.67 0.00 4.77 -0.87 -4.87 117.00 111.25 1i43 n LEU 149 Ca -0.35 0.11 -0.41 0.00 -0.03 0.00 0.00 56.01 55.33 1i43 n LEU 149 Cb 1.12 -1.05 -0.04 0.00 -2.33 0.00 0.00 43.42 41.11 1i43 n LEU 149 CO 0.39 0.87 0.56 -0.69 -1.33 0.00 0.00 177.39 177.20 1i43 s VAL 150 N -2.54 4.91 0.60 4.08 1.01 -0.98 -5.04 120.40 122.43 1i43 s VAL 150 Ca -0.26 1.57 -0.09 0.00 0.00 0.00 0.00 61.98 63.20 1i43 s VAL 150 Cb 0.07 -4.11 -0.02 0.00 0.00 0.00 0.00 36.38 32.33 1i43 s VAL 150 CO 0.71 0.06 0.96 -2.16 0.00 0.00 0.00 175.10 174.67 1i43 s PRO 151 N 1.95 3.29 0.21 2.72 0.05 -1.26 -4.80 135.00 137.16 1i43 s PRO 151 Ca 0.37 0.39 -0.32 0.00 0.05 0.00 0.00 61.00 61.50 1i43 s PRO 151 Cb -0.17 -2.18 -0.13 0.00 0.05 0.00 0.00 34.50 32.07 1i43 s PRO 151 CO 0.13 -0.60 1.64 0.00 0.05 0.00 0.00 177.00 178.22 1i43 n ALA 152 N -2.65 2.23 -0.45 8.56 0.00 -1.26 -1.11 120.51 125.84 1i43 n ALA 152 Ca 0.04 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1i43 n ALA 152 Cb 0.56 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.56 1i43 n ALA 152 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i43 n GLY 153 N 3.40 1.47 3.71 0.00 0.00 0.42 -4.92 105.19 109.28 1i43 n GLY 153 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.86 1.57 0.01 -0.02 0.00 -0.26 -4.65 107.32 102.10 1i43 s GLY 154 Ca 0.00 -0.52 0.07 0.00 0.00 0.00 0.00 44.72 44.27 1i43 s GLY 154 CO 0.00 0.11 -0.22 -1.58 0.00 0.00 0.00 173.10 171.41 1i43 s HIS 155 N -3.11 2.45 0.16 1.90 5.65 -1.26 -1.02 115.29 120.06 1i43 s HIS 155 Ca 0.66 -0.34 0.08 0.00 0.25 0.00 0.00 55.06 55.71 1i43 s HIS 155 Cb -0.16 -1.48 -0.04 0.00 -1.18 0.00 0.00 32.58 29.72 1i43 s HIS 155 CO 0.56 0.12 -0.18 -1.50 -0.65 0.00 0.00 174.74 173.08 1i43 s ILE 156 N -0.76 1.79 -0.06 0.89 2.07 0.53 -0.75 121.20 124.90 1i43 s ILE 156 Ca 0.12 -1.86 0.01 0.00 -1.41 0.00 0.00 60.65 57.51 1i43 s ILE 156 Cb -0.10 -1.80 0.02 0.00 0.13 0.00 0.00 42.46 40.71 1i43 s ILE 156 CO 0.02 -0.29 -0.07 -0.69 -1.91 0.00 0.00 174.94 172.00 1i43 s VAL 157 N -1.94 0.74 0.30 4.00 1.01 -0.77 0.11 120.40 123.85 1i43 s VAL 157 Ca 0.14 -0.23 0.04 0.00 0.00 0.00 0.00 61.98 61.93 1i43 s VAL 157 Cb -0.06 -0.74 -0.01 0.00 0.00 0.00 0.00 36.38 35.57 1i43 s VAL 157 CO 0.06 0.28 0.32 0.35 0.00 0.00 0.00 175.10 176.11 1i43 n THR 158 N 4.10 0.00 -3.12 3.92 -2.24 -0.72 -0.13 114.28 116.10 1i43 n THR 158 Ca -0.22 -1.95 -0.18 0.00 -2.27 0.00 0.00 64.05 59.43 1i43 n THR 158 Cb 0.51 1.04 0.01 0.00 -2.10 0.00 0.00 70.33 69.79 1i43 n THR 158 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1i43 s THR 159 N -3.04 3.31 -0.47 4.28 -4.23 -1.26 -0.92 115.64 113.31 1i43 s THR 159 Ca 0.32 -0.97 0.26 0.00 -1.18 0.00 0.00 61.69 60.12 1i43 s THR 159 Cb 0.01 -3.13 0.32 0.00 1.34 0.00 0.00 72.50 71.04 1i43 s THR 159 CO 0.23 -0.05 1.74 0.71 -0.54 0.00 0.00 174.62 176.71 1i43 h THR 160 N 0.67 0.00 -0.53 3.99 1.35 -1.43 -3.12 112.91 113.85 1i43 h THR 160 Ca -0.42 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 64.83 1i43 h THR 160 Cb 1.27 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 1i43 h THR 160 CO 0.48 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 176.22 1i43 n ASP 161 N -2.66 3.22 -4.57 5.36 9.92 -1.26 -4.98 116.55 121.58 1i43 n ASP 161 Ca 0.04 -2.13 -0.40 0.00 -0.53 0.00 0.00 54.79 51.77 1i43 n ASP 161 Cb 0.41 -0.42 0.03 0.00 -0.64 0.00 0.00 41.12 40.50 1i43 n ASP 161 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1i43 n TYR 163 N -1.10 2.25 -0.23 0.00 9.36 -1.26 -4.75 117.16 121.42 1i43 n TYR 163 Ca 0.11 0.24 -0.08 0.00 3.32 0.00 0.00 57.90 61.50 1i43 n TYR 163 Cb 0.43 -2.55 -0.07 0.00 -0.63 0.00 0.00 39.34 36.52 1i43 n TYR 163 CO 0.00 0.00 0.00 -0.09 0.22 0.00 0.00 176.86 176.99 1i43 h ARG 164 N 6.42 -0.06 -0.97 2.98 2.43 -1.94 0.58 114.38 123.83 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 1.26 0.01 -0.10 0.00 -0.42 0.00 0.00 29.97 30.73 1i43 h ARG 164 CO 0.89 -0.04 0.58 0.87 -1.51 0.00 0.00 179.97 180.76 1i43 h LYS 165 N -0.06 0.79 -0.42 0.20 6.56 -1.99 0.11 116.57 121.76 1i43 h LYS 165 Ca 0.09 -0.05 -0.07 0.00 -1.06 0.00 0.00 60.65 59.56 1i43 h LYS 165 Cb 0.30 -0.18 -0.02 0.00 -0.57 0.00 0.00 32.23 31.76 1i43 h LYS 165 CO -0.57 0.53 -0.04 1.15 -2.06 0.00 0.00 179.45 178.46 1i43 h THR 166 N 0.82 1.24 -0.31 -0.16 2.02 -1.49 -2.13 112.91 112.89 1i43 h THR 166 Ca 0.52 -1.00 -0.01 0.00 0.77 0.00 0.00 66.41 66.69 1i43 h THR 166 Cb 0.69 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 1i43 h THR 166 CO -0.33 0.34 0.14 -0.09 0.37 0.00 0.00 175.52 175.96 1i43 h ARG 167 N 0.65 0.45 -0.09 6.66 9.65 0.13 -2.35 114.38 129.48 1i43 h ARG 167 Ca 0.13 -0.07 0.03 0.00 -1.10 0.00 0.00 59.98 58.97 1i43 h ARG 167 Cb 0.46 -0.08 -0.04 0.00 -1.39 0.00 0.00 29.97 28.92 1i43 h ARG 167 CO 0.02 0.43 -0.13 0.82 2.80 0.00 0.00 179.97 183.91 1i43 h ILE 168 N 0.36 0.66 -0.64 1.20 2.04 -0.81 0.99 117.51 121.32 1i43 h ILE 168 Ca 0.11 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.05 1i43 h ILE 168 Cb 0.13 0.66 -0.07 0.00 -0.74 0.00 0.00 36.82 36.80 1i43 h ILE 168 CO -0.01 0.00 0.29 0.15 0.00 0.00 0.00 178.15 178.58 1i43 h PHE 169 N -0.17 0.52 -0.11 1.37 3.57 -1.29 0.36 116.94 121.19 1i43 h PHE 169 Ca 0.08 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.49 1i43 h PHE 169 Cb 0.28 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 1i43 h PHE 169 CO -0.23 0.18 -0.45 0.82 -2.23 0.00 0.00 178.31 176.41 1i43 h ILE 170 N 0.52 1.32 -0.00 1.41 2.04 -0.98 -0.13 117.51 121.68 1i43 h ILE 170 Ca 0.31 -1.61 0.00 0.00 1.00 0.00 0.00 64.86 64.56 1i43 h ILE 170 Cb 0.32 1.73 0.00 0.00 -0.74 0.00 0.00 36.82 38.14 1i43 h ILE 170 CO -0.26 0.48 -0.51 -0.62 0.00 0.00 0.00 178.15 177.24 1i43 n GLU 171 N -4.00 0.29 0.00 2.37 1.02 0.30 -4.19 120.64 116.44 1i43 n GLU 171 Ca -0.02 -0.19 0.00 0.00 -0.02 0.00 0.00 57.16 56.94 1i43 n GLU 171 Cb 0.51 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 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 -1.19 0.00 -0.14 2.62 -2.24 0.12 -4.83 114.28 108.62 1i43 n THR 172 Ca 0.07 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.56 1i43 n THR 172 Cb 0.35 -0.62 -0.10 0.00 -2.10 0.00 0.00 70.33 67.85 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 -1.48 1.53 -0.34 2.28 2.08 -0.10 -4.55 119.36 118.77 1i43 n ILE 173 Ca 0.00 -0.35 0.09 0.00 0.56 0.00 0.00 62.75 63.05 1i43 n ILE 173 Cb 0.32 -1.90 0.29 0.00 -0.75 0.00 0.00 39.64 37.59 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 0.84 -2.70 1.39 3.38 -1.62 -0.97 115.31 114.63 1i43 h LEU 174 Ca -0.67 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.36 1i43 h LEU 174 Cb 1.58 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 42.22 1i43 h LEU 174 CO -0.40 0.42 0.05 1.55 0.09 0.00 0.00 178.44 180.15 1i43 h PRO 175 N 0.89 0.00 0.00 1.13 0.13 -1.73 0.15 132.00 132.56 1i43 h PRO 175 Ca 0.50 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.60 1i43 h PRO 175 Cb 0.61 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.74 1i43 h PRO 175 CO -0.27 0.00 -0.12 0.87 -0.23 0.00 0.00 178.00 178.25 1i43 h LYS 176 N 0.00 0.00 -0.59 0.86 1.57 -1.41 0.77 116.57 117.77 1i43 h LYS 176 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1i43 h LYS 176 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1i43 h LYS 176 CO -0.00 0.12 0.00 -1.33 -0.57 0.00 0.00 179.45 177.67 1i43 n MET 177 N -3.55 4.35 -1.01 3.15 2.81 0.48 -4.91 117.12 118.43 1i43 n MET 177 Ca -0.01 -3.04 -0.00 0.00 -1.81 0.00 0.00 57.70 52.83 1i43 n MET 177 Cb 0.26 -2.10 -0.00 0.00 -0.71 0.00 0.00 33.22 30.67 1i43 n MET 177 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1i43 n GLY 178 N 0.78 0.26 3.66 3.03 0.00 0.26 -0.43 105.19 112.75 1i43 n GLY 178 Ca 0.27 -0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.48 4.64 0.12 -0.61 1.01 -0.96 -3.32 121.20 120.60 1i43 s ILE 179 Ca 0.00 1.97 0.03 0.00 0.00 0.00 0.00 60.65 62.66 1i43 s ILE 179 Cb 0.00 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.16 1i43 s ILE 179 CO 0.00 -0.15 0.18 0.28 0.00 0.00 0.00 174.94 175.24 1i43 s THR 180 N 3.09 4.88 0.09 2.92 -1.32 -0.19 -3.51 115.64 121.60 1i43 s THR 180 Ca 0.46 -0.79 0.04 0.00 -1.21 0.00 0.00 61.69 60.18 1i43 s THR 180 Cb -0.16 -3.45 -0.03 0.00 -1.51 0.00 0.00 72.50 67.34 1i43 s THR 180 CO 0.08 -0.01 -0.10 0.00 -2.21 0.00 0.00 174.62 172.38 1i43 s ALA 181 N -1.63 1.03 -0.18 11.08 0.00 -1.26 -0.35 121.76 130.45 1i43 s ALA 181 Ca 0.32 -1.12 0.01 0.00 0.00 0.00 0.00 51.96 51.18 1i43 s ALA 181 Cb -0.11 0.02 0.02 0.00 0.00 0.00 0.00 23.12 23.06 1i43 s ALA 181 CO 0.25 -0.02 -0.18 0.99 0.00 0.00 0.00 175.76 176.80 1i43 s THR 182 N -2.23 1.97 -0.28 0.00 2.01 0.12 -4.91 115.64 112.32 1i43 s THR 182 Ca 0.03 -0.95 -0.12 0.00 0.31 0.00 0.00 61.69 60.96 1i43 s THR 182 Cb -0.04 -1.82 -0.05 0.00 0.01 0.00 0.00 72.50 70.60 1i43 s THR 182 CO 0.00 0.46 0.25 -0.69 -0.69 0.00 0.00 174.62 173.95 1i43 s VAL 183 N 1.31 5.27 0.36 3.82 1.01 -1.26 -1.75 120.40 129.16 1i43 s VAL 183 Ca 0.04 0.30 0.08 0.00 0.00 0.00 0.00 61.98 62.40 1i43 s VAL 183 Cb -0.14 -3.58 -0.07 0.00 0.00 0.00 0.00 36.38 32.59 1i43 s VAL 183 CO -0.12 0.22 -0.05 0.27 0.00 0.00 0.00 175.10 175.42 1i43 s ILE 184 N 1.84 2.11 0.23 2.22 -4.36 -0.10 -4.88 121.20 118.26 1i43 s ILE 184 Ca 0.10 -2.12 -0.30 0.00 -0.26 0.00 0.00 60.65 58.06 1i43 s ILE 184 Cb -0.16 -2.77 -0.09 0.00 1.25 0.00 0.00 42.46 40.69 1i43 s ILE 184 CO 0.10 -0.13 0.94 -0.62 0.24 0.00 0.00 174.94 175.47 1i43 s ASP 185 N -3.64 7.64 0.31 4.36 2.15 -1.26 -1.05 116.67 125.18 1i43 s ASP 185 Ca 0.33 1.94 0.03 0.00 0.43 0.00 0.00 52.55 55.28 1i43 s ASP 185 Cb 0.05 -2.61 0.79 0.00 -0.30 0.00 0.00 42.92 40.85 1i43 s ASP 185 CO 0.17 0.15 1.59 -0.65 -0.17 0.00 0.00 175.17 176.26 1i43 h PRO 186 N 4.21 0.05 0.13 4.34 0.11 -1.94 -0.91 132.00 137.99 1i43 h PRO 186 Ca -0.45 -0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.38 1i43 h PRO 186 Cb 1.20 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1i43 h PRO 186 CO 0.68 0.03 -1.30 0.00 -0.21 0.00 0.00 178.00 177.21 1i43 h ALA 187 N 1.93 0.11 -0.22 -0.75 0.00 -1.92 -3.44 119.26 114.97 1i43 h ALA 187 Ca 0.60 -0.92 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 1i43 h ALA 187 Cb 1.28 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 1i43 h ALA 187 CO -0.84 0.98 0.49 -3.47 0.00 0.00 0.00 179.25 176.40 1i43 n ASP 188 N -3.53 0.87 0.08 0.00 -0.08 -0.35 -4.72 116.55 108.82 1i43 n ASP 188 Ca -0.10 -1.42 -0.07 0.00 -1.51 0.00 0.00 54.79 51.69 1i43 n ASP 188 Cb 1.03 -1.38 -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 7.39 1.59 -0.48 5.18 2.07 -1.85 -3.21 116.25 126.94 1i43 h VAL 189 Ca 0.01 -2.97 -0.01 0.00 0.82 0.00 0.00 66.70 64.54 1i43 h VAL 189 Cb 1.03 2.65 -0.02 0.00 -1.52 0.00 0.00 31.29 33.43 1i43 h VAL 189 CO 1.14 0.86 0.26 1.23 0.02 0.00 0.00 177.57 181.07 1i43 h GLY 190 N 2.37 0.72 0.47 2.17 0.00 -1.98 0.09 103.07 106.90 1i43 h GLY 190 Ca -0.03 -0.33 0.08 0.00 0.00 0.00 0.00 47.33 47.05 1i43 h GLY 190 CO 0.13 0.31 0.23 0.00 0.00 0.00 0.00 176.54 177.22 1i43 h ALA 191 N 1.10 0.75 0.09 3.60 0.00 -1.95 0.39 119.26 123.24 1i43 h ALA 191 Ca 0.17 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1i43 h ALA 191 Cb 0.06 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1i43 h ALA 191 CO -0.03 -0.17 -0.04 1.25 0.00 0.00 0.00 179.25 180.26 1i43 h LEU 192 N 0.43 -0.10 -1.28 0.00 5.85 -1.42 0.18 115.31 118.97 1i43 h LEU 192 Ca 0.29 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 59.04 1i43 h LEU 192 Cb 0.32 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.33 1i43 h LEU 192 CO -0.27 -0.05 0.52 -0.08 -0.34 0.00 0.00 178.44 178.22 1i43 h GLU 193 N -0.15 0.87 0.23 1.25 4.81 -0.05 0.38 114.58 121.92 1i43 h GLU 193 Ca -0.01 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 1i43 h GLU 193 Cb 0.12 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.30 1i43 h GLU 193 CO 0.02 0.57 -0.11 1.25 -0.73 0.00 0.00 179.01 180.01 1i43 h LEU 194 N 0.89 -0.26 -1.37 1.64 5.85 0.23 -2.91 115.31 119.39 1i43 h LEU 194 Ca 0.33 -0.25 0.09 0.00 0.84 0.00 0.00 57.88 58.90 1i43 h LEU 194 Cb 0.17 0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.22 1i43 h LEU 194 CO -0.11 0.16 0.51 0.00 -0.34 0.00 0.00 178.44 178.65 1i43 h ALA 195 N -0.14 1.77 0.00 1.25 0.00 -0.27 0.95 119.26 122.82 1i43 h ALA 195 Ca -0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1i43 h ALA 195 Cb 0.50 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1i43 h ALA 195 CO 0.05 0.07 -0.04 -0.07 0.00 0.00 0.00 179.25 179.26 1i43 h LEU 196 N 0.72 0.00 0.02 0.00 -0.00 -0.16 -3.12 115.31 112.77 1i43 h LEU 196 Ca 0.36 0.00 -0.39 0.00 -0.00 0.00 0.00 57.88 57.84 1i43 h LEU 196 Cb 0.43 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 41.03 1i43 h LEU 196 CO -0.13 0.04 -2.39 0.59 -0.00 0.00 0.00 178.44 176.55 1i43 n ASN 197 N -3.91 2.00 0.00 -0.43 3.02 0.17 -4.63 115.26 111.48 1i43 n ASN 197 Ca -0.03 -0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.50 1i43 n ASN 197 Cb 0.13 -0.54 0.00 0.00 -0.61 0.00 0.00 39.78 38.76 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 -3.43 0.00 -2.35 3.52 6.02 -0.27 -4.82 117.38 116.05 1i43 n GLN 198 Ca -0.45 0.09 -0.24 0.00 -0.01 0.00 0.00 57.00 56.39 1i43 n GLN 198 Cb 0.98 -1.05 0.07 0.00 1.02 0.00 0.00 30.24 31.26 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 -1.19 2.20 -0.83 -1.09 3.01 -1.18 -5.02 119.74 115.64 1i43 s LYS 199 Ca 0.00 -0.49 -0.17 0.00 -1.01 0.00 0.00 55.97 54.30 1i43 s LYS 199 Cb 0.00 -2.27 0.15 0.00 -1.01 0.00 0.00 37.83 34.70 1i43 s LYS 199 CO 0.00 -1.14 0.94 0.21 0.51 0.00 0.00 175.35 175.87 1i43 s LYS 200 N -5.12 3.48 0.20 1.68 2.20 -1.26 -4.62 119.74 116.30 1i43 s LYS 200 Ca 0.60 -1.86 -0.31 0.00 -0.36 0.00 0.00 55.97 54.04 1i43 s LYS 200 Cb -0.10 -4.63 -0.10 0.00 -1.51 0.00 0.00 37.83 31.49 1i43 s LYS 200 CO 0.43 -1.59 1.53 0.08 -0.36 0.00 0.00 175.35 175.44 1i43 s VAL 201 N 1.97 2.59 -0.17 4.02 1.01 -1.26 -4.17 120.40 124.39 1i43 s VAL 201 Ca 0.24 0.45 -0.11 0.00 0.00 0.00 0.00 61.98 62.56 1i43 s VAL 201 Cb -0.10 -3.29 -0.22 0.00 0.00 0.00 0.00 36.38 32.77 1i43 s VAL 201 CO -0.06 0.05 0.21 0.59 0.00 0.00 0.00 175.10 175.89 1i43 n ASN 202 N 3.33 2.02 -3.65 3.32 4.13 0.07 -4.19 115.26 120.27 1i43 n ASN 202 Ca 0.11 0.25 -0.14 0.00 1.68 0.00 0.00 54.58 56.48 1i43 n ASN 202 Cb 0.39 -0.85 -0.08 0.00 -1.54 0.00 0.00 39.78 37.70 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 -7.28 -0.23 -0.24 3.41 0.20 -1.24 -1.65 118.68 111.66 1i43 s LEU 203 Ca -0.27 1.01 -0.06 0.00 0.69 0.00 0.00 54.13 55.50 1i43 s LEU 203 Cb 0.07 2.05 -0.02 0.00 -0.43 0.00 0.00 46.19 47.86 1i43 s LEU 203 CO 0.68 -0.30 0.04 0.12 -0.29 0.00 0.00 176.35 176.60 1i43 s PHE 204 N -0.10 3.06 -0.04 5.38 5.36 0.43 -1.84 117.98 130.24 1i43 s PHE 204 Ca -0.03 -0.53 0.07 0.00 -0.96 0.00 0.00 56.93 55.47 1i43 s PHE 204 Cb -0.03 -2.20 -0.01 0.00 -0.34 0.00 0.00 43.02 40.43 1i43 s PHE 204 CO 0.03 -0.39 -0.25 0.12 -1.46 0.00 0.00 175.22 173.27 1i43 s PHE 205 N 1.53 2.30 0.01 10.12 5.36 0.82 -1.08 117.98 137.04 1i43 s PHE 205 Ca 0.06 -0.56 -0.29 0.00 -0.96 0.00 0.00 56.93 55.18 1i43 s PHE 205 Cb -0.15 -1.50 0.10 0.00 -0.34 0.00 0.00 43.02 41.14 1i43 s PHE 205 CO 0.02 -0.12 1.10 -0.08 -1.46 0.00 0.00 175.22 174.68 1i43 s THR 206 N -0.38 0.00 0.23 0.12 -1.32 -0.79 -4.00 115.64 109.52 1i43 s THR 206 Ca 0.03 -0.28 0.09 0.00 -1.21 0.00 0.00 61.69 60.32 1i43 s THR 206 Cb -0.11 -1.64 -0.04 0.00 -1.51 0.00 0.00 72.50 69.20 1i43 s THR 206 CO 0.01 0.00 0.02 -1.83 -2.21 0.00 0.00 174.62 170.61 1i43 s GLU 207 N -2.82 2.39 -0.30 7.08 -1.05 -1.26 -0.66 118.70 122.07 1i43 s GLU 207 Ca 0.11 -1.28 -0.08 0.00 -0.15 0.00 0.00 54.97 53.58 1i43 s GLU 207 Cb 0.01 -2.27 0.17 0.00 -0.44 0.00 0.00 34.13 31.60 1i43 s GLU 207 CO -0.03 0.40 0.77 0.45 0.95 0.00 0.00 175.26 177.80 1i43 s SER 208 N -3.44 -1.00 1.00 0.83 0.15 -1.10 -4.20 113.70 105.95 1i43 s SER 208 Ca 0.30 0.86 -0.11 0.00 0.70 0.00 0.00 55.95 57.70 1i43 s SER 208 Cb -0.08 1.93 0.19 0.00 -1.71 0.00 0.00 66.02 66.36 1i43 s SER 208 CO 0.20 -0.19 1.10 -2.65 1.20 0.00 0.00 173.24 172.90 1i43 n PRO 209 N 5.37 -1.13 -3.28 5.44 -0.02 -1.26 -4.51 135.00 135.61 1i43 n PRO 209 Ca -0.06 -0.27 -0.22 0.00 -2.02 0.00 0.00 63.50 60.93 1i43 n PRO 209 Cb 0.51 -2.31 -0.00 0.00 -0.02 0.00 0.00 33.50 31.69 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 -2.56 4.41 -0.13 3.45 -1.32 0.66 -4.68 115.64 115.47 1i43 s THR 210 Ca 0.67 -0.64 -0.01 0.00 -1.21 0.00 0.00 61.69 60.50 1i43 s THR 210 Cb -0.24 -3.60 -0.02 0.00 -1.51 0.00 0.00 72.50 67.13 1i43 s THR 210 CO 0.60 -0.35 -0.09 0.21 -2.21 0.00 0.00 174.62 172.78 1i43 s ASN 211 N -4.14 4.38 0.00 8.08 2.47 -1.26 0.03 114.94 124.50 1i43 s ASN 211 Ca 0.44 -0.21 0.19 0.00 0.42 0.00 0.00 52.86 53.70 1i43 s ASN 211 Cb -0.10 -1.60 0.21 0.00 -1.45 0.00 0.00 41.25 38.31 1i43 s ASN 211 CO 0.35 0.19 1.16 -0.81 -3.72 0.00 0.00 177.10 174.27 1i43 n PRO 212 N 3.34 1.83 -0.26 0.43 -0.04 -1.26 -4.74 135.00 134.31 1i43 n PRO 212 Ca -0.18 -1.76 0.04 0.00 -0.04 0.00 0.00 63.50 61.56 1i43 n PRO 212 Cb 0.53 -1.38 0.15 0.00 -0.04 0.00 0.00 33.50 32.75 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 1.11 0.62 -4.14 0.54 3.72 -1.25 -4.59 117.46 113.47 1i43 n PHE 213 Ca 0.12 -0.24 -0.31 0.00 -0.05 0.00 0.00 57.45 56.97 1i43 n PHE 213 Cb 0.49 -0.14 -0.08 0.00 -0.94 0.00 0.00 39.48 38.81 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 0.30 -0.82 -4.76 4.37 4.77 0.10 -4.76 117.00 116.21 1i43 n LEU 214 Ca 0.10 -1.13 -0.40 0.00 -0.03 0.00 0.00 56.01 54.56 1i43 n LEU 214 Cb 0.45 -1.41 -0.04 0.00 -2.33 0.00 0.00 43.42 40.08 1i43 n LEU 214 CO 0.10 0.32 0.78 -0.13 -1.33 0.00 0.00 177.39 177.12 1i43 s ARG 215 N -6.78 4.57 0.23 3.23 1.81 -1.25 -4.30 118.95 116.46 1i43 s ARG 215 Ca 0.23 1.74 0.08 0.00 -1.72 0.00 0.00 55.73 56.06 1i43 s ARG 215 Cb -0.13 -3.09 -0.04 0.00 -0.45 0.00 0.00 34.95 31.24 1i43 s ARG 215 CO 0.89 0.17 0.07 0.00 -0.68 0.00 0.00 175.30 175.75 1i43 s VAL 217 N -2.08 1.52 -0.94 0.00 1.01 -1.26 -4.69 120.40 113.97 1i43 s VAL 217 Ca 0.31 -0.73 -0.25 0.00 0.00 0.00 0.00 61.98 61.31 1i43 s VAL 217 Cb -0.08 -1.33 -0.09 0.00 0.00 0.00 0.00 36.38 34.88 1i43 s VAL 217 CO 0.21 0.44 2.08 -0.62 0.00 0.00 0.00 175.10 177.21 1i43 s ASP 218 N 0.31 4.64 0.12 3.32 -1.08 -1.26 -4.77 116.67 117.95 1i43 s ASP 218 Ca -0.11 -0.67 -0.30 0.00 -0.52 0.00 0.00 52.55 50.95 1i43 s ASP 218 Cb -0.15 -2.57 -0.07 0.00 -1.46 0.00 0.00 42.92 38.67 1i43 s ASP 218 CO 0.04 -3.28 1.58 0.40 0.52 0.00 0.00 175.17 174.44 1i43 h ILE 219 N 7.15 0.15 -0.41 4.11 2.04 -1.96 0.19 117.51 128.78 1i43 h ILE 219 Ca 0.08 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.01 1i43 h ILE 219 Cb 0.99 0.15 -0.09 0.00 -0.74 0.00 0.00 36.82 37.13 1i43 h ILE 219 CO 1.14 0.00 -0.45 -0.08 0.00 0.00 0.00 178.15 178.76 1i43 h GLU 220 N -0.55 -0.33 0.63 2.37 4.81 -1.86 0.18 114.58 119.84 1i43 h GLU 220 Ca 0.05 0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1i43 h GLU 220 Cb 0.64 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.09 1i43 h GLU 220 CO -0.34 -0.22 -0.40 1.25 -0.73 0.00 0.00 179.01 178.57 1i43 h LEU 221 N -0.34 -1.02 -1.00 1.64 5.85 -1.78 -2.47 115.31 116.20 1i43 h LEU 221 Ca 0.13 0.06 0.27 0.00 0.84 0.00 0.00 57.88 59.18 1i43 h LEU 221 Cb 0.59 0.30 -0.13 0.00 0.37 0.00 0.00 40.66 41.78 1i43 h LEU 221 CO -0.58 -0.61 0.59 0.58 -0.34 0.00 0.00 178.44 178.08 1i43 h VAL 222 N -0.97 0.45 -0.04 1.05 2.07 -0.37 0.41 116.25 118.85 1i43 h VAL 222 Ca -0.08 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.27 1i43 h VAL 222 Cb 0.78 -0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1i43 h VAL 222 CO 0.08 0.09 0.03 0.28 0.02 0.00 0.00 177.57 178.06 1i43 h SER 223 N 0.49 0.05 -0.04 0.57 0.02 -0.43 -2.50 113.55 111.71 1i43 h SER 223 Ca 0.68 -0.01 0.03 0.00 -0.84 0.00 0.00 61.79 61.65 1i43 h SER 223 Cb 1.39 -0.01 -0.04 0.00 0.14 0.00 0.00 62.40 63.87 1i43 h SER 223 CO -0.52 0.04 -0.21 0.50 -1.14 0.00 0.00 176.83 175.50 1i43 h LYS 224 N 0.04 -0.30 -0.76 3.45 3.64 -0.46 -0.67 116.57 121.51 1i43 h LYS 224 Ca 0.01 0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.46 1i43 h LYS 224 Cb 0.00 0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 31.84 1i43 h LYS 224 CO -0.00 -0.20 0.47 -0.07 -2.27 0.00 0.00 179.45 177.37 1i43 h LEU 225 N -0.31 0.74 0.74 5.20 3.38 -1.40 -1.97 115.31 121.69 1i43 h LEU 225 Ca 0.07 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1i43 h LEU 225 Cb 0.41 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.02 1i43 h LEU 225 CO -0.22 0.50 -0.35 0.00 0.09 0.00 0.00 178.44 178.45 1i43 h HIS 227 N -1.16 0.00 -0.13 0.00 3.86 -1.09 0.32 115.15 116.95 1i43 h HIS 227 Ca -0.10 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.04 1i43 h HIS 227 Cb 0.76 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.22 1i43 h HIS 227 CO 0.02 0.00 -0.22 1.49 0.86 0.00 0.00 177.93 180.08 1i43 h GLU 228 N 0.00 0.23 -0.49 2.45 4.81 -1.22 -2.67 114.58 117.69 1i43 h GLU 228 Ca 0.27 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 1i43 h GLU 228 Cb 1.27 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.62 1i43 h GLU 228 CO -0.00 0.45 0.00 1.63 -0.73 0.00 0.00 179.01 180.35 1i43 n LYS 229 N -4.20 2.92 -0.94 1.92 4.76 0.10 -4.97 118.16 117.77 1i43 n LYS 229 Ca -0.01 -2.37 0.00 0.00 -2.87 0.00 0.00 58.31 53.06 1i43 n LYS 229 Cb 0.33 -1.46 0.00 0.00 -1.84 0.00 0.00 35.03 32.06 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 0.85 0.60 3.87 0.72 0.00 -0.56 -4.88 105.19 105.79 1i43 n GLY 230 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.31 3.18 0.17 4.61 0.00 -0.67 -4.91 121.76 121.82 1i43 s ALA 231 Ca 0.00 -0.10 0.03 0.00 0.00 0.00 0.00 51.96 51.89 1i43 s ALA 231 Cb 0.00 -2.95 -0.03 0.00 0.00 0.00 0.00 23.12 20.13 1i43 s ALA 231 CO 0.00 -0.41 0.28 -0.51 0.00 0.00 0.00 175.76 175.12 1i43 s LEU 232 N -4.60 4.25 -0.12 0.00 1.43 -0.66 -3.71 118.68 115.28 1i43 s LEU 232 Ca 0.54 0.10 0.01 0.00 -1.03 0.00 0.00 54.13 53.75 1i43 s LEU 232 Cb -0.10 -2.82 0.02 0.00 0.03 0.00 0.00 46.19 43.32 1i43 s LEU 232 CO 0.43 0.03 -0.13 -0.69 0.23 0.00 0.00 176.35 176.22 1i43 s VAL 233 N -1.80 1.36 -0.13 -1.59 1.01 -1.26 0.16 120.40 118.15 1i43 s VAL 233 Ca 0.34 -0.53 0.02 0.00 0.00 0.00 0.00 61.98 61.81 1i43 s VAL 233 Cb -0.10 -1.28 0.01 0.00 0.00 0.00 0.00 36.38 35.01 1i43 s VAL 233 CO 0.28 0.42 -0.19 0.00 0.00 0.00 0.00 175.10 175.61 1i43 s ILE 235 N 0.97 3.42 -0.85 0.00 -1.09 0.39 -1.88 121.20 122.15 1i43 s ILE 235 Ca -0.05 -0.54 -0.15 0.00 -2.23 0.00 0.00 60.65 57.68 1i43 s ILE 235 Cb -0.15 -2.44 0.21 0.00 -1.58 0.00 0.00 42.46 38.50 1i43 s ILE 235 CO -0.03 0.53 0.83 -0.62 -1.23 0.00 0.00 174.94 174.42 1i43 s ASP 236 N 0.11 6.77 -0.13 3.58 -1.08 0.16 -0.89 116.67 125.20 1i43 s ASP 236 Ca -0.04 -2.64 0.01 0.00 -0.52 0.00 0.00 52.55 49.37 1i43 s ASP 236 Cb -0.14 -2.24 0.19 0.00 -1.46 0.00 0.00 42.92 39.27 1i43 s ASP 236 CO 0.04 -0.63 1.25 0.61 0.52 0.00 0.00 175.17 176.96 1i43 n GLY 237 N 4.14 2.69 0.44 2.66 0.00 -0.88 -2.71 105.19 111.53 1i43 n GLY 237 Ca 0.16 -0.31 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 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 0.29 0.07 -0.20 2.61 2.02 -1.88 0.22 112.91 116.05 1i43 h THR 238 Ca 0.18 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.35 1i43 h THR 238 Cb 1.52 0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 1i43 h THR 238 CO 0.31 0.00 0.10 -0.26 0.37 0.00 0.00 175.52 176.04 1i43 h PHE 239 N -0.52 0.26 0.06 3.16 0.04 -1.83 -3.17 116.94 114.93 1i43 h PHE 239 Ca 0.06 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.83 1i43 h PHE 239 Cb 0.65 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 38.72 1i43 h PHE 239 CO -0.55 0.19 -0.03 0.00 -0.60 0.00 0.00 178.31 177.32 1i43 h ALA 240 N 1.84 -0.07 0.00 2.45 0.00 -1.47 -3.41 119.26 118.59 1i43 h ALA 240 Ca 0.07 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1i43 h ALA 240 Cb 0.02 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1i43 h ALA 240 CO -0.01 -0.15 0.00 2.41 0.00 0.00 0.00 179.25 181.50 1i43 n THR 241 N -4.78 -0.72 0.00 0.00 -1.04 0.67 -3.81 114.28 104.60 1i43 n THR 241 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 1i43 n THR 241 Cb 0.32 -0.03 0.00 0.00 -1.82 0.00 0.00 70.33 68.79 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 -0.13 0.00 0.08 -2.82 -0.04 -1.26 -1.83 135.00 129.00 1i43 n PRO 242 Ca 0.00 0.35 -0.22 0.00 -0.04 0.00 0.00 63.50 63.59 1i43 n PRO 242 Cb 0.00 -1.56 -0.15 0.00 -0.04 0.00 0.00 33.50 31.75 1i43 n PRO 242 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1i43 h LEU 243 N 0.00 0.60 0.00 1.53 3.38 -1.93 -3.36 115.31 115.54 1i43 h LEU 243 Ca 0.00 -0.88 0.00 0.00 0.09 0.00 0.00 57.88 57.09 1i43 h LEU 243 Cb 0.11 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1i43 h LEU 243 CO 0.00 1.74 -0.03 0.78 0.09 0.00 0.00 178.44 181.01 1i43 h ASN 244 N 0.11 0.00 -4.69 -0.43 2.35 -1.46 -3.45 115.58 108.00 1i43 h ASN 244 Ca -0.33 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.41 1i43 h ASN 244 Cb 2.10 0.00 -0.20 0.00 0.05 0.00 0.00 38.32 40.27 1i43 h ASN 244 CO 0.18 0.00 0.32 0.00 -1.65 0.00 0.00 177.43 176.28 1i43 s GLN 245 N -3.17 0.90 -0.73 0.81 -2.07 -1.18 -1.05 119.66 113.17 1i43 s GLN 245 Ca 0.08 0.18 0.04 0.00 -1.82 0.00 0.00 55.36 53.85 1i43 s GLN 245 Cb 0.08 0.43 0.24 0.00 -1.09 0.00 0.00 33.01 32.67 1i43 s GLN 245 CO 0.65 -0.29 0.82 1.63 -1.32 0.00 0.00 175.29 176.78 1i43 n LYS 246 N 0.78 2.72 -0.41 9.60 4.76 -1.26 -4.40 118.16 129.96 1i43 n LYS 246 Ca -0.16 -4.62 0.33 0.00 -2.87 0.00 0.00 58.31 50.99 1i43 n LYS 246 Cb 0.58 -2.31 0.62 0.00 -1.84 0.00 0.00 35.03 32.07 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 4.65 2.63 -0.46 7.82 0.00 -1.94 0.26 119.26 132.21 1i43 h ALA 247 Ca 0.19 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 1i43 h ALA 247 Cb 0.68 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1i43 h ALA 247 CO 0.89 -1.17 0.03 -0.07 0.00 0.00 0.00 179.25 178.94 1i43 h LEU 248 N 0.17 0.77 -1.10 0.00 3.38 -1.86 -0.83 115.31 115.84 1i43 h LEU 248 Ca 0.74 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 58.40 1i43 h LEU 248 Cb 2.25 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 42.79 1i43 h LEU 248 CO -0.35 0.87 -0.12 0.00 0.09 0.00 0.00 178.44 178.94 1i43 h ALA 249 N 0.93 1.00 -0.00 1.53 0.00 -0.82 -2.66 119.26 119.24 1i43 h ALA 249 Ca 0.14 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1i43 h ALA 249 Cb 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1i43 h ALA 249 CO 0.02 0.14 -0.08 1.28 0.00 0.00 0.00 179.25 180.61 1i43 n LEU 250 N -3.23 0.21 0.00 0.00 4.77 -0.75 -4.90 117.00 113.10 1i43 n LEU 250 Ca 0.01 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1i43 n LEU 250 Cb 0.40 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1i43 n LEU 250 CO 0.31 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1i43 n GLY 251 N 1.35 1.50 3.73 -0.72 0.00 -1.00 -3.40 105.19 106.64 1i43 n GLY 251 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 1i43 n GLY 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i43 s ALA 252 N -1.75 2.31 -0.07 4.61 0.00 -0.35 -4.90 121.76 121.61 1i43 s ALA 252 Ca 0.00 1.14 -0.10 0.00 0.00 0.00 0.00 51.96 53.00 1i43 s ALA 252 Cb 0.00 -3.54 -0.29 0.00 0.00 0.00 0.00 23.12 19.29 1i43 s ALA 252 CO 0.00 -1.66 0.57 -0.44 0.00 0.00 0.00 175.76 174.23 1i43 h ASP 253 N 0.36 0.55 -3.77 0.00 3.32 -1.57 -3.42 116.42 111.90 1i43 h ASP 253 Ca -0.50 -0.94 -0.25 0.00 0.02 0.00 0.00 57.03 55.36 1i43 h ASP 253 Cb 1.33 -0.18 -0.28 0.00 0.22 0.00 0.00 39.33 40.42 1i43 h ASP 253 CO 0.52 1.81 -0.73 -0.76 -1.72 0.00 0.00 179.24 178.37 1i43 s LEU 254 N -7.24 2.00 -0.16 1.55 1.43 -0.82 -4.13 118.68 111.31 1i43 s LEU 254 Ca -0.18 -0.02 0.00 0.00 -1.03 0.00 0.00 54.13 52.90 1i43 s LEU 254 Cb 0.06 -0.05 0.03 0.00 0.03 0.00 0.00 46.19 46.26 1i43 s LEU 254 CO 0.83 0.01 -0.09 0.54 0.23 0.00 0.00 176.35 177.87 1i43 s VAL 255 N -0.02 1.35 0.09 -1.59 0.11 -0.68 -0.46 120.40 119.20 1i43 s VAL 255 Ca 0.00 -0.68 0.08 0.00 -2.93 0.00 0.00 61.98 58.45 1i43 s VAL 255 Cb -0.00 -1.41 -0.04 0.00 -1.53 0.00 0.00 36.38 33.40 1i43 s VAL 255 CO -0.00 0.25 -0.15 -1.48 -3.33 0.00 0.00 175.10 170.38 1i43 s LEU 256 N 1.55 2.79 0.00 2.54 0.05 -0.06 -1.48 118.68 124.06 1i43 s LEU 256 Ca 0.02 -0.46 0.01 0.00 0.05 0.00 0.00 54.13 53.75 1i43 s LEU 256 Cb -0.15 -1.63 -0.00 0.00 -2.05 0.00 0.00 46.19 42.36 1i43 s LEU 256 CO -0.09 0.20 0.05 1.41 -0.55 0.00 0.00 176.35 177.37 1i43 n HIS 257 N 0.98 0.22 -3.51 3.48 8.25 -0.81 -2.07 115.22 121.76 1i43 n HIS 257 Ca -0.15 -1.19 -0.28 0.00 -0.26 0.00 0.00 57.72 55.84 1i43 n HIS 257 Cb 0.52 -0.05 -0.11 0.00 1.12 0.00 0.00 29.99 31.47 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 -2.20 2.39 0.50 0.41 0.15 -1.26 -2.75 113.70 110.94 1i43 s SER 258 Ca 0.06 -3.01 0.08 0.00 0.70 0.00 0.00 55.95 53.78 1i43 s SER 258 Cb 0.00 -0.67 0.43 0.00 -1.71 0.00 0.00 66.02 64.07 1i43 s SER 258 CO 0.05 -0.19 1.15 0.00 1.20 0.00 0.00 173.24 175.44 1i43 h ALA 259 N 5.91 1.58 0.00 5.45 0.00 -1.68 0.33 119.26 130.86 1i43 h ALA 259 Ca 0.19 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 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 0.42 -0.58 -0.02 1.15 0.00 0.00 0.00 179.25 180.22 1i43 h THR 260 N 0.00 0.55 0.00 0.00 2.02 -1.75 0.22 112.91 113.95 1i43 h THR 260 Ca 0.00 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.09 1i43 h THR 260 Cb 1.35 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 68.82 1i43 h THR 260 CO 0.00 0.02 0.00 0.29 0.37 0.00 0.00 175.52 176.20 1i43 n LYS 261 N -3.84 0.00 -0.01 6.66 4.76 0.12 -4.65 118.16 121.20 1i43 n LYS 261 Ca -0.03 0.00 -0.17 0.00 -2.87 0.00 0.00 58.31 55.25 1i43 n LYS 261 Cb 0.11 0.00 -0.11 0.00 -1.84 0.00 0.00 35.03 33.19 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 0.51 -0.52 2.13 0.04 -1.74 -2.03 116.94 115.32 1i43 h PHE 262 Ca 0.00 -0.27 0.10 0.00 2.80 0.00 0.00 57.97 60.60 1i43 h PHE 262 Cb 0.00 -0.06 -0.08 0.00 2.20 0.00 0.00 35.95 38.01 1i43 h PHE 262 CO 0.00 1.08 0.03 -0.07 -0.60 0.00 0.00 178.31 178.75 1i43 h LEU 263 N -0.20 -0.16 0.10 1.54 3.38 -1.82 -1.67 115.31 116.47 1i43 h LEU 263 Ca -0.06 0.12 -0.30 0.00 0.09 0.00 0.00 57.88 57.73 1i43 h LEU 263 Cb 1.21 0.20 0.03 0.00 0.09 0.00 0.00 40.66 42.18 1i43 h LEU 263 CO 0.10 -0.05 -1.22 1.23 0.09 0.00 0.00 178.44 178.58 1i43 h GLY 264 N 0.15 0.72 -0.18 0.83 0.00 -1.08 -3.29 103.07 100.22 1i43 h GLY 264 Ca 0.27 -1.47 -0.05 0.00 0.00 0.00 0.00 47.33 46.08 1i43 h GLY 264 CO -0.42 1.30 -0.05 0.61 0.00 0.00 0.00 176.54 177.98 1i43 n GLY 265 N 1.34 0.23 0.00 4.60 0.00 -0.63 -4.53 105.19 106.20 1i43 n GLY 265 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.65 0.00 -3.84 1.61 8.25 -1.26 -1.70 115.22 116.63 1i43 n HIS 266 Ca -0.02 -0.27 -0.24 0.00 -0.26 0.00 0.00 57.72 56.92 1i43 n HIS 266 Cb 0.42 -0.03 0.01 0.00 1.12 0.00 0.00 29.99 31.51 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 -0.27 -1.13 -0.47 0.41 3.02 -1.26 -4.83 115.26 110.72 1i43 n ASN 267 Ca 0.00 -0.90 0.00 0.00 -0.03 0.00 0.00 54.58 53.65 1i43 n ASN 267 Cb 0.26 -3.57 0.00 0.00 -0.61 0.00 0.00 39.78 35.86 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 -3.00 0.00 -3.60 6.41 5.75 -1.26 -5.11 116.55 115.74 1i43 n ASP 268 Ca -0.27 -1.78 -0.09 0.00 -0.01 0.00 0.00 54.79 52.65 1i43 n ASP 268 Cb 0.66 -0.16 -0.05 0.00 -1.03 0.00 0.00 41.12 40.55 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 0.04 2.12 0.11 -1.26 -5.10 120.40 116.30 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 -0.00 -0.76 -3.33 0.00 0.00 175.10 171.01 1i43 s LEU 270 N -0.85 3.48 -0.16 2.54 1.43 -1.26 -4.36 118.68 119.50 1i43 s LEU 270 Ca 0.01 -0.08 -0.30 0.00 -1.03 0.00 0.00 54.13 52.73 1i43 s LEU 270 Cb -0.01 -2.09 0.12 0.00 0.03 0.00 0.00 46.19 44.24 1i43 s LEU 270 CO -0.02 0.24 0.97 0.00 0.23 0.00 0.00 176.35 177.77 1i43 s ALA 271 N -1.18 -1.92 0.11 4.21 0.00 -1.21 -4.68 121.76 117.09 1i43 s ALA 271 Ca 0.22 1.59 0.07 0.00 0.00 0.00 0.00 51.96 53.84 1i43 s ALA 271 Cb -0.12 -0.71 -0.04 0.00 0.00 0.00 0.00 23.12 22.25 1i43 s ALA 271 CO 0.14 -0.31 -0.08 0.20 0.00 0.00 0.00 175.76 175.71 1i43 s GLY 272 N -0.99 1.82 -0.01 0.00 0.00 -0.81 -1.82 107.32 105.51 1i43 s GLY 272 Ca -0.02 -1.23 0.02 0.00 0.00 0.00 0.00 44.72 43.49 1i43 s GLY 272 CO 0.02 -1.21 -0.06 0.00 0.00 0.00 0.00 173.10 171.84 1i43 s ILE 274 N -0.06 -0.47 0.09 0.00 1.01 -0.89 -1.93 121.20 118.95 1i43 s ILE 274 Ca 0.01 -0.12 0.08 0.00 0.00 0.00 0.00 60.65 60.63 1i43 s ILE 274 Cb -0.04 -0.77 -0.04 0.00 0.01 0.00 0.00 42.46 41.63 1i43 s ILE 274 CO -0.00 -0.18 -0.18 -0.44 0.00 0.00 0.00 174.94 174.14 1i43 s SER 275 N 2.44 3.87 0.00 3.58 0.01 -0.55 -0.86 113.70 122.19 1i43 s SER 275 Ca 0.10 -0.51 0.00 0.00 1.31 0.00 0.00 55.95 56.85 1i43 s SER 275 Cb -0.15 -0.57 0.00 0.00 0.21 0.00 0.00 66.02 65.50 1i43 s SER 275 CO -0.16 0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.31 1i43 n GLY 276 N 1.04 -0.98 3.76 3.44 0.00 -0.82 -1.68 105.19 109.95 1i43 n GLY 276 Ca -0.16 -1.03 -0.35 0.00 0.00 0.00 0.00 46.02 44.49 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 -1.35 2.86 0.09 1.61 0.04 -1.26 -1.98 135.00 135.02 1i43 s PRO 277 Ca 0.00 1.64 -0.29 0.00 0.04 0.00 0.00 61.00 62.39 1i43 s PRO 277 Cb 0.00 -1.94 -0.15 0.00 0.04 0.00 0.00 34.50 32.45 1i43 s PRO 277 CO 0.00 -1.25 1.66 1.25 0.04 0.00 0.00 177.00 178.70 1i43 h LEU 278 N 0.50 -0.58 -1.52 -3.56 6.46 -1.89 0.89 115.31 115.60 1i43 h LEU 278 Ca -0.49 0.04 0.42 0.00 -0.12 0.00 0.00 57.88 57.73 1i43 h LEU 278 Cb 1.27 0.18 -0.11 0.00 -0.73 0.00 0.00 40.66 41.27 1i43 h LEU 278 CO 0.54 -0.36 0.89 0.50 -0.62 0.00 0.00 178.44 179.39 1i43 h LYS 279 N -0.57 0.11 0.00 1.25 3.64 -1.99 0.76 116.57 119.77 1i43 h LYS 279 Ca -0.04 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.30 1i43 h LYS 279 Cb 0.48 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1i43 h LYS 279 CO 0.03 0.07 -0.63 1.28 -2.27 0.00 0.00 179.45 177.93 1i43 n LEU 280 N -4.55 1.81 0.01 5.20 4.77 -0.91 -4.03 117.00 119.31 1i43 n LEU 280 Ca 0.35 0.61 0.19 0.00 -0.03 0.00 0.00 56.01 57.14 1i43 n LEU 280 Cb 1.41 -0.89 0.69 0.00 -2.33 0.00 0.00 43.42 42.30 1i43 n LEU 280 CO 0.26 -0.35 1.18 1.62 -1.33 0.00 0.00 177.39 178.76 1i43 h VAL 281 N -1.00 0.75 -0.25 4.08 3.04 -0.48 -0.79 116.25 121.60 1i43 h VAL 281 Ca -0.06 -0.00 -0.12 0.00 -1.01 0.00 0.00 66.70 65.51 1i43 h VAL 281 Cb 0.63 0.75 -0.01 0.00 -2.01 0.00 0.00 31.29 30.65 1i43 h VAL 281 CO -0.04 0.00 -0.34 0.77 -1.01 0.00 0.00 177.57 176.95 1i43 h SER 282 N 0.00 0.56 -0.43 3.17 4.64 -1.05 -0.99 113.55 119.46 1i43 h SER 282 Ca 0.24 -0.23 -0.04 0.00 -0.47 0.00 0.00 61.79 61.29 1i43 h SER 282 Cb 0.96 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.87 1i43 h SER 282 CO -0.00 0.87 0.13 -0.33 -0.87 0.00 0.00 176.83 176.62 1i43 h GLU 283 N 0.46 0.74 -0.07 4.77 4.39 -1.28 -1.89 114.58 121.70 1i43 h GLU 283 Ca 0.05 -0.14 -0.08 0.00 0.34 0.00 0.00 59.36 59.54 1i43 h GLU 283 Cb 0.82 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.35 1i43 h GLU 283 CO 0.07 0.67 -0.25 0.82 -1.16 0.00 0.00 179.01 179.16 1i43 h ILE 284 N 0.72 1.42 -0.76 3.13 2.04 -1.40 -3.12 117.51 119.55 1i43 h ILE 284 Ca 0.16 -1.63 0.20 0.00 1.00 0.00 0.00 64.86 64.59 1i43 h ILE 284 Cb 0.26 2.29 -0.04 0.00 -0.74 0.00 0.00 36.82 38.58 1i43 h ILE 284 CO -0.00 0.47 0.53 -0.09 0.00 0.00 0.00 178.15 179.05 1i43 h ARG 285 N -0.20 0.15 0.10 2.37 2.43 -0.85 0.11 114.38 118.49 1i43 h ARG 285 Ca -0.01 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1i43 h ARG 285 Cb 0.88 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.40 1i43 h ARG 285 CO 0.05 0.10 -0.05 -0.91 -1.51 0.00 0.00 179.97 177.65 1i43 h ASN 286 N 0.15 -0.11 -0.03 -3.80 4.21 -1.29 -1.55 115.58 113.16 1i43 h ASN 286 Ca 0.37 -0.30 -0.05 0.00 1.21 0.00 0.00 56.30 57.53 1i43 h ASN 286 Cb 1.23 0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 38.45 1i43 h ASN 286 CO -0.06 0.25 -0.11 0.25 -1.29 0.00 0.00 177.43 176.47 1i43 h LEU 287 N -0.49 0.29 -0.82 1.61 5.85 -1.30 -1.98 115.31 118.48 1i43 h LEU 287 Ca -0.01 -0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.67 1i43 h LEU 287 Cb 0.41 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.31 1i43 h LEU 287 CO 0.02 0.44 0.52 -0.74 -0.34 0.00 0.00 178.44 178.35 1i43 h HIS 288 N 0.29 0.98 0.00 1.25 2.76 -0.63 -0.24 115.15 119.57 1i43 h HIS 288 Ca 0.06 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.26 1i43 h HIS 288 Cb 0.39 -0.33 0.00 0.00 1.55 0.00 0.00 27.41 29.02 1i43 h HIS 288 CO 0.01 0.57 0.00 0.72 -1.30 0.00 0.00 177.93 177.93 1i43 n HIS 289 N -4.57 0.05 -0.10 5.26 8.25 -0.60 -1.30 115.22 122.20 1i43 n HIS 289 Ca 0.10 0.02 -0.16 0.00 -0.26 0.00 0.00 57.72 57.42 1i43 n HIS 289 Cb 0.08 -0.54 -0.08 0.00 1.12 0.00 0.00 29.99 30.57 1i43 n HIS 289 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1i43 n ILE 290 N -1.55 1.11 0.28 1.59 5.41 -0.24 -4.47 119.36 121.48 1i43 n ILE 290 Ca 0.01 -0.38 0.17 0.00 1.00 0.00 0.00 62.75 63.55 1i43 n ILE 290 Cb 0.07 -1.36 0.62 0.00 -0.71 0.00 0.00 39.64 38.26 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 -0.22 0.00 -2.26 1.39 3.38 -1.01 -3.48 115.31 113.11 1i43 h LEU 291 Ca -0.46 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.17 1i43 h LEU 291 Cb 1.60 0.00 0.14 0.00 0.09 0.00 0.00 40.66 42.49 1i43 h LEU 291 CO -0.14 0.00 -0.85 0.61 0.09 0.00 0.00 178.44 178.15 1i43 n GLY 292 N 0.16 -0.75 2.23 0.83 0.00 -0.42 -4.92 105.19 102.31 1i43 n GLY 292 Ca 0.01 0.35 -0.30 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.38 5.49 3.50 -0.02 0.00 -1.26 -5.02 105.19 106.50 1i43 n GLY 293 Ca -0.18 -1.95 -0.38 0.00 0.00 0.00 0.00 46.02 43.51 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 -0.98 -0.85 -2.79 4.61 0.00 -1.26 -0.36 120.51 118.87 1i43 n ALA 294 Ca 0.59 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.68 1i43 n ALA 294 Cb 0.98 -1.89 -0.08 0.00 0.00 0.00 0.00 19.45 18.46 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 0.19 4.17 0.23 0.00 2.96 -1.26 -4.18 118.68 120.80 1i43 s LEU 295 Ca 0.70 0.28 -0.30 0.00 -0.22 0.00 0.00 54.13 54.59 1i43 s LEU 295 Cb -0.45 -2.05 -0.09 0.00 0.50 0.00 0.00 46.19 44.10 1i43 s LEU 295 CO 0.53 0.27 1.29 0.21 -1.32 0.00 0.00 176.35 177.33 1i43 s ASN 296 N -0.17 6.90 0.30 3.68 3.84 -1.26 -4.89 114.94 123.34 1i43 s ASN 296 Ca 0.10 2.45 0.06 0.00 0.21 0.00 0.00 52.86 55.68 1i43 s ASN 296 Cb -0.12 -2.62 0.73 0.00 -0.55 0.00 0.00 41.25 38.69 1i43 s ASN 296 CO 0.01 -0.50 1.78 -0.65 -2.79 0.00 0.00 177.10 174.95 1i43 h PRO 297 N 4.82 0.75 -0.52 0.43 0.11 -1.96 0.14 132.00 135.78 1i43 h PRO 297 Ca -0.46 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 65.63 1i43 h PRO 297 Cb 1.22 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 1i43 h PRO 297 CO 0.74 0.50 0.32 -0.91 -0.21 0.00 0.00 178.00 178.43 1i43 h ASN 298 N 0.77 0.52 -0.49 -2.05 2.35 -1.93 -0.45 115.58 114.31 1i43 h ASN 298 Ca 0.58 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 56.26 1i43 h ASN 298 Cb 0.88 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 39.12 1i43 h ASN 298 CO -0.38 0.37 0.05 0.00 -1.65 0.00 0.00 177.43 175.82 1i43 h ALA 299 N 1.22 1.07 -0.87 -0.83 0.00 -1.41 -2.23 119.26 116.21 1i43 h ALA 299 Ca 0.21 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1i43 h ALA 299 Cb 0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 1i43 h ALA 299 CO -0.08 0.59 0.48 0.00 0.00 0.00 0.00 179.25 180.25 1i43 h ALA 300 N 1.22 1.22 -0.26 0.00 0.00 -0.25 -2.43 119.26 118.76 1i43 h ALA 300 Ca 0.17 -0.12 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 1i43 h ALA 300 Cb 0.42 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1i43 h ALA 300 CO 0.01 0.64 -0.47 -0.92 0.00 0.00 0.00 179.25 178.51 1i43 h TYR 301 N 1.21 0.83 0.00 0.00 3.20 -0.78 -1.54 116.97 119.89 1i43 h TYR 301 Ca 0.31 -0.27 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 1i43 h TYR 301 Cb 0.01 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.11 1i43 h TYR 301 CO 0.01 1.02 -0.10 -0.07 -1.64 0.00 0.00 178.16 177.37 1i43 h LEU 302 N 0.54 0.00 0.13 2.82 3.38 -0.96 -0.28 115.31 120.94 1i43 h LEU 302 Ca 0.03 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.76 1i43 h LEU 302 Cb 1.02 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.77 1i43 h LEU 302 CO 0.10 0.10 -1.16 0.40 0.09 0.00 0.00 178.44 177.97 1i43 h ILE 303 N 0.00 1.24 -0.94 1.22 2.04 -1.27 -2.16 117.51 117.64 1i43 h ILE 303 Ca -0.00 -2.47 0.12 0.00 1.00 0.00 0.00 64.86 63.51 1i43 h ILE 303 Cb 0.20 2.93 -0.08 0.00 -0.74 0.00 0.00 36.82 39.12 1i43 h ILE 303 CO 0.01 0.71 0.57 0.40 0.00 0.00 0.00 178.15 179.84 1i43 h ILE 304 N -0.33 0.88 -0.08 -0.67 2.04 -0.92 0.16 117.51 118.60 1i43 h ILE 304 Ca -0.23 -0.31 -0.03 0.00 1.00 0.00 0.00 64.86 65.29 1i43 h ILE 304 Cb 1.72 -0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 37.71 1i43 h ILE 304 CO 0.10 0.16 -0.07 -0.09 0.00 0.00 0.00 178.15 178.26 1i43 h ARG 305 N 0.89 0.19 -0.63 2.37 2.43 -1.14 -3.18 114.38 115.31 1i43 h ARG 305 Ca 0.47 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 1i43 h ARG 305 Cb 0.50 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.02 1i43 h ARG 305 CO -0.28 0.60 0.41 0.78 -1.51 0.00 0.00 179.97 179.97 1i43 h GLY 306 N -0.21 0.89 1.99 2.80 0.00 -0.64 -1.51 103.07 106.38 1i43 h GLY 306 Ca 0.02 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1i43 h GLY 306 CO 0.02 0.33 0.00 1.03 0.00 0.00 0.00 176.54 177.92 1i43 n MET 307 N -4.43 0.00 0.30 4.80 2.81 0.49 -2.59 117.12 118.50 1i43 n MET 307 Ca 0.06 0.19 0.19 0.00 -1.81 0.00 0.00 57.70 56.33 1i43 n MET 307 Cb 0.05 -1.50 0.91 0.00 -0.71 0.00 0.00 33.22 31.96 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 -1.25 -2.40 116.57 114.74 1i43 h LYS 308 Ca 0.00 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.42 1i43 h LYS 308 Cb 0.31 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 30.86 1i43 h LYS 308 CO 0.00 0.01 -0.59 0.25 -1.08 0.00 0.00 179.45 178.04 1i43 n THR 309 N -3.12 1.53 0.45 -0.16 -2.24 -1.07 -4.76 114.28 104.91 1i43 n THR 309 Ca -0.01 -2.45 -0.18 0.00 -2.27 0.00 0.00 64.05 59.14 1i43 n THR 309 Cb 0.21 0.10 -0.09 0.00 -2.10 0.00 0.00 70.33 68.45 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 0.86 -1.04 -0.81 3.22 5.85 -1.49 -1.27 115.31 120.63 1i43 h LEU 310 Ca -0.06 0.04 0.13 0.00 0.84 0.00 0.00 57.88 58.84 1i43 h LEU 310 Cb 1.24 0.28 -0.09 0.00 0.37 0.00 0.00 40.66 42.46 1i43 h LEU 310 CO 0.03 -0.71 0.40 1.12 -0.34 0.00 0.00 178.44 178.94 1i43 h HIS 311 N -1.16 0.71 -0.07 1.25 2.07 -1.89 0.26 115.15 116.33 1i43 h HIS 311 Ca -0.11 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.44 1i43 h HIS 311 Cb 0.90 -0.19 -0.00 0.00 2.57 0.00 0.00 27.41 30.68 1i43 h HIS 311 CO -0.00 0.18 0.04 -0.07 -3.07 0.00 0.00 177.93 175.01 1i43 h LEU 312 N 0.60 0.08 0.46 6.12 3.38 -1.90 0.39 115.31 124.43 1i43 h LEU 312 Ca 0.43 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.37 1i43 h LEU 312 Cb 0.59 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1i43 h LEU 312 CO -0.35 0.07 -0.22 0.03 0.09 0.00 0.00 178.44 178.06 1i43 h ARG 313 N 0.08 -0.59 -0.39 1.13 3.08 -0.29 -2.84 114.38 114.55 1i43 h ARG 313 Ca 0.02 0.04 0.08 0.00 0.07 0.00 0.00 59.98 60.20 1i43 h ARG 313 Cb 0.00 0.13 -0.09 0.00 0.08 0.00 0.00 29.97 30.10 1i43 h ARG 313 CO -0.01 -0.31 -0.28 0.28 -1.07 0.00 0.00 179.97 178.59 1i43 h VAL 314 N -0.81 0.29 -0.67 2.04 2.07 -0.48 -0.94 116.25 117.75 1i43 h VAL 314 Ca -0.06 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.57 1i43 h VAL 314 Cb 0.56 0.29 -0.12 0.00 -1.52 0.00 0.00 31.29 30.50 1i43 h VAL 314 CO 0.10 0.00 -0.35 1.56 0.02 0.00 0.00 177.57 178.90 1i43 h GLN 315 N -0.21 -0.13 -0.34 1.57 4.20 -0.89 0.14 115.11 119.45 1i43 h GLN 315 Ca 0.18 0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.88 1i43 h GLN 315 Cb 0.50 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.30 1i43 h GLN 315 CO -0.51 -0.09 0.12 0.37 -0.67 0.00 0.00 178.83 178.05 1i43 h GLN 316 N -0.14 0.51 -0.41 1.46 5.75 -1.12 -2.88 115.11 118.28 1i43 h GLN 316 Ca 0.25 -0.10 -0.05 0.00 -0.15 0.00 0.00 58.65 58.60 1i43 h GLN 316 Cb 0.56 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 29.01 1i43 h GLN 316 CO -0.74 0.52 0.06 1.96 -2.65 0.00 0.00 178.83 177.98 1i43 h GLN 317 N 0.40 0.63 -0.38 1.69 4.20 -0.38 -2.03 115.11 119.24 1i43 h GLN 317 Ca 0.11 -0.13 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 1i43 h GLN 317 Cb 0.21 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 1i43 h GLN 317 CO -0.01 0.61 0.24 -0.91 -0.67 0.00 0.00 178.83 178.10 1i43 h ASN 318 N 0.61 0.45 0.02 1.46 2.35 -0.61 -1.91 115.58 117.96 1i43 h ASN 318 Ca 0.13 -0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1i43 h ASN 318 Cb 0.30 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.56 1i43 h ASN 318 CO 0.00 0.36 -0.01 0.28 -1.65 0.00 0.00 177.43 176.41 1i43 h SER 319 N 0.51 -0.03 -0.88 5.81 0.02 -1.26 -2.07 113.55 115.65 1i43 h SER 319 Ca 0.14 0.00 0.13 0.00 -0.84 0.00 0.00 61.79 61.22 1i43 h SER 319 Cb -0.02 0.01 -0.14 0.00 0.14 0.00 0.00 62.40 62.39 1i43 h SER 319 CO -0.03 -0.02 -0.35 0.41 -1.14 0.00 0.00 176.83 175.70 1i43 n THR 320 N -2.10 -0.47 0.20 -2.27 -1.04 -0.80 -0.45 114.28 107.35 1i43 n THR 320 Ca -0.00 2.07 -0.16 0.00 -2.04 0.00 0.00 64.05 63.92 1i43 n THR 320 Cb 0.01 -2.73 -0.08 0.00 -1.82 0.00 0.00 70.33 65.71 1i43 n THR 320 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1i43 h ALA 321 N 1.17 -0.91 0.14 2.41 0.00 -1.39 0.24 119.26 120.93 1i43 h ALA 321 Ca 0.30 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1i43 h ALA 321 Cb 0.52 0.68 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 1i43 h ALA 321 CO -0.87 -1.06 -0.39 1.25 0.00 0.00 0.00 179.25 178.18 1i43 h LEU 322 N -0.81 -1.13 -0.49 0.00 5.85 -0.22 0.51 115.31 119.02 1i43 h LEU 322 Ca -0.02 0.12 0.08 0.00 0.84 0.00 0.00 57.88 58.90 1i43 h LEU 322 Cb 0.75 0.42 -0.07 0.00 0.37 0.00 0.00 40.66 42.14 1i43 h LEU 322 CO -0.14 -0.47 0.11 0.03 -0.34 0.00 0.00 178.44 177.63 1i43 h ARG 323 N -0.63 0.25 -0.12 1.25 3.08 -0.62 -0.93 114.38 116.66 1i43 h ARG 323 Ca 0.02 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 59.96 1i43 h ARG 323 Cb 0.65 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 1i43 h ARG 323 CO -0.22 0.16 -0.36 0.52 -1.07 0.00 0.00 179.97 179.01 1i43 h MET 324 N 0.25 0.24 -0.53 0.04 2.86 -0.19 -2.81 114.93 114.79 1i43 h MET 324 Ca 0.24 -0.10 0.04 0.00 -2.06 0.00 0.00 59.70 57.82 1i43 h MET 324 Cb 0.31 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.92 1i43 h MET 324 CO -0.31 0.57 0.30 0.00 1.06 0.00 0.00 176.91 178.53 1i43 h ALA 325 N 1.43 0.69 0.45 6.32 0.00 0.14 -0.27 119.26 128.00 1i43 h ALA 325 Ca 0.02 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1i43 h ALA 325 Cb 0.73 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1i43 h ALA 325 CO 0.06 -0.02 -0.21 0.93 0.00 0.00 0.00 179.25 180.00 1i43 h GLU 326 N 0.58 -0.58 -0.89 0.00 5.08 -1.27 -1.00 114.58 116.49 1i43 h GLU 326 Ca 0.23 0.04 0.21 0.00 -1.00 0.00 0.00 59.36 58.83 1i43 h GLU 326 Cb 0.08 0.13 -0.12 0.00 0.50 0.00 0.00 28.75 29.35 1i43 h GLU 326 CO -0.13 -0.28 0.41 0.82 -1.00 0.00 0.00 179.01 178.84 1i43 h ILE 327 N -0.87 0.53 -0.54 3.13 2.04 -1.36 0.15 117.51 120.60 1i43 h ILE 327 Ca -0.06 -0.16 -0.11 0.00 1.00 0.00 0.00 64.86 65.53 1i43 h ILE 327 Cb 0.57 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 1i43 h ILE 327 CO 0.10 0.08 -0.11 -0.07 0.00 0.00 0.00 178.15 178.15 1i43 h LEU 328 N 0.46 1.03 -0.94 1.44 3.38 -0.93 -1.81 115.31 117.93 1i43 h LEU 328 Ca 0.54 -0.35 -0.05 0.00 0.09 0.00 0.00 57.88 58.11 1i43 h LEU 328 Cb 0.98 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.42 1i43 h LEU 328 CO -0.49 1.14 0.24 -0.08 0.09 0.00 0.00 178.44 179.34 1i43 h GLU 329 N 0.90 1.01 0.00 1.13 4.81 0.62 -2.02 114.58 121.03 1i43 h GLU 329 Ca 0.14 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1i43 h GLU 329 Cb 0.68 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1i43 h GLU 329 CO 0.05 0.84 0.00 0.00 -0.73 0.00 0.00 179.01 179.17 1i43 h ALA 330 N 1.28 1.00 -2.73 2.92 0.00 -0.94 -3.46 119.26 117.33 1i43 h ALA 330 Ca 0.22 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.61 1i43 h ALA 330 Cb 0.24 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.08 1i43 h ALA 330 CO -0.01 0.00 0.72 -1.58 0.00 0.00 0.00 179.25 178.37 1i43 s HIS 331 N -3.16 3.10 0.37 0.00 5.65 -0.69 -4.92 115.29 115.63 1i43 s HIS 331 Ca 0.09 1.11 0.17 0.00 0.25 0.00 0.00 55.06 56.68 1i43 s HIS 331 Cb 0.11 -3.74 0.93 0.00 -1.18 0.00 0.00 32.58 28.69 1i43 s HIS 331 CO 0.57 -2.37 1.90 -1.00 -0.65 0.00 0.00 174.74 173.19 1i43 h PRO 332 N 5.03 0.00 -0.00 2.88 0.13 -1.88 -2.79 132.00 135.37 1i43 h PRO 332 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1i43 h PRO 332 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1i43 h PRO 332 CO 0.77 0.28 -0.20 1.63 -0.23 0.00 0.00 178.00 180.26 1i43 n LYS 333 N -3.96 0.13 -3.55 0.86 5.02 -1.26 -4.71 118.16 110.69 1i43 n LYS 333 Ca -0.02 -0.04 -0.40 0.00 -2.02 0.00 0.00 58.31 55.83 1i43 n LYS 333 Cb 0.35 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.76 1i43 n LYS 333 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1i43 s VAL 334 N -2.90 5.27 0.08 -0.18 1.01 -1.06 0.16 120.40 122.78 1i43 s VAL 334 Ca 0.16 -0.14 -0.14 0.00 0.00 0.00 0.00 61.98 61.86 1i43 s VAL 334 Cb 0.19 -3.66 -0.18 0.00 0.00 0.00 0.00 36.38 32.73 1i43 s VAL 334 CO 0.58 0.05 1.26 -0.09 0.00 0.00 0.00 175.10 176.90 1i43 h ARG 335 N 8.46 0.72 -2.94 2.72 2.43 -1.20 -3.45 114.38 121.13 1i43 h ARG 335 Ca -0.32 -0.63 -0.08 0.00 -0.81 0.00 0.00 59.98 58.14 1i43 h ARG 335 Cb 1.16 0.14 -0.17 0.00 -0.42 0.00 0.00 29.97 30.68 1i43 h ARG 335 CO 0.62 1.23 -0.11 -1.58 -1.51 0.00 0.00 179.97 178.62 1i43 s HIS 336 N -3.65 -0.29 -0.02 2.20 5.04 -1.15 -4.99 115.29 112.45 1i43 s HIS 336 Ca -0.11 0.31 0.02 0.00 -1.54 0.00 0.00 55.06 53.74 1i43 s HIS 336 Cb 0.08 0.21 0.00 0.00 0.04 0.00 0.00 32.58 32.91 1i43 s HIS 336 CO 0.89 -0.54 -0.06 0.08 -2.34 0.00 0.00 174.74 172.77 1i43 s VAL 337 N -2.16 0.54 -0.18 0.89 1.01 -1.26 -0.25 120.40 119.00 1i43 s VAL 337 Ca -0.07 -0.25 -0.02 0.00 0.00 0.00 0.00 61.98 61.64 1i43 s VAL 337 Cb -0.02 -0.49 -0.01 0.00 0.00 0.00 0.00 36.38 35.87 1i43 s VAL 337 CO -0.00 0.17 -0.08 -0.31 0.00 0.00 0.00 175.10 174.88 1i43 s TYR 338 N 0.13 2.90 -0.30 5.22 1.51 0.41 -4.88 117.35 122.34 1i43 s TYR 338 Ca -0.01 -0.79 -0.18 0.00 -1.01 0.00 0.00 57.07 55.08 1i43 s TYR 338 Cb -0.06 -1.98 0.18 0.00 -0.11 0.00 0.00 41.96 39.99 1i43 s TYR 338 CO -0.00 -0.38 1.18 -0.47 -1.11 0.00 0.00 175.55 174.78 1i43 s TYR 339 N 0.92 -0.28 0.65 2.71 5.04 -1.26 -2.48 117.35 122.65 1i43 s TYR 339 Ca -0.02 0.44 0.27 0.00 -2.44 0.00 0.00 57.07 55.32 1i43 s TYR 339 Cb -0.15 0.15 1.42 0.00 0.35 0.00 0.00 41.96 43.74 1i43 s TYR 339 CO 0.00 -0.14 1.81 -1.35 -1.34 0.00 0.00 175.55 174.53 1i43 h PRO 340 N 7.35 0.00 0.00 4.97 0.11 -1.84 -0.53 132.00 142.06 1i43 h PRO 340 Ca -0.14 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.86 1i43 h PRO 340 Cb 1.13 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 1i43 h PRO 340 CO 0.02 0.00 -0.56 0.78 -0.21 0.00 0.00 178.00 178.03 1i43 h GLY 341 N 0.00 0.00 -1.51 -0.55 0.00 -1.94 -3.42 103.07 95.65 1i43 h GLY 341 Ca 0.05 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.88 1i43 h GLY 341 CO -0.00 0.00 0.37 1.08 0.00 0.00 0.00 176.54 177.99 1i43 s LEU 342 N -7.02 3.30 0.32 3.11 1.43 -0.21 -4.95 118.68 114.67 1i43 s LEU 342 Ca 0.01 1.69 0.25 0.00 -1.03 0.00 0.00 54.13 55.05 1i43 s LEU 342 Cb 0.11 -4.51 0.61 0.00 0.03 0.00 0.00 46.19 42.42 1i43 s LEU 342 CO 0.74 -1.29 1.70 1.56 0.23 0.00 0.00 176.35 179.29 1i43 h GLN 343 N -0.18 0.00 -0.00 1.70 4.20 -1.88 -3.17 115.11 115.78 1i43 h GLN 343 Ca -0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.26 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 0.57 0.00 -0.02 -1.13 -0.67 0.00 0.00 178.83 177.59 1i43 n SER 344 N -2.67 0.04 -4.71 1.46 3.41 -1.26 -4.85 113.62 105.04 1i43 n SER 344 Ca 0.05 -0.12 -0.42 0.00 -0.26 0.00 0.00 58.87 58.12 1i43 n SER 344 Cb 0.47 -0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 64.11 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 -2.61 3.57 0.30 7.33 5.04 -1.20 -4.95 115.29 122.78 1i43 s HIS 345 Ca 0.27 1.53 0.04 0.00 -1.54 0.00 0.00 55.06 55.36 1i43 s HIS 345 Cb 0.20 -3.25 0.79 0.00 0.04 0.00 0.00 32.58 30.36 1i43 s HIS 345 CO 0.47 -0.57 1.61 -1.35 -2.34 0.00 0.00 174.74 172.56 1i43 h PRO 346 N 6.56 0.10 -0.66 2.88 0.11 -1.92 -1.09 132.00 137.99 1i43 h PRO 346 Ca -0.42 -0.01 -0.44 0.00 0.11 0.00 0.00 66.00 65.25 1i43 h PRO 346 Cb 1.22 -0.02 -0.27 0.00 0.11 0.00 0.00 31.00 32.03 1i43 h PRO 346 CO 0.77 0.07 -0.13 -0.85 -0.21 0.00 0.00 178.00 177.64 1i43 n GLU 347 N -5.33 2.71 0.13 1.05 0.00 -1.26 -4.71 120.64 113.22 1i43 n GLU 347 Ca 0.24 -3.59 0.05 0.00 0.00 0.00 0.00 57.16 53.86 1i43 n GLU 347 Cb 0.77 -2.11 0.51 0.00 0.00 0.00 0.00 31.44 30.62 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 1.68 0.26 -0.08 -1.84 2.76 -1.44 0.19 115.15 116.67 1i43 h HIS 348 Ca 0.37 0.00 -0.14 0.00 -2.20 0.00 0.00 60.37 58.41 1i43 h HIS 348 Cb 1.44 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 30.30 1i43 h HIS 348 CO 1.07 0.19 -0.57 1.12 -1.30 0.00 0.00 177.93 178.44 1i43 h HIS 349 N 0.28 0.31 0.00 5.26 2.07 -1.84 -0.92 115.15 120.31 1i43 h HIS 349 Ca 0.07 -0.11 -0.00 0.00 -2.85 0.00 0.00 60.37 57.48 1i43 h HIS 349 Cb 0.01 -0.06 0.00 0.00 2.57 0.00 0.00 27.41 29.94 1i43 h HIS 349 CO 0.00 0.76 -0.00 0.82 -3.07 0.00 0.00 177.93 176.44 1i43 h ILE 350 N 0.19 1.59 -0.50 6.12 2.04 -1.58 -2.74 117.51 122.64 1i43 h ILE 350 Ca -0.00 -1.76 0.09 0.00 1.00 0.00 0.00 64.86 64.19 1i43 h ILE 350 Cb 1.06 2.79 -0.08 0.00 -0.74 0.00 0.00 36.82 39.85 1i43 h ILE 350 CO 0.09 0.46 0.02 0.00 0.00 0.00 0.00 178.15 178.72 1i43 h ALA 351 N 0.24 0.49 -0.04 1.87 0.00 -0.67 -0.40 119.26 120.76 1i43 h ALA 351 Ca -0.00 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1i43 h ALA 351 Cb 0.75 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 1i43 h ALA 351 CO 0.00 -0.37 0.02 -0.22 0.00 0.00 0.00 179.25 178.67 1i43 h LYS 352 N 0.14 0.05 0.00 0.00 3.64 -1.21 0.34 116.57 119.53 1i43 h LYS 352 Ca 0.25 -0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.46 1i43 h LYS 352 Cb 0.37 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.15 1i43 h LYS 352 CO -0.39 0.05 -1.19 -0.22 -2.27 0.00 0.00 179.45 175.42 1i43 h LYS 353 N 0.05 0.00 -0.06 1.90 3.64 -0.79 -3.38 116.57 117.94 1i43 h LYS 353 Ca 0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1i43 h LYS 353 Cb 0.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1i43 h LYS 353 CO -0.00 0.43 0.00 0.00 -2.27 0.00 0.00 179.45 177.61 1i43 n GLN 354 N -3.03 0.86 -4.25 1.90 10.64 -0.62 -5.03 117.38 117.84 1i43 n GLN 354 Ca -0.07 -1.13 -0.19 0.00 -1.83 0.00 0.00 57.00 53.79 1i43 n GLN 354 Cb 0.85 -1.10 -0.11 0.00 -0.86 0.00 0.00 30.24 29.02 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 -0.61 1.05 0.00 2.61 -1.94 0.09 -4.58 119.30 115.92 1i43 s MET 355 Ca 0.07 -1.25 0.09 0.00 -1.71 0.00 0.00 55.69 52.90 1i43 s MET 355 Cb 0.04 -0.97 -0.10 0.00 2.01 0.00 0.00 34.83 35.81 1i43 s MET 355 CO 0.06 0.19 0.41 0.25 -0.01 0.00 0.00 175.02 175.93 1i43 n THR 356 N 0.55 0.00 -4.15 2.05 -2.24 -0.22 -4.73 114.28 105.55 1i43 n THR 356 Ca -0.16 -0.29 -0.16 0.00 -2.27 0.00 0.00 64.05 61.18 1i43 n THR 356 Cb 0.57 1.01 -0.06 0.00 -2.10 0.00 0.00 70.33 69.75 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 -1.85 1.68 -0.06 3.38 0.00 -1.26 -5.03 107.32 104.17 1i43 s GLY 357 Ca 0.04 -1.66 0.15 0.00 0.00 0.00 0.00 44.72 43.24 1i43 s GLY 357 CO 0.38 -1.15 1.13 0.69 0.00 0.00 0.00 173.10 174.15 1i43 n PHE 358 N -0.55 0.00 -0.34 1.90 3.72 -1.26 -4.97 117.46 115.96 1i43 n PHE 358 Ca 0.03 -0.65 0.04 0.00 -0.05 0.00 0.00 57.45 56.83 1i43 n PHE 358 Cb 0.62 -0.14 -0.02 0.00 -0.94 0.00 0.00 39.48 39.00 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 -0.29 -2.15 0.92 1.37 0.00 -1.26 -4.66 105.19 99.13 1i43 n GLY 359 Ca 0.09 -1.40 0.09 0.00 0.00 0.00 0.00 46.02 44.80 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 -2.91 1.73 3.82 -0.02 0.00 -1.26 -4.34 105.19 102.21 1i43 n GLY 360 Ca -0.01 -0.58 -0.37 0.00 0.00 0.00 0.00 46.02 45.06 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 -1.21 3.75 -0.05 4.61 0.00 -1.26 -1.97 121.76 125.63 1i43 s ALA 361 Ca 0.31 -0.47 -0.02 0.00 0.00 0.00 0.00 51.96 51.78 1i43 s ALA 361 Cb 0.18 -2.20 0.03 0.00 0.00 0.00 0.00 23.12 21.13 1i43 s ALA 361 CO 0.25 0.43 0.08 0.08 0.00 0.00 0.00 175.76 176.60 1i43 s VAL 362 N -0.61 -0.14 -0.05 0.00 1.01 -0.20 -4.92 120.40 115.49 1i43 s VAL 362 Ca 0.17 0.39 -0.01 0.00 0.00 0.00 0.00 61.98 62.54 1i43 s VAL 362 Cb -0.14 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 36.03 1i43 s VAL 362 CO 0.06 0.16 0.02 -0.44 0.00 0.00 0.00 175.10 174.91 1i43 s SER 363 N 2.09 5.30 0.03 3.32 0.01 -1.04 -0.37 113.70 123.05 1i43 s SER 363 Ca 0.03 0.11 -0.22 0.00 1.31 0.00 0.00 55.95 57.18 1i43 s SER 363 Cb -0.12 -1.47 0.05 0.00 0.21 0.00 0.00 66.02 64.68 1i43 s SER 363 CO -0.04 0.33 0.50 0.72 0.41 0.00 0.00 173.24 175.16 1i43 s PHE 364 N -1.00 -0.40 -0.18 2.43 -0.71 -0.23 0.16 117.98 118.05 1i43 s PHE 364 Ca 0.17 0.48 -0.06 0.00 -1.04 0.00 0.00 56.93 56.48 1i43 s PHE 364 Cb -0.11 0.30 -0.03 0.00 -1.21 0.00 0.00 43.02 41.96 1i43 s PHE 364 CO 0.06 -0.60 0.02 -1.21 -1.34 0.00 0.00 175.22 172.15 1i43 s GLU 365 N -2.19 3.79 0.48 1.99 2.02 0.66 -0.43 118.70 125.02 1i43 s GLU 365 Ca -0.07 -0.44 -0.13 0.00 0.02 0.00 0.00 54.97 54.35 1i43 s GLU 365 Cb -0.01 -3.09 -0.07 0.00 0.10 0.00 0.00 34.13 31.06 1i43 s GLU 365 CO 0.00 0.19 0.90 0.08 0.02 0.00 0.00 175.26 176.45 1i43 s VAL 366 N 0.55 4.66 -1.35 2.63 1.01 -1.14 -0.76 120.40 126.00 1i43 s VAL 366 Ca 0.00 0.91 -0.15 0.00 0.00 0.00 0.00 61.98 62.74 1i43 s VAL 366 Cb -0.14 -3.75 0.08 0.00 0.00 0.00 0.00 36.38 32.58 1i43 s VAL 366 CO 0.02 -0.68 1.90 -0.67 0.00 0.00 0.00 175.10 175.67 1i43 n ASP 367 N -1.63 4.59 0.00 3.32 2.03 0.12 -4.58 116.55 120.40 1i43 n ASP 367 Ca 0.05 -2.92 0.00 0.00 0.52 0.00 0.00 54.79 52.44 1i43 n ASP 367 Cb 0.54 -1.67 0.00 0.00 -0.72 0.00 0.00 41.12 39.27 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 4.51 2.00 3.51 0.27 0.00 -1.26 -5.01 105.19 109.21 1i43 n GLY 368 Ca 0.48 -0.39 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1i43 n GLY 368 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1i43 n ASP 369 N 0.00 2.17 -0.31 1.61 5.75 -1.26 -4.81 116.55 119.70 1i43 n ASP 369 Ca 0.00 -3.22 0.13 0.00 -0.01 0.00 0.00 54.79 51.69 1i43 n ASP 369 Cb 0.00 0.75 0.27 0.00 -1.03 0.00 0.00 41.12 41.11 1i43 n ASP 369 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1i43 h LEU 370 N 0.00 -0.27 -0.09 -2.12 7.12 -1.98 0.12 115.31 118.08 1i43 h LEU 370 Ca -0.37 0.24 -0.05 0.00 0.13 0.00 0.00 57.88 57.83 1i43 h LEU 370 Cb 1.26 0.38 -0.00 0.00 -0.53 0.00 0.00 40.66 41.76 1i43 h LEU 370 CO 0.59 -0.26 -0.12 -0.07 -0.13 0.00 0.00 178.44 178.45 1i43 h LEU 371 N 0.09 0.27 0.12 2.25 -0.00 -1.96 -2.89 115.31 113.20 1i43 h LEU 371 Ca 0.55 -0.52 -0.01 0.00 -0.00 0.00 0.00 57.88 57.91 1i43 h LEU 371 Cb 1.12 -0.08 0.00 0.00 -0.00 0.00 0.00 40.66 41.70 1i43 h LEU 371 CO -0.78 0.73 -0.06 0.74 -0.00 0.00 0.00 178.44 179.08 1i43 h THR 372 N -0.18 0.95 -0.71 0.22 2.02 -1.62 -1.85 112.91 111.75 1i43 h THR 372 Ca 0.01 -0.28 0.15 0.00 0.77 0.00 0.00 66.41 67.06 1i43 h THR 372 Cb 0.67 1.13 -0.10 0.00 -1.74 0.00 0.00 68.15 68.11 1i43 h THR 372 CO 0.03 0.07 0.17 0.74 0.37 0.00 0.00 175.52 176.90 1i43 h THR 373 N -0.29 0.55 -0.77 3.16 2.02 -0.91 0.22 112.91 116.90 1i43 h THR 373 Ca -0.02 -0.10 0.05 0.00 0.77 0.00 0.00 66.41 67.11 1i43 h THR 373 Cb 0.23 0.25 -0.05 0.00 -1.74 0.00 0.00 68.15 66.84 1i43 h THR 373 CO 0.03 0.05 0.47 0.00 0.37 0.00 0.00 175.52 176.44 1i43 h ALA 374 N 1.58 1.03 -0.88 6.16 0.00 -1.27 -1.00 119.26 124.88 1i43 h ALA 374 Ca 0.39 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.40 1i43 h ALA 374 Cb 0.65 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 18.15 1i43 h ALA 374 CO -0.48 0.23 0.57 -0.22 0.00 0.00 0.00 179.25 179.35 1i43 h LYS 375 N 0.90 0.77 -0.04 0.00 3.64 0.27 0.83 116.57 122.94 1i43 h LYS 375 Ca 0.32 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.65 1i43 h LYS 375 Cb 0.09 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1i43 h LYS 375 CO -0.14 0.51 -0.00 0.35 -2.27 0.00 0.00 179.45 177.90 1i43 h PHE 376 N 0.80 0.07 -0.19 1.91 3.57 -0.62 -2.12 116.94 120.36 1i43 h PHE 376 Ca 0.42 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.83 1i43 h PHE 376 Cb 0.52 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.23 1i43 h PHE 376 CO -0.00 0.36 -0.22 -0.39 -2.23 0.00 0.00 178.31 175.83 1i43 h VAL 377 N -0.24 1.24 0.00 1.41 -1.51 -1.09 -1.49 116.25 114.56 1i43 h VAL 377 Ca 0.01 -1.12 0.00 0.00 -1.23 0.00 0.00 66.70 64.36 1i43 h VAL 377 Cb 0.34 1.35 0.00 0.00 -2.13 0.00 0.00 31.29 30.84 1i43 h VAL 377 CO 0.00 0.35 0.00 0.44 -1.23 0.00 0.00 177.57 177.13 1i43 h ASP 378 N 0.31 0.00 0.76 4.19 5.19 -0.72 -2.69 116.42 123.46 1i43 h ASP 378 Ca 0.05 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.27 1i43 h ASP 378 Cb 0.57 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.05 1i43 h ASP 378 CO 0.04 0.00 -1.35 0.00 -3.12 0.00 0.00 179.24 174.81 1i43 h ALA 379 N 2.15 0.66 -2.78 3.45 0.00 -0.58 -3.47 119.26 118.70 1i43 h ALA 379 Ca 0.00 -0.92 -0.55 0.00 0.00 0.00 0.00 54.91 53.43 1i43 h ALA 379 Cb 0.38 0.26 0.17 0.00 0.00 0.00 0.00 17.79 18.60 1i43 h ALA 379 CO 0.00 1.03 0.22 1.28 0.00 0.00 0.00 179.25 181.77 1i43 n LEU 380 N -2.98 4.16 0.00 0.00 4.77 -1.02 -4.76 117.00 117.17 1i43 n LEU 380 Ca -0.09 0.70 0.00 0.00 -0.03 0.00 0.00 56.01 56.59 1i43 n LEU 380 Cb 0.87 -1.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.51 1i43 n LEU 380 CO 0.43 -1.77 -0.38 0.29 -1.33 0.00 0.00 177.39 174.64 1i43 n LYS 381 N -1.97 1.47 -0.10 3.23 5.02 -1.26 -4.89 118.16 119.66 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 0.49 -0.87 -0.08 0.00 -0.02 0.00 0.00 35.03 34.55 1i43 n LYS 381 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1i43 n ILE 382 N -1.16 1.50 -1.93 -0.18 5.41 -1.26 -4.96 119.36 116.78 1i43 n ILE 382 Ca 0.00 -0.01 -0.33 0.00 1.00 0.00 0.00 62.75 63.41 1i43 n ILE 382 Cb 0.00 -2.13 0.03 0.00 -0.71 0.00 0.00 39.64 36.83 1i43 n ILE 382 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1i43 s PRO 383 N -2.39 3.09 0.12 0.38 0.04 -1.26 -4.67 135.00 130.31 1i43 s PRO 383 Ca -0.27 1.30 -0.08 0.00 0.04 0.00 0.00 61.00 61.99 1i43 s PRO 383 Cb 0.06 -2.00 -0.06 0.00 0.04 0.00 0.00 34.50 32.55 1i43 s PRO 383 CO 0.47 -1.01 0.41 0.71 0.04 0.00 0.00 177.00 177.63 1i43 s TYR 384 N -2.38 3.52 -0.80 0.56 2.02 0.48 -4.81 117.35 115.94 1i43 s TYR 384 Ca 0.65 0.71 -0.19 0.00 -0.37 0.00 0.00 57.07 57.87 1i43 s TYR 384 Cb -0.18 -2.11 0.12 0.00 -0.40 0.00 0.00 41.96 39.38 1i43 s TYR 384 CO 0.39 0.45 0.98 0.42 -1.57 0.00 0.00 175.55 176.22 1i43 s ILE 385 N -1.56 4.73 0.34 2.71 1.01 -1.26 -0.66 121.20 126.51 1i43 s ILE 385 Ca 0.38 -1.27 -0.17 0.00 0.00 0.00 0.00 60.65 59.59 1i43 s ILE 385 Cb -0.13 -4.68 0.04 0.00 0.01 0.00 0.00 42.46 37.70 1i43 s ILE 385 CO 0.21 -1.39 0.74 0.00 0.00 0.00 0.00 174.94 174.50 1i43 s ALA 386 N 2.79 -0.85 0.99 9.38 0.00 -0.97 -4.97 121.76 128.13 1i43 s ALA 386 Ca 0.25 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 51.59 1i43 s ALA 386 Cb -0.12 0.77 0.00 0.00 0.00 0.00 0.00 23.12 23.78 1i43 s ALA 386 CO -0.02 -0.99 0.00 -0.35 0.00 0.00 0.00 175.76 174.39 1i43 n PRO 387 N -0.50 0.23 -1.16 0.00 -0.05 -1.26 -4.44 135.00 127.82 1i43 n PRO 387 Ca -0.06 0.00 0.15 0.00 -0.05 0.00 0.00 63.50 63.54 1i43 n PRO 387 Cb 0.60 0.00 -0.05 0.00 -0.05 0.00 0.00 33.50 34.00 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 -2.36 -6.90 -3.65 3.54 2.88 -1.26 -4.99 113.62 100.88 1i43 n SER 388 Ca 0.00 0.61 0.00 0.00 -1.33 0.00 0.00 58.87 58.15 1i43 n SER 388 Cb 0.00 -3.60 -0.00 0.00 -0.75 0.00 0.00 64.21 59.86 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 -2.41 -0.05 0.00 0.66 -0.12 -1.26 -4.94 117.98 109.86 1i43 s PHE 389 Ca 0.00 -0.13 0.00 0.00 -0.05 0.00 0.00 56.93 56.75 1i43 s PHE 389 Cb 0.00 0.58 0.00 0.00 -0.63 0.00 0.00 43.02 42.97 1i43 s PHE 389 CO 0.00 -0.47 0.00 0.41 -0.05 0.00 0.00 175.22 175.11 1i43 n GLY 390 N -0.54 0.11 3.92 1.99 0.00 -1.26 -4.21 105.19 105.21 1i43 n GLY 390 Ca -0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.00 1.61 0.37 -0.02 0.00 -1.26 -4.27 107.32 101.75 1i43 s GLY 391 Ca 0.00 -0.74 0.10 0.00 0.00 0.00 0.00 44.72 44.08 1i43 s GLY 391 CO 0.00 -0.46 1.89 0.00 0.00 0.00 0.00 173.10 174.53 1i43 s GLU 393 N -5.63 4.78 0.37 0.00 8.01 -1.26 0.24 118.70 125.21 1i43 s GLU 393 Ca -0.10 1.60 -0.23 0.00 0.01 0.00 0.00 54.97 56.25 1i43 s GLU 393 Cb 0.21 -3.25 -0.10 0.00 -4.31 0.00 0.00 34.13 26.68 1i43 s GLU 393 CO 0.78 0.41 0.93 -1.12 0.01 0.00 0.00 175.26 176.28 1i43 s SER 394 N -1.07 7.14 0.03 -0.19 0.01 -1.26 -4.30 113.70 114.06 1i43 s SER 394 Ca 0.42 1.74 0.01 0.00 1.31 0.00 0.00 55.95 59.44 1i43 s SER 394 Cb -0.28 -2.55 -0.02 0.00 0.21 0.00 0.00 66.02 63.38 1i43 s SER 394 CO 0.35 -0.19 -0.05 -0.63 0.41 0.00 0.00 173.24 173.12 1i43 s ILE 395 N -1.87 0.34 0.06 1.44 1.01 -0.26 -0.39 121.20 121.53 1i43 s ILE 395 Ca 0.55 -0.82 0.01 0.00 0.00 0.00 0.00 60.65 60.40 1i43 s ILE 395 Cb -0.14 -0.41 -0.03 0.00 0.01 0.00 0.00 42.46 41.89 1i43 s ILE 395 CO 0.19 -0.32 -0.06 -0.69 0.00 0.00 0.00 174.94 174.05 1i43 s VAL 396 N -1.12 0.52 -0.10 2.92 1.01 0.16 -0.30 120.40 123.49 1i43 s VAL 396 Ca -0.09 -1.50 -0.32 0.00 0.00 0.00 0.00 61.98 60.07 1i43 s VAL 396 Cb -0.08 -1.12 0.12 0.00 0.00 0.00 0.00 36.38 35.30 1i43 s VAL 396 CO -0.00 -0.67 1.04 1.51 0.00 0.00 0.00 175.10 176.98 1i43 s ASP 397 N -2.32 -0.26 -0.63 3.32 -4.77 -1.18 -2.28 116.67 108.54 1i43 s ASP 397 Ca 0.00 0.03 -0.06 0.00 -3.30 0.00 0.00 52.55 49.22 1i43 s ASP 397 Cb -0.02 0.27 0.16 0.00 -1.09 0.00 0.00 42.92 42.25 1i43 s ASP 397 CO -0.03 -0.43 0.48 -1.10 0.70 0.00 0.00 175.17 174.80 1i43 s GLN 398 N -2.62 2.75 0.43 2.11 -0.21 -1.26 -2.05 119.66 118.81 1i43 s GLN 398 Ca 0.06 -2.35 0.36 0.00 0.02 0.00 0.00 55.36 53.46 1i43 s GLN 398 Cb -0.01 -3.91 1.39 0.00 1.00 0.00 0.00 33.01 31.48 1i43 s GLN 398 CO -0.06 -1.20 1.34 -2.30 -2.12 0.00 0.00 175.29 170.95 1i43 n PRO 399 N 3.90 -0.02 -0.06 2.91 -0.02 -1.26 0.16 135.00 140.61 1i43 n PRO 399 Ca 0.06 1.00 -0.09 0.00 -2.02 0.00 0.00 63.50 62.45 1i43 n PRO 399 Cb 0.41 -2.14 -0.02 0.00 -0.02 0.00 0.00 33.50 31.73 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 1.10 0.29 0.03 3.55 0.00 -1.84 -0.46 119.26 121.95 1i43 h ALA 400 Ca 0.79 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 55.55 1i43 h ALA 400 Cb 2.87 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 20.61 1i43 h ALA 400 CO -0.20 -0.29 -0.84 0.82 0.00 0.00 0.00 179.25 178.75 1i43 h ILE 401 N 0.25 1.28 -0.99 0.00 2.04 0.12 -1.64 117.51 118.56 1i43 h ILE 401 Ca 0.10 -2.31 0.03 0.00 1.00 0.00 0.00 64.86 63.69 1i43 h ILE 401 Cb 0.03 2.79 -0.06 0.00 -0.74 0.00 0.00 36.82 38.85 1i43 h ILE 401 CO -0.08 0.52 0.65 0.24 0.00 0.00 0.00 178.15 179.49 1i43 h MET 402 N -0.81 1.23 0.00 2.37 2.86 -0.78 -3.29 114.93 116.51 1i43 h MET 402 Ca -0.21 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 1i43 h MET 402 Cb 1.32 -0.28 0.00 0.00 0.06 0.00 0.00 31.60 32.70 1i43 h MET 402 CO -0.06 0.81 0.00 0.43 1.06 0.00 0.00 176.91 179.16 1i43 n SER 403 N -4.43 0.58 -0.22 1.22 7.64 -0.23 -4.84 113.62 113.34 1i43 n SER 403 Ca 0.13 -1.28 0.00 0.00 1.01 0.00 0.00 58.87 58.73 1i43 n SER 403 Cb 0.09 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 1i43 n SER 403 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1i43 n TYR 404 N -0.14 0.00 0.28 1.43 4.02 -0.89 -4.86 117.16 116.99 1i43 n TYR 404 Ca 0.00 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 58.02 1i43 n TYR 404 Cb 0.41 -0.01 0.81 0.00 -0.02 0.00 0.00 39.34 40.53 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 -1.36 -1.95 115.95 111.92 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 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.32 1i43 h TRP 405 CO 0.03 0.05 0.00 0.38 -0.00 0.00 0.00 178.44 178.90 1i43 h ASP 406 N 0.00 0.00 -2.45 2.65 2.03 -1.89 -3.44 116.42 113.32 1i43 h ASP 406 Ca -0.00 0.00 -0.46 0.00 -0.73 0.00 0.00 57.03 55.84 1i43 h ASP 406 Cb 0.13 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 38.63 1i43 h ASP 406 CO 0.01 0.00 -0.26 -0.76 -1.03 0.00 0.00 179.24 177.20 1i43 s LEU 407 N -5.47 4.01 0.41 0.15 1.43 -0.73 -5.09 118.68 113.38 1i43 s LEU 407 Ca 0.02 0.20 -0.21 0.00 -1.03 0.00 0.00 54.13 53.11 1i43 s LEU 407 Cb 0.09 -3.07 -0.11 0.00 0.03 0.00 0.00 46.19 43.14 1i43 s LEU 407 CO 0.47 -0.35 0.93 -0.94 0.23 0.00 0.00 176.35 176.69 1i43 s SER 408 N -4.08 6.98 0.39 2.29 1.04 -1.26 -4.80 113.70 114.25 1i43 s SER 408 Ca 0.41 1.68 0.21 0.00 0.48 0.00 0.00 55.95 58.73 1i43 s SER 408 Cb -0.09 -2.53 1.24 0.00 0.10 0.00 0.00 66.02 64.73 1i43 s SER 408 CO 0.34 -0.31 1.66 -0.61 0.98 0.00 0.00 173.24 175.29 1i43 h GLN 409 N 2.09 0.21 -0.17 4.02 4.15 -1.95 0.51 115.11 123.96 1i43 h GLN 409 Ca -0.49 -0.01 -0.10 0.00 0.77 0.00 0.00 58.65 58.82 1i43 h GLN 409 Cb 1.18 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.82 1i43 h GLN 409 CO 0.62 0.14 -0.30 0.66 -1.93 0.00 0.00 178.83 178.02 1i43 h SER 410 N 0.22 0.56 0.19 -0.69 4.64 -1.99 -1.90 113.55 114.58 1i43 h SER 410 Ca 0.75 -0.54 -0.09 0.00 -0.47 0.00 0.00 61.79 61.45 1i43 h SER 410 Cb 2.02 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 63.94 1i43 h SER 410 CO -0.50 0.99 -0.32 0.44 -0.87 0.00 0.00 176.83 176.57 1i43 h ASP 411 N 0.15 0.21 0.28 4.97 3.32 -0.58 -1.56 116.42 123.21 1i43 h ASP 411 Ca 0.01 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 1i43 h ASP 411 Cb 0.88 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.38 1i43 h ASP 411 CO 0.07 0.53 -0.14 0.03 -1.72 0.00 0.00 179.24 178.01 1i43 h ARG 412 N 0.18 -0.37 -0.17 3.56 3.08 -0.28 -3.01 114.38 117.38 1i43 h ARG 412 Ca 0.02 0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.15 1i43 h ARG 412 Cb 0.66 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.78 1i43 h ARG 412 CO 0.05 -0.03 0.14 0.00 -1.07 0.00 0.00 179.97 179.06 1i43 h ALA 413 N -0.26 2.05 0.00 0.04 0.00 -1.28 -0.31 119.26 119.50 1i43 h ALA 413 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1i43 h ALA 413 Cb 0.51 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1i43 h ALA 413 CO 0.06 -0.23 0.22 -0.22 0.00 0.00 0.00 179.25 179.09 1i43 h LYS 414 N 0.00 0.00 -0.50 0.00 3.64 -1.13 -1.59 116.57 116.98 1i43 h LYS 414 Ca 0.08 0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 59.15 1i43 h LYS 414 Cb 0.36 0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 31.77 1i43 h LYS 414 CO -0.00 0.00 -1.05 0.66 -2.27 0.00 0.00 179.45 176.79 1i43 n TYR 415 N -2.14 1.60 0.00 1.91 4.01 -0.13 -5.01 117.16 117.40 1i43 n TYR 415 Ca -0.01 -2.15 0.00 0.00 -0.16 0.00 0.00 57.90 55.58 1i43 n TYR 415 Cb 0.24 -0.26 0.00 0.00 -0.31 0.00 0.00 39.34 39.02 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 -0.62 2.25 3.63 2.72 0.00 -0.60 -4.97 105.19 107.59 1i43 n GLY 416 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.45 3.43 0.17 -0.61 -1.09 -1.21 -4.93 121.20 116.52 1i43 s ILE 417 Ca 0.00 0.48 0.06 0.00 -2.23 0.00 0.00 60.65 58.96 1i43 s ILE 417 Cb 0.00 -3.45 -0.04 0.00 -1.58 0.00 0.00 42.46 37.39 1i43 s ILE 417 CO 0.00 -0.20 0.07 -0.04 -1.23 0.00 0.00 174.94 173.54 1i43 s MET 418 N 5.06 2.65 0.00 2.79 -1.94 -1.26 -3.44 119.30 123.16 1i43 s MET 418 Ca 0.81 -1.00 0.12 0.00 -1.71 0.00 0.00 55.69 53.92 1i43 s MET 418 Cb -0.29 -2.50 0.68 0.00 2.01 0.00 0.00 34.83 34.74 1i43 s MET 418 CO 0.33 0.47 1.25 -0.25 -0.01 0.00 0.00 175.02 176.80 1i43 n ASP 419 N -0.25 0.00 -0.02 3.03 9.92 -1.26 -2.10 116.55 125.87 1i43 n ASP 419 Ca -0.09 -0.13 -0.16 0.00 -0.53 0.00 0.00 54.79 53.88 1i43 n ASP 419 Cb 0.55 -0.15 -0.14 0.00 -0.64 0.00 0.00 41.12 40.74 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 -1.15 1.60 -4.65 -2.24 5.03 -1.26 -3.87 115.26 108.72 1i43 n ASN 420 Ca 0.08 0.23 -0.47 0.00 0.87 0.00 0.00 54.58 55.28 1i43 n ASN 420 Cb 0.07 -0.47 -0.04 0.00 -1.02 0.00 0.00 39.78 38.32 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 -3.28 2.67 -3.81 3.41 7.94 -0.89 -2.86 117.00 120.17 1i43 n LEU 421 Ca -0.29 1.10 -0.24 0.00 -1.11 0.00 0.00 56.01 55.48 1i43 n LEU 421 Cb 1.05 -1.36 -0.17 0.00 0.53 0.00 0.00 43.42 43.47 1i43 n LEU 421 CO 0.42 -0.54 -0.40 -0.69 -1.11 0.00 0.00 177.39 175.07 1i43 s VAL 422 N 0.64 0.56 -0.34 1.96 1.01 0.43 -4.22 120.40 120.44 1i43 s VAL 422 Ca 0.79 0.00 -0.14 0.00 0.00 0.00 0.00 61.98 62.63 1i43 s VAL 422 Cb -0.75 -0.68 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 1i43 s VAL 422 CO 0.42 0.29 0.29 -0.60 0.00 0.00 0.00 175.10 175.50 1i43 s ARG 423 N 1.87 3.50 -0.24 2.72 3.52 -0.87 -1.07 118.95 128.39 1i43 s ARG 423 Ca 0.05 -0.57 -0.09 0.00 -0.13 0.00 0.00 55.73 54.98 1i43 s ARG 423 Cb -0.12 -3.81 -0.04 0.00 -1.56 0.00 0.00 34.95 29.41 1i43 s ARG 423 CO -0.06 -0.48 0.11 0.12 -0.81 0.00 0.00 175.30 174.18 1i43 s PHE 424 N 1.83 3.19 -0.54 5.12 2.19 0.50 -3.09 117.98 127.18 1i43 s PHE 424 Ca 0.08 -0.07 -0.12 0.00 0.33 0.00 0.00 56.93 57.14 1i43 s PHE 424 Cb -0.17 -2.24 0.14 0.00 -1.31 0.00 0.00 43.02 39.43 1i43 s PHE 424 CO 0.11 -0.13 0.46 0.45 1.83 0.00 0.00 175.22 177.94 1i43 s SER 425 N 1.29 5.99 0.01 6.13 0.15 0.58 -1.04 113.70 126.82 1i43 s SER 425 Ca 0.06 -1.98 -0.30 0.00 0.70 0.00 0.00 55.95 54.43 1i43 s SER 425 Cb -0.15 -2.11 -0.06 0.00 -1.71 0.00 0.00 66.02 62.00 1i43 s SER 425 CO 0.05 -0.74 1.47 -0.36 1.20 0.00 0.00 173.24 174.86 1i43 s PHE 426 N 1.29 2.70 0.00 3.44 0.08 -0.83 -1.10 117.98 123.56 1i43 s PHE 426 Ca 0.06 0.67 0.00 0.00 0.12 0.00 0.00 56.93 57.78 1i43 s PHE 426 Cb -0.26 -3.75 0.00 0.00 -0.57 0.00 0.00 43.02 38.44 1i43 s PHE 426 CO -0.00 -2.85 0.00 0.41 -0.10 0.00 0.00 175.22 172.68 1i43 n GLY 427 N 3.75 -0.28 0.00 4.36 0.00 -1.26 -4.84 105.19 106.93 1i43 n GLY 427 Ca 0.14 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 45.02 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 0.59 -0.60 1.61 3.14 0.14 -4.56 118.33 118.65 1i43 n VAL 428 Ca 0.00 -0.71 -0.29 0.00 -2.96 0.00 0.00 64.34 60.37 1i43 n VAL 428 Cb 0.00 0.76 0.22 0.00 -1.06 0.00 0.00 33.84 33.76 1i43 n VAL 428 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 1i43 s GLU 429 N -0.59 -0.23 0.23 1.45 8.01 -1.26 -4.90 118.70 121.41 1i43 s GLU 429 Ca 0.00 1.11 -0.31 0.00 0.01 0.00 0.00 54.97 55.78 1i43 s GLU 429 Cb 0.00 -1.61 -0.10 0.00 -4.31 0.00 0.00 34.13 28.10 1i43 s GLU 429 CO 0.00 -3.34 1.51 0.34 0.01 0.00 0.00 175.26 173.78 1i43 s ASP 430 N -2.57 6.59 0.18 -0.19 2.15 -1.26 -4.89 116.67 116.69 1i43 s ASP 430 Ca 0.68 2.69 -0.19 0.00 0.43 0.00 0.00 52.55 56.16 1i43 s ASP 430 Cb -0.24 -2.61 0.13 0.00 -0.30 0.00 0.00 42.92 39.89 1i43 s ASP 430 CO 0.62 -0.78 1.61 0.15 -0.17 0.00 0.00 175.17 176.60 1i43 h PHE 431 N 5.60 -0.69 -0.40 -5.34 3.57 -1.99 -1.51 116.94 116.19 1i43 h PHE 431 Ca -0.45 0.06 0.08 0.00 3.53 0.00 0.00 57.97 61.19 1i43 h PHE 431 Cb 1.21 0.38 -0.07 0.00 2.79 0.00 0.00 35.95 40.26 1i43 h PHE 431 CO 0.61 -0.34 -0.03 -0.44 -2.23 0.00 0.00 178.31 175.88 1i43 h ASP 432 N -0.14 -0.24 -0.52 0.41 3.32 -1.99 0.50 116.42 117.77 1i43 h ASP 432 Ca 0.23 0.10 0.04 0.00 0.02 0.00 0.00 57.03 57.42 1i43 h ASP 432 Cb 0.51 0.20 -0.04 0.00 0.22 0.00 0.00 39.33 40.21 1i43 h ASP 432 CO -0.60 -0.08 0.27 0.44 -1.72 0.00 0.00 179.24 177.56 1i43 h ASP 433 N 0.07 0.41 0.60 6.45 3.32 -1.76 -0.44 116.42 125.06 1i43 h ASP 433 Ca 0.20 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.24 1i43 h ASP 433 Cb 0.29 -0.06 0.01 0.00 0.22 0.00 0.00 39.33 39.79 1i43 h ASP 433 CO -0.36 0.28 -0.29 -0.07 -1.72 0.00 0.00 179.24 177.09 1i43 h LEU 434 N 0.54 -0.68 -0.51 1.55 3.38 -0.31 -2.54 115.31 116.74 1i43 h LEU 434 Ca 0.22 -0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.26 1i43 h LEU 434 Cb 0.11 0.18 -0.10 0.00 0.09 0.00 0.00 40.66 40.93 1i43 h LEU 434 CO -0.14 -0.36 -0.25 0.50 0.09 0.00 0.00 178.44 178.29 1i43 h LYS 435 N -1.02 -0.13 -0.98 1.13 3.64 0.11 0.35 116.57 119.68 1i43 h LYS 435 Ca -0.08 0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.41 1i43 h LYS 435 Cb 0.67 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.44 1i43 h LYS 435 CO 0.14 -0.08 0.62 0.00 -2.27 0.00 0.00 179.45 177.85 1i43 h ALA 436 N 1.16 1.53 0.07 5.00 0.00 -1.11 -0.95 119.26 124.96 1i43 h ALA 436 Ca 0.23 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1i43 h ALA 436 Cb 0.49 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1i43 h ALA 436 CO -0.59 0.26 -0.03 0.22 0.00 0.00 0.00 179.25 179.11 1i43 h ASP 437 N 1.01 -0.08 -0.65 0.00 3.58 -0.53 -0.13 116.42 119.61 1i43 h ASP 437 Ca 0.46 -0.21 0.00 0.00 0.42 0.00 0.00 57.03 57.71 1i43 h ASP 437 Cb 0.40 0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.44 1i43 h ASP 437 CO -0.22 0.16 0.42 0.40 -2.88 0.00 0.00 179.24 177.12 1i43 h ILE 438 N -0.33 1.17 0.06 2.25 2.04 -0.85 -1.99 117.51 119.86 1i43 h ILE 438 Ca -0.01 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 65.50 1i43 h ILE 438 Cb 0.29 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 1i43 h ILE 438 CO 0.02 0.17 -0.03 -0.07 0.00 0.00 0.00 178.15 178.24 1i43 h LEU 439 N 0.88 -0.07 -0.86 1.44 3.38 -1.14 -2.29 115.31 116.67 1i43 h LEU 439 Ca 0.24 -0.14 0.13 0.00 0.09 0.00 0.00 57.88 58.20 1i43 h LEU 439 Cb -0.08 0.02 -0.09 0.00 0.09 0.00 0.00 40.66 40.60 1i43 h LEU 439 CO -0.05 0.10 0.46 -0.61 0.09 0.00 0.00 178.44 178.43 1i43 h GLN 440 N -0.23 0.67 0.00 1.13 -0.00 -0.80 0.73 115.11 116.61 1i43 h GLN 440 Ca -0.01 -0.04 0.00 0.00 -0.00 0.00 0.00 58.65 58.60 1i43 h GLN 440 Cb 0.20 -0.15 0.00 0.00 0.00 0.00 0.00 27.48 27.53 1i43 h GLN 440 CO 0.01 0.44 0.00 0.00 0.00 0.00 0.00 178.83 179.28 1i43 n ALA 441 N -2.41 2.12 0.12 3.38 0.00 -0.77 -3.13 120.51 119.83 1i43 n ALA 441 Ca 0.17 -0.02 0.05 0.00 0.00 0.00 0.00 53.44 53.63 1i43 n ALA 441 Cb 0.40 -1.43 0.02 0.00 0.00 0.00 0.00 19.45 18.43 1i43 n ALA 441 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1i43 h LEU 442 N 0.00 0.00 0.00 0.00 3.38 -0.26 -3.29 115.31 115.14 1i43 h LEU 442 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1i43 h LEU 442 Cb 0.57 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1i43 h LEU 442 CO 0.00 0.36 -0.45 0.44 0.09 0.00 0.00 178.44 178.88 1i43 h ASP 443 N 0.00 0.00 -0.27 -0.43 3.32 -1.42 -3.21 116.42 114.41 1i43 h ASP 443 Ca -0.04 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 1i43 h ASP 443 Cb 1.31 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.85 1i43 h ASP 443 CO 0.04 0.34 0.13 0.28 -1.72 0.00 0.00 179.24 178.31 1i43 h SER 444 N 0.00 0.40 0.00 6.45 0.02 -1.64 -3.53 113.55 115.25 1i43 h SER 444 Ca -0.01 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1i43 h SER 444 Cb 1.27 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.71 1i43 h SER 444 CO 0.04 0.36 0.00 -0.38 -1.14 0.00 0.00 176.83 175.72