#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 3.14 -0.00 2.98 0.00 -1.26 -5.04 121.76 121.58 1i43 s ALA 51 Ca 0.00 -1.38 -0.00 0.00 0.00 0.00 0.00 51.96 50.58 1i43 s ALA 51 Cb 0.00 -0.94 -0.26 0.00 0.00 0.00 0.00 23.12 21.92 1i43 s ALA 51 CO 0.00 0.49 0.83 0.66 0.00 0.00 0.00 175.76 177.74 1i43 h SER 52 N 2.82 0.30 0.29 0.00 4.64 -2.05 -3.25 113.55 116.30 1i43 h SER 52 Ca -0.47 -0.44 0.00 0.00 -0.47 0.00 0.00 61.79 60.41 1i43 h SER 52 Cb 1.20 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1i43 h SER 52 CO 0.57 1.37 0.00 2.22 -0.87 0.00 0.00 176.83 180.12 1i43 n PHE 53 N -3.39 0.00 -3.83 4.77 1.16 -1.26 -4.35 117.46 110.56 1i43 n PHE 53 Ca -0.16 0.00 -0.35 0.00 -1.87 0.00 0.00 57.45 55.07 1i43 n PHE 53 Cb 1.04 -0.17 -0.12 0.00 -1.61 0.00 0.00 39.48 38.61 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 -2.35 5.14 0.00 5.98 1.43 -1.23 -4.92 118.68 122.73 1i43 s LEU 54 Ca 0.30 -2.10 0.13 0.00 -1.03 0.00 0.00 54.13 51.43 1i43 s LEU 54 Cb 0.17 -1.78 0.18 0.00 0.03 0.00 0.00 46.19 44.80 1i43 s LEU 54 CO 0.35 -0.50 1.04 0.59 0.23 0.00 0.00 176.35 178.07 1i43 n ASN 55 N 4.46 2.42 -4.42 2.29 3.02 -1.26 -4.61 115.26 117.16 1i43 n ASN 55 Ca -0.00 -1.69 -0.29 0.00 -0.03 0.00 0.00 54.58 52.56 1i43 n ASN 55 Cb 0.41 -0.08 -0.13 0.00 -0.61 0.00 0.00 39.78 39.37 1i43 n ASN 55 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1i43 s SER 56 N -1.10 3.52 0.26 6.41 0.15 -1.26 -5.03 113.70 116.65 1i43 s SER 56 Ca 0.19 -0.64 -0.04 0.00 0.70 0.00 0.00 55.95 56.17 1i43 s SER 56 Cb 0.12 -0.37 0.32 0.00 -1.71 0.00 0.00 66.02 64.39 1i43 s SER 56 CO 0.18 0.20 1.84 0.44 1.20 0.00 0.00 173.24 177.09 1i43 h ASP 57 N 4.02 0.93 -0.46 5.45 3.32 -1.98 -1.41 116.42 126.28 1i43 h ASP 57 Ca -0.50 -0.13 0.02 0.00 0.02 0.00 0.00 57.03 56.45 1i43 h ASP 57 Cb 1.16 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 40.44 1i43 h ASP 57 CO 0.43 0.82 0.27 1.23 -1.72 0.00 0.00 179.24 180.27 1i43 h GLY 58 N 1.07 0.65 1.49 2.75 0.00 -1.98 0.45 103.07 107.50 1i43 h GLY 58 Ca 0.24 -0.21 -0.07 0.00 0.00 0.00 0.00 47.33 47.29 1i43 h GLY 58 CO -0.02 0.18 -0.08 1.76 0.00 0.00 0.00 176.54 178.38 1i43 h SER 59 N 0.55 0.60 0.38 0.19 0.02 -1.90 -3.00 113.55 110.38 1i43 h SER 59 Ca 0.19 -0.15 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 1i43 h SER 59 Cb 0.01 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.40 1i43 h SER 59 CO -0.09 0.72 -0.18 0.58 -1.14 0.00 0.00 176.83 176.72 1i43 h VAL 60 N 0.57 0.55 0.00 2.27 2.07 -0.24 -2.14 116.25 119.34 1i43 h VAL 60 Ca 0.11 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1i43 h VAL 60 Cb 0.48 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1i43 h VAL 60 CO 0.03 0.09 0.44 0.00 0.02 0.00 0.00 177.57 178.15 1i43 h ALA 61 N -0.43 1.38 0.00 1.67 0.00 -0.07 0.67 119.26 122.49 1i43 h ALA 61 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.50 1i43 h ALA 61 Cb 0.54 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 1i43 h ALA 61 CO 0.09 -0.38 -1.94 -0.89 0.00 0.00 0.00 179.25 176.12 1i43 n ILE 62 N -2.45 1.54 0.60 0.00 5.41 -1.11 -4.25 119.36 119.10 1i43 n ILE 62 Ca -0.01 -0.22 0.08 0.00 1.00 0.00 0.00 62.75 63.60 1i43 n ILE 62 Cb 0.47 -1.95 -0.11 0.00 -0.71 0.00 0.00 39.64 37.34 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 -4.31 0.00 -1.68 1.39 8.25 -0.78 -4.89 115.22 113.20 1i43 n HIS 63 Ca -0.44 0.00 -0.48 0.00 -0.26 0.00 0.00 57.72 56.54 1i43 n HIS 63 Cb 0.80 -0.10 -0.05 0.00 1.12 0.00 0.00 29.99 31.76 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 -1.57 0.89 -0.90 -1.41 0.00 0.23 -1.02 120.51 116.74 1i43 n ALA 64 Ca 0.02 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.75 1i43 n ALA 64 Cb 0.31 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.28 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 4.32 0.46 2.03 0.00 0.00 -1.26 -4.17 105.19 106.58 1i43 n GLY 65 Ca 0.22 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.90 0.00 -0.35 1.61 1.02 -0.19 -4.73 120.64 115.12 1i43 n GLU 66 Ca 0.00 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.27 1i43 n GLU 66 Cb 0.00 0.00 0.33 0.00 -0.02 0.00 0.00 31.44 31.75 1i43 n GLU 66 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1i43 h ARG 67 N 0.00 0.75 0.03 3.49 9.65 -1.72 -2.74 114.38 123.84 1i43 h ARG 67 Ca 0.00 -0.05 -0.28 0.00 -1.10 0.00 0.00 59.98 58.55 1i43 h ARG 67 Cb 0.00 -0.17 -0.04 0.00 -1.39 0.00 0.00 29.97 28.37 1i43 h ARG 67 CO 0.00 0.50 -1.57 -0.07 2.80 0.00 0.00 179.97 181.62 1i43 h LEU 68 N 0.77 0.10 0.00 3.80 3.38 -1.93 -3.50 115.31 117.93 1i43 h LEU 68 Ca 0.56 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.36 1i43 h LEU 68 Cb 0.86 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1i43 h LEU 68 CO -0.35 1.15 0.00 0.61 0.09 0.00 0.00 178.44 179.94 1i43 n GLY 69 N 1.57 -0.46 0.00 0.83 0.00 -1.04 -5.08 105.19 101.02 1i43 n GLY 69 Ca -0.15 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 44.90 1i43 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i43 n ARG 70 N -0.12 1.92 0.00 1.61 1.74 -1.26 -3.58 116.66 116.97 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 -0.16 0.00 0.00 -1.02 0.00 0.00 32.46 31.28 1i43 n ARG 70 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1i43 n GLY 71 N 0.00 2.84 2.93 -0.13 0.00 -1.26 -4.84 105.19 104.73 1i43 n GLY 71 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1i43 n GLY 71 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1i43 s ILE 72 N -1.07 2.70 0.27 -0.61 -1.16 -1.26 -5.09 121.20 114.98 1i43 s ILE 72 Ca 0.00 -3.65 -0.29 0.00 -0.51 0.00 0.00 60.65 56.20 1i43 s ILE 72 Cb 0.00 -2.84 -0.14 0.00 0.61 0.00 0.00 42.46 40.09 1i43 s ILE 72 CO 0.00 -0.87 1.11 0.52 -2.81 0.00 0.00 174.94 172.89 1i43 n VAL 73 N 2.72 1.71 -3.57 4.00 0.31 -1.26 -4.94 118.33 117.29 1i43 n VAL 73 Ca 0.10 -0.43 -0.09 0.00 -0.01 0.00 0.00 64.34 63.91 1i43 n VAL 73 Cb 0.33 -1.10 -0.04 0.00 -0.91 0.00 0.00 33.84 32.12 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 -0.82 0.00 -0.35 2.52 -4.23 -1.26 -5.00 115.64 106.50 1i43 s THR 74 Ca 0.61 0.00 0.10 0.00 -1.18 0.00 0.00 61.69 61.22 1i43 s THR 74 Cb -0.70 -1.00 0.68 0.00 1.34 0.00 0.00 72.50 72.82 1i43 s THR 74 CO 0.58 0.00 1.64 -0.90 -0.54 0.00 0.00 174.62 175.40 1i43 n ASP 75 N 0.47 4.76 -4.88 3.99 5.75 -1.26 -4.91 116.55 120.47 1i43 n ASP 75 Ca -0.08 -2.96 -0.33 0.00 -0.01 0.00 0.00 54.79 51.41 1i43 n ASP 75 Cb 0.59 -0.70 -0.05 0.00 -1.03 0.00 0.00 41.12 39.93 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 -2.62 3.69 0.18 2.12 0.00 -1.26 -5.01 121.76 118.87 1i43 s ALA 76 Ca 0.48 -0.40 0.03 0.00 0.00 0.00 0.00 51.96 52.07 1i43 s ALA 76 Cb 0.38 -2.28 0.06 0.00 0.00 0.00 0.00 23.12 21.28 1i43 s ALA 76 CO 0.13 0.58 1.43 0.82 0.00 0.00 0.00 175.76 178.71 1i43 h ILE 77 N 2.29 1.46 -1.81 0.00 2.04 -2.02 -3.46 117.51 116.02 1i43 h ILE 77 Ca -0.47 -2.44 -0.47 0.00 1.00 0.00 0.00 64.86 62.48 1i43 h ILE 77 Cb 1.18 2.33 -0.02 0.00 -0.74 0.00 0.00 36.82 39.57 1i43 h ILE 77 CO 0.70 0.71 -0.39 0.42 0.00 0.00 0.00 178.15 179.59 1i43 s THR 78 N -3.36 3.74 0.00 -0.27 -4.23 -1.26 -4.98 115.64 105.28 1i43 s THR 78 Ca -0.03 -1.19 -0.30 0.00 -1.18 0.00 0.00 61.69 58.99 1i43 s THR 78 Cb 0.11 -3.28 -0.03 0.00 1.34 0.00 0.00 72.50 70.64 1i43 s THR 78 CO 0.82 -0.16 0.99 -0.89 -0.54 0.00 0.00 174.62 174.84 1i43 s THR 79 N -2.25 4.85 0.18 3.99 2.01 -1.26 -5.03 115.64 118.13 1i43 s THR 79 Ca 0.43 2.05 -0.30 0.00 0.31 0.00 0.00 61.69 64.18 1i43 s THR 79 Cb -0.07 -4.31 -0.08 0.00 0.01 0.00 0.00 72.50 68.05 1i43 s THR 79 CO 0.29 0.16 1.06 -2.84 -0.69 0.00 0.00 174.62 172.59 1i43 s PRO 80 N 1.02 4.65 -0.25 4.92 0.02 -1.26 -5.01 135.00 139.09 1i43 s PRO 80 Ca 0.52 1.65 -0.26 0.00 0.02 0.00 0.00 61.00 62.92 1i43 s PRO 80 Cb -0.21 -3.29 0.00 0.00 0.02 0.00 0.00 34.50 31.02 1i43 s PRO 80 CO 0.28 0.16 0.92 0.08 -0.33 0.00 0.00 177.00 178.11 1i43 s VAL 81 N -0.36 4.74 -0.49 3.83 1.01 -1.26 -4.44 120.40 123.43 1i43 s VAL 81 Ca 0.48 1.71 -0.14 0.00 0.00 0.00 0.00 61.98 64.02 1i43 s VAL 81 Cb -0.28 -4.22 0.10 0.00 0.00 0.00 0.00 36.38 31.99 1i43 s VAL 81 CO 0.34 -0.17 0.41 -0.69 0.00 0.00 0.00 175.10 174.99 1i43 s VAL 82 N 3.06 4.92 -1.08 2.92 1.01 -1.26 -5.00 120.40 124.97 1i43 s VAL 82 Ca 0.39 -1.40 -0.15 0.00 0.00 0.00 0.00 61.98 60.82 1i43 s VAL 82 Cb -0.15 -4.08 0.18 0.00 0.00 0.00 0.00 36.38 32.33 1i43 s VAL 82 CO 0.08 -0.71 1.24 0.20 0.00 0.00 0.00 175.10 175.91 1i43 s ASN 83 N 2.93 6.94 0.05 3.32 0.01 -1.26 -4.79 114.94 122.14 1i43 s ASN 83 Ca 0.04 -2.75 0.01 0.00 -0.71 0.00 0.00 52.86 49.45 1i43 s ASN 83 Cb -0.27 -2.36 -0.03 0.00 0.41 0.00 0.00 41.25 39.01 1i43 s ASN 83 CO 0.03 -0.77 -0.06 0.28 -1.51 0.00 0.00 177.10 175.07 1i43 s THR 84 N 1.42 0.47 -0.05 1.60 -1.32 -1.26 -5.04 115.64 111.46 1i43 s THR 84 Ca 0.36 -1.32 0.19 0.00 -1.21 0.00 0.00 61.69 59.71 1i43 s THR 84 Cb -0.05 -0.88 -0.29 0.00 -1.51 0.00 0.00 72.50 69.77 1i43 s THR 84 CO -0.05 -0.58 0.37 -1.54 -2.21 0.00 0.00 174.62 170.61 1i43 n SER 85 N 1.01 0.57 -3.73 8.08 3.41 -1.26 -4.75 113.62 116.95 1i43 n SER 85 Ca -0.20 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.29 1i43 n SER 85 Cb 0.57 1.73 -0.06 0.00 -0.26 0.00 0.00 64.21 66.19 1i43 n SER 85 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i43 s ALA 86 N -3.20 0.58 -0.04 7.33 0.00 -1.26 -0.24 121.76 124.93 1i43 s ALA 86 Ca -0.07 -1.37 0.03 0.00 0.00 0.00 0.00 51.96 50.54 1i43 s ALA 86 Cb 0.11 1.20 0.00 0.00 0.00 0.00 0.00 23.12 24.44 1i43 s ALA 86 CO 0.79 -0.76 -0.10 0.71 0.00 0.00 0.00 175.76 176.40 1i43 s TYR 87 N -3.66 1.13 0.53 0.00 1.51 -0.44 -4.88 117.35 111.55 1i43 s TYR 87 Ca 0.30 -0.32 0.01 0.00 -1.01 0.00 0.00 57.07 56.05 1i43 s TYR 87 Cb 0.01 -0.81 0.02 0.00 -0.11 0.00 0.00 41.96 41.08 1i43 s TYR 87 CO 0.15 -0.14 0.76 -0.59 -1.11 0.00 0.00 175.55 174.62 1i43 s PHE 88 N 0.28 2.96 0.02 2.71 -0.12 -1.26 -4.72 117.98 117.86 1i43 s PHE 88 Ca -0.05 0.08 0.05 0.00 -0.05 0.00 0.00 56.93 56.96 1i43 s PHE 88 Cb -0.10 -2.66 -0.02 0.00 -0.63 0.00 0.00 43.02 39.61 1i43 s PHE 88 CO 0.01 -0.76 -0.16 -0.06 -0.05 0.00 0.00 175.22 174.20 1i43 s PHE 89 N -2.74 1.42 0.23 3.49 0.40 -1.26 -5.06 117.98 114.46 1i43 s PHE 89 Ca 0.55 -0.33 -0.03 0.00 -0.60 0.00 0.00 56.93 56.53 1i43 s PHE 89 Cb -0.10 -0.86 0.24 0.00 0.51 0.00 0.00 43.02 42.80 1i43 s PHE 89 CO 0.39 0.03 1.65 -0.91 0.70 0.00 0.00 175.22 177.08 1i43 h ASN 90 N 5.19 0.71 -4.70 1.36 2.35 -2.00 -3.46 115.58 115.04 1i43 h ASN 90 Ca -0.38 -0.25 -0.07 0.00 -0.55 0.00 0.00 56.30 55.05 1i43 h ASN 90 Cb 1.17 -0.20 -0.20 0.00 0.05 0.00 0.00 38.32 39.14 1i43 h ASN 90 CO 0.45 0.92 0.08 -1.59 -1.65 0.00 0.00 177.43 175.65 1i43 s LYS 91 N -4.59 0.92 0.43 0.81 -2.85 -1.26 -5.03 119.74 108.17 1i43 s LYS 91 Ca -0.09 0.38 0.30 0.00 -1.00 0.00 0.00 55.97 55.56 1i43 s LYS 91 Cb 0.13 0.43 1.43 0.00 -2.06 0.00 0.00 37.83 37.76 1i43 s LYS 91 CO 0.82 -0.24 1.61 1.15 0.10 0.00 0.00 175.35 178.79 1i43 h THR 92 N 3.44 0.09 0.08 3.79 2.02 -1.99 0.31 112.91 120.64 1i43 h THR 92 Ca -0.28 -0.02 0.02 0.00 0.77 0.00 0.00 66.41 66.90 1i43 h THR 92 Cb 1.15 0.02 -0.04 0.00 -1.74 0.00 0.00 68.15 67.54 1i43 h THR 92 CO 0.31 0.01 -0.29 -1.28 0.37 0.00 0.00 175.52 174.64 1i43 h SER 93 N 0.06 -0.83 -0.84 4.18 0.87 -2.00 -1.41 113.55 113.58 1i43 h SER 93 Ca 0.84 0.10 -0.00 0.00 -1.23 0.00 0.00 61.79 61.50 1i43 h SER 93 Cb 2.60 0.32 -0.04 0.00 -0.44 0.00 0.00 62.40 64.84 1i43 h SER 93 CO -0.47 -0.37 0.52 -0.33 -0.53 0.00 0.00 176.83 175.66 1i43 h GLU 94 N -0.48 1.13 -0.89 2.24 5.08 -0.82 -1.82 114.58 119.03 1i43 h GLU 94 Ca 0.04 -0.09 0.10 0.00 -1.00 0.00 0.00 59.36 58.41 1i43 h GLU 94 Cb 0.53 -0.24 -0.08 0.00 0.50 0.00 0.00 28.75 29.46 1i43 h GLU 94 CO -0.19 0.78 0.53 1.25 -1.00 0.00 0.00 179.01 180.38 1i43 h LEU 95 N 1.15 0.77 -0.27 1.33 5.85 -0.99 -0.04 115.31 123.11 1i43 h LEU 95 Ca 0.30 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 59.04 1i43 h LEU 95 Cb -0.07 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 1i43 h LEU 95 CO -0.06 0.44 0.06 0.40 -0.34 0.00 0.00 178.44 178.93 1i43 h ILE 96 N 0.88 1.22 -0.52 4.05 2.04 -0.60 -1.82 117.51 122.75 1i43 h ILE 96 Ca 0.43 -0.74 0.10 0.00 1.00 0.00 0.00 64.86 65.65 1i43 h ILE 96 Cb 0.39 1.18 -0.08 0.00 -0.74 0.00 0.00 36.82 37.56 1i43 h ILE 96 CO -0.25 0.24 0.02 0.44 0.00 0.00 0.00 178.15 178.60 1i43 h ASP 97 N 0.27 -0.19 -0.28 1.72 3.32 -0.30 0.21 116.42 121.17 1i43 h ASP 97 Ca 0.09 0.12 0.01 0.00 0.02 0.00 0.00 57.03 57.26 1i43 h ASP 97 Cb 0.31 0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 1i43 h ASP 97 CO 0.00 -0.07 0.18 0.15 -1.72 0.00 0.00 179.24 177.78 1i43 h PHE 98 N 0.13 0.33 0.00 4.55 3.57 -0.88 0.16 116.94 124.81 1i43 h PHE 98 Ca 0.27 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.76 1i43 h PHE 98 Cb 0.40 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.03 1i43 h PHE 98 CO -0.31 0.20 -0.06 0.87 -2.23 0.00 0.00 178.31 176.78 1i43 h LYS 99 N 0.36 0.00 -0.68 1.11 1.79 -0.29 -1.07 116.57 117.79 1i43 h LYS 99 Ca 0.11 0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.45 1i43 h LYS 99 Cb -0.02 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 30.55 1i43 h LYS 99 CO -0.04 0.06 0.16 0.39 -1.08 0.00 0.00 179.45 178.95 1i43 n GLU 100 N -3.68 4.27 -3.06 3.15 1.02 0.60 -4.93 120.64 118.01 1i43 n GLU 100 Ca -0.02 -3.13 -0.22 0.00 -0.02 0.00 0.00 57.16 53.77 1i43 n GLU 100 Cb 0.16 -2.25 0.02 0.00 -0.02 0.00 0.00 31.44 29.35 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 0.19 -3.97 -0.00 3.49 4.01 -0.41 -4.86 118.16 116.61 1i43 n LYS 101 Ca 0.36 0.73 0.07 0.00 -0.51 0.00 0.00 58.31 58.96 1i43 n LYS 101 Cb 1.32 -5.51 -0.10 0.00 -0.51 0.00 0.00 35.03 30.23 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 -3.77 1.11 -4.22 1.97 1.74 0.47 -5.00 116.66 108.96 1i43 n ARG 102 Ca -0.09 -0.09 -0.13 0.00 -0.77 0.00 0.00 57.85 56.78 1i43 n ARG 102 Cb 0.59 -1.29 -0.10 0.00 -1.02 0.00 0.00 32.46 30.65 1i43 n ARG 102 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1i43 s ARG 103 N -2.78 1.00 0.03 5.56 3.52 -1.19 -4.90 118.95 120.19 1i43 s ARG 103 Ca -0.01 -1.43 0.02 0.00 -0.13 0.00 0.00 55.73 54.18 1i43 s ARG 103 Cb 0.10 -0.44 -0.04 0.00 -1.56 0.00 0.00 34.95 33.01 1i43 s ARG 103 CO 0.61 0.01 0.03 0.00 -0.81 0.00 0.00 175.30 175.14 1i43 s ALA 104 N -3.47 3.39 0.00 6.12 0.00 -1.26 -4.46 121.76 122.08 1i43 s ALA 104 Ca 0.16 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 51.14 1i43 s ALA 104 Cb 0.04 -1.37 0.00 0.00 0.00 0.00 0.00 23.12 21.79 1i43 s ALA 104 CO -0.01 0.69 0.00 0.45 0.00 0.00 0.00 175.76 176.89 1i43 n SER 105 N 1.01 0.00 0.15 0.00 2.88 -1.26 -5.02 113.62 111.38 1i43 n SER 105 Ca -0.12 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 57.51 1i43 n SER 105 Cb 0.52 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 64.05 1i43 n SER 105 CO 0.00 0.00 0.00 -0.26 -1.23 0.00 0.00 175.04 173.55 1i43 h PHE 106 N 0.00 0.00 0.00 0.66 0.04 -1.94 -3.48 116.94 112.23 1i43 h PHE 106 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1i43 h PHE 106 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 1i43 h PHE 106 CO 0.00 0.13 0.00 -1.91 -0.60 0.00 0.00 178.31 175.93 1i43 n GLU 107 N -2.94 0.00 -4.35 1.51 2.13 -1.26 -4.54 120.64 111.18 1i43 n GLU 107 Ca 0.01 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.58 1i43 n GLU 107 Cb 0.60 0.00 -0.12 0.00 0.27 0.00 0.00 31.44 32.19 1i43 n GLU 107 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1i43 s TYR 108 N 0.00 2.01 0.54 4.31 5.04 -1.26 -1.33 117.35 126.66 1i43 s TYR 108 Ca 0.00 -0.41 0.33 0.00 -2.44 0.00 0.00 57.07 54.55 1i43 s TYR 108 Cb 0.00 -1.04 1.86 0.00 0.35 0.00 0.00 41.96 43.13 1i43 s TYR 108 CO 0.00 0.34 2.22 0.78 -1.34 0.00 0.00 175.55 177.55 1i43 h GLY 109 N 3.57 0.00 2.00 8.97 0.00 -0.84 -1.48 103.07 115.29 1i43 h GLY 109 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1i43 h GLY 109 CO 0.45 0.00 0.00 -0.09 0.00 0.00 0.00 176.54 176.90 1i43 h ARG 110 N 0.00 0.00 -0.20 4.80 2.43 -1.91 -3.11 114.38 116.38 1i43 h ARG 110 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1i43 h ARG 110 Cb 0.12 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 1i43 h ARG 110 CO 0.00 0.00 0.00 0.66 -1.51 0.00 0.00 179.97 179.12 1i43 n TYR 111 N -2.36 0.24 -0.26 2.20 4.01 -0.56 -4.76 117.16 115.68 1i43 n TYR 111 Ca 0.04 -0.13 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 1i43 n TYR 111 Cb 0.35 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.38 1i43 n TYR 111 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i43 n GLY 112 N 1.31 -1.09 3.64 2.72 0.00 -1.18 -4.93 105.19 105.67 1i43 n GLY 112 Ca 0.15 -1.60 -0.05 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 -0.47 -0.24 0.15 1.61 3.84 -1.26 -4.48 114.94 114.08 1i43 s ASN 113 Ca 0.00 0.45 -0.19 0.00 0.21 0.00 0.00 52.86 53.33 1i43 s ASN 113 Cb 0.00 0.58 0.03 0.00 -0.55 0.00 0.00 41.25 41.31 1i43 s ASN 113 CO 0.00 -0.08 1.67 1.55 -2.79 0.00 0.00 177.10 177.46 1i43 h PRO 114 N 3.98 -0.07 0.00 0.43 0.13 -1.96 -1.27 132.00 133.25 1i43 h PRO 114 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1i43 h PRO 114 Cb 1.19 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1i43 h PRO 114 CO 0.16 -0.04 0.00 -2.37 -0.23 0.00 0.00 178.00 175.51 1i43 n THR 115 N -5.29 0.75 -0.09 1.56 5.66 -1.26 -3.00 114.28 112.62 1i43 n THR 115 Ca -0.00 0.19 -0.15 0.00 -3.05 0.00 0.00 64.05 61.03 1i43 n THR 115 Cb 0.20 -0.92 -0.14 0.00 -1.55 0.00 0.00 70.33 67.92 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 -1.40 1.51 0.23 1.09 -1.04 -0.57 -4.25 114.28 109.87 1i43 n THR 116 Ca 0.06 -0.69 0.07 0.00 -2.04 0.00 0.00 64.05 61.44 1i43 n THR 116 Cb 0.15 -1.14 0.55 0.00 -1.82 0.00 0.00 70.33 68.08 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 0.01 0.96 -0.14 12.58 -1.51 -1.21 -1.78 116.25 125.16 1i43 h VAL 117 Ca -0.52 -0.70 0.02 0.00 -1.23 0.00 0.00 66.70 64.27 1i43 h VAL 117 Cb 2.04 1.39 -0.02 0.00 -2.13 0.00 0.00 31.29 32.57 1i43 h VAL 117 CO -0.01 0.19 0.02 0.58 -1.23 0.00 0.00 177.57 177.12 1i43 h VAL 118 N 0.00 0.93 -0.43 7.19 2.07 -1.73 0.21 116.25 124.49 1i43 h VAL 118 Ca -0.00 -0.03 -0.06 0.00 0.82 0.00 0.00 66.70 67.44 1i43 h VAL 118 Cb 0.38 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1i43 h VAL 118 CO 0.02 0.01 0.03 0.25 0.02 0.00 0.00 177.57 177.91 1i43 h LEU 119 N 0.07 0.63 -0.35 2.57 5.85 -1.61 0.86 115.31 123.32 1i43 h LEU 119 Ca 0.06 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 1i43 h LEU 119 Cb 0.06 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1i43 h LEU 119 CO -0.09 0.68 0.21 -0.33 -0.34 0.00 0.00 178.44 178.58 1i43 h GLU 120 N 0.64 0.48 -0.10 1.25 5.08 -0.40 -0.75 114.58 120.79 1i43 h GLU 120 Ca 0.13 -0.04 -0.17 0.00 -1.00 0.00 0.00 59.36 58.28 1i43 h GLU 120 Cb 0.36 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1i43 h GLU 120 CO 0.01 0.36 -0.67 0.93 -1.00 0.00 0.00 179.01 178.64 1i43 h GLU 121 N 0.46 0.40 0.52 2.33 5.08 -0.35 -2.12 114.58 120.90 1i43 h GLU 121 Ca 0.13 -0.30 -0.02 0.00 -1.00 0.00 0.00 59.36 58.17 1i43 h GLU 121 Cb 0.01 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1i43 h GLU 121 CO -0.02 0.93 -0.38 -0.22 -1.00 0.00 0.00 179.01 178.31 1i43 h LYS 122 N 0.28 -0.85 -0.05 2.33 3.64 -0.43 -1.27 116.57 120.22 1i43 h LYS 122 Ca -0.02 0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 1i43 h LYS 122 Cb 1.22 0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 33.23 1i43 h LYS 122 CO 0.11 -0.57 -0.15 0.82 -2.27 0.00 0.00 179.45 177.40 1i43 h ILE 123 N -0.88 1.14 -0.31 2.00 2.04 -1.19 -2.17 117.51 118.14 1i43 h ILE 123 Ca -0.06 -0.63 -0.07 0.00 1.00 0.00 0.00 64.86 65.10 1i43 h ILE 123 Cb 0.74 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.08 1i43 h ILE 123 CO 0.02 0.19 -0.11 0.28 0.00 0.00 0.00 178.15 178.52 1i43 h SER 124 N 0.07 0.51 -0.24 1.72 0.02 -0.91 -2.25 113.55 112.47 1i43 h SER 124 Ca 0.01 -0.13 -0.16 0.00 -0.84 0.00 0.00 61.79 60.67 1i43 h SER 124 Cb 0.31 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.72 1i43 h SER 124 CO 0.02 0.66 -0.47 0.00 -1.14 0.00 0.00 176.83 175.90 1i43 h ALA 125 N 1.39 0.38 0.35 3.77 0.00 -0.59 0.43 119.26 124.99 1i43 h ALA 125 Ca 0.09 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 1i43 h ALA 125 Cb 0.49 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1i43 h ALA 125 CO 0.03 0.54 -0.17 -0.07 0.00 0.00 0.00 179.25 179.58 1i43 h LEU 126 N 0.47 -0.40 -0.18 0.00 3.38 -1.28 -2.28 115.31 115.02 1i43 h LEU 126 Ca 0.01 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1i43 h LEU 126 Cb 1.08 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1i43 h LEU 126 CO 0.11 -0.23 0.00 -0.62 0.09 0.00 0.00 178.44 177.79 1i43 n GLU 127 N -5.26 0.08 -2.93 1.13 -0.58 -0.86 -4.86 120.64 107.35 1i43 n GLU 127 Ca -0.10 0.24 -0.17 0.00 -0.42 0.00 0.00 57.16 56.71 1i43 n GLU 127 Cb 0.22 -1.63 0.03 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 0.43 -0.18 3.96 0.62 0.00 -0.14 -4.73 105.19 105.15 1i43 n GLY 128 Ca 0.04 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.74 1i43 n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i43 s ALA 129 N -3.06 3.52 -0.00 4.61 0.00 0.13 -4.99 121.76 121.97 1i43 s ALA 129 Ca 0.27 -1.22 0.07 0.00 0.00 0.00 0.00 51.96 51.08 1i43 s ALA 129 Cb -0.12 -2.30 -0.24 0.00 0.00 0.00 0.00 23.12 20.47 1i43 s ALA 129 CO 0.34 -1.13 0.81 1.49 0.00 0.00 0.00 175.76 177.27 1i43 h GLU 130 N -0.34 0.06 -2.15 0.00 4.81 -1.79 -3.44 114.58 111.74 1i43 h GLU 130 Ca -0.42 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 58.70 1i43 h GLU 130 Cb 1.30 0.04 -0.18 0.00 0.63 0.00 0.00 28.75 30.54 1i43 h GLU 130 CO 0.53 0.76 0.29 0.45 -0.73 0.00 0.00 179.01 180.31 1i43 s SER 131 N -6.44 -0.56 0.02 1.04 0.15 -0.83 -4.81 113.70 102.27 1i43 s SER 131 Ca -0.05 0.45 0.03 0.00 0.70 0.00 0.00 55.95 57.08 1i43 s SER 131 Cb 0.08 0.49 -0.01 0.00 -1.71 0.00 0.00 66.02 64.87 1i43 s SER 131 CO 0.82 -0.63 -0.10 -0.89 1.20 0.00 0.00 173.24 173.64 1i43 s THR 132 N -1.87 0.77 -0.04 6.45 2.01 -1.26 -1.67 115.64 120.03 1i43 s THR 132 Ca -0.05 -0.68 0.06 0.00 0.31 0.00 0.00 61.69 61.33 1i43 s THR 132 Cb -0.00 -0.70 -0.02 0.00 0.01 0.00 0.00 72.50 71.79 1i43 s THR 132 CO 0.02 0.03 -0.23 -0.22 -0.69 0.00 0.00 174.62 173.53 1i43 s LEU 133 N -0.73 2.24 -0.07 4.42 2.96 -0.02 -4.84 118.68 122.64 1i43 s LEU 133 Ca 0.00 -0.41 0.04 0.00 -0.22 0.00 0.00 54.13 53.54 1i43 s LEU 133 Cb -0.06 -1.40 -0.02 0.00 0.50 0.00 0.00 46.19 45.21 1i43 s LEU 133 CO 0.00 0.31 -0.18 -0.76 -1.32 0.00 0.00 176.35 174.40 1i43 s LEU 134 N -0.53 2.49 0.00 -0.68 1.43 -1.26 -2.09 118.68 118.03 1i43 s LEU 134 Ca 0.07 -0.33 0.02 0.00 -1.03 0.00 0.00 54.13 52.85 1i43 s LEU 134 Cb -0.11 -1.50 -0.01 0.00 0.03 0.00 0.00 46.19 44.61 1i43 s LEU 134 CO 0.00 0.28 0.06 0.23 0.23 0.00 0.00 176.35 177.15 1i43 n MET 135 N 2.75 0.77 0.22 1.70 2.81 -0.99 -4.50 117.12 119.87 1i43 n MET 135 Ca -0.17 -3.30 0.07 0.00 -1.81 0.00 0.00 57.70 52.49 1i43 n MET 135 Cb 0.52 1.24 0.50 0.00 -0.71 0.00 0.00 33.22 34.78 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 1.40 1.36 -2.39 3.04 0.00 -1.30 -1.02 119.26 120.35 1i43 h ALA 136 Ca -0.35 -0.23 0.12 0.00 0.00 0.00 0.00 54.91 54.45 1i43 h ALA 136 Cb 1.15 -0.04 -0.12 0.00 0.00 0.00 0.00 17.79 18.77 1i43 h ALA 136 CO 0.57 0.32 0.46 -1.54 0.00 0.00 0.00 179.25 179.05 1i43 s SER 137 N -6.63 -0.32 0.15 0.00 1.04 -1.26 -3.19 113.70 103.48 1i43 s SER 137 Ca -0.03 -0.14 -0.20 0.00 0.48 0.00 0.00 55.95 56.05 1i43 s SER 137 Cb 0.14 0.45 0.04 0.00 0.10 0.00 0.00 66.02 66.74 1i43 s SER 137 CO 0.67 -0.76 1.65 1.23 0.98 0.00 0.00 173.24 177.01 1i43 h GLY 138 N 2.00 0.02 0.20 7.32 0.00 -1.75 -0.91 103.07 109.94 1i43 h GLY 138 Ca -0.24 0.21 0.18 0.00 0.00 0.00 0.00 47.33 47.48 1i43 h GLY 138 CO 0.30 -0.17 0.61 -0.33 0.00 0.00 0.00 176.54 176.95 1i43 h MET 139 N -0.15 0.73 -0.59 4.80 2.86 -1.92 0.23 114.93 120.90 1i43 h MET 139 Ca 0.14 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.70 1i43 h MET 139 Cb 0.36 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 31.83 1i43 h MET 139 CO -0.35 0.48 0.22 0.00 1.06 0.00 0.00 176.91 178.32 1i43 h ALA 141 N 1.07 -1.04 0.10 0.00 0.00 0.34 0.23 119.26 119.96 1i43 h ALA 141 Ca 0.19 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1i43 h ALA 141 Cb 0.23 0.56 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 1i43 h ALA 141 CO -0.01 -1.06 -0.41 0.77 0.00 0.00 0.00 179.25 178.54 1i43 h SER 142 N -0.70 -1.21 -0.34 0.00 0.02 -1.31 -0.45 113.55 109.56 1i43 h SER 142 Ca -0.05 0.14 0.04 0.00 -0.84 0.00 0.00 61.79 61.08 1i43 h SER 142 Cb 0.60 0.46 -0.06 0.00 0.14 0.00 0.00 62.40 63.54 1i43 h SER 142 CO -0.02 -0.48 -0.36 0.74 -1.14 0.00 0.00 176.83 175.57 1i43 h THR 143 N -0.63 0.00 -0.55 -2.27 2.02 -0.97 0.26 112.91 110.77 1i43 h THR 143 Ca 0.03 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.25 1i43 h THR 143 Cb 0.67 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.03 1i43 h THR 143 CO -0.25 0.00 0.30 0.58 0.37 0.00 0.00 175.52 176.52 1i43 h VAL 144 N -0.20 0.98 -0.80 3.16 2.07 -0.85 -1.61 116.25 119.00 1i43 h VAL 144 Ca 0.06 -0.20 0.09 0.00 0.82 0.00 0.00 66.70 67.47 1i43 h VAL 144 Cb 0.35 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 30.41 1i43 h VAL 144 CO -0.42 0.10 0.46 -0.03 0.02 0.00 0.00 177.57 177.70 1i43 h MET 145 N 0.57 0.75 -0.13 1.57 -1.53 -0.38 0.07 114.93 115.86 1i43 h MET 145 Ca 0.24 -0.05 -0.04 0.00 -3.44 0.00 0.00 59.70 56.42 1i43 h MET 145 Cb 0.12 -0.17 -0.00 0.00 -0.55 0.00 0.00 31.60 31.00 1i43 h MET 145 CO -0.15 0.50 -0.06 -0.07 0.14 0.00 0.00 176.91 177.27 1i43 h LEU 146 N 0.78 0.28 -2.02 3.39 3.38 -0.47 -0.79 115.31 119.86 1i43 h LEU 146 Ca 0.38 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1i43 h LEU 146 Cb 0.33 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1i43 h LEU 146 CO -0.24 0.63 -0.09 -0.07 0.09 0.00 0.00 178.44 178.76 1i43 h LEU 147 N -0.07 0.00 0.11 1.67 3.38 -0.91 -1.70 115.31 117.80 1i43 h LEU 147 Ca 0.03 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.64 1i43 h LEU 147 Cb 0.52 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1i43 h LEU 147 CO 0.02 0.09 -1.95 0.00 0.09 0.00 0.00 178.44 176.69 1i43 n ALA 148 N -2.25 0.95 -0.01 1.53 0.00 -0.02 -4.59 120.51 116.13 1i43 n ALA 148 Ca -0.02 -0.60 -0.18 0.00 0.00 0.00 0.00 53.44 52.65 1i43 n ALA 148 Cb 0.22 -0.72 -0.14 0.00 0.00 0.00 0.00 19.45 18.81 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 -3.43 2.12 -4.64 0.00 4.77 -0.32 -4.85 117.00 110.65 1i43 n LEU 149 Ca -0.30 0.26 -0.41 0.00 -0.03 0.00 0.00 56.01 55.53 1i43 n LEU 149 Cb 1.05 -0.73 -0.05 0.00 -2.33 0.00 0.00 43.42 41.36 1i43 n LEU 149 CO 0.44 0.72 0.59 -0.69 -1.33 0.00 0.00 177.39 177.12 1i43 s VAL 150 N -2.57 4.87 0.74 4.08 1.01 -0.64 -5.04 120.40 122.85 1i43 s VAL 150 Ca -0.18 1.48 -0.11 0.00 0.00 0.00 0.00 61.98 63.18 1i43 s VAL 150 Cb 0.07 -4.08 0.03 0.00 0.00 0.00 0.00 36.38 32.40 1i43 s VAL 150 CO 0.78 -0.04 1.09 -2.84 0.00 0.00 0.00 175.10 174.09 1i43 s PRO 151 N 2.69 2.59 0.28 2.72 0.02 -1.26 -4.77 135.00 137.27 1i43 s PRO 151 Ca 0.33 0.59 -0.30 0.00 0.02 0.00 0.00 61.00 61.65 1i43 s PRO 151 Cb -0.15 -1.98 -0.10 0.00 0.02 0.00 0.00 34.50 32.28 1i43 s PRO 151 CO 0.08 -1.25 1.47 0.00 -0.33 0.00 0.00 177.00 176.97 1i43 s ALA 152 N -3.24 3.64 0.00 -1.55 0.00 -1.26 -1.67 121.76 117.67 1i43 s ALA 152 Ca 0.59 1.41 0.00 0.00 0.00 0.00 0.00 51.96 53.96 1i43 s ALA 152 Cb -0.13 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.42 1i43 s ALA 152 CO 0.53 -0.82 0.00 0.41 0.00 0.00 0.00 175.76 175.88 1i43 n GLY 153 N 1.87 2.63 3.64 0.00 0.00 0.95 -4.90 105.19 109.39 1i43 n GLY 153 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.99 1.56 0.06 -0.02 0.00 -0.67 -4.56 107.32 101.70 1i43 s GLY 154 Ca 0.00 -0.30 0.07 0.00 0.00 0.00 0.00 44.72 44.49 1i43 s GLY 154 CO 0.00 0.33 -0.14 -1.58 0.00 0.00 0.00 173.10 171.71 1i43 s HIS 155 N -2.86 2.67 0.12 1.90 5.65 -1.26 -1.11 115.29 120.40 1i43 s HIS 155 Ca 0.66 -0.19 0.05 0.00 0.25 0.00 0.00 55.06 55.83 1i43 s HIS 155 Cb -0.20 -1.46 -0.04 0.00 -1.18 0.00 0.00 32.58 29.70 1i43 s HIS 155 CO 0.59 0.35 -0.13 -1.50 -0.65 0.00 0.00 174.74 173.40 1i43 s ILE 156 N -1.06 1.27 -0.03 0.89 2.07 0.20 -1.17 121.20 123.37 1i43 s ILE 156 Ca 0.18 -1.76 0.02 0.00 -1.41 0.00 0.00 60.65 57.68 1i43 s ILE 156 Cb -0.11 -1.55 0.01 0.00 0.13 0.00 0.00 42.46 40.94 1i43 s ILE 156 CO 0.09 -0.48 -0.09 -0.69 -1.91 0.00 0.00 174.94 171.86 1i43 s VAL 157 N -2.34 0.82 0.36 4.00 1.01 -0.97 -0.14 120.40 123.14 1i43 s VAL 157 Ca 0.10 -0.36 -0.05 0.00 0.00 0.00 0.00 61.98 61.67 1i43 s VAL 157 Cb -0.04 -0.74 0.01 0.00 0.00 0.00 0.00 36.38 35.62 1i43 s VAL 157 CO 0.02 0.26 0.54 0.42 0.00 0.00 0.00 175.10 176.35 1i43 s THR 158 N 0.33 0.00 0.54 3.92 -4.23 -0.54 -0.80 115.64 114.86 1i43 s THR 158 Ca -0.06 -1.48 0.04 0.00 -1.18 0.00 0.00 61.69 59.02 1i43 s THR 158 Cb -0.10 -2.71 0.04 0.00 1.34 0.00 0.00 72.50 71.07 1i43 s THR 158 CO 0.01 0.00 0.74 0.42 -0.54 0.00 0.00 174.62 175.25 1i43 s THR 159 N -2.84 2.64 -0.43 3.99 -4.23 -1.26 -0.43 115.64 113.08 1i43 s THR 159 Ca 0.28 -0.80 0.23 0.00 -1.18 0.00 0.00 61.69 60.22 1i43 s THR 159 Cb -0.01 -2.84 0.29 0.00 1.34 0.00 0.00 72.50 71.28 1i43 s THR 159 CO 0.19 0.00 1.54 0.71 -0.54 0.00 0.00 174.62 176.52 1i43 h THR 160 N 0.18 0.00 -0.32 3.99 1.35 -1.01 -3.23 112.91 113.87 1i43 h THR 160 Ca -0.39 -0.97 0.00 0.00 -0.55 0.00 0.00 66.41 64.50 1i43 h THR 160 Cb 1.29 1.90 0.00 0.00 -1.73 0.00 0.00 68.15 69.60 1i43 h THR 160 CO 0.47 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 176.21 1i43 n ASP 161 N -2.99 2.09 -4.44 5.36 9.92 -1.26 -4.97 116.55 120.26 1i43 n ASP 161 Ca 0.04 -1.89 -0.43 0.00 -0.53 0.00 0.00 54.79 51.98 1i43 n ASP 161 Cb 0.53 -0.21 -0.00 0.00 -0.64 0.00 0.00 41.12 40.80 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 -0.68 2.44 -0.32 0.00 9.36 -1.26 -4.76 117.16 121.94 1i43 n TYR 163 Ca 0.12 -0.01 -0.08 0.00 3.32 0.00 0.00 57.90 61.25 1i43 n TYR 163 Cb 0.37 -2.67 -0.08 0.00 -0.63 0.00 0.00 39.34 36.34 1i43 n TYR 163 CO 0.00 0.00 0.00 -2.13 0.22 0.00 0.00 176.86 174.95 1i43 n ARG 164 N 5.46 -0.34 -0.21 2.98 0.63 -1.26 -0.33 116.66 123.59 1i43 n ARG 164 Ca 0.19 1.22 0.05 0.00 -0.92 0.00 0.00 57.85 58.39 1i43 n ARG 164 Cb 0.33 -1.80 0.31 0.00 0.45 0.00 0.00 32.46 31.75 1i43 n ARG 164 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 1i43 h LYS 165 N 0.00 0.83 -0.18 -0.14 6.56 -1.99 -0.06 116.57 121.59 1i43 h LYS 165 Ca 0.12 -0.05 -0.10 0.00 -1.06 0.00 0.00 60.65 59.56 1i43 h LYS 165 Cb 0.31 -0.19 -0.01 0.00 -0.57 0.00 0.00 32.23 31.77 1i43 h LYS 165 CO -0.72 0.55 -0.32 1.15 -2.06 0.00 0.00 179.45 178.05 1i43 h THR 166 N 0.85 1.28 -0.27 -0.16 2.02 -1.04 -2.33 112.91 113.26 1i43 h THR 166 Ca 0.31 -1.36 -0.03 0.00 0.77 0.00 0.00 66.41 66.11 1i43 h THR 166 Cb 0.16 1.50 -0.01 0.00 -1.74 0.00 0.00 68.15 68.06 1i43 h THR 166 CO -0.10 0.42 0.06 -0.09 0.37 0.00 0.00 175.52 176.18 1i43 h ARG 167 N 0.31 0.43 -0.60 6.66 9.65 0.83 -2.59 114.38 129.07 1i43 h ARG 167 Ca 0.04 -0.10 0.03 0.00 -1.10 0.00 0.00 59.98 58.85 1i43 h ARG 167 Cb 0.72 -0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 29.21 1i43 h ARG 167 CO 0.06 0.52 0.36 0.82 2.80 0.00 0.00 179.97 184.52 1i43 h ILE 168 N 0.26 1.05 -0.59 1.20 2.04 -0.97 -0.07 117.51 120.42 1i43 h ILE 168 Ca 0.08 -0.24 0.04 0.00 1.00 0.00 0.00 64.86 65.74 1i43 h ILE 168 Cb 0.29 0.29 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 1i43 h ILE 168 CO 0.00 0.13 0.34 0.15 0.00 0.00 0.00 178.15 178.77 1i43 h PHE 169 N 0.69 0.63 -0.07 1.37 3.57 -1.30 -0.19 116.94 121.65 1i43 h PHE 169 Ca 0.25 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.64 1i43 h PHE 169 Cb 0.05 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 1i43 h PHE 169 CO -0.06 0.34 -0.52 0.82 -2.23 0.00 0.00 178.31 176.65 1i43 h ILE 170 N 0.66 1.36 -0.00 1.41 2.04 -1.03 -1.01 117.51 120.95 1i43 h ILE 170 Ca 0.25 -1.79 0.00 0.00 1.00 0.00 0.00 64.86 64.32 1i43 h ILE 170 Cb 0.08 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 1i43 h ILE 170 CO -0.13 0.53 -0.61 -0.62 0.00 0.00 0.00 178.15 177.31 1i43 n GLU 171 N -3.93 0.05 0.00 2.37 1.02 -0.09 -4.24 120.64 115.82 1i43 n GLU 171 Ca -0.02 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 1i43 n GLU 171 Cb 0.55 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.47 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 -1.45 0.00 -0.09 2.62 -2.24 -0.12 -4.82 114.28 108.18 1i43 n THR 172 Ca 0.05 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.69 1i43 n THR 172 Cb 0.34 -0.08 -0.05 0.00 -2.10 0.00 0.00 70.33 68.44 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 -1.17 1.43 -0.35 2.28 2.08 -0.41 -4.62 119.36 118.60 1i43 n ILE 173 Ca 0.00 -0.01 0.14 0.00 0.56 0.00 0.00 62.75 63.44 1i43 n ILE 173 Cb 0.13 -2.11 0.34 0.00 -0.75 0.00 0.00 39.64 37.25 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 -0.88 0.76 -2.44 1.39 3.38 -1.66 0.32 115.31 116.18 1i43 h LEU 174 Ca -0.22 0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.87 1i43 h LEU 174 Cb 1.11 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.83 1i43 h LEU 174 CO -0.13 0.25 0.16 1.55 0.09 0.00 0.00 178.44 180.35 1i43 h PRO 175 N 0.72 0.00 0.00 1.13 0.13 -1.73 0.24 132.00 132.49 1i43 h PRO 175 Ca 0.59 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.66 1i43 h PRO 175 Cb 0.96 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.09 1i43 h PRO 175 CO -0.39 0.00 -0.25 0.87 -0.23 0.00 0.00 178.00 178.00 1i43 h LYS 176 N 0.00 0.00 -0.64 0.86 1.57 -1.18 -0.03 116.57 117.15 1i43 h LYS 176 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1i43 h LYS 176 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1i43 h LYS 176 CO -0.00 0.25 0.00 -1.33 -0.57 0.00 0.00 179.45 177.80 1i43 n MET 177 N -4.19 3.37 -1.05 3.15 0.00 0.82 -4.89 117.12 114.34 1i43 n MET 177 Ca -0.02 -2.24 -0.02 0.00 0.00 0.00 0.00 57.70 55.42 1i43 n MET 177 Cb 0.31 -1.86 -0.01 0.00 0.00 0.00 0.00 33.22 31.66 1i43 n MET 177 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1i43 n GLY 178 N 0.78 0.41 3.64 3.03 0.00 -0.02 -0.03 105.19 112.99 1i43 n GLY 178 Ca 0.20 -0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.65 4.61 0.26 -0.61 1.01 -1.02 -3.04 121.20 120.76 1i43 s ILE 179 Ca 0.00 1.78 0.03 0.00 0.00 0.00 0.00 60.65 62.46 1i43 s ILE 179 Cb 0.00 -4.34 -0.03 0.00 0.01 0.00 0.00 42.46 38.09 1i43 s ILE 179 CO 0.00 -0.34 0.41 0.28 0.00 0.00 0.00 174.94 175.29 1i43 s THR 180 N 3.40 5.21 0.04 2.92 -1.32 -0.27 -3.63 115.64 121.99 1i43 s THR 180 Ca 0.43 -0.72 0.00 0.00 -1.21 0.00 0.00 61.69 60.19 1i43 s THR 180 Cb -0.13 -3.83 -0.03 0.00 -1.51 0.00 0.00 72.50 66.99 1i43 s THR 180 CO 0.12 -0.36 -0.04 0.00 -2.21 0.00 0.00 174.62 172.13 1i43 s ALA 181 N -2.05 0.33 -0.20 11.08 0.00 -1.26 -0.63 121.76 129.03 1i43 s ALA 181 Ca 0.36 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.51 1i43 s ALA 181 Cb -0.10 0.17 0.03 0.00 0.00 0.00 0.00 23.12 23.22 1i43 s ALA 181 CO 0.31 -0.21 -0.17 0.99 0.00 0.00 0.00 175.76 176.69 1i43 s THR 182 N -2.24 2.19 -0.30 0.00 2.01 0.80 -4.92 115.64 113.17 1i43 s THR 182 Ca -0.07 -1.07 -0.12 0.00 0.31 0.00 0.00 61.69 60.74 1i43 s THR 182 Cb -0.04 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.42 1i43 s THR 182 CO -0.04 0.40 0.23 -0.69 -0.69 0.00 0.00 174.62 173.83 1i43 s VAL 183 N 1.26 5.29 0.47 3.82 1.01 -1.26 -1.46 120.40 129.53 1i43 s VAL 183 Ca 0.02 0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.10 1i43 s VAL 183 Cb -0.15 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 1i43 s VAL 183 CO -0.10 0.14 0.08 0.27 0.00 0.00 0.00 175.10 175.49 1i43 s ILE 184 N 1.78 1.61 0.21 2.22 -4.36 0.43 -4.87 121.20 118.22 1i43 s ILE 184 Ca 0.07 -1.89 -0.21 0.00 -0.26 0.00 0.00 60.65 58.36 1i43 s ILE 184 Cb -0.16 -2.50 -0.08 0.00 1.25 0.00 0.00 42.46 40.97 1i43 s ILE 184 CO 0.11 0.00 0.74 -0.62 0.24 0.00 0.00 174.94 175.41 1i43 s ASP 185 N -3.89 7.13 0.43 4.36 2.15 -1.26 -0.32 116.67 125.26 1i43 s ASP 185 Ca 0.22 1.47 0.22 0.00 0.43 0.00 0.00 52.55 54.89 1i43 s ASP 185 Cb 0.04 -2.44 1.19 0.00 -0.30 0.00 0.00 42.92 41.41 1i43 s ASP 185 CO 0.12 0.06 1.79 -0.65 -0.17 0.00 0.00 175.17 176.32 1i43 h PRO 186 N 3.59 0.30 0.05 4.34 0.11 -1.94 -2.44 132.00 136.02 1i43 h PRO 186 Ca -0.48 -0.02 -0.33 0.00 0.11 0.00 0.00 66.00 65.29 1i43 h PRO 186 Cb 1.20 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 1i43 h PRO 186 CO 0.65 0.20 -1.86 0.00 -0.21 0.00 0.00 178.00 176.78 1i43 n ALA 187 N -2.54 1.24 -1.48 -0.75 0.00 -1.26 -4.73 120.51 111.00 1i43 n ALA 187 Ca 0.24 -0.71 -0.12 0.00 0.00 0.00 0.00 53.44 52.85 1i43 n ALA 187 Cb 0.92 -0.75 -0.10 0.00 0.00 0.00 0.00 19.45 19.53 1i43 n ALA 187 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1i43 n ASP 188 N -3.22 0.75 0.16 0.00 -0.08 -0.92 -4.71 116.55 108.54 1i43 n ASP 188 Ca -0.24 -2.08 0.01 0.00 -1.51 0.00 0.00 54.79 50.97 1i43 n ASP 188 Cb 1.05 -1.50 0.27 0.00 2.34 0.00 0.00 41.12 43.28 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 6.92 1.30 -0.57 5.18 2.07 -1.87 -3.00 116.25 126.28 1i43 h VAL 189 Ca 0.00 -1.72 -0.03 0.00 0.82 0.00 0.00 66.70 65.77 1i43 h VAL 189 Cb 1.01 1.94 -0.03 0.00 -1.52 0.00 0.00 31.29 32.69 1i43 h VAL 189 CO 1.03 0.48 0.24 1.23 0.02 0.00 0.00 177.57 180.57 1i43 h GLY 190 N 1.59 0.91 0.72 2.17 0.00 -1.98 -1.04 103.07 105.44 1i43 h GLY 190 Ca -0.00 -0.48 0.06 0.00 0.00 0.00 0.00 47.33 46.90 1i43 h GLY 190 CO 0.06 0.46 0.50 0.00 0.00 0.00 0.00 176.54 177.56 1i43 h ALA 191 N 1.08 1.12 -0.31 3.60 0.00 -1.92 0.28 119.26 123.11 1i43 h ALA 191 Ca 0.19 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1i43 h ALA 191 Cb 0.18 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1i43 h ALA 191 CO -0.02 0.23 0.10 1.25 0.00 0.00 0.00 179.25 180.81 1i43 h LEU 192 N 0.91 0.45 -0.98 0.00 5.85 -1.41 0.20 115.31 120.33 1i43 h LEU 192 Ca 0.36 -0.20 -0.05 0.00 0.84 0.00 0.00 57.88 58.83 1i43 h LEU 192 Cb 0.17 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 1i43 h LEU 192 CO -0.17 0.53 0.16 -0.08 -0.34 0.00 0.00 178.44 178.54 1i43 h GLU 193 N 0.35 0.90 0.34 1.25 4.81 -0.44 0.85 114.58 122.64 1i43 h GLU 193 Ca 0.10 -0.18 -0.02 0.00 -0.13 0.00 0.00 59.36 59.13 1i43 h GLU 193 Cb 0.24 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.48 1i43 h GLU 193 CO -0.00 0.79 -0.17 1.25 -0.73 0.00 0.00 179.01 180.15 1i43 h LEU 194 N 0.87 -0.39 -0.89 1.64 5.85 -0.19 -2.78 115.31 119.41 1i43 h LEU 194 Ca 0.19 -0.14 0.08 0.00 0.84 0.00 0.00 57.88 58.86 1i43 h LEU 194 Cb 0.28 0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.34 1i43 h LEU 194 CO -0.00 -0.06 0.54 0.00 -0.34 0.00 0.00 178.44 178.58 1i43 h ALA 195 N -0.22 1.26 -0.73 1.25 0.00 -0.84 0.88 119.26 120.86 1i43 h ALA 195 Ca -0.05 0.01 0.17 0.00 0.00 0.00 0.00 54.91 55.04 1i43 h ALA 195 Cb 0.51 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1i43 h ALA 195 CO 0.08 0.23 0.50 -0.07 0.00 0.00 0.00 179.25 179.98 1i43 h LEU 196 N 0.94 0.24 0.09 0.00 -0.00 -0.69 -2.72 115.31 113.16 1i43 h LEU 196 Ca 0.41 0.02 -0.36 0.00 -0.00 0.00 0.00 57.88 57.95 1i43 h LEU 196 Cb 0.29 -0.03 -0.03 0.00 -0.00 0.00 0.00 40.66 40.89 1i43 h LEU 196 CO -0.22 0.12 -2.00 0.59 -0.00 0.00 0.00 178.44 176.93 1i43 n ASN 197 N -4.43 2.06 0.00 -0.43 3.02 -0.06 -4.54 115.26 110.89 1i43 n ASN 197 Ca 0.14 0.19 0.00 0.00 -0.03 0.00 0.00 54.58 54.88 1i43 n ASN 197 Cb 0.63 -0.81 0.00 0.00 -0.61 0.00 0.00 39.78 38.99 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 -3.60 0.00 -2.65 3.52 6.02 0.10 -4.80 117.38 115.97 1i43 n GLN 198 Ca -0.35 0.11 -0.24 0.00 -0.01 0.00 0.00 57.00 56.51 1i43 n GLN 198 Cb 0.98 -1.06 0.03 0.00 1.02 0.00 0.00 30.24 31.21 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 -1.26 2.87 -0.68 -1.09 3.01 -1.05 -5.02 119.74 116.52 1i43 s LYS 199 Ca 0.00 -0.32 -0.22 0.00 -1.01 0.00 0.00 55.97 54.42 1i43 s LYS 199 Cb 0.00 -2.41 0.08 0.00 -1.01 0.00 0.00 37.83 34.49 1i43 s LYS 199 CO 0.00 -0.57 0.96 0.21 0.51 0.00 0.00 175.35 176.45 1i43 s LYS 200 N -4.81 3.15 -0.01 1.68 2.20 -1.26 -4.53 119.74 116.16 1i43 s LYS 200 Ca 0.53 -0.97 -0.30 0.00 -0.36 0.00 0.00 55.97 54.87 1i43 s LYS 200 Cb -0.10 -4.30 -0.04 0.00 -1.51 0.00 0.00 37.83 31.87 1i43 s LYS 200 CO 0.41 -1.79 1.26 0.08 -0.36 0.00 0.00 175.35 174.95 1i43 s VAL 201 N 3.81 4.04 -0.10 4.02 1.01 -1.26 -4.07 120.40 127.84 1i43 s VAL 201 Ca 0.22 1.41 -0.19 0.00 0.00 0.00 0.00 61.98 63.42 1i43 s VAL 201 Cb -0.16 -3.90 -0.27 0.00 0.00 0.00 0.00 36.38 32.04 1i43 s VAL 201 CO 0.08 0.02 0.62 0.78 0.00 0.00 0.00 175.10 176.60 1i43 h ASN 202 N 7.41 0.33 -3.83 3.32 4.21 -1.50 -3.35 115.58 122.16 1i43 h ASN 202 Ca -0.37 -0.86 -0.04 0.00 1.21 0.00 0.00 56.30 56.24 1i43 h ASN 202 Cb 1.18 -0.11 -0.21 0.00 -1.12 0.00 0.00 38.32 38.06 1i43 h ASN 202 CO 0.87 1.50 0.07 -0.22 -1.29 0.00 0.00 177.43 178.36 1i43 s LEU 203 N -7.71 -0.64 -0.28 1.61 0.20 -1.25 -1.48 118.68 109.13 1i43 s LEU 203 Ca -0.19 1.39 -0.10 0.00 0.69 0.00 0.00 54.13 55.91 1i43 s LEU 203 Cb 0.03 2.33 -0.04 0.00 -0.43 0.00 0.00 46.19 48.08 1i43 s LEU 203 CO 0.76 -0.24 0.17 0.12 -0.29 0.00 0.00 176.35 176.87 1i43 s PHE 204 N 0.56 3.19 -0.04 5.38 5.36 0.53 -2.30 117.98 130.66 1i43 s PHE 204 Ca -0.02 -0.04 0.06 0.00 -0.96 0.00 0.00 56.93 55.97 1i43 s PHE 204 Cb -0.05 -2.36 -0.02 0.00 -0.34 0.00 0.00 43.02 40.25 1i43 s PHE 204 CO -0.02 -0.23 -0.21 0.12 -1.46 0.00 0.00 175.22 173.42 1i43 s PHE 205 N 1.72 2.52 -0.15 10.12 5.36 0.02 -0.98 117.98 136.58 1i43 s PHE 205 Ca 0.07 -0.38 -0.33 0.00 -0.96 0.00 0.00 56.93 55.33 1i43 s PHE 205 Cb -0.16 -1.58 0.13 0.00 -0.34 0.00 0.00 43.02 41.07 1i43 s PHE 205 CO 0.09 0.02 1.13 -0.08 -1.46 0.00 0.00 175.22 174.92 1i43 s THR 206 N -0.55 0.00 0.20 0.12 -1.32 -0.68 -4.06 115.64 109.35 1i43 s THR 206 Ca 0.08 0.00 0.06 0.00 -1.21 0.00 0.00 61.69 60.62 1i43 s THR 206 Cb -0.11 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.84 1i43 s THR 206 CO 0.01 0.00 0.14 -1.83 -2.21 0.00 0.00 174.62 170.73 1i43 s GLU 207 N -2.31 2.85 -0.30 7.08 -1.05 -1.26 -0.46 118.70 123.25 1i43 s GLU 207 Ca 0.07 -0.97 -0.07 0.00 -0.15 0.00 0.00 54.97 53.85 1i43 s GLU 207 Cb -0.01 -2.58 0.16 0.00 -0.44 0.00 0.00 34.13 31.27 1i43 s GLU 207 CO -0.05 0.45 0.71 0.45 0.95 0.00 0.00 175.26 177.76 1i43 s SER 208 N -3.39 -1.12 1.12 0.83 0.15 -1.00 -4.23 113.70 106.07 1i43 s SER 208 Ca 0.31 1.06 -0.12 0.00 0.70 0.00 0.00 55.95 57.90 1i43 s SER 208 Cb -0.09 2.08 0.26 0.00 -1.71 0.00 0.00 66.02 66.56 1i43 s SER 208 CO 0.23 -0.21 1.05 -2.84 1.20 0.00 0.00 173.24 172.67 1i43 s PRO 209 N 2.83 -0.60 0.33 5.44 0.02 -1.26 -4.49 135.00 137.28 1i43 s PRO 209 Ca 0.06 1.01 0.07 0.00 0.02 0.00 0.00 61.00 62.16 1i43 s PRO 209 Cb -0.12 -1.58 -0.01 0.00 0.02 0.00 0.00 34.50 32.81 1i43 s PRO 209 CO -0.19 -3.56 0.45 -0.08 -0.33 0.00 0.00 177.00 173.29 1i43 s THR 210 N -2.48 4.07 -0.11 0.99 -1.32 0.11 -4.70 115.64 112.21 1i43 s THR 210 Ca 0.68 -1.02 0.00 0.00 -1.21 0.00 0.00 61.69 60.14 1i43 s THR 210 Cb -0.25 -3.41 -0.02 0.00 -1.51 0.00 0.00 72.50 67.31 1i43 s THR 210 CO 0.63 -0.16 -0.10 0.21 -2.21 0.00 0.00 174.62 172.99 1i43 s ASN 211 N -4.16 4.29 0.00 8.08 2.47 -1.26 0.16 114.94 124.52 1i43 s ASN 211 Ca 0.44 -0.20 0.20 0.00 0.42 0.00 0.00 52.86 53.72 1i43 s ASN 211 Cb -0.09 -1.41 0.08 0.00 -1.45 0.00 0.00 41.25 38.38 1i43 s ASN 211 CO 0.31 0.24 1.08 -0.81 -3.72 0.00 0.00 177.10 174.19 1i43 n PRO 212 N 3.03 1.68 -0.10 0.43 -0.04 -1.26 -4.75 135.00 133.98 1i43 n PRO 212 Ca -0.18 -1.35 0.02 0.00 -0.04 0.00 0.00 63.50 61.95 1i43 n PRO 212 Cb 0.53 -1.40 0.07 0.00 -0.04 0.00 0.00 33.50 32.66 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 0.58 0.26 -4.29 0.54 3.72 -1.25 -4.59 117.46 112.43 1i43 n PHE 213 Ca 0.10 -0.11 -0.33 0.00 -0.05 0.00 0.00 57.45 57.06 1i43 n PHE 213 Cb 0.47 -0.05 -0.09 0.00 -0.94 0.00 0.00 39.48 38.88 1i43 n PHE 213 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1i43 n LEU 214 N -0.01 -0.88 -4.78 4.37 4.77 0.12 -4.79 117.00 115.80 1i43 n LEU 214 Ca 0.05 -1.21 -0.36 0.00 -0.03 0.00 0.00 56.01 54.46 1i43 n LEU 214 Cb 0.21 -1.52 -0.03 0.00 -2.33 0.00 0.00 43.42 39.74 1i43 n LEU 214 CO 0.04 0.33 0.74 -0.13 -1.33 0.00 0.00 177.39 177.05 1i43 s ARG 215 N -7.11 4.02 0.13 3.23 1.81 -1.25 -4.21 118.95 115.55 1i43 s ARG 215 Ca 0.26 1.51 0.10 0.00 -1.72 0.00 0.00 55.73 55.88 1i43 s ARG 215 Cb -0.15 -2.41 -0.04 0.00 -0.45 0.00 0.00 34.95 31.90 1i43 s ARG 215 CO 0.96 -0.27 -0.25 0.00 -0.68 0.00 0.00 175.30 175.06 1i43 s VAL 217 N -1.08 3.04 -0.94 0.00 1.01 -1.26 -4.76 120.40 116.42 1i43 s VAL 217 Ca 0.15 -0.69 -0.24 0.00 0.00 0.00 0.00 61.98 61.19 1i43 s VAL 217 Cb -0.10 -2.24 -0.07 0.00 0.00 0.00 0.00 36.38 33.97 1i43 s VAL 217 CO 0.07 0.55 2.01 -0.62 0.00 0.00 0.00 175.10 177.11 1i43 s ASP 218 N -0.08 4.91 0.20 3.32 -1.08 -1.26 -4.78 116.67 117.91 1i43 s ASP 218 Ca -0.02 -0.75 -0.12 0.00 -0.52 0.00 0.00 52.55 51.14 1i43 s ASP 218 Cb -0.14 -2.56 0.25 0.00 -1.46 0.00 0.00 42.92 39.01 1i43 s ASP 218 CO 0.04 -3.01 1.68 0.40 0.52 0.00 0.00 175.17 174.80 1i43 h ILE 219 N 7.13 0.58 0.01 4.11 2.04 -1.95 -0.60 117.51 128.83 1i43 h ILE 219 Ca 0.10 -0.05 0.03 0.00 1.00 0.00 0.00 64.86 65.94 1i43 h ILE 219 Cb 0.99 0.42 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 1i43 h ILE 219 CO 1.18 0.03 -0.26 -0.08 0.00 0.00 0.00 178.15 179.02 1i43 h GLU 220 N 0.15 -0.39 0.70 2.37 4.81 -1.86 -0.58 114.58 119.78 1i43 h GLU 220 Ca 0.29 0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.51 1i43 h GLU 220 Cb 0.45 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.92 1i43 h GLU 220 CO -0.44 -0.26 -0.37 1.25 -0.73 0.00 0.00 179.01 178.46 1i43 h LEU 221 N -0.40 -0.90 -0.92 1.64 5.85 -1.74 -2.70 115.31 116.13 1i43 h LEU 221 Ca 0.06 0.04 0.27 0.00 0.84 0.00 0.00 57.88 59.09 1i43 h LEU 221 Cb 0.48 0.25 -0.15 0.00 0.37 0.00 0.00 40.66 41.61 1i43 h LEU 221 CO -0.22 -0.60 0.31 0.58 -0.34 0.00 0.00 178.44 178.17 1i43 h VAL 222 N -0.98 0.26 -0.30 1.05 2.07 -1.06 0.17 116.25 117.46 1i43 h VAL 222 Ca -0.09 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 1i43 h VAL 222 Cb 0.76 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 1i43 h VAL 222 CO 0.13 0.04 0.18 0.28 0.02 0.00 0.00 177.57 178.22 1i43 h SER 223 N 0.20 0.36 0.11 0.57 0.02 -1.03 -2.19 113.55 111.60 1i43 h SER 223 Ca 0.62 -0.05 0.02 0.00 -0.84 0.00 0.00 61.79 61.53 1i43 h SER 223 Cb 1.32 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.73 1i43 h SER 223 CO -0.68 0.31 -0.26 0.50 -1.14 0.00 0.00 176.83 175.57 1i43 h LYS 224 N 0.39 -0.44 -0.29 3.45 3.64 -0.35 0.18 116.57 123.15 1i43 h LYS 224 Ca 0.11 0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.57 1i43 h LYS 224 Cb 0.01 0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.89 1i43 h LYS 224 CO -0.02 -0.29 0.02 -0.07 -2.27 0.00 0.00 179.45 176.82 1i43 h LEU 225 N -0.46 -0.07 0.83 5.20 3.38 -1.37 -1.51 115.31 121.31 1i43 h LEU 225 Ca 0.03 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1i43 h LEU 225 Cb 0.49 0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.34 1i43 h LEU 225 CO -0.15 -0.00 -0.41 0.00 0.09 0.00 0.00 178.44 177.96 1i43 h HIS 227 N -1.13 0.00 -0.26 0.00 3.86 -0.90 0.23 115.15 116.96 1i43 h HIS 227 Ca -0.11 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.03 1i43 h HIS 227 Cb 0.88 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.33 1i43 h HIS 227 CO -0.03 0.00 -0.13 1.49 0.86 0.00 0.00 177.93 180.12 1i43 h GLU 228 N 0.00 0.43 -0.60 2.45 4.81 -0.94 -2.61 114.58 118.13 1i43 h GLU 228 Ca 0.18 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1i43 h GLU 228 Cb 0.83 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.16 1i43 h GLU 228 CO -0.00 0.57 0.00 1.63 -0.73 0.00 0.00 179.01 180.48 1i43 n LYS 229 N -4.21 2.66 -0.80 1.92 4.76 0.71 -4.95 118.16 118.24 1i43 n LYS 229 Ca 0.00 -2.50 0.00 0.00 -2.87 0.00 0.00 58.31 52.95 1i43 n LYS 229 Cb 0.32 -1.52 0.00 0.00 -1.84 0.00 0.00 35.03 31.99 1i43 n LYS 229 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1i43 n GLY 230 N 1.49 0.73 3.85 0.72 0.00 -0.62 -4.89 105.19 106.47 1i43 n GLY 230 Ca 0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.69 3.07 0.09 4.61 0.00 -0.56 -4.92 121.76 121.36 1i43 s ALA 231 Ca 0.00 0.09 0.01 0.00 0.00 0.00 0.00 51.96 52.06 1i43 s ALA 231 Cb 0.00 -3.11 -0.04 0.00 0.00 0.00 0.00 23.12 19.97 1i43 s ALA 231 CO 0.00 -0.40 0.23 -0.51 0.00 0.00 0.00 175.76 175.08 1i43 s LEU 232 N -4.46 4.34 -0.11 0.00 1.43 -0.55 -3.72 118.68 115.61 1i43 s LEU 232 Ca 0.58 0.23 0.03 0.00 -1.03 0.00 0.00 54.13 53.93 1i43 s LEU 232 Cb -0.10 -2.93 0.01 0.00 0.03 0.00 0.00 46.19 43.19 1i43 s LEU 232 CO 0.39 0.13 -0.19 -0.69 0.23 0.00 0.00 176.35 176.22 1i43 s VAL 233 N -1.58 1.79 -0.15 -1.59 1.01 -1.26 0.20 120.40 118.82 1i43 s VAL 233 Ca 0.35 -0.83 -0.00 0.00 0.00 0.00 0.00 61.98 61.49 1i43 s VAL 233 Cb -0.12 -1.59 0.03 0.00 0.00 0.00 0.00 36.38 34.70 1i43 s VAL 233 CO 0.28 0.50 -0.08 0.00 0.00 0.00 0.00 175.10 175.80 1i43 s ILE 235 N 1.61 4.40 -0.67 0.00 -1.09 -0.67 -1.69 121.20 123.09 1i43 s ILE 235 Ca 0.03 -0.21 -0.13 0.00 -2.23 0.00 0.00 60.65 58.11 1i43 s ILE 235 Cb -0.14 -2.86 0.17 0.00 -1.58 0.00 0.00 42.46 38.05 1i43 s ILE 235 CO -0.08 0.60 0.60 -0.62 -1.23 0.00 0.00 174.94 174.20 1i43 s ASP 236 N -0.78 6.29 -0.24 3.58 2.15 0.39 -1.30 116.67 126.76 1i43 s ASP 236 Ca 0.12 -2.33 0.00 0.00 0.43 0.00 0.00 52.55 50.78 1i43 s ASP 236 Cb -0.12 -2.15 0.23 0.00 -0.30 0.00 0.00 42.92 40.59 1i43 s ASP 236 CO 0.02 -0.66 1.74 0.61 -0.17 0.00 0.00 175.17 176.72 1i43 n GLY 237 N 4.44 3.55 0.32 2.66 0.00 -0.82 -2.39 105.19 112.95 1i43 n GLY 237 Ca 0.02 -0.75 -0.15 0.00 0.00 0.00 0.00 46.02 45.14 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 0.74 0.39 -0.17 2.61 2.02 -1.87 0.97 112.91 117.61 1i43 h THR 238 Ca 0.26 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.40 1i43 h THR 238 Cb 1.31 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 1i43 h THR 238 CO 0.59 0.00 -0.10 -0.26 0.37 0.00 0.00 175.52 176.12 1i43 h PHE 239 N -0.64 0.27 0.31 3.16 0.04 -1.84 -3.28 116.94 114.97 1i43 h PHE 239 Ca -0.02 -0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.71 1i43 h PHE 239 Cb 0.57 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 38.65 1i43 h PHE 239 CO -0.16 0.36 -0.15 0.00 -0.60 0.00 0.00 178.31 177.76 1i43 h ALA 240 N 1.65 -0.43 0.00 2.45 0.00 -1.70 -3.41 119.26 117.83 1i43 h ALA 240 Ca 0.05 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1i43 h ALA 240 Cb 0.34 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1i43 h ALA 240 CO 0.02 -0.40 0.00 2.41 0.00 0.00 0.00 179.25 181.28 1i43 n THR 241 N -5.00 -0.17 0.23 0.00 -1.04 0.31 -3.99 114.28 104.61 1i43 n THR 241 Ca -0.05 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 61.98 1i43 n THR 241 Cb 0.17 0.00 0.12 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 0.86 0.09 -0.01 -2.82 -0.04 -1.26 -2.11 135.00 129.71 1i43 n PRO 242 Ca 0.00 0.17 -0.18 0.00 -0.04 0.00 0.00 63.50 63.45 1i43 n PRO 242 Cb 0.00 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 31.82 1i43 n PRO 242 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1i43 n LEU 243 N -1.20 2.14 0.01 1.53 4.77 -1.26 -4.21 117.00 118.79 1i43 n LEU 243 Ca 0.02 0.24 0.13 0.00 -0.03 0.00 0.00 56.01 56.38 1i43 n LEU 243 Cb 0.03 -0.74 0.50 0.00 -2.33 0.00 0.00 43.42 40.88 1i43 n LEU 243 CO 0.03 0.73 0.81 0.59 -1.33 0.00 0.00 177.39 178.22 1i43 n ASN 244 N -3.34 0.22 -3.59 -1.43 3.02 -0.90 -4.82 115.26 104.42 1i43 n ASN 244 Ca -0.29 0.32 -0.07 0.00 -0.03 0.00 0.00 54.58 54.50 1i43 n ASN 244 Cb 1.05 -0.32 -0.04 0.00 -0.61 0.00 0.00 39.78 39.85 1i43 n ASN 244 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i43 s GLN 245 N -3.02 0.45 -0.70 3.52 -2.07 -1.18 -1.70 119.66 114.96 1i43 s GLN 245 Ca 0.13 0.04 0.05 0.00 -1.82 0.00 0.00 55.36 53.76 1i43 s GLN 245 Cb 0.18 0.21 0.20 0.00 -1.09 0.00 0.00 33.01 32.51 1i43 s GLN 245 CO 0.58 -0.15 0.60 1.63 -1.32 0.00 0.00 175.29 176.63 1i43 n LYS 246 N 0.48 2.12 -0.35 9.60 4.76 -1.26 -4.38 118.16 129.14 1i43 n LYS 246 Ca -0.06 -4.55 0.30 0.00 -2.87 0.00 0.00 58.31 51.12 1i43 n LYS 246 Cb 0.59 -2.29 0.62 0.00 -1.84 0.00 0.00 35.03 32.10 1i43 n LYS 246 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1i43 h ALA 247 N 5.05 2.64 -0.43 7.82 0.00 -1.94 0.24 119.26 132.64 1i43 h ALA 247 Ca 0.17 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.00 1i43 h ALA 247 Cb 0.73 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1i43 h ALA 247 CO 0.77 -1.06 -0.16 -0.07 0.00 0.00 0.00 179.25 178.72 1i43 h LEU 248 N 0.21 0.81 -0.59 0.00 3.38 -1.85 -1.60 115.31 115.67 1i43 h LEU 248 Ca 0.63 -0.27 -0.13 0.00 0.09 0.00 0.00 57.88 58.20 1i43 h LEU 248 Cb 1.97 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 42.49 1i43 h LEU 248 CO -0.21 0.97 -0.61 0.00 0.09 0.00 0.00 178.44 178.67 1i43 h ALA 249 N 1.10 0.83 0.00 1.53 0.00 -0.84 -3.02 119.26 118.86 1i43 h ALA 249 Ca 0.11 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1i43 h ALA 249 Cb 0.67 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1i43 h ALA 249 CO 0.05 0.77 0.00 1.28 0.00 0.00 0.00 179.25 181.34 1i43 n LEU 250 N -3.58 0.00 0.00 0.00 4.77 -0.79 -4.88 117.00 112.51 1i43 n LEU 250 Ca -0.00 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 1i43 n LEU 250 Cb 0.66 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 1i43 n LEU 250 CO 0.41 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1i43 n GLY 251 N 0.85 1.66 3.74 -0.72 0.00 -1.14 -3.59 105.19 105.99 1i43 n GLY 251 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.81 2.56 -0.07 4.61 0.00 -0.62 -4.90 121.76 121.53 1i43 s ALA 252 Ca 0.00 1.17 -0.18 0.00 0.00 0.00 0.00 51.96 52.95 1i43 s ALA 252 Cb 0.00 -3.52 -0.30 0.00 0.00 0.00 0.00 23.12 19.31 1i43 s ALA 252 CO 0.00 -1.37 0.73 -0.44 0.00 0.00 0.00 175.76 174.68 1i43 h ASP 253 N 0.93 0.45 -4.65 0.00 3.32 -1.62 -3.41 116.42 111.45 1i43 h ASP 253 Ca -0.51 -0.90 -0.33 0.00 0.02 0.00 0.00 57.03 55.32 1i43 h ASP 253 Cb 1.31 -0.15 -0.21 0.00 0.22 0.00 0.00 39.33 40.50 1i43 h ASP 253 CO 0.55 1.54 -0.75 -0.76 -1.72 0.00 0.00 179.24 178.09 1i43 s LEU 254 N -7.69 2.27 -0.06 1.55 1.43 -0.91 -4.05 118.68 111.21 1i43 s LEU 254 Ca -0.16 -0.58 -0.01 0.00 -1.03 0.00 0.00 54.13 52.35 1i43 s LEU 254 Cb 0.03 -0.30 0.03 0.00 0.03 0.00 0.00 46.19 45.97 1i43 s LEU 254 CO 0.81 -0.16 -0.01 0.54 0.23 0.00 0.00 176.35 177.76 1i43 s VAL 255 N -1.37 0.42 0.17 -1.59 0.11 -0.51 -1.66 120.40 115.96 1i43 s VAL 255 Ca -0.06 0.05 0.10 0.00 -2.93 0.00 0.00 61.98 59.14 1i43 s VAL 255 Cb -0.10 -0.53 -0.04 0.00 -1.53 0.00 0.00 36.38 34.18 1i43 s VAL 255 CO 0.01 0.25 -0.20 -1.48 -3.33 0.00 0.00 175.10 170.35 1i43 s LEU 256 N 1.64 2.60 0.00 2.54 0.05 -0.42 -0.78 118.68 124.31 1i43 s LEU 256 Ca -0.00 -0.74 0.04 0.00 0.05 0.00 0.00 54.13 53.49 1i43 s LEU 256 Cb -0.13 -1.36 -0.02 0.00 -2.05 0.00 0.00 46.19 42.64 1i43 s LEU 256 CO -0.04 0.13 0.16 1.41 -0.55 0.00 0.00 176.35 177.46 1i43 n HIS 257 N 0.34 -0.19 -3.61 3.48 8.25 -0.13 -1.95 115.22 121.42 1i43 n HIS 257 Ca -0.13 -2.17 -0.28 0.00 -0.26 0.00 0.00 57.72 54.88 1i43 n HIS 257 Cb 0.55 0.09 -0.11 0.00 1.12 0.00 0.00 29.99 31.64 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 -2.96 2.96 0.53 0.41 0.15 -1.26 -2.46 113.70 111.07 1i43 s SER 258 Ca 0.23 -3.22 0.09 0.00 0.70 0.00 0.00 55.95 53.74 1i43 s SER 258 Cb 0.01 -0.92 0.47 0.00 -1.71 0.00 0.00 66.02 63.86 1i43 s SER 258 CO 0.16 -0.16 1.19 0.00 1.20 0.00 0.00 173.24 175.62 1i43 h ALA 259 N 5.78 1.61 -0.06 5.45 0.00 -1.76 0.59 119.26 130.86 1i43 h ALA 259 Ca 0.18 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1i43 h ALA 259 Cb 0.86 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 1i43 h ALA 259 CO 0.50 -0.61 0.07 1.15 0.00 0.00 0.00 179.25 180.36 1i43 h THR 260 N 0.00 0.51 0.00 0.00 2.02 -1.74 0.87 112.91 114.56 1i43 h THR 260 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1i43 h THR 260 Cb 1.37 0.94 0.00 0.00 -1.74 0.00 0.00 68.15 68.72 1i43 h THR 260 CO 0.00 0.00 0.00 0.29 0.37 0.00 0.00 175.52 176.18 1i43 n LYS 261 N -3.83 0.00 0.10 6.66 4.76 0.20 -4.61 118.16 121.44 1i43 n LYS 261 Ca -0.01 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.20 1i43 n LYS 261 Cb 0.17 0.00 -0.15 0.00 -1.84 0.00 0.00 35.03 33.21 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 0.77 -0.47 2.13 0.04 -1.75 -1.94 116.94 115.74 1i43 h PHE 262 Ca 0.00 -0.57 0.07 0.00 2.80 0.00 0.00 57.97 60.27 1i43 h PHE 262 Cb 0.00 -0.03 -0.06 0.00 2.20 0.00 0.00 35.95 38.06 1i43 h PHE 262 CO 0.00 1.51 0.13 -0.07 -0.60 0.00 0.00 178.31 179.29 1i43 h LEU 263 N -0.05 0.10 0.14 1.54 3.38 -1.83 -2.66 115.31 115.94 1i43 h LEU 263 Ca -0.25 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 1i43 h LEU 263 Cb 1.98 0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.80 1i43 h LEU 263 CO 0.21 0.09 -0.07 1.23 0.09 0.00 0.00 178.44 179.98 1i43 h GLY 264 N 0.29 -0.20 0.00 0.83 0.00 -0.97 -3.30 103.07 99.72 1i43 h GLY 264 Ca 0.23 0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.63 1i43 h GLY 264 CO -0.26 -0.07 0.00 0.61 0.00 0.00 0.00 176.54 176.82 1i43 n GLY 265 N 0.71 0.71 0.11 4.60 0.00 -0.73 -4.49 105.19 106.10 1i43 n GLY 265 Ca -0.07 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.00 0.05 -3.68 1.61 8.25 -1.26 -0.72 115.22 117.47 1i43 n HIS 266 Ca 0.00 -0.28 -0.22 0.00 -0.26 0.00 0.00 57.72 56.96 1i43 n HIS 266 Cb 0.00 -0.03 0.05 0.00 1.12 0.00 0.00 29.99 31.13 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 -0.11 -2.50 -0.21 0.41 3.02 -1.26 -4.83 115.26 109.77 1i43 n ASN 267 Ca 0.02 -0.75 0.00 0.00 -0.03 0.00 0.00 54.58 53.82 1i43 n ASN 267 Cb 0.18 -4.34 0.00 0.00 -0.61 0.00 0.00 39.78 35.02 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 -3.03 0.00 -3.59 6.41 5.75 -1.26 -5.11 116.55 115.72 1i43 n ASP 268 Ca -0.21 -1.40 -0.12 0.00 -0.01 0.00 0.00 54.79 53.06 1i43 n ASP 268 Cb 0.64 -0.08 -0.06 0.00 -1.03 0.00 0.00 41.12 40.59 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 0.08 2.12 0.11 -1.26 -5.10 120.40 116.35 1i43 s VAL 269 Ca 0.00 0.00 0.05 0.00 -2.93 0.00 0.00 61.98 59.10 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 -0.01 -0.76 -3.33 0.00 0.00 175.10 171.00 1i43 s LEU 270 N -0.53 3.43 -0.15 2.54 1.43 -1.26 -4.25 118.68 119.89 1i43 s LEU 270 Ca -0.01 -0.17 -0.30 0.00 -1.03 0.00 0.00 54.13 52.61 1i43 s LEU 270 Cb -0.02 -2.14 0.13 0.00 0.03 0.00 0.00 46.19 44.18 1i43 s LEU 270 CO 0.00 0.19 0.99 0.00 0.23 0.00 0.00 176.35 177.76 1i43 s ALA 271 N -1.27 -1.93 0.17 4.21 0.00 -1.19 -4.66 121.76 117.09 1i43 s ALA 271 Ca 0.25 1.55 0.05 0.00 0.00 0.00 0.00 51.96 53.81 1i43 s ALA 271 Cb -0.12 -0.62 -0.04 0.00 0.00 0.00 0.00 23.12 22.35 1i43 s ALA 271 CO 0.17 -0.34 0.13 0.20 0.00 0.00 0.00 175.76 175.92 1i43 s GLY 272 N -1.22 1.70 -0.06 0.00 0.00 -0.39 -2.27 107.32 105.08 1i43 s GLY 272 Ca -0.01 -1.23 -0.03 0.00 0.00 0.00 0.00 44.72 43.45 1i43 s GLY 272 CO 0.01 -1.24 0.14 0.00 0.00 0.00 0.00 173.10 172.00 1i43 s ILE 274 N 1.15 -0.28 0.04 0.00 1.01 -0.89 -0.96 121.20 121.27 1i43 s ILE 274 Ca -0.09 0.02 0.07 0.00 0.00 0.00 0.00 60.65 60.65 1i43 s ILE 274 Cb -0.11 -0.56 -0.03 0.00 0.01 0.00 0.00 42.46 41.77 1i43 s ILE 274 CO -0.06 -0.11 -0.19 -0.44 0.00 0.00 0.00 174.94 174.14 1i43 s SER 275 N 2.30 3.74 0.00 3.58 0.01 0.04 -0.84 113.70 122.53 1i43 s SER 275 Ca 0.05 -0.44 0.00 0.00 1.31 0.00 0.00 55.95 56.87 1i43 s SER 275 Cb -0.15 -0.58 0.00 0.00 0.21 0.00 0.00 66.02 65.51 1i43 s SER 275 CO -0.10 0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.42 1i43 n GLY 276 N 1.56 -1.07 3.77 3.44 0.00 -0.67 -1.42 105.19 110.80 1i43 n GLY 276 Ca -0.16 -0.90 -0.34 0.00 0.00 0.00 0.00 46.02 44.62 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 -0.72 2.83 0.08 1.61 0.04 -1.26 -1.95 135.00 135.63 1i43 s PRO 277 Ca 0.00 1.48 -0.31 0.00 0.04 0.00 0.00 61.00 62.21 1i43 s PRO 277 Cb 0.00 -1.95 -0.16 0.00 0.04 0.00 0.00 34.50 32.43 1i43 s PRO 277 CO 0.00 -1.24 1.63 1.25 0.04 0.00 0.00 177.00 178.68 1i43 h LEU 278 N 0.23 -0.77 -1.25 -3.56 6.46 -1.91 0.04 115.31 114.56 1i43 h LEU 278 Ca -0.48 0.04 0.40 0.00 -0.12 0.00 0.00 57.88 57.73 1i43 h LEU 278 Cb 1.26 0.23 -0.14 0.00 -0.73 0.00 0.00 40.66 41.27 1i43 h LEU 278 CO 0.54 -0.48 0.73 0.50 -0.62 0.00 0.00 178.44 179.11 1i43 h LYS 279 N -0.77 0.13 0.00 1.25 3.64 -2.00 0.71 116.57 119.53 1i43 h LYS 279 Ca -0.06 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1i43 h LYS 279 Cb 0.63 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1i43 h LYS 279 CO 0.06 0.08 -0.18 -0.07 -2.27 0.00 0.00 179.45 177.07 1i43 h LEU 280 N 0.13 0.00 -1.75 5.20 3.38 -1.83 -3.34 115.31 117.10 1i43 h LEU 280 Ca 0.80 0.00 0.23 0.00 0.09 0.00 0.00 57.88 59.00 1i43 h LEU 280 Cb 2.28 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.98 1i43 h LEU 280 CO -0.52 0.43 0.62 1.62 0.09 0.00 0.00 178.44 180.69 1i43 h VAL 281 N -0.68 0.61 -0.57 1.22 3.04 -0.71 0.06 116.25 119.21 1i43 h VAL 281 Ca 0.00 -0.07 -0.08 0.00 -1.01 0.00 0.00 66.70 65.54 1i43 h VAL 281 Cb 0.18 0.39 -0.02 0.00 -2.01 0.00 0.00 31.29 29.83 1i43 h VAL 281 CO 0.00 0.04 0.02 0.77 -1.01 0.00 0.00 177.57 177.39 1i43 h SER 282 N 0.20 0.93 -0.58 3.17 4.64 -1.05 -1.18 113.55 119.68 1i43 h SER 282 Ca 0.45 -0.24 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1i43 h SER 282 Cb 1.46 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 63.27 1i43 h SER 282 CO -0.10 0.98 0.37 -0.33 -0.87 0.00 0.00 176.83 176.88 1i43 h GLU 283 N 0.89 0.78 -0.05 4.77 4.39 -1.10 -1.85 114.58 122.42 1i43 h GLU 283 Ca 0.17 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.77 1i43 h GLU 283 Cb 0.49 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1i43 h GLU 283 CO 0.02 0.53 -0.13 0.82 -1.16 0.00 0.00 179.01 179.09 1i43 h ILE 284 N 0.80 1.45 -0.98 3.13 2.04 -1.38 -3.13 117.51 119.43 1i43 h ILE 284 Ca 0.21 -1.52 0.25 0.00 1.00 0.00 0.00 64.86 64.80 1i43 h ILE 284 Cb -0.07 2.34 -0.07 0.00 -0.74 0.00 0.00 36.82 38.28 1i43 h ILE 284 CO -0.04 0.42 0.66 -0.09 0.00 0.00 0.00 178.15 179.09 1i43 h ARG 285 N -0.37 0.30 0.09 2.37 2.43 -0.73 0.10 114.38 118.58 1i43 h ARG 285 Ca -0.00 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1i43 h ARG 285 Cb 0.74 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 1i43 h ARG 285 CO 0.03 0.20 -0.04 -0.91 -1.51 0.00 0.00 179.97 177.74 1i43 h ASN 286 N 0.31 -0.10 0.31 -3.80 4.21 -1.30 -0.24 115.58 114.97 1i43 h ASN 286 Ca 0.52 -0.25 -0.05 0.00 1.21 0.00 0.00 56.30 57.73 1i43 h ASN 286 Cb 1.47 0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 38.69 1i43 h ASN 286 CO -0.18 0.20 -0.24 0.25 -1.29 0.00 0.00 177.43 176.17 1i43 h LEU 287 N -0.41 0.00 -0.46 1.61 5.85 -1.22 -2.21 115.31 118.47 1i43 h LEU 287 Ca -0.01 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 1i43 h LEU 287 Cb 0.35 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1i43 h LEU 287 CO 0.02 0.24 0.19 -0.74 -0.34 0.00 0.00 178.44 177.80 1i43 h HIS 288 N 0.00 0.70 0.00 1.25 2.76 -0.48 0.31 115.15 119.69 1i43 h HIS 288 Ca -0.00 -0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.12 1i43 h HIS 288 Cb 0.45 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 29.20 1i43 h HIS 288 CO 0.00 0.59 0.00 0.72 -1.30 0.00 0.00 177.93 177.94 1i43 n HIS 289 N -4.60 0.71 -0.14 5.26 8.25 -0.13 -0.98 115.22 123.59 1i43 n HIS 289 Ca 0.01 0.36 -0.29 0.00 -0.26 0.00 0.00 57.72 57.54 1i43 n HIS 289 Cb 0.15 -1.08 -0.10 0.00 1.12 0.00 0.00 29.99 30.08 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 -2.22 1.52 0.30 1.59 5.41 -0.65 -4.40 119.36 120.92 1i43 n ILE 290 Ca -0.01 -0.37 0.17 0.00 1.00 0.00 0.00 62.75 63.55 1i43 n ILE 290 Cb 0.05 -1.90 0.92 0.00 -0.71 0.00 0.00 39.64 38.00 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 -1.00 0.00 -1.89 1.39 3.38 -0.76 -3.47 115.31 112.96 1i43 h LEU 291 Ca -0.68 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.02 1i43 h LEU 291 Cb 1.59 0.00 0.16 0.00 0.09 0.00 0.00 40.66 42.50 1i43 h LEU 291 CO -0.41 0.04 -0.70 0.61 0.09 0.00 0.00 178.44 178.08 1i43 n GLY 292 N -0.80 -0.42 2.36 0.83 0.00 -0.15 -4.94 105.19 102.08 1i43 n GLY 292 Ca -0.02 0.14 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.15 5.88 3.64 -0.02 0.00 -1.26 -5.02 105.19 107.25 1i43 n GLY 293 Ca -0.21 -2.34 -0.39 0.00 0.00 0.00 0.00 46.02 43.08 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 -0.88 0.44 -2.74 4.61 0.00 -1.26 -1.11 120.51 119.57 1i43 n ALA 294 Ca 0.62 0.09 -0.36 0.00 0.00 0.00 0.00 53.44 53.78 1i43 n ALA 294 Cb 0.64 -2.15 -0.07 0.00 0.00 0.00 0.00 19.45 17.88 1i43 n ALA 294 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1i43 s LEU 295 N -1.84 4.29 0.21 0.00 2.96 -1.26 -4.27 118.68 118.76 1i43 s LEU 295 Ca 0.71 0.45 -0.30 0.00 -0.22 0.00 0.00 54.13 54.77 1i43 s LEU 295 Cb -0.45 -2.23 -0.09 0.00 0.50 0.00 0.00 46.19 43.93 1i43 s LEU 295 CO 0.50 0.22 1.22 0.21 -1.32 0.00 0.00 176.35 177.19 1i43 s ASN 296 N -0.06 7.03 0.36 3.68 3.84 -1.26 -4.90 114.94 123.63 1i43 s ASN 296 Ca 0.14 2.31 0.12 0.00 0.21 0.00 0.00 52.86 55.64 1i43 s ASN 296 Cb -0.12 -2.61 0.90 0.00 -0.55 0.00 0.00 41.25 38.87 1i43 s ASN 296 CO 0.03 -0.40 1.82 -0.65 -2.79 0.00 0.00 177.10 175.10 1i43 h PRO 297 N 5.01 0.58 -0.77 0.43 0.11 -1.96 0.15 132.00 135.55 1i43 h PRO 297 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1i43 h PRO 297 Cb 1.21 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 32.16 1i43 h PRO 297 CO 0.74 0.38 0.49 -0.91 -0.21 0.00 0.00 178.00 178.49 1i43 h ASN 298 N 0.60 0.91 -0.16 -2.05 2.35 -1.92 -1.52 115.58 113.78 1i43 h ASN 298 Ca 0.52 -0.04 -0.20 0.00 -0.55 0.00 0.00 56.30 56.03 1i43 h ASN 298 Cb 1.02 -0.23 0.01 0.00 0.05 0.00 0.00 38.32 39.17 1i43 h ASN 298 CO -0.27 0.68 -0.69 0.00 -1.65 0.00 0.00 177.43 175.50 1i43 h ALA 299 N 1.48 0.30 -0.79 -0.83 0.00 -1.40 -2.80 119.26 115.22 1i43 h ALA 299 Ca 0.28 -0.57 0.07 0.00 0.00 0.00 0.00 54.91 54.70 1i43 h ALA 299 Cb -0.09 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 1i43 h ALA 299 CO -0.06 0.61 0.52 0.00 0.00 0.00 0.00 179.25 180.32 1i43 h ALA 300 N 0.55 1.67 -0.15 0.00 0.00 -0.56 -1.72 119.26 119.05 1i43 h ALA 300 Ca -0.04 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 1i43 h ALA 300 Cb 1.32 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.91 1i43 h ALA 300 CO 0.14 0.20 -0.53 -0.92 0.00 0.00 0.00 179.25 178.14 1i43 h TYR 301 N 0.82 0.82 -0.49 0.00 3.20 -1.29 -1.75 116.97 118.28 1i43 h TYR 301 Ca 0.35 -0.34 0.14 0.00 3.14 0.00 0.00 58.73 62.02 1i43 h TYR 301 Cb 0.29 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 1i43 h TYR 301 CO -0.00 1.13 0.36 -0.07 -1.64 0.00 0.00 178.16 177.94 1i43 h LEU 302 N 0.28 0.00 0.14 2.82 3.38 -1.06 0.19 115.31 121.05 1i43 h LEU 302 Ca -0.02 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.67 1i43 h LEU 302 Cb 1.16 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.91 1i43 h LEU 302 CO 0.11 0.00 -1.34 0.40 0.09 0.00 0.00 178.44 177.70 1i43 h ILE 303 N 0.00 1.13 -0.57 1.22 2.04 -1.28 -2.44 117.51 117.61 1i43 h ILE 303 Ca 0.23 -2.46 0.08 0.00 1.00 0.00 0.00 64.86 63.72 1i43 h ILE 303 Cb 0.95 2.84 -0.07 0.00 -0.74 0.00 0.00 36.82 39.81 1i43 h ILE 303 CO -0.00 0.73 0.22 0.40 0.00 0.00 0.00 178.15 179.49 1i43 h ILE 304 N -0.24 0.80 -0.36 -0.67 2.04 -0.32 0.69 117.51 119.44 1i43 h ILE 304 Ca -0.27 -0.14 -0.04 0.00 1.00 0.00 0.00 64.86 65.41 1i43 h ILE 304 Cb 1.80 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 38.23 1i43 h ILE 304 CO 0.11 0.07 0.06 -0.09 0.00 0.00 0.00 178.15 178.30 1i43 h ARG 305 N 0.40 0.59 -0.34 2.37 2.43 -0.79 -2.95 114.38 116.10 1i43 h ARG 305 Ca 0.28 -0.16 -0.04 0.00 -0.81 0.00 0.00 59.98 59.25 1i43 h ARG 305 Cb 0.33 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1i43 h ARG 305 CO -0.28 0.66 0.03 0.78 -1.51 0.00 0.00 179.97 179.65 1i43 h GLY 306 N 0.44 0.55 2.00 2.80 0.00 -0.87 -2.34 103.07 105.65 1i43 h GLY 306 Ca 0.11 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.13 1i43 h GLY 306 CO 0.01 0.29 0.00 -0.33 0.00 0.00 0.00 176.54 176.51 1i43 h MET 307 N 0.50 0.00 0.00 4.80 2.86 -0.71 -2.92 114.93 119.46 1i43 h MET 307 Ca 0.11 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1i43 h MET 307 Cb 0.28 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.94 1i43 h MET 307 CO 0.00 0.00 -0.02 0.87 1.06 0.00 0.00 176.91 178.83 1i43 h LYS 308 N 0.00 0.00 0.00 1.72 1.79 -1.33 -1.63 116.57 117.12 1i43 h LYS 308 Ca 0.00 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1i43 h LYS 308 Cb 0.44 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.09 1i43 h LYS 308 CO 0.00 0.02 -0.09 0.25 -1.08 0.00 0.00 179.45 178.55 1i43 n THR 309 N -3.26 1.93 0.04 -0.16 -2.24 -1.10 -4.76 114.28 104.72 1i43 n THR 309 Ca -0.02 -2.42 -0.03 0.00 -2.27 0.00 0.00 64.05 59.30 1i43 n THR 309 Cb 0.13 -0.24 -0.02 0.00 -2.10 0.00 0.00 70.33 68.11 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 0.17 -0.30 -1.01 3.22 5.85 -1.36 -0.77 115.31 121.11 1i43 h LEU 310 Ca -0.00 0.03 0.28 0.00 0.84 0.00 0.00 57.88 59.03 1i43 h LEU 310 Cb 1.00 0.10 -0.13 0.00 0.37 0.00 0.00 40.66 42.00 1i43 h LEU 310 CO 0.00 -0.12 0.59 1.12 -0.34 0.00 0.00 178.44 179.69 1i43 h HIS 311 N -0.17 0.97 -0.41 1.25 2.07 -1.89 0.19 115.15 117.16 1i43 h HIS 311 Ca -0.01 0.04 -0.08 0.00 -2.85 0.00 0.00 60.37 57.47 1i43 h HIS 311 Cb 0.16 -0.27 -0.01 0.00 2.57 0.00 0.00 27.41 29.86 1i43 h HIS 311 CO -0.21 -0.04 -0.05 -0.07 -3.07 0.00 0.00 177.93 174.48 1i43 h LEU 312 N 0.47 0.76 0.32 6.12 3.38 -1.86 -0.93 115.31 123.56 1i43 h LEU 312 Ca 0.68 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 58.30 1i43 h LEU 312 Cb 1.43 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1i43 h LEU 312 CO -0.53 0.92 -0.15 0.03 0.09 0.00 0.00 178.44 178.80 1i43 h ARG 313 N 0.59 -0.41 -0.61 1.13 3.08 0.68 -2.88 114.38 115.95 1i43 h ARG 313 Ca 0.11 0.03 0.12 0.00 0.07 0.00 0.00 59.98 60.31 1i43 h ARG 313 Cb 0.56 0.09 -0.10 0.00 0.08 0.00 0.00 29.97 30.61 1i43 h ARG 313 CO 0.03 -0.08 0.06 0.28 -1.07 0.00 0.00 179.97 179.19 1i43 h VAL 314 N -0.87 0.55 -0.26 2.04 2.07 -0.80 -0.60 116.25 118.37 1i43 h VAL 314 Ca -0.04 -0.06 0.06 0.00 0.82 0.00 0.00 66.70 67.48 1i43 h VAL 314 Cb 0.52 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 30.58 1i43 h VAL 314 CO 0.07 0.03 -0.27 1.56 0.02 0.00 0.00 177.57 178.98 1i43 h GLN 315 N 0.17 -0.26 -0.21 1.57 4.20 -1.18 0.17 115.11 119.57 1i43 h GLN 315 Ca 0.32 0.02 -0.01 0.00 0.06 0.00 0.00 58.65 59.04 1i43 h GLN 315 Cb 0.52 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 1i43 h GLN 315 CO -0.48 -0.18 0.09 0.37 -0.67 0.00 0.00 178.83 177.96 1i43 h GLN 316 N -0.27 0.32 -0.83 1.46 5.75 -1.08 -2.90 115.11 117.56 1i43 h GLN 316 Ca 0.14 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.58 1i43 h GLN 316 Cb 0.49 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.95 1i43 h GLN 316 CO -0.42 0.37 0.48 1.96 -2.65 0.00 0.00 178.83 178.57 1i43 h GLN 317 N 0.19 1.14 -0.96 1.69 4.20 -0.82 -1.61 115.11 118.93 1i43 h GLN 317 Ca 0.07 -0.11 0.11 0.00 0.06 0.00 0.00 58.65 58.78 1i43 h GLN 317 Cb 0.17 -0.23 -0.08 0.00 0.30 0.00 0.00 27.48 27.63 1i43 h GLN 317 CO -0.01 0.81 0.60 -0.91 -0.67 0.00 0.00 178.83 178.65 1i43 h ASN 318 N 1.14 0.88 0.29 1.46 2.35 -0.53 -0.62 115.58 120.55 1i43 h ASN 318 Ca 0.30 0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 56.08 1i43 h ASN 318 Cb -0.02 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.23 1i43 h ASN 318 CO -0.05 0.48 -0.14 0.28 -1.65 0.00 0.00 177.43 176.35 1i43 h SER 319 N 0.96 -0.32 -0.92 5.81 0.02 -1.25 -2.74 113.55 115.10 1i43 h SER 319 Ca 0.47 0.01 0.26 0.00 -0.84 0.00 0.00 61.79 61.69 1i43 h SER 319 Cb 0.44 0.08 -0.16 0.00 0.14 0.00 0.00 62.40 62.91 1i43 h SER 319 CO -0.26 0.06 0.17 0.74 -1.14 0.00 0.00 176.83 176.40 1i43 h THR 320 N -0.96 0.18 0.43 -2.27 2.02 -1.20 -0.22 112.91 110.88 1i43 h THR 320 Ca -0.04 -0.04 -0.02 0.00 0.77 0.00 0.00 66.41 67.08 1i43 h THR 320 Cb 0.29 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.77 1i43 h THR 320 CO 0.06 0.02 -0.20 0.00 0.37 0.00 0.00 175.52 175.77 1i43 h ALA 321 N 1.87 -0.57 0.51 6.16 0.00 -1.20 -1.05 119.26 124.98 1i43 h ALA 321 Ca 0.59 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.32 1i43 h ALA 321 Cb 1.23 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 19.22 1i43 h ALA 321 CO -0.77 -0.75 -0.51 1.25 0.00 0.00 0.00 179.25 178.48 1i43 h LEU 322 N -0.72 -1.40 -0.44 0.00 5.85 -0.80 0.21 115.31 118.01 1i43 h LEU 322 Ca -0.06 0.11 0.08 0.00 0.84 0.00 0.00 57.88 58.85 1i43 h LEU 322 Cb 0.51 0.46 -0.07 0.00 0.37 0.00 0.00 40.66 41.94 1i43 h LEU 322 CO 0.10 -0.68 0.03 0.03 -0.34 0.00 0.00 178.44 177.58 1i43 h ARG 323 N -1.02 0.15 -0.19 1.25 3.08 -1.19 -1.07 114.38 115.39 1i43 h ARG 323 Ca -0.07 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 59.94 1i43 h ARG 323 Cb 0.89 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 1i43 h ARG 323 CO -0.06 0.10 -0.05 0.52 -1.07 0.00 0.00 179.97 179.41 1i43 h MET 324 N 0.15 0.29 0.12 0.04 2.86 -0.98 -2.22 114.93 115.20 1i43 h MET 324 Ca 0.22 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.80 1i43 h MET 324 Cb 0.31 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.92 1i43 h MET 324 CO -0.34 0.36 -0.06 0.00 1.06 0.00 0.00 176.91 177.94 1i43 h ALA 325 N 1.67 -0.16 0.11 6.32 0.00 0.70 0.33 119.26 128.24 1i43 h ALA 325 Ca 0.06 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1i43 h ALA 325 Cb 0.28 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1i43 h ALA 325 CO 0.01 -0.52 -0.20 0.93 0.00 0.00 0.00 179.25 179.47 1i43 h GLU 326 N -0.30 -0.37 -0.77 0.00 5.08 -1.17 0.26 114.58 117.31 1i43 h GLU 326 Ca -0.02 0.03 0.14 0.00 -1.00 0.00 0.00 59.36 58.51 1i43 h GLU 326 Cb 0.24 0.08 -0.09 0.00 0.50 0.00 0.00 28.75 29.48 1i43 h GLU 326 CO 0.03 -0.25 0.33 0.82 -1.00 0.00 0.00 179.01 178.94 1i43 h ILE 327 N -0.39 0.67 -0.27 3.13 2.04 -1.33 -0.86 117.51 120.50 1i43 h ILE 327 Ca 0.03 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.69 1i43 h ILE 327 Cb 0.41 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 1i43 h ILE 327 CO -0.11 0.09 0.06 -0.07 0.00 0.00 0.00 178.15 178.11 1i43 h LEU 328 N 0.48 0.42 -0.81 1.44 3.38 -0.07 -2.44 115.31 117.72 1i43 h LEU 328 Ca 0.42 -0.25 0.08 0.00 0.09 0.00 0.00 57.88 58.23 1i43 h LEU 328 Cb 0.64 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 41.21 1i43 h LEU 328 CO -0.40 0.56 0.47 -0.08 0.09 0.00 0.00 178.44 179.08 1i43 h GLU 329 N 0.27 0.78 0.00 1.13 4.81 0.75 -0.98 114.58 121.33 1i43 h GLU 329 Ca 0.08 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1i43 h GLU 329 Cb 0.31 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.51 1i43 h GLU 329 CO 0.00 0.52 0.00 0.00 -0.73 0.00 0.00 179.01 178.80 1i43 n ALA 330 N -2.37 2.15 -1.99 2.92 0.00 -0.45 -4.82 120.51 115.94 1i43 n ALA 330 Ca 0.13 -0.08 -0.41 0.00 0.00 0.00 0.00 53.44 53.08 1i43 n ALA 330 Cb 0.24 -1.41 -0.03 0.00 0.00 0.00 0.00 19.45 18.25 1i43 n ALA 330 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1i43 s HIS 331 N -3.02 3.38 0.34 0.00 5.04 -0.37 -4.93 115.29 115.73 1i43 s HIS 331 Ca 0.12 1.42 0.27 0.00 -1.54 0.00 0.00 55.06 55.32 1i43 s HIS 331 Cb 0.16 -3.46 1.32 0.00 0.04 0.00 0.00 32.58 30.64 1i43 s HIS 331 CO 0.47 -1.30 2.01 -1.00 -2.34 0.00 0.00 174.74 172.57 1i43 h PRO 332 N 4.98 0.00 -0.00 2.88 0.13 -1.88 -2.80 132.00 135.31 1i43 h PRO 332 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1i43 h PRO 332 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1i43 h PRO 332 CO 0.74 0.15 -0.39 1.63 -0.23 0.00 0.00 178.00 179.89 1i43 n LYS 333 N -3.55 0.30 -3.50 0.86 5.02 -1.26 -4.76 118.16 111.27 1i43 n LYS 333 Ca -0.01 -0.17 -0.41 0.00 -2.02 0.00 0.00 58.31 55.70 1i43 n LYS 333 Cb 0.29 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.70 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 -2.82 5.27 0.03 -0.18 1.01 -1.06 -0.02 120.40 122.64 1i43 s VAL 334 Ca 0.16 -0.31 -0.21 0.00 0.00 0.00 0.00 61.98 61.61 1i43 s VAL 334 Cb 0.18 -3.78 -0.15 0.00 0.00 0.00 0.00 36.38 32.63 1i43 s VAL 334 CO 0.63 -0.10 1.37 -0.09 0.00 0.00 0.00 175.10 176.91 1i43 h ARG 335 N 8.53 0.27 -3.43 2.72 2.43 -0.85 -3.45 114.38 120.60 1i43 h ARG 335 Ca -0.30 -0.13 -0.12 0.00 -0.81 0.00 0.00 59.98 58.62 1i43 h ARG 335 Cb 1.15 -0.00 -0.19 0.00 -0.42 0.00 0.00 29.97 30.50 1i43 h ARG 335 CO 0.66 0.63 -0.40 -1.58 -1.51 0.00 0.00 179.97 177.77 1i43 s HIS 336 N -4.47 -0.00 -0.05 2.20 5.04 -1.14 -4.97 115.29 111.90 1i43 s HIS 336 Ca -0.14 -0.11 0.01 0.00 -1.54 0.00 0.00 55.06 53.28 1i43 s HIS 336 Cb 0.05 -0.01 0.02 0.00 0.04 0.00 0.00 32.58 32.68 1i43 s HIS 336 CO 0.73 -0.37 -0.05 0.08 -2.34 0.00 0.00 174.74 172.79 1i43 s VAL 337 N -1.86 0.55 -0.25 0.89 1.01 -1.26 -0.16 120.40 119.32 1i43 s VAL 337 Ca -0.11 -0.13 -0.07 0.00 0.00 0.00 0.00 61.98 61.68 1i43 s VAL 337 Cb -0.04 -0.58 -0.02 0.00 0.00 0.00 0.00 36.38 35.74 1i43 s VAL 337 CO -0.00 0.23 0.06 -0.31 0.00 0.00 0.00 175.10 175.08 1i43 s TYR 338 N 0.96 3.08 -0.29 5.22 1.51 0.18 -4.88 117.35 123.12 1i43 s TYR 338 Ca -0.10 -0.57 -0.15 0.00 -1.01 0.00 0.00 57.07 55.24 1i43 s TYR 338 Cb -0.14 -2.23 0.15 0.00 -0.11 0.00 0.00 41.96 39.63 1i43 s TYR 338 CO -0.00 -0.42 0.95 -0.47 -1.11 0.00 0.00 175.55 174.50 1i43 s TYR 339 N 1.58 -0.69 0.55 2.71 5.04 -1.26 -2.87 117.35 122.41 1i43 s TYR 339 Ca 0.06 1.28 0.24 0.00 -2.44 0.00 0.00 57.07 56.21 1i43 s TYR 339 Cb -0.15 0.41 1.46 0.00 0.35 0.00 0.00 41.96 44.03 1i43 s TYR 339 CO 0.03 -0.34 2.06 -1.35 -1.34 0.00 0.00 175.55 174.61 1i43 h PRO 340 N 6.81 0.00 0.00 4.97 0.11 -1.86 -1.23 132.00 140.81 1i43 h PRO 340 Ca -0.22 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.86 1i43 h PRO 340 Cb 1.16 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1i43 h PRO 340 CO 0.14 0.00 -0.10 0.78 -0.21 0.00 0.00 178.00 178.61 1i43 h GLY 341 N 0.00 0.00 -1.77 -0.55 0.00 -1.94 -3.42 103.07 95.39 1i43 h GLY 341 Ca 0.14 0.00 -0.47 0.00 0.00 0.00 0.00 47.33 47.00 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 -6.56 3.64 0.41 3.11 1.43 -0.46 -4.96 118.68 115.28 1i43 s LEU 342 Ca -0.00 1.61 0.26 0.00 -1.03 0.00 0.00 54.13 54.96 1i43 s LEU 342 Cb 0.10 -4.51 0.66 0.00 0.03 0.00 0.00 46.19 42.46 1i43 s LEU 342 CO 0.57 -0.63 1.72 1.56 0.23 0.00 0.00 176.35 179.80 1i43 h GLN 343 N 0.95 0.00 -0.00 1.70 4.20 -1.86 -3.11 115.11 116.99 1i43 h GLN 343 Ca -0.47 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.24 1i43 h GLN 343 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1i43 h GLN 343 CO 0.61 0.00 -0.01 -1.13 -0.67 0.00 0.00 178.83 177.63 1i43 n SER 344 N -2.89 0.03 -4.71 1.46 3.41 -1.26 -4.84 113.62 104.81 1i43 n SER 344 Ca 0.04 -0.34 -0.42 0.00 -0.26 0.00 0.00 58.87 57.88 1i43 n SER 344 Cb 0.45 -0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 64.16 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 -2.45 3.61 0.30 7.33 5.04 -1.18 -4.95 115.29 122.99 1i43 s HIS 345 Ca 0.33 1.60 -0.00 0.00 -1.54 0.00 0.00 55.06 55.45 1i43 s HIS 345 Cb 0.21 -3.20 0.69 0.00 0.04 0.00 0.00 32.58 30.31 1i43 s HIS 345 CO 0.44 -0.34 1.58 -1.35 -2.34 0.00 0.00 174.74 172.74 1i43 h PRO 346 N 6.63 0.03 -0.54 2.88 0.11 -1.92 -0.94 132.00 138.26 1i43 h PRO 346 Ca -0.41 -0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.35 1i43 h PRO 346 Cb 1.22 -0.01 -0.22 0.00 0.11 0.00 0.00 31.00 32.10 1i43 h PRO 346 CO 0.76 0.02 -0.16 -0.85 -0.21 0.00 0.00 178.00 177.56 1i43 n GLU 347 N -5.46 2.41 -0.28 1.05 0.00 -1.26 -4.70 120.64 112.40 1i43 n GLU 347 Ca 0.21 -3.47 0.06 0.00 0.00 0.00 0.00 57.16 53.96 1i43 n GLU 347 Cb 0.70 -2.00 0.29 0.00 0.00 0.00 0.00 31.44 30.42 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 1.45 0.96 -0.48 -1.84 2.76 -1.41 0.49 115.15 117.08 1i43 h HIS 348 Ca 0.31 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.47 1i43 h HIS 348 Cb 1.50 -0.31 -0.02 0.00 1.55 0.00 0.00 27.41 30.12 1i43 h HIS 348 CO 1.05 0.47 0.14 1.12 -1.30 0.00 0.00 177.93 179.40 1i43 h HIS 349 N 0.91 0.73 -0.02 5.26 2.07 -1.84 0.64 115.15 122.90 1i43 h HIS 349 Ca 0.40 -0.05 -0.03 0.00 -2.85 0.00 0.00 60.37 57.83 1i43 h HIS 349 Cb 0.34 -0.22 0.00 0.00 2.57 0.00 0.00 27.41 30.10 1i43 h HIS 349 CO -0.00 0.61 -0.12 0.82 -3.07 0.00 0.00 177.93 176.16 1i43 h ILE 350 N 0.70 1.50 -0.65 6.12 2.04 -1.52 -2.67 117.51 123.04 1i43 h ILE 350 Ca 0.16 -1.66 0.09 0.00 1.00 0.00 0.00 64.86 64.45 1i43 h ILE 350 Cb 0.23 2.54 -0.07 0.00 -0.74 0.00 0.00 36.82 38.78 1i43 h ILE 350 CO -0.01 0.45 0.29 0.00 0.00 0.00 0.00 178.15 178.88 1i43 h ALA 351 N 0.35 0.87 0.00 1.87 0.00 -0.75 0.47 119.26 122.07 1i43 h ALA 351 Ca -0.01 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1i43 h ALA 351 Cb 0.80 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1i43 h ALA 351 CO 0.03 -0.12 -0.13 -0.22 0.00 0.00 0.00 179.25 178.81 1i43 h LYS 352 N 0.51 0.00 0.01 0.00 3.64 -0.90 0.11 116.57 119.94 1i43 h LYS 352 Ca 0.32 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.42 1i43 h LYS 352 Cb 0.36 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.13 1i43 h LYS 352 CO -0.28 0.13 -1.61 -0.22 -2.27 0.00 0.00 179.45 175.20 1i43 h LYS 353 N 0.00 0.03 -0.09 1.90 3.64 -0.63 -3.39 116.57 118.03 1i43 h LYS 353 Ca -0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1i43 h LYS 353 Cb 0.42 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 1i43 h LYS 353 CO 0.02 0.64 0.00 0.00 -2.27 0.00 0.00 179.45 177.84 1i43 n GLN 354 N -3.14 1.13 -4.30 1.90 10.64 -0.10 -5.03 117.38 118.49 1i43 n GLN 354 Ca -0.15 -1.29 -0.19 0.00 -1.83 0.00 0.00 57.00 53.54 1i43 n GLN 354 Cb 1.03 -1.15 -0.11 0.00 -0.86 0.00 0.00 30.24 29.15 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 -0.76 1.18 -0.01 2.61 -1.94 0.36 -4.65 119.30 116.10 1i43 s MET 355 Ca 0.11 -1.41 0.08 0.00 -1.71 0.00 0.00 55.69 52.76 1i43 s MET 355 Cb 0.07 -1.04 -0.12 0.00 2.01 0.00 0.00 34.83 35.75 1i43 s MET 355 CO 0.10 0.19 0.24 0.25 -0.01 0.00 0.00 175.02 175.79 1i43 n THR 356 N 0.11 0.00 -4.12 2.05 -2.24 -0.69 -4.73 114.28 104.67 1i43 n THR 356 Ca -0.12 -0.23 -0.11 0.00 -2.27 0.00 0.00 64.05 61.32 1i43 n THR 356 Cb 0.58 0.56 -0.08 0.00 -2.10 0.00 0.00 70.33 69.29 1i43 n THR 356 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1i43 s GLY 357 N -2.54 1.06 -0.15 3.38 0.00 -1.26 -5.05 107.32 102.76 1i43 s GLY 357 Ca -0.01 -1.38 0.15 0.00 0.00 0.00 0.00 44.72 43.48 1i43 s GLY 357 CO 0.34 -1.14 1.20 0.69 0.00 0.00 0.00 173.10 174.20 1i43 n PHE 358 N -0.27 0.00 -0.84 1.90 3.72 -1.26 -4.91 117.46 115.79 1i43 n PHE 358 Ca -0.01 -1.22 0.11 0.00 -0.05 0.00 0.00 57.45 56.29 1i43 n PHE 358 Cb 0.64 -0.22 -0.04 0.00 -0.94 0.00 0.00 39.48 38.93 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 -0.74 -2.27 0.96 1.37 0.00 -1.26 -4.62 105.19 98.62 1i43 n GLY 359 Ca 0.16 -1.27 0.08 0.00 0.00 0.00 0.00 46.02 44.99 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 -3.48 2.52 3.76 -0.02 0.00 -1.26 -4.36 105.19 102.35 1i43 n GLY 360 Ca -0.02 -0.57 -0.37 0.00 0.00 0.00 0.00 46.02 45.07 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 -1.02 3.61 -0.04 4.61 0.00 -1.26 -1.98 121.76 125.67 1i43 s ALA 361 Ca 0.34 -0.38 -0.01 0.00 0.00 0.00 0.00 51.96 51.92 1i43 s ALA 361 Cb 0.18 -2.40 0.03 0.00 0.00 0.00 0.00 23.12 20.93 1i43 s ALA 361 CO 0.24 0.19 0.02 0.08 0.00 0.00 0.00 175.76 176.29 1i43 s VAL 362 N 0.09 0.13 -0.04 0.00 1.01 0.30 -4.93 120.40 116.96 1i43 s VAL 362 Ca 0.19 0.21 0.02 0.00 0.00 0.00 0.00 61.98 62.40 1i43 s VAL 362 Cb -0.14 -0.29 -0.03 0.00 0.00 0.00 0.00 36.38 35.92 1i43 s VAL 362 CO 0.07 0.18 -0.07 -0.44 0.00 0.00 0.00 175.10 174.84 1i43 s SER 363 N 1.62 4.62 0.08 3.32 0.01 -1.14 0.86 113.70 123.06 1i43 s SER 363 Ca -0.01 -0.08 -0.19 0.00 1.31 0.00 0.00 55.95 56.98 1i43 s SER 363 Cb -0.13 -1.12 0.04 0.00 0.21 0.00 0.00 66.02 65.02 1i43 s SER 363 CO -0.03 0.33 0.44 0.72 0.41 0.00 0.00 173.24 175.11 1i43 s PHE 364 N -0.88 -0.29 -0.20 2.43 -0.71 0.16 0.49 117.98 118.98 1i43 s PHE 364 Ca 0.14 0.17 -0.07 0.00 -1.04 0.00 0.00 56.93 56.14 1i43 s PHE 364 Cb -0.11 0.27 -0.03 0.00 -1.21 0.00 0.00 43.02 41.94 1i43 s PHE 364 CO 0.04 -0.64 0.04 -1.21 -1.34 0.00 0.00 175.22 172.11 1i43 s GLU 365 N -2.96 3.81 0.45 1.99 2.02 0.77 -0.61 118.70 124.17 1i43 s GLU 365 Ca -0.02 -0.43 -0.14 0.00 0.02 0.00 0.00 54.97 54.40 1i43 s GLU 365 Cb 0.00 -3.18 -0.07 0.00 0.10 0.00 0.00 34.13 30.97 1i43 s GLU 365 CO -0.06 0.12 0.87 0.08 0.02 0.00 0.00 175.26 176.29 1i43 s VAL 366 N 0.76 4.65 -1.36 2.63 1.01 -1.13 -0.22 120.40 126.74 1i43 s VAL 366 Ca 0.02 0.94 -0.14 0.00 0.00 0.00 0.00 61.98 62.81 1i43 s VAL 366 Cb -0.14 -3.71 0.08 0.00 0.00 0.00 0.00 36.38 32.62 1i43 s VAL 366 CO 0.02 -0.56 1.96 -0.67 0.00 0.00 0.00 175.10 175.85 1i43 n ASP 367 N -1.33 4.50 0.00 3.32 2.03 0.97 -4.57 116.55 121.48 1i43 n ASP 367 Ca 0.05 -2.93 0.00 0.00 0.52 0.00 0.00 54.79 52.43 1i43 n ASP 367 Cb 0.54 -1.64 0.00 0.00 -0.72 0.00 0.00 41.12 39.30 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 4.17 2.47 2.81 0.27 0.00 -1.26 -5.02 105.19 108.64 1i43 n GLY 368 Ca 0.47 -0.38 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 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 1.84 -0.29 1.61 5.75 -1.26 -4.83 116.55 119.37 1i43 n ASP 369 Ca 0.00 -2.79 0.09 0.00 -0.01 0.00 0.00 54.79 52.09 1i43 n ASP 369 Cb 0.00 0.66 0.22 0.00 -1.03 0.00 0.00 41.12 40.97 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 -0.26 -0.13 -2.12 7.12 -1.99 0.34 115.31 118.27 1i43 h LEU 370 Ca -0.29 0.21 -0.08 0.00 0.13 0.00 0.00 57.88 57.85 1i43 h LEU 370 Cb 1.01 0.34 0.00 0.00 -0.53 0.00 0.00 40.66 41.48 1i43 h LEU 370 CO 0.46 -0.20 -0.24 -0.07 -0.13 0.00 0.00 178.44 178.26 1i43 h LEU 371 N 0.12 0.43 -0.31 2.25 -0.00 -1.96 -2.75 115.31 113.10 1i43 h LEU 371 Ca 0.49 -0.55 -0.03 0.00 -0.00 0.00 0.00 57.88 57.79 1i43 h LEU 371 Cb 0.94 -0.12 -0.01 0.00 -0.00 0.00 0.00 40.66 41.46 1i43 h LEU 371 CO -0.71 0.91 0.07 0.74 -0.00 0.00 0.00 178.44 179.44 1i43 h THR 372 N -0.02 1.22 -0.46 0.22 2.02 -1.67 -2.15 112.91 112.08 1i43 h THR 372 Ca 0.01 -0.76 0.07 0.00 0.77 0.00 0.00 66.41 66.50 1i43 h THR 372 Cb 0.83 1.13 -0.06 0.00 -1.74 0.00 0.00 68.15 68.32 1i43 h THR 372 CO 0.05 0.25 0.14 0.74 0.37 0.00 0.00 175.52 177.07 1i43 h THR 373 N 0.33 0.81 -0.65 3.16 2.02 -0.45 -1.02 112.91 117.11 1i43 h THR 373 Ca 0.10 -0.10 0.06 0.00 0.77 0.00 0.00 66.41 67.23 1i43 h THR 373 Cb 0.31 0.49 -0.05 0.00 -1.74 0.00 0.00 68.15 67.16 1i43 h THR 373 CO 0.00 0.05 0.35 0.00 0.37 0.00 0.00 175.52 176.30 1i43 h ALA 374 N 1.33 0.87 -0.64 6.16 0.00 -1.33 -0.37 119.26 125.27 1i43 h ALA 374 Ca 0.22 0.02 0.15 0.00 0.00 0.00 0.00 54.91 55.30 1i43 h ALA 374 Cb 0.25 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1i43 h ALA 374 CO -0.25 0.02 0.44 -0.22 0.00 0.00 0.00 179.25 179.24 1i43 h LYS 375 N 0.66 0.21 0.15 0.00 3.64 -0.52 0.25 116.57 120.95 1i43 h LYS 375 Ca 0.29 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.65 1i43 h LYS 375 Cb 0.19 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1i43 h LYS 375 CO -0.19 0.14 -0.07 0.35 -2.27 0.00 0.00 179.45 177.41 1i43 h PHE 376 N 0.22 -0.18 0.00 1.91 3.57 -0.51 -2.79 116.94 119.15 1i43 h PHE 376 Ca 0.31 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.78 1i43 h PHE 376 Cb 0.91 0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.71 1i43 h PHE 376 CO -0.00 0.25 -0.11 -0.39 -2.23 0.00 0.00 178.31 175.83 1i43 h VAL 377 N -0.73 1.02 0.00 1.41 -1.51 -0.87 -0.59 116.25 114.98 1i43 h VAL 377 Ca -0.02 -0.39 0.00 0.00 -1.23 0.00 0.00 66.70 65.06 1i43 h VAL 377 Cb 0.52 1.21 0.00 0.00 -2.13 0.00 0.00 31.29 30.89 1i43 h VAL 377 CO 0.03 0.11 0.00 0.44 -1.23 0.00 0.00 177.57 176.92 1i43 h ASP 378 N 0.00 0.00 1.00 4.19 5.19 -0.51 -2.98 116.42 123.31 1i43 h ASP 378 Ca -0.00 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.30 1i43 h ASP 378 Cb 0.20 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.69 1i43 h ASP 378 CO 0.01 0.00 -1.06 0.00 -3.12 0.00 0.00 179.24 175.07 1i43 h ALA 379 N 2.25 0.64 -3.02 3.45 0.00 -0.82 -3.47 119.26 118.28 1i43 h ALA 379 Ca 0.00 -0.53 -0.55 0.00 0.00 0.00 0.00 54.91 53.82 1i43 h ALA 379 Cb 0.53 0.13 0.16 0.00 0.00 0.00 0.00 17.79 18.60 1i43 h ALA 379 CO 0.00 0.60 0.49 -0.51 0.00 0.00 0.00 179.25 179.84 1i43 s LEU 380 N -5.84 3.53 0.00 0.00 1.43 -1.13 -4.75 118.68 111.92 1i43 s LEU 380 Ca -0.00 2.58 0.00 0.00 -1.03 0.00 0.00 54.13 55.68 1i43 s LEU 380 Cb 0.08 -4.61 0.00 0.00 0.03 0.00 0.00 46.19 41.69 1i43 s LEU 380 CO 0.79 -2.06 0.00 0.29 0.23 0.00 0.00 176.35 175.59 1i43 n LYS 381 N -2.05 1.81 -0.09 1.70 5.02 -1.26 -4.87 118.16 118.41 1i43 n LYS 381 Ca 0.15 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.29 1i43 n LYS 381 Cb 0.48 -0.92 -0.09 0.00 -0.02 0.00 0.00 35.03 34.49 1i43 n LYS 381 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1i43 h ILE 382 N 0.00 0.75 -4.16 -0.18 2.04 -1.96 -3.48 117.51 110.53 1i43 h ILE 382 Ca 0.00 -1.86 -0.49 0.00 1.00 0.00 0.00 64.86 63.51 1i43 h ILE 382 Cb 0.30 1.71 0.06 0.00 -0.74 0.00 0.00 36.82 38.15 1i43 h ILE 382 CO 0.00 0.25 0.39 -2.16 0.00 0.00 0.00 178.15 176.63 1i43 s PRO 383 N -2.27 3.37 0.10 2.37 0.04 -1.26 -4.73 135.00 132.62 1i43 s PRO 383 Ca -0.23 1.31 -0.12 0.00 0.04 0.00 0.00 61.00 62.00 1i43 s PRO 383 Cb 0.04 -2.03 -0.06 0.00 0.04 0.00 0.00 34.50 32.48 1i43 s PRO 383 CO 0.48 -0.78 0.45 0.71 0.04 0.00 0.00 177.00 177.90 1i43 s TYR 384 N -2.26 3.60 -0.79 0.56 2.02 -0.19 -4.80 117.35 115.49 1i43 s TYR 384 Ca 0.66 0.89 -0.21 0.00 -0.37 0.00 0.00 57.07 58.04 1i43 s TYR 384 Cb -0.17 -2.23 0.10 0.00 -0.40 0.00 0.00 41.96 39.25 1i43 s TYR 384 CO 0.32 0.50 1.05 0.42 -1.57 0.00 0.00 175.55 176.27 1i43 s ILE 385 N -1.40 4.48 0.35 2.71 1.01 -1.26 -0.69 121.20 126.40 1i43 s ILE 385 Ca 0.34 -0.90 -0.17 0.00 0.00 0.00 0.00 60.65 59.92 1i43 s ILE 385 Cb -0.14 -4.74 0.05 0.00 0.01 0.00 0.00 42.46 37.64 1i43 s ILE 385 CO 0.18 -1.49 0.78 0.00 0.00 0.00 0.00 174.94 174.40 1i43 s ALA 386 N 3.50 -0.89 0.74 9.38 0.00 -0.95 -4.97 121.76 128.57 1i43 s ALA 386 Ca 0.27 -0.62 -0.02 0.00 0.00 0.00 0.00 51.96 51.59 1i43 s ALA 386 Cb -0.11 0.72 0.04 0.00 0.00 0.00 0.00 23.12 23.77 1i43 s ALA 386 CO 0.01 -1.00 0.24 -0.35 0.00 0.00 0.00 175.76 174.66 1i43 n PRO 387 N -0.51 0.08 -0.43 0.00 -0.05 -1.26 -4.45 135.00 128.38 1i43 n PRO 387 Ca -0.07 -0.49 0.06 0.00 -0.05 0.00 0.00 63.50 62.94 1i43 n PRO 387 Cb 0.60 -0.21 -0.02 0.00 -0.05 0.00 0.00 33.50 33.82 1i43 n PRO 387 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 175.50 175.90 1i43 n SER 388 N -3.08 -2.55 -3.63 3.54 2.88 -1.26 -5.01 113.62 104.51 1i43 n SER 388 Ca 0.03 0.18 -0.01 0.00 -1.33 0.00 0.00 58.87 57.75 1i43 n SER 388 Cb 0.12 -1.31 -0.02 0.00 -0.75 0.00 0.00 64.21 62.26 1i43 n SER 388 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1i43 s PHE 389 N -1.47 -0.01 0.00 0.66 -0.12 -1.26 -4.94 117.98 110.85 1i43 s PHE 389 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 56.93 56.88 1i43 s PHE 389 Cb 0.00 0.50 0.00 0.00 -0.63 0.00 0.00 43.02 42.89 1i43 s PHE 389 CO 0.00 -0.02 0.00 0.41 -0.05 0.00 0.00 175.22 175.56 1i43 n GLY 390 N -0.11 0.44 3.93 1.99 0.00 -1.26 -4.21 105.19 105.96 1i43 n GLY 390 Ca 0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.25 1.59 0.48 -0.02 0.00 -1.26 -4.29 107.32 102.58 1i43 s GLY 391 Ca 0.00 -0.83 0.18 0.00 0.00 0.00 0.00 44.72 44.07 1i43 s GLY 391 CO 0.00 -0.59 2.01 0.00 0.00 0.00 0.00 173.10 174.53 1i43 s GLU 393 N -5.21 4.45 0.49 0.00 8.01 -1.26 -0.26 118.70 124.92 1i43 s GLU 393 Ca -0.06 0.94 -0.22 0.00 0.01 0.00 0.00 54.97 55.64 1i43 s GLU 393 Cb 0.19 -3.43 -0.07 0.00 -4.31 0.00 0.00 34.13 26.52 1i43 s GLU 393 CO 0.73 0.11 1.15 -1.12 0.01 0.00 0.00 175.26 176.14 1i43 s SER 394 N 0.62 6.01 0.06 -0.19 0.01 -1.26 -4.46 113.70 114.48 1i43 s SER 394 Ca 0.38 2.26 0.01 0.00 1.31 0.00 0.00 55.95 59.92 1i43 s SER 394 Cb -0.18 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.42 1i43 s SER 394 CO 0.20 -1.02 -0.06 -0.63 0.41 0.00 0.00 173.24 172.13 1i43 s ILE 395 N -1.62 0.48 0.05 1.44 1.01 -0.60 -1.02 121.20 120.94 1i43 s ILE 395 Ca 0.67 -1.40 -0.04 0.00 0.00 0.00 0.00 60.65 59.88 1i43 s ILE 395 Cb -0.27 -0.99 -0.02 0.00 0.01 0.00 0.00 42.46 41.19 1i43 s ILE 395 CO 0.32 -0.63 0.06 -0.69 0.00 0.00 0.00 174.94 174.00 1i43 s VAL 396 N -2.38 0.17 -0.11 2.92 1.01 0.13 -1.23 120.40 120.91 1i43 s VAL 396 Ca -0.02 -1.43 -0.33 0.00 0.00 0.00 0.00 61.98 60.20 1i43 s VAL 396 Cb -0.03 -1.25 0.13 0.00 0.00 0.00 0.00 36.38 35.22 1i43 s VAL 396 CO -0.03 -0.79 1.21 1.51 0.00 0.00 0.00 175.10 177.00 1i43 s ASP 397 N -2.63 -0.12 -0.59 3.32 -4.77 -1.18 -2.24 116.67 108.46 1i43 s ASP 397 Ca 0.02 -0.06 -0.04 0.00 -3.30 0.00 0.00 52.55 49.18 1i43 s ASP 397 Cb 0.04 0.17 0.15 0.00 -1.09 0.00 0.00 42.92 42.20 1i43 s ASP 397 CO -0.08 -0.30 0.41 -1.10 0.70 0.00 0.00 175.17 174.80 1i43 s GLN 398 N -2.49 2.51 0.24 2.11 -0.21 -1.26 -2.23 119.66 118.33 1i43 s GLN 398 Ca 0.11 -2.37 0.07 0.00 0.02 0.00 0.00 55.36 53.19 1i43 s GLN 398 Cb 0.01 -3.74 0.72 0.00 1.00 0.00 0.00 33.01 30.99 1i43 s GLN 398 CO -0.04 -1.16 1.13 -2.30 -2.12 0.00 0.00 175.29 170.79 1i43 n PRO 399 N 3.77 -0.05 -0.06 2.91 -0.02 -1.26 0.12 135.00 140.40 1i43 n PRO 399 Ca 0.06 1.04 -0.09 0.00 -2.02 0.00 0.00 63.50 62.49 1i43 n PRO 399 Cb 0.39 -1.74 -0.03 0.00 -0.02 0.00 0.00 33.50 32.10 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 1.44 -0.28 0.12 3.55 0.00 -1.85 0.32 119.26 122.55 1i43 h ALA 400 Ca 0.51 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.47 1i43 h ALA 400 Cb 1.18 0.67 0.00 0.00 0.00 0.00 0.00 17.79 19.65 1i43 h ALA 400 CO -0.63 -0.77 -0.06 0.82 0.00 0.00 0.00 179.25 178.62 1i43 h ILE 401 N -0.32 0.75 -0.65 0.00 2.04 0.58 -1.48 117.51 118.43 1i43 h ILE 401 Ca 0.13 -1.27 0.10 0.00 1.00 0.00 0.00 64.86 64.83 1i43 h ILE 401 Cb 0.54 1.32 -0.08 0.00 -0.74 0.00 0.00 36.82 37.87 1i43 h ILE 401 CO -0.46 0.22 0.26 0.24 0.00 0.00 0.00 178.15 178.41 1i43 h MET 402 N -0.94 0.43 0.00 2.37 2.86 -0.60 -3.20 114.93 115.85 1i43 h MET 402 Ca -0.02 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1i43 h MET 402 Cb 0.48 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.05 1i43 h MET 402 CO 0.03 0.28 -0.05 -1.13 1.06 0.00 0.00 176.91 177.10 1i43 n SER 403 N -4.98 1.22 -0.32 1.22 3.41 0.11 -4.80 113.62 109.48 1i43 n SER 403 Ca 0.10 -1.84 0.00 0.00 -0.26 0.00 0.00 58.87 56.86 1i43 n SER 403 Cb 0.29 -0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.16 1i43 n SER 403 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1i43 n TYR 404 N -0.43 0.00 0.27 7.33 4.02 -0.98 -4.87 117.16 122.51 1i43 n TYR 404 Ca 0.02 0.00 0.15 0.00 -0.01 0.00 0.00 57.90 58.06 1i43 n TYR 404 Cb 0.43 0.01 0.76 0.00 -0.02 0.00 0.00 39.34 40.52 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 -1.27 -2.19 115.95 111.77 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 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.37 1i43 h TRP 405 CO 0.02 0.09 0.00 0.38 -0.00 0.00 0.00 178.44 178.93 1i43 h ASP 406 N 0.00 0.00 -2.54 2.65 2.03 -1.88 -3.45 116.42 113.23 1i43 h ASP 406 Ca -0.00 0.00 -0.51 0.00 -0.73 0.00 0.00 57.03 55.79 1i43 h ASP 406 Cb 0.36 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.84 1i43 h ASP 406 CO 0.01 0.00 -0.40 -0.76 -1.03 0.00 0.00 179.24 177.06 1i43 s LEU 407 N -4.84 4.28 0.52 0.15 1.43 -0.83 -5.09 118.68 114.30 1i43 s LEU 407 Ca 0.05 0.22 -0.19 0.00 -1.03 0.00 0.00 54.13 53.19 1i43 s LEU 407 Cb 0.10 -2.99 -0.07 0.00 0.03 0.00 0.00 46.19 43.25 1i43 s LEU 407 CO 0.47 -0.03 1.04 -0.94 0.23 0.00 0.00 176.35 177.12 1i43 s SER 408 N -3.49 6.20 0.34 2.29 1.04 -1.26 -4.77 113.70 114.05 1i43 s SER 408 Ca 0.36 1.87 0.13 0.00 0.48 0.00 0.00 55.95 58.79 1i43 s SER 408 Cb -0.10 -2.55 1.04 0.00 0.10 0.00 0.00 66.02 64.50 1i43 s SER 408 CO 0.29 -0.88 1.68 -0.61 0.98 0.00 0.00 173.24 174.70 1i43 h GLN 409 N 1.20 0.36 -0.04 4.02 4.15 -1.96 0.36 115.11 123.20 1i43 h GLN 409 Ca -0.49 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 58.90 1i43 h GLN 409 Cb 1.22 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 28.83 1i43 h GLN 409 CO 0.59 0.24 -0.02 0.77 -1.93 0.00 0.00 178.83 178.48 1i43 h SER 410 N 0.37 0.09 0.24 -0.69 0.02 -1.99 -1.69 113.55 109.91 1i43 h SER 410 Ca 0.71 -0.41 -0.04 0.00 -0.84 0.00 0.00 61.79 61.21 1i43 h SER 410 Cb 1.57 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 64.08 1i43 h SER 410 CO -0.58 0.48 -0.19 0.44 -1.14 0.00 0.00 176.83 175.84 1i43 h ASP 411 N -0.30 0.00 0.12 3.07 3.32 -1.24 -0.65 116.42 120.75 1i43 h ASP 411 Ca 0.01 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 1i43 h ASP 411 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1i43 h ASP 411 CO 0.01 0.19 -0.06 0.03 -1.72 0.00 0.00 179.24 177.68 1i43 h ARG 412 N 0.00 -0.16 0.00 3.56 3.08 -0.31 -2.95 114.38 117.60 1i43 h ARG 412 Ca -0.00 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 1i43 h ARG 412 Cb 0.36 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.44 1i43 h ARG 412 CO 0.02 0.29 -0.01 0.00 -1.07 0.00 0.00 179.97 179.21 1i43 h ALA 413 N 0.02 1.39 0.00 0.04 0.00 -1.05 -0.67 119.26 118.99 1i43 h ALA 413 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1i43 h ALA 413 Cb 0.53 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1i43 h ALA 413 CO 0.03 0.01 0.17 -0.22 0.00 0.00 0.00 179.25 179.24 1i43 h LYS 414 N 0.00 0.00 -0.95 0.00 3.64 -0.93 -2.82 116.57 115.51 1i43 h LYS 414 Ca -0.00 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 59.02 1i43 h LYS 414 Cb 0.02 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 31.44 1i43 h LYS 414 CO 0.00 0.00 -1.15 0.66 -2.27 0.00 0.00 179.45 176.69 1i43 n TYR 415 N -2.58 1.35 0.00 1.91 4.01 -0.26 -5.01 117.16 116.58 1i43 n TYR 415 Ca -0.02 -2.71 0.00 0.00 -0.16 0.00 0.00 57.90 55.02 1i43 n TYR 415 Cb 0.22 -0.33 0.00 0.00 -0.31 0.00 0.00 39.34 38.91 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 -0.18 1.64 3.64 2.72 0.00 -1.07 -4.96 105.19 106.98 1i43 n GLY 416 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.34 3.60 0.12 -0.61 -1.09 -1.22 -4.96 121.20 116.70 1i43 s ILE 417 Ca 0.00 0.69 0.07 0.00 -2.23 0.00 0.00 60.65 59.19 1i43 s ILE 417 Cb 0.00 -3.57 -0.04 0.00 -1.58 0.00 0.00 42.46 37.27 1i43 s ILE 417 CO 0.00 -0.20 -0.10 -0.04 -1.23 0.00 0.00 174.94 173.37 1i43 s MET 418 N 4.60 2.10 0.00 2.79 -1.94 -1.26 -3.64 119.30 121.95 1i43 s MET 418 Ca 0.74 -1.07 0.07 0.00 -1.71 0.00 0.00 55.69 53.72 1i43 s MET 418 Cb -0.28 -2.27 0.35 0.00 2.01 0.00 0.00 34.83 34.64 1i43 s MET 418 CO 0.30 0.49 1.03 -0.25 -0.01 0.00 0.00 175.02 176.59 1i43 n ASP 419 N 0.59 0.00 0.01 3.03 9.92 -1.26 -1.31 116.55 127.53 1i43 n ASP 419 Ca -0.13 0.12 -0.17 0.00 -0.53 0.00 0.00 54.79 54.07 1i43 n ASP 419 Cb 0.53 -0.24 -0.14 0.00 -0.64 0.00 0.00 41.12 40.63 1i43 n ASP 419 CO 0.00 0.00 0.00 0.78 0.13 0.00 0.00 177.20 178.11 1i43 h ASN 420 N 0.00 0.32 -2.42 -2.24 -0.26 -1.88 -3.35 115.58 105.75 1i43 h ASN 420 Ca 0.00 -0.64 -0.61 0.00 -0.56 0.00 0.00 56.30 54.49 1i43 h ASN 420 Cb 0.05 -0.10 0.08 0.00 -1.06 0.00 0.00 38.32 37.29 1i43 h ASN 420 CO 0.00 1.57 0.47 -0.11 -1.06 0.00 0.00 177.43 178.29 1i43 n LEU 421 N -3.37 2.50 -3.76 1.61 7.94 -0.43 -2.83 117.00 118.66 1i43 n LEU 421 Ca -0.25 1.14 -0.19 0.00 -1.11 0.00 0.00 56.01 55.61 1i43 n LEU 421 Cb 1.05 -1.35 -0.17 0.00 0.53 0.00 0.00 43.42 43.48 1i43 n LEU 421 CO 0.45 -0.81 -0.36 -0.69 -1.11 0.00 0.00 177.39 174.87 1i43 s VAL 422 N -0.17 0.10 -0.27 1.96 1.01 0.22 -4.34 120.40 118.92 1i43 s VAL 422 Ca 0.69 0.21 -0.09 0.00 0.00 0.00 0.00 61.98 62.79 1i43 s VAL 422 Cb -0.72 -0.26 -0.03 0.00 0.00 0.00 0.00 36.38 35.36 1i43 s VAL 422 CO 0.51 0.17 0.13 -0.60 0.00 0.00 0.00 175.10 175.32 1i43 s ARG 423 N 1.56 3.71 -0.24 2.72 3.52 -0.95 -0.66 118.95 128.61 1i43 s ARG 423 Ca -0.02 -0.46 -0.06 0.00 -0.13 0.00 0.00 55.73 55.05 1i43 s ARG 423 Cb -0.13 -3.51 -0.02 0.00 -1.56 0.00 0.00 34.95 29.74 1i43 s ARG 423 CO -0.03 -0.23 0.02 0.12 -0.81 0.00 0.00 175.30 174.37 1i43 s PHE 424 N 1.67 3.04 -0.66 5.12 2.19 0.25 -3.08 117.98 126.51 1i43 s PHE 424 Ca 0.06 -0.70 -0.14 0.00 0.33 0.00 0.00 56.93 56.48 1i43 s PHE 424 Cb -0.16 -2.18 0.17 0.00 -1.31 0.00 0.00 43.02 39.53 1i43 s PHE 424 CO 0.07 -0.46 0.60 0.45 1.83 0.00 0.00 175.22 177.70 1i43 s SER 425 N 1.54 6.36 0.05 6.13 0.15 -0.37 -0.54 113.70 127.03 1i43 s SER 425 Ca 0.06 -2.20 -0.30 0.00 0.70 0.00 0.00 55.95 54.20 1i43 s SER 425 Cb -0.15 -2.18 -0.08 0.00 -1.71 0.00 0.00 66.02 61.90 1i43 s SER 425 CO 0.01 -0.71 1.67 -0.36 1.20 0.00 0.00 173.24 175.04 1i43 s PHE 426 N 0.94 2.28 0.00 3.44 0.08 -0.84 -1.55 117.98 122.32 1i43 s PHE 426 Ca 0.10 0.25 0.00 0.00 0.12 0.00 0.00 56.93 57.40 1i43 s PHE 426 Cb -0.21 -3.97 0.00 0.00 -0.57 0.00 0.00 43.02 38.26 1i43 s PHE 426 CO -0.02 -3.97 0.00 0.41 -0.10 0.00 0.00 175.22 171.54 1i43 n GLY 427 N 4.05 -0.36 0.00 4.36 0.00 -1.26 -4.83 105.19 107.15 1i43 n GLY 427 Ca 0.16 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 45.07 1i43 n GLY 427 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1i43 n VAL 428 N 0.00 0.28 -0.63 1.61 0.31 0.64 -4.51 118.33 116.03 1i43 n VAL 428 Ca 0.00 -0.59 -0.31 0.00 -0.01 0.00 0.00 64.34 63.43 1i43 n VAL 428 Cb 0.00 0.93 0.19 0.00 -0.91 0.00 0.00 33.84 34.05 1i43 n VAL 428 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1i43 n GLU 429 N -0.14 -1.37 -1.92 5.55 4.71 -1.26 -4.87 120.64 121.34 1i43 n GLU 429 Ca 0.00 -0.36 -0.42 0.00 -0.01 0.00 0.00 57.16 56.37 1i43 n GLU 429 Cb 0.10 -2.04 -0.03 0.00 -1.01 0.00 0.00 31.44 28.46 1i43 n GLU 429 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1i43 s ASP 430 N -2.25 6.58 0.12 1.62 2.15 -1.26 -4.89 116.67 118.74 1i43 s ASP 430 Ca 0.63 2.63 -0.28 0.00 0.43 0.00 0.00 52.55 55.96 1i43 s ASP 430 Cb -0.21 -2.59 -0.08 0.00 -0.30 0.00 0.00 42.92 39.74 1i43 s ASP 430 CO 0.64 -0.83 1.47 0.15 -0.17 0.00 0.00 175.17 176.43 1i43 h PHE 431 N 6.81 -1.55 -0.85 -5.34 3.57 -1.98 -1.11 116.94 116.48 1i43 h PHE 431 Ca -0.43 0.09 0.22 0.00 3.53 0.00 0.00 57.97 61.38 1i43 h PHE 431 Cb 1.20 0.75 -0.14 0.00 2.79 0.00 0.00 35.95 40.56 1i43 h PHE 431 CO 0.65 -0.38 0.20 -0.44 -2.23 0.00 0.00 178.31 176.11 1i43 h ASP 432 N -0.20 -0.04 -0.66 0.41 3.32 -1.98 0.45 116.42 117.71 1i43 h ASP 432 Ca 0.09 0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.32 1i43 h ASP 432 Cb 0.45 0.27 -0.03 0.00 0.22 0.00 0.00 39.33 40.23 1i43 h ASP 432 CO -0.64 -0.14 0.37 0.44 -1.72 0.00 0.00 179.24 177.55 1i43 h ASP 433 N 0.21 0.83 0.01 6.45 3.32 -1.61 -0.64 116.42 124.98 1i43 h ASP 433 Ca 0.52 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.48 1i43 h ASP 433 Cb 1.01 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.35 1i43 h ASP 433 CO -0.64 0.68 -0.01 -0.07 -1.72 0.00 0.00 179.24 177.48 1i43 h LEU 434 N 0.91 -0.02 -0.12 1.55 3.38 0.00 -2.66 115.31 118.36 1i43 h LEU 434 Ca 0.23 -0.48 0.04 0.00 0.09 0.00 0.00 57.88 57.77 1i43 h LEU 434 Cb 0.03 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 1i43 h LEU 434 CO -0.04 0.47 -0.15 0.50 0.09 0.00 0.00 178.44 179.32 1i43 h LYS 435 N -0.51 -0.18 -0.95 1.13 3.64 -0.19 -0.91 116.57 118.60 1i43 h LYS 435 Ca -0.00 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.50 1i43 h LYS 435 Cb 0.49 0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 32.28 1i43 h LYS 435 CO 0.00 -0.12 0.58 0.00 -2.27 0.00 0.00 179.45 177.64 1i43 h ALA 436 N 0.86 1.39 -0.05 5.00 0.00 -1.17 -0.58 119.26 124.70 1i43 h ALA 436 Ca 0.09 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1i43 h ALA 436 Cb 0.32 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1i43 h ALA 436 CO -0.23 0.21 0.01 0.22 0.00 0.00 0.00 179.25 179.47 1i43 h ASP 437 N 0.95 0.07 -0.90 0.00 3.58 -0.99 0.12 116.42 119.27 1i43 h ASP 437 Ca 0.46 -0.21 -0.00 0.00 0.42 0.00 0.00 57.03 57.69 1i43 h ASP 437 Cb 0.41 -0.02 -0.04 0.00 1.72 0.00 0.00 39.33 41.39 1i43 h ASP 437 CO -0.25 0.27 0.55 0.40 -2.88 0.00 0.00 179.24 177.33 1i43 h ILE 438 N -0.13 1.25 0.25 2.25 2.04 -0.65 -0.85 117.51 121.66 1i43 h ILE 438 Ca 0.02 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.34 1i43 h ILE 438 Cb 0.22 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.28 1i43 h ILE 438 CO -0.00 0.26 -0.12 -0.07 0.00 0.00 0.00 178.15 178.22 1i43 h LEU 439 N 1.24 -0.28 -0.90 1.44 3.38 -1.00 -0.33 115.31 118.85 1i43 h LEU 439 Ca 0.32 -0.22 0.18 0.00 0.09 0.00 0.00 57.88 58.26 1i43 h LEU 439 Cb -0.06 0.07 -0.11 0.00 0.09 0.00 0.00 40.66 40.65 1i43 h LEU 439 CO -0.06 0.10 0.47 -0.61 0.09 0.00 0.00 178.44 178.43 1i43 h GLN 440 N -0.71 0.56 -0.01 1.13 -0.00 -0.80 0.54 115.11 115.83 1i43 h GLN 440 Ca -0.03 -0.03 -0.00 0.00 -0.00 0.00 0.00 58.65 58.58 1i43 h GLN 440 Cb 0.48 -0.13 -0.00 0.00 0.00 0.00 0.00 27.48 27.84 1i43 h GLN 440 CO 0.06 0.37 0.00 0.00 0.00 0.00 0.00 178.83 179.26 1i43 h ALA 441 N 1.63 0.02 -0.08 3.38 0.00 -1.06 -2.80 119.26 120.35 1i43 h ALA 441 Ca 0.53 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.31 1i43 h ALA 441 Cb 0.86 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 1i43 h ALA 441 CO -0.42 -0.33 0.07 -0.07 0.00 0.00 0.00 179.25 178.50 1i43 h LEU 442 N -0.26 0.00 0.00 0.00 3.38 0.24 -1.69 115.31 116.98 1i43 h LEU 442 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1i43 h LEU 442 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1i43 h LEU 442 CO 0.00 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.00 1i43 n ASP 443 N -4.12 0.00 -0.06 -0.43 9.92 0.06 -2.78 116.55 119.13 1i43 n ASP 443 Ca -0.01 -0.67 -0.08 0.00 -0.53 0.00 0.00 54.79 53.50 1i43 n ASP 443 Cb 0.18 0.00 -0.07 0.00 -0.64 0.00 0.00 41.12 40.59 1i43 n ASP 443 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1i43 n SER 444 N -0.64 2.80 0.00 -2.24 7.64 -0.64 -5.08 113.62 115.46 1i43 n SER 444 Ca 0.03 -0.05 0.00 0.00 1.01 0.00 0.00 58.87 59.86 1i43 n SER 444 Cb 0.01 0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 1i43 n SER 444 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65