#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i75 s PRO 2 N 0.00 2.19 0.42 0.00 0.04 -1.26 -4.59 135.00 131.80 1i75 s PRO 2 Ca 0.00 0.61 0.15 0.00 0.04 0.00 0.00 61.00 61.80 1i75 s PRO 2 Cb 0.00 -1.93 1.02 0.00 0.04 0.00 0.00 34.50 33.63 1i75 s PRO 2 CO 0.00 -1.54 1.92 0.38 0.04 0.00 0.00 177.00 177.79 1i75 h ASP 3 N -1.03 0.42 0.21 6.66 2.03 -1.93 -2.21 116.42 120.57 1i75 h ASP 3 Ca -0.47 0.02 0.00 0.00 -0.73 0.00 0.00 57.03 55.86 1i75 h ASP 3 Cb 1.27 -0.06 0.00 0.00 -0.83 0.00 0.00 39.33 39.71 1i75 h ASP 3 CO 0.60 0.22 -0.03 0.35 -1.03 0.00 0.00 179.24 179.35 1i75 n THR 4 N -4.49 0.00 -1.90 1.15 -2.24 -1.26 -4.83 114.28 100.72 1i75 n THR 4 Ca 0.15 -0.04 -0.37 0.00 -2.27 0.00 0.00 64.05 61.51 1i75 n THR 4 Cb 0.52 -0.29 0.04 0.00 -2.10 0.00 0.00 70.33 68.50 1i75 n THR 4 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1i75 s SER 5 N -2.24 5.14 0.55 3.42 0.15 -0.83 -4.90 113.70 114.99 1i75 s SER 5 Ca 0.38 2.55 0.33 0.00 0.70 0.00 0.00 55.95 59.91 1i75 s SER 5 Cb 0.21 -2.62 1.52 0.00 -1.71 0.00 0.00 66.02 63.42 1i75 s SER 5 CO 0.41 -1.64 2.05 1.62 1.20 0.00 0.00 173.24 176.88 1i75 h VAL 6 N 1.04 0.18 -0.00 4.45 3.04 -1.90 -2.35 116.25 120.71 1i75 h VAL 6 Ca -0.51 -0.51 0.00 0.00 -1.01 0.00 0.00 66.70 64.67 1i75 h VAL 6 Cb 1.31 1.42 0.00 0.00 -2.01 0.00 0.00 31.29 32.01 1i75 h VAL 6 CO 0.56 0.05 -0.00 -1.54 -1.01 0.00 0.00 177.57 175.62 1i75 n SER 7 N -3.23 0.11 -4.55 3.17 3.41 -1.26 -4.45 113.62 106.82 1i75 n SER 7 Ca -0.01 -0.86 -0.42 0.00 -0.26 0.00 0.00 58.87 57.32 1i75 n SER 7 Cb 0.27 -0.05 -0.02 0.00 -0.26 0.00 0.00 64.21 64.14 1i75 n SER 7 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1i75 s ASN 8 N -2.12 6.62 0.14 4.04 3.04 -0.89 -4.75 114.94 121.02 1i75 s ASN 8 Ca 0.43 -1.82 0.27 0.00 0.04 0.00 0.00 52.86 51.78 1i75 s ASN 8 Cb 0.22 -2.55 0.96 0.00 -1.54 0.00 0.00 41.25 38.34 1i75 s ASN 8 CO 0.39 -1.34 1.82 0.29 -3.04 0.00 0.00 177.10 175.22 1i75 n LYS 9 N 8.36 0.17 0.05 0.43 5.02 -1.26 -4.13 118.16 126.80 1i75 n LYS 9 Ca 0.36 0.15 -0.12 0.00 -2.02 0.00 0.00 58.31 56.68 1i75 n LYS 9 Cb 0.49 -1.70 -0.13 0.00 -0.02 0.00 0.00 35.03 33.67 1i75 n LYS 9 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1i75 h GLN 10 N 0.00 0.12 -4.29 1.97 7.50 -1.85 0.43 115.11 118.99 1i75 h GLN 10 Ca 0.00 -0.21 -0.37 0.00 0.50 0.00 0.00 58.65 58.58 1i75 h GLN 10 Cb 0.64 0.08 -0.30 0.00 0.05 0.00 0.00 27.48 27.94 1i75 h GLN 10 CO 0.00 0.97 -0.77 -0.80 -1.50 0.00 0.00 178.83 176.74 1i75 s ASN 11 N -6.74 0.80 -0.01 1.46 0.01 -1.26 -4.04 114.94 105.15 1i75 s ASN 11 Ca -0.04 -0.12 0.03 0.00 -0.71 0.00 0.00 52.86 52.02 1i75 s ASN 11 Cb 0.08 -0.21 0.05 0.00 0.41 0.00 0.00 41.25 41.59 1i75 s ASN 11 CO 0.84 0.03 1.04 0.49 -1.51 0.00 0.00 177.10 177.99 1i75 n PHE 12 N 3.32 0.04 0.30 2.20 3.01 -1.26 -4.77 117.46 120.30 1i75 n PHE 12 Ca -0.18 -0.55 0.18 0.00 1.01 0.00 0.00 57.45 57.91 1i75 n PHE 12 Cb 0.55 -0.06 0.93 0.00 -0.01 0.00 0.00 39.48 40.89 1i75 n PHE 12 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 1i75 h SER 13 N 0.16 0.00 -0.08 4.37 0.02 -1.82 -1.74 113.55 114.45 1i75 h SER 13 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1i75 h SER 13 Cb 0.57 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.11 1i75 h SER 13 CO 0.00 0.04 0.00 0.35 -1.14 0.00 0.00 176.83 176.08 1i75 n THR 14 N -3.37 0.10 -4.10 -2.27 -2.24 -1.26 -4.62 114.28 96.53 1i75 n THR 14 Ca -0.02 -0.18 -0.22 0.00 -2.27 0.00 0.00 64.05 61.35 1i75 n THR 14 Cb 0.17 0.07 -0.04 0.00 -2.10 0.00 0.00 70.33 68.43 1i75 n THR 14 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1i75 s ASP 15 N -1.63 5.61 -0.13 3.42 1.11 -0.66 -3.38 116.67 121.01 1i75 s ASP 15 Ca 0.32 -0.20 0.02 0.00 0.18 0.00 0.00 52.55 52.87 1i75 s ASP 15 Cb 0.16 -1.46 0.01 0.00 1.07 0.00 0.00 42.92 42.70 1i75 s ASP 15 CO 0.26 -0.03 -0.18 -0.69 1.18 0.00 0.00 175.17 175.71 1i75 s VAL 16 N -2.07 1.76 -0.01 -1.27 1.01 -1.26 -4.22 120.40 114.34 1i75 s VAL 16 Ca 0.33 -0.79 -0.18 0.00 0.00 0.00 0.00 61.98 61.34 1i75 s VAL 16 Cb -0.08 -1.59 -0.06 0.00 0.00 0.00 0.00 36.38 34.65 1i75 s VAL 16 CO 0.25 0.49 0.50 -0.63 0.00 0.00 0.00 175.10 175.71 1i75 s ILE 17 N 1.01 4.97 -0.24 2.22 1.01 -0.28 -1.52 121.20 128.37 1i75 s ILE 17 Ca -0.04 1.03 -0.03 0.00 0.00 0.00 0.00 60.65 61.61 1i75 s ILE 17 Cb -0.15 -3.82 0.01 0.00 0.01 0.00 0.00 42.46 38.51 1i75 s ILE 17 CO -0.04 0.48 -0.04 -0.47 0.00 0.00 0.00 174.94 174.88 1i75 s TYR 18 N -0.52 3.03 -0.26 3.97 6.14 -0.22 -0.12 117.35 129.38 1i75 s TYR 18 Ca 0.27 -1.28 -0.19 0.00 0.64 0.00 0.00 57.07 56.50 1i75 s TYR 18 Cb -0.17 -2.10 -0.02 0.00 0.42 0.00 0.00 41.96 40.09 1i75 s TYR 18 CO 0.15 -0.65 0.57 -1.14 0.64 0.00 0.00 175.55 175.12 1i75 s GLN 19 N 1.40 4.07 -0.15 4.97 0.74 0.66 -0.52 119.66 130.83 1i75 s GLN 19 Ca 0.02 0.42 -0.02 0.00 0.05 0.00 0.00 55.36 55.83 1i75 s GLN 19 Cb -0.16 -3.66 -0.02 0.00 1.10 0.00 0.00 33.01 30.28 1i75 s GLN 19 CO -0.03 -0.40 -0.08 0.42 -0.55 0.00 0.00 175.29 174.65 1i75 s ILE 20 N 2.42 3.43 -0.56 -2.34 1.01 0.11 -0.86 121.20 124.40 1i75 s ILE 20 Ca 0.24 -0.52 -0.25 0.00 0.00 0.00 0.00 60.65 60.12 1i75 s ILE 20 Cb -0.16 -2.49 0.04 0.00 0.01 0.00 0.00 42.46 39.87 1i75 s ILE 20 CO 0.09 0.50 0.98 -0.36 0.00 0.00 0.00 174.94 176.15 1i75 s PHE 21 N 0.53 2.75 0.37 3.97 0.08 -1.26 -3.41 117.98 121.01 1i75 s PHE 21 Ca -0.06 0.02 0.13 0.00 0.12 0.00 0.00 56.93 57.14 1i75 s PHE 21 Cb -0.15 -4.15 0.95 0.00 -0.57 0.00 0.00 43.02 39.10 1i75 s PHE 21 CO 0.03 -1.41 1.80 1.15 -0.10 0.00 0.00 175.22 176.70 1i75 h THR 22 N 6.04 0.65 0.00 0.64 2.02 -1.91 0.87 112.91 121.22 1i75 h THR 22 Ca -0.26 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.72 1i75 h THR 22 Cb 1.07 0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.53 1i75 h THR 22 CO 1.11 0.10 -0.06 -0.78 0.37 0.00 0.00 175.52 176.26 1i75 h ASP 23 N 0.55 0.00 -0.39 4.18 1.82 -1.79 -3.11 116.42 117.69 1i75 h ASP 23 Ca 0.54 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.18 1i75 h ASP 23 Cb 1.14 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.15 1i75 h ASP 23 CO -0.29 0.06 0.00 0.54 -1.61 0.00 0.00 179.24 177.94 1i75 n ARG 24 N -3.19 2.68 0.00 0.28 5.12 0.29 -1.60 116.66 120.24 1i75 n ARG 24 Ca 0.00 -2.09 0.00 0.00 -1.93 0.00 0.00 57.85 53.83 1i75 n ARG 24 Cb 0.32 -1.32 0.00 0.00 -1.16 0.00 0.00 32.46 30.30 1i75 n ARG 24 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1i75 n PHE 25 N 0.73 0.00 -3.75 -1.55 7.35 -1.17 -1.81 117.46 117.25 1i75 n PHE 25 Ca 0.13 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.69 1i75 n PHE 25 Cb 0.45 0.00 -0.14 0.00 0.35 0.00 0.00 39.48 40.14 1i75 n PHE 25 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 1i75 s SER 26 N -1.35 -0.13 -1.01 -2.13 0.15 -1.26 -4.62 113.70 103.34 1i75 s SER 26 Ca 0.00 0.32 -0.22 0.00 0.70 0.00 0.00 55.95 56.75 1i75 s SER 26 Cb 0.00 0.22 0.07 0.00 -1.71 0.00 0.00 66.02 64.60 1i75 s SER 26 CO 0.00 -0.14 1.39 -0.62 1.20 0.00 0.00 173.24 175.08 1i75 s ASP 27 N 1.05 6.55 0.07 5.45 3.68 -1.26 -1.53 116.67 130.68 1i75 s ASP 27 Ca -0.08 -1.63 0.26 0.00 2.13 0.00 0.00 52.55 53.23 1i75 s ASP 27 Cb -0.10 -2.53 0.72 0.00 -1.45 0.00 0.00 42.92 39.56 1i75 s ASP 27 CO -0.05 -1.39 1.60 0.61 0.13 0.00 0.00 175.17 176.06 1i75 n GLY 28 N 6.51 -1.45 2.55 2.66 0.00 -1.26 -4.63 105.19 109.56 1i75 n GLY 28 Ca 0.32 -0.19 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 1i75 n GLY 28 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1i75 s ASN 29 N -3.63 3.31 0.52 1.61 2.47 -1.26 -4.78 114.94 113.18 1i75 s ASN 29 Ca 0.10 -1.36 0.30 0.00 0.42 0.00 0.00 52.86 52.33 1i75 s ASN 29 Cb 0.16 -0.28 1.35 0.00 -1.45 0.00 0.00 41.25 41.02 1i75 s ASN 29 CO 0.64 -0.42 1.99 -0.65 -3.72 0.00 0.00 177.10 174.94 1i75 h PRO 30 N 8.23 0.00 0.00 0.43 0.11 -1.90 -3.20 132.00 135.66 1i75 h PRO 30 Ca -0.16 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.92 1i75 h PRO 30 Cb 1.01 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 1i75 h PRO 30 CO 0.41 0.11 -0.12 0.00 -0.21 0.00 0.00 178.00 178.18 1i75 h ALA 31 N 1.89 1.25 -0.34 -0.75 0.00 -1.99 -2.30 119.26 117.03 1i75 h ALA 31 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1i75 h ALA 31 Cb 0.49 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1i75 h ALA 31 CO 0.01 0.15 0.00 0.27 0.00 0.00 0.00 179.25 179.68 1i75 n ASN 32 N -3.60 2.37 -4.73 0.00 0.23 -1.21 -4.94 115.26 103.39 1i75 n ASN 32 Ca -0.02 -1.89 -0.42 0.00 -0.53 0.00 0.00 54.58 51.73 1i75 n ASN 32 Cb 0.25 -0.22 -0.03 0.00 -2.08 0.00 0.00 39.78 37.70 1i75 n ASN 32 CO 0.00 0.00 0.00 0.20 -0.93 0.00 0.00 177.26 176.53 1i75 s ASN 33 N -1.31 6.97 0.66 0.53 -0.87 -0.87 -4.22 114.94 115.82 1i75 s ASN 33 Ca 0.33 2.27 -0.17 0.00 -1.57 0.00 0.00 52.86 53.72 1i75 s ASN 33 Cb 0.18 -2.60 -0.08 0.00 -0.02 0.00 0.00 41.25 38.73 1i75 s ASN 33 CO 0.25 -0.50 0.33 -2.65 -2.57 0.00 0.00 177.10 171.96 1i75 n PRO 34 N 3.09 0.29 -4.25 -0.60 -0.02 -1.26 -5.02 135.00 127.24 1i75 n PRO 34 Ca 0.07 0.13 -0.24 0.00 -2.02 0.00 0.00 63.50 61.44 1i75 n PRO 34 Cb 0.44 -1.60 -0.08 0.00 -0.02 0.00 0.00 33.50 32.24 1i75 n PRO 34 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1i75 s THR 35 N -1.88 2.70 0.00 3.45 -4.23 -1.26 -4.57 115.64 109.85 1i75 s THR 35 Ca 0.63 -1.85 0.00 0.00 -1.18 0.00 0.00 61.69 59.29 1i75 s THR 35 Cb -0.39 -2.88 0.00 0.00 1.34 0.00 0.00 72.50 70.57 1i75 s THR 35 CO 0.60 -0.17 0.00 0.61 -0.54 0.00 0.00 174.62 175.12 1i75 n GLY 36 N -1.05 1.90 0.28 3.99 0.00 -1.26 -2.88 105.19 106.18 1i75 n GLY 36 Ca -0.03 -0.48 0.19 0.00 0.00 0.00 0.00 46.02 45.69 1i75 n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i75 h ALA 37 N -0.52 1.00 -0.00 4.61 0.00 -2.03 -2.27 119.26 120.05 1i75 h ALA 37 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1i75 h ALA 37 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1i75 h ALA 37 CO 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 179.25 179.08 1i75 n ALA 38 N -2.02 2.84 -2.59 0.00 0.00 -1.14 -4.90 120.51 112.71 1i75 n ALA 38 Ca -0.01 -0.25 -0.24 0.00 0.00 0.00 0.00 53.44 52.94 1i75 n ALA 38 Cb 0.15 -1.32 -0.15 0.00 0.00 0.00 0.00 19.45 18.14 1i75 n ALA 38 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1i75 s PHE 39 N -2.73 1.51 -0.31 0.00 5.36 -0.86 -1.16 117.98 119.80 1i75 s PHE 39 Ca 0.21 -0.31 -0.03 0.00 -0.96 0.00 0.00 56.93 55.84 1i75 s PHE 39 Cb 0.19 -0.98 0.11 0.00 -0.34 0.00 0.00 43.02 42.00 1i75 s PHE 39 CO 0.54 -0.05 0.14 0.34 -1.46 0.00 0.00 175.22 174.73 1i75 s ASP 40 N -0.31 3.52 0.50 6.13 2.15 0.45 -4.78 116.67 124.33 1i75 s ASP 40 Ca 0.05 -1.53 0.16 0.00 0.43 0.00 0.00 52.55 51.66 1i75 s ASP 40 Cb -0.07 -0.45 1.22 0.00 -0.30 0.00 0.00 42.92 43.31 1i75 s ASP 40 CO -0.00 -0.41 2.10 1.23 -0.17 0.00 0.00 175.17 177.92 1i75 h GLY 41 N 8.08 0.00 2.00 2.66 0.00 -1.82 -0.39 103.07 113.61 1i75 h GLY 41 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1i75 h GLY 41 CO 0.42 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.82 1i75 n SER 42 N -4.42 0.26 -4.01 0.19 3.41 -1.26 -4.92 113.62 102.87 1i75 n SER 42 Ca -0.03 0.53 -0.30 0.00 -0.26 0.00 0.00 58.87 58.81 1i75 n SER 42 Cb 0.14 -0.60 -0.01 0.00 -0.26 0.00 0.00 64.21 63.49 1i75 n SER 42 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i75 n THR 44 N -4.46 0.51 -3.29 0.00 -2.24 -1.26 -4.62 114.28 98.91 1i75 n THR 44 Ca -0.09 -0.59 -0.46 0.00 -2.27 0.00 0.00 64.05 60.64 1i75 n THR 44 Cb 0.58 -0.25 -0.05 0.00 -2.10 0.00 0.00 70.33 68.51 1i75 n THR 44 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1i75 s ASN 45 N -5.03 6.22 0.00 3.42 3.84 -1.26 -4.92 114.94 117.21 1i75 s ASN 45 Ca -0.06 -1.80 0.00 0.00 0.21 0.00 0.00 52.86 51.21 1i75 s ASN 45 Cb 0.11 -2.22 0.00 0.00 -0.55 0.00 0.00 41.25 38.59 1i75 s ASN 45 CO 0.86 -0.87 0.60 0.18 -2.79 0.00 0.00 177.10 175.08 1i75 n LEU 46 N 5.28 0.02 -0.67 3.21 4.77 -1.26 -2.47 117.00 125.88 1i75 n LEU 46 Ca -0.12 -0.01 0.08 0.00 -0.03 0.00 0.00 56.01 55.93 1i75 n LEU 46 Cb 0.40 -0.01 0.07 0.00 -2.33 0.00 0.00 43.42 41.55 1i75 n LEU 46 CO 0.53 0.01 0.51 0.54 -1.33 0.00 0.00 177.39 177.65 1i75 n ARG 47 N -0.47 1.35 -3.69 3.23 1.74 -1.26 -4.89 116.66 112.67 1i75 n ARG 47 Ca 0.00 -1.50 -0.21 0.00 -0.77 0.00 0.00 57.85 55.37 1i75 n ARG 47 Cb 0.01 -1.32 -0.04 0.00 -1.02 0.00 0.00 32.46 30.09 1i75 n ARG 47 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1i75 s LEU 48 N -1.42 3.43 -0.08 0.55 1.02 -1.03 -1.25 118.68 119.91 1i75 s LEU 48 Ca 0.20 -0.69 -0.30 0.00 0.02 0.00 0.00 54.13 53.36 1i75 s LEU 48 Cb 0.14 -2.06 -0.04 0.00 0.02 0.00 0.00 46.19 44.25 1i75 s LEU 48 CO 0.21 -0.54 1.35 -0.31 0.02 0.00 0.00 176.35 177.08 1i75 s TYR 49 N -2.43 2.80 -0.35 0.29 2.02 -0.31 -4.83 117.35 114.53 1i75 s TYR 49 Ca 0.45 0.88 0.23 0.00 -0.37 0.00 0.00 57.07 58.26 1i75 s TYR 49 Cb -0.04 -3.59 0.11 0.00 -0.40 0.00 0.00 41.96 38.04 1i75 s TYR 49 CO 0.27 -2.15 1.15 0.00 -1.57 0.00 0.00 175.55 173.26 1i75 n GLY 51 N 1.21 1.30 3.69 0.00 0.00 -1.25 -4.64 105.19 105.52 1i75 n GLY 51 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1i75 n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i75 n GLY 52 N -0.21 0.47 2.72 -0.02 0.00 -0.63 -4.34 105.19 103.19 1i75 n GLY 52 Ca 0.00 0.17 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 1i75 n GLY 52 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1i75 n ASP 53 N 0.14 -1.38 0.11 1.61 3.85 -0.58 -3.99 116.55 116.31 1i75 n ASP 53 Ca 0.07 -2.35 -0.02 0.00 -0.71 0.00 0.00 54.79 51.78 1i75 n ASP 53 Cb 0.40 2.41 0.20 0.00 -1.35 0.00 0.00 41.12 42.78 1i75 n ASP 53 CO 0.00 0.00 0.00 -0.50 -1.01 0.00 0.00 177.20 175.69 1i75 h TRP 54 N 1.77 0.18 -0.22 2.11 6.55 -1.45 -2.01 115.95 122.89 1i75 h TRP 54 Ca -0.23 -0.06 -0.02 0.00 0.95 0.00 0.00 58.89 59.53 1i75 h TRP 54 Cb 0.93 -0.04 -0.01 0.00 -0.86 0.00 0.00 29.16 29.18 1i75 h TRP 54 CO 0.00 0.63 0.07 0.37 -1.05 0.00 0.00 178.44 178.46 1i75 h GLN 55 N 0.12 0.31 -0.37 0.49 5.75 -1.89 -1.46 115.11 118.05 1i75 h GLN 55 Ca 0.00 -0.04 -0.16 0.00 -0.15 0.00 0.00 58.65 58.31 1i75 h GLN 55 Cb 0.95 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 29.43 1i75 h GLN 55 CO 0.07 0.28 -0.39 0.78 -2.65 0.00 0.00 178.83 176.92 1i75 h GLY 56 N 0.48 0.97 0.81 2.39 0.00 -1.44 -0.63 103.07 105.66 1i75 h GLY 56 Ca 0.08 -0.99 -0.04 0.00 0.00 0.00 0.00 47.33 46.37 1i75 h GLY 56 CO -0.01 0.90 -0.03 -2.22 0.00 0.00 0.00 176.54 175.18 1i75 h ILE 57 N 0.73 1.28 -0.60 2.60 2.04 -1.38 -1.33 117.51 120.86 1i75 h ILE 57 Ca 0.06 -0.99 0.12 0.00 1.00 0.00 0.00 64.86 65.05 1i75 h ILE 57 Cb 0.97 1.52 -0.09 0.00 -0.74 0.00 0.00 36.82 38.48 1i75 h ILE 57 CO 0.09 0.30 0.07 0.40 0.00 0.00 0.00 178.15 179.02 1i75 h ILE 58 N 0.11 0.58 -0.87 -0.67 2.04 -1.08 0.04 117.51 117.66 1i75 h ILE 58 Ca 0.05 -0.07 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 1i75 h ILE 58 Cb 0.47 0.37 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 1i75 h ILE 58 CO 0.02 0.03 0.46 0.78 0.00 0.00 0.00 178.15 179.45 1i75 h ASN 59 N 0.19 1.11 1.56 1.72 2.35 -0.93 -0.53 115.58 121.04 1i75 h ASN 59 Ca 0.31 -0.11 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 1i75 h ASN 59 Cb 0.49 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1i75 h ASN 59 CO -0.45 0.90 0.00 0.11 -1.65 0.00 0.00 177.43 176.34 1i75 h LYS 60 N 1.23 0.00 -0.00 0.81 1.79 -0.45 -0.63 116.57 119.32 1i75 h LYS 60 Ca 0.31 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.73 1i75 h LYS 60 Cb 0.05 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.70 1i75 h LYS 60 CO -0.05 0.00 -0.18 0.82 -1.08 0.00 0.00 179.45 178.97 1i75 h ILE 61 N 0.00 1.57 -0.21 1.86 2.04 -0.33 -2.59 117.51 119.86 1i75 h ILE 61 Ca 0.00 -1.93 0.04 0.00 1.00 0.00 0.00 64.86 63.98 1i75 h ILE 61 Cb 0.78 2.81 -0.04 0.00 -0.74 0.00 0.00 36.82 39.63 1i75 h ILE 61 CO 0.00 0.52 -0.07 0.78 0.00 0.00 0.00 178.15 179.38 1i75 h ASN 62 N -0.59 -0.24 -0.01 1.72 2.35 -0.99 -2.61 115.58 115.21 1i75 h ASN 62 Ca -0.02 0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1i75 h ASN 62 Cb 0.95 0.15 0.00 0.00 0.05 0.00 0.00 38.32 39.47 1i75 h ASN 62 CO 0.04 -0.09 0.00 -0.90 -1.65 0.00 0.00 177.43 174.82 1i75 n ASP 63 N -5.22 0.08 0.00 5.81 5.68 -0.25 -4.89 116.55 117.75 1i75 n ASP 63 Ca -0.02 -1.56 0.00 0.00 -0.50 0.00 0.00 54.79 52.71 1i75 n ASP 63 Cb 0.15 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.12 1i75 n ASP 63 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1i75 n GLY 64 N 0.74 0.78 0.04 6.12 0.00 -0.98 -4.95 105.19 106.94 1i75 n GLY 64 Ca 0.11 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 1i75 n GLY 64 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1i75 h TYR 65 N 0.00 -0.00 0.01 1.61 3.20 -1.75 -0.41 116.97 119.62 1i75 h TYR 65 Ca 0.00 -0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.75 1i75 h TYR 65 Cb 0.00 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.28 1i75 h TYR 65 CO 0.00 0.07 -0.46 -0.07 -1.64 0.00 0.00 178.16 176.06 1i75 h LEU 66 N -0.07 0.39 -1.31 2.82 4.07 -1.75 -3.25 115.31 116.20 1i75 h LEU 66 Ca -0.00 -0.78 -0.05 0.00 0.08 0.00 0.00 57.88 57.13 1i75 h LEU 66 Cb 0.07 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.68 1i75 h LEU 66 CO 0.00 1.12 -0.23 0.71 -1.08 0.00 0.00 178.44 178.96 1i75 h THR 67 N -0.30 0.65 0.00 0.22 1.35 -1.80 -2.69 112.91 110.33 1i75 h THR 67 Ca -0.06 -1.04 -0.08 0.00 -0.55 0.00 0.00 66.41 64.69 1i75 h THR 67 Cb 1.20 1.67 -0.01 0.00 -1.73 0.00 0.00 68.15 69.28 1i75 h THR 67 CO 0.09 0.23 -0.36 1.23 -0.25 0.00 0.00 175.52 176.46 1i75 h GLY 68 N 1.68 0.00 1.84 5.82 0.00 -1.14 -2.04 103.07 109.23 1i75 h GLY 68 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1i75 h GLY 68 CO 0.03 0.00 -0.10 -0.13 0.00 0.00 0.00 176.54 176.34 1i75 n MET 69 N -3.48 0.12 -0.55 4.80 0.00 -1.02 -4.70 117.12 112.29 1i75 n MET 69 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 57.70 57.78 1i75 n MET 69 Cb 0.52 -1.62 0.00 0.00 0.00 0.00 0.00 33.22 32.11 1i75 n MET 69 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1i75 n GLY 70 N 1.42 0.70 3.75 -5.12 0.00 -0.77 -2.92 105.19 102.26 1i75 n GLY 70 Ca 0.06 -0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 1i75 n GLY 70 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i75 s ILE 71 N -2.00 2.83 0.00 -0.61 -1.09 -1.19 -4.49 121.20 114.64 1i75 s ILE 71 Ca 0.00 0.75 0.00 0.00 -2.23 0.00 0.00 60.65 59.17 1i75 s ILE 71 Cb 0.00 -3.48 0.00 0.00 -1.58 0.00 0.00 42.46 37.40 1i75 s ILE 71 CO 0.00 0.14 0.77 0.35 -1.23 0.00 0.00 174.94 174.97 1i75 n THR 72 N 1.75 0.59 -3.66 2.92 -2.24 -0.58 -4.72 114.28 108.33 1i75 n THR 72 Ca 0.04 -0.64 -0.14 0.00 -2.27 0.00 0.00 64.05 61.04 1i75 n THR 72 Cb 0.42 0.76 -0.08 0.00 -2.10 0.00 0.00 70.33 69.32 1i75 n THR 72 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1i75 s ALA 73 N -0.59 -1.45 0.10 6.98 0.00 -0.90 -1.19 121.76 124.71 1i75 s ALA 73 Ca 0.00 1.58 0.09 0.00 0.00 0.00 0.00 51.96 53.62 1i75 s ALA 73 Cb 0.00 -0.84 -0.04 0.00 0.00 0.00 0.00 23.12 22.24 1i75 s ALA 73 CO 0.00 -0.29 -0.20 0.96 0.00 0.00 0.00 175.76 176.24 1i75 s ILE 74 N 0.12 2.70 -0.20 0.00 -4.36 -0.12 -1.05 121.20 118.28 1i75 s ILE 74 Ca -0.02 -1.46 0.01 0.00 -0.26 0.00 0.00 60.65 58.93 1i75 s ILE 74 Cb -0.04 -2.20 0.03 0.00 1.25 0.00 0.00 42.46 41.50 1i75 s ILE 74 CO 0.02 0.17 -0.18 0.86 0.24 0.00 0.00 174.94 176.05 1i75 s TRP 75 N -1.06 2.90 0.38 1.37 -0.00 0.33 -0.60 118.94 122.25 1i75 s TRP 75 Ca 0.16 -1.81 0.08 0.00 -0.00 0.00 0.00 56.10 54.53 1i75 s TRP 75 Cb -0.10 -1.92 -0.05 0.00 -0.00 0.00 0.00 33.47 31.40 1i75 s TRP 75 CO 0.08 -0.83 0.16 0.96 -0.00 0.00 0.00 176.95 177.32 1i75 s ILE 76 N 1.24 2.66 0.78 5.86 -4.36 -0.63 0.04 121.20 126.80 1i75 s ILE 76 Ca 0.02 -1.70 -0.14 0.00 -0.26 0.00 0.00 60.65 58.57 1i75 s ILE 76 Cb -0.15 -2.97 0.07 0.00 1.25 0.00 0.00 42.46 40.66 1i75 s ILE 76 CO -0.11 -0.10 1.19 -0.44 0.24 0.00 0.00 174.94 175.73 1i75 s SER 77 N -3.88 3.82 0.18 4.36 0.01 -1.22 -2.12 113.70 114.86 1i75 s SER 77 Ca 0.40 2.32 -0.33 0.00 1.31 0.00 0.00 55.95 59.65 1i75 s SER 77 Cb 0.00 -2.58 -0.13 0.00 0.21 0.00 0.00 66.02 63.52 1i75 s SER 77 CO 0.23 -2.51 1.68 1.67 0.41 0.00 0.00 173.24 174.71 1i75 n GLN 78 N -3.16 2.55 0.00 12.44 7.27 -1.26 -4.42 117.38 130.79 1i75 n GLN 78 Ca 0.13 0.92 0.14 0.00 0.07 0.00 0.00 57.00 58.26 1i75 n GLN 78 Cb 0.51 -2.74 0.57 0.00 2.41 0.00 0.00 30.24 30.98 1i75 n GLN 78 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 1i75 n PRO 79 N 3.87 0.37 -2.16 3.69 -0.04 -1.26 -4.75 135.00 134.72 1i75 n PRO 79 Ca 0.17 -0.11 -0.32 0.00 -0.04 0.00 0.00 63.50 63.20 1i75 n PRO 79 Cb 0.33 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.28 1i75 n PRO 79 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1i75 s VAL 80 N -2.71 4.53 0.19 0.52 -7.23 -1.26 -1.16 120.40 113.28 1i75 s VAL 80 Ca 0.22 1.06 -0.32 0.00 -1.81 0.00 0.00 61.98 61.12 1i75 s VAL 80 Cb 0.19 -3.74 -0.12 0.00 0.56 0.00 0.00 36.38 33.27 1i75 s VAL 80 CO 0.53 -0.85 1.72 1.21 -0.31 0.00 0.00 175.10 177.40 1i75 n GLU 81 N -2.08 2.69 -3.49 4.82 2.13 -0.14 -3.48 120.64 121.09 1i75 n GLU 81 Ca 0.07 0.97 -0.20 0.00 0.66 0.00 0.00 57.16 58.65 1i75 n GLU 81 Cb 0.54 -2.81 -0.02 0.00 0.27 0.00 0.00 31.44 29.41 1i75 n GLU 81 CO 0.00 0.00 0.00 -0.80 -0.41 0.00 0.00 177.13 175.92 1i75 s ASN 82 N 1.34 5.22 0.63 4.31 -0.87 -1.26 -0.98 114.94 123.33 1i75 s ASN 82 Ca 0.77 -0.64 -0.17 0.00 -1.57 0.00 0.00 52.86 51.24 1i75 s ASN 82 Cb -0.53 -0.66 -0.01 0.00 -0.02 0.00 0.00 41.25 40.03 1i75 s ASN 82 CO 0.34 -0.63 1.19 0.27 -2.57 0.00 0.00 177.10 175.70 1i75 s ILE 83 N -2.42 2.65 -1.44 0.60 -4.36 -0.65 -4.67 121.20 110.90 1i75 s ILE 83 Ca 0.48 0.37 0.24 0.00 -0.26 0.00 0.00 60.65 61.49 1i75 s ILE 83 Cb -0.05 -3.05 0.06 0.00 1.25 0.00 0.00 42.46 40.66 1i75 s ILE 83 CO 0.29 -0.12 1.33 -1.22 0.24 0.00 0.00 174.94 175.45 1i75 n TYR 84 N -1.94 0.00 -2.10 1.37 4.01 -1.26 -4.58 117.16 112.66 1i75 n TYR 84 Ca 0.13 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.49 1i75 n TYR 84 Cb 0.50 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 39.41 1i75 n TYR 84 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1i75 s SER 85 N -2.73 6.05 -0.32 7.72 0.01 -1.26 -5.00 113.70 118.16 1i75 s SER 85 Ca 0.16 2.51 -0.11 0.00 1.31 0.00 0.00 55.95 59.83 1i75 s SER 85 Cb 0.18 -2.62 -0.02 0.00 0.21 0.00 0.00 66.02 63.77 1i75 s SER 85 CO 0.64 -1.02 0.20 -0.69 0.41 0.00 0.00 173.24 172.78 1i75 s VAL 86 N -1.40 5.00 -0.18 3.43 1.01 -1.26 -4.57 120.40 122.44 1i75 s VAL 86 Ca 0.63 -0.24 -0.10 0.00 0.00 0.00 0.00 61.98 62.26 1i75 s VAL 86 Cb -0.34 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 1i75 s VAL 86 CO 0.42 0.06 0.16 -0.63 0.00 0.00 0.00 175.10 175.11 1i75 s ILE 87 N 1.68 5.40 -0.37 2.22 1.01 0.05 -4.86 121.20 126.33 1i75 s ILE 87 Ca 0.06 0.25 -0.17 0.00 0.00 0.00 0.00 60.65 60.79 1i75 s ILE 87 Cb -0.17 -3.49 0.00 0.00 0.01 0.00 0.00 42.46 38.82 1i75 s ILE 87 CO 0.09 0.46 0.42 0.21 0.00 0.00 0.00 174.94 176.12 1i75 s ASN 88 N 0.16 6.22 -0.38 3.58 3.84 -1.26 0.52 114.94 127.62 1i75 s ASN 88 Ca 0.10 -0.34 -0.06 0.00 0.21 0.00 0.00 52.86 52.78 1i75 s ASN 88 Cb -0.11 -2.22 0.07 0.00 -0.55 0.00 0.00 41.25 38.44 1i75 s ASN 88 CO -0.00 -0.46 0.17 -0.31 -2.79 0.00 0.00 177.10 173.71 1i75 s TYR 89 N 2.15 3.38 -1.40 0.43 4.12 0.10 -4.71 117.35 121.42 1i75 s TYR 89 Ca 0.14 -1.82 -0.03 0.00 0.02 0.00 0.00 57.07 55.38 1i75 s TYR 89 Cb -0.16 -2.75 0.02 0.00 -1.52 0.00 0.00 41.96 37.55 1i75 s TYR 89 CO 0.13 -0.85 0.64 0.43 0.02 0.00 0.00 175.55 175.91 1i75 n SER 90 N 4.75 -1.46 0.00 2.29 7.64 -1.26 -1.85 113.62 123.73 1i75 n SER 90 Ca -0.09 -0.90 0.00 0.00 1.01 0.00 0.00 58.87 58.90 1i75 n SER 90 Cb 0.43 -3.58 0.00 0.00 -1.01 0.00 0.00 64.21 60.05 1i75 n SER 90 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1i75 n GLY 91 N -1.73 2.93 3.72 0.23 0.00 -1.26 -5.03 105.19 104.05 1i75 n GLY 91 Ca -0.24 -0.76 -0.41 0.00 0.00 0.00 0.00 46.02 44.61 1i75 n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i75 s VAL 92 N 0.00 4.56 0.43 1.61 0.11 -0.77 -4.95 120.40 121.39 1i75 s VAL 92 Ca 0.00 2.05 -0.21 0.00 -2.93 0.00 0.00 61.98 60.89 1i75 s VAL 92 Cb 0.00 -4.31 -0.10 0.00 -1.53 0.00 0.00 36.38 30.44 1i75 s VAL 92 CO 0.00 0.28 0.97 0.20 -3.33 0.00 0.00 175.10 173.21 1i75 s ASN 93 N 0.24 6.86 -0.01 3.54 0.01 -1.26 0.01 114.94 124.34 1i75 s ASN 93 Ca 0.48 1.75 -0.00 0.00 -0.71 0.00 0.00 52.86 54.38 1i75 s ASN 93 Cb -0.23 -2.55 0.01 0.00 0.41 0.00 0.00 41.25 38.89 1i75 s ASN 93 CO 0.30 -0.41 0.01 0.20 -1.51 0.00 0.00 177.10 175.68 1i75 s ASN 94 N -2.08 0.02 0.43 -1.22 0.01 0.18 -4.69 114.94 107.59 1i75 s ASN 94 Ca 0.62 0.01 0.03 0.00 -0.71 0.00 0.00 52.86 52.81 1i75 s ASN 94 Cb -0.11 -0.02 -0.03 0.00 0.41 0.00 0.00 41.25 41.50 1i75 s ASN 94 CO 0.15 -0.04 0.07 0.42 -1.51 0.00 0.00 177.10 176.19 1i75 s THR 95 N 0.29 1.00 -0.06 1.60 -4.23 -0.38 -0.77 115.64 113.09 1i75 s THR 95 Ca -0.02 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.49 1i75 s THR 95 Cb -0.04 -2.41 0.06 0.00 1.34 0.00 0.00 72.50 71.45 1i75 s THR 95 CO -0.01 0.00 1.56 0.00 -0.54 0.00 0.00 174.62 175.63 1i75 n ALA 96 N -1.00 3.56 0.15 3.99 0.00 -1.26 -4.58 120.51 121.37 1i75 n ALA 96 Ca -0.10 -0.34 0.14 0.00 0.00 0.00 0.00 53.44 53.14 1i75 n ALA 96 Cb 0.66 -1.07 0.69 0.00 0.00 0.00 0.00 19.45 19.73 1i75 n ALA 96 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 1i75 h TYR 97 N 0.62 0.00 0.00 0.00 -0.00 -1.88 -0.51 116.97 115.20 1i75 h TYR 97 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.80 1i75 h TYR 97 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.82 1i75 h TYR 97 CO 0.27 0.00 -0.03 -2.39 -0.00 0.00 0.00 178.16 176.00 1i75 n HIS 98 N -4.39 0.22 -0.52 0.10 1.44 -1.26 -4.51 115.22 106.30 1i75 n HIS 98 Ca 0.03 0.06 0.00 0.00 -2.01 0.00 0.00 57.72 55.80 1i75 n HIS 98 Cb 0.32 -0.59 0.00 0.00 0.12 0.00 0.00 29.99 29.84 1i75 n HIS 98 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1i75 n GLY 99 N 1.45 1.44 0.00 -1.39 0.00 -0.20 -4.47 105.19 102.02 1i75 n GLY 99 Ca 0.07 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.22 1i75 n GLY 99 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1i75 n TYR 100 N -2.00 0.00 -3.40 1.61 4.01 -1.26 -4.52 117.16 111.60 1i75 n TYR 100 Ca 0.00 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.36 1i75 n TYR 100 Cb 0.00 -0.35 -0.04 0.00 -0.31 0.00 0.00 39.34 38.64 1i75 n TYR 100 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 1i75 n TRP 101 N -1.35 3.83 -2.24 -0.72 8.01 -1.26 -4.83 117.44 118.87 1i75 n TRP 101 Ca 0.11 -3.72 -0.36 0.00 -1.31 0.00 0.00 57.50 52.21 1i75 n TRP 101 Cb 0.24 -1.17 -0.00 0.00 -2.01 0.00 0.00 31.31 28.37 1i75 n TRP 101 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1i75 s ALA 102 N -1.89 2.84 0.00 6.99 0.00 -0.96 -1.64 121.76 127.10 1i75 s ALA 102 Ca 0.31 0.90 0.00 0.00 0.00 0.00 0.00 51.96 53.17 1i75 s ALA 102 Cb -0.01 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.73 1i75 s ALA 102 CO -0.04 -0.73 0.00 2.89 0.00 0.00 0.00 175.76 177.88 1i75 n ARG 103 N -0.87 2.49 -3.51 0.00 1.85 -0.15 -3.82 116.66 112.64 1i75 n ARG 103 Ca 0.09 0.00 -0.17 0.00 -1.00 0.00 0.00 57.85 56.78 1i75 n ARG 103 Cb 0.49 -0.82 -0.13 0.00 -1.05 0.00 0.00 32.46 30.95 1i75 n ARG 103 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1i75 s ASP 104 N -2.08 1.10 0.00 2.89 3.68 -0.89 -1.22 116.67 120.15 1i75 s ASP 104 Ca 0.00 -0.04 0.29 0.00 2.13 0.00 0.00 52.55 54.93 1i75 s ASP 104 Cb 0.00 0.48 1.69 0.00 -1.45 0.00 0.00 42.92 43.64 1i75 s ASP 104 CO 0.00 -0.31 2.05 0.49 0.13 0.00 0.00 175.17 177.53 1i75 n PHE 105 N 5.33 0.00 0.25 -5.34 3.01 -1.26 -2.34 117.46 117.11 1i75 n PHE 105 Ca -0.05 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.48 1i75 n PHE 105 Cb 0.50 -0.03 0.12 0.00 -0.01 0.00 0.00 39.48 40.06 1i75 n PHE 105 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1i75 n LYS 106 N -1.03 1.81 -4.40 -1.08 5.02 -1.26 -4.90 118.16 112.32 1i75 n LYS 106 Ca 0.21 -1.74 -0.20 0.00 -2.02 0.00 0.00 58.31 54.56 1i75 n LYS 106 Cb 0.11 -1.31 -0.10 0.00 -0.02 0.00 0.00 35.03 33.71 1i75 n LYS 106 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1i75 s LYS 107 N -1.13 1.48 0.43 1.97 1.02 -1.20 -4.88 119.74 117.43 1i75 s LYS 107 Ca 0.23 -1.75 -0.02 0.00 0.02 0.00 0.00 55.97 54.45 1i75 s LYS 107 Cb 0.14 -0.99 -0.02 0.00 -0.52 0.00 0.00 37.83 36.43 1i75 s LYS 107 CO 0.19 -0.00 0.68 0.95 -0.92 0.00 0.00 175.35 176.25 1i75 s THR 108 N -3.13 4.69 -0.41 2.17 -4.23 -1.26 -0.97 115.64 112.50 1i75 s THR 108 Ca 0.29 -0.22 -0.29 0.00 -1.18 0.00 0.00 61.69 60.30 1i75 s THR 108 Cb 0.04 -3.75 0.02 0.00 1.34 0.00 0.00 72.50 70.16 1i75 s THR 108 CO 0.11 -0.60 1.09 0.21 -0.54 0.00 0.00 174.62 174.89 1i75 s ASN 109 N -4.12 6.73 0.40 3.99 3.84 -0.31 -3.37 114.94 122.10 1i75 s ASN 109 Ca 0.45 0.66 0.28 0.00 0.21 0.00 0.00 52.86 54.47 1i75 s ASN 109 Cb -0.10 -2.54 1.34 0.00 -0.55 0.00 0.00 41.25 39.40 1i75 s ASN 109 CO 0.40 -1.08 1.86 1.55 -2.79 0.00 0.00 177.10 177.04 1i75 h PRO 110 N 8.76 0.00 -0.03 0.43 0.13 -1.92 -1.02 132.00 138.35 1i75 h PRO 110 Ca -0.22 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.82 1i75 h PRO 110 Cb 1.06 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.18 1i75 h PRO 110 CO 1.08 0.00 -0.40 0.00 -0.23 0.00 0.00 178.00 178.44 1i75 h ALA 111 N 2.10 1.27 0.15 -0.56 0.00 -1.92 -3.09 119.26 117.20 1i75 h ALA 111 Ca 0.00 -0.38 -0.32 0.00 0.00 0.00 0.00 54.91 54.21 1i75 h ALA 111 Cb 0.24 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1i75 h ALA 111 CO 0.00 0.53 -1.59 1.88 0.00 0.00 0.00 179.25 180.08 1i75 h TYR 112 N 0.06 0.57 0.00 0.00 0.05 -1.47 -3.43 116.97 112.74 1i75 h TYR 112 Ca 0.00 -0.41 0.00 0.00 0.05 0.00 0.00 58.73 58.37 1i75 h TYR 112 Cb 0.74 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.46 1i75 h TYR 112 CO 0.00 1.47 0.00 0.41 -1.05 0.00 0.00 178.16 179.00 1i75 n GLY 113 N 1.72 -1.55 4.00 3.88 0.00 -0.92 -1.15 105.19 111.17 1i75 n GLY 113 Ca -0.19 -1.43 -0.23 0.00 0.00 0.00 0.00 46.02 44.18 1i75 n GLY 113 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1i75 s THR 114 N -2.23 2.18 0.31 2.61 -4.23 -1.26 -3.94 115.64 109.08 1i75 s THR 114 Ca 0.00 -0.68 0.01 0.00 -1.18 0.00 0.00 61.69 59.84 1i75 s THR 114 Cb 0.00 -2.51 0.28 0.00 1.34 0.00 0.00 72.50 71.61 1i75 s THR 114 CO 0.00 0.00 1.93 0.24 -0.54 0.00 0.00 174.62 176.25 1i75 h MET 115 N -0.35 0.98 -0.40 3.99 2.86 -1.98 -0.88 114.93 119.16 1i75 h MET 115 Ca -0.36 -0.06 -0.15 0.00 -2.06 0.00 0.00 59.70 57.08 1i75 h MET 115 Cb 1.27 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.70 1i75 h MET 115 CO 0.41 0.65 -0.32 0.37 1.06 0.00 0.00 176.91 179.08 1i75 h GLN 116 N 1.01 0.92 -0.87 1.72 5.75 -1.98 -1.53 115.11 120.12 1i75 h GLN 116 Ca 0.36 -0.46 0.01 0.00 -0.15 0.00 0.00 58.65 58.41 1i75 h GLN 116 Cb 0.13 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.64 1i75 h GLN 116 CO -0.12 1.11 0.57 -0.44 -2.65 0.00 0.00 178.83 177.30 1i75 h ASP 117 N 0.74 1.01 -0.32 -0.69 3.32 -1.80 0.68 116.42 119.36 1i75 h ASP 117 Ca 0.07 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.05 1i75 h ASP 117 Cb 0.90 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 1i75 h ASP 117 CO 0.08 0.74 0.05 0.15 -1.72 0.00 0.00 179.24 178.54 1i75 h PHE 118 N 1.18 0.57 -0.68 4.55 3.04 -0.99 -0.61 116.94 124.00 1i75 h PHE 118 Ca 0.32 -0.08 0.03 0.00 3.98 0.00 0.00 57.97 62.22 1i75 h PHE 118 Cb -0.12 -0.16 -0.04 0.00 2.56 0.00 0.00 35.95 38.19 1i75 h PHE 118 CO 0.00 0.62 0.43 0.87 -2.02 0.00 0.00 178.31 178.20 1i75 h LYS 119 N 0.36 0.80 -0.59 1.11 1.57 -1.10 -0.59 116.57 118.13 1i75 h LYS 119 Ca 0.10 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.76 1i75 h LYS 119 Cb 0.36 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.46 1i75 h LYS 119 CO 0.01 0.53 0.10 -0.91 -0.57 0.00 0.00 179.45 178.61 1i75 h ASN 120 N 0.83 0.90 -0.67 0.86 2.35 -0.71 -0.78 115.58 118.36 1i75 h ASN 120 Ca 0.28 -0.19 -0.08 0.00 -0.55 0.00 0.00 56.30 55.76 1i75 h ASN 120 Cb 0.03 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.14 1i75 h ASN 120 CO -0.11 0.90 0.11 0.25 -1.65 0.00 0.00 177.43 176.93 1i75 h LEU 121 N 0.90 1.06 -0.07 1.61 5.85 -0.31 -1.21 115.31 123.13 1i75 h LEU 121 Ca 0.19 -0.26 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 1i75 h LEU 121 Cb 0.38 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 1i75 h LEU 121 CO 0.01 1.05 0.04 0.40 -0.34 0.00 0.00 178.44 179.59 1i75 h ILE 122 N 1.02 1.10 -0.44 4.05 1.08 -0.67 -1.25 117.51 122.40 1i75 h ILE 122 Ca 0.20 -0.29 -0.10 0.00 -0.39 0.00 0.00 64.86 64.28 1i75 h ILE 122 Cb 0.44 1.16 -0.02 0.00 -3.07 0.00 0.00 36.82 35.33 1i75 h ILE 122 CO 0.01 0.08 -0.14 0.44 -0.69 0.00 0.00 178.15 177.86 1i75 h ASP 123 N 0.01 0.82 -0.26 1.72 3.32 -1.10 -0.59 116.42 120.34 1i75 h ASP 123 Ca 0.03 -0.26 -0.06 0.00 0.02 0.00 0.00 57.03 56.75 1i75 h ASP 123 Cb 0.10 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 1i75 h ASP 123 CO -0.00 0.97 -0.09 0.74 -1.72 0.00 0.00 179.24 179.13 1i75 h THR 124 N 0.73 1.29 -0.20 0.35 2.02 -1.11 -0.80 112.91 115.19 1i75 h THR 124 Ca 0.12 -1.14 0.02 0.00 0.77 0.00 0.00 66.41 66.18 1i75 h THR 124 Cb 0.64 1.50 -0.02 0.00 -1.74 0.00 0.00 68.15 68.53 1i75 h THR 124 CO 0.05 0.36 0.06 0.00 0.37 0.00 0.00 175.52 176.35 1i75 h ALA 125 N 0.75 0.22 -0.51 6.16 0.00 -1.16 -2.23 119.26 122.48 1i75 h ALA 125 Ca 0.06 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1i75 h ALA 125 Cb 0.58 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1i75 h ALA 125 CO 0.03 -0.36 0.02 0.45 0.00 0.00 0.00 179.25 179.39 1i75 h HIS 126 N 0.15 0.89 0.00 0.00 -0.00 -0.94 0.73 115.15 115.98 1i75 h HIS 126 Ca 0.09 -0.12 -0.02 0.00 -0.00 0.00 0.00 60.37 60.31 1i75 h HIS 126 Cb 0.06 -0.24 -0.00 0.00 -0.00 0.00 0.00 27.41 27.22 1i75 h HIS 126 CO -0.12 0.81 -0.12 0.00 -0.00 0.00 0.00 177.93 178.49 1i75 h ALA 127 N 1.23 1.58 -0.46 2.45 0.00 -0.98 -1.21 119.26 121.87 1i75 h ALA 127 Ca 0.15 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1i75 h ALA 127 Cb 0.44 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 1i75 h ALA 127 CO 0.02 0.15 0.06 0.72 0.00 0.00 0.00 179.25 180.19 1i75 n HIS 128 N -4.08 1.61 -3.84 0.00 8.25 -0.63 -4.97 115.22 111.55 1i75 n HIS 128 Ca -0.02 -0.98 -0.28 0.00 -0.26 0.00 0.00 57.72 56.18 1i75 n HIS 128 Cb 0.20 -0.47 0.03 0.00 1.12 0.00 0.00 29.99 30.87 1i75 n HIS 128 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1i75 n ASN 129 N -0.19 -4.07 -4.29 0.41 3.02 -0.46 -5.01 115.26 104.68 1i75 n ASN 129 Ca 0.29 -0.77 -0.33 0.00 -0.03 0.00 0.00 54.58 53.74 1i75 n ASN 129 Cb 1.10 -4.01 -0.15 0.00 -0.61 0.00 0.00 39.78 36.11 1i75 n ASN 129 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1i75 s ILE 130 N -3.39 2.62 0.43 2.41 1.01 0.16 -4.75 121.20 119.68 1i75 s ILE 130 Ca 0.50 -0.81 -0.15 0.00 0.00 0.00 0.00 60.65 60.19 1i75 s ILE 130 Cb -0.25 -2.07 -0.08 0.00 0.01 0.00 0.00 42.46 40.06 1i75 s ILE 130 CO 0.82 0.53 0.87 -0.54 0.00 0.00 0.00 174.94 176.62 1i75 s LYS 131 N 0.51 3.96 -0.16 2.79 1.02 -0.33 -3.20 119.74 124.33 1i75 s LYS 131 Ca -0.11 0.79 0.01 0.00 0.02 0.00 0.00 55.97 56.69 1i75 s LYS 131 Cb -0.16 -2.27 0.02 0.00 -0.52 0.00 0.00 37.83 34.89 1i75 s LYS 131 CO 0.04 -0.08 -0.20 0.08 -0.92 0.00 0.00 175.35 174.27 1i75 s VAL 132 N -2.36 2.00 -0.14 3.17 1.01 -1.26 -0.95 120.40 121.87 1i75 s VAL 132 Ca 0.56 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 61.59 1i75 s VAL 132 Cb -0.10 -1.79 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 1i75 s VAL 132 CO 0.25 0.53 0.02 -0.63 0.00 0.00 0.00 175.10 175.28 1i75 s ILE 133 N 1.14 4.42 -0.04 2.22 1.01 0.23 -1.00 121.20 129.18 1i75 s ILE 133 Ca 0.01 -0.18 0.02 0.00 0.00 0.00 0.00 60.65 60.49 1i75 s ILE 133 Cb -0.14 -2.93 -0.03 0.00 0.01 0.00 0.00 42.46 39.37 1i75 s ILE 133 CO -0.09 0.53 -0.07 0.27 0.00 0.00 0.00 174.94 175.59 1i75 s ILE 134 N -0.18 3.69 0.56 2.92 -4.36 -0.97 -1.60 121.20 121.27 1i75 s ILE 134 Ca 0.06 -0.58 -0.20 0.00 -0.26 0.00 0.00 60.65 59.67 1i75 s ILE 134 Cb -0.12 -2.54 -0.04 0.00 1.25 0.00 0.00 42.46 41.00 1i75 s ILE 134 CO 0.02 0.53 1.25 -1.81 0.24 0.00 0.00 174.94 175.17 1i75 s ASP 135 N -1.02 5.30 -0.10 4.36 1.01 -0.90 -0.85 116.67 124.47 1i75 s ASP 135 Ca 0.14 2.51 -0.05 0.00 0.71 0.00 0.00 52.55 55.86 1i75 s ASP 135 Cb -0.11 -2.61 0.05 0.00 1.01 0.00 0.00 42.92 41.26 1i75 s ASP 135 CO 0.04 -1.53 0.23 0.12 0.21 0.00 0.00 175.17 174.24 1i75 s PHE 136 N -1.48 -0.31 -0.62 4.23 2.19 -0.04 -4.27 117.98 117.68 1i75 s PHE 136 Ca 0.74 0.75 0.06 0.00 0.33 0.00 0.00 56.93 58.81 1i75 s PHE 136 Cb -0.34 -0.01 0.21 0.00 -1.31 0.00 0.00 43.02 41.57 1i75 s PHE 136 CO 0.38 -0.24 0.57 0.00 1.83 0.00 0.00 175.22 177.76 1i75 n ALA 137 N 4.48 3.50 1.92 11.12 0.00 -1.26 -1.38 120.51 138.89 1i75 n ALA 137 Ca -0.21 -4.36 0.08 0.00 0.00 0.00 0.00 53.44 48.95 1i75 n ALA 137 Cb 0.52 -0.93 0.49 0.00 0.00 0.00 0.00 19.45 19.53 1i75 n ALA 137 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1i75 n PRO 138 N 1.61 0.96 0.11 0.00 -0.04 -1.26 -3.85 135.00 132.52 1i75 n PRO 138 Ca 0.25 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.67 1i75 n PRO 138 Cb 0.40 -1.27 0.05 0.00 -0.04 0.00 0.00 33.50 32.65 1i75 n PRO 138 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 1i75 h ASN 139 N 0.00 0.00 -5.08 3.54 -1.24 -1.93 -3.45 115.58 107.42 1i75 h ASN 139 Ca 0.00 0.00 0.02 0.00 0.71 0.00 0.00 56.30 57.03 1i75 h ASN 139 Cb 0.00 0.00 -0.07 0.00 0.73 0.00 0.00 38.32 38.98 1i75 h ASN 139 CO 0.00 0.77 0.10 -1.38 -1.29 0.00 0.00 177.43 175.63 1i75 s HIS 140 N -3.25 -0.03 0.00 0.67 -3.43 -1.25 -1.32 115.29 106.69 1i75 s HIS 140 Ca -0.00 -0.38 0.00 0.00 -0.80 0.00 0.00 55.06 53.88 1i75 s HIS 140 Cb 0.12 0.51 0.00 0.00 -1.43 0.00 0.00 32.58 31.77 1i75 s HIS 140 CO 0.79 -1.11 0.00 0.25 -2.00 0.00 0.00 174.74 172.66 1i75 n THR 141 N -0.42 0.00 -4.14 -5.38 -2.24 -0.89 -4.67 114.28 96.55 1i75 n THR 141 Ca -0.05 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.60 1i75 n THR 141 Cb 0.61 -0.69 -0.07 0.00 -2.10 0.00 0.00 70.33 68.08 1i75 n THR 141 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1i75 s SER 142 N -0.97 0.64 0.18 3.42 1.04 -1.25 -2.26 113.70 114.50 1i75 s SER 142 Ca 0.00 -1.40 -0.33 0.00 0.48 0.00 0.00 55.95 54.70 1i75 s SER 142 Cb 0.00 0.55 -0.14 0.00 0.10 0.00 0.00 66.02 66.53 1i75 s SER 142 CO 0.00 -1.10 1.43 -2.65 0.98 0.00 0.00 173.24 171.91 1i75 n PRO 143 N -0.46 1.87 -3.73 4.02 -0.02 -1.26 -1.41 135.00 134.01 1i75 n PRO 143 Ca 0.02 0.67 -0.13 0.00 -2.02 0.00 0.00 63.50 62.04 1i75 n PRO 143 Cb 0.63 -2.35 -0.08 0.00 -0.02 0.00 0.00 33.50 31.68 1i75 n PRO 143 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1i75 s ALA 144 N 0.34 -0.81 -0.10 3.55 0.00 -0.38 -3.44 121.76 120.93 1i75 s ALA 144 Ca 0.75 0.21 -0.01 0.00 0.00 0.00 0.00 51.96 52.91 1i75 s ALA 144 Cb -0.72 0.23 0.03 0.00 0.00 0.00 0.00 23.12 22.66 1i75 s ALA 144 CO 0.45 -0.36 -0.04 0.45 0.00 0.00 0.00 175.76 176.26 1i75 s SER 145 N -1.77 1.98 0.35 0.00 0.15 -1.26 -4.80 113.70 108.35 1i75 s SER 145 Ca -0.08 -0.24 0.17 0.00 0.70 0.00 0.00 55.95 56.50 1i75 s SER 145 Cb -0.02 -0.67 0.55 0.00 -1.71 0.00 0.00 66.02 64.18 1i75 s SER 145 CO -0.00 -0.16 1.68 0.77 1.20 0.00 0.00 173.24 176.72 1i75 h SER 146 N 8.24 0.00 0.23 5.45 4.64 -1.96 -3.16 113.55 127.00 1i75 h SER 146 Ca -0.25 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 60.87 1i75 h SER 146 Cb 1.13 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1i75 h SER 146 CO 0.34 0.43 -0.81 0.44 -0.87 0.00 0.00 176.83 176.36 1i75 h ASP 147 N 0.00 0.56 -3.75 4.97 3.45 -1.95 -3.37 116.42 116.33 1i75 h ASP 147 Ca -0.00 -0.39 -0.70 0.00 0.43 0.00 0.00 57.03 56.36 1i75 h ASP 147 Cb 1.00 -0.17 -0.34 0.00 -0.56 0.00 0.00 39.33 39.26 1i75 h ASP 147 CO 0.06 1.16 -0.45 -0.62 -1.57 0.00 0.00 179.24 177.81 1i75 s ASP 148 N -7.03 5.29 0.06 6.45 2.15 -1.19 -4.94 116.67 117.46 1i75 s ASP 148 Ca -0.06 -2.38 0.13 0.00 0.43 0.00 0.00 52.55 50.67 1i75 s ASP 148 Cb 0.10 -1.86 0.57 0.00 -0.30 0.00 0.00 42.92 41.43 1i75 s ASP 148 CO 0.86 -0.48 1.41 -0.81 -0.17 0.00 0.00 175.17 175.98 1i75 n PRO 149 N 4.15 0.04 0.00 4.34 -0.04 -1.24 -1.89 135.00 140.35 1i75 n PRO 149 Ca 0.02 0.35 0.13 0.00 -0.04 0.00 0.00 63.50 63.95 1i75 n PRO 149 Cb 0.40 -1.58 0.35 0.00 -0.04 0.00 0.00 33.50 32.63 1i75 n PRO 149 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1i75 n SER 150 N -1.65 0.70 -4.73 3.54 3.41 -1.26 -4.48 113.62 109.16 1i75 n SER 150 Ca 0.02 -0.52 -0.42 0.00 -0.26 0.00 0.00 58.87 57.69 1i75 n SER 150 Cb 0.14 0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 64.20 1i75 n SER 150 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1i75 s PHE 151 N -2.74 3.27 0.00 7.33 2.19 -0.79 -4.83 117.98 122.41 1i75 s PHE 151 Ca 0.18 1.12 0.00 0.00 0.33 0.00 0.00 56.93 58.56 1i75 s PHE 151 Cb 0.19 -3.62 0.00 0.00 -1.31 0.00 0.00 43.02 38.28 1i75 s PHE 151 CO 0.60 -2.03 0.00 0.00 1.83 0.00 0.00 175.22 175.61 1i75 n ALA 152 N 3.27 0.00 -1.41 11.12 0.00 -1.26 -1.64 120.51 130.59 1i75 n ALA 152 Ca 0.09 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.52 1i75 n ALA 152 Cb 0.43 0.00 0.20 0.00 0.00 0.00 0.00 19.45 20.08 1i75 n ALA 152 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1i75 n GLU 153 N 14.00 1.87 -4.06 0.00 1.02 -1.26 -4.96 120.64 127.25 1i75 n GLU 153 Ca 0.00 -3.14 -0.32 0.00 -0.02 0.00 0.00 57.16 53.68 1i75 n GLU 153 Cb 0.00 -1.77 -0.00 0.00 -0.02 0.00 0.00 31.44 29.65 1i75 n GLU 153 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1i75 n ASN 154 N -1.08 -3.50 -1.52 1.62 4.05 -0.65 -1.78 115.26 112.39 1i75 n ASN 154 Ca 0.29 -0.91 -0.16 0.00 0.45 0.00 0.00 54.58 54.24 1i75 n ASN 154 Cb 0.94 -3.28 -0.06 0.00 1.23 0.00 0.00 39.78 38.60 1i75 n ASN 154 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1i75 n GLY 155 N -1.58 1.40 3.77 8.20 0.00 -1.22 -1.04 105.19 114.71 1i75 n GLY 155 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1i75 n GLY 155 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i75 n ARG 156 N -2.11 2.64 -4.87 1.61 1.74 -0.73 -4.56 116.66 110.39 1i75 n ARG 156 Ca -0.16 0.93 -0.33 0.00 -0.77 0.00 0.00 57.85 57.52 1i75 n ARG 156 Cb 0.53 -2.65 -0.14 0.00 -1.02 0.00 0.00 32.46 29.18 1i75 n ARG 156 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1i75 s LEU 157 N -1.78 2.70 0.19 0.55 2.96 -0.26 -4.53 118.68 118.50 1i75 s LEU 157 Ca 0.55 -0.26 0.09 0.00 -0.22 0.00 0.00 54.13 54.29 1i75 s LEU 157 Cb -0.48 -1.57 -0.04 0.00 0.50 0.00 0.00 46.19 44.59 1i75 s LEU 157 CO 0.62 0.27 -0.19 -0.31 -1.32 0.00 0.00 176.35 175.42 1i75 s TYR 158 N -0.30 1.92 -0.33 5.38 2.02 -0.36 0.05 117.35 125.73 1i75 s TYR 158 Ca 0.02 -0.45 0.01 0.00 -0.37 0.00 0.00 57.07 56.28 1i75 s TYR 158 Cb -0.13 -0.93 0.10 0.00 -0.40 0.00 0.00 41.96 40.60 1i75 s TYR 158 CO 0.03 0.40 0.08 0.34 -1.57 0.00 0.00 175.55 174.82 1i75 s ASP 159 N -2.83 4.34 -1.53 2.29 2.15 0.14 -4.38 116.67 116.86 1i75 s ASP 159 Ca 0.19 -1.88 -0.11 0.00 0.43 0.00 0.00 52.55 51.17 1i75 s ASP 159 Cb -0.05 -1.20 0.08 0.00 -0.30 0.00 0.00 42.92 41.45 1i75 s ASP 159 CO 0.08 -0.40 0.81 -3.20 -0.17 0.00 0.00 175.17 172.29 1i75 n ASN 160 N 4.56 -3.22 0.00 -0.34 2.85 -1.26 -1.42 115.26 116.43 1i75 n ASN 160 Ca 0.01 -0.88 0.00 0.00 -0.11 0.00 0.00 54.58 53.59 1i75 n ASN 160 Cb 0.42 -3.46 0.00 0.00 1.24 0.00 0.00 39.78 37.97 1i75 n ASN 160 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1i75 n GLY 161 N -1.64 2.79 3.66 8.20 0.00 -1.26 -5.03 105.19 111.90 1i75 n GLY 161 Ca -0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 1i75 n GLY 161 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1i75 s ASN 162 N -1.23 6.67 -0.05 1.61 2.47 -0.51 -5.02 114.94 118.88 1i75 s ASN 162 Ca 0.00 0.81 -0.30 0.00 0.42 0.00 0.00 52.86 53.79 1i75 s ASN 162 Cb 0.00 -2.34 -0.05 0.00 -1.45 0.00 0.00 41.25 37.40 1i75 s ASN 162 CO 0.00 -0.28 1.52 -0.22 -3.72 0.00 0.00 177.10 174.41 1i75 s LEU 163 N 1.96 4.30 -0.15 3.21 0.20 -1.26 0.27 118.68 127.21 1i75 s LEU 163 Ca 0.28 2.14 -0.10 0.00 0.69 0.00 0.00 54.13 57.14 1i75 s LEU 163 Cb -0.16 -3.54 -0.24 0.00 -0.43 0.00 0.00 46.19 41.82 1i75 s LEU 163 CO 0.10 -0.84 0.27 0.18 -0.29 0.00 0.00 176.35 175.77 1i75 n LEU 164 N 6.43 2.46 0.00 -0.68 4.77 0.11 -4.91 117.00 125.18 1i75 n LEU 164 Ca 0.15 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 1i75 n LEU 164 Cb 0.43 -1.06 0.00 0.00 -2.33 0.00 0.00 43.42 40.46 1i75 n LEU 164 CO 0.60 0.72 0.00 0.61 -1.33 0.00 0.00 177.39 177.99 1i75 n GLY 165 N 1.86 1.59 3.53 -0.72 0.00 -1.09 -4.99 105.19 105.37 1i75 n GLY 165 Ca -0.34 -0.90 -0.29 0.00 0.00 0.00 0.00 46.02 44.49 1i75 n GLY 165 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i75 n GLY 166 N -0.57 3.35 0.13 -0.02 0.00 -1.26 -1.10 105.19 105.71 1i75 n GLY 166 Ca 0.00 -2.35 -0.11 0.00 0.00 0.00 0.00 46.02 43.56 1i75 n GLY 166 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1i75 h TYR 167 N 1.08 0.40 -3.46 1.61 3.20 -1.35 -3.36 116.97 115.08 1i75 h TYR 167 Ca -0.38 -0.24 -0.54 0.00 3.14 0.00 0.00 58.73 60.71 1i75 h TYR 167 Cb 1.22 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 39.42 1i75 h TYR 167 CO 0.00 1.09 0.18 0.99 -1.64 0.00 0.00 178.16 178.78 1i75 s THR 168 N -3.08 4.62 -1.23 1.81 2.01 -1.26 -3.96 115.64 114.55 1i75 s THR 168 Ca -0.04 1.68 -0.05 0.00 0.31 0.00 0.00 61.69 63.60 1i75 s THR 168 Cb 0.09 -4.14 0.01 0.00 0.01 0.00 0.00 72.50 68.47 1i75 s THR 168 CO 0.85 0.40 1.05 -3.20 -0.69 0.00 0.00 174.62 173.03 1i75 n ASN 169 N 2.49 -4.24 -4.19 3.53 5.15 -1.26 -4.89 115.26 111.84 1i75 n ASN 169 Ca -0.03 -0.55 -0.43 0.00 -0.60 0.00 0.00 54.58 52.97 1i75 n ASN 169 Cb 0.50 -4.88 0.00 0.00 -0.53 0.00 0.00 39.78 34.87 1i75 n ASN 169 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1i75 n ASP 170 N -2.92 4.59 0.25 1.20 4.64 -1.25 -4.74 116.55 118.32 1i75 n ASP 170 Ca -0.13 -2.91 0.17 0.00 -1.38 0.00 0.00 54.79 50.54 1i75 n ASP 170 Cb 0.61 -1.67 0.70 0.00 -1.04 0.00 0.00 41.12 39.71 1i75 n ASP 170 CO 0.00 0.00 0.00 0.71 -0.82 0.00 0.00 177.20 177.09 1i75 h THR 171 N 4.73 0.00 -0.01 5.18 1.35 -1.90 -2.46 112.91 119.80 1i75 h THR 171 Ca 0.48 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.94 1i75 h THR 171 Cb 0.76 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.52 1i75 h THR 171 CO 1.61 0.00 -0.38 0.00 -0.25 0.00 0.00 175.52 176.50 1i75 n GLN 172 N -2.91 0.86 -3.71 4.72 6.02 -1.26 -4.99 117.38 116.11 1i75 n GLN 172 Ca 0.00 -0.60 -0.28 0.00 -0.01 0.00 0.00 57.00 56.11 1i75 n GLN 172 Cb 0.26 -1.49 0.03 0.00 1.02 0.00 0.00 30.24 30.07 1i75 n GLN 172 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1i75 n ASN 173 N -0.55 -4.00 0.18 1.08 3.02 -0.93 -4.87 115.26 109.20 1i75 n ASN 173 Ca 0.10 -0.97 0.13 0.00 -0.03 0.00 0.00 54.58 53.81 1i75 n ASN 173 Cb 0.38 -3.51 0.36 0.00 -0.61 0.00 0.00 39.78 36.41 1i75 n ASN 173 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1i75 h LEU 174 N -1.84 0.00 -8.79 3.41 3.38 -1.91 -3.44 115.31 106.12 1i75 h LEU 174 Ca -0.65 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 56.92 1i75 h LEU 174 Cb 1.36 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.96 1i75 h LEU 174 CO 0.51 0.00 -0.73 -0.36 0.09 0.00 0.00 178.44 177.96 1i75 s PHE 175 N -3.26 1.53 0.11 1.13 0.40 -1.26 -0.77 117.98 115.87 1i75 s PHE 175 Ca 0.07 -0.64 -0.24 0.00 -0.60 0.00 0.00 56.93 55.52 1i75 s PHE 175 Cb 0.08 -0.74 -0.07 0.00 0.51 0.00 0.00 43.02 42.81 1i75 s PHE 175 CO 0.60 0.25 0.75 -1.01 0.70 0.00 0.00 175.22 176.50 1i75 s HIS 176 N -3.05 3.83 -0.49 0.36 3.76 -0.03 -4.72 115.29 114.96 1i75 s HIS 176 Ca 0.20 1.53 0.08 0.00 -0.15 0.00 0.00 55.06 56.72 1i75 s HIS 176 Cb 0.00 -2.75 0.33 0.00 1.11 0.00 0.00 32.58 31.27 1i75 s HIS 176 CO 0.04 0.44 0.82 0.72 -0.85 0.00 0.00 174.74 175.90 1i75 n HIS 177 N 2.06 2.14 -0.02 1.40 8.25 -1.26 -4.58 115.22 123.22 1i75 n HIS 177 Ca -0.05 -3.91 0.02 0.00 -0.26 0.00 0.00 57.72 53.52 1i75 n HIS 177 Cb 0.49 -0.46 0.05 0.00 1.12 0.00 0.00 29.99 31.19 1i75 n HIS 177 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1i75 n TYR 178 N 0.16 0.13 -1.69 4.41 4.01 -1.26 -5.11 117.16 117.81 1i75 n TYR 178 Ca 0.28 -0.40 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 1i75 n TYR 178 Cb 0.51 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.51 1i75 n TYR 178 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i75 n GLY 179 N -0.08 -1.94 3.93 2.72 0.00 -1.26 -4.95 105.19 103.60 1i75 n GLY 179 Ca 0.04 -1.78 -0.29 0.00 0.00 0.00 0.00 46.02 43.98 1i75 n GLY 179 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i75 s GLY 180 N -0.46 1.99 0.52 -0.02 0.00 -1.26 -1.59 107.32 106.48 1i75 s GLY 180 Ca 0.00 -0.90 -0.18 0.00 0.00 0.00 0.00 44.72 43.63 1i75 s GLY 180 CO 0.00 -0.89 1.02 -1.08 0.00 0.00 0.00 173.10 172.16 1i75 s THR 181 N -1.62 3.98 -1.39 0.90 -1.32 -0.09 -4.73 115.64 111.37 1i75 s THR 181 Ca 0.35 1.10 0.13 0.00 -1.21 0.00 0.00 61.69 62.06 1i75 s THR 181 Cb -0.12 -3.49 0.20 0.00 -1.51 0.00 0.00 72.50 67.58 1i75 s THR 181 CO 0.28 -0.40 1.07 -0.90 -2.21 0.00 0.00 174.62 172.46 1i75 n ASP 182 N -1.34 2.48 -1.59 8.08 3.85 -1.26 -4.79 116.55 121.98 1i75 n ASP 182 Ca 0.08 -1.73 -0.18 0.00 -0.71 0.00 0.00 54.79 52.26 1i75 n ASP 182 Cb 0.53 -0.11 -0.05 0.00 -1.35 0.00 0.00 41.12 40.14 1i75 n ASP 182 CO 0.00 0.00 0.00 0.49 -1.01 0.00 0.00 177.20 176.68 1i75 n PHE 183 N 0.71 -0.31 -0.01 2.11 3.01 -1.26 -4.89 117.46 116.81 1i75 n PHE 183 Ca 0.10 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.39 1i75 n PHE 183 Cb 0.38 -3.20 -0.06 0.00 -0.01 0.00 0.00 39.48 36.58 1i75 n PHE 183 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1i75 h SER 184 N 0.00 0.90 -3.73 4.37 4.64 -1.94 -3.46 113.55 114.33 1i75 h SER 184 Ca -0.38 -0.60 -0.39 0.00 -0.47 0.00 0.00 61.79 59.96 1i75 h SER 184 Cb 1.21 -0.27 -0.14 0.00 -0.31 0.00 0.00 62.40 62.89 1i75 h SER 184 CO 0.52 1.39 -0.68 0.42 -0.87 0.00 0.00 176.83 177.61 1i75 s THR 185 N -3.71 1.19 0.16 2.95 -4.23 -1.26 -5.01 115.64 105.73 1i75 s THR 185 Ca -0.10 -2.06 -0.12 0.00 -1.18 0.00 0.00 61.69 58.22 1i75 s THR 185 Cb 0.09 -2.22 0.05 0.00 1.34 0.00 0.00 72.50 71.76 1i75 s THR 185 CO 0.90 -0.44 1.68 0.40 -0.54 0.00 0.00 174.62 176.61 1i75 h ILE 186 N 2.53 1.24 -0.36 2.99 2.04 -1.94 -0.91 117.51 123.10 1i75 h ILE 186 Ca -0.38 -0.84 0.05 0.00 1.00 0.00 0.00 64.86 64.69 1i75 h ILE 186 Cb 1.22 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 38.01 1i75 h ILE 186 CO 0.64 0.31 0.11 -0.08 0.00 0.00 0.00 178.15 179.13 1i75 h GLU 187 N 0.76 0.24 -0.45 2.37 4.81 -1.96 -1.86 114.58 118.49 1i75 h GLU 187 Ca 0.17 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.44 1i75 h GLU 187 Cb 0.31 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.59 1i75 h GLU 187 CO -0.00 0.16 0.17 -0.97 -0.73 0.00 0.00 179.01 177.63 1i75 h ASN 188 N 0.25 0.18 0.78 1.04 -0.73 -1.86 -2.28 115.58 112.95 1i75 h ASN 188 Ca 0.16 0.05 0.00 0.00 1.87 0.00 0.00 56.30 58.39 1i75 h ASN 188 Cb 0.16 0.03 0.00 0.00 0.27 0.00 0.00 38.32 38.78 1i75 h ASN 188 CO -0.18 0.14 0.00 1.23 -0.37 0.00 0.00 177.43 178.24 1i75 h GLY 189 N 0.34 0.00 0.71 1.57 0.00 -0.59 -2.63 103.07 102.48 1i75 h GLY 189 Ca 0.21 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.25 1i75 h GLY 189 CO -0.21 0.00 -1.44 -2.22 0.00 0.00 0.00 176.54 172.67 1i75 h ILE 190 N 0.00 1.08 0.00 2.60 2.04 -0.78 -3.42 117.51 119.03 1i75 h ILE 190 Ca 0.00 -2.47 0.00 0.00 1.00 0.00 0.00 64.86 63.39 1i75 h ILE 190 Cb 0.39 2.81 0.00 0.00 -0.74 0.00 0.00 36.82 39.28 1i75 h ILE 190 CO 0.00 0.75 -0.98 -1.22 0.00 0.00 0.00 178.15 176.70 1i75 n TYR 191 N -3.85 0.00 -3.60 1.37 4.01 -1.05 -4.65 117.16 109.39 1i75 n TYR 191 Ca -0.23 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.29 1i75 n TYR 191 Cb 0.95 -0.06 -0.01 0.00 -0.31 0.00 0.00 39.34 39.91 1i75 n TYR 191 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1i75 s LYS 192 N -2.76 3.40 0.34 -0.72 1.02 -0.99 -4.63 119.74 115.39 1i75 s LYS 192 Ca 0.05 -0.59 -0.27 0.00 0.02 0.00 0.00 55.97 55.17 1i75 s LYS 192 Cb 0.13 -2.77 -0.09 0.00 -0.52 0.00 0.00 37.83 34.58 1i75 s LYS 192 CO 0.73 0.22 1.14 -0.80 -0.92 0.00 0.00 175.35 175.73 1i75 s ASN 193 N -4.04 6.89 -0.39 2.83 0.01 -0.62 -4.57 114.94 115.04 1i75 s ASN 193 Ca 0.39 2.32 -0.28 0.00 -0.71 0.00 0.00 52.86 54.58 1i75 s ASN 193 Cb -0.09 -2.62 0.02 0.00 0.41 0.00 0.00 41.25 38.97 1i75 s ASN 193 CO 0.33 -0.41 1.04 -0.76 -1.51 0.00 0.00 177.10 175.78 1i75 s LEU 194 N -2.00 3.86 0.00 0.60 1.43 -1.26 -0.91 118.68 120.40 1i75 s LEU 194 Ca 0.51 0.66 0.00 0.00 -1.03 0.00 0.00 54.13 54.27 1i75 s LEU 194 Cb -0.31 -3.44 0.00 0.00 0.03 0.00 0.00 46.19 42.47 1i75 s LEU 194 CO 0.40 -1.00 0.00 -1.22 0.23 0.00 0.00 176.35 174.76 1i75 n TYR 195 N 7.17 0.00 -0.58 0.29 4.01 -1.26 -1.42 117.16 125.37 1i75 n TYR 195 Ca 0.10 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.90 1i75 n TYR 195 Cb 0.48 0.00 0.13 0.00 -0.31 0.00 0.00 39.34 39.64 1i75 n TYR 195 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1i75 n ASP 196 N 10.42 2.69 -4.70 7.72 5.75 -1.26 -4.79 116.55 132.38 1i75 n ASP 196 Ca 0.00 -2.56 -0.42 0.00 -0.01 0.00 0.00 54.79 51.80 1i75 n ASP 196 Cb 0.00 -0.29 -0.03 0.00 -1.03 0.00 0.00 41.12 39.77 1i75 n ASP 196 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1i75 s LEU 197 N -1.97 4.32 -0.29 -2.12 1.43 -0.51 -1.24 118.68 118.30 1i75 s LEU 197 Ca 0.23 1.89 -0.28 0.00 -1.03 0.00 0.00 54.13 54.94 1i75 s LEU 197 Cb 0.18 -3.57 -0.03 0.00 0.03 0.00 0.00 46.19 42.81 1i75 s LEU 197 CO 0.06 -0.52 1.91 0.00 0.23 0.00 0.00 176.35 178.04 1i75 s ALA 198 N 1.65 2.85 -0.10 4.21 0.00 -0.50 -4.19 121.76 125.68 1i75 s ALA 198 Ca 0.57 0.43 -0.30 0.00 0.00 0.00 0.00 51.96 52.66 1i75 s ALA 198 Cb -0.26 -4.02 -0.03 0.00 0.00 0.00 0.00 23.12 18.80 1i75 s ALA 198 CO 0.25 -2.64 1.38 0.34 0.00 0.00 0.00 175.76 175.09 1i75 s ASP 199 N 6.64 6.87 0.39 0.00 3.68 -1.26 -2.09 116.67 130.90 1i75 s ASP 199 Ca 0.86 1.92 -0.24 0.00 2.13 0.00 0.00 52.55 57.21 1i75 s ASP 199 Cb -0.26 -2.54 -0.09 0.00 -1.45 0.00 0.00 42.92 38.58 1i75 s ASP 199 CO 0.34 -0.78 1.05 -0.76 0.13 0.00 0.00 175.17 175.15 1i75 s LEU 200 N 3.30 4.15 -0.55 -1.34 1.43 -0.43 -0.85 118.68 124.39 1i75 s LEU 200 Ca 0.61 2.03 -0.17 0.00 -1.03 0.00 0.00 54.13 55.58 1i75 s LEU 200 Cb -0.27 -4.17 0.12 0.00 0.03 0.00 0.00 46.19 41.91 1i75 s LEU 200 CO 0.21 -0.47 0.55 0.21 0.23 0.00 0.00 176.35 177.08 1i75 s ASN 201 N -1.56 6.19 0.00 2.29 2.47 0.05 -4.64 114.94 119.75 1i75 s ASN 201 Ca 0.57 -1.72 0.24 0.00 0.42 0.00 0.00 52.86 52.38 1i75 s ASN 201 Cb -0.22 -2.23 1.13 0.00 -1.45 0.00 0.00 41.25 38.48 1i75 s ASN 201 CO 0.28 -0.91 1.80 1.41 -3.72 0.00 0.00 177.10 175.95 1i75 n HIS 202 N 5.48 0.00 0.87 0.43 8.25 -1.26 -2.04 115.22 126.95 1i75 n HIS 202 Ca -0.13 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.47 1i75 n HIS 202 Cb 0.41 -0.40 0.51 0.00 1.12 0.00 0.00 29.99 31.62 1i75 n HIS 202 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1i75 n ASN 203 N -1.40 0.31 -4.66 0.41 5.15 -1.26 -4.32 115.26 109.48 1i75 n ASN 203 Ca 0.09 0.45 -0.43 0.00 -0.60 0.00 0.00 54.58 54.09 1i75 n ASN 203 Cb 0.24 -0.50 -0.02 0.00 -0.53 0.00 0.00 39.78 38.97 1i75 n ASN 203 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1i75 s ASN 204 N -3.51 7.11 0.38 1.20 3.84 -0.87 -4.73 114.94 118.36 1i75 s ASN 204 Ca 0.12 1.42 0.11 0.00 0.21 0.00 0.00 52.86 54.73 1i75 s ASN 204 Cb 0.17 -2.54 0.89 0.00 -0.55 0.00 0.00 41.25 39.21 1i75 s ASN 204 CO 0.57 -0.65 1.88 0.28 -2.79 0.00 0.00 177.10 176.40 1i75 h SER 205 N 7.46 0.58 -0.60 -4.21 0.02 -1.88 -1.07 113.55 113.84 1i75 h SER 205 Ca -0.21 0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 60.71 1i75 h SER 205 Cb 1.07 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.51 1i75 h SER 205 CO 0.96 0.29 0.13 0.28 -1.14 0.00 0.00 176.83 177.35 1i75 h SER 206 N 0.61 0.93 -0.24 3.07 0.02 -1.94 -0.97 113.55 115.03 1i75 h SER 206 Ca 0.42 -0.25 -0.07 0.00 -0.84 0.00 0.00 61.79 61.06 1i75 h SER 206 Cb 0.75 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 1i75 h SER 206 CO -0.18 0.94 -0.12 0.58 -1.14 0.00 0.00 176.83 176.91 1i75 h VAL 207 N 0.89 1.30 0.15 2.27 2.07 -1.50 -1.11 116.25 120.32 1i75 h VAL 207 Ca 0.19 -1.19 0.01 0.00 0.82 0.00 0.00 66.70 66.53 1i75 h VAL 207 Cb 0.38 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.69 1i75 h VAL 207 CO 0.01 0.37 -0.22 -0.78 0.02 0.00 0.00 177.57 176.96 1i75 h ASP 208 N 0.23 -0.61 -0.65 0.57 1.82 -1.16 -1.67 116.42 114.94 1i75 h ASP 208 Ca 0.05 0.07 -0.07 0.00 -0.39 0.00 0.00 57.03 56.70 1i75 h ASP 208 Cb 0.62 0.23 -0.03 0.00 0.68 0.00 0.00 39.33 40.83 1i75 h ASP 208 CO 0.04 -0.32 0.16 0.58 -1.61 0.00 0.00 179.24 178.09 1i75 h VAL 209 N -0.44 1.26 -0.12 2.25 2.07 -1.20 -2.49 116.25 117.58 1i75 h VAL 209 Ca 0.02 -0.95 -0.01 0.00 0.82 0.00 0.00 66.70 66.59 1i75 h VAL 209 Cb 0.44 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1i75 h VAL 209 CO -0.10 0.36 0.06 0.22 0.02 0.00 0.00 177.57 178.13 1i75 h TYR 210 N 1.01 0.18 -0.02 1.57 3.20 -0.94 -0.05 116.97 121.92 1i75 h TYR 210 Ca 0.21 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.98 1i75 h TYR 210 Cb 0.36 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 1i75 h TYR 210 CO 0.03 0.24 -0.44 -0.07 -1.64 0.00 0.00 178.16 176.28 1i75 h LEU 211 N 0.06 0.04 -0.28 2.82 3.38 -1.30 -0.61 115.31 119.43 1i75 h LEU 211 Ca 0.04 -0.02 -0.21 0.00 0.09 0.00 0.00 57.88 57.79 1i75 h LEU 211 Cb 0.13 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1i75 h LEU 211 CO -0.00 0.48 -0.79 0.11 0.09 0.00 0.00 178.44 178.32 1i75 h LYS 212 N 0.03 0.54 -0.43 1.13 1.57 -1.24 -2.10 116.57 116.07 1i75 h LYS 212 Ca -0.00 -0.47 -0.11 0.00 -1.87 0.00 0.00 60.65 58.21 1i75 h LYS 212 Cb 0.79 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.19 1i75 h LYS 212 CO 0.06 1.09 -0.16 -0.44 -0.57 0.00 0.00 179.45 179.44 1i75 h ASP 213 N 0.36 0.81 -0.41 0.86 3.45 -0.81 -2.82 116.42 117.86 1i75 h ASP 213 Ca -0.05 -0.27 -0.06 0.00 0.43 0.00 0.00 57.03 57.08 1i75 h ASP 213 Cb 1.39 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 39.93 1i75 h ASP 213 CO 0.15 0.97 0.01 0.00 -1.57 0.00 0.00 179.24 178.80 1i75 h ALA 214 N 1.10 0.55 -0.30 3.45 0.00 -1.04 -2.42 119.26 120.60 1i75 h ALA 214 Ca 0.11 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 1i75 h ALA 214 Cb 0.66 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1i75 h ALA 214 CO 0.05 0.32 -0.24 0.97 0.00 0.00 0.00 179.25 180.34 1i75 h ILE 215 N 0.55 1.27 -0.75 0.00 6.09 -1.33 -2.36 117.51 120.98 1i75 h ILE 215 Ca 0.12 -1.30 -0.03 0.00 -1.37 0.00 0.00 64.86 62.29 1i75 h ILE 215 Cb 0.46 1.31 -0.04 0.00 0.47 0.00 0.00 36.82 39.02 1i75 h ILE 215 CO 0.02 0.42 0.37 0.11 -3.07 0.00 0.00 178.15 175.99 1i75 h LYS 216 N 0.51 1.07 -0.33 2.19 1.57 -1.41 -1.59 116.57 118.58 1i75 h LYS 216 Ca 0.07 -0.14 0.03 0.00 -1.87 0.00 0.00 60.65 58.74 1i75 h LYS 216 Cb 0.69 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 1i75 h LYS 216 CO 0.05 0.82 0.15 1.98 -0.57 0.00 0.00 179.45 181.88 1i75 h MET 217 N 1.06 0.31 -0.14 3.15 4.05 -0.91 0.17 114.93 122.62 1i75 h MET 217 Ca 0.26 -0.02 -0.08 0.00 -0.28 0.00 0.00 59.70 59.58 1i75 h MET 217 Cb 0.10 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 30.81 1i75 h MET 217 CO -0.03 0.21 -0.25 -1.49 0.23 0.00 0.00 176.91 175.57 1i75 h TRP 218 N 0.32 0.28 -0.47 1.39 4.06 -1.26 -2.08 115.95 118.20 1i75 h TRP 218 Ca 0.14 -0.05 -0.13 0.00 2.06 0.00 0.00 58.89 60.91 1i75 h TRP 218 Cb 0.07 -0.07 -0.01 0.00 -1.00 0.00 0.00 29.16 28.14 1i75 h TRP 218 CO -0.11 0.50 -0.23 -0.07 -3.56 0.00 0.00 178.44 174.97 1i75 h LEU 219 N 0.23 1.02 -2.14 -4.49 3.38 -0.75 -2.13 115.31 110.43 1i75 h LEU 219 Ca 0.04 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.59 1i75 h LEU 219 Cb 0.58 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 1i75 h LEU 219 CO 0.04 1.19 -0.06 0.44 0.09 0.00 0.00 178.44 180.14 1i75 h ASP 220 N 0.84 0.00 -0.03 -0.43 3.45 -0.29 -1.72 116.42 118.24 1i75 h ASP 220 Ca 0.11 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.57 1i75 h ASP 220 Cb 0.81 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.58 1i75 h ASP 220 CO 0.07 0.06 0.00 0.18 -1.57 0.00 0.00 179.24 177.98 1i75 n LEU 221 N -3.89 0.37 0.00 1.55 4.77 -0.80 -4.93 117.00 114.07 1i75 n LEU 221 Ca -0.03 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1i75 n LEU 221 Cb 0.16 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1i75 n LEU 221 CO 0.30 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 1i75 n GLY 222 N 0.88 0.90 3.75 -0.72 0.00 -0.65 -4.93 105.19 104.43 1i75 n GLY 222 Ca 0.15 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 1i75 n GLY 222 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1i75 s VAL 223 N -2.00 2.79 -0.61 1.61 -7.23 -1.20 -4.88 120.40 108.88 1i75 s VAL 223 Ca 0.00 0.42 0.11 0.00 -1.81 0.00 0.00 61.98 60.70 1i75 s VAL 223 Cb 0.00 -3.02 -0.09 0.00 0.56 0.00 0.00 36.38 33.83 1i75 s VAL 223 CO 0.00 -0.18 0.50 0.47 -0.31 0.00 0.00 175.10 175.58 1i75 n ASP 224 N -2.16 0.66 -3.65 4.85 8.00 -0.17 -4.89 116.55 119.20 1i75 n ASP 224 Ca 0.12 -0.83 -0.09 0.00 0.71 0.00 0.00 54.79 54.70 1i75 n ASP 224 Cb 0.51 0.89 -0.02 0.00 -0.02 0.00 0.00 41.12 42.48 1i75 n ASP 224 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1i75 s GLY 225 N -1.89 -0.34 -0.02 0.44 0.00 -1.09 -3.61 107.32 100.81 1i75 s GLY 225 Ca 0.05 0.11 0.00 0.00 0.00 0.00 0.00 44.72 44.89 1i75 s GLY 225 CO 0.40 0.04 0.01 -0.42 0.00 0.00 0.00 173.10 173.14 1i75 s ILE 226 N -3.78 0.03 -0.23 0.90 1.01 -0.28 -2.29 121.20 116.57 1i75 s ILE 226 Ca 0.07 0.11 -0.03 0.00 0.00 0.00 0.00 60.65 60.80 1i75 s ILE 226 Cb -0.03 -0.12 0.00 0.00 0.01 0.00 0.00 42.46 42.31 1i75 s ILE 226 CO -0.03 0.08 -0.06 -0.60 0.00 0.00 0.00 174.94 174.34 1i75 s ARG 227 N 0.75 3.22 -0.18 2.79 3.00 -0.03 -1.43 118.95 127.07 1i75 s ARG 227 Ca -0.07 -0.72 -0.17 0.00 -1.00 0.00 0.00 55.73 53.77 1i75 s ARG 227 Cb -0.10 -2.98 -0.04 0.00 0.00 0.00 0.00 34.95 31.84 1i75 s ARG 227 CO -0.02 -0.25 0.44 0.08 0.00 0.00 0.00 175.30 175.55 1i75 s VAL 228 N 1.43 5.18 0.31 7.11 1.01 0.16 -0.86 120.40 134.75 1i75 s VAL 228 Ca 0.05 0.81 -0.27 0.00 0.00 0.00 0.00 61.98 62.57 1i75 s VAL 228 Cb -0.15 -3.77 -0.10 0.00 0.00 0.00 0.00 36.38 32.37 1i75 s VAL 228 CO -0.04 0.26 0.97 -0.62 0.00 0.00 0.00 175.10 175.67 1i75 s ASP 229 N 0.94 7.31 -1.32 3.32 2.15 -0.48 -2.32 116.67 126.27 1i75 s ASP 229 Ca 0.22 1.93 -0.02 0.00 0.43 0.00 0.00 52.55 55.11 1i75 s ASP 229 Cb -0.15 -2.59 0.01 0.00 -0.30 0.00 0.00 42.92 39.89 1i75 s ASP 229 CO 0.09 -0.09 0.77 0.00 -0.17 0.00 0.00 175.17 175.76 1i75 n ALA 230 N 0.71 -1.92 0.27 3.66 0.00 -1.26 -4.64 120.51 117.34 1i75 n ALA 230 Ca 0.01 -0.11 0.13 0.00 0.00 0.00 0.00 53.44 53.47 1i75 n ALA 230 Cb 0.49 -2.32 0.78 0.00 0.00 0.00 0.00 19.45 18.40 1i75 n ALA 230 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1i75 h VAL 231 N -1.91 0.64 0.00 0.00 -1.51 -1.76 -0.46 116.25 111.24 1i75 h VAL 231 Ca -0.61 -0.28 0.00 0.00 -1.23 0.00 0.00 66.70 64.59 1i75 h VAL 231 Cb 1.36 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 31.69 1i75 h VAL 231 CO 0.57 0.07 0.00 1.17 -1.23 0.00 0.00 177.57 178.15 1i75 n LYS 232 N -3.86 0.05 -0.10 5.19 4.81 -1.26 -3.56 118.16 119.43 1i75 n LYS 232 Ca -0.02 0.34 0.05 0.00 -0.87 0.00 0.00 58.31 57.81 1i75 n LYS 232 Cb 0.16 -1.61 0.10 0.00 0.02 0.00 0.00 35.03 33.70 1i75 n LYS 232 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1i75 n HIS 233 N -1.71 0.17 -4.22 5.64 8.25 -0.18 -4.52 115.22 118.65 1i75 n HIS 233 Ca 0.03 -0.72 -0.19 0.00 -0.26 0.00 0.00 57.72 56.58 1i75 n HIS 233 Cb 0.16 -0.11 -0.12 0.00 1.12 0.00 0.00 29.99 31.04 1i75 n HIS 233 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1i75 s MET 234 N -1.86 0.96 0.19 -0.41 -1.94 -1.23 -4.37 119.30 110.63 1i75 s MET 234 Ca 0.19 -1.13 -0.32 0.00 -1.71 0.00 0.00 55.69 52.72 1i75 s MET 234 Cb 0.15 -0.91 -0.11 0.00 2.01 0.00 0.00 34.83 35.96 1i75 s MET 234 CO 0.04 0.19 1.71 -2.14 -0.01 0.00 0.00 175.02 174.81 1i75 s PRO 235 N -2.27 4.14 0.34 2.03 0.02 -1.26 -4.90 135.00 133.09 1i75 s PRO 235 Ca 0.05 2.57 0.06 0.00 0.02 0.00 0.00 61.00 63.69 1i75 s PRO 235 Cb -0.07 -3.15 0.60 0.00 0.02 0.00 0.00 34.50 31.90 1i75 s PRO 235 CO 0.03 -0.74 1.83 0.74 -0.33 0.00 0.00 177.00 178.53 1i75 h PHE 236 N 7.02 0.41 -0.30 6.54 0.04 -1.89 -0.71 116.94 128.05 1i75 h PHE 236 Ca -0.43 -0.06 -0.10 0.00 2.80 0.00 0.00 57.97 60.17 1i75 h PHE 236 Cb 1.20 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 39.23 1i75 h PHE 236 CO 0.66 0.53 -0.24 0.78 -0.60 0.00 0.00 178.31 179.43 1i75 h GLY 237 N 0.89 0.62 0.92 -1.45 0.00 -1.90 -0.55 103.07 101.60 1i75 h GLY 237 Ca 0.07 -0.52 -0.13 0.00 0.00 0.00 0.00 47.33 46.75 1i75 h GLY 237 CO 0.03 0.47 -0.37 -0.25 0.00 0.00 0.00 176.54 176.42 1i75 h TRP 238 N 0.51 0.76 -0.17 5.60 7.01 -1.53 -2.80 115.95 125.33 1i75 h TRP 238 Ca 0.07 -0.27 -0.03 0.00 2.11 0.00 0.00 58.89 60.78 1i75 h TRP 238 Cb 0.69 -0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 27.60 1i75 h TRP 238 CO 0.03 1.02 -0.01 1.96 -2.79 0.00 0.00 178.44 178.64 1i75 h GLN 239 N 0.28 0.24 -0.53 2.65 4.20 -0.96 -0.55 115.11 120.44 1i75 h GLN 239 Ca 0.01 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.60 1i75 h GLN 239 Cb 0.97 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.69 1i75 h GLN 239 CO 0.08 0.28 -0.00 -0.22 -0.67 0.00 0.00 178.83 178.30 1i75 h LYS 240 N 0.24 0.91 0.00 1.46 3.64 -0.96 -0.72 116.57 121.13 1i75 h LYS 240 Ca 0.06 -0.26 -0.12 0.00 -1.27 0.00 0.00 60.65 59.05 1i75 h LYS 240 Cb 0.19 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1i75 h LYS 240 CO 0.01 0.90 -0.58 0.66 -2.27 0.00 0.00 179.45 178.17 1i75 h SER 241 N 0.84 0.00 -0.14 4.20 4.64 -1.08 -0.39 113.55 121.62 1i75 h SER 241 Ca 0.16 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.46 1i75 h SER 241 Cb 0.50 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 1i75 h SER 241 CO 0.02 0.58 0.02 0.15 -0.87 0.00 0.00 176.83 176.74 1i75 h PHE 242 N 0.00 0.25 -0.80 4.77 3.57 -0.87 -1.22 116.94 122.65 1i75 h PHE 242 Ca -0.01 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.41 1i75 h PHE 242 Cb 1.03 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.67 1i75 h PHE 242 CO 0.00 0.42 0.33 0.52 -2.23 0.00 0.00 178.31 177.35 1i75 h MET 243 N 0.01 1.19 -0.19 1.11 2.86 -0.91 -1.40 114.93 117.60 1i75 h MET 243 Ca 0.04 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.46 1i75 h MET 243 Cb 0.30 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 1i75 h MET 243 CO 0.00 0.96 0.05 0.00 1.06 0.00 0.00 176.91 178.98 1i75 h ALA 244 N 1.19 1.74 -0.23 6.32 0.00 -0.98 0.11 119.26 127.41 1i75 h ALA 244 Ca 0.27 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 1i75 h ALA 244 Cb 0.21 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1i75 h ALA 244 CO -0.02 0.21 -0.01 1.15 0.00 0.00 0.00 179.25 180.57 1i75 h THR 245 N 0.27 1.26 0.21 0.00 2.02 -0.18 -1.27 112.91 115.22 1i75 h THR 245 Ca 0.07 -0.93 -0.01 0.00 0.77 0.00 0.00 66.41 66.31 1i75 h THR 245 Cb 0.10 1.42 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1i75 h THR 245 CO -0.00 0.29 -0.10 0.40 0.37 0.00 0.00 175.52 176.47 1i75 h ILE 246 N 0.17 0.86 -0.12 3.11 2.04 -0.90 -2.84 117.51 119.83 1i75 h ILE 246 Ca 0.06 -0.40 -0.06 0.00 1.00 0.00 0.00 64.86 65.46 1i75 h ILE 246 Cb 0.43 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1i75 h ILE 246 CO 0.01 0.09 -0.18 0.78 0.00 0.00 0.00 178.15 178.86 1i75 h ASN 247 N -0.48 0.19 0.49 1.72 -0.26 -0.78 -0.46 115.58 116.01 1i75 h ASN 247 Ca -0.03 -0.04 0.00 0.00 -0.56 0.00 0.00 56.30 55.67 1i75 h ASN 247 Cb 0.37 -0.05 0.00 0.00 -1.06 0.00 0.00 38.32 37.57 1i75 h ASN 247 CO 0.05 0.39 -0.32 0.59 -1.06 0.00 0.00 177.43 177.08 1i75 n ASN 248 N -4.24 0.54 -0.02 5.81 3.02 -0.48 -4.00 115.26 115.88 1i75 n ASN 248 Ca -0.01 -0.33 -0.02 0.00 -0.03 0.00 0.00 54.58 54.18 1i75 n ASN 248 Cb 0.30 0.07 -0.01 0.00 -0.61 0.00 0.00 39.78 39.53 1i75 n ASN 248 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i75 n TYR 249 N -1.23 0.00 -3.36 3.10 4.19 -0.71 -4.98 117.16 114.18 1i75 n TYR 249 Ca 0.09 0.00 -0.18 0.00 3.31 0.00 0.00 57.90 61.12 1i75 n TYR 249 Cb 0.33 -0.13 -0.08 0.00 0.49 0.00 0.00 39.34 39.95 1i75 n TYR 249 CO 0.00 0.00 0.00 0.15 0.91 0.00 0.00 176.86 177.92 1i75 s LYS 250 N -1.54 0.65 0.14 2.98 1.02 -0.26 -5.10 119.74 117.63 1i75 s LYS 250 Ca -0.07 -0.93 -0.31 0.00 0.02 0.00 0.00 55.97 54.67 1i75 s LYS 250 Cb 0.01 -0.76 -0.09 0.00 -0.52 0.00 0.00 37.83 36.47 1i75 s LYS 250 CO 0.11 -1.21 1.54 -1.25 -0.92 0.00 0.00 175.35 173.62 1i75 s PRO 251 N 1.35 4.24 0.07 -1.68 0.04 -1.18 -4.67 135.00 133.17 1i75 s PRO 251 Ca 0.18 2.29 0.01 0.00 0.04 0.00 0.00 61.00 63.51 1i75 s PRO 251 Cb -0.15 -3.24 -0.04 0.00 0.04 0.00 0.00 34.50 31.11 1i75 s PRO 251 CO -0.02 -0.59 -0.06 0.14 0.04 0.00 0.00 177.00 176.52 1i75 s VAL 252 N 1.35 0.50 0.06 -0.36 -7.23 -1.26 -4.48 120.40 108.98 1i75 s VAL 252 Ca 0.69 -1.71 -0.31 0.00 -1.81 0.00 0.00 61.98 58.84 1i75 s VAL 252 Cb -0.42 -1.39 -0.10 0.00 0.56 0.00 0.00 36.38 35.03 1i75 s VAL 252 CO 0.31 -0.81 1.90 0.33 -0.31 0.00 0.00 175.10 176.52 1i75 n PHE 253 N 0.32 2.52 -4.63 2.82 -0.00 0.14 -4.85 117.46 113.78 1i75 n PHE 253 Ca -0.15 -0.23 -0.24 0.00 -0.00 0.00 0.00 57.45 56.84 1i75 n PHE 253 Cb 0.60 -2.75 -0.16 0.00 -0.00 0.00 0.00 39.48 37.16 1i75 n PHE 253 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.76 177.75 1i75 s THR 254 N 3.66 1.14 0.04 -2.13 2.01 -1.26 -1.13 115.64 117.97 1i75 s THR 254 Ca 0.87 -0.54 -0.01 0.00 0.31 0.00 0.00 61.69 62.32 1i75 s THR 254 Cb -0.49 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 70.98 1i75 s THR 254 CO 0.42 0.34 -0.03 0.72 -0.69 0.00 0.00 174.62 175.38 1i75 s PHE 255 N 0.20 0.43 0.36 4.92 -0.12 -0.52 -2.06 117.98 121.19 1i75 s PHE 255 Ca -0.05 -0.87 0.07 0.00 -0.05 0.00 0.00 56.93 56.03 1i75 s PHE 255 Cb -0.11 -0.32 -0.07 0.00 -0.63 0.00 0.00 43.02 41.89 1i75 s PHE 255 CO 0.02 -0.31 -0.02 0.20 -0.05 0.00 0.00 175.22 175.06 1i75 s GLY 256 N -2.38 2.25 -0.26 1.99 0.00 -0.11 -0.67 107.32 108.14 1i75 s GLY 256 Ca -0.01 -2.15 -0.09 0.00 0.00 0.00 0.00 44.72 42.47 1i75 s GLY 256 CO -0.07 -2.00 0.11 1.85 0.00 0.00 0.00 173.10 173.00 1i75 s GLU 257 N -3.71 3.68 -0.22 2.90 2.12 -0.98 -0.77 118.70 121.72 1i75 s GLU 257 Ca 0.34 -0.47 -0.01 0.00 0.36 0.00 0.00 54.97 55.19 1i75 s GLU 257 Cb 0.07 -3.44 0.06 0.00 0.26 0.00 0.00 34.13 31.08 1i75 s GLU 257 CO 0.16 -0.22 -0.00 -0.46 -0.54 0.00 0.00 175.26 174.20 1i75 s TRP 258 N 1.65 1.76 0.29 5.30 -0.11 -1.26 -3.33 118.94 123.23 1i75 s TRP 258 Ca 0.06 -1.37 -0.29 0.00 1.22 0.00 0.00 56.10 55.72 1i75 s TRP 258 Cb -0.16 -1.36 -0.10 0.00 -1.50 0.00 0.00 33.47 30.35 1i75 s TRP 258 CO 0.06 -0.71 1.16 0.12 -4.62 0.00 0.00 176.95 172.95 1i75 s PHE 259 N 1.61 3.43 0.03 5.86 5.36 -1.26 -4.80 117.98 128.20 1i75 s PHE 259 Ca -0.02 1.62 0.04 0.00 -0.96 0.00 0.00 56.93 57.61 1i75 s PHE 259 Cb -0.18 -3.39 -0.02 0.00 -0.34 0.00 0.00 43.02 39.09 1i75 s PHE 259 CO -0.08 -0.92 -0.13 -0.51 -1.46 0.00 0.00 175.22 172.12 1i75 s LEU 260 N -1.52 2.13 0.00 6.12 1.43 -1.26 -5.12 118.68 120.46 1i75 s LEU 260 Ca 0.46 -0.39 -0.01 0.00 -1.03 0.00 0.00 54.13 53.16 1i75 s LEU 260 Cb -0.34 -0.56 0.08 0.00 0.03 0.00 0.00 46.19 45.40 1i75 s LEU 260 CO 0.44 0.04 0.54 0.61 0.23 0.00 0.00 176.35 178.21 1i75 n GLY 261 N 2.14 0.54 3.71 -3.19 0.00 -1.26 -4.93 105.19 102.20 1i75 n GLY 261 Ca -0.17 -1.97 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 1i75 n GLY 261 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i75 s VAL 262 N -1.59 2.38 -1.21 1.61 1.01 -1.26 -2.09 120.40 119.26 1i75 s VAL 262 Ca 0.35 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.46 1i75 s VAL 262 Cb -0.02 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.28 1i75 s VAL 262 CO 0.23 0.01 0.00 0.59 0.00 0.00 0.00 175.10 175.93 1i75 n ASN 263 N 4.76 -5.50 -4.66 3.32 5.03 -1.26 -4.97 115.26 111.98 1i75 n ASN 263 Ca 0.16 0.28 -0.40 0.00 0.87 0.00 0.00 54.58 55.50 1i75 n ASN 263 Cb 0.37 -4.00 -0.06 0.00 -1.02 0.00 0.00 39.78 35.07 1i75 n ASN 263 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1i75 s GLU 264 N -2.90 4.20 -0.08 3.52 2.12 -0.89 -5.03 118.70 119.64 1i75 s GLU 264 Ca 0.00 0.55 0.04 0.00 0.36 0.00 0.00 54.97 55.92 1i75 s GLU 264 Cb 0.00 -3.58 -0.00 0.00 0.26 0.00 0.00 34.13 30.81 1i75 s GLU 264 CO 0.00 -0.23 -0.22 0.42 -0.54 0.00 0.00 175.26 174.69 1i75 s ILE 265 N 1.88 1.87 -0.08 -3.70 1.09 -1.26 -4.74 121.20 116.26 1i75 s ILE 265 Ca 0.27 -0.93 0.03 0.00 -1.10 0.00 0.00 60.65 58.93 1i75 s ILE 265 Cb -0.16 -1.62 0.01 0.00 -1.06 0.00 0.00 42.46 39.63 1i75 s ILE 265 CO 0.10 0.52 -0.18 -0.55 -0.10 0.00 0.00 174.94 174.73 1i75 s SER 266 N 0.27 2.43 0.17 3.58 0.15 -1.26 -5.02 113.70 114.00 1i75 s SER 266 Ca -0.14 -0.42 -0.15 0.00 0.70 0.00 0.00 55.95 55.93 1i75 s SER 266 Cb -0.16 -1.06 0.04 0.00 -1.71 0.00 0.00 66.02 63.13 1i75 s SER 266 CO 0.07 0.11 1.82 -0.65 1.20 0.00 0.00 173.24 175.79 1i75 h PRO 267 N 6.76 0.64 -0.71 5.44 0.11 -1.99 -2.58 132.00 139.66 1i75 h PRO 267 Ca -0.26 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1i75 h PRO 267 Cb 1.21 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.14 1i75 h PRO 267 CO 0.47 0.43 0.46 0.93 -0.21 0.00 0.00 178.00 180.08 1i75 h GLU 268 N 0.65 0.95 0.08 1.05 3.07 -1.98 0.15 114.58 118.55 1i75 h GLU 268 Ca 0.18 -0.07 0.01 0.00 -0.50 0.00 0.00 59.36 58.97 1i75 h GLU 268 Cb -0.06 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 27.63 1i75 h GLU 268 CO -0.04 0.64 -0.10 -0.92 -1.40 0.00 0.00 179.01 177.20 1i75 h TYR 269 N 0.97 -0.24 -0.54 4.33 5.03 -1.96 0.41 116.97 124.96 1i75 h TYR 269 Ca 0.26 0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.51 1i75 h TYR 269 Cb -0.08 0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.27 1i75 h TYR 269 CO -0.02 -0.15 0.11 0.45 -1.32 0.00 0.00 178.16 177.23 1i75 h HIS 270 N -0.20 0.88 -0.65 -3.82 3.86 -1.05 -1.70 115.15 112.47 1i75 h HIS 270 Ca 0.01 -0.09 -0.02 0.00 -1.16 0.00 0.00 60.37 59.11 1i75 h HIS 270 Cb 0.21 -0.25 -0.03 0.00 1.06 0.00 0.00 27.41 28.39 1i75 h HIS 270 CO -0.12 0.75 0.33 1.96 0.86 0.00 0.00 177.93 181.71 1i75 h GLN 271 N 0.81 0.93 -0.28 2.45 4.20 -0.42 -1.62 115.11 121.18 1i75 h GLN 271 Ca 0.17 -0.13 -0.00 0.00 0.06 0.00 0.00 58.65 58.76 1i75 h GLN 271 Cb 0.33 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 1i75 h GLN 271 CO 0.00 0.73 0.17 0.35 -0.67 0.00 0.00 178.83 179.41 1i75 h PHE 272 N 0.90 0.37 -0.63 2.96 3.04 -0.56 0.16 116.94 123.17 1i75 h PHE 272 Ca 0.23 -0.00 -0.00 0.00 3.98 0.00 0.00 57.97 62.17 1i75 h PHE 272 Cb 0.09 -0.12 -0.03 0.00 2.56 0.00 0.00 35.95 38.45 1i75 h PHE 272 CO -0.00 0.27 0.38 0.00 -2.02 0.00 0.00 178.31 176.94 1i75 h ALA 273 N 1.07 1.49 0.00 2.41 0.00 -0.98 -1.31 119.26 121.93 1i75 h ALA 273 Ca 0.10 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 1i75 h ALA 273 Cb 0.01 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1i75 h ALA 273 CO -0.02 0.45 -0.80 -0.91 0.00 0.00 0.00 179.25 177.97 1i75 h ASN 274 N 0.86 0.00 0.00 0.00 2.35 -1.00 -3.41 115.58 114.39 1i75 h ASN 274 Ca 0.23 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.98 1i75 h ASN 274 Cb -0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.33 1i75 h ASN 274 CO -0.04 0.42 0.00 -0.62 -1.65 0.00 0.00 177.43 175.54 1i75 n GLU 275 N -3.04 -0.47 0.06 0.81 1.02 0.53 -4.79 120.64 114.75 1i75 n GLU 275 Ca -0.02 -0.34 -0.05 0.00 -0.02 0.00 0.00 57.16 56.73 1i75 n GLU 275 Cb 0.73 -0.84 -0.09 0.00 -0.02 0.00 0.00 31.44 31.22 1i75 n GLU 275 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1i75 h SER 276 N 0.00 0.00 0.00 1.62 4.64 -1.42 -3.48 113.55 114.91 1i75 h SER 276 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1i75 h SER 276 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1i75 h SER 276 CO 0.00 0.88 0.00 0.61 -0.87 0.00 0.00 176.83 177.45 1i75 n GLY 277 N 1.37 0.46 3.43 -0.77 0.00 -1.26 -4.40 105.19 104.02 1i75 n GLY 277 Ca -0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 1i75 n GLY 277 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1i75 s MET 278 N -0.78 1.56 0.00 1.61 0.23 -1.26 -4.80 119.30 115.86 1i75 s MET 278 Ca 0.00 -1.75 0.00 0.00 -1.03 0.00 0.00 55.69 52.91 1i75 s MET 278 Cb 0.00 -1.36 0.00 0.00 -1.53 0.00 0.00 34.83 31.94 1i75 s MET 278 CO 0.00 0.16 0.00 -1.13 -2.03 0.00 0.00 175.02 172.02 1i75 n SER 279 N -0.57 0.04 -4.15 -1.18 3.41 -0.88 -4.54 113.62 105.75 1i75 n SER 279 Ca -0.06 -0.88 -0.12 0.00 -0.26 0.00 0.00 58.87 57.56 1i75 n SER 279 Cb 0.62 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.46 1i75 n SER 279 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1i75 s LEU 280 N 0.00 2.45 0.17 1.04 2.96 -1.26 -0.94 118.68 123.10 1i75 s LEU 280 Ca 0.00 -0.90 -0.31 0.00 -0.22 0.00 0.00 54.13 52.70 1i75 s LEU 280 Cb 0.00 -0.13 -0.09 0.00 0.50 0.00 0.00 46.19 46.48 1i75 s LEU 280 CO 0.00 -0.39 1.36 -0.76 -1.32 0.00 0.00 176.35 175.24 1i75 s LEU 281 N -2.71 4.39 -1.21 -0.68 1.43 0.05 -1.65 118.68 118.31 1i75 s LEU 281 Ca 0.07 2.40 -0.15 0.00 -1.03 0.00 0.00 54.13 55.42 1i75 s LEU 281 Cb 0.01 -3.60 0.15 0.00 0.03 0.00 0.00 46.19 42.79 1i75 s LEU 281 CO -0.03 -0.60 1.47 -0.62 0.23 0.00 0.00 176.35 176.80 1i75 s ASP 282 N 0.68 7.01 0.51 2.29 3.68 0.92 -4.76 116.67 127.01 1i75 s ASP 282 Ca 0.61 -2.85 0.28 0.00 2.13 0.00 0.00 52.55 52.72 1i75 s ASP 282 Cb -0.37 -2.43 1.34 0.00 -1.45 0.00 0.00 42.92 40.01 1i75 s ASP 282 CO 0.35 -0.83 2.00 -0.26 0.13 0.00 0.00 175.17 176.56 1i75 h PHE 283 N 7.32 0.00 -0.52 -5.34 0.04 -1.87 -1.94 116.94 114.64 1i75 h PHE 283 Ca 0.33 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.99 1i75 h PHE 283 Cb 0.88 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.01 1i75 h PHE 283 CO 1.16 0.13 -0.10 -0.09 -0.60 0.00 0.00 178.31 178.81 1i75 h ARG 284 N 0.00 0.98 0.13 1.51 2.43 -1.91 0.02 114.38 117.54 1i75 h ARG 284 Ca -0.00 -0.36 -0.01 0.00 -0.81 0.00 0.00 59.98 58.80 1i75 h ARG 284 Cb 0.47 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 1i75 h ARG 284 CO 0.02 1.03 -0.06 0.35 -1.51 0.00 0.00 179.97 179.80 1i75 h PHE 285 N 0.84 -0.17 -0.42 2.20 3.57 -1.82 -2.79 116.94 118.36 1i75 h PHE 285 Ca 0.13 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.64 1i75 h PHE 285 Cb 0.66 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.43 1i75 h PHE 285 CO 0.05 0.16 0.26 0.00 -2.23 0.00 0.00 178.31 176.55 1i75 h ALA 286 N 0.31 0.53 -0.49 2.41 0.00 -1.24 0.96 119.26 121.74 1i75 h ALA 286 Ca -0.02 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1i75 h ALA 286 Cb 0.40 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1i75 h ALA 286 CO 0.03 -0.04 -0.04 1.96 0.00 0.00 0.00 179.25 181.16 1i75 h GLN 287 N 0.54 0.89 -0.41 0.00 1.08 -1.06 -0.64 115.11 115.51 1i75 h GLN 287 Ca 0.16 -0.31 -0.15 0.00 -1.45 0.00 0.00 58.65 56.90 1i75 h GLN 287 Cb -0.04 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.31 1i75 h GLN 287 CO -0.05 0.95 -0.34 -0.22 -0.95 0.00 0.00 178.83 178.22 1i75 h LYS 288 N 0.75 0.96 -0.78 1.46 1.63 -1.21 -1.42 116.57 117.96 1i75 h LYS 288 Ca 0.13 -0.48 0.01 0.00 -0.85 0.00 0.00 60.65 59.46 1i75 h LYS 288 Cb 0.57 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.16 1i75 h LYS 288 CO 0.03 1.14 0.52 0.00 -3.45 0.00 0.00 179.45 177.69 1i75 h ALA 289 N 0.81 0.99 -0.34 5.00 0.00 -0.60 -0.56 119.26 124.56 1i75 h ALA 289 Ca 0.08 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1i75 h ALA 289 Cb 0.93 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1i75 h ALA 289 CO 0.09 0.41 -0.21 0.00 0.00 0.00 0.00 179.25 179.54 1i75 h ARG 290 N 1.06 0.65 -0.77 0.00 3.08 -0.93 0.15 114.38 117.63 1i75 h ARG 290 Ca 0.29 -0.24 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 1i75 h ARG 290 Cb -0.12 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 29.85 1i75 h ARG 290 CO -0.06 0.81 0.32 1.96 -1.07 0.00 0.00 179.97 181.93 1i75 h GLN 291 N 0.58 1.13 0.00 0.04 4.20 -0.38 0.86 115.11 121.54 1i75 h GLN 291 Ca 0.09 -0.19 -0.03 0.00 0.06 0.00 0.00 58.65 58.57 1i75 h GLN 291 Cb 0.67 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 28.25 1i75 h GLN 291 CO 0.05 0.91 -0.18 0.28 -0.67 0.00 0.00 178.83 179.22 1i75 h VAL 292 N 1.11 1.68 0.00 -0.54 2.07 -1.02 0.61 116.25 120.16 1i75 h VAL 292 Ca 0.26 -2.33 -0.02 0.00 0.82 0.00 0.00 66.70 65.43 1i75 h VAL 292 Cb 0.18 3.25 -0.00 0.00 -1.52 0.00 0.00 31.29 33.20 1i75 h VAL 292 CO -0.02 0.58 -1.17 0.49 0.02 0.00 0.00 177.57 177.46 1i75 n PHE 293 N -4.57 0.86 -0.03 1.57 3.01 0.03 -4.33 117.46 113.99 1i75 n PHE 293 Ca -0.13 0.25 -0.07 0.00 1.01 0.00 0.00 57.45 58.51 1i75 n PHE 293 Cb 0.51 -0.92 -0.02 0.00 -0.01 0.00 0.00 39.48 39.04 1i75 n PHE 293 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 1i75 n ARG 294 N -2.65 0.25 0.02 -1.08 0.63 0.07 -4.82 116.66 109.08 1i75 n ARG 294 Ca -0.02 0.10 0.11 0.00 -0.92 0.00 0.00 57.85 57.13 1i75 n ARG 294 Cb 0.58 -0.94 0.03 0.00 0.45 0.00 0.00 32.46 32.58 1i75 n ARG 294 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1i75 n ASP 295 N -3.83 0.65 -3.78 6.15 10.43 0.07 -4.97 116.55 121.27 1i75 n ASP 295 Ca -0.12 -0.36 -0.26 0.00 2.57 0.00 0.00 54.79 56.62 1i75 n ASP 295 Cb 0.37 0.78 0.04 0.00 1.84 0.00 0.00 41.12 44.15 1i75 n ASP 295 CO 0.00 0.00 0.00 -3.20 -1.07 0.00 0.00 177.20 172.93 1i75 n ASN 296 N -1.81 -3.85 -1.00 -2.24 5.15 -0.33 -4.89 115.26 106.29 1i75 n ASN 296 Ca 0.03 -0.74 0.11 0.00 -0.60 0.00 0.00 54.58 53.38 1i75 n ASN 296 Cb 0.40 -4.19 0.15 0.00 -0.53 0.00 0.00 39.78 35.61 1i75 n ASN 296 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1i75 n THR 297 N -4.59 0.24 -3.78 -0.44 -2.24 0.06 -4.95 114.28 98.58 1i75 n THR 297 Ca -0.08 -0.62 -0.10 0.00 -2.27 0.00 0.00 64.05 60.98 1i75 n THR 297 Cb 0.58 1.24 -0.05 0.00 -2.10 0.00 0.00 70.33 70.00 1i75 n THR 297 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1i75 s ASP 298 N -1.67 -0.18 0.00 3.42 -1.08 -1.10 -4.97 116.67 111.09 1i75 s ASP 298 Ca 0.31 -0.56 0.00 0.00 -0.52 0.00 0.00 52.55 51.78 1i75 s ASP 298 Cb 0.20 0.53 0.00 0.00 -1.46 0.00 0.00 42.92 42.19 1i75 s ASP 298 CO 0.29 -0.99 0.00 -0.46 0.52 0.00 0.00 175.17 174.53 1i75 n ASN 299 N -0.30 1.70 0.29 -0.34 0.23 -1.26 -4.06 115.26 111.53 1i75 n ASN 299 Ca -0.10 -0.87 0.16 0.00 -0.53 0.00 0.00 54.58 53.24 1i75 n ASN 299 Cb 0.63 0.00 0.90 0.00 -2.08 0.00 0.00 39.78 39.23 1i75 n ASN 299 CO 0.00 0.00 0.00 0.24 -0.93 0.00 0.00 177.26 176.57 1i75 h MET 300 N 0.00 0.00 -0.18 -3.83 2.86 -1.41 -0.92 114.93 111.45 1i75 h MET 300 Ca 0.00 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.52 1i75 h MET 300 Cb 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1i75 h MET 300 CO 0.00 0.04 -0.40 1.88 1.06 0.00 0.00 176.91 179.49 1i75 h TYR 301 N 0.00 0.48 -0.52 -0.22 -1.99 -1.83 -0.72 116.97 112.17 1i75 h TYR 301 Ca -0.00 -0.13 -0.11 0.00 2.00 0.00 0.00 58.73 60.48 1i75 h TYR 301 Cb 0.14 -0.11 -0.02 0.00 2.00 0.00 0.00 36.73 38.75 1i75 h TYR 301 CO 0.00 0.75 -0.11 0.78 -0.00 0.00 0.00 178.16 179.58 1i75 h GLY 302 N 1.14 1.07 0.90 3.88 0.00 -1.56 -0.22 103.07 108.28 1i75 h GLY 302 Ca 0.03 -0.87 -0.00 0.00 0.00 0.00 0.00 47.33 46.48 1i75 h GLY 302 CO 0.07 0.80 0.04 -2.00 0.00 0.00 0.00 176.54 175.45 1i75 h LEU 303 N 0.86 0.11 -0.30 3.11 5.85 -1.33 -1.43 115.31 122.18 1i75 h LEU 303 Ca 0.13 -0.12 0.06 0.00 0.84 0.00 0.00 57.88 58.80 1i75 h LEU 303 Cb 0.67 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.62 1i75 h LEU 303 CO 0.05 0.20 -0.08 0.50 -0.34 0.00 0.00 178.44 178.77 1i75 h LYS 304 N 0.02 -0.01 -0.35 1.25 3.64 -1.07 -1.22 116.57 118.83 1i75 h LYS 304 Ca 0.03 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.35 1i75 h LYS 304 Cb 0.11 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 1i75 h LYS 304 CO -0.00 -0.00 -0.03 0.00 -2.27 0.00 0.00 179.45 177.14 1i75 h ALA 305 N 1.29 1.30 -0.38 5.00 0.00 -0.85 0.36 119.26 125.99 1i75 h ALA 305 Ca 0.15 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 1i75 h ALA 305 Cb 0.23 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1i75 h ALA 305 CO -0.31 0.47 -0.12 1.98 0.00 0.00 0.00 179.25 181.27 1i75 h MET 306 N 0.53 0.75 -0.51 0.00 1.85 -0.86 0.55 114.93 117.23 1i75 h MET 306 Ca 0.11 -0.30 -0.12 0.00 -0.61 0.00 0.00 59.70 58.78 1i75 h MET 306 Cb 0.39 -0.03 -0.02 0.00 0.43 0.00 0.00 31.60 32.37 1i75 h MET 306 CO 0.02 0.91 -0.14 -0.07 -0.40 0.00 0.00 176.91 177.22 1i75 h LEU 307 N 0.55 1.00 -0.20 3.39 3.38 -0.70 0.85 115.31 123.58 1i75 h LEU 307 Ca 0.09 -0.34 -0.20 0.00 0.09 0.00 0.00 57.88 57.51 1i75 h LEU 307 Cb 0.65 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 41.14 1i75 h LEU 307 CO 0.04 1.13 -0.67 -0.33 0.09 0.00 0.00 178.44 178.70 1i75 h GLU 308 N 0.87 0.80 -0.14 1.13 5.08 -0.88 -2.80 114.58 118.64 1i75 h GLU 308 Ca 0.13 -0.60 -0.10 0.00 -1.00 0.00 0.00 59.36 57.79 1i75 h GLU 308 Cb 0.71 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.07 1i75 h GLU 308 CO 0.05 1.22 -0.29 0.78 -1.00 0.00 0.00 179.01 179.78 1i75 h GLY 309 N 0.55 0.49 2.00 -3.84 0.00 -0.82 -3.22 103.07 98.23 1i75 h GLY 309 Ca -0.03 -0.58 -0.06 0.00 0.00 0.00 0.00 47.33 46.66 1i75 h GLY 309 CO 0.14 0.52 -0.27 1.48 0.00 0.00 0.00 176.54 178.41 1i75 h SER 310 N 0.06 0.00 -0.02 0.19 4.64 -0.86 -1.57 113.55 115.99 1i75 h SER 310 Ca 0.00 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 1i75 h SER 310 Cb 0.88 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.97 1i75 h SER 310 CO 0.06 0.27 0.02 -0.08 -0.87 0.00 0.00 176.83 176.23 1i75 h GLU 311 N 0.00 0.00 0.03 4.77 4.81 -1.50 -2.03 114.58 120.66 1i75 h GLU 311 Ca -0.00 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 58.92 1i75 h GLU 311 Cb 0.52 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.86 1i75 h GLU 311 CO 0.04 0.00 -1.66 0.28 -0.73 0.00 0.00 179.01 176.93 1i75 n VAL 312 N -4.36 1.59 0.21 0.32 0.31 -0.79 -4.55 118.33 111.06 1i75 n VAL 312 Ca -0.03 -0.24 0.08 0.00 -0.01 0.00 0.00 64.34 64.14 1i75 n VAL 312 Cb 0.11 -1.93 0.47 0.00 -0.91 0.00 0.00 33.84 31.59 1i75 n VAL 312 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1i75 h ASP 313 N -0.73 0.00 -3.49 4.52 3.32 -1.16 -3.40 116.42 115.49 1i75 h ASP 313 Ca -0.43 0.00 -0.61 0.00 0.02 0.00 0.00 57.03 56.02 1i75 h ASP 313 Cb 1.53 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.96 1i75 h ASP 313 CO -0.17 0.28 -0.28 -0.31 -1.72 0.00 0.00 179.24 177.04 1i75 s TYR 314 N -3.89 3.37 0.22 4.55 2.02 -0.78 -4.93 117.35 117.91 1i75 s TYR 314 Ca -0.01 0.53 -0.07 0.00 -0.37 0.00 0.00 57.07 57.15 1i75 s TYR 314 Cb 0.12 -2.46 0.19 0.00 -0.40 0.00 0.00 41.96 39.41 1i75 s TYR 314 CO 0.66 0.02 1.78 0.00 -1.57 0.00 0.00 175.55 176.44 1i75 h ALA 315 N 7.35 1.06 -3.12 3.71 0.00 -1.89 -3.33 119.26 123.05 1i75 h ALA 315 Ca -0.37 -0.20 -0.62 0.00 0.00 0.00 0.00 54.91 53.72 1i75 h ALA 315 Cb 1.16 -0.30 -0.41 0.00 0.00 0.00 0.00 17.79 18.24 1i75 h ALA 315 CO 0.71 0.66 -0.62 -0.65 0.00 0.00 0.00 179.25 179.34 1i75 s GLN 316 N -5.49 2.19 0.51 0.00 1.11 -1.26 -4.94 119.66 111.79 1i75 s GLN 316 Ca -0.12 -3.02 0.29 0.00 0.01 0.00 0.00 55.36 52.51 1i75 s GLN 316 Cb 0.16 -3.23 1.34 0.00 -1.01 0.00 0.00 33.01 30.27 1i75 s GLN 316 CO 0.84 -1.24 2.00 -0.24 0.01 0.00 0.00 175.29 176.66 1i75 h VAL 317 N 4.74 0.42 0.00 1.09 3.04 -1.88 -2.33 116.25 121.33 1i75 h VAL 317 Ca 0.09 -0.69 0.00 0.00 -1.01 0.00 0.00 66.70 65.09 1i75 h VAL 317 Cb 0.81 1.49 0.00 0.00 -2.01 0.00 0.00 31.29 31.57 1i75 h VAL 317 CO 0.68 0.12 0.00 0.59 -1.01 0.00 0.00 177.57 177.95 1i75 n ASN 318 N -3.42 0.00 -0.92 3.17 3.02 -1.26 -2.27 115.26 113.59 1i75 n ASN 318 Ca -0.01 0.13 0.10 0.00 -0.03 0.00 0.00 54.58 54.77 1i75 n ASN 318 Cb 0.30 -0.33 0.14 0.00 -0.61 0.00 0.00 39.78 39.28 1i75 n ASN 318 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1i75 n ASP 319 N -1.33 2.98 -4.79 6.41 10.43 -0.87 -4.28 116.55 125.09 1i75 n ASP 319 Ca 0.08 -1.89 -0.39 0.00 2.57 0.00 0.00 54.79 55.15 1i75 n ASP 319 Cb 0.15 -0.11 -0.06 0.00 1.84 0.00 0.00 41.12 42.94 1i75 n ASP 319 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 1i75 s GLN 320 N -1.52 4.30 -0.31 -1.24 -1.52 -0.96 -4.58 119.66 113.83 1i75 s GLN 320 Ca 0.29 0.81 -0.19 0.00 -1.95 0.00 0.00 55.36 54.32 1i75 s GLN 320 Cb 0.18 -3.28 -0.01 0.00 -0.22 0.00 0.00 33.01 29.69 1i75 s GLN 320 CO 0.27 0.54 0.57 0.08 -0.25 0.00 0.00 175.29 176.49 1i75 s VAL 321 N -0.81 4.99 0.32 1.09 1.01 -0.66 -0.90 120.40 125.44 1i75 s VAL 321 Ca 0.31 0.70 0.02 0.00 0.00 0.00 0.00 61.98 63.01 1i75 s VAL 321 Cb -0.20 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.20 1i75 s VAL 321 CO 0.20 -0.12 0.50 0.42 0.00 0.00 0.00 175.10 176.10 1i75 s THR 322 N 2.48 5.04 0.02 3.92 -4.23 -0.40 -0.06 115.64 122.42 1i75 s THR 322 Ca 0.22 -0.62 -0.28 0.00 -1.18 0.00 0.00 61.69 59.83 1i75 s THR 322 Cb -0.15 -3.82 0.10 0.00 1.34 0.00 0.00 72.50 69.96 1i75 s THR 322 CO 0.12 -0.47 0.97 0.72 -0.54 0.00 0.00 174.62 175.42 1i75 s PHE 323 N -2.24 -0.24 -0.25 3.99 -0.12 -1.26 -0.44 117.98 117.42 1i75 s PHE 323 Ca 0.39 0.06 0.10 0.00 -0.05 0.00 0.00 56.93 57.43 1i75 s PHE 323 Cb -0.09 0.57 -0.13 0.00 -0.63 0.00 0.00 43.02 42.73 1i75 s PHE 323 CO 0.34 -0.58 0.33 0.44 -0.05 0.00 0.00 175.22 175.71 1i75 n ILE 324 N -0.32 0.00 -3.83 -4.49 -5.35 -1.26 -4.05 119.36 100.06 1i75 n ILE 324 Ca -0.07 -0.25 -0.06 0.00 -0.27 0.00 0.00 62.75 62.10 1i75 n ILE 324 Cb 0.61 0.64 -0.01 0.00 -1.74 0.00 0.00 39.64 39.14 1i75 n ILE 324 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 1i75 s ASP 325 N -2.55 -0.21 0.01 7.28 1.47 -1.26 -4.70 116.67 116.70 1i75 s ASP 325 Ca 0.00 -0.60 -0.01 0.00 1.18 0.00 0.00 52.55 53.13 1i75 s ASP 325 Cb 0.07 0.67 0.00 0.00 -0.34 0.00 0.00 42.92 43.33 1i75 s ASP 325 CO 0.42 -1.25 0.04 -0.46 0.68 0.00 0.00 175.17 174.61 1i75 n ASN 326 N -0.54 -0.07 0.05 2.11 0.23 -1.26 -4.48 115.26 111.30 1i75 n ASN 326 Ca -0.05 -1.04 0.04 0.00 -0.53 0.00 0.00 54.58 53.01 1i75 n ASN 326 Cb 0.59 0.12 0.22 0.00 -2.08 0.00 0.00 39.78 38.63 1i75 n ASN 326 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1i75 n HIS 327 N -0.03 0.24 -0.80 -2.53 1.44 -1.26 -2.74 115.22 109.53 1i75 n HIS 327 Ca -0.00 0.12 0.08 0.00 -2.01 0.00 0.00 57.72 55.91 1i75 n HIS 327 Cb 0.02 -0.69 0.28 0.00 0.12 0.00 0.00 29.99 29.72 1i75 n HIS 327 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1i75 n ASP 328 N -1.74 4.13 -3.82 4.39 8.00 -1.26 -4.67 116.55 121.59 1i75 n ASP 328 Ca 0.00 -2.77 -0.10 0.00 0.71 0.00 0.00 54.79 52.64 1i75 n ASP 328 Cb 0.05 -0.52 -0.06 0.00 -0.02 0.00 0.00 41.12 40.57 1i75 n ASP 328 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1i75 s MET 329 N -2.40 1.14 0.52 -1.24 0.23 -1.11 -4.99 119.30 111.45 1i75 s MET 329 Ca 0.42 -0.96 -0.23 0.00 -1.03 0.00 0.00 55.69 53.89 1i75 s MET 329 Cb 0.32 0.43 -0.06 0.00 -1.53 0.00 0.00 34.83 33.99 1i75 s MET 329 CO 0.13 -0.44 1.38 -1.21 -2.03 0.00 0.00 175.02 172.85 1i75 s GLU 330 N -3.89 3.28 0.42 3.16 2.02 -1.26 -4.63 118.70 117.81 1i75 s GLU 330 Ca 0.10 2.29 -0.26 0.00 0.02 0.00 0.00 54.97 57.12 1i75 s GLU 330 Cb 0.02 -2.36 -0.10 0.00 0.10 0.00 0.00 34.13 31.79 1i75 s GLU 330 CO -0.05 -1.09 1.40 0.54 0.02 0.00 0.00 175.26 176.07 1i75 n ARG 331 N -0.81 2.25 0.02 1.61 5.12 -0.26 -4.78 116.66 119.82 1i75 n ARG 331 Ca 0.09 0.80 -0.12 0.00 -1.93 0.00 0.00 57.85 56.69 1i75 n ARG 331 Cb 0.44 -2.56 -0.06 0.00 -1.16 0.00 0.00 32.46 29.12 1i75 n ARG 331 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 1i75 h PHE 332 N 2.39 0.05 -2.98 -1.55 3.57 -1.86 -3.41 116.94 113.15 1i75 h PHE 332 Ca -0.50 0.00 -0.54 0.00 3.53 0.00 0.00 57.97 60.46 1i75 h PHE 332 Cb 1.27 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.00 1i75 h PHE 332 CO 0.50 0.05 0.76 -1.58 -2.23 0.00 0.00 178.31 175.80 1i75 s HIS 333 N -6.14 3.04 0.56 0.41 2.46 -1.26 -4.99 115.29 109.38 1i75 s HIS 333 Ca -0.13 0.95 0.06 0.00 0.47 0.00 0.00 55.06 56.41 1i75 s HIS 333 Cb 0.06 -3.61 0.06 0.00 -0.13 0.00 0.00 32.58 28.96 1i75 s HIS 333 CO 0.67 -2.17 0.51 0.95 -2.47 0.00 0.00 174.74 172.23 1i75 s THR 334 N 1.93 1.70 0.15 0.89 -4.23 -1.26 -4.29 115.64 110.52 1i75 s THR 334 Ca 0.63 -1.37 -0.13 0.00 -1.18 0.00 0.00 61.69 59.64 1i75 s THR 334 Cb -0.32 -2.07 0.02 0.00 1.34 0.00 0.00 72.50 71.47 1i75 s THR 334 CO 0.27 0.00 1.61 0.77 -0.54 0.00 0.00 174.62 176.73 1i75 h SER 335 N 0.57 0.83 -0.52 3.99 4.64 -1.98 -3.17 113.55 117.92 1i75 h SER 335 Ca -0.34 -0.30 0.00 0.00 -0.47 0.00 0.00 61.79 60.68 1i75 h SER 335 Cb 1.30 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1i75 h SER 335 CO 0.53 0.92 0.00 -0.46 -0.87 0.00 0.00 176.83 176.95 1i75 n ASN 336 N -4.35 4.27 -4.88 4.97 0.23 -1.26 -4.98 115.26 109.26 1i75 n ASN 336 Ca 0.01 -2.48 -0.35 0.00 -0.53 0.00 0.00 54.58 51.23 1i75 n ASN 336 Cb 0.30 -0.51 -0.05 0.00 -2.08 0.00 0.00 39.78 37.44 1i75 n ASN 336 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1i75 s GLY 337 N -1.13 2.25 0.13 4.83 0.00 -1.20 -5.06 107.32 107.14 1i75 s GLY 337 Ca 0.44 -0.58 -0.31 0.00 0.00 0.00 0.00 44.72 44.27 1i75 s GLY 337 CO 0.20 -0.37 1.43 -0.35 0.00 0.00 0.00 173.10 174.01 1i75 s ASP 338 N -1.59 6.76 0.63 1.64 2.15 -1.26 -4.70 116.67 120.30 1i75 s ASP 338 Ca 0.26 2.40 0.37 0.00 0.43 0.00 0.00 52.55 56.00 1i75 s ASP 338 Cb -0.13 -2.59 2.11 0.00 -0.30 0.00 0.00 42.92 42.01 1i75 s ASP 338 CO 0.14 -0.69 2.31 0.03 -0.17 0.00 0.00 175.17 176.79 1i75 h ARG 339 N 6.77 0.00 0.00 4.34 3.08 -1.97 -1.37 114.38 125.23 1i75 h ARG 339 Ca -0.42 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.58 1i75 h ARG 339 Cb 1.21 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.25 1i75 h ARG 339 CO 0.88 0.00 -0.20 -0.09 -1.07 0.00 0.00 179.97 179.48 1i75 h ARG 340 N 0.00 0.00 -0.63 0.04 9.65 -1.99 -2.16 114.38 119.28 1i75 h ARG 340 Ca -0.00 0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 58.83 1i75 h ARG 340 Cb 0.00 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.56 1i75 h ARG 340 CO 0.00 0.20 0.22 0.87 2.80 0.00 0.00 179.97 184.06 1i75 h LYS 341 N 0.00 0.97 -0.25 0.20 1.57 -1.56 -0.33 116.57 117.17 1i75 h LYS 341 Ca -0.00 -0.20 -0.06 0.00 -1.87 0.00 0.00 60.65 58.52 1i75 h LYS 341 Cb 0.41 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 1i75 h LYS 341 CO 0.03 0.84 -0.07 1.25 -0.57 0.00 0.00 179.45 180.93 1i75 h LEU 342 N 0.90 0.50 -0.43 2.94 5.85 -1.54 -1.73 115.31 121.81 1i75 h LEU 342 Ca 0.21 -0.37 0.02 0.00 0.84 0.00 0.00 57.88 58.57 1i75 h LEU 342 Cb 0.26 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 1i75 h LEU 342 CO -0.01 0.76 0.24 -0.33 -0.34 0.00 0.00 178.44 178.76 1i75 h GLU 343 N 0.23 0.47 -0.28 1.25 5.08 -1.09 -0.98 114.58 119.26 1i75 h GLU 343 Ca 0.06 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1i75 h GLU 343 Cb 0.55 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 1i75 h GLU 343 CO 0.03 0.31 0.11 1.96 -1.00 0.00 0.00 179.01 180.42 1i75 h GLN 344 N 0.49 0.42 -0.55 2.33 4.20 -1.03 -1.14 115.11 119.83 1i75 h GLN 344 Ca 0.17 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 1i75 h GLN 344 Cb 0.03 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.71 1i75 h GLN 344 CO -0.09 0.44 0.28 0.00 -0.67 0.00 0.00 178.83 178.79 1i75 h ALA 345 N 0.96 1.47 -0.32 3.87 0.00 -1.00 0.99 119.26 125.23 1i75 h ALA 345 Ca 0.09 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1i75 h ALA 345 Cb 0.18 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1i75 h ALA 345 CO -0.01 0.43 -0.14 -0.07 0.00 0.00 0.00 179.25 179.47 1i75 h LEU 346 N 0.76 0.67 -0.71 0.00 3.38 -1.06 -0.95 115.31 117.41 1i75 h LEU 346 Ca 0.19 -0.40 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 1i75 h LEU 346 Cb 0.05 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 1i75 h LEU 346 CO -0.03 0.92 0.31 0.00 0.09 0.00 0.00 178.44 179.73 1i75 h ALA 347 N 0.77 0.91 -0.26 1.53 0.00 -0.29 -1.20 119.26 120.73 1i75 h ALA 347 Ca 0.07 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1i75 h ALA 347 Cb 0.66 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1i75 h ALA 347 CO 0.04 0.51 0.15 0.35 0.00 0.00 0.00 179.25 180.30 1i75 h PHE 348 N 1.00 0.28 -0.40 0.00 3.57 -0.72 -2.54 116.94 118.14 1i75 h PHE 348 Ca 0.24 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.70 1i75 h PHE 348 Cb 0.17 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 1i75 h PHE 348 CO 0.01 0.17 0.07 1.15 -2.23 0.00 0.00 178.31 177.48 1i75 h THR 349 N 0.31 1.24 0.00 4.41 2.02 -0.86 -2.31 112.91 117.72 1i75 h THR 349 Ca 0.10 -0.87 -0.03 0.00 0.77 0.00 0.00 66.41 66.38 1i75 h THR 349 Cb -0.01 1.03 -0.00 0.00 -1.74 0.00 0.00 68.15 67.43 1i75 h THR 349 CO -0.04 0.30 -0.15 -0.07 0.37 0.00 0.00 175.52 175.93 1i75 h LEU 350 N 0.51 0.00 -2.07 2.58 3.38 -1.13 -2.63 115.31 115.94 1i75 h LEU 350 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1i75 h LEU 350 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1i75 h LEU 350 CO 0.01 0.15 0.00 0.35 0.09 0.00 0.00 178.44 179.04 1i75 n THR 351 N -3.66 0.19 -2.88 0.22 -2.24 -0.97 -4.88 114.28 100.07 1i75 n THR 351 Ca -0.02 -0.59 -0.21 0.00 -2.27 0.00 0.00 64.05 60.97 1i75 n THR 351 Cb 0.27 1.29 0.02 0.00 -2.10 0.00 0.00 70.33 69.81 1i75 n THR 351 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1i75 s SER 352 N -1.81 5.56 0.67 3.42 0.01 -0.89 -4.91 113.70 115.75 1i75 s SER 352 Ca 0.32 -0.03 -0.15 0.00 1.31 0.00 0.00 55.95 57.40 1i75 s SER 352 Cb 0.21 -1.04 0.00 0.00 0.21 0.00 0.00 66.02 65.41 1i75 s SER 352 CO 0.31 -0.89 1.14 0.00 0.41 0.00 0.00 173.24 174.21 1i75 s ARG 353 N -4.57 2.68 0.00 12.44 3.03 -1.26 -4.84 118.95 126.43 1i75 s ARG 353 Ca 0.53 1.51 0.00 0.00 2.03 0.00 0.00 55.73 59.80 1i75 s ARG 353 Cb -0.10 -1.93 0.00 0.00 -1.03 0.00 0.00 34.95 31.89 1i75 s ARG 353 CO 0.36 -1.36 0.00 0.41 -1.13 0.00 0.00 175.30 173.58 1i75 n GLY 354 N -0.22 -0.53 3.02 3.88 0.00 -1.26 -4.86 105.19 105.22 1i75 n GLY 354 Ca 0.11 -2.12 -0.31 0.00 0.00 0.00 0.00 46.02 43.70 1i75 n GLY 354 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i75 s VAL 355 N 0.00 2.01 0.21 1.61 1.01 -0.08 -4.65 120.40 120.51 1i75 s VAL 355 Ca 0.00 -1.68 -0.30 0.00 0.00 0.00 0.00 61.98 60.00 1i75 s VAL 355 Cb 0.00 -2.24 -0.08 0.00 0.00 0.00 0.00 36.38 34.06 1i75 s VAL 355 CO 0.00 -0.18 1.16 -2.16 0.00 0.00 0.00 175.10 173.92 1i75 s PRO 356 N 1.14 4.53 -0.06 2.72 0.04 -1.26 -1.27 135.00 140.84 1i75 s PRO 356 Ca -0.04 1.84 0.05 0.00 0.04 0.00 0.00 61.00 62.90 1i75 s PRO 356 Cb -0.19 -3.23 -0.01 0.00 0.04 0.00 0.00 34.50 31.10 1i75 s PRO 356 CO -0.06 -0.01 -0.23 0.00 0.04 0.00 0.00 177.00 176.74 1i75 s ALA 357 N -0.33 2.27 -0.13 8.56 0.00 0.42 -1.13 121.76 131.42 1i75 s ALA 357 Ca 0.50 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 51.44 1i75 s ALA 357 Cb -0.32 -0.75 -0.01 0.00 0.00 0.00 0.00 23.12 22.04 1i75 s ALA 357 CO 0.38 0.43 -0.14 0.42 0.00 0.00 0.00 175.76 176.84 1i75 s ILE 358 N -0.22 2.92 0.11 0.00 1.01 0.84 -4.44 121.20 121.42 1i75 s ILE 358 Ca -0.01 -0.71 -0.30 0.00 0.00 0.00 0.00 60.65 59.63 1i75 s ILE 358 Cb -0.13 -2.21 -0.06 0.00 0.01 0.00 0.00 42.46 40.06 1i75 s ILE 358 CO 0.03 0.53 0.96 -0.47 0.00 0.00 0.00 174.94 175.99 1i75 s TYR 359 N 0.37 3.81 0.43 3.97 5.04 -1.26 -0.24 117.35 129.47 1i75 s TYR 359 Ca -0.12 1.80 -0.24 0.00 -2.44 0.00 0.00 57.07 56.07 1i75 s TYR 359 Cb -0.16 -3.05 -0.10 0.00 0.35 0.00 0.00 41.96 39.00 1i75 s TYR 359 CO 0.06 0.21 1.07 2.48 -1.34 0.00 0.00 175.55 178.03 1i75 n TYR 360 N 2.77 1.39 -0.59 4.97 4.11 -0.04 -1.78 117.16 128.00 1i75 n TYR 360 Ca 0.02 0.54 0.00 0.00 -0.00 0.00 0.00 57.90 58.46 1i75 n TYR 360 Cb 0.49 -2.26 0.00 0.00 -0.00 0.00 0.00 39.34 37.57 1i75 n TYR 360 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1i75 n GLY 361 N 1.10 1.67 0.37 -7.48 0.00 -1.26 -4.89 105.19 94.70 1i75 n GLY 361 Ca 0.09 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.15 1i75 n GLY 361 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1i75 h SER 362 N 0.00 0.94 0.38 1.61 0.02 -1.71 -1.56 113.55 113.24 1i75 h SER 362 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1i75 h SER 362 Cb 0.00 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.35 1i75 h SER 362 CO 0.00 0.60 0.00 -1.84 -1.14 0.00 0.00 176.83 174.45 1i75 n GLU 363 N -4.49 0.22 -0.34 3.45 0.00 -1.26 -1.67 120.64 116.54 1i75 n GLU 363 Ca 0.14 0.13 0.08 0.00 0.00 0.00 0.00 57.16 57.51 1i75 n GLU 363 Cb 0.20 -1.50 0.22 0.00 0.00 0.00 0.00 31.44 30.35 1i75 n GLU 363 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1i75 n GLN 364 N -1.32 2.83 -3.99 3.44 1.13 -0.60 -3.99 117.38 114.89 1i75 n GLN 364 Ca 0.08 -2.57 -0.30 0.00 -1.94 0.00 0.00 57.00 52.27 1i75 n GLN 364 Cb 0.15 -1.64 0.00 0.00 0.11 0.00 0.00 30.24 28.87 1i75 n GLN 364 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1i75 n TYR 365 N -0.27 -2.00 -2.14 1.08 4.01 -0.67 -4.93 117.16 112.24 1i75 n TYR 365 Ca 0.18 0.84 -0.41 0.00 -0.16 0.00 0.00 57.90 58.35 1i75 n TYR 365 Cb 0.73 -3.70 -0.03 0.00 -0.31 0.00 0.00 39.34 36.04 1i75 n TYR 365 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 1i75 s MET 366 N -6.63 4.36 0.35 -0.72 -1.94 -1.15 -4.96 119.30 108.61 1i75 s MET 366 Ca 0.51 2.17 0.09 0.00 -1.71 0.00 0.00 55.69 56.74 1i75 s MET 366 Cb -0.26 -3.12 -0.05 0.00 2.01 0.00 0.00 34.83 33.40 1i75 s MET 366 CO 0.87 -0.25 0.04 -1.54 -0.01 0.00 0.00 175.02 174.13 1i75 s SER 367 N -0.05 4.22 0.00 3.03 1.04 -1.26 -4.37 113.70 116.31 1i75 s SER 367 Ca 0.54 -1.01 0.00 0.00 0.48 0.00 0.00 55.95 55.96 1i75 s SER 367 Cb -0.39 -0.53 0.00 0.00 0.10 0.00 0.00 66.02 65.20 1i75 s SER 367 CO 0.46 -0.29 0.00 0.61 0.98 0.00 0.00 173.24 174.99 1i75 n GLY 368 N -1.00 3.71 0.00 7.32 0.00 -1.26 -4.90 105.19 109.06 1i75 n GLY 368 Ca -0.04 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.38 1i75 n GLY 368 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i75 n GLY 369 N -1.10 0.19 3.80 -0.02 0.00 -1.26 -1.10 105.19 105.70 1i75 n GLY 369 Ca 0.00 -1.51 -0.29 0.00 0.00 0.00 0.00 46.02 44.22 1i75 n GLY 369 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1i75 s ASN 370 N -1.06 3.40 -0.08 1.61 0.01 -1.26 -2.20 114.94 115.36 1i75 s ASN 370 Ca 0.00 0.87 -0.41 0.00 -0.71 0.00 0.00 52.86 52.61 1i75 s ASN 370 Cb 0.00 -1.38 -0.20 0.00 0.41 0.00 0.00 41.25 40.08 1i75 s ASN 370 CO 0.00 -2.61 1.17 -0.67 -1.51 0.00 0.00 177.10 173.48 1i75 n ASP 371 N -3.79 0.28 -0.76 -1.22 4.64 -1.26 -1.20 116.55 113.24 1i75 n ASP 371 Ca 0.08 1.16 0.10 0.00 -1.38 0.00 0.00 54.79 54.75 1i75 n ASP 371 Cb 0.59 -0.93 0.30 0.00 -1.04 0.00 0.00 41.12 40.05 1i75 n ASP 371 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 1i75 n PRO 372 N 1.98 2.00 0.09 -0.67 -0.04 -1.26 -4.93 135.00 132.17 1i75 n PRO 372 Ca 0.22 -1.51 0.11 0.00 -0.04 0.00 0.00 63.50 62.28 1i75 n PRO 372 Cb 0.06 -1.42 0.44 0.00 -0.04 0.00 0.00 33.50 32.54 1i75 n PRO 372 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1i75 n ASP 373 N 0.73 0.47 -0.66 3.54 8.00 -0.34 -1.06 116.55 127.23 1i75 n ASP 373 Ca 0.17 0.60 0.10 0.00 0.71 0.00 0.00 54.79 56.38 1i75 n ASP 373 Cb 0.42 -0.71 0.33 0.00 -0.02 0.00 0.00 41.12 41.14 1i75 n ASP 373 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1i75 n ASN 374 N -2.01 1.98 -2.29 -2.24 6.94 -0.94 -4.21 115.26 112.50 1i75 n ASN 374 Ca 0.03 -1.78 -0.23 0.00 -0.02 0.00 0.00 54.58 52.59 1i75 n ASN 374 Cb 0.24 -0.14 0.02 0.00 -2.36 0.00 0.00 39.78 37.54 1i75 n ASN 374 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1i75 n ARG 375 N 0.53 3.27 -1.22 -3.83 1.74 -0.23 -4.90 116.66 112.02 1i75 n ARG 375 Ca 0.16 -4.20 -0.29 0.00 -0.77 0.00 0.00 57.85 52.75 1i75 n ARG 375 Cb 0.37 -2.16 0.15 0.00 -1.02 0.00 0.00 32.46 29.80 1i75 n ARG 375 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1i75 s ALA 376 N -3.57 1.42 0.33 7.54 0.00 -1.26 -4.91 121.76 121.31 1i75 s ALA 376 Ca 0.47 -0.17 -0.27 0.00 0.00 0.00 0.00 51.96 51.99 1i75 s ALA 376 Cb 0.40 -3.16 -0.09 0.00 0.00 0.00 0.00 23.12 20.27 1i75 s ALA 376 CO -0.05 -2.46 1.05 0.50 0.00 0.00 0.00 175.76 174.81 1i75 s ARG 377 N -4.97 4.44 0.22 0.00 3.52 -1.26 -4.88 118.95 116.02 1i75 s ARG 377 Ca 0.64 1.62 -0.30 0.00 -0.13 0.00 0.00 55.73 57.56 1i75 s ARG 377 Cb -0.18 -2.89 -0.08 0.00 -1.56 0.00 0.00 34.95 30.24 1i75 s ARG 377 CO 0.57 0.08 1.07 -0.48 -0.81 0.00 0.00 175.30 175.73 1i75 s LEU 378 N -1.99 4.54 0.02 -0.88 2.34 -0.75 -4.88 118.68 117.07 1i75 s LEU 378 Ca 0.50 2.12 0.28 0.00 0.06 0.00 0.00 54.13 57.09 1i75 s LEU 378 Cb -0.26 -3.61 0.98 0.00 -0.56 0.00 0.00 46.19 42.74 1i75 s LEU 378 CO 0.33 -0.13 1.76 -0.81 -1.06 0.00 0.00 176.35 176.44 1i75 n PRO 379 N 1.86 0.02 -3.51 1.48 -0.04 -1.26 -4.90 135.00 128.66 1i75 n PRO 379 Ca 0.01 0.01 -0.12 0.00 -0.04 0.00 0.00 63.50 63.36 1i75 n PRO 379 Cb 0.46 -1.52 -0.04 0.00 -0.04 0.00 0.00 33.50 32.36 1i75 n PRO 379 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1i75 s SER 380 N -3.12 -0.47 -0.27 3.54 0.15 -1.26 -5.05 113.70 107.22 1i75 s SER 380 Ca 0.13 0.26 0.10 0.00 0.70 0.00 0.00 55.95 57.14 1i75 s SER 380 Cb 0.18 0.44 0.46 0.00 -1.71 0.00 0.00 66.02 65.39 1i75 s SER 380 CO 0.59 -0.61 1.18 0.49 1.20 0.00 0.00 173.24 176.08 1i75 n PHE 381 N 0.23 2.17 -1.91 3.44 3.72 -1.26 -4.96 117.46 118.89 1i75 n PHE 381 Ca -0.13 -2.09 -0.42 0.00 -0.05 0.00 0.00 57.45 54.76 1i75 n PHE 381 Cb 0.60 -0.31 -0.03 0.00 -0.94 0.00 0.00 39.48 38.80 1i75 n PHE 381 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1i75 s SER 382 N -3.55 6.57 -0.07 4.37 0.15 -1.26 -4.90 113.70 115.00 1i75 s SER 382 Ca 0.46 2.60 0.17 0.00 0.70 0.00 0.00 55.95 59.88 1i75 s SER 382 Cb 0.39 -2.58 0.62 0.00 -1.71 0.00 0.00 66.02 62.73 1i75 s SER 382 CO 0.01 -0.86 1.51 0.35 1.20 0.00 0.00 173.24 175.45 1i75 n THR 383 N 4.20 1.40 -0.10 6.45 -2.24 -1.26 -4.34 114.28 118.40 1i75 n THR 383 Ca 0.15 -0.98 0.03 0.00 -2.27 0.00 0.00 64.05 60.98 1i75 n THR 383 Cb 0.39 0.16 0.09 0.00 -2.10 0.00 0.00 70.33 68.87 1i75 n THR 383 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1i75 n THR 384 N 1.08 0.98 -2.10 4.28 -2.24 -1.26 -4.75 114.28 110.27 1i75 n THR 384 Ca 0.22 -0.99 -0.34 0.00 -2.27 0.00 0.00 64.05 60.67 1i75 n THR 384 Cb 0.73 0.51 0.02 0.00 -2.10 0.00 0.00 70.33 69.48 1i75 n THR 384 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1i75 s THR 385 N -0.99 3.21 0.21 4.28 -4.23 -1.26 -4.88 115.64 111.98 1i75 s THR 385 Ca 0.13 0.69 -0.10 0.00 -1.18 0.00 0.00 61.69 61.24 1i75 s THR 385 Cb 0.07 -3.23 0.14 0.00 1.34 0.00 0.00 72.50 70.81 1i75 s THR 385 CO 0.09 -0.23 1.78 0.74 -0.54 0.00 0.00 174.62 176.46 1i75 h THR 386 N 0.81 0.88 -0.45 3.99 2.02 -1.95 -1.95 112.91 116.26 1i75 h THR 386 Ca -0.49 -0.19 0.05 0.00 0.77 0.00 0.00 66.41 66.55 1i75 h THR 386 Cb 1.26 0.29 -0.04 0.00 -1.74 0.00 0.00 68.15 67.91 1i75 h THR 386 CO 0.56 0.10 0.20 0.00 0.37 0.00 0.00 175.52 176.75 1i75 h ALA 387 N 1.37 0.56 -0.51 6.16 0.00 -1.92 0.18 119.26 125.10 1i75 h ALA 387 Ca 0.30 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.32 1i75 h ALA 387 Cb 0.27 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 1i75 h ALA 387 CO -0.23 -0.17 0.16 -0.92 0.00 0.00 0.00 179.25 178.09 1i75 h TYR 388 N 0.40 0.28 -0.27 0.00 3.20 -1.57 -1.92 116.97 117.09 1i75 h TYR 388 Ca 0.20 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 62.00 1i75 h TYR 388 Cb 0.15 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 1i75 h TYR 388 CO -0.12 0.07 -0.26 1.96 -1.64 0.00 0.00 178.16 178.17 1i75 h GLN 389 N 0.33 0.53 -0.56 1.82 4.20 -0.46 -0.60 115.11 120.38 1i75 h GLN 389 Ca 0.25 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 1i75 h GLN 389 Cb 0.29 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.02 1i75 h GLN 389 CO -0.27 0.75 0.34 0.28 -0.67 0.00 0.00 178.83 179.25 1i75 h VAL 390 N 0.47 1.17 -0.30 -0.54 2.07 -0.21 -0.54 116.25 118.37 1i75 h VAL 390 Ca 0.07 -0.37 -0.18 0.00 0.82 0.00 0.00 66.70 67.04 1i75 h VAL 390 Cb 0.70 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1i75 h VAL 390 CO 0.05 0.17 -0.53 0.40 0.02 0.00 0.00 177.57 177.69 1i75 h ILE 391 N 0.75 1.27 -0.89 4.57 2.04 -1.09 -2.36 117.51 121.80 1i75 h ILE 391 Ca 0.20 -1.71 0.02 0.00 1.00 0.00 0.00 64.86 64.38 1i75 h ILE 391 Cb -0.02 1.59 -0.05 0.00 -0.74 0.00 0.00 36.82 37.60 1i75 h ILE 391 CO -0.04 0.56 0.58 -0.61 0.00 0.00 0.00 178.15 178.65 1i75 h GLN 392 N 0.68 1.11 0.05 2.37 4.15 -0.72 0.18 115.11 122.94 1i75 h GLN 392 Ca 0.02 -0.07 -0.25 0.00 0.77 0.00 0.00 58.65 59.13 1i75 h GLN 392 Cb 1.13 -0.25 0.01 0.00 0.21 0.00 0.00 27.48 28.58 1i75 h GLN 392 CO 0.12 0.74 -1.06 0.87 -1.93 0.00 0.00 178.83 177.57 1i75 h LYS 393 N 1.15 0.41 0.03 1.69 1.57 -1.00 -3.41 116.57 117.01 1i75 h LYS 393 Ca 0.34 -0.50 -0.34 0.00 -1.87 0.00 0.00 60.65 58.28 1i75 h LYS 393 Cb -0.05 0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.37 1i75 h LYS 393 CO -0.09 1.17 -2.06 1.28 -0.57 0.00 0.00 179.45 179.18 1i75 n LEU 394 N -3.70 1.32 -0.25 2.94 4.77 -0.90 -4.48 117.00 116.70 1i75 n LEU 394 Ca -0.08 0.18 -0.05 0.00 -0.03 0.00 0.00 56.01 56.03 1i75 n LEU 394 Cb 0.90 -0.17 0.05 0.00 -2.33 0.00 0.00 43.42 41.87 1i75 n LEU 394 CO 0.53 0.60 1.15 0.00 -1.33 0.00 0.00 177.39 178.34 1i75 h ALA 395 N 0.66 0.88 0.00 -1.18 0.00 -1.18 -0.75 119.26 117.69 1i75 h ALA 395 Ca -0.43 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1i75 h ALA 395 Cb 2.06 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1i75 h ALA 395 CO 0.04 0.32 0.14 -1.00 0.00 0.00 0.00 179.25 178.75 1i75 h PRO 396 N 0.95 0.00 0.00 0.00 0.13 -1.78 -2.31 132.00 128.98 1i75 h PRO 396 Ca 0.25 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.37 1i75 h PRO 396 Cb -0.08 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.04 1i75 h PRO 396 CO -0.05 0.00 -0.06 -0.07 -0.23 0.00 0.00 178.00 177.59 1i75 h LEU 397 N 0.00 0.00 -1.02 1.56 3.38 -1.36 -1.64 115.31 116.23 1i75 h LEU 397 Ca 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1i75 h LEU 397 Cb 0.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1i75 h LEU 397 CO 0.00 0.06 -0.20 0.03 0.09 0.00 0.00 178.44 178.42 1i75 h ARG 398 N 0.00 0.47 0.18 1.13 3.08 -1.55 0.32 114.38 118.01 1i75 h ARG 398 Ca -0.00 -0.16 -0.31 0.00 0.07 0.00 0.00 59.98 59.58 1i75 h ARG 398 Cb 0.36 -0.04 0.02 0.00 0.08 0.00 0.00 29.97 30.39 1i75 h ARG 398 CO 0.01 0.65 -1.42 0.87 -1.07 0.00 0.00 179.97 179.01 1i75 h LYS 399 N 0.42 0.39 0.00 0.04 1.79 -1.33 -3.40 116.57 114.48 1i75 h LYS 399 Ca 0.07 -0.66 0.00 0.00 -2.18 0.00 0.00 60.65 57.88 1i75 h LYS 399 Cb 0.59 0.25 0.00 0.00 -1.58 0.00 0.00 32.23 31.49 1i75 h LYS 399 CO 0.04 1.31 -1.28 -1.13 -1.08 0.00 0.00 179.45 177.31 1i75 n SER 400 N -3.60 0.56 -4.01 0.86 3.41 -0.82 -4.75 113.62 105.27 1i75 n SER 400 Ca -0.14 0.12 -0.31 0.00 -0.26 0.00 0.00 58.87 58.28 1i75 n SER 400 Cb 1.06 0.94 -0.15 0.00 -0.26 0.00 0.00 64.21 65.81 1i75 n SER 400 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1i75 s ASN 401 N -4.81 4.52 0.59 4.04 3.84 0.11 -4.97 114.94 118.25 1i75 s ASN 401 Ca -0.02 -1.76 0.29 0.00 0.21 0.00 0.00 52.86 51.59 1i75 s ASN 401 Cb 0.12 -1.51 1.61 0.00 -0.55 0.00 0.00 41.25 40.91 1i75 s ASN 401 CO 0.82 -0.30 2.04 -0.65 -2.79 0.00 0.00 177.10 176.22 1i75 h PRO 402 N 7.73 0.00 -0.44 0.43 0.11 -1.85 -0.74 132.00 137.24 1i75 h PRO 402 Ca -0.11 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.88 1i75 h PRO 402 Cb 1.03 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 1i75 h PRO 402 CO 0.48 0.00 -0.18 0.00 -0.21 0.00 0.00 178.00 178.09 1i75 h ALA 403 N 1.67 0.85 -0.13 -0.75 0.00 -1.82 0.19 119.26 119.28 1i75 h ALA 403 Ca 0.12 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.60 1i75 h ALA 403 Cb 0.69 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1i75 h ALA 403 CO -0.00 0.64 -0.20 0.82 0.00 0.00 0.00 179.25 180.51 1i75 h ILE 404 N 0.75 1.37 -0.42 0.00 1.08 -1.45 0.21 117.51 119.05 1i75 h ILE 404 Ca 0.11 -1.43 -0.14 0.00 -0.39 0.00 0.00 64.86 63.01 1i75 h ILE 404 Cb 0.71 1.99 -0.01 0.00 -3.07 0.00 0.00 36.82 36.44 1i75 h ILE 404 CO 0.05 0.42 -0.30 0.00 -0.69 0.00 0.00 178.15 177.64 1i75 h ALA 405 N 0.56 0.67 0.00 1.87 0.00 -1.28 -3.40 119.26 117.68 1i75 h ALA 405 Ca 0.01 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1i75 h ALA 405 Cb 0.76 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1i75 h ALA 405 CO 0.05 0.67 -0.05 0.66 0.00 0.00 0.00 179.25 180.58 1i75 n TYR 406 N -4.08 0.00 -1.34 0.00 4.02 0.66 -4.67 117.16 111.76 1i75 n TYR 406 Ca -0.01 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.59 1i75 n TYR 406 Cb 0.50 0.00 0.17 0.00 -0.02 0.00 0.00 39.34 39.98 1i75 n TYR 406 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1i75 s GLY 407 N -0.69 1.58 0.81 2.72 0.00 0.74 -4.96 107.32 107.51 1i75 s GLY 407 Ca 0.00 -0.55 -0.11 0.00 0.00 0.00 0.00 44.72 44.06 1i75 s GLY 407 CO 0.00 0.09 1.10 -1.35 0.00 0.00 0.00 173.10 172.93 1i75 s SER 408 N -3.80 4.41 -0.11 1.64 1.04 -0.67 -4.69 113.70 111.51 1i75 s SER 408 Ca 0.66 1.33 0.03 0.00 0.48 0.00 0.00 55.95 58.45 1i75 s SER 408 Cb -0.15 -2.06 0.01 0.00 0.10 0.00 0.00 66.02 63.91 1i75 s SER 408 CO 0.55 -2.03 -0.20 -0.89 0.98 0.00 0.00 173.24 171.65 1i75 s THR 409 N -3.13 1.85 -0.10 2.02 2.01 -1.26 -2.62 115.64 114.41 1i75 s THR 409 Ca 0.61 -0.88 -0.01 0.00 0.31 0.00 0.00 61.69 61.72 1i75 s THR 409 Cb -0.15 -1.64 0.03 0.00 0.01 0.00 0.00 72.50 70.75 1i75 s THR 409 CO 0.54 0.51 -0.04 -2.28 -0.69 0.00 0.00 174.62 172.67 1i75 s HIS 410 N 0.66 1.15 -0.10 4.92 5.04 -0.17 -4.96 115.29 121.82 1i75 s HIS 410 Ca -0.12 -0.53 -0.30 0.00 -1.54 0.00 0.00 55.06 52.57 1i75 s HIS 410 Cb -0.16 -1.06 -0.02 0.00 0.04 0.00 0.00 32.58 31.38 1i75 s HIS 410 CO 0.03 -0.45 1.13 -2.00 -2.34 0.00 0.00 174.74 171.11 1i75 s GLU 411 N 1.82 4.35 -0.10 2.88 -6.30 -1.26 -0.40 118.70 119.68 1i75 s GLU 411 Ca 0.05 1.56 0.16 0.00 -2.50 0.00 0.00 54.97 54.23 1i75 s GLU 411 Cb -0.13 -3.59 -0.24 0.00 0.00 0.00 0.00 34.13 30.17 1i75 s GLU 411 CO -0.07 -0.46 0.21 0.54 0.02 0.00 0.00 175.26 175.50 1i75 n ARG 412 N 5.45 0.94 -3.64 4.30 5.12 0.22 -4.95 116.66 124.09 1i75 n ARG 412 Ca 0.11 -0.08 -0.15 0.00 -1.93 0.00 0.00 57.85 55.80 1i75 n ARG 412 Cb 0.47 -1.43 -0.08 0.00 -1.16 0.00 0.00 32.46 30.26 1i75 n ARG 412 CO 0.00 0.00 0.00 -0.46 -1.93 0.00 0.00 177.63 175.24 1i75 s TRP 413 N -2.79 -0.49 -0.00 -1.55 -0.00 -1.12 -4.69 118.94 108.29 1i75 s TRP 413 Ca -0.07 0.95 -0.29 0.00 -0.00 0.00 0.00 56.10 56.69 1i75 s TRP 413 Cb 0.08 0.25 0.08 0.00 -0.00 0.00 0.00 33.47 33.88 1i75 s TRP 413 CO 0.71 -0.45 0.70 -1.50 -0.00 0.00 0.00 176.95 176.41 1i75 s ILE 414 N -0.83 0.00 0.05 5.86 2.07 -1.26 -0.90 121.20 126.19 1i75 s ILE 414 Ca -0.09 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.14 1i75 s ILE 414 Cb -0.03 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.57 1i75 s ILE 414 CO 0.06 0.00 0.08 -0.46 -1.91 0.00 0.00 174.94 172.71 1i75 n ASN 415 N 0.51 -0.24 -0.07 4.50 0.23 -0.48 -4.97 115.26 114.74 1i75 n ASN 415 Ca -0.17 -1.21 0.15 0.00 -0.53 0.00 0.00 54.58 52.81 1i75 n ASN 415 Cb 0.59 0.41 0.56 0.00 -2.08 0.00 0.00 39.78 39.26 1i75 n ASN 415 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 1i75 h ASN 416 N 0.24 0.26 -0.00 0.53 4.21 -1.98 -3.19 115.58 115.66 1i75 h ASN 416 Ca -0.04 0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.48 1i75 h ASN 416 Cb 0.15 -0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.31 1i75 h ASN 416 CO 0.05 0.15 -0.17 0.47 -1.29 0.00 0.00 177.43 176.64 1i75 n ASP 417 N -4.45 0.55 -4.07 5.81 8.00 -1.26 -1.34 116.55 119.80 1i75 n ASP 417 Ca 0.11 -0.78 -0.23 0.00 0.71 0.00 0.00 54.79 54.60 1i75 n ASP 417 Cb 0.47 0.74 -0.16 0.00 -0.02 0.00 0.00 41.12 42.15 1i75 n ASP 417 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1i75 s VAL 418 N -1.20 1.10 0.01 2.53 1.01 -1.20 -0.82 120.40 121.83 1i75 s VAL 418 Ca 0.03 -0.54 0.04 0.00 0.00 0.00 0.00 61.98 61.52 1i75 s VAL 418 Cb 0.04 -0.96 -0.01 0.00 0.00 0.00 0.00 36.38 35.44 1i75 s VAL 418 CO 0.17 0.33 -0.12 -0.51 0.00 0.00 0.00 175.10 174.96 1i75 s ILE 419 N 0.12 0.97 -0.12 2.22 2.07 -0.80 -1.38 121.20 124.28 1i75 s ILE 419 Ca -0.03 -0.72 0.00 0.00 -1.41 0.00 0.00 60.65 58.49 1i75 s ILE 419 Cb -0.10 -0.85 0.02 0.00 0.13 0.00 0.00 42.46 41.66 1i75 s ILE 419 CO 0.01 0.13 -0.10 -0.63 -1.91 0.00 0.00 174.94 172.44 1i75 s ILE 420 N -0.55 1.23 0.18 2.00 1.01 -0.08 -1.31 121.20 123.69 1i75 s ILE 420 Ca 0.03 -0.43 0.08 0.00 0.00 0.00 0.00 60.65 60.33 1i75 s ILE 420 Cb -0.06 -1.20 -0.04 0.00 0.01 0.00 0.00 42.46 41.16 1i75 s ILE 420 CO 0.00 0.40 -0.16 -0.72 0.00 0.00 0.00 174.94 174.47 1i75 s TYR 421 N 1.57 1.71 -0.00 3.97 1.13 -0.60 -0.61 117.35 124.51 1i75 s TYR 421 Ca 0.04 -0.53 0.08 0.00 -1.41 0.00 0.00 57.07 55.24 1i75 s TYR 421 Cb -0.13 -0.83 -0.02 0.00 -1.10 0.00 0.00 41.96 39.88 1i75 s TYR 421 CO -0.08 0.32 -0.24 -2.00 -2.51 0.00 0.00 175.55 171.04 1i75 s GLU 422 N -3.19 1.88 -0.06 -3.49 2.12 0.46 -1.21 118.70 115.21 1i75 s GLU 422 Ca 0.18 -0.90 0.04 0.00 0.36 0.00 0.00 54.97 54.65 1i75 s GLU 422 Cb -0.03 -1.87 -0.02 0.00 0.26 0.00 0.00 34.13 32.47 1i75 s GLU 422 CO 0.06 0.51 -0.17 1.03 -0.54 0.00 0.00 175.26 176.14 1i75 s ARG 423 N -0.71 2.55 -0.10 4.30 1.81 0.36 -1.00 118.95 126.16 1i75 s ARG 423 Ca 0.09 -0.76 -0.06 0.00 -1.72 0.00 0.00 55.73 53.29 1i75 s ARG 423 Cb -0.09 -2.32 0.04 0.00 -0.45 0.00 0.00 34.95 32.12 1i75 s ARG 423 CO -0.00 0.53 0.23 0.21 -0.68 0.00 0.00 175.30 175.59 1i75 s LYS 424 N -0.50 0.21 -0.25 3.54 2.20 -1.08 -1.42 119.74 122.43 1i75 s LYS 424 Ca 0.06 0.47 -0.02 0.00 -0.36 0.00 0.00 55.97 56.12 1i75 s LYS 424 Cb -0.12 -0.08 0.12 0.00 -1.51 0.00 0.00 37.83 36.24 1i75 s LYS 424 CO 0.01 -0.14 0.25 0.12 -0.36 0.00 0.00 175.35 175.24 1i75 s PHE 425 N 1.02 -0.34 0.00 4.03 5.36 -0.48 -1.66 117.98 125.92 1i75 s PHE 425 Ca -0.07 -0.03 0.00 0.00 -0.96 0.00 0.00 56.93 55.87 1i75 s PHE 425 Cb -0.09 -0.44 0.00 0.00 -0.34 0.00 0.00 43.02 42.16 1i75 s PHE 425 CO -0.07 -0.78 0.00 0.41 -1.46 0.00 0.00 175.22 173.33 1i75 n GLY 426 N 5.31 3.58 1.28 13.12 0.00 -1.26 -1.41 105.19 125.82 1i75 n GLY 426 Ca -0.04 -0.08 0.10 0.00 0.00 0.00 0.00 46.02 46.01 1i75 n GLY 426 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1i75 n ASN 427 N 8.79 3.99 -4.83 1.61 4.13 -1.26 -4.91 115.26 122.78 1i75 n ASN 427 Ca 0.00 -2.13 -0.38 0.00 1.68 0.00 0.00 54.58 53.75 1i75 n ASN 427 Cb 0.00 -0.47 -0.06 0.00 -1.54 0.00 0.00 39.78 37.71 1i75 n ASN 427 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 1i75 s ASN 428 N -1.00 6.75 0.01 6.41 0.01 -0.50 -4.40 114.94 122.21 1i75 s ASN 428 Ca 0.45 0.89 0.00 0.00 -0.71 0.00 0.00 52.86 53.49 1i75 s ASN 428 Cb 0.25 -2.23 -0.01 0.00 0.41 0.00 0.00 41.25 39.67 1i75 s ASN 428 CO 0.28 0.31 -0.02 -0.69 -1.51 0.00 0.00 177.10 175.47 1i75 s VAL 429 N -0.94 0.09 0.01 1.60 1.01 -0.57 -1.38 120.40 120.23 1i75 s VAL 429 Ca 0.23 -0.37 0.01 0.00 0.00 0.00 0.00 61.98 61.84 1i75 s VAL 429 Cb -0.16 -0.14 -0.01 0.00 0.00 0.00 0.00 36.38 36.07 1i75 s VAL 429 CO 0.12 -0.18 -0.05 0.00 0.00 0.00 0.00 175.10 174.99 1i75 s ALA 430 N -0.57 0.37 -0.05 5.51 0.00 -0.51 -1.28 121.76 125.23 1i75 s ALA 430 Ca -0.06 -0.39 0.03 0.00 0.00 0.00 0.00 51.96 51.54 1i75 s ALA 430 Cb -0.04 -0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.07 1i75 s ALA 430 CO -0.00 0.02 -0.11 0.08 0.00 0.00 0.00 175.76 175.74 1i75 s VAL 431 N -0.62 1.04 -0.05 0.00 1.01 0.24 -0.49 120.40 121.54 1i75 s VAL 431 Ca -0.04 -0.45 0.04 0.00 0.00 0.00 0.00 61.98 61.53 1i75 s VAL 431 Cb -0.05 -0.94 -0.00 0.00 0.00 0.00 0.00 36.38 35.39 1i75 s VAL 431 CO -0.00 0.33 -0.17 -0.69 0.00 0.00 0.00 175.10 174.56 1i75 s VAL 432 N 0.48 1.45 -0.06 2.92 1.01 -0.35 -0.54 120.40 125.31 1i75 s VAL 432 Ca -0.10 -0.73 0.04 0.00 0.00 0.00 0.00 61.98 61.19 1i75 s VAL 432 Cb -0.13 -1.25 0.00 0.00 0.00 0.00 0.00 36.38 35.00 1i75 s VAL 432 CO 0.02 0.42 -0.18 0.00 0.00 0.00 0.00 175.10 175.36 1i75 s ALA 433 N 0.06 1.65 -0.04 5.51 0.00 -0.20 -1.56 121.76 127.17 1i75 s ALA 433 Ca -0.04 -0.71 0.01 0.00 0.00 0.00 0.00 51.96 51.21 1i75 s ALA 433 Cb -0.12 -0.60 0.02 0.00 0.00 0.00 0.00 23.12 22.43 1i75 s ALA 433 CO 0.02 0.25 -0.03 0.42 0.00 0.00 0.00 175.76 176.42 1i75 s ILE 434 N 0.23 0.47 -0.32 0.00 1.01 -0.42 -1.83 121.20 120.34 1i75 s ILE 434 Ca -0.09 -0.08 -0.01 0.00 0.00 0.00 0.00 60.65 60.47 1i75 s ILE 434 Cb -0.14 -0.52 0.07 0.00 0.01 0.00 0.00 42.46 41.88 1i75 s ILE 434 CO 0.04 0.22 0.03 0.21 0.00 0.00 0.00 174.94 175.44 1i75 s ASN 435 N 1.00 4.92 0.01 3.58 3.04 -0.03 -1.90 114.94 125.55 1i75 s ASN 435 Ca -0.10 -1.49 0.28 0.00 0.04 0.00 0.00 52.86 51.59 1i75 s ASN 435 Cb -0.14 -1.72 1.14 0.00 -1.54 0.00 0.00 41.25 38.99 1i75 s ASN 435 CO -0.01 -0.32 1.86 -2.11 -3.04 0.00 0.00 177.10 173.49 1i75 n ARG 436 N 4.57 0.01 -2.55 0.43 1.85 0.00 -3.00 116.66 117.97 1i75 n ARG 436 Ca -0.10 0.01 -0.42 0.00 -1.00 0.00 0.00 57.85 56.34 1i75 n ARG 436 Cb 0.43 -1.51 -0.03 0.00 -1.05 0.00 0.00 32.46 30.30 1i75 n ARG 436 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 1i75 s ASN 437 N -3.04 7.20 0.00 2.89 3.84 -1.26 -4.69 114.94 119.87 1i75 s ASN 437 Ca 0.14 1.84 0.25 0.00 0.21 0.00 0.00 52.86 55.29 1i75 s ASN 437 Cb 0.19 -2.57 0.50 0.00 -0.55 0.00 0.00 41.25 38.81 1i75 s ASN 437 CO 0.55 -0.40 1.40 0.23 -2.79 0.00 0.00 177.10 176.09 1i75 n MET 438 N 4.10 0.59 0.00 0.43 2.81 -1.26 -0.76 117.12 123.03 1i75 n MET 438 Ca 0.08 -0.39 0.00 0.00 -1.81 0.00 0.00 57.70 55.58 1i75 n MET 438 Cb 0.48 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.50 1i75 n MET 438 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 1i75 n ASN 439 N -0.86 0.17 -4.17 7.83 6.94 -1.26 -4.63 115.26 119.28 1i75 n ASN 439 Ca 0.09 -0.56 -0.33 0.00 -0.02 0.00 0.00 54.58 53.76 1i75 n ASN 439 Cb 0.36 0.76 -0.16 0.00 -2.36 0.00 0.00 39.78 38.38 1i75 n ASN 439 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1i75 s THR 440 N -0.76 2.20 0.54 5.53 2.01 -1.26 -4.91 115.64 118.99 1i75 s THR 440 Ca 0.00 -0.91 -0.21 0.00 0.31 0.00 0.00 61.69 60.88 1i75 s THR 440 Cb 0.00 -1.91 -0.05 0.00 0.01 0.00 0.00 72.50 70.55 1i75 s THR 440 CO 0.00 0.54 1.27 -2.16 -0.69 0.00 0.00 174.62 173.57 1i75 s PRO 441 N 1.06 3.21 -0.22 4.92 0.04 -1.26 -4.18 135.00 138.57 1i75 s PRO 441 Ca -0.01 2.00 -0.08 0.00 0.04 0.00 0.00 61.00 62.95 1i75 s PRO 441 Cb -0.14 -2.18 -0.04 0.00 0.04 0.00 0.00 34.50 32.18 1i75 s PRO 441 CO -0.07 -1.06 0.09 0.00 0.04 0.00 0.00 177.00 176.00 1i75 s ALA 442 N -1.45 3.39 -0.38 8.56 0.00 -0.14 -4.94 121.76 126.80 1i75 s ALA 442 Ca 0.72 -0.89 -0.29 0.00 0.00 0.00 0.00 51.96 51.50 1i75 s ALA 442 Cb -0.35 -2.07 0.02 0.00 0.00 0.00 0.00 23.12 20.73 1i75 s ALA 442 CO 0.40 -0.10 1.11 0.45 0.00 0.00 0.00 175.76 177.62 1i75 s SER 443 N 0.90 6.80 -0.25 0.00 0.15 -1.26 -0.61 113.70 119.43 1i75 s SER 443 Ca 0.05 0.85 -0.13 0.00 0.70 0.00 0.00 55.95 57.41 1i75 s SER 443 Cb -0.14 -2.55 -0.04 0.00 -1.71 0.00 0.00 66.02 61.59 1i75 s SER 443 CO 0.03 -1.03 0.29 -0.63 1.20 0.00 0.00 173.24 173.09 1i75 s ILE 444 N 4.00 5.25 0.02 6.45 -1.09 0.25 -4.99 121.20 131.08 1i75 s ILE 444 Ca 0.47 0.42 0.05 0.00 -2.23 0.00 0.00 60.65 59.35 1i75 s ILE 444 Cb -0.11 -3.62 -0.02 0.00 -1.58 0.00 0.00 42.46 37.14 1i75 s ILE 444 CO 0.22 0.23 -0.14 0.42 -1.23 0.00 0.00 174.94 174.45 1i75 s THR 445 N 1.65 1.09 0.00 2.92 -4.23 -1.26 -2.72 115.64 113.09 1i75 s THR 445 Ca 0.12 -0.79 0.00 0.00 -1.18 0.00 0.00 61.69 59.84 1i75 s THR 445 Cb -0.15 -0.95 0.00 0.00 1.34 0.00 0.00 72.50 72.74 1i75 s THR 445 CO 0.09 0.15 0.00 0.61 -0.54 0.00 0.00 174.62 174.92 1i75 n GLY 446 N 2.31 0.47 3.70 3.99 0.00 -1.26 -5.00 105.19 109.39 1i75 n GLY 446 Ca -0.16 -0.92 -0.42 0.00 0.00 0.00 0.00 46.02 44.52 1i75 n GLY 446 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1i75 s LEU 447 N 0.00 4.32 0.03 0.99 2.96 -1.26 -5.01 118.68 120.71 1i75 s LEU 447 Ca 0.00 1.65 0.09 0.00 -0.22 0.00 0.00 54.13 55.65 1i75 s LEU 447 Cb 0.00 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 43.10 1i75 s LEU 447 CO 0.00 -0.37 -0.26 -0.69 -1.32 0.00 0.00 176.35 173.70 1i75 s VAL 448 N 1.49 2.13 0.32 1.68 1.01 -1.26 -1.76 120.40 124.00 1i75 s VAL 448 Ca 0.51 -1.31 0.06 0.00 0.00 0.00 0.00 61.98 61.24 1i75 s VAL 448 Cb -0.21 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.34 1i75 s VAL 448 CO 0.24 0.43 0.24 0.42 0.00 0.00 0.00 175.10 176.42 1i75 s THR 449 N -0.75 0.07 -1.22 3.92 -4.23 0.11 -4.92 115.64 108.62 1i75 s THR 449 Ca 0.11 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 58.79 1i75 s THR 449 Cb -0.10 -2.48 0.65 0.00 1.34 0.00 0.00 72.50 71.91 1i75 s THR 449 CO 0.01 0.00 1.54 -1.20 -0.54 0.00 0.00 174.62 174.44 1i75 n SER 450 N -1.33 4.32 -4.74 3.99 7.64 -1.26 -4.21 113.62 118.02 1i75 n SER 450 Ca 0.05 -2.39 -0.41 0.00 1.01 0.00 0.00 58.87 57.14 1i75 n SER 450 Cb 0.63 -0.55 -0.05 0.00 -1.01 0.00 0.00 64.21 63.24 1i75 n SER 450 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1i75 s LEU 451 N -1.68 4.55 0.85 -3.43 1.43 -1.26 -4.97 118.68 114.18 1i75 s LEU 451 Ca 0.46 1.89 -0.10 0.00 -1.03 0.00 0.00 54.13 55.35 1i75 s LEU 451 Cb 0.30 -3.60 0.10 0.00 0.03 0.00 0.00 46.19 43.02 1i75 s LEU 451 CO 0.23 -0.00 1.11 -2.16 0.23 0.00 0.00 176.35 175.76 1i75 s PRO 452 N -0.50 1.60 0.19 1.29 0.04 -1.26 -3.97 135.00 132.40 1i75 s PRO 452 Ca 0.45 1.29 -0.33 0.00 0.04 0.00 0.00 61.00 62.45 1i75 s PRO 452 Cb -0.25 -1.81 -0.15 0.00 0.04 0.00 0.00 34.50 32.33 1i75 s PRO 452 CO 0.31 -2.14 1.29 -2.13 0.04 0.00 0.00 177.00 174.37 1i75 n ARG 453 N -3.87 1.53 0.00 4.56 0.63 -1.25 -4.84 116.66 113.41 1i75 n ARG 453 Ca 0.10 0.55 0.00 0.00 -0.92 0.00 0.00 57.85 57.57 1i75 n ARG 453 Cb 0.53 -2.13 0.00 0.00 0.45 0.00 0.00 32.46 31.31 1i75 n ARG 453 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1i75 n GLY 454 N 2.19 -0.13 3.12 5.14 0.00 -0.21 -4.98 105.19 110.32 1i75 n GLY 454 Ca 0.14 -1.16 -0.37 0.00 0.00 0.00 0.00 46.02 44.63 1i75 n GLY 454 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1i75 s SER 455 N 0.00 5.33 -0.06 1.61 0.01 -1.26 -1.06 113.70 118.26 1i75 s SER 455 Ca 0.00 -2.48 -0.27 0.00 1.31 0.00 0.00 55.95 54.51 1i75 s SER 455 Cb 0.00 -1.87 -0.03 0.00 0.21 0.00 0.00 66.02 64.33 1i75 s SER 455 CO 0.00 -0.47 0.86 -0.31 0.41 0.00 0.00 173.24 173.73 1i75 s TYR 456 N 0.49 3.58 0.06 2.43 2.02 0.30 -4.86 117.35 121.36 1i75 s TYR 456 Ca 0.13 1.45 -0.22 0.00 -0.37 0.00 0.00 57.07 58.06 1i75 s TYR 456 Cb -0.21 -2.99 -0.06 0.00 -0.40 0.00 0.00 41.96 38.29 1i75 s TYR 456 CO -0.04 -0.03 0.67 -0.80 -1.57 0.00 0.00 175.55 173.78 1i75 s ASN 457 N 0.96 7.15 -0.15 2.29 -0.87 -1.26 -0.99 114.94 122.07 1i75 s ASN 457 Ca 0.44 1.36 -0.33 0.00 -1.57 0.00 0.00 52.86 52.76 1i75 s ASN 457 Cb -0.19 -2.42 -0.11 0.00 -0.02 0.00 0.00 41.25 38.52 1i75 s ASN 457 CO 0.21 0.14 1.99 -0.67 -2.57 0.00 0.00 177.10 176.20 1i75 n ASP 458 N 2.28 3.22 -0.09 -1.22 2.03 -1.26 -4.73 116.55 116.78 1i75 n ASP 458 Ca -0.06 0.77 0.18 0.00 0.52 0.00 0.00 54.79 56.20 1i75 n ASP 458 Cb 0.50 -1.38 0.60 0.00 -0.72 0.00 0.00 41.12 40.12 1i75 n ASP 458 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 1i75 h VAL 459 N 5.99 0.75 0.00 5.18 2.07 -1.51 0.39 116.25 129.12 1i75 h VAL 459 Ca -0.44 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.01 1i75 h VAL 459 Cb 1.28 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1i75 h VAL 459 CO 0.96 0.04 0.00 0.18 0.02 0.00 0.00 177.57 178.77 1i75 n LEU 460 N -4.42 0.00 -2.70 2.57 4.77 -1.26 -4.89 117.00 111.06 1i75 n LEU 460 Ca 0.13 0.12 -0.22 0.00 -0.03 0.00 0.00 56.01 56.01 1i75 n LEU 460 Cb 0.59 -0.12 0.01 0.00 -2.33 0.00 0.00 43.42 41.57 1i75 n LEU 460 CO 0.35 -0.03 -0.14 0.61 -1.33 0.00 0.00 177.39 176.85 1i75 n GLY 461 N 0.62 -0.51 2.82 -0.72 0.00 0.13 -2.05 105.19 105.48 1i75 n GLY 461 Ca 0.15 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1i75 n GLY 461 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i75 n GLY 462 N -1.27 0.41 0.27 -0.02 0.00 -1.26 -4.89 105.19 98.43 1i75 n GLY 462 Ca -0.18 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.00 1i75 n GLY 462 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1i75 h ILE 463 N 0.00 0.07 -0.99 -0.61 3.07 -1.77 -0.95 117.51 116.33 1i75 h ILE 463 Ca 0.00 -0.63 -0.61 0.00 1.55 0.00 0.00 64.86 65.17 1i75 h ILE 463 Cb 0.25 1.59 -0.37 0.00 -0.27 0.00 0.00 36.82 38.01 1i75 h ILE 463 CO 0.00 0.03 -0.12 0.18 -1.05 0.00 0.00 178.15 177.19 1i75 n LEU 464 N -3.13 6.02 -3.16 0.16 4.77 -1.26 -4.91 117.00 115.48 1i75 n LEU 464 Ca 0.01 -4.65 -0.23 0.00 -0.03 0.00 0.00 56.01 51.12 1i75 n LEU 464 Cb 0.34 -0.61 0.02 0.00 -2.33 0.00 0.00 43.42 40.84 1i75 n LEU 464 CO 0.29 1.88 -0.01 0.59 -1.33 0.00 0.00 177.39 178.81 1i75 n ASN 465 N -0.75 -5.16 -3.76 -1.43 3.02 -0.36 -1.24 115.26 105.58 1i75 n ASN 465 Ca 0.51 -0.33 -0.29 0.00 -0.03 0.00 0.00 54.58 54.44 1i75 n ASN 465 Cb 0.79 -4.20 0.21 0.00 -0.61 0.00 0.00 39.78 35.97 1i75 n ASN 465 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1i75 n GLY 466 N -1.39 -1.83 3.48 7.41 0.00 -1.21 -4.49 105.19 107.16 1i75 n GLY 466 Ca -0.07 -1.65 -0.10 0.00 0.00 0.00 0.00 46.02 44.19 1i75 n GLY 466 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i75 s ASN 467 N -5.36 0.03 0.39 1.61 4.22 -1.26 -4.53 114.94 110.05 1i75 s ASN 467 Ca 0.72 -1.09 -0.22 0.00 -2.14 0.00 0.00 52.86 50.13 1i75 s ASN 467 Cb -0.03 0.53 -0.11 0.00 1.28 0.00 0.00 41.25 42.93 1i75 s ASN 467 CO 0.52 -1.07 0.94 -0.89 -2.04 0.00 0.00 177.10 174.55 1i75 s THR 468 N -4.00 4.35 -0.19 0.54 2.01 -1.26 -3.97 115.64 113.11 1i75 s THR 468 Ca 0.27 1.56 -0.03 0.00 0.31 0.00 0.00 61.69 63.80 1i75 s THR 468 Cb 0.01 -3.72 -0.01 0.00 0.01 0.00 0.00 72.50 68.79 1i75 s THR 468 CO 0.10 -0.17 -0.05 -0.22 -0.69 0.00 0.00 174.62 173.59 1i75 s LEU 469 N -2.83 2.97 -0.27 4.42 2.96 -0.16 -4.95 118.68 120.83 1i75 s LEU 469 Ca 0.58 -0.31 -0.10 0.00 -0.22 0.00 0.00 54.13 54.08 1i75 s LEU 469 Cb -0.12 -1.74 -0.05 0.00 0.50 0.00 0.00 46.19 44.79 1i75 s LEU 469 CO 0.16 0.06 0.17 -0.89 -1.32 0.00 0.00 176.35 174.53 1i75 s THR 470 N 1.03 5.20 -0.12 3.68 2.01 -1.26 -0.54 115.64 125.63 1i75 s THR 470 Ca 0.00 0.13 0.02 0.00 0.31 0.00 0.00 61.69 62.16 1i75 s THR 470 Cb -0.15 -3.46 -0.00 0.00 0.01 0.00 0.00 72.50 68.90 1i75 s THR 470 CO 0.00 0.28 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.32 1i75 s VAL 471 N 1.60 2.39 0.00 3.82 1.01 -0.23 -0.32 120.40 128.67 1i75 s VAL 471 Ca 0.07 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.15 1i75 s VAL 471 Cb -0.15 -1.95 0.00 0.00 0.00 0.00 0.00 36.38 34.28 1i75 s VAL 471 CO 0.09 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.34 1i75 n GLY 472 N 3.61 2.04 3.75 4.51 0.00 -0.35 -1.04 105.19 117.72 1i75 n GLY 472 Ca -0.19 -1.90 -0.41 0.00 0.00 0.00 0.00 46.02 43.52 1i75 n GLY 472 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i75 s ALA 473 N -2.92 3.43 -0.25 4.61 0.00 -1.26 -2.99 121.76 122.38 1i75 s ALA 473 Ca 0.00 0.96 0.00 0.00 0.00 0.00 0.00 51.96 52.92 1i75 s ALA 473 Cb 0.00 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.75 1i75 s ALA 473 CO 0.00 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 175.88 1i75 n GLY 474 N 1.46 0.57 2.44 0.00 0.00 -1.26 -3.40 105.19 105.00 1i75 n GLY 474 Ca 0.01 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.40 1i75 n GLY 474 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i75 n GLY 475 N -2.51 0.35 3.69 -0.02 0.00 -1.16 -4.70 105.19 100.84 1i75 n GLY 475 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1i75 n GLY 475 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i75 s ALA 476 N -1.75 3.43 0.25 4.61 0.00 -1.22 -0.72 121.76 126.37 1i75 s ALA 476 Ca 0.00 0.59 -0.19 0.00 0.00 0.00 0.00 51.96 52.36 1i75 s ALA 476 Cb 0.00 -3.47 -0.09 0.00 0.00 0.00 0.00 23.12 19.56 1i75 s ALA 476 CO 0.00 -0.64 0.74 0.00 0.00 0.00 0.00 175.76 175.86 1i75 s ALA 477 N 1.91 3.38 0.45 0.00 0.00 -0.72 -1.21 121.76 125.57 1i75 s ALA 477 Ca 0.54 0.14 -0.23 0.00 0.00 0.00 0.00 51.96 52.41 1i75 s ALA 477 Cb -0.23 -2.82 -0.08 0.00 0.00 0.00 0.00 23.12 19.99 1i75 s ALA 477 CO 0.22 0.32 1.13 -1.54 0.00 0.00 0.00 175.76 175.90 1i75 s SER 478 N -1.83 6.32 0.61 0.00 1.04 0.57 -4.64 113.70 115.77 1i75 s SER 478 Ca 0.46 2.21 -0.18 0.00 0.48 0.00 0.00 55.95 58.93 1i75 s SER 478 Cb -0.15 -2.60 -0.04 0.00 0.10 0.00 0.00 66.02 63.33 1i75 s SER 478 CO 0.20 -0.81 0.98 0.59 0.98 0.00 0.00 173.24 175.18 1i75 n ASN 479 N -0.42 0.81 -3.81 7.02 3.02 -1.26 -4.72 115.26 115.89 1i75 n ASN 479 Ca 0.07 0.80 -0.09 0.00 -0.03 0.00 0.00 54.58 55.32 1i75 n ASN 479 Cb 0.49 -1.40 -0.04 0.00 -0.61 0.00 0.00 39.78 38.22 1i75 n ASN 479 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1i75 s PHE 480 N -1.52 -0.02 -0.25 3.10 -0.12 -1.10 -5.02 117.98 113.05 1i75 s PHE 480 Ca 0.77 -0.34 -0.08 0.00 -0.05 0.00 0.00 56.93 57.22 1i75 s PHE 480 Cb -0.41 0.40 -0.04 0.00 -0.63 0.00 0.00 43.02 42.34 1i75 s PHE 480 CO 0.46 -0.98 0.10 0.99 -0.05 0.00 0.00 175.22 175.73 1i75 s THR 481 N -3.91 4.60 -0.22 -4.49 2.01 -1.26 -0.59 115.64 111.79 1i75 s THR 481 Ca 0.12 -0.08 -0.23 0.00 0.31 0.00 0.00 61.69 61.81 1i75 s THR 481 Cb -0.02 -3.15 -0.01 0.00 0.01 0.00 0.00 72.50 69.33 1i75 s THR 481 CO 0.01 0.34 0.76 -0.22 -0.69 0.00 0.00 174.62 174.82 1i75 s LEU 482 N 1.48 4.11 0.66 4.42 2.96 0.22 -4.91 118.68 127.63 1i75 s LEU 482 Ca 0.06 0.99 -0.17 0.00 -0.22 0.00 0.00 54.13 54.79 1i75 s LEU 482 Cb -0.15 -3.10 -0.04 0.00 0.50 0.00 0.00 46.19 43.40 1i75 s LEU 482 CO 0.05 -0.42 0.74 0.00 -1.32 0.00 0.00 176.35 175.40 1i75 n ALA 483 N 5.58 -0.71 -1.65 5.97 0.00 -1.26 -0.97 120.51 127.47 1i75 n ALA 483 Ca 0.03 -0.12 -0.55 0.00 0.00 0.00 0.00 53.44 52.80 1i75 n ALA 483 Cb 0.48 -1.97 -0.07 0.00 0.00 0.00 0.00 19.45 17.89 1i75 n ALA 483 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1i75 n PRO 484 N -0.93 1.14 -0.92 0.00 -0.02 -1.26 -0.33 135.00 132.68 1i75 n PRO 484 Ca 0.12 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 1i75 n PRO 484 Cb 0.49 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 1i75 n PRO 484 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1i75 n GLY 485 N 3.37 0.48 3.77 -1.23 0.00 0.06 -4.89 105.19 106.75 1i75 n GLY 485 Ca 0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 1i75 n GLY 485 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i75 s GLY 486 N -2.00 2.98 -0.08 -0.02 0.00 0.55 -4.74 107.32 104.00 1i75 s GLY 486 Ca 0.00 1.22 -0.04 0.00 0.00 0.00 0.00 44.72 45.90 1i75 s GLY 486 CO 0.00 1.84 0.19 -1.59 0.00 0.00 0.00 173.10 173.54 1i75 s THR 487 N -1.19 -0.09 -0.01 0.90 2.01 -0.38 -0.86 115.64 116.03 1i75 s THR 487 Ca 0.51 0.20 -0.04 0.00 0.31 0.00 0.00 61.69 62.67 1i75 s THR 487 Cb -0.38 -0.30 -0.00 0.00 0.01 0.00 0.00 72.50 71.82 1i75 s THR 487 CO 0.51 0.08 0.08 0.00 -0.69 0.00 0.00 174.62 174.60 1i75 s ALA 488 N 1.41 -0.19 -0.08 7.40 0.00 -0.76 -3.28 121.76 126.26 1i75 s ALA 488 Ca -0.07 -0.11 0.03 0.00 0.00 0.00 0.00 51.96 51.80 1i75 s ALA 488 Cb -0.11 0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.05 1i75 s ALA 488 CO -0.07 -0.14 -0.16 0.08 0.00 0.00 0.00 175.76 175.47 1i75 s VAL 489 N -0.93 1.44 0.08 0.00 1.01 -1.26 -1.04 120.40 119.70 1i75 s VAL 489 Ca -0.10 -0.65 0.07 0.00 0.00 0.00 0.00 61.98 61.29 1i75 s VAL 489 Cb -0.06 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 1i75 s VAL 489 CO 0.00 0.42 -0.19 0.26 0.00 0.00 0.00 175.10 175.60 1i75 s TRP 490 N 0.58 1.60 0.15 5.22 0.51 0.30 -1.12 118.94 126.17 1i75 s TRP 490 Ca -0.16 -0.42 -0.18 0.00 -2.12 0.00 0.00 56.10 53.22 1i75 s TRP 490 Cb -0.16 -0.89 0.04 0.00 -0.81 0.00 0.00 33.47 31.65 1i75 s TRP 490 CO 0.05 0.14 0.48 1.14 -0.51 0.00 0.00 176.95 178.26 1i75 s GLN 491 N -1.74 1.20 -0.11 4.98 -2.07 -1.26 -0.59 119.66 120.07 1i75 s GLN 491 Ca 0.04 -0.69 -0.06 0.00 -1.82 0.00 0.00 55.36 52.83 1i75 s GLN 491 Cb -0.10 0.51 0.04 0.00 -1.09 0.00 0.00 33.01 32.38 1i75 s GLN 491 CO 0.03 -0.50 0.26 -0.47 -1.32 0.00 0.00 175.29 173.29 1i75 s TYR 492 N -3.81 -0.33 0.09 9.60 5.04 -0.40 -4.99 117.35 122.54 1i75 s TYR 492 Ca 0.04 0.78 0.08 0.00 -2.44 0.00 0.00 57.07 55.53 1i75 s TYR 492 Cb 0.00 0.07 -0.03 0.00 0.35 0.00 0.00 41.96 42.35 1i75 s TYR 492 CO -0.10 -0.21 -0.20 0.95 -1.34 0.00 0.00 175.55 174.65 1i75 s THR 493 N 0.95 1.62 0.28 4.34 -4.23 -1.26 -1.50 115.64 115.84 1i75 s THR 493 Ca -0.07 -1.43 -0.08 0.00 -1.18 0.00 0.00 61.69 58.93 1i75 s THR 493 Cb -0.08 -1.47 -0.00 0.00 1.34 0.00 0.00 72.50 72.29 1i75 s THR 493 CO -0.06 -0.02 0.46 0.42 -0.54 0.00 0.00 174.62 174.87 1i75 s THR 494 N -1.09 0.00 0.09 3.99 -4.23 -1.26 -5.01 115.64 108.13 1i75 s THR 494 Ca 0.06 -1.52 -0.22 0.00 -1.18 0.00 0.00 61.69 58.83 1i75 s THR 494 Cb -0.10 -2.43 -0.07 0.00 1.34 0.00 0.00 72.50 71.25 1i75 s THR 494 CO 0.03 0.00 0.65 -1.81 -0.54 0.00 0.00 174.62 172.96 1i75 s ASP 495 N -3.11 7.17 0.02 3.99 1.11 -1.26 -4.74 116.67 119.84 1i75 s ASP 495 Ca 0.27 1.39 -0.06 0.00 0.18 0.00 0.00 52.55 54.33 1i75 s ASP 495 Cb -0.00 -2.41 -0.05 0.00 1.07 0.00 0.00 42.92 41.53 1i75 s ASP 495 CO 0.14 0.22 0.26 0.00 1.18 0.00 0.00 175.17 176.96 1i75 s ALA 496 N -0.95 3.87 -0.10 5.23 0.00 -1.26 -4.90 121.76 123.65 1i75 s ALA 496 Ca 0.32 -0.62 0.19 0.00 0.00 0.00 0.00 51.96 51.86 1i75 s ALA 496 Cb -0.21 -2.03 -0.29 0.00 0.00 0.00 0.00 23.12 20.60 1i75 s ALA 496 CO 0.21 0.67 0.29 0.25 0.00 0.00 0.00 175.76 177.19 1i75 n THR 497 N 0.98 0.58 -3.18 0.00 -2.24 -1.26 -4.18 114.28 104.97 1i75 n THR 497 Ca -0.10 -0.63 -0.39 0.00 -2.27 0.00 0.00 64.05 60.66 1i75 n THR 497 Cb 0.53 -0.20 -0.06 0.00 -2.10 0.00 0.00 70.33 68.50 1i75 n THR 497 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1i75 s THR 498 N -3.02 4.65 0.26 4.28 2.01 -1.26 -4.94 115.64 117.62 1i75 s THR 498 Ca -0.08 1.36 -0.30 0.00 0.31 0.00 0.00 61.69 62.98 1i75 s THR 498 Cb 0.10 -3.97 -0.10 0.00 0.01 0.00 0.00 72.50 68.54 1i75 s THR 498 CO 0.83 0.54 1.39 -2.84 -0.69 0.00 0.00 174.62 173.85 1i75 s PRO 499 N -1.05 4.30 -0.03 4.92 0.02 -1.20 -4.22 135.00 137.74 1i75 s PRO 499 Ca 0.31 2.25 0.00 0.00 0.02 0.00 0.00 61.00 63.58 1i75 s PRO 499 Cb -0.20 -3.11 0.03 0.00 0.02 0.00 0.00 34.50 31.23 1i75 s PRO 499 CO 0.21 -0.34 0.01 0.42 -0.33 0.00 0.00 177.00 176.97 1i75 s ILE 500 N -0.30 0.14 -0.16 2.83 1.01 -0.04 -4.01 121.20 120.66 1i75 s ILE 500 Ca 0.56 0.14 -0.16 0.00 0.00 0.00 0.00 60.65 61.19 1i75 s ILE 500 Cb -0.41 -0.26 -0.04 0.00 0.01 0.00 0.00 42.46 41.77 1i75 s ILE 500 CO 0.45 0.15 0.38 -0.63 0.00 0.00 0.00 174.94 175.30 1i75 s ILE 501 N 1.20 5.23 -0.13 2.92 1.01 -1.26 -1.75 121.20 128.41 1i75 s ILE 501 Ca -0.07 0.73 0.16 0.00 0.00 0.00 0.00 60.65 61.47 1i75 s ILE 501 Cb -0.13 -3.72 -0.23 0.00 0.01 0.00 0.00 42.46 38.38 1i75 s ILE 501 CO -0.02 0.32 0.15 0.61 0.00 0.00 0.00 174.94 176.00 1i75 n GLY 502 N 3.54 -0.86 3.51 6.18 0.00 0.93 -4.94 105.19 113.56 1i75 n GLY 502 Ca -0.09 -0.33 -0.10 0.00 0.00 0.00 0.00 46.02 45.49 1i75 n GLY 502 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1i75 s ASN 503 N -4.88 -0.42 -0.03 1.61 3.04 -1.06 -4.91 114.94 108.28 1i75 s ASN 503 Ca -0.08 0.18 -0.03 0.00 0.04 0.00 0.00 52.86 52.97 1i75 s ASN 503 Cb 0.07 0.41 0.01 0.00 -1.54 0.00 0.00 41.25 40.20 1i75 s ASN 503 CO 0.73 -0.59 0.09 -0.69 -3.04 0.00 0.00 177.10 173.60 1i75 s VAL 504 N -2.47 -0.00 -0.21 -5.21 1.01 -1.26 -0.97 120.40 111.28 1i75 s VAL 504 Ca 0.01 0.01 -0.15 0.00 0.00 0.00 0.00 61.98 61.85 1i75 s VAL 504 Cb -0.01 -0.13 0.06 0.00 0.00 0.00 0.00 36.38 36.30 1i75 s VAL 504 CO -0.05 0.00 0.54 -0.83 0.00 0.00 0.00 175.10 174.77 1i75 s GLY 505 N 0.11 -0.44 0.92 4.51 0.00 -0.40 -4.65 107.32 107.37 1i75 s GLY 505 Ca -0.01 1.76 -0.12 0.00 0.00 0.00 0.00 44.72 46.35 1i75 s GLY 505 CO -0.00 1.71 1.14 2.56 0.00 0.00 0.00 173.10 178.50 1i75 s PRO 506 N 0.97 1.05 0.00 2.90 0.04 -1.26 -0.42 135.00 138.27 1i75 s PRO 506 Ca -0.05 0.29 0.20 0.00 0.04 0.00 0.00 61.00 61.47 1i75 s PRO 506 Cb -0.06 -1.83 0.22 0.00 0.04 0.00 0.00 34.50 32.88 1i75 s PRO 506 CO -0.09 -2.26 1.19 -1.33 0.04 0.00 0.00 177.00 174.56 1i75 n MET 507 N -3.81 1.95 -3.67 4.56 2.81 -1.26 -4.86 117.12 112.85 1i75 n MET 507 Ca 0.07 -1.83 -0.09 0.00 -1.81 0.00 0.00 57.70 54.04 1i75 n MET 507 Cb 0.59 -1.40 -0.10 0.00 -0.71 0.00 0.00 33.22 31.60 1i75 n MET 507 CO 0.00 0.00 0.00 1.41 1.51 0.00 0.00 175.97 178.89 1i75 s MET 508 N -1.57 0.35 0.00 0.03 -2.45 -1.26 -0.56 119.30 113.84 1i75 s MET 508 Ca 0.26 0.98 -0.29 0.00 -1.25 0.00 0.00 55.69 55.40 1i75 s MET 508 Cb 0.18 0.25 0.10 0.00 1.25 0.00 0.00 34.83 36.60 1i75 s MET 508 CO 0.26 -0.23 0.98 0.00 1.05 0.00 0.00 175.02 177.08 1i75 s ALA 509 N 2.30 -1.85 0.64 4.11 0.00 -0.81 -4.82 121.76 121.32 1i75 s ALA 509 Ca -0.04 0.87 -0.08 0.00 0.00 0.00 0.00 51.96 52.71 1i75 s ALA 509 Cb -0.11 0.39 0.01 0.00 0.00 0.00 0.00 23.12 23.41 1i75 s ALA 509 CO -0.13 -0.78 0.98 -1.59 0.00 0.00 0.00 175.76 174.24 1i75 s LYS 510 N -3.00 2.92 0.21 0.00 -2.85 -1.26 -0.95 119.74 114.80 1i75 s LYS 510 Ca 0.08 0.20 -0.30 0.00 -1.00 0.00 0.00 55.97 54.95 1i75 s LYS 510 Cb -0.01 -2.17 -0.16 0.00 -2.06 0.00 0.00 37.83 33.44 1i75 s LYS 510 CO -0.05 -0.82 0.96 -2.30 0.10 0.00 0.00 175.35 173.23 1i75 n PRO 511 N -2.75 0.92 0.00 1.78 -0.02 -1.26 -2.91 135.00 130.76 1i75 n PRO 511 Ca 0.05 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 1i75 n PRO 511 Cb 0.57 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.39 1i75 n PRO 511 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1i75 n GLY 512 N 1.69 1.34 3.76 -1.23 0.00 0.35 -4.94 105.19 106.16 1i75 n GLY 512 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 1i75 n GLY 512 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i75 s VAL 513 N -2.33 4.10 -0.14 1.61 1.01 -1.14 -4.68 120.40 118.83 1i75 s VAL 513 Ca 0.00 1.98 -0.25 0.00 0.00 0.00 0.00 61.98 63.71 1i75 s VAL 513 Cb 0.00 -4.21 -0.02 0.00 0.00 0.00 0.00 36.38 32.15 1i75 s VAL 513 CO 0.00 0.37 0.81 -0.89 0.00 0.00 0.00 175.10 175.39 1i75 s THR 514 N -1.34 4.91 0.34 3.92 2.01 -1.26 -0.82 115.64 123.41 1i75 s THR 514 Ca 0.44 1.62 0.08 0.00 0.31 0.00 0.00 61.69 64.14 1i75 s THR 514 Cb -0.24 -4.13 -0.03 0.00 0.01 0.00 0.00 72.50 68.12 1i75 s THR 514 CO 0.29 0.08 0.27 0.27 -0.69 0.00 0.00 174.62 174.84 1i75 s ILE 515 N 1.81 3.39 -0.18 1.82 -4.36 0.03 -4.77 121.20 118.93 1i75 s ILE 515 Ca 0.39 -1.44 -0.02 0.00 -0.26 0.00 0.00 60.65 59.32 1i75 s ILE 515 Cb -0.17 -3.13 -0.01 0.00 1.25 0.00 0.00 42.46 40.40 1i75 s ILE 515 CO 0.15 -0.17 -0.10 -0.89 0.24 0.00 0.00 174.94 174.17 1i75 s THR 516 N -2.34 3.05 -0.20 8.37 2.01 0.44 -2.22 115.64 124.75 1i75 s THR 516 Ca 0.41 -0.62 -0.03 0.00 0.31 0.00 0.00 61.69 61.75 1i75 s THR 516 Cb -0.05 -2.34 -0.01 0.00 0.01 0.00 0.00 72.50 70.11 1i75 s THR 516 CO 0.26 0.48 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.98 1i75 s ILE 517 N 1.08 3.40 0.08 1.82 1.01 0.10 -1.27 121.20 127.42 1i75 s ILE 517 Ca 0.00 -0.50 0.08 0.00 0.00 0.00 0.00 60.65 60.23 1i75 s ILE 517 Cb -0.15 -2.52 -0.04 0.00 0.01 0.00 0.00 42.46 39.77 1i75 s ILE 517 CO -0.02 0.45 -0.16 -1.81 0.00 0.00 0.00 174.94 173.39 1i75 s ASP 518 N 1.13 3.96 0.00 3.58 -0.00 -0.15 -0.73 116.67 124.47 1i75 s ASP 518 Ca 0.02 -0.46 0.00 0.00 -0.00 0.00 0.00 52.55 52.10 1i75 s ASP 518 Cb -0.15 -0.64 0.00 0.00 -0.00 0.00 0.00 42.92 42.14 1i75 s ASP 518 CO -0.01 0.21 0.00 0.61 -0.00 0.00 0.00 175.17 175.98 1i75 n GLY 519 N 1.11 -0.86 3.23 0.21 0.00 -0.17 -0.05 105.19 108.66 1i75 n GLY 519 Ca -0.15 -0.10 -0.12 0.00 0.00 0.00 0.00 46.02 45.65 1i75 n GLY 519 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1i75 s ARG 520 N -0.73 0.74 0.00 1.61 1.81 -0.72 -4.28 118.95 117.38 1i75 s ARG 520 Ca 0.00 -0.48 0.00 0.00 -1.72 0.00 0.00 55.73 53.53 1i75 s ARG 520 Cb 0.00 0.32 0.00 0.00 -0.45 0.00 0.00 34.95 34.82 1i75 s ARG 520 CO 0.00 -0.23 0.00 0.41 -0.68 0.00 0.00 175.30 174.80 1i75 n GLY 521 N 0.75 0.61 0.20 -3.53 0.00 -1.08 -0.87 105.19 101.27 1i75 n GLY 521 Ca -0.19 -0.14 0.07 0.00 0.00 0.00 0.00 46.02 45.76 1i75 n GLY 521 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1i75 h PHE 522 N 0.00 0.00 0.00 1.61 0.05 -1.69 -3.18 116.94 113.73 1i75 h PHE 522 Ca 0.00 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 1i75 h PHE 522 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 35.95 37.95 1i75 h PHE 522 CO 0.00 0.31 0.00 0.41 -0.18 0.00 0.00 178.31 178.85 1i75 n GLY 523 N 0.06 -1.07 0.08 -1.45 0.00 -1.26 -4.51 105.19 97.04 1i75 n GLY 523 Ca -0.00 -1.63 -0.10 0.00 0.00 0.00 0.00 46.02 44.28 1i75 n GLY 523 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1i75 h SER 524 N 0.00 0.12 -3.29 1.61 0.02 -1.91 -3.03 113.55 107.07 1i75 h SER 524 Ca 0.00 -0.15 -0.56 0.00 -0.84 0.00 0.00 61.79 60.23 1i75 h SER 524 Cb 0.00 -0.04 -0.04 0.00 0.14 0.00 0.00 62.40 62.46 1i75 h SER 524 CO 0.00 1.13 -0.02 -0.83 -1.14 0.00 0.00 176.83 175.97 1i75 s GLY 525 N -4.85 2.65 0.09 -3.77 0.00 -1.26 -4.71 107.32 95.47 1i75 s GLY 525 Ca -0.03 0.04 -0.34 0.00 0.00 0.00 0.00 44.72 44.39 1i75 s GLY 525 CO 0.83 0.44 1.69 1.17 0.00 0.00 0.00 173.10 177.24 1i75 n LYS 526 N 1.50 2.24 0.00 2.90 4.81 -1.26 -4.14 118.16 124.21 1i75 n LYS 526 Ca -0.09 0.81 0.00 0.00 -0.87 0.00 0.00 58.31 58.16 1i75 n LYS 526 Cb 0.51 -2.62 0.00 0.00 0.02 0.00 0.00 35.03 32.94 1i75 n LYS 526 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1i75 n GLY 527 N 3.79 2.31 3.12 3.14 0.00 -1.26 -4.45 105.19 111.83 1i75 n GLY 527 Ca 0.19 -0.33 -0.23 0.00 0.00 0.00 0.00 46.02 45.65 1i75 n GLY 527 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i75 s THR 528 N 4.04 1.19 -0.12 2.61 2.01 0.10 -4.67 115.64 120.80 1i75 s THR 528 Ca 0.00 -0.63 0.00 0.00 0.31 0.00 0.00 61.69 61.38 1i75 s THR 528 Cb 0.00 -1.00 -0.02 0.00 0.01 0.00 0.00 72.50 71.50 1i75 s THR 528 CO 0.00 0.34 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.45 1i75 s VAL 529 N -0.25 3.05 -0.19 3.82 1.01 -0.38 -0.58 120.40 126.88 1i75 s VAL 529 Ca 0.04 -0.67 -0.05 0.00 0.00 0.00 0.00 61.98 61.30 1i75 s VAL 529 Cb -0.07 -2.27 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 1i75 s VAL 529 CO -0.00 0.53 -0.01 -0.31 0.00 0.00 0.00 175.10 175.32 1i75 s TYR 530 N 0.19 3.04 -0.39 5.22 1.51 0.56 0.15 117.35 127.64 1i75 s TYR 530 Ca -0.08 -0.40 -0.03 0.00 -1.01 0.00 0.00 57.07 55.56 1i75 s TYR 530 Cb -0.15 -2.05 0.10 0.00 -0.11 0.00 0.00 41.96 39.74 1i75 s TYR 530 CO 0.05 -0.17 0.17 -0.06 -1.11 0.00 0.00 175.55 174.43 1i75 s PHE 531 N 0.82 3.54 0.00 2.71 0.40 -0.02 -1.57 117.98 123.86 1i75 s PHE 531 Ca 0.00 -2.31 0.00 0.00 -0.60 0.00 0.00 56.93 54.02 1i75 s PHE 531 Cb -0.14 -3.03 0.00 0.00 0.51 0.00 0.00 43.02 40.36 1i75 s PHE 531 CO 0.02 -0.94 0.00 0.41 0.70 0.00 0.00 175.22 175.41 1i75 n GLY 532 N 4.60 3.02 1.19 4.36 0.00 0.10 -1.42 105.19 117.04 1i75 n GLY 532 Ca -0.04 -0.19 0.12 0.00 0.00 0.00 0.00 46.02 45.90 1i75 n GLY 532 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1i75 n THR 533 N 0.00 0.62 -2.92 2.61 -2.24 -1.26 -4.90 114.28 106.19 1i75 n THR 533 Ca 0.00 -0.81 -0.41 0.00 -2.27 0.00 0.00 64.05 60.56 1i75 n THR 533 Cb 0.00 0.88 -0.04 0.00 -2.10 0.00 0.00 70.33 69.07 1i75 n THR 533 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1i75 s THR 534 N -1.36 4.95 -0.06 4.28 2.01 -0.51 -5.04 115.64 119.91 1i75 s THR 534 Ca 0.40 1.64 -0.12 0.00 0.31 0.00 0.00 61.69 63.93 1i75 s THR 534 Cb 0.23 -4.13 -0.05 0.00 0.01 0.00 0.00 72.50 68.56 1i75 s THR 534 CO 0.32 0.15 0.29 0.00 -0.69 0.00 0.00 174.62 174.69 1i75 s ALA 535 N 1.34 3.76 -0.10 7.40 0.00 -1.26 -0.84 121.76 132.07 1i75 s ALA 535 Ca 0.41 -0.41 0.02 0.00 0.00 0.00 0.00 51.96 51.98 1i75 s ALA 535 Cb -0.18 -2.22 0.01 0.00 0.00 0.00 0.00 23.12 20.74 1i75 s ALA 535 CO 0.18 0.51 -0.15 0.08 0.00 0.00 0.00 175.76 176.38 1i75 s VAL 536 N -0.94 1.42 0.33 0.00 1.01 0.12 -4.98 120.40 117.36 1i75 s VAL 536 Ca 0.20 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.58 1i75 s VAL 536 Cb -0.15 -1.29 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 1i75 s VAL 536 CO 0.09 0.42 0.38 -0.89 0.00 0.00 0.00 175.10 175.10 1i75 s THR 537 N 0.91 0.00 0.00 3.92 2.01 -1.26 -1.24 115.64 119.97 1i75 s THR 537 Ca -0.09 -1.77 0.00 0.00 0.31 0.00 0.00 61.69 60.14 1i75 s THR 537 Cb -0.15 -2.57 0.00 0.00 0.01 0.00 0.00 72.50 69.79 1i75 s THR 537 CO 0.00 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.54 1i75 n GLY 538 N -0.56 3.00 0.30 4.40 0.00 -1.26 -2.77 105.19 108.29 1i75 n GLY 538 Ca 0.03 -0.21 0.19 0.00 0.00 0.00 0.00 46.02 46.03 1i75 n GLY 538 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i75 h ALA 539 N -0.81 1.02 0.00 4.61 0.00 -2.01 -2.49 119.26 119.57 1i75 h ALA 539 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1i75 h ALA 539 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1i75 h ALA 539 CO 0.00 0.01 0.00 -0.44 0.00 0.00 0.00 179.25 178.82 1i75 h ASP 540 N 0.00 0.00 -3.50 0.00 3.32 -1.93 -3.39 116.42 110.93 1i75 h ASP 540 Ca -0.00 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 56.41 1i75 h ASP 540 Cb 0.31 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.72 1i75 h ASP 540 CO 0.00 0.00 0.29 -0.63 -1.72 0.00 0.00 179.24 177.18 1i75 s ILE 541 N -3.30 4.68 0.19 0.35 1.01 -0.94 -0.95 121.20 122.24 1i75 s ILE 541 Ca 0.06 0.19 0.01 0.00 0.00 0.00 0.00 60.65 60.91 1i75 s ILE 541 Cb 0.09 -4.32 -0.09 0.00 0.01 0.00 0.00 42.46 38.14 1i75 s ILE 541 CO 0.57 -0.76 1.47 0.58 0.00 0.00 0.00 174.94 176.80 1i75 h VAL 542 N 5.94 1.39 -2.51 2.92 2.07 -0.60 -3.46 116.25 122.00 1i75 h VAL 542 Ca -0.25 -2.13 -0.09 0.00 0.82 0.00 0.00 66.70 65.04 1i75 h VAL 542 Cb 1.09 2.10 -0.23 0.00 -1.52 0.00 0.00 31.29 32.74 1i75 h VAL 542 CO 0.96 0.64 -0.11 0.00 0.02 0.00 0.00 177.57 179.08 1i75 s ALA 543 N -3.63 -1.26 -0.03 1.67 0.00 -0.64 -4.94 121.76 112.93 1i75 s ALA 543 Ca -0.05 1.35 0.00 0.00 0.00 0.00 0.00 51.96 53.26 1i75 s ALA 543 Cb 0.11 -0.72 0.03 0.00 0.00 0.00 0.00 23.12 22.54 1i75 s ALA 543 CO 0.83 -0.25 0.01 -0.46 0.00 0.00 0.00 175.76 175.88 1i75 s TRP 544 N 0.07 0.29 0.34 0.00 -0.11 -1.26 -0.91 118.94 117.35 1i75 s TRP 544 Ca -0.02 0.02 -0.07 0.00 1.22 0.00 0.00 56.10 57.25 1i75 s TRP 544 Cb -0.03 -0.43 0.03 0.00 -1.50 0.00 0.00 33.47 31.53 1i75 s TRP 544 CO 0.02 -0.15 0.57 -0.85 -4.62 0.00 0.00 176.95 171.92 1i75 n GLU 545 N 4.32 0.82 0.24 5.86 0.28 -0.18 -4.89 120.64 127.09 1i75 n GLU 545 Ca -0.23 -2.26 0.11 0.00 -0.16 0.00 0.00 57.16 54.61 1i75 n GLU 545 Cb 0.50 2.46 0.61 0.00 1.43 0.00 0.00 31.44 36.44 1i75 n GLU 545 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 177.13 177.19 1i75 h ASP 546 N 1.78 0.00 0.00 -1.84 1.82 -1.86 -2.97 116.42 113.35 1i75 h ASP 546 Ca -0.27 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.37 1i75 h ASP 546 Cb 1.09 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.10 1i75 h ASP 546 CO 0.36 0.18 -0.41 0.35 -1.61 0.00 0.00 179.24 178.11 1i75 n THR 547 N -3.60 0.00 -3.70 2.25 -2.24 -1.26 -2.16 114.28 103.57 1i75 n THR 547 Ca -0.01 -0.30 -0.12 0.00 -2.27 0.00 0.00 64.05 61.35 1i75 n THR 547 Cb 0.32 0.99 -0.10 0.00 -2.10 0.00 0.00 70.33 69.44 1i75 n THR 547 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1i75 s GLN 548 N -1.81 0.52 -0.03 -0.78 0.74 -1.12 -1.00 119.66 116.18 1i75 s GLN 548 Ca 0.03 0.76 0.07 0.00 0.05 0.00 0.00 55.36 56.27 1i75 s GLN 548 Cb 0.06 0.16 -0.02 0.00 1.10 0.00 0.00 33.01 34.32 1i75 s GLN 548 CO 0.35 -0.11 -0.25 0.42 -0.55 0.00 0.00 175.29 175.16 1i75 s ILE 549 N 0.77 2.13 -0.12 -2.34 1.01 0.09 -1.01 121.20 121.72 1i75 s ILE 549 Ca -0.04 -1.07 0.02 0.00 0.00 0.00 0.00 60.65 59.56 1i75 s ILE 549 Cb -0.05 -1.75 0.01 0.00 0.01 0.00 0.00 42.46 40.68 1i75 s ILE 549 CO -0.06 0.58 -0.20 -1.10 0.00 0.00 0.00 174.94 174.16 1i75 s GLN 550 N -0.52 2.73 -0.00 2.79 -0.21 -0.09 -0.72 119.66 123.65 1i75 s GLN 550 Ca 0.07 -0.75 -0.03 0.00 0.02 0.00 0.00 55.36 54.67 1i75 s GLN 550 Cb -0.11 -2.22 -0.01 0.00 1.00 0.00 0.00 33.01 31.68 1i75 s GLN 550 CO 0.00 -0.01 0.05 0.54 -2.12 0.00 0.00 175.29 173.75 1i75 s VAL 551 N 0.82 0.06 0.20 1.09 0.11 -0.94 0.03 120.40 121.77 1i75 s VAL 551 Ca -0.08 -0.52 -0.30 0.00 -2.93 0.00 0.00 61.98 58.15 1i75 s VAL 551 Cb -0.16 -0.24 -0.08 0.00 -1.53 0.00 0.00 36.38 34.37 1i75 s VAL 551 CO -0.01 -0.29 1.01 -0.54 -3.33 0.00 0.00 175.10 171.95 1i75 s LYS 552 N -0.89 4.72 0.03 1.54 1.02 -0.13 -0.79 119.74 125.24 1i75 s LYS 552 Ca -0.10 1.59 -0.30 0.00 0.02 0.00 0.00 55.97 57.17 1i75 s LYS 552 Cb -0.06 -3.29 -0.06 0.00 -0.52 0.00 0.00 37.83 33.90 1i75 s LYS 552 CO 0.00 0.28 1.41 0.42 -0.92 0.00 0.00 175.35 176.54 1i75 s ILE 553 N -0.65 3.58 0.92 2.17 1.01 -0.00 -4.87 121.20 123.36 1i75 s ILE 553 Ca 0.45 1.03 -0.11 0.00 0.00 0.00 0.00 60.65 62.02 1i75 s ILE 553 Cb -0.27 -3.66 0.14 0.00 0.01 0.00 0.00 42.46 38.68 1i75 s ILE 553 CO 0.34 0.02 1.11 -2.16 0.00 0.00 0.00 174.94 174.24 1i75 s PRO 554 N 2.06 1.03 -1.41 2.79 0.04 -1.26 -0.50 135.00 137.76 1i75 s PRO 554 Ca 0.65 1.24 -0.13 0.00 0.04 0.00 0.00 61.00 62.79 1i75 s PRO 554 Cb -0.33 -1.75 0.07 0.00 0.04 0.00 0.00 34.50 32.53 1i75 s PRO 554 CO 0.28 -2.52 2.11 0.00 0.04 0.00 0.00 177.00 176.91 1i75 n ALA 555 N -4.13 5.38 -2.94 8.56 0.00 -1.26 -4.57 120.51 121.55 1i75 n ALA 555 Ca 0.09 -3.99 -0.23 0.00 0.00 0.00 0.00 53.44 49.31 1i75 n ALA 555 Cb 0.53 -3.40 -0.02 0.00 0.00 0.00 0.00 19.45 16.55 1i75 n ALA 555 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1i75 s VAL 556 N 2.56 5.28 0.53 0.00 -7.23 -1.26 -5.08 120.40 115.20 1i75 s VAL 556 Ca 0.46 -0.82 -0.22 0.00 -1.81 0.00 0.00 61.98 59.58 1i75 s VAL 556 Cb 0.12 -3.81 -0.05 0.00 0.56 0.00 0.00 36.38 33.20 1i75 s VAL 556 CO -0.06 -0.24 1.35 -0.81 -0.31 0.00 0.00 175.10 175.03 1i75 n PRO 557 N -1.05 1.72 -1.63 4.82 -0.04 -1.26 -4.90 135.00 132.65 1i75 n PRO 557 Ca -0.08 0.63 -0.43 0.00 -0.04 0.00 0.00 63.50 63.58 1i75 n PRO 557 Cb 0.56 -2.56 -0.01 0.00 -0.04 0.00 0.00 33.50 31.45 1i75 n PRO 557 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1i75 n GLY 558 N 0.76 0.06 0.00 0.55 0.00 -1.26 -4.88 105.19 100.42 1i75 n GLY 558 Ca 0.10 0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.41 1i75 n GLY 558 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i75 n GLY 559 N 1.05 -1.18 3.57 -0.02 0.00 -0.61 -4.57 105.19 103.42 1i75 n GLY 559 Ca 0.08 -1.25 -0.34 0.00 0.00 0.00 0.00 46.02 44.51 1i75 n GLY 559 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i75 s ILE 560 N -2.96 4.36 0.10 -0.61 1.01 -1.26 -0.68 121.20 121.16 1i75 s ILE 560 Ca 0.00 -0.19 0.07 0.00 0.00 0.00 0.00 60.65 60.53 1i75 s ILE 560 Cb 0.00 -2.95 -0.03 0.00 0.01 0.00 0.00 42.46 39.49 1i75 s ILE 560 CO 0.00 0.47 -0.17 -0.31 0.00 0.00 0.00 174.94 174.93 1i75 s TYR 561 N 0.41 1.53 0.08 3.97 1.51 0.29 -4.91 117.35 120.23 1i75 s TYR 561 Ca -0.00 -0.45 -0.15 0.00 -1.01 0.00 0.00 57.07 55.46 1i75 s TYR 561 Cb -0.13 -0.84 -0.06 0.00 -0.11 0.00 0.00 41.96 40.82 1i75 s TYR 561 CO 0.02 0.15 0.49 -0.51 -1.11 0.00 0.00 175.55 174.58 1i75 s ASP 562 N -1.94 6.85 -0.04 2.29 1.01 -1.26 -1.52 116.67 122.07 1i75 s ASP 562 Ca 0.04 1.04 0.01 0.00 0.71 0.00 0.00 52.55 54.35 1i75 s ASP 562 Cb -0.09 -2.28 -0.03 0.00 1.01 0.00 0.00 42.92 41.53 1i75 s ASP 562 CO 0.03 0.22 -0.02 -0.63 0.21 0.00 0.00 175.17 174.98 1i75 s ILE 563 N -1.26 4.03 -0.08 0.77 1.01 0.90 -0.72 121.20 125.84 1i75 s ILE 563 Ca 0.31 -0.51 -0.12 0.00 0.00 0.00 0.00 60.65 60.33 1i75 s ILE 563 Cb -0.16 -2.73 0.03 0.00 0.01 0.00 0.00 42.46 39.60 1i75 s ILE 563 CO 0.17 0.48 0.30 -0.60 0.00 0.00 0.00 174.94 175.29 1i75 s ARG 564 N -1.21 0.45 -0.04 2.79 3.52 -0.61 -0.45 118.95 123.40 1i75 s ARG 564 Ca 0.16 0.20 0.02 0.00 -0.13 0.00 0.00 55.73 55.98 1i75 s ARG 564 Cb -0.11 0.21 -0.03 0.00 -1.56 0.00 0.00 34.95 33.45 1i75 s ARG 564 CO 0.06 -0.09 -0.07 0.08 -0.81 0.00 0.00 175.30 174.48 1i75 s VAL 565 N -0.34 3.68 -0.07 7.11 1.01 -1.26 -0.32 120.40 130.20 1i75 s VAL 565 Ca -0.05 -0.60 0.04 0.00 0.00 0.00 0.00 61.98 61.37 1i75 s VAL 565 Cb -0.03 -2.54 0.00 0.00 0.00 0.00 0.00 36.38 33.81 1i75 s VAL 565 CO 0.02 0.51 -0.18 0.00 0.00 0.00 0.00 175.10 175.45 1i75 s ALA 566 N -0.89 1.68 1.07 5.51 0.00 0.25 -0.15 121.76 129.24 1i75 s ALA 566 Ca 0.14 -0.70 -0.18 0.00 0.00 0.00 0.00 51.96 51.22 1i75 s ALA 566 Cb -0.11 -0.64 0.24 0.00 0.00 0.00 0.00 23.12 22.62 1i75 s ALA 566 CO 0.04 0.23 1.25 0.54 0.00 0.00 0.00 175.76 177.82 1i75 s ASN 567 N 0.35 2.12 0.64 0.00 2.20 -0.13 -0.72 114.94 119.40 1i75 s ASN 567 Ca -0.13 0.35 0.34 0.00 -0.94 0.00 0.00 52.86 52.48 1i75 s ASN 567 Cb -0.15 -0.42 1.88 0.00 -2.00 0.00 0.00 41.25 40.55 1i75 s ASN 567 CO 0.05 -3.36 2.12 0.00 -2.94 0.00 0.00 177.10 172.97 1i75 h ALA 568 N -2.07 1.42 -0.48 3.54 0.00 -1.78 0.11 119.26 120.01 1i75 h ALA 568 Ca -0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1i75 h ALA 568 Cb 1.25 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1i75 h ALA 568 CO 0.34 -0.23 0.00 0.00 0.00 0.00 0.00 179.25 179.36 1i75 n ALA 569 N -2.11 2.43 -0.95 0.00 0.00 -1.26 -4.92 120.51 113.69 1i75 n ALA 569 Ca -0.01 -0.87 0.00 0.00 0.00 0.00 0.00 53.44 52.56 1i75 n ALA 569 Cb 0.28 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.76 1i75 n ALA 569 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i75 n GLY 570 N 1.31 1.10 3.70 0.00 0.00 0.39 -5.01 105.19 106.68 1i75 n GLY 570 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1i75 n GLY 570 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i75 s ALA 571 N -3.95 3.49 0.09 4.61 0.00 -1.26 -4.74 121.76 120.01 1i75 s ALA 571 Ca 0.00 0.84 0.01 0.00 0.00 0.00 0.00 51.96 52.81 1i75 s ALA 571 Cb 0.00 -3.51 -0.04 0.00 0.00 0.00 0.00 23.12 19.57 1i75 s ALA 571 CO 0.00 -0.66 0.22 0.00 0.00 0.00 0.00 175.76 175.32 1i75 s ALA 572 N 1.69 3.95 0.91 0.00 0.00 -1.26 -0.96 121.76 126.08 1i75 s ALA 572 Ca 0.60 -0.92 -0.10 0.00 0.00 0.00 0.00 51.96 51.54 1i75 s ALA 572 Cb -0.30 -1.77 0.18 0.00 0.00 0.00 0.00 23.12 21.23 1i75 s ALA 572 CO 0.27 0.73 1.11 -1.13 0.00 0.00 0.00 175.76 176.74 1i75 n SER 573 N 0.04 0.45 -4.74 0.00 3.41 0.78 -4.64 113.62 108.92 1i75 n SER 573 Ca -0.06 -1.62 -0.31 0.00 -0.26 0.00 0.00 58.87 56.62 1i75 n SER 573 Cb 0.52 -0.82 0.11 0.00 -0.26 0.00 0.00 64.21 63.77 1i75 n SER 573 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1i75 s ASN 574 N -5.18 4.02 0.00 4.04 4.22 -1.26 -4.78 114.94 116.00 1i75 s ASN 574 Ca 0.66 1.74 -0.18 0.00 -2.14 0.00 0.00 52.86 52.93 1i75 s ASN 574 Cb -0.02 -2.41 -0.06 0.00 1.28 0.00 0.00 41.25 40.04 1i75 s ASN 574 CO 0.45 -2.33 0.53 -0.63 -2.04 0.00 0.00 177.10 173.08 1i75 s ILE 575 N -2.89 4.93 -0.28 0.54 1.01 -1.26 -4.56 121.20 118.69 1i75 s ILE 575 Ca 0.62 1.10 -0.01 0.00 0.00 0.00 0.00 60.65 62.36 1i75 s ILE 575 Cb -0.18 -3.85 0.04 0.00 0.01 0.00 0.00 42.46 38.48 1i75 s ILE 575 CO 0.57 0.48 -0.04 -0.47 0.00 0.00 0.00 174.94 175.47 1i75 s TYR 576 N -0.53 3.20 0.45 3.97 5.04 0.41 -4.94 117.35 124.94 1i75 s TYR 576 Ca 0.28 -1.87 0.01 0.00 -2.44 0.00 0.00 57.07 53.04 1i75 s TYR 576 Cb -0.18 -2.05 0.09 0.00 0.35 0.00 0.00 41.96 40.17 1i75 s TYR 576 CO 0.16 -0.80 0.62 -0.40 -1.34 0.00 0.00 175.55 173.78 1i75 n ASP 577 N 4.60 0.93 -2.32 4.32 5.75 -1.26 -0.07 116.55 128.49 1i75 n ASP 577 Ca -0.14 -1.76 -0.18 0.00 -0.01 0.00 0.00 54.79 52.69 1i75 n ASP 577 Cb 0.44 -0.39 0.01 0.00 -1.03 0.00 0.00 41.12 40.15 1i75 n ASP 577 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1i75 n ASN 578 N -2.88 -5.35 -4.71 -1.12 5.15 -1.21 -4.88 115.26 100.25 1i75 n ASN 578 Ca 0.10 -0.13 -0.41 0.00 -0.60 0.00 0.00 54.58 53.54 1i75 n ASN 578 Cb 0.38 -4.31 -0.03 0.00 -0.53 0.00 0.00 39.78 35.29 1i75 n ASN 578 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 1i75 s PHE 579 N -2.99 3.62 -0.30 1.20 5.36 -0.57 -4.86 117.98 119.43 1i75 s PHE 579 Ca 0.13 1.54 -0.10 0.00 -0.96 0.00 0.00 56.93 57.55 1i75 s PHE 579 Cb -0.06 -3.03 -0.01 0.00 -0.34 0.00 0.00 43.02 39.58 1i75 s PHE 579 CO 0.16 -0.00 0.15 -2.00 -1.46 0.00 0.00 175.22 172.07 1i75 s GLU 580 N 1.06 3.43 -0.15 10.12 2.12 0.27 -0.55 118.70 135.01 1i75 s GLU 580 Ca 0.47 -0.66 -0.21 0.00 0.36 0.00 0.00 54.97 54.94 1i75 s GLU 580 Cb -0.20 -3.57 -0.03 0.00 0.26 0.00 0.00 34.13 30.60 1i75 s GLU 580 CO 0.24 -0.38 0.60 0.08 -0.54 0.00 0.00 175.26 175.26 1i75 s VAL 581 N 1.63 5.07 0.47 3.70 1.01 0.15 -1.92 120.40 130.51 1i75 s VAL 581 Ca 0.05 1.17 -0.08 0.00 0.00 0.00 0.00 61.98 63.12 1i75 s VAL 581 Cb -0.17 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.23 1i75 s VAL 581 CO 0.07 0.20 0.82 -0.76 0.00 0.00 0.00 175.10 175.42 1i75 s LEU 582 N 1.33 3.65 0.46 3.92 1.43 -0.13 -1.57 118.68 127.77 1i75 s LEU 582 Ca 0.30 1.09 0.26 0.00 -1.03 0.00 0.00 54.13 54.75 1i75 s LEU 582 Cb -0.16 -4.03 0.84 0.00 0.03 0.00 0.00 46.19 42.87 1i75 s LEU 582 CO 0.12 -0.55 1.79 0.74 0.23 0.00 0.00 176.35 178.68 1i75 h THR 583 N 0.50 0.29 0.00 5.49 2.02 -1.93 -3.39 112.91 115.89 1i75 h THR 583 Ca -0.47 -1.02 0.00 0.00 0.77 0.00 0.00 66.41 65.69 1i75 h THR 583 Cb 1.20 1.81 0.00 0.00 -1.74 0.00 0.00 68.15 69.41 1i75 h THR 583 CO 0.62 0.13 0.00 0.61 0.37 0.00 0.00 175.52 177.26 1i75 n GLY 584 N 0.43 -0.62 3.71 2.16 0.00 -1.26 -4.93 105.19 104.69 1i75 n GLY 584 Ca 0.01 -0.94 -0.32 0.00 0.00 0.00 0.00 46.02 44.78 1i75 n GLY 584 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1i75 s ASP 585 N -4.00 3.69 0.15 1.61 -0.00 -1.26 -4.76 116.67 112.10 1i75 s ASP 585 Ca 0.00 2.17 0.09 0.00 -0.00 0.00 0.00 52.55 54.81 1i75 s ASP 585 Cb 0.00 -2.57 -0.04 0.00 -0.00 0.00 0.00 42.92 40.31 1i75 s ASP 585 CO 0.00 -2.59 -0.11 -1.10 -0.00 0.00 0.00 175.17 171.37 1i75 s GLN 586 N -4.44 2.03 0.05 8.23 -1.52 -1.26 -0.55 119.66 122.20 1i75 s GLN 586 Ca 0.68 -1.21 0.00 0.00 -1.95 0.00 0.00 55.36 52.89 1i75 s GLN 586 Cb -0.24 -2.18 -0.03 0.00 -0.22 0.00 0.00 33.01 30.34 1i75 s GLN 586 CO 0.53 0.46 -0.04 0.14 -0.25 0.00 0.00 175.29 176.12 1i75 s VAL 587 N -1.51 0.34 -0.22 1.09 -7.23 -0.44 -4.72 120.40 107.70 1i75 s VAL 587 Ca 0.23 -1.56 -0.10 0.00 -1.81 0.00 0.00 61.98 58.74 1i75 s VAL 587 Cb -0.10 -1.18 -0.05 0.00 0.56 0.00 0.00 36.38 35.62 1i75 s VAL 587 CO 0.14 -0.79 0.13 -0.89 -0.31 0.00 0.00 175.10 173.37 1i75 s THR 588 N -3.04 5.19 -0.09 5.32 2.01 -1.26 -1.30 115.64 122.47 1i75 s THR 588 Ca 0.01 0.12 0.02 0.00 0.31 0.00 0.00 61.69 62.14 1i75 s THR 588 Cb 0.01 -3.39 -0.02 0.00 0.01 0.00 0.00 72.50 69.11 1i75 s THR 588 CO -0.06 0.39 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.43 1i75 s VAL 589 N 0.83 2.99 -0.21 3.82 1.01 -0.24 -3.24 120.40 125.35 1i75 s VAL 589 Ca 0.07 -0.71 -0.22 0.00 0.00 0.00 0.00 61.98 61.11 1i75 s VAL 589 Cb -0.13 -2.21 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 1i75 s VAL 589 CO 0.02 0.55 0.70 -0.60 0.00 0.00 0.00 175.10 175.78 1i75 s ARG 590 N -0.10 4.20 -0.19 2.72 3.52 -0.07 -0.62 118.95 128.41 1i75 s ARG 590 Ca -0.02 0.73 -0.07 0.00 -0.13 0.00 0.00 55.73 56.23 1i75 s ARG 590 Cb -0.14 -3.61 -0.04 0.00 -1.56 0.00 0.00 34.95 29.61 1i75 s ARG 590 CO 0.04 -0.34 0.06 -0.06 -0.81 0.00 0.00 175.30 174.18 1i75 s PHE 591 N 2.25 3.19 -0.11 5.12 0.08 -0.17 -0.56 117.98 127.78 1i75 s PHE 591 Ca 0.31 -0.05 0.03 0.00 0.12 0.00 0.00 56.93 57.33 1i75 s PHE 591 Cb -0.16 -2.10 0.01 0.00 -0.57 0.00 0.00 43.02 40.20 1i75 s PHE 591 CO 0.10 0.03 -0.19 0.08 -0.10 0.00 0.00 175.22 175.14 1i75 s VAL 592 N 0.64 1.77 -0.13 -0.44 1.01 0.88 -1.55 120.40 122.58 1i75 s VAL 592 Ca 0.03 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.20 1i75 s VAL 592 Cb -0.13 -1.58 0.01 0.00 0.00 0.00 0.00 36.38 34.69 1i75 s VAL 592 CO 0.02 0.50 -0.18 -0.51 0.00 0.00 0.00 175.10 174.93 1i75 s ILE 593 N 0.74 1.72 0.27 2.22 1.10 -0.51 -1.07 121.20 125.69 1i75 s ILE 593 Ca -0.11 -0.77 0.01 0.00 -0.51 0.00 0.00 60.65 59.28 1i75 s ILE 593 Cb -0.16 -1.56 -0.04 0.00 0.15 0.00 0.00 42.46 40.86 1i75 s ILE 593 CO 0.01 0.48 0.46 0.20 -2.11 0.00 0.00 174.94 173.98 1i75 s ASN 594 N 1.02 6.33 -1.23 4.50 -0.87 0.51 -1.45 114.94 123.75 1i75 s ASN 594 Ca -0.04 0.36 -0.07 0.00 -1.57 0.00 0.00 52.86 51.53 1i75 s ASN 594 Cb -0.15 -1.99 0.01 0.00 -0.02 0.00 0.00 41.25 39.10 1i75 s ASN 594 CO -0.04 -0.16 1.07 0.59 -2.57 0.00 0.00 177.10 175.99 1i75 n ASN 595 N -1.32 -5.64 -4.12 -1.22 3.02 -0.95 -0.71 115.26 104.33 1i75 n ASN 595 Ca -0.06 -0.50 -0.37 0.00 -0.03 0.00 0.00 54.58 53.62 1i75 n ASN 595 Cb 0.56 -4.66 -0.06 0.00 -0.61 0.00 0.00 39.78 35.00 1i75 n ASN 595 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i75 s ALA 596 N -3.30 4.24 0.40 5.41 0.00 -0.71 -4.46 121.76 123.34 1i75 s ALA 596 Ca 0.49 -3.80 -0.23 0.00 0.00 0.00 0.00 51.96 48.42 1i75 s ALA 596 Cb -0.21 -2.87 -0.10 0.00 0.00 0.00 0.00 23.12 19.93 1i75 s ALA 596 CO 0.67 -2.15 0.96 0.95 0.00 0.00 0.00 175.76 176.19 1i75 s THR 597 N -1.25 4.27 0.08 0.00 -4.23 -1.26 -4.78 115.64 108.46 1i75 s THR 597 Ca 0.27 1.57 0.01 0.00 -1.18 0.00 0.00 61.69 62.35 1i75 s THR 597 Cb -0.08 -3.73 -0.04 0.00 1.34 0.00 0.00 72.50 69.99 1i75 s THR 597 CO -0.12 -0.15 -0.05 0.42 -0.54 0.00 0.00 174.62 174.18 1i75 s THR 598 N -1.96 0.51 0.84 3.99 -4.23 -1.26 -5.11 115.64 108.43 1i75 s THR 598 Ca 0.58 -1.84 -0.09 0.00 -1.18 0.00 0.00 61.69 59.16 1i75 s THR 598 Cb -0.13 -1.56 0.16 0.00 1.34 0.00 0.00 72.50 72.31 1i75 s THR 598 CO 0.18 -0.89 1.17 0.00 -0.54 0.00 0.00 174.62 174.53 1i75 s ALA 599 N -3.60 2.89 0.23 3.99 0.00 -1.26 -4.95 121.76 119.06 1i75 s ALA 599 Ca 0.09 -1.37 -0.31 0.00 0.00 0.00 0.00 51.96 50.36 1i75 s ALA 599 Cb 0.05 -2.47 -0.11 0.00 0.00 0.00 0.00 23.12 20.59 1i75 s ALA 599 CO -0.06 -1.95 1.65 -1.17 0.00 0.00 0.00 175.76 174.23 1i75 s LEU 600 N -5.54 4.36 0.00 0.00 0.20 -1.26 -1.49 118.68 114.96 1i75 s LEU 600 Ca 0.70 2.84 0.00 0.00 0.69 0.00 0.00 54.13 58.35 1i75 s LEU 600 Cb -0.05 -3.61 0.00 0.00 -0.43 0.00 0.00 46.19 42.10 1i75 s LEU 600 CO 0.49 -0.92 0.00 0.61 -0.29 0.00 0.00 176.35 176.24 1i75 n GLY 601 N 3.36 0.37 3.71 7.98 0.00 -1.26 -4.99 105.19 114.36 1i75 n GLY 601 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 1i75 n GLY 601 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1i75 s GLN 602 N -0.65 3.78 0.16 1.61 0.74 -0.56 -4.51 119.66 120.25 1i75 s GLN 602 Ca 0.00 -0.28 0.05 0.00 0.05 0.00 0.00 55.36 55.17 1i75 s GLN 602 Cb 0.00 -3.20 -0.05 0.00 1.10 0.00 0.00 33.01 30.87 1i75 s GLN 602 CO 0.00 0.44 -0.09 -0.80 -0.55 0.00 0.00 175.29 174.29 1i75 s ASN 603 N -0.09 1.86 -0.04 6.67 -0.87 -0.26 -4.61 114.94 117.60 1i75 s ASN 603 Ca 0.08 -1.04 -0.10 0.00 -1.57 0.00 0.00 52.86 50.23 1i75 s ASN 603 Cb -0.12 -0.02 -0.05 0.00 -0.02 0.00 0.00 41.25 41.04 1i75 s ASN 603 CO 0.01 -0.34 0.28 -0.69 -2.57 0.00 0.00 177.10 173.79 1i75 s VAL 604 N -3.31 5.27 0.29 1.60 1.01 -1.26 -0.81 120.40 123.18 1i75 s VAL 604 Ca 0.18 0.46 0.02 0.00 0.00 0.00 0.00 61.98 62.65 1i75 s VAL 604 Cb 0.03 -3.56 -0.05 0.00 0.00 0.00 0.00 36.38 32.80 1i75 s VAL 604 CO 0.02 0.55 0.12 -0.36 0.00 0.00 0.00 175.10 175.42 1i75 s PHE 605 N -1.11 1.61 0.00 5.22 0.40 -0.03 -1.22 117.98 122.86 1i75 s PHE 605 Ca 0.21 -1.23 0.04 0.00 -0.60 0.00 0.00 56.93 55.36 1i75 s PHE 605 Cb -0.14 -0.94 -0.01 0.00 0.51 0.00 0.00 43.02 42.44 1i75 s PHE 605 CO 0.10 -0.37 -0.14 -1.17 0.70 0.00 0.00 175.22 174.35 1i75 s LEU 606 N -3.37 2.06 0.23 -0.37 2.96 -0.26 -1.68 118.68 118.26 1i75 s LEU 606 Ca 0.36 -0.31 -0.06 0.00 -0.22 0.00 0.00 54.13 53.90 1i75 s LEU 606 Cb 0.07 -0.69 -0.02 0.00 0.50 0.00 0.00 46.19 46.04 1i75 s LEU 606 CO 0.15 0.14 0.31 0.28 -1.32 0.00 0.00 176.35 175.91 1i75 s THR 607 N -0.46 0.00 0.00 3.68 -1.32 -0.89 0.22 115.64 116.87 1i75 s THR 607 Ca 0.04 -1.71 0.00 0.00 -1.21 0.00 0.00 61.69 58.82 1i75 s THR 607 Cb -0.06 -2.37 0.00 0.00 -1.51 0.00 0.00 72.50 68.56 1i75 s THR 607 CO -0.00 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.02 1i75 n GLY 608 N -0.35 1.06 1.28 6.08 0.00 -1.13 -2.12 105.19 110.02 1i75 n GLY 608 Ca 0.00 -0.78 0.05 0.00 0.00 0.00 0.00 46.02 45.30 1i75 n GLY 608 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1i75 n ASN 609 N -0.19 3.72 -4.39 1.61 6.94 0.11 -0.53 115.26 122.54 1i75 n ASN 609 Ca 0.00 -2.46 -0.20 0.00 -0.02 0.00 0.00 54.58 51.90 1i75 n ASN 609 Cb 0.00 -0.55 -0.10 0.00 -2.36 0.00 0.00 39.78 36.77 1i75 n ASN 609 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 1i75 s VAL 610 N -1.95 1.71 0.45 3.53 -7.23 -1.26 -4.87 120.40 110.78 1i75 s VAL 610 Ca 0.35 -2.17 0.13 0.00 -1.81 0.00 0.00 61.98 58.47 1i75 s VAL 610 Cb 0.25 -2.26 0.21 0.00 0.56 0.00 0.00 36.38 35.14 1i75 s VAL 610 CO 0.13 -0.43 2.03 0.77 -0.31 0.00 0.00 175.10 177.29 1i75 h SER 611 N 2.41 0.11 0.02 4.85 4.64 -1.89 -1.14 113.55 122.55 1i75 h SER 611 Ca -0.39 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1i75 h SER 611 Cb 1.23 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1i75 h SER 611 CO 0.64 0.19 -0.01 -0.33 -0.87 0.00 0.00 176.83 176.46 1i75 h GLU 612 N 0.12 0.00 -0.37 4.77 3.07 -1.93 -0.44 114.58 119.79 1i75 h GLU 612 Ca 0.03 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.89 1i75 h GLU 612 Cb 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.10 1i75 h GLU 612 CO 0.01 0.01 0.00 1.28 -1.40 0.00 0.00 179.01 178.91 1i75 n LEU 613 N -3.79 3.83 0.00 1.33 4.77 -0.53 -4.93 117.00 117.68 1i75 n LEU 613 Ca -0.03 -2.60 0.00 0.00 -0.03 0.00 0.00 56.01 53.35 1i75 n LEU 613 Cb 0.09 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 1i75 n LEU 613 CO 0.27 0.71 0.00 0.61 -1.33 0.00 0.00 177.39 177.65 1i75 n GLY 614 N 0.15 0.73 4.03 -0.72 0.00 -0.17 -2.85 105.19 106.36 1i75 n GLY 614 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 1i75 n GLY 614 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1i75 n ASN 615 N 0.00 -0.63 -0.50 1.61 5.03 -0.63 -1.79 115.26 118.35 1i75 n ASN 615 Ca 0.00 -1.10 -0.07 0.00 0.87 0.00 0.00 54.58 54.29 1i75 n ASN 615 Cb 0.00 -2.62 -0.03 0.00 -1.02 0.00 0.00 39.78 36.11 1i75 n ASN 615 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 1i75 n TRP 616 N -4.47 0.00 -3.34 3.10 5.03 0.31 -4.95 117.44 113.12 1i75 n TRP 616 Ca -0.29 0.00 -0.41 0.00 3.03 0.00 0.00 57.50 59.83 1i75 n TRP 616 Cb 0.67 -2.26 -0.09 0.00 -1.03 0.00 0.00 31.31 28.61 1i75 n TRP 616 CO 0.00 0.00 0.00 0.34 -0.03 0.00 0.00 177.69 178.00 1i75 s ASP 617 N -2.28 6.22 0.39 -0.99 3.68 -0.74 -4.95 116.67 117.99 1i75 s ASP 617 Ca 0.00 -0.28 0.14 0.00 2.13 0.00 0.00 52.55 54.53 1i75 s ASP 617 Cb 0.00 -2.22 0.97 0.00 -1.45 0.00 0.00 42.92 40.21 1i75 s ASP 617 CO 0.00 -0.43 1.86 -0.65 0.13 0.00 0.00 175.17 176.08 1i75 h PRO 618 N 8.53 0.51 0.00 4.34 0.11 -1.93 0.23 132.00 143.79 1i75 h PRO 618 Ca -0.29 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.76 1i75 h PRO 618 Cb 1.13 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 1i75 h PRO 618 CO 0.74 0.34 -0.17 -0.91 -0.21 0.00 0.00 178.00 177.79 1i75 h ASN 619 N 0.53 0.00 -0.34 -2.05 -0.26 -1.95 -2.84 115.58 108.66 1i75 h ASN 619 Ca 0.45 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.19 1i75 h ASN 619 Cb 0.95 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.21 1i75 h ASN 619 CO -0.19 0.17 0.00 0.59 -1.06 0.00 0.00 177.43 176.93 1i75 n ASN 620 N -3.72 4.19 -4.76 5.81 3.02 0.78 -5.03 115.26 115.55 1i75 n ASN 620 Ca -0.02 -2.89 -0.34 0.00 -0.03 0.00 0.00 54.58 51.30 1i75 n ASN 620 Cb 0.28 -0.55 0.04 0.00 -0.61 0.00 0.00 39.78 38.94 1i75 n ASN 620 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i75 s ALA 621 N -2.61 2.50 -0.19 5.41 0.00 -0.95 -4.15 121.76 121.77 1i75 s ALA 621 Ca 0.43 0.74 -0.29 0.00 0.00 0.00 0.00 51.96 52.84 1i75 s ALA 621 Cb 0.34 -3.37 -0.00 0.00 0.00 0.00 0.00 23.12 20.08 1i75 s ALA 621 CO 0.12 -1.18 1.18 0.42 0.00 0.00 0.00 175.76 176.29 1i75 s ILE 622 N -2.01 4.43 -5.00 0.00 -1.09 0.13 -4.83 121.20 112.83 1i75 s ILE 622 Ca 0.71 1.73 0.00 0.00 -2.23 0.00 0.00 60.65 60.86 1i75 s ILE 622 Cb -0.24 -4.12 0.00 0.00 -1.58 0.00 0.00 42.46 36.52 1i75 s ILE 622 CO 0.36 -0.15 0.00 0.61 -1.23 0.00 0.00 174.94 174.53 1i75 n GLY 623 N 3.50 0.24 3.78 6.18 0.00 -1.26 -1.10 105.19 116.53 1i75 n GLY 623 Ca 0.13 -1.58 -0.41 0.00 0.00 0.00 0.00 46.02 44.16 1i75 n GLY 623 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1i75 s PRO 624 N -2.00 4.10 1.02 1.61 0.02 -1.26 -5.07 135.00 133.41 1i75 s PRO 624 Ca 0.00 2.53 -0.12 0.00 0.02 0.00 0.00 61.00 63.43 1i75 s PRO 624 Cb 0.00 -2.95 0.20 0.00 0.02 0.00 0.00 34.50 31.77 1i75 s PRO 624 CO 0.00 -0.53 1.08 -1.64 -0.33 0.00 0.00 177.00 175.58 1i75 s MET 625 N -2.10 0.27 0.27 5.54 -1.94 -0.36 -5.02 119.30 115.96 1i75 s MET 625 Ca 0.53 0.69 0.06 0.00 -1.71 0.00 0.00 55.69 55.26 1i75 s MET 625 Cb -0.46 -1.70 -0.02 0.00 2.01 0.00 0.00 34.83 34.65 1i75 s MET 625 CO 0.62 -2.88 0.39 0.71 -0.01 0.00 0.00 175.02 173.85 1i75 s TYR 626 N -2.82 3.34 0.00 -0.03 2.02 0.23 -4.86 117.35 115.24 1i75 s TYR 626 Ca 0.66 -0.08 0.00 0.00 -0.37 0.00 0.00 57.07 57.28 1i75 s TYR 626 Cb -0.20 -1.69 0.00 0.00 -0.40 0.00 0.00 41.96 39.67 1i75 s TYR 626 CO 0.59 0.31 0.84 0.27 -1.57 0.00 0.00 175.55 176.00 1i75 n ASN 627 N -1.47 -0.83 0.03 2.29 0.23 -1.26 -0.42 115.26 113.82 1i75 n ASN 627 Ca -0.06 -1.69 0.00 0.00 -0.53 0.00 0.00 54.58 52.30 1i75 n ASN 627 Cb 0.57 0.25 0.00 0.00 -2.08 0.00 0.00 39.78 38.52 1i75 n ASN 627 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1i75 n GLN 628 N 0.00 0.00 -0.00 -3.83 6.02 -0.83 -0.88 117.38 117.85 1i75 n GLN 628 Ca -0.23 0.00 -0.00 0.00 -0.01 0.00 0.00 57.00 56.76 1i75 n GLN 628 Cb 0.63 -0.43 -0.00 0.00 1.02 0.00 0.00 30.24 31.46 1i75 n GLN 628 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1i75 h VAL 629 N 0.00 0.00 -0.16 5.09 2.07 -1.95 -3.40 116.25 117.89 1i75 h VAL 629 Ca 0.00 -0.05 -0.12 0.00 0.82 0.00 0.00 66.70 67.35 1i75 h VAL 629 Cb 0.50 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 1i75 h VAL 629 CO 0.00 0.00 -0.42 0.58 0.02 0.00 0.00 177.57 177.75 1i75 h VAL 630 N -0.05 1.31 -3.79 2.57 2.07 -1.97 -3.44 116.25 112.96 1i75 h VAL 630 Ca 0.00 -1.57 -0.15 0.00 0.82 0.00 0.00 66.70 65.80 1i75 h VAL 630 Cb 0.02 1.65 -0.20 0.00 -1.52 0.00 0.00 31.29 31.24 1i75 h VAL 630 CO 0.00 0.48 -0.58 -0.31 0.02 0.00 0.00 177.57 177.18 1i75 s TYR 631 N -4.16 0.18 0.02 1.57 2.02 -1.26 -5.15 117.35 110.56 1i75 s TYR 631 Ca -0.06 -0.42 0.06 0.00 -0.37 0.00 0.00 57.07 56.28 1i75 s TYR 631 Cb 0.13 -0.14 -0.03 0.00 -0.40 0.00 0.00 41.96 41.52 1i75 s TYR 631 CO 0.80 -0.28 -0.16 -0.65 -1.57 0.00 0.00 175.55 173.69 1i75 s GLN 632 N -1.89 2.23 0.15 -0.62 1.11 -1.26 -1.97 119.66 117.41 1i75 s GLN 632 Ca -0.11 -0.88 -0.33 0.00 0.01 0.00 0.00 55.36 54.05 1i75 s GLN 632 Cb -0.06 -2.27 -0.17 0.00 -1.01 0.00 0.00 33.01 29.50 1i75 s GLN 632 CO -0.02 0.57 0.89 0.98 0.01 0.00 0.00 175.29 177.72 1i75 n TYR 633 N 1.73 0.46 0.31 0.91 9.36 -0.06 -0.72 117.16 129.15 1i75 n TYR 633 Ca -0.16 0.89 -0.03 0.00 3.32 0.00 0.00 57.90 61.92 1i75 n TYR 633 Cb 0.52 -2.11 0.10 0.00 -0.63 0.00 0.00 39.34 37.22 1i75 n TYR 633 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1i75 n PRO 634 N 1.33 1.87 -3.53 2.98 -0.04 -1.26 -5.07 135.00 131.28 1i75 n PRO 634 Ca 0.17 -1.03 -0.37 0.00 -0.04 0.00 0.00 63.50 62.23 1i75 n PRO 634 Cb 0.21 -1.58 -0.07 0.00 -0.04 0.00 0.00 33.50 32.03 1i75 n PRO 634 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1i75 s THR 635 N -1.35 5.25 0.18 0.52 2.01 0.10 -1.73 115.64 120.61 1i75 s THR 635 Ca 0.19 0.63 0.11 0.00 0.31 0.00 0.00 61.69 62.93 1i75 s THR 635 Cb 0.15 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.97 1i75 s THR 635 CO 0.05 0.45 -0.23 0.26 -0.69 0.00 0.00 174.62 174.45 1i75 s TRP 636 N -0.00 2.34 0.08 4.92 0.52 -0.53 -4.04 118.94 122.23 1i75 s TRP 636 Ca 0.19 -0.35 -0.08 0.00 0.02 0.00 0.00 56.10 55.88 1i75 s TRP 636 Cb -0.14 -1.18 -0.00 0.00 -1.15 0.00 0.00 33.47 31.00 1i75 s TRP 636 CO 0.07 0.47 0.17 1.52 0.02 0.00 0.00 176.95 179.20 1i75 s TYR 637 N -1.55 0.16 -0.25 -1.98 1.13 0.44 -1.42 117.35 113.88 1i75 s TYR 637 Ca 0.20 -0.56 -0.26 0.00 -1.41 0.00 0.00 57.07 55.04 1i75 s TYR 637 Cb -0.08 -0.08 0.09 0.00 -1.10 0.00 0.00 41.96 40.79 1i75 s TYR 637 CO 0.10 -0.51 0.85 -0.47 -2.51 0.00 0.00 175.55 173.01 1i75 s TYR 638 N -3.60 -0.63 -0.26 -3.49 6.04 -0.60 -0.60 117.35 114.22 1i75 s TYR 638 Ca 0.03 1.47 -0.12 0.00 0.04 0.00 0.00 57.07 58.50 1i75 s TYR 638 Cb 0.04 0.33 -0.05 0.00 -1.04 0.00 0.00 41.96 41.24 1i75 s TYR 638 CO -0.10 -0.34 0.21 -0.51 -1.54 0.00 0.00 175.55 173.28 1i75 s ASP 639 N 0.07 6.10 -0.03 4.32 -0.00 -1.26 -1.00 116.67 124.87 1i75 s ASP 639 Ca 0.00 0.09 0.03 0.00 -0.00 0.00 0.00 52.55 52.67 1i75 s ASP 639 Cb -0.04 -2.13 0.00 0.00 -0.00 0.00 0.00 42.92 40.75 1i75 s ASP 639 CO -0.01 -0.03 -0.11 -0.69 -0.00 0.00 0.00 175.17 174.33 1i75 s VAL 640 N 1.55 0.97 -0.14 -1.27 1.01 0.21 -3.46 120.40 119.28 1i75 s VAL 640 Ca 0.09 -0.47 -0.26 0.00 0.00 0.00 0.00 61.98 61.34 1i75 s VAL 640 Cb -0.15 -0.85 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 1i75 s VAL 640 CO 0.09 0.29 0.83 -0.55 0.00 0.00 0.00 175.10 175.76 1i75 s SER 641 N 0.11 7.01 0.04 3.32 0.15 -1.24 -1.08 113.70 122.01 1i75 s SER 641 Ca -0.03 1.24 -0.01 0.00 0.70 0.00 0.00 55.95 57.85 1i75 s SER 641 Cb -0.09 -2.46 -0.04 0.00 -1.71 0.00 0.00 66.02 61.72 1i75 s SER 641 CO 0.01 -0.34 -0.03 0.68 1.20 0.00 0.00 173.24 174.76 1i75 s VAL 642 N 1.83 0.20 0.36 4.45 -7.23 -0.42 -4.83 120.40 114.76 1i75 s VAL 642 Ca 0.40 -1.62 -0.28 0.00 -1.81 0.00 0.00 61.98 58.67 1i75 s VAL 642 Cb -0.17 -1.26 -0.12 0.00 0.56 0.00 0.00 36.38 35.39 1i75 s VAL 642 CO 0.15 -0.89 1.44 -0.81 -0.31 0.00 0.00 175.10 174.67 1i75 n PRO 643 N 0.41 2.51 -2.97 4.82 -0.04 -1.26 -1.33 135.00 137.13 1i75 n PRO 643 Ca -0.16 0.88 -0.35 0.00 -0.04 0.00 0.00 63.50 63.83 1i75 n PRO 643 Cb 0.60 -2.57 -0.06 0.00 -0.04 0.00 0.00 33.50 31.42 1i75 n PRO 643 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1i75 s ALA 644 N -1.00 3.27 -1.21 0.55 0.00 0.29 -4.23 121.76 119.42 1i75 s ALA 644 Ca 0.55 0.28 0.00 0.00 0.00 0.00 0.00 51.96 52.79 1i75 s ALA 644 Cb -0.51 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 19.64 1i75 s ALA 644 CO 0.62 0.25 0.00 0.41 0.00 0.00 0.00 175.76 177.04 1i75 n GLY 645 N 0.18 0.00 3.16 0.00 0.00 -0.30 -4.84 105.19 103.40 1i75 n GLY 645 Ca 0.02 -0.32 -0.09 0.00 0.00 0.00 0.00 46.02 45.63 1i75 n GLY 645 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1i75 s GLN 646 N -4.50 0.90 -0.35 1.61 -2.07 -1.24 -4.85 119.66 109.16 1i75 s GLN 646 Ca 0.00 -1.35 -0.19 0.00 -1.82 0.00 0.00 55.36 52.00 1i75 s GLN 646 Cb 0.00 0.26 -0.00 0.00 -1.09 0.00 0.00 33.01 32.17 1i75 s GLN 646 CO 0.00 -0.25 0.57 0.99 -1.32 0.00 0.00 175.29 175.28 1i75 s THR 647 N -4.01 4.96 0.23 3.63 2.01 -1.26 -0.42 115.64 120.78 1i75 s THR 647 Ca 0.20 0.49 0.05 0.00 0.31 0.00 0.00 61.69 62.73 1i75 s THR 647 Cb 0.07 -4.01 -0.03 0.00 0.01 0.00 0.00 72.50 68.54 1i75 s THR 647 CO -0.01 -0.24 0.33 0.27 -0.69 0.00 0.00 174.62 174.29 1i75 s ILE 648 N 2.53 5.20 0.02 1.82 -4.36 0.21 -4.90 121.20 121.72 1i75 s ILE 648 Ca 0.21 -0.98 0.08 0.00 -0.26 0.00 0.00 60.65 59.71 1i75 s ILE 648 Cb -0.15 -3.80 -0.03 0.00 1.25 0.00 0.00 42.46 39.73 1i75 s ILE 648 CO 0.14 -0.29 -0.22 -1.61 0.24 0.00 0.00 174.94 173.19 1i75 s GLU 649 N -3.85 2.03 0.27 0.37 2.02 -1.26 -1.61 118.70 116.68 1i75 s GLU 649 Ca 0.34 -0.99 -0.20 0.00 0.02 0.00 0.00 54.97 54.14 1i75 s GLU 649 Cb -0.09 -2.10 0.02 0.00 0.10 0.00 0.00 34.13 32.05 1i75 s GLU 649 CO 0.29 0.54 0.70 -0.59 0.02 0.00 0.00 175.26 176.22 1i75 s PHE 650 N -0.80 -0.16 -0.03 1.61 -0.12 -0.31 -0.71 117.98 117.46 1i75 s PHE 650 Ca 0.12 -0.29 -0.26 0.00 -0.05 0.00 0.00 56.93 56.45 1i75 s PHE 650 Cb -0.10 0.67 0.06 0.00 -0.63 0.00 0.00 43.02 43.01 1i75 s PHE 650 CO 0.02 -1.21 0.58 0.15 -0.05 0.00 0.00 175.22 174.71 1i75 s LYS 651 N -3.92 0.96 0.38 1.99 1.02 -0.90 -0.28 119.74 118.99 1i75 s LYS 651 Ca 0.12 0.11 0.02 0.00 0.02 0.00 0.00 55.97 56.24 1i75 s LYS 651 Cb -0.05 0.45 -0.01 0.00 -0.52 0.00 0.00 37.83 37.69 1i75 s LYS 651 CO 0.06 -0.30 0.57 -0.06 -0.92 0.00 0.00 175.35 174.71 1i75 s PHE 652 N -1.32 3.28 0.09 3.18 0.08 -1.26 -2.09 117.98 119.94 1i75 s PHE 652 Ca -0.11 0.13 -0.15 0.00 0.12 0.00 0.00 56.93 56.91 1i75 s PHE 652 Cb -0.01 -2.08 0.03 0.00 -0.57 0.00 0.00 43.02 40.39 1i75 s PHE 652 CO 0.08 -0.10 0.37 -0.48 -0.10 0.00 0.00 175.22 174.99 1i75 s LEU 653 N -4.36 0.58 -0.07 -0.37 2.34 -0.68 -2.04 118.68 114.08 1i75 s LEU 653 Ca 0.44 -0.27 -0.01 0.00 0.06 0.00 0.00 54.13 54.35 1i75 s LEU 653 Cb -0.10 1.66 -0.03 0.00 -0.56 0.00 0.00 46.19 47.16 1i75 s LEU 653 CO 0.35 -0.77 -0.02 -0.54 -1.06 0.00 0.00 176.35 174.31 1i75 s LYS 654 N -3.37 2.87 -0.01 1.48 1.02 0.43 -0.85 119.74 121.32 1i75 s LYS 654 Ca 0.00 -0.48 0.03 0.00 0.02 0.00 0.00 55.97 55.55 1i75 s LYS 654 Cb 0.01 -2.71 -0.01 0.00 -0.52 0.00 0.00 37.83 34.61 1i75 s LYS 654 CO -0.09 0.68 -0.11 0.15 -0.92 0.00 0.00 175.35 175.06 1i75 s LYS 655 N -0.93 0.92 -0.13 1.68 1.02 0.01 -0.63 119.74 121.68 1i75 s LYS 655 Ca 0.14 -0.40 -0.04 0.00 0.02 0.00 0.00 55.97 55.69 1i75 s LYS 655 Cb -0.11 -0.89 0.06 0.00 -0.52 0.00 0.00 37.83 36.37 1i75 s LYS 655 CO 0.03 0.24 0.17 -1.14 -0.92 0.00 0.00 175.35 173.73 1i75 s GLN 656 N -0.25 0.08 6.58 1.68 0.74 -0.48 -1.11 119.66 126.91 1i75 s GLN 656 Ca 0.04 0.41 0.00 0.00 0.05 0.00 0.00 55.36 55.86 1i75 s GLN 656 Cb -0.05 -0.67 0.00 0.00 1.10 0.00 0.00 33.01 33.39 1i75 s GLN 656 CO -0.00 -0.44 0.00 0.41 -0.55 0.00 0.00 175.29 174.71 1i75 n GLY 657 N 5.32 3.94 1.01 2.59 0.00 -1.26 -0.88 105.19 115.90 1i75 n GLY 657 Ca -0.05 0.20 0.11 0.00 0.00 0.00 0.00 46.02 46.28 1i75 n GLY 657 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1i75 n SER 658 N 7.90 3.01 -4.72 1.61 7.64 -1.26 -4.92 113.62 122.87 1i75 n SER 658 Ca 0.00 -1.93 -0.35 0.00 1.01 0.00 0.00 58.87 57.60 1i75 n SER 658 Cb 0.00 -0.22 -0.08 0.00 -1.01 0.00 0.00 64.21 62.90 1i75 n SER 658 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1i75 s THR 659 N -1.55 5.40 -0.17 0.44 2.01 -0.06 -5.05 115.64 116.65 1i75 s THR 659 Ca 0.37 0.20 -0.01 0.00 0.31 0.00 0.00 61.69 62.55 1i75 s THR 659 Cb 0.21 -3.48 -0.01 0.00 0.01 0.00 0.00 72.50 69.24 1i75 s THR 659 CO 0.30 0.43 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.87 1i75 s VAL 660 N 0.43 3.05 -0.30 3.82 1.01 -1.26 -1.39 120.40 125.76 1i75 s VAL 660 Ca 0.08 -0.63 -0.04 0.00 0.00 0.00 0.00 61.98 61.39 1i75 s VAL 660 Cb -0.11 -2.33 0.03 0.00 0.00 0.00 0.00 36.38 33.97 1i75 s VAL 660 CO -0.01 0.49 0.03 -0.89 0.00 0.00 0.00 175.10 174.71 1i75 s THR 661 N 0.92 3.38 0.43 3.92 2.01 0.20 -4.96 115.64 121.53 1i75 s THR 661 Ca -0.02 -1.10 -0.16 0.00 0.31 0.00 0.00 61.69 60.72 1i75 s THR 661 Cb -0.15 -2.85 -0.09 0.00 0.01 0.00 0.00 72.50 69.43 1i75 s THR 661 CO -0.00 -0.02 0.88 0.26 -0.69 0.00 0.00 174.62 175.04 1i75 s TRP 662 N 1.36 3.40 0.52 4.92 0.52 -1.26 -0.43 118.94 127.97 1i75 s TRP 662 Ca -0.02 1.37 -0.22 0.00 0.02 0.00 0.00 56.10 57.26 1i75 s TRP 662 Cb -0.18 -2.68 -0.05 0.00 -1.15 0.00 0.00 33.47 29.40 1i75 s TRP 662 CO -0.00 -0.14 1.29 -1.21 0.02 0.00 0.00 176.95 176.91 1i75 s GLU 663 N -3.52 3.31 0.06 4.98 2.02 -0.87 -4.95 118.70 119.74 1i75 s GLU 663 Ca 0.57 2.07 -0.00 0.00 0.02 0.00 0.00 54.97 57.62 1i75 s GLU 663 Cb -0.10 -2.28 0.01 0.00 0.10 0.00 0.00 34.13 31.87 1i75 s GLU 663 CO 0.23 -1.00 0.08 0.41 0.02 0.00 0.00 175.26 175.00 1i75 n GLY 664 N 0.63 0.00 4.23 -1.39 0.00 -0.09 -4.97 105.19 103.59 1i75 n GLY 664 Ca 0.10 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.27 1i75 n GLY 664 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i75 n GLY 665 N 4.41 -2.18 3.79 -0.02 0.00 -1.26 -4.72 105.19 105.20 1i75 n GLY 665 Ca 0.01 -1.49 -0.32 0.00 0.00 0.00 0.00 46.02 44.22 1i75 n GLY 665 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i75 s ALA 666 N -1.01 2.59 0.50 4.61 0.00 -1.26 -5.01 121.76 122.18 1i75 s ALA 666 Ca 0.00 0.36 -0.23 0.00 0.00 0.00 0.00 51.96 52.09 1i75 s ALA 666 Cb 0.00 -3.25 -0.06 0.00 0.00 0.00 0.00 23.12 19.81 1i75 s ALA 666 CO 0.00 -1.14 1.31 -0.80 0.00 0.00 0.00 175.76 175.13 1i75 s ASN 667 N -3.01 5.66 0.37 0.00 0.01 -1.26 -5.00 114.94 111.72 1i75 s ASN 667 Ca 0.63 2.65 -0.19 0.00 -0.71 0.00 0.00 52.86 55.24 1i75 s ASN 667 Cb -0.17 -2.63 -0.10 0.00 0.41 0.00 0.00 41.25 38.76 1i75 s ASN 667 CO 0.44 -1.29 0.87 -0.13 -1.51 0.00 0.00 177.10 175.48 1i75 s ARG 668 N -2.74 4.19 0.14 -0.60 0.52 0.61 -4.89 118.95 116.19 1i75 s ARG 668 Ca 0.67 0.98 0.09 0.00 -0.52 0.00 0.00 55.73 56.95 1i75 s ARG 668 Cb -0.38 -2.35 -0.04 0.00 0.52 0.00 0.00 34.95 32.70 1i75 s ARG 668 CO 0.45 0.08 -0.21 0.95 0.02 0.00 0.00 175.30 176.59 1i75 s THR 669 N -2.03 1.94 -0.21 0.02 -4.23 -1.26 -1.16 115.64 108.72 1i75 s THR 669 Ca 0.57 -1.79 -0.16 0.00 -1.18 0.00 0.00 61.69 59.13 1i75 s THR 669 Cb -0.11 -1.82 0.06 0.00 1.34 0.00 0.00 72.50 71.97 1i75 s THR 669 CO 0.16 -0.14 0.54 0.12 -0.54 0.00 0.00 174.62 174.76 1i75 s PHE 670 N -1.55 -0.69 -0.36 3.99 5.36 -0.63 -4.97 117.98 119.13 1i75 s PHE 670 Ca 0.13 1.55 -0.16 0.00 -0.96 0.00 0.00 56.93 57.49 1i75 s PHE 670 Cb -0.08 0.31 -0.00 0.00 -0.34 0.00 0.00 43.02 42.90 1i75 s PHE 670 CO 0.06 -0.35 0.40 0.99 -1.46 0.00 0.00 175.22 174.86 1i75 s THR 671 N 0.84 5.13 0.53 0.12 2.01 -1.26 -0.62 115.64 122.40 1i75 s THR 671 Ca -0.04 0.01 -0.19 0.00 0.31 0.00 0.00 61.69 61.77 1i75 s THR 671 Cb -0.05 -3.88 -0.06 0.00 0.01 0.00 0.00 72.50 68.51 1i75 s THR 671 CO -0.07 -0.17 1.09 0.42 -0.69 0.00 0.00 174.62 175.20 1i75 s THR 672 N 2.09 3.46 0.87 -0.82 -4.23 0.44 -4.89 115.64 112.56 1i75 s THR 672 Ca 0.13 0.88 -0.11 0.00 -1.18 0.00 0.00 61.69 61.41 1i75 s THR 672 Cb -0.16 -3.35 0.11 0.00 1.34 0.00 0.00 72.50 70.44 1i75 s THR 672 CO 0.12 -0.23 1.11 -2.16 -0.54 0.00 0.00 174.62 172.93 1i75 s PRO 673 N -3.37 1.45 0.27 3.99 0.04 -1.26 -2.45 135.00 133.66 1i75 s PRO 673 Ca 0.70 1.27 0.17 0.00 0.04 0.00 0.00 61.00 63.17 1i75 s PRO 673 Cb -0.20 -1.80 0.07 0.00 0.04 0.00 0.00 34.50 32.61 1i75 s PRO 673 CO 0.26 -2.24 1.36 1.79 0.04 0.00 0.00 177.00 178.21 1i75 h THR 674 N -1.57 0.67 -3.28 1.26 1.35 -1.94 -0.78 112.91 108.62 1i75 h THR 674 Ca -0.45 -1.99 0.01 0.00 -0.55 0.00 0.00 66.41 63.43 1i75 h THR 674 Cb 1.26 2.28 -0.06 0.00 -1.73 0.00 0.00 68.15 69.89 1i75 h THR 674 CO 0.48 0.38 0.09 -0.94 -0.25 0.00 0.00 175.52 175.28 1i75 s SER 675 N -6.29 -0.15 0.04 5.36 1.04 -1.26 -4.74 113.70 107.71 1i75 s SER 675 Ca 0.03 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 55.67 1i75 s SER 675 Cb 0.07 0.68 0.00 0.00 0.10 0.00 0.00 66.02 66.88 1i75 s SER 675 CO 0.75 -1.29 0.00 0.61 0.98 0.00 0.00 173.24 174.28 1i75 n GLY 676 N -0.44 -1.73 3.78 7.32 0.00 -1.26 -4.97 105.19 107.89 1i75 n GLY 676 Ca -0.03 -1.35 -0.33 0.00 0.00 0.00 0.00 46.02 44.31 1i75 n GLY 676 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1i75 s THR 677 N 0.00 1.13 0.17 2.61 -4.23 -1.26 -4.10 115.64 109.95 1i75 s THR 677 Ca 0.00 -1.98 -0.22 0.00 -1.18 0.00 0.00 61.69 58.31 1i75 s THR 677 Cb 0.00 -2.11 0.06 0.00 1.34 0.00 0.00 72.50 71.80 1i75 s THR 677 CO 0.00 0.00 0.59 0.00 -0.54 0.00 0.00 174.62 174.67 1i75 s ALA 678 N -2.88 -1.50 -0.05 3.99 0.00 -1.20 -4.91 121.76 115.20 1i75 s ALA 678 Ca 0.05 0.37 0.05 0.00 0.00 0.00 0.00 51.96 52.43 1i75 s ALA 678 Cb 0.01 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 23.99 1i75 s ALA 678 CO 0.03 -0.78 -0.21 0.99 0.00 0.00 0.00 175.76 175.79 1i75 s THR 679 N -3.77 1.74 -0.24 0.00 2.01 -1.26 -0.89 115.64 113.22 1i75 s THR 679 Ca 0.02 -0.88 -0.07 0.00 0.31 0.00 0.00 61.69 61.07 1i75 s THR 679 Cb -0.01 -1.49 -0.03 0.00 0.01 0.00 0.00 72.50 70.99 1i75 s THR 679 CO -0.11 0.49 0.05 -0.69 -0.69 0.00 0.00 174.62 173.67 1i75 s VAL 680 N -0.01 4.18 -0.18 3.82 1.01 0.27 -4.96 120.40 124.55 1i75 s VAL 680 Ca -0.05 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.72 1i75 s VAL 680 Cb -0.13 -2.95 0.03 0.00 0.00 0.00 0.00 36.38 33.33 1i75 s VAL 680 CO 0.03 0.35 -0.13 0.21 0.00 0.00 0.00 175.10 175.57 1i75 s ASN 681 N 1.57 3.11 0.32 3.32 3.84 -1.26 -0.09 114.94 125.74 1i75 s ASN 681 Ca 0.06 -0.71 0.04 0.00 0.21 0.00 0.00 52.86 52.46 1i75 s ASN 681 Cb -0.15 -1.25 -0.03 0.00 -0.55 0.00 0.00 41.25 39.27 1i75 s ASN 681 CO 0.03 -0.09 0.20 0.68 -2.79 0.00 0.00 177.10 175.12 1i75 s VAL 682 N 1.41 0.21 -0.03 -5.21 -7.23 -0.23 -5.00 120.40 104.33 1i75 s VAL 682 Ca 0.02 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.24 1i75 s VAL 682 Cb -0.15 -2.48 -0.01 0.00 0.56 0.00 0.00 36.38 34.30 1i75 s VAL 682 CO -0.10 0.00 -0.19 0.20 -0.31 0.00 0.00 175.10 174.70 1i75 s ASN 683 N -3.38 2.33 0.15 4.85 0.01 -1.26 -0.36 114.94 117.27 1i75 s ASN 683 Ca 0.36 -0.37 -0.34 0.00 -0.71 0.00 0.00 52.86 51.80 1i75 s ASN 683 Cb 0.04 -0.41 -0.14 0.00 0.41 0.00 0.00 41.25 41.15 1i75 s ASN 683 CO 0.20 0.22 1.52 1.87 -1.51 0.00 0.00 177.10 179.40 1i75 n TRP 684 N 2.79 2.11 -3.57 2.20 -0.00 0.12 -4.86 117.44 116.23 1i75 n TRP 684 Ca -0.16 0.35 -0.40 0.00 -0.00 0.00 0.00 57.50 57.29 1i75 n TRP 684 Cb 0.53 -2.50 -0.11 0.00 -0.00 0.00 0.00 31.31 29.24 1i75 n TRP 684 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 177.69 177.04 1i75 s GLN 685 N 0.80 3.46 0.00 5.87 -0.21 -1.26 -5.02 119.66 123.30 1i75 s GLN 685 Ca 0.80 -0.66 0.20 0.00 0.02 0.00 0.00 55.36 55.73 1i75 s GLN 685 Cb -0.74 -3.74 1.22 0.00 1.00 0.00 0.00 33.01 30.75 1i75 s GLN 685 CO 0.40 -0.43 1.60 -0.35 -2.12 0.00 0.00 175.29 174.39