#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pj9 s PRO 2 N 0.00 2.84 0.54 0.00 0.04 -1.26 -4.58 135.00 132.58 1pj9 s PRO 2 Ca 0.00 0.89 0.23 0.00 0.04 0.00 0.00 61.00 62.16 1pj9 s PRO 2 Cb 0.00 -1.98 1.42 0.00 0.04 0.00 0.00 34.50 33.97 1pj9 s PRO 2 CO 0.00 -1.15 2.07 0.38 0.04 0.00 0.00 177.00 178.34 1pj9 h ASP 3 N -0.76 0.00 0.20 6.66 2.03 -1.93 -1.46 116.42 121.17 1pj9 h ASP 3 Ca -0.44 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.86 1pj9 h ASP 3 Cb 1.22 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.72 1pj9 h ASP 3 CO 0.57 0.00 -0.04 0.35 -1.03 0.00 0.00 179.24 179.10 1pj9 n THR 4 N -4.30 0.00 -1.87 1.15 -2.24 -1.26 -4.82 114.28 100.94 1pj9 n THR 4 Ca 0.03 -0.06 -0.38 0.00 -2.27 0.00 0.00 64.05 61.38 1pj9 n THR 4 Cb 0.36 -0.21 0.03 0.00 -2.10 0.00 0.00 70.33 68.42 1pj9 n THR 4 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1pj9 s SER 5 N -2.24 5.39 0.61 3.42 0.15 -0.55 -4.88 113.70 115.59 1pj9 s SER 5 Ca 0.37 2.67 0.39 0.00 0.70 0.00 0.00 55.95 60.08 1pj9 s SER 5 Cb 0.21 -2.63 1.96 0.00 -1.71 0.00 0.00 66.02 63.85 1pj9 s SER 5 CO 0.41 -1.48 2.21 1.62 1.20 0.00 0.00 173.24 177.21 1pj9 h VAL 6 N 1.46 0.08 0.00 4.45 3.04 -1.90 -1.94 116.25 121.44 1pj9 h VAL 6 Ca -0.51 -0.23 0.00 0.00 -1.01 0.00 0.00 66.70 64.95 1pj9 h VAL 6 Cb 1.29 1.21 0.00 0.00 -2.01 0.00 0.00 31.29 31.78 1pj9 h VAL 6 CO 0.57 0.01 0.00 -1.54 -1.01 0.00 0.00 177.57 175.61 1pj9 n SER 7 N -3.17 0.12 -4.56 3.17 3.41 -1.26 -4.61 113.62 106.72 1pj9 n SER 7 Ca -0.02 0.52 -0.41 0.00 -0.26 0.00 0.00 58.87 58.71 1pj9 n SER 7 Cb 0.17 -0.55 -0.03 0.00 -0.26 0.00 0.00 64.21 63.54 1pj9 n SER 7 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1pj9 s ASN 8 N -3.22 6.33 0.02 4.04 3.84 -0.73 -4.81 114.94 120.40 1pj9 s ASN 8 Ca 0.10 -1.06 0.28 0.00 0.21 0.00 0.00 52.86 52.39 1pj9 s ASN 8 Cb 0.14 -2.57 1.12 0.00 -0.55 0.00 0.00 41.25 39.39 1pj9 s ASN 8 CO 0.41 -1.67 1.86 0.29 -2.79 0.00 0.00 177.10 175.20 1pj9 n LYS 9 N 9.06 0.02 0.00 0.43 5.02 -1.26 -3.68 118.16 127.75 1pj9 n LYS 9 Ca 0.23 0.02 0.11 0.00 -2.02 0.00 0.00 58.31 56.65 1pj9 n LYS 9 Cb 0.50 -1.53 0.13 0.00 -0.02 0.00 0.00 35.03 34.12 1pj9 n LYS 9 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1pj9 n GLN 10 N -1.57 0.02 -3.69 1.97 3.00 -1.26 -0.32 117.38 115.54 1pj9 n GLN 10 Ca 0.07 -0.02 -0.22 0.00 -0.01 0.00 0.00 57.00 56.82 1pj9 n GLN 10 Cb 0.35 -1.50 -0.18 0.00 0.00 0.00 0.00 30.24 28.91 1pj9 n GLN 10 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.06 178.27 1pj9 s ASN 11 N -2.99 1.56 -0.00 1.08 3.84 -1.24 -4.57 114.94 112.62 1pj9 s ASN 11 Ca 0.10 -0.13 0.05 0.00 0.21 0.00 0.00 52.86 53.09 1pj9 s ASN 11 Cb 0.17 -0.25 0.15 0.00 -0.55 0.00 0.00 41.25 40.77 1pj9 s ASN 11 CO 0.75 -0.26 1.12 0.49 -2.79 0.00 0.00 177.10 176.42 1pj9 n PHE 12 N 5.25 0.23 0.27 0.43 3.01 -1.26 -4.69 117.46 120.69 1pj9 n PHE 12 Ca -0.05 -0.51 0.15 0.00 1.01 0.00 0.00 57.45 58.05 1pj9 n PHE 12 Cb 0.50 -0.04 0.70 0.00 -0.01 0.00 0.00 39.48 40.62 1pj9 n PHE 12 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 1pj9 h SER 13 N 0.97 0.00 -0.20 4.37 0.02 -1.84 -1.63 113.55 115.24 1pj9 h SER 13 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1pj9 h SER 13 Cb 0.62 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.16 1pj9 h SER 13 CO 0.00 0.09 0.00 0.35 -1.14 0.00 0.00 176.83 176.13 1pj9 n THR 14 N -3.31 0.24 -3.59 -2.27 -2.24 -1.26 -4.51 114.28 97.35 1pj9 n THR 14 Ca -0.01 -0.48 -0.20 0.00 -2.27 0.00 0.00 64.05 61.09 1pj9 n THR 14 Cb 0.30 0.76 -0.03 0.00 -2.10 0.00 0.00 70.33 69.26 1pj9 n THR 14 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1pj9 s ASP 15 N -1.67 5.29 -0.13 3.42 1.01 -0.61 -3.67 116.67 120.30 1pj9 s ASP 15 Ca 0.34 -0.57 -0.00 0.00 0.71 0.00 0.00 52.55 53.03 1pj9 s ASP 15 Cb 0.20 -0.79 0.03 0.00 1.01 0.00 0.00 42.92 43.37 1pj9 s ASP 15 CO 0.30 -0.53 -0.07 -0.69 0.21 0.00 0.00 175.17 174.39 1pj9 s VAL 16 N -2.37 1.05 0.10 -1.27 1.01 -1.26 -4.31 120.40 113.34 1pj9 s VAL 16 Ca 0.46 -0.41 -0.21 0.00 0.00 0.00 0.00 61.98 61.81 1pj9 s VAL 16 Cb -0.05 -1.13 -0.07 0.00 0.00 0.00 0.00 36.38 35.12 1pj9 s VAL 16 CO 0.28 0.28 0.64 -0.63 0.00 0.00 0.00 175.10 175.66 1pj9 s ILE 17 N 1.68 4.64 -0.25 2.22 1.01 0.42 -2.11 121.20 128.81 1pj9 s ILE 17 Ca 0.03 1.37 -0.02 0.00 0.00 0.00 0.00 60.65 62.04 1pj9 s ILE 17 Cb -0.14 -3.98 0.03 0.00 0.01 0.00 0.00 42.46 38.38 1pj9 s ILE 17 CO -0.08 0.53 -0.06 -0.47 0.00 0.00 0.00 174.94 174.86 1pj9 s TYR 18 N -1.04 3.06 -0.43 3.97 5.04 -0.05 0.19 117.35 128.08 1pj9 s TYR 18 Ca 0.31 -1.56 -0.26 0.00 -2.44 0.00 0.00 57.07 53.13 1pj9 s TYR 18 Cb -0.21 -2.06 0.02 0.00 0.35 0.00 0.00 41.96 40.07 1pj9 s TYR 18 CO 0.21 -0.73 0.93 -1.14 -1.34 0.00 0.00 175.55 173.48 1pj9 s GLN 19 N 1.32 3.64 -0.23 4.97 0.74 0.15 -1.55 119.66 128.71 1pj9 s GLN 19 Ca 0.00 0.31 -0.10 0.00 0.05 0.00 0.00 55.36 55.62 1pj9 s GLN 19 Cb -0.17 -3.89 -0.05 0.00 1.10 0.00 0.00 33.01 30.01 1pj9 s GLN 19 CO -0.05 -1.14 0.14 0.42 -0.55 0.00 0.00 175.29 174.11 1pj9 s ILE 20 N 3.70 5.22 -0.81 -2.34 1.01 0.60 -0.83 121.20 127.73 1pj9 s ILE 20 Ca 0.38 0.13 -0.18 0.00 0.00 0.00 0.00 60.65 60.98 1pj9 s ILE 20 Cb -0.11 -3.41 0.15 0.00 0.01 0.00 0.00 42.46 39.10 1pj9 s ILE 20 CO 0.24 0.37 0.93 0.12 0.00 0.00 0.00 174.94 176.61 1pj9 s PHE 21 N 0.90 3.25 0.11 3.97 5.36 -1.26 -3.38 117.98 126.92 1pj9 s PHE 21 Ca 0.07 -1.42 -0.15 0.00 -0.96 0.00 0.00 56.93 54.47 1pj9 s PHE 21 Cb -0.13 -4.10 0.03 0.00 -0.34 0.00 0.00 43.02 38.48 1pj9 s PHE 21 CO 0.03 -1.32 0.89 0.09 -1.46 0.00 0.00 175.22 173.45 1pj9 n ASN 22 N 5.85 -0.52 0.28 6.13 4.13 -1.26 -0.47 115.26 129.41 1pj9 n ASN 22 Ca 0.13 1.02 0.14 0.00 1.68 0.00 0.00 54.58 57.54 1pj9 n ASN 22 Cb 0.47 -0.17 0.85 0.00 -1.54 0.00 0.00 39.78 39.39 1pj9 n ASN 22 CO 0.00 0.00 0.00 -0.78 0.28 0.00 0.00 177.26 176.76 1pj9 h ASP 23 N 0.00 0.00 -0.48 6.41 3.58 -1.79 -2.75 116.42 121.39 1pj9 h ASP 23 Ca 0.13 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.58 1pj9 h ASP 23 Cb 0.28 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.33 1pj9 h ASP 23 CO -0.55 0.00 0.00 0.54 -2.88 0.00 0.00 179.24 176.35 1pj9 n ARG 24 N -4.01 2.67 -0.01 0.28 5.12 0.38 -1.05 116.66 120.05 1pj9 n ARG 24 Ca -0.03 -2.27 -0.01 0.00 -1.93 0.00 0.00 57.85 53.62 1pj9 n ARG 24 Cb 0.10 -1.40 -0.00 0.00 -1.16 0.00 0.00 32.46 30.00 1pj9 n ARG 24 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1pj9 n PHE 25 N 1.04 0.02 -3.66 -1.55 7.35 -1.04 -1.71 117.46 117.92 1pj9 n PHE 25 Ca 0.17 0.01 -0.06 0.00 -0.76 0.00 0.00 57.45 56.81 1pj9 n PHE 25 Cb 0.51 -0.10 -0.07 0.00 0.35 0.00 0.00 39.48 40.17 1pj9 n PHE 25 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 1pj9 s SER 26 N -4.02 -0.71 -0.83 -2.13 0.15 -1.26 -4.63 113.70 100.26 1pj9 s SER 26 Ca -0.02 1.26 -0.22 0.00 0.70 0.00 0.00 55.95 57.67 1pj9 s SER 26 Cb 0.00 1.57 0.08 0.00 -1.71 0.00 0.00 66.02 65.96 1pj9 s SER 26 CO 0.03 -0.22 1.17 -0.62 1.20 0.00 0.00 173.24 174.79 1pj9 s ASP 27 N 2.33 6.38 0.13 5.45 2.15 -1.26 -1.59 116.67 130.27 1pj9 s ASP 27 Ca -0.06 -1.33 0.24 0.00 0.43 0.00 0.00 52.55 51.83 1pj9 s ASP 27 Cb -0.10 -2.47 0.35 0.00 -0.30 0.00 0.00 42.92 40.40 1pj9 s ASP 27 CO -0.16 -1.40 1.33 1.23 -0.17 0.00 0.00 175.17 176.00 1pj9 h GLY 28 N 11.64 0.00 -6.71 2.66 0.00 -1.83 -3.43 103.07 105.40 1pj9 h GLY 28 Ca -0.05 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.73 1pj9 h GLY 28 CO 1.23 0.00 -0.81 0.21 0.00 0.00 0.00 176.54 177.17 1pj9 s ASN 29 N -4.34 3.28 0.63 0.19 2.47 -1.26 -4.74 114.94 111.17 1pj9 s ASN 29 Ca 0.06 -1.78 0.40 0.00 0.42 0.00 0.00 52.86 51.96 1pj9 s ASN 29 Cb 0.13 -0.41 2.16 0.00 -1.45 0.00 0.00 41.25 41.67 1pj9 s ASN 29 CO 0.72 -0.37 2.29 -0.65 -3.72 0.00 0.00 177.10 175.37 1pj9 h PRO 30 N 7.66 0.00 0.00 0.43 0.11 -1.91 -2.88 132.00 135.41 1pj9 h PRO 30 Ca -0.06 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.01 1pj9 h PRO 30 Cb 0.99 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.09 1pj9 h PRO 30 CO 0.35 0.01 -0.16 0.00 -0.21 0.00 0.00 178.00 178.00 1pj9 h ALA 31 N 1.99 1.43 -0.46 -0.75 0.00 -1.99 -2.63 119.26 116.86 1pj9 h ALA 31 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1pj9 h ALA 31 Cb 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1pj9 h ALA 31 CO 0.00 0.20 0.00 0.27 0.00 0.00 0.00 179.25 179.72 1pj9 n ASN 32 N -3.90 3.11 -4.75 0.00 0.23 -1.08 -4.97 115.26 103.90 1pj9 n ASN 32 Ca -0.02 -1.95 -0.41 0.00 -0.53 0.00 0.00 54.58 51.66 1pj9 n ASN 32 Cb 0.25 -0.30 -0.02 0.00 -2.08 0.00 0.00 39.78 37.63 1pj9 n ASN 32 CO 0.00 0.00 0.00 0.20 -0.93 0.00 0.00 177.26 176.53 1pj9 s ASN 33 N -1.28 6.72 1.03 0.53 0.01 -0.99 -4.29 114.94 116.66 1pj9 s ASN 33 Ca 0.39 2.65 -0.12 0.00 -0.71 0.00 0.00 52.86 55.08 1pj9 s ASN 33 Cb 0.21 -2.63 0.21 0.00 0.41 0.00 0.00 41.25 39.45 1pj9 s ASN 33 CO 0.29 -0.63 1.08 -2.84 -1.51 0.00 0.00 177.10 173.50 1pj9 s PRO 34 N -0.88 0.16 0.43 -0.60 0.02 -1.26 -5.03 135.00 127.84 1pj9 s PRO 34 Ca 0.55 1.09 0.04 0.00 0.02 0.00 0.00 61.00 62.70 1pj9 s PRO 34 Cb -0.41 -1.66 -0.04 0.00 0.02 0.00 0.00 34.50 32.41 1pj9 s PRO 34 CO 0.47 -3.07 0.04 0.95 -0.33 0.00 0.00 177.00 175.05 1pj9 s THR 35 N -2.61 1.28 0.00 0.99 -4.23 -1.26 -4.64 115.64 105.16 1pj9 s THR 35 Ca 0.67 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.18 1pj9 s THR 35 Cb -0.23 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.08 1pj9 s THR 35 CO 0.61 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.30 1pj9 n GLY 36 N -1.01 2.56 0.00 3.99 0.00 -1.26 -2.90 105.19 106.56 1pj9 n GLY 36 Ca -0.10 -0.45 0.06 0.00 0.00 0.00 0.00 46.02 45.53 1pj9 n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pj9 n ALA 37 N 9.03 1.61 1.01 4.61 0.00 -1.26 -2.12 120.51 133.39 1pj9 n ALA 37 Ca 0.00 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.51 1pj9 n ALA 37 Cb 0.00 -1.19 0.29 0.00 0.00 0.00 0.00 19.45 18.56 1pj9 n ALA 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pj9 n ALA 38 N -1.40 2.49 -2.73 0.00 0.00 -1.14 -4.94 120.51 112.78 1pj9 n ALA 38 Ca 0.04 -0.66 -0.17 0.00 0.00 0.00 0.00 53.44 52.65 1pj9 n ALA 38 Cb 0.12 -0.98 -0.13 0.00 0.00 0.00 0.00 19.45 18.46 1pj9 n ALA 38 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1pj9 s PHE 39 N -1.83 0.80 -0.31 0.00 5.36 -0.90 -1.17 117.98 119.92 1pj9 s PHE 39 Ca 0.34 -0.27 0.00 0.00 -0.96 0.00 0.00 56.93 56.04 1pj9 s PHE 39 Cb 0.20 -0.49 0.14 0.00 -0.34 0.00 0.00 43.02 42.53 1pj9 s PHE 39 CO 0.30 -0.02 0.29 0.34 -1.46 0.00 0.00 175.22 174.68 1pj9 s ASP 40 N -0.75 1.82 0.62 6.13 2.15 -0.25 -4.82 116.67 121.58 1pj9 s ASP 40 Ca -0.01 -1.10 0.38 0.00 0.43 0.00 0.00 52.55 52.25 1pj9 s ASP 40 Cb -0.06 0.38 2.10 0.00 -0.30 0.00 0.00 42.92 45.04 1pj9 s ASP 40 CO 0.00 -0.36 2.29 1.23 -0.17 0.00 0.00 175.17 178.17 1pj9 h GLY 41 N 7.91 0.00 1.64 2.66 0.00 -1.80 -0.46 103.07 113.01 1pj9 h GLY 41 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1pj9 h GLY 41 CO 0.31 0.00 -0.20 -1.30 0.00 0.00 0.00 176.54 175.35 1pj9 n THR 42 N -3.39 0.08 -3.80 4.70 -2.24 -1.26 -4.94 114.28 103.44 1pj9 n THR 42 Ca -0.03 -0.04 -0.25 0.00 -2.27 0.00 0.00 64.05 61.46 1pj9 n THR 42 Cb 0.10 -0.25 0.03 0.00 -2.10 0.00 0.00 70.33 68.11 1pj9 n THR 42 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1pj9 n THR 44 N -4.47 1.73 -2.91 0.00 -1.04 -1.26 -4.64 114.28 101.70 1pj9 n THR 44 Ca -0.15 -0.66 -0.43 0.00 -2.04 0.00 0.00 64.05 60.77 1pj9 n THR 44 Cb 0.61 -1.63 -0.04 0.00 -1.82 0.00 0.00 70.33 67.45 1pj9 n THR 44 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1pj9 s ASN 45 N -6.90 6.20 0.00 8.00 3.84 -1.26 -4.90 114.94 119.92 1pj9 s ASN 45 Ca -0.23 -0.96 0.05 0.00 0.21 0.00 0.00 52.86 51.93 1pj9 s ASN 45 Cb 0.07 -2.40 0.28 0.00 -0.55 0.00 0.00 41.25 38.65 1pj9 s ASN 45 CO 0.75 -1.34 0.87 0.18 -2.79 0.00 0.00 177.10 174.78 1pj9 n LEU 46 N 7.41 0.00 -0.46 3.21 4.77 -1.26 -2.64 117.00 128.03 1pj9 n LEU 46 Ca -0.04 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.01 1pj9 n LEU 46 Cb 0.45 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.57 1pj9 n LEU 46 CO 0.63 0.00 0.37 0.54 -1.33 0.00 0.00 177.39 177.60 1pj9 n ARG 47 N -0.61 1.38 -3.94 3.23 1.74 -1.26 -4.88 116.66 112.32 1pj9 n ARG 47 Ca 0.03 -1.07 -0.24 0.00 -0.77 0.00 0.00 57.85 55.80 1pj9 n ARG 47 Cb 0.02 -1.24 -0.05 0.00 -1.02 0.00 0.00 32.46 30.16 1pj9 n ARG 47 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1pj9 s LEU 48 N -1.50 3.14 0.24 0.55 1.43 -1.08 -1.65 118.68 119.81 1pj9 s LEU 48 Ca 0.14 -1.01 -0.30 0.00 -1.03 0.00 0.00 54.13 51.94 1pj9 s LEU 48 Cb 0.12 -1.59 -0.09 0.00 0.03 0.00 0.00 46.19 44.66 1pj9 s LEU 48 CO 0.25 -0.64 1.26 -0.31 0.23 0.00 0.00 176.35 177.14 1pj9 s TYR 49 N -2.58 3.29 -0.09 0.29 1.51 -0.32 -4.82 117.35 114.62 1pj9 s TYR 49 Ca 0.42 1.38 0.17 0.00 -1.01 0.00 0.00 57.07 58.03 1pj9 s TYR 49 Cb 0.01 -3.54 -0.26 0.00 -0.11 0.00 0.00 41.96 38.06 1pj9 s TYR 49 CO 0.24 -1.54 0.41 0.00 -1.11 0.00 0.00 175.55 173.54 1pj9 n GLY 51 N 1.51 1.87 3.66 0.00 0.00 -1.25 -4.57 105.19 106.41 1pj9 n GLY 51 Ca -0.03 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.54 1pj9 n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pj9 n GLY 52 N -0.31 0.74 1.20 -0.02 0.00 -0.21 -4.27 105.19 102.32 1pj9 n GLY 52 Ca 0.00 0.52 -0.06 0.00 0.00 0.00 0.00 46.02 46.49 1pj9 n GLY 52 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1pj9 n ASP 53 N 2.30 -0.43 -0.03 1.61 5.68 -0.62 -3.42 116.55 121.64 1pj9 n ASP 53 Ca 0.13 -1.72 -0.07 0.00 -0.50 0.00 0.00 54.79 52.63 1pj9 n ASP 53 Cb 0.30 0.83 0.11 0.00 -1.14 0.00 0.00 41.12 41.22 1pj9 n ASP 53 CO 0.00 0.00 0.00 -0.50 -1.33 0.00 0.00 177.20 175.37 1pj9 h TRP 54 N 1.37 0.72 -0.34 2.11 6.55 -1.52 -2.62 115.95 122.21 1pj9 h TRP 54 Ca -0.09 -0.19 -0.04 0.00 0.95 0.00 0.00 58.89 59.52 1pj9 h TRP 54 Cb 0.43 -0.16 -0.02 0.00 -0.86 0.00 0.00 29.16 28.55 1pj9 h TRP 54 CO 0.00 0.88 0.05 0.37 -1.05 0.00 0.00 178.44 178.69 1pj9 h GLN 55 N 0.52 0.51 -0.64 0.49 5.75 -1.89 -0.40 115.11 119.45 1pj9 h GLN 55 Ca 0.05 -0.09 -0.05 0.00 -0.15 0.00 0.00 58.65 58.41 1pj9 h GLN 55 Cb 0.84 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 29.28 1pj9 h GLN 55 CO 0.07 0.50 0.20 0.78 -2.65 0.00 0.00 178.83 177.73 1pj9 h GLY 56 N 0.77 1.07 1.00 2.39 0.00 -1.53 -0.54 103.07 106.23 1pj9 h GLY 56 Ca 0.11 -0.64 -0.06 0.00 0.00 0.00 0.00 47.33 46.75 1pj9 h GLY 56 CO 0.00 0.59 0.13 -2.22 0.00 0.00 0.00 176.54 175.04 1pj9 h ILE 57 N 0.93 1.25 -0.72 2.60 2.04 -1.04 -1.71 117.51 120.85 1pj9 h ILE 57 Ca 0.21 -0.90 0.05 0.00 1.00 0.00 0.00 64.86 65.21 1pj9 h ILE 57 Cb 0.30 0.76 -0.05 0.00 -0.74 0.00 0.00 36.82 37.09 1pj9 h ILE 57 CO -0.01 0.33 0.43 0.40 0.00 0.00 0.00 178.15 179.31 1pj9 h ILE 58 N 0.80 1.04 -0.57 -0.67 2.04 -0.72 -0.26 117.51 119.17 1pj9 h ILE 58 Ca 0.17 -0.28 -0.05 0.00 1.00 0.00 0.00 64.86 65.70 1pj9 h ILE 58 Cb 0.36 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.56 1pj9 h ILE 58 CO 0.00 0.15 0.15 0.78 0.00 0.00 0.00 178.15 179.24 1pj9 h ASN 59 N 0.82 0.85 1.04 1.72 2.35 -0.72 -0.25 115.58 121.40 1pj9 h ASN 59 Ca 0.30 -0.22 -0.03 0.00 -0.55 0.00 0.00 56.30 55.80 1pj9 h ASN 59 Cb 0.11 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.25 1pj9 h ASN 59 CO -0.15 0.85 -0.16 0.11 -1.65 0.00 0.00 177.43 176.44 1pj9 h LYS 60 N 0.81 0.00 -0.02 0.81 1.79 -0.90 0.88 116.57 119.94 1pj9 h LYS 60 Ca 0.18 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 58.45 1pj9 h LYS 60 Cb 0.32 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.99 1pj9 h LYS 60 CO -0.00 0.16 -0.77 0.82 -1.08 0.00 0.00 179.45 178.58 1pj9 h ILE 61 N 0.00 1.35 0.00 1.86 2.04 -0.64 -2.97 117.51 119.15 1pj9 h ILE 61 Ca -0.00 -2.10 -0.13 0.00 1.00 0.00 0.00 64.86 63.62 1pj9 h ILE 61 Cb 0.72 2.43 -0.02 0.00 -0.74 0.00 0.00 36.82 39.21 1pj9 h ILE 61 CO 0.02 0.63 -0.63 0.78 0.00 0.00 0.00 178.15 178.96 1pj9 h ASN 62 N 0.15 0.00 -0.43 1.72 2.35 -0.64 -3.26 115.58 115.47 1pj9 h ASN 62 Ca -0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1pj9 h ASN 62 Cb 1.44 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.81 1pj9 h ASN 62 CO 0.15 0.63 0.00 -0.90 -1.65 0.00 0.00 177.43 175.66 1pj9 n ASP 63 N -3.46 2.39 0.00 5.81 5.68 0.27 -4.95 116.55 122.28 1pj9 n ASP 63 Ca 0.00 -1.98 0.00 0.00 -0.50 0.00 0.00 54.79 52.32 1pj9 n ASP 63 Cb 0.71 -0.28 0.00 0.00 -1.14 0.00 0.00 41.12 40.40 1pj9 n ASP 63 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1pj9 n GLY 64 N 1.22 0.96 0.14 6.12 0.00 -1.23 -4.96 105.19 107.44 1pj9 n GLY 64 Ca 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 1pj9 n GLY 64 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1pj9 h TYR 65 N 0.00 -0.23 0.00 1.61 3.20 -1.81 0.16 116.97 119.91 1pj9 h TYR 65 Ca 0.00 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.77 1pj9 h TYR 65 Cb 0.00 0.11 0.01 0.00 1.54 0.00 0.00 36.73 38.39 1pj9 h TYR 65 CO 0.00 -0.14 -0.45 -0.07 -1.64 0.00 0.00 178.16 175.85 1pj9 h LEU 66 N -0.13 0.39 -0.92 2.82 3.38 -1.88 -3.20 115.31 115.77 1pj9 h LEU 66 Ca 0.06 -0.78 0.01 0.00 0.09 0.00 0.00 57.88 57.26 1pj9 h LEU 66 Cb 0.21 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 1pj9 h LEU 66 CO -0.14 1.12 0.61 0.71 0.09 0.00 0.00 178.44 180.82 1pj9 h THR 67 N -0.30 1.24 0.00 0.22 1.35 -1.78 -1.10 112.91 112.55 1pj9 h THR 67 Ca -0.06 -0.45 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 1pj9 h THR 67 Cb 1.20 -0.12 0.00 0.00 -1.73 0.00 0.00 68.15 67.50 1pj9 h THR 67 CO 0.09 0.23 0.00 1.23 -0.25 0.00 0.00 175.52 176.82 1pj9 h GLY 68 N 1.26 0.00 0.81 5.82 0.00 -0.77 -2.07 103.07 108.12 1pj9 h GLY 68 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 1pj9 h GLY 68 CO -0.07 0.00 -0.94 -0.13 0.00 0.00 0.00 176.54 175.39 1pj9 n MET 69 N -2.75 0.36 -0.29 4.80 0.00 -0.45 -4.77 117.12 114.02 1pj9 n MET 69 Ca -0.00 0.04 0.00 0.00 0.00 0.00 0.00 57.70 57.74 1pj9 n MET 69 Cb 0.19 -1.66 0.00 0.00 0.00 0.00 0.00 33.22 31.75 1pj9 n MET 69 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1pj9 n GLY 70 N 1.32 0.85 3.73 -5.12 0.00 -0.78 -2.55 105.19 102.63 1pj9 n GLY 70 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1pj9 n GLY 70 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pj9 s VAL 71 N -2.02 3.44 0.00 1.61 1.01 -0.98 -4.58 120.40 118.89 1pj9 s VAL 71 Ca 0.00 1.11 0.00 0.00 0.00 0.00 0.00 61.98 63.09 1pj9 s VAL 71 Cb 0.00 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.67 1pj9 s VAL 71 CO 0.00 0.13 0.76 0.35 0.00 0.00 0.00 175.10 176.34 1pj9 n THR 72 N 3.21 0.57 -3.57 3.92 -2.24 -0.90 -4.51 114.28 110.77 1pj9 n THR 72 Ca 0.08 -0.65 -0.17 0.00 -2.27 0.00 0.00 64.05 61.04 1pj9 n THR 72 Cb 0.44 0.77 -0.06 0.00 -2.10 0.00 0.00 70.33 69.37 1pj9 n THR 72 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1pj9 s ALA 73 N -0.57 -1.69 -0.01 6.98 0.00 -1.06 -1.06 121.76 124.35 1pj9 s ALA 73 Ca 0.00 1.41 0.04 0.00 0.00 0.00 0.00 51.96 53.41 1pj9 s ALA 73 Cb 0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 1pj9 s ALA 73 CO 0.00 -0.35 -0.13 0.96 0.00 0.00 0.00 175.76 176.24 1pj9 s ILE 74 N -0.81 1.04 -0.29 0.00 -4.36 -0.17 -0.87 121.20 115.74 1pj9 s ILE 74 Ca -0.08 -0.57 -0.03 0.00 -0.26 0.00 0.00 60.65 59.71 1pj9 s ILE 74 Cb -0.02 -0.87 0.03 0.00 1.25 0.00 0.00 42.46 42.86 1pj9 s ILE 74 CO 0.07 0.29 0.00 0.86 0.24 0.00 0.00 174.94 176.41 1pj9 s TRP 75 N -0.32 3.18 0.36 1.37 -0.00 -0.59 -0.24 118.94 122.70 1pj9 s TRP 75 Ca 0.05 -1.57 0.07 0.00 -0.00 0.00 0.00 56.10 54.65 1pj9 s TRP 75 Cb -0.05 -2.13 -0.02 0.00 -0.00 0.00 0.00 33.47 31.26 1pj9 s TRP 75 CO -0.00 -0.74 0.35 0.96 -0.00 0.00 0.00 176.95 177.52 1pj9 s ILE 76 N 1.33 3.31 0.84 5.86 -4.36 -0.16 -0.29 121.20 127.74 1pj9 s ILE 76 Ca -0.02 -1.31 -0.13 0.00 -0.26 0.00 0.00 60.65 58.93 1pj9 s ILE 76 Cb -0.18 -3.14 0.08 0.00 1.25 0.00 0.00 42.46 40.46 1pj9 s ILE 76 CO -0.01 -0.12 1.00 -1.20 0.24 0.00 0.00 174.94 174.86 1pj9 n SER 77 N -1.47 0.20 -4.66 4.36 7.64 -1.22 -1.85 113.62 116.62 1pj9 n SER 77 Ca 0.00 0.52 -0.48 0.00 1.01 0.00 0.00 58.87 59.92 1pj9 n SER 77 Cb 0.60 -1.43 -0.05 0.00 -1.01 0.00 0.00 64.21 62.33 1pj9 n SER 77 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1pj9 n GLN 78 N -2.98 1.95 0.00 1.43 7.27 -1.26 -4.13 117.38 119.67 1pj9 n GLN 78 Ca 0.12 0.71 0.14 0.00 0.07 0.00 0.00 57.00 58.04 1pj9 n GLN 78 Cb 0.51 -2.48 0.59 0.00 2.41 0.00 0.00 30.24 31.28 1pj9 n GLN 78 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 1pj9 n PRO 79 N 4.28 0.03 -1.70 3.69 -0.04 -1.26 -4.80 135.00 135.20 1pj9 n PRO 79 Ca 0.19 -0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.33 1pj9 n PRO 79 Cb 0.27 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.27 1pj9 n PRO 79 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1pj9 s VAL 80 N -2.97 3.90 0.16 0.52 -7.23 -1.26 -1.09 120.40 112.42 1pj9 s VAL 80 Ca 0.15 0.71 -0.31 0.00 -1.81 0.00 0.00 61.98 60.71 1pj9 s VAL 80 Cb 0.19 -3.36 -0.11 0.00 0.56 0.00 0.00 36.38 33.67 1pj9 s VAL 80 CO 0.54 -0.72 1.77 -0.70 -0.31 0.00 0.00 175.10 175.69 1pj9 s GLU 81 N -4.71 4.14 0.45 4.82 2.12 -0.12 -3.71 118.70 121.68 1pj9 s GLU 81 Ca 0.60 2.59 0.08 0.00 0.36 0.00 0.00 54.97 58.60 1pj9 s GLU 81 Cb -0.15 -3.37 0.01 0.00 0.26 0.00 0.00 34.13 30.88 1pj9 s GLU 81 CO 0.49 -0.80 0.52 -0.80 -0.54 0.00 0.00 175.26 174.14 1pj9 s ASN 82 N 2.04 5.28 0.72 -1.70 -0.87 -1.26 -0.80 114.94 118.36 1pj9 s ASN 82 Ca 0.78 -0.66 -0.14 0.00 -1.57 0.00 0.00 52.86 51.26 1pj9 s ASN 82 Cb -0.47 -0.40 0.03 0.00 -0.02 0.00 0.00 41.25 40.39 1pj9 s ASN 82 CO 0.34 -0.84 1.16 0.27 -2.57 0.00 0.00 177.10 175.46 1pj9 s ILE 83 N -2.47 2.73 -1.93 0.60 -4.36 -0.59 -4.67 121.20 110.51 1pj9 s ILE 83 Ca 0.52 0.33 0.21 0.00 -0.26 0.00 0.00 60.65 61.45 1pj9 s ILE 83 Cb -0.06 -2.84 -0.00 0.00 1.25 0.00 0.00 42.46 40.81 1pj9 s ILE 83 CO 0.31 -0.22 1.03 -1.22 0.24 0.00 0.00 174.94 175.09 1pj9 n TYR 84 N -2.76 0.00 -1.91 1.37 4.01 -1.26 -4.63 117.16 111.98 1pj9 n TYR 84 Ca 0.12 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.47 1pj9 n TYR 84 Cb 0.51 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.56 1pj9 n TYR 84 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1pj9 s SER 85 N -2.30 5.92 -0.41 7.72 0.01 -1.26 -4.99 113.70 118.38 1pj9 s SER 85 Ca 0.17 2.76 -0.12 0.00 1.31 0.00 0.00 55.95 60.08 1pj9 s SER 85 Cb 0.17 -2.64 0.04 0.00 0.21 0.00 0.00 66.02 63.80 1pj9 s SER 85 CO 0.52 -1.13 0.26 -0.63 0.41 0.00 0.00 173.24 172.67 1pj9 s ILE 86 N -1.26 4.72 -0.07 1.44 1.01 -1.26 -4.58 121.20 121.19 1pj9 s ILE 86 Ca 0.62 -0.98 -0.22 0.00 0.00 0.00 0.00 60.65 60.07 1pj9 s ILE 86 Cb -0.40 -3.72 -0.04 0.00 0.01 0.00 0.00 42.46 38.31 1pj9 s ILE 86 CO 0.51 -0.36 0.63 -0.63 0.00 0.00 0.00 174.94 175.09 1pj9 s ILE 87 N 1.56 5.07 -0.40 2.92 1.01 0.45 -4.80 121.20 127.02 1pj9 s ILE 87 Ca 0.03 1.30 -0.16 0.00 0.00 0.00 0.00 60.65 61.82 1pj9 s ILE 87 Cb -0.21 -3.97 0.01 0.00 0.01 0.00 0.00 42.46 38.30 1pj9 s ILE 87 CO 0.06 0.28 0.36 0.21 0.00 0.00 0.00 174.94 175.85 1pj9 s ASN 88 N 0.67 6.15 -0.44 3.58 3.84 -1.26 0.68 114.94 128.16 1pj9 s ASN 88 Ca 0.34 -0.70 -0.07 0.00 0.21 0.00 0.00 52.86 52.63 1pj9 s ASN 88 Cb -0.17 -2.19 0.11 0.00 -0.55 0.00 0.00 41.25 38.45 1pj9 s ASN 88 CO 0.16 -0.48 0.29 -0.31 -2.79 0.00 0.00 177.10 173.97 1pj9 s TYR 89 N 1.90 3.46 -1.28 0.43 2.02 0.22 -4.67 117.35 119.43 1pj9 s TYR 89 Ca 0.09 -1.97 -0.01 0.00 -0.37 0.00 0.00 57.07 54.80 1pj9 s TYR 89 Cb -0.18 -3.32 -0.00 0.00 -0.40 0.00 0.00 41.96 38.06 1pj9 s TYR 89 CO 0.12 -0.96 0.72 0.43 -1.57 0.00 0.00 175.55 174.28 1pj9 n SER 90 N 4.82 -1.59 0.00 2.29 7.64 -1.26 -2.30 113.62 123.22 1pj9 n SER 90 Ca -0.07 -0.82 0.00 0.00 1.01 0.00 0.00 58.87 58.99 1pj9 n SER 90 Cb 0.41 -4.09 0.00 0.00 -1.01 0.00 0.00 64.21 59.52 1pj9 n SER 90 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1pj9 n GLY 91 N -1.55 0.65 3.10 0.23 0.00 -1.26 -5.03 105.19 101.33 1pj9 n GLY 91 Ca -0.28 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 1pj9 n GLY 91 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pj9 s VAL 92 N -2.53 1.81 0.30 1.61 1.01 -0.97 -5.11 120.40 116.52 1pj9 s VAL 92 Ca 0.00 -0.81 -0.28 0.00 0.00 0.00 0.00 61.98 60.88 1pj9 s VAL 92 Cb 0.00 -1.63 -0.09 0.00 0.00 0.00 0.00 36.38 34.66 1pj9 s VAL 92 CO 0.00 0.50 1.06 0.20 0.00 0.00 0.00 175.10 176.86 1pj9 s ASN 93 N 1.03 7.21 0.00 3.32 0.01 -1.26 -0.61 114.94 124.64 1pj9 s ASN 93 Ca -0.04 2.16 0.02 0.00 -0.71 0.00 0.00 52.86 54.29 1pj9 s ASN 93 Cb -0.15 -2.61 -0.01 0.00 0.41 0.00 0.00 41.25 38.89 1pj9 s ASN 93 CO -0.04 -0.18 -0.06 0.20 -1.51 0.00 0.00 177.10 175.51 1pj9 s ASN 94 N -1.10 0.68 0.44 -1.22 0.01 0.21 -4.74 114.94 109.24 1pj9 s ASN 94 Ca 0.47 -0.14 0.04 0.00 -0.71 0.00 0.00 52.86 52.52 1pj9 s ASN 94 Cb -0.29 -0.06 -0.05 0.00 0.41 0.00 0.00 41.25 41.26 1pj9 s ASN 94 CO 0.36 0.04 0.02 0.42 -1.51 0.00 0.00 177.10 176.44 1pj9 s THR 95 N -0.25 1.49 -0.32 1.60 -4.23 -0.66 -0.41 115.64 112.87 1pj9 s THR 95 Ca 0.01 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.54 1pj9 s THR 95 Cb -0.03 -2.60 0.38 0.00 1.34 0.00 0.00 72.50 71.59 1pj9 s THR 95 CO -0.00 0.00 1.70 0.00 -0.54 0.00 0.00 174.62 175.78 1pj9 n ALA 96 N -1.06 4.72 0.06 3.99 0.00 -1.26 -4.55 120.51 122.42 1pj9 n ALA 96 Ca -0.11 -1.91 0.19 0.00 0.00 0.00 0.00 53.44 51.61 1pj9 n ALA 96 Cb 0.67 -1.34 0.72 0.00 0.00 0.00 0.00 19.45 19.50 1pj9 n ALA 96 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 1pj9 h TYR 97 N 0.90 0.00 0.00 0.00 -0.00 -1.90 0.03 116.97 116.00 1pj9 h TYR 97 Ca 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 59.13 1pj9 h TYR 97 Cb 1.82 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.55 1pj9 h TYR 97 CO 1.00 0.00 0.00 1.12 -0.00 0.00 0.00 178.16 180.28 1pj9 h HIS 98 N 0.00 0.00 0.00 0.10 2.07 -1.97 -3.41 115.15 111.94 1pj9 h HIS 98 Ca 0.20 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.72 1pj9 h HIS 98 Cb 0.89 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.87 1pj9 h HIS 98 CO 0.00 0.00 0.00 0.41 -3.07 0.00 0.00 177.93 175.27 1pj9 n GLY 99 N 0.49 0.69 0.61 6.13 0.00 -0.00 -4.55 105.19 108.56 1pj9 n GLY 99 Ca 0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.16 1pj9 n GLY 99 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1pj9 n TYR 100 N -2.61 0.18 -3.44 1.61 4.01 -1.26 -4.45 117.16 111.20 1pj9 n TYR 100 Ca 0.00 -0.09 -0.35 0.00 -0.16 0.00 0.00 57.90 57.31 1pj9 n TYR 100 Cb 0.00 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 38.98 1pj9 n TYR 100 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 1pj9 n TRP 101 N 0.45 3.59 -2.27 -0.72 8.01 -1.26 -4.82 117.44 120.41 1pj9 n TRP 101 Ca 0.17 -3.80 -0.37 0.00 -1.31 0.00 0.00 57.50 52.19 1pj9 n TRP 101 Cb 0.38 -0.98 -0.01 0.00 -2.01 0.00 0.00 31.31 28.69 1pj9 n TRP 101 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1pj9 s ALA 102 N -2.03 2.95 0.00 6.99 0.00 -0.41 -1.54 121.76 127.72 1pj9 s ALA 102 Ca 0.32 0.91 0.00 0.00 0.00 0.00 0.00 51.96 53.19 1pj9 s ALA 102 Cb 0.02 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.77 1pj9 s ALA 102 CO -0.04 -0.64 0.00 2.89 0.00 0.00 0.00 175.76 177.96 1pj9 n ARG 103 N -0.55 2.31 -3.36 0.00 1.85 0.02 -3.87 116.66 113.06 1pj9 n ARG 103 Ca 0.08 0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.81 1pj9 n ARG 103 Cb 0.48 -0.83 -0.08 0.00 -1.05 0.00 0.00 32.46 30.98 1pj9 n ARG 103 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1pj9 s ASP 104 N -1.77 0.62 0.00 2.89 -1.08 -1.08 0.64 116.67 116.89 1pj9 s ASP 104 Ca 0.00 -0.11 0.22 0.00 -0.52 0.00 0.00 52.55 52.14 1pj9 s ASP 104 Cb 0.00 0.94 1.20 0.00 -1.46 0.00 0.00 42.92 43.60 1pj9 s ASP 104 CO 0.00 -0.33 1.72 0.49 0.52 0.00 0.00 175.17 177.57 1pj9 n PHE 105 N 5.35 0.00 -0.01 -5.34 3.01 -1.26 -2.63 117.46 116.58 1pj9 n PHE 105 Ca -0.03 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.52 1pj9 n PHE 105 Cb 0.49 -0.19 0.19 0.00 -0.01 0.00 0.00 39.48 39.97 1pj9 n PHE 105 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1pj9 n LYS 106 N -1.19 2.43 -4.36 -1.08 5.02 -1.26 -4.88 118.16 112.84 1pj9 n LYS 106 Ca 0.13 -2.13 -0.19 0.00 -2.02 0.00 0.00 58.31 54.10 1pj9 n LYS 106 Cb 0.14 -1.39 -0.10 0.00 -0.02 0.00 0.00 35.03 33.66 1pj9 n LYS 106 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1pj9 s LYS 107 N -1.11 1.40 0.50 1.97 1.02 -1.15 -4.84 119.74 117.53 1pj9 s LYS 107 Ca 0.31 -1.69 -0.02 0.00 0.02 0.00 0.00 55.97 54.59 1pj9 s LYS 107 Cb 0.17 -0.88 -0.00 0.00 -0.52 0.00 0.00 37.83 36.60 1pj9 s LYS 107 CO 0.23 -0.00 0.75 0.95 -0.92 0.00 0.00 175.35 176.36 1pj9 s THR 108 N -3.21 3.95 -0.48 2.17 -4.23 -1.26 -0.95 115.64 111.63 1pj9 s THR 108 Ca 0.27 -0.29 -0.24 0.00 -1.18 0.00 0.00 61.69 60.25 1pj9 s THR 108 Cb 0.04 -3.50 0.03 0.00 1.34 0.00 0.00 72.50 70.42 1pj9 s THR 108 CO 0.09 -0.41 0.88 0.21 -0.54 0.00 0.00 174.62 174.85 1pj9 s ASN 109 N -4.24 6.42 0.60 3.99 3.84 -0.25 -3.28 114.94 122.01 1pj9 s ASN 109 Ca 0.50 -0.12 0.28 0.00 0.21 0.00 0.00 52.86 53.74 1pj9 s ASN 109 Cb -0.10 -2.42 1.44 0.00 -0.55 0.00 0.00 41.25 39.61 1pj9 s ASN 109 CO 0.41 -1.05 1.84 1.55 -2.79 0.00 0.00 177.10 177.06 1pj9 h PRO 110 N 9.11 0.00 -0.36 0.43 0.13 -1.92 0.13 132.00 139.53 1pj9 h PRO 110 Ca -0.25 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.79 1pj9 h PRO 110 Cb 1.08 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.19 1pj9 h PRO 110 CO 1.02 0.00 -0.16 0.00 -0.23 0.00 0.00 178.00 178.63 1pj9 h ALA 111 N 1.36 1.05 0.18 -0.56 0.00 -1.92 -2.97 119.26 116.40 1pj9 h ALA 111 Ca 0.21 -0.32 -0.30 0.00 0.00 0.00 0.00 54.91 54.49 1pj9 h ALA 111 Cb 1.25 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 18.91 1pj9 h ALA 111 CO -0.00 0.58 -1.34 1.88 0.00 0.00 0.00 179.25 180.36 1pj9 h TYR 112 N 0.59 0.70 0.00 0.00 0.05 -1.05 -3.43 116.97 113.82 1pj9 h TYR 112 Ca 0.10 -0.51 0.00 0.00 0.05 0.00 0.00 58.73 58.36 1pj9 h TYR 112 Cb 0.61 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.32 1pj9 h TYR 112 CO 0.03 1.40 0.00 0.41 -1.05 0.00 0.00 178.16 178.95 1pj9 n GLY 113 N 1.60 -1.00 4.00 3.88 0.00 -0.80 -1.38 105.19 111.49 1pj9 n GLY 113 Ca -0.12 -1.54 -0.22 0.00 0.00 0.00 0.00 46.02 44.14 1pj9 n GLY 113 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pj9 s THR 114 N -2.02 2.27 0.22 2.61 -4.23 -1.26 -4.03 115.64 109.20 1pj9 s THR 114 Ca 0.00 -0.70 -0.08 0.00 -1.18 0.00 0.00 61.69 59.73 1pj9 s THR 114 Cb 0.00 -2.56 0.18 0.00 1.34 0.00 0.00 72.50 71.46 1pj9 s THR 114 CO 0.00 0.00 1.87 0.40 -0.54 0.00 0.00 174.62 176.35 1pj9 h ILE 115 N -0.24 1.13 -0.58 2.99 1.08 -1.98 -1.25 117.51 118.67 1pj9 h ILE 115 Ca -0.36 -0.35 0.01 0.00 -0.39 0.00 0.00 64.86 63.77 1pj9 h ILE 115 Cb 1.28 0.03 -0.03 0.00 -3.07 0.00 0.00 36.82 35.03 1pj9 h ILE 115 CO 0.43 0.19 0.37 0.00 -0.69 0.00 0.00 178.15 178.45 1pj9 h ALA 116 N 1.33 0.73 -0.91 1.87 0.00 -1.99 -0.83 119.26 119.47 1pj9 h ALA 116 Ca 0.32 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.23 1pj9 h ALA 116 Cb -0.01 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.51 1pj9 h ALA 116 CO -0.11 0.14 0.59 -0.44 0.00 0.00 0.00 179.25 179.44 1pj9 h ASP 117 N 0.76 0.98 -0.65 0.00 3.32 -1.70 -0.62 116.42 118.50 1pj9 h ASP 117 Ca 0.22 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.23 1pj9 h ASP 117 Cb -0.06 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.24 1pj9 h ASP 117 CO -0.06 0.67 0.28 0.15 -1.72 0.00 0.00 179.24 178.57 1pj9 h PHE 118 N 1.14 0.97 -0.68 4.55 3.57 -0.38 -0.01 116.94 126.09 1pj9 h PHE 118 Ca 0.36 -0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.76 1pj9 h PHE 118 Cb 0.01 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 38.43 1pj9 h PHE 118 CO -0.01 0.74 0.26 1.96 -2.23 0.00 0.00 178.31 179.03 1pj9 h GLN 119 N 0.91 1.01 -0.12 1.11 4.20 -0.49 -0.86 115.11 120.86 1pj9 h GLN 119 Ca 0.22 -0.18 -0.11 0.00 0.06 0.00 0.00 58.65 58.65 1pj9 h GLN 119 Cb 0.17 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 1pj9 h GLN 119 CO -0.02 0.84 -0.39 -0.91 -0.67 0.00 0.00 178.83 177.67 1pj9 h ASN 120 N 0.99 0.28 -0.14 1.46 2.35 -0.60 -1.32 115.58 118.61 1pj9 h ASN 120 Ca 0.23 -0.11 -0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1pj9 h ASN 120 Cb 0.21 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.50 1pj9 h ASN 120 CO -0.02 0.65 -0.03 0.25 -1.65 0.00 0.00 177.43 176.63 1pj9 h LEU 121 N 0.23 0.26 -0.64 1.61 5.85 -0.30 0.24 115.31 122.56 1pj9 h LEU 121 Ca 0.02 -0.36 0.04 0.00 0.84 0.00 0.00 57.88 58.42 1pj9 h LEU 121 Cb 0.80 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.71 1pj9 h LEU 121 CO 0.06 0.56 0.39 0.40 -0.34 0.00 0.00 178.44 179.51 1pj9 h ILE 122 N -0.04 1.04 -0.07 4.05 1.08 -1.05 -0.60 117.51 121.92 1pj9 h ILE 122 Ca 0.03 -0.25 -0.00 0.00 -0.39 0.00 0.00 64.86 64.25 1pj9 h ILE 122 Cb 0.45 0.24 -0.00 0.00 -3.07 0.00 0.00 36.82 34.43 1pj9 h ILE 122 CO 0.01 0.14 0.03 0.00 -0.69 0.00 0.00 178.15 177.64 1pj9 h ALA 123 N 1.30 0.09 -0.59 1.87 0.00 -1.10 -1.67 119.26 119.15 1pj9 h ALA 123 Ca 0.27 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 1pj9 h ALA 123 Cb 0.07 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1pj9 h ALA 123 CO -0.13 -0.33 0.20 0.00 0.00 0.00 0.00 179.25 179.00 1pj9 h ALA 124 N 0.87 0.77 0.04 0.00 0.00 -0.71 -1.07 119.26 119.17 1pj9 h ALA 124 Ca 0.02 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1pj9 h ALA 124 Cb 0.16 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1pj9 h ALA 124 CO -0.00 0.42 -0.02 0.00 0.00 0.00 0.00 179.25 179.65 1pj9 h ALA 125 N 1.06 -0.06 -0.70 0.00 0.00 -1.08 -2.81 119.26 115.69 1pj9 h ALA 125 Ca 0.19 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1pj9 h ALA 125 Cb 0.26 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1pj9 h ALA 125 CO -0.01 -0.47 0.39 0.45 0.00 0.00 0.00 179.25 179.61 1pj9 h HIS 126 N -0.18 0.93 0.00 0.00 3.86 -1.19 0.16 115.15 118.72 1pj9 h HIS 126 Ca -0.01 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.19 1pj9 h HIS 126 Cb 0.16 -0.30 -0.00 0.00 1.06 0.00 0.00 27.41 28.33 1pj9 h HIS 126 CO -0.03 0.64 -0.04 0.00 0.86 0.00 0.00 177.93 179.36 1pj9 h ALA 127 N 1.47 1.62 -0.48 2.45 0.00 -1.02 -0.72 119.26 122.58 1pj9 h ALA 127 Ca 0.25 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1pj9 h ALA 127 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1pj9 h ALA 127 CO -0.04 0.05 0.00 1.63 0.00 0.00 0.00 179.25 180.88 1pj9 n LYS 128 N -4.03 4.19 -2.87 0.00 4.76 -0.50 -4.95 118.16 114.78 1pj9 n LYS 128 Ca -0.03 -3.04 -0.22 0.00 -2.87 0.00 0.00 58.31 52.15 1pj9 n LYS 128 Cb 0.12 -2.10 0.02 0.00 -1.84 0.00 0.00 35.03 31.24 1pj9 n LYS 128 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1pj9 n ASN 129 N 0.31 -6.12 -4.40 4.39 3.02 -0.28 -4.99 115.26 107.18 1pj9 n ASN 129 Ca 0.26 -0.22 -0.34 0.00 -0.03 0.00 0.00 54.58 54.24 1pj9 n ASN 129 Cb 1.08 -4.98 -0.13 0.00 -0.61 0.00 0.00 39.78 35.13 1pj9 n ASN 129 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1pj9 s ILE 130 N -3.15 3.48 0.43 2.41 1.01 0.44 -4.76 121.20 121.05 1pj9 s ILE 130 Ca 0.23 -0.49 -0.14 0.00 0.00 0.00 0.00 60.65 60.25 1pj9 s ILE 130 Cb -0.10 -2.53 -0.08 0.00 0.01 0.00 0.00 42.46 39.77 1pj9 s ILE 130 CO 0.28 0.48 0.84 -0.54 0.00 0.00 0.00 174.94 176.01 1pj9 s LYS 131 N 0.70 3.91 -0.17 2.79 1.02 -0.23 -3.16 119.74 124.59 1pj9 s LYS 131 Ca -0.03 0.70 0.01 0.00 0.02 0.00 0.00 55.97 56.67 1pj9 s LYS 131 Cb -0.15 -2.30 0.01 0.00 -0.52 0.00 0.00 37.83 34.87 1pj9 s LYS 131 CO 0.02 -0.07 -0.19 0.08 -0.92 0.00 0.00 175.35 174.27 1pj9 s VAL 132 N -2.36 2.24 -0.13 3.17 1.01 -1.26 -1.00 120.40 122.06 1pj9 s VAL 132 Ca 0.55 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.62 1pj9 s VAL 132 Cb -0.10 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 34.32 1pj9 s VAL 132 CO 0.27 0.53 -0.08 -0.63 0.00 0.00 0.00 175.10 175.19 1pj9 s ILE 133 N 1.16 3.52 -0.01 2.22 1.01 0.66 -0.34 121.20 129.43 1pj9 s ILE 133 Ca 0.01 -0.50 0.01 0.00 0.00 0.00 0.00 60.65 60.18 1pj9 s ILE 133 Cb -0.14 -2.51 -0.04 0.00 0.01 0.00 0.00 42.46 39.79 1pj9 s ILE 133 CO -0.08 0.52 -0.01 0.27 0.00 0.00 0.00 174.94 175.64 1pj9 s ILE 134 N 0.22 4.11 0.47 2.92 -4.36 -1.02 -0.99 121.20 122.55 1pj9 s ILE 134 Ca -0.05 -0.59 -0.21 0.00 -0.26 0.00 0.00 60.65 59.55 1pj9 s ILE 134 Cb -0.14 -2.82 -0.09 0.00 1.25 0.00 0.00 42.46 40.66 1pj9 s ILE 134 CO 0.04 0.40 1.03 -0.62 0.24 0.00 0.00 174.94 176.02 1pj9 s ASP 135 N -1.48 6.46 -0.13 4.36 -1.08 -0.77 -1.27 116.67 122.77 1pj9 s ASP 135 Ca 0.19 1.90 -0.05 0.00 -0.52 0.00 0.00 52.55 54.07 1pj9 s ASP 135 Cb -0.11 -2.56 0.06 0.00 -1.46 0.00 0.00 42.92 38.85 1pj9 s ASP 135 CO 0.09 -0.70 0.27 0.12 0.52 0.00 0.00 175.17 175.47 1pj9 s PHE 136 N -1.99 -0.42 -0.70 -5.34 5.36 -0.22 -4.01 117.98 110.64 1pj9 s PHE 136 Ca 0.66 0.97 0.05 0.00 -0.96 0.00 0.00 56.93 57.65 1pj9 s PHE 136 Cb -0.16 -0.02 0.19 0.00 -0.34 0.00 0.00 43.02 42.70 1pj9 s PHE 136 CO 0.19 -0.34 0.56 0.00 -1.46 0.00 0.00 175.22 174.17 1pj9 n ALA 137 N 5.21 3.58 1.70 11.12 0.00 -1.26 -1.08 120.51 139.78 1pj9 n ALA 137 Ca -0.09 -4.59 0.01 0.00 0.00 0.00 0.00 53.44 48.78 1pj9 n ALA 137 Cb 0.50 -1.03 0.04 0.00 0.00 0.00 0.00 19.45 18.96 1pj9 n ALA 137 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1pj9 n PRO 138 N 1.74 1.21 0.09 0.00 -0.04 -1.26 -3.81 135.00 132.92 1pj9 n PRO 138 Ca 0.22 -0.32 -0.06 0.00 -0.04 0.00 0.00 63.50 63.30 1pj9 n PRO 138 Cb 0.36 -1.08 -0.02 0.00 -0.04 0.00 0.00 33.50 32.73 1pj9 n PRO 138 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 1pj9 h ASN 139 N 0.52 0.05 -5.19 3.54 -1.24 -1.91 -3.44 115.58 107.89 1pj9 h ASN 139 Ca 0.00 -0.04 -0.08 0.00 0.71 0.00 0.00 56.30 56.89 1pj9 h ASN 139 Cb 0.13 -0.01 -0.05 0.00 0.73 0.00 0.00 38.32 39.11 1pj9 h ASN 139 CO 0.00 0.90 0.06 -1.38 -1.29 0.00 0.00 177.43 175.71 1pj9 s HIS 140 N -3.05 0.37 0.00 0.67 -3.43 -1.25 -1.39 115.29 107.22 1pj9 s HIS 140 Ca -0.00 -0.83 0.00 0.00 -0.80 0.00 0.00 55.06 53.43 1pj9 s HIS 140 Cb 0.11 0.43 0.00 0.00 -1.43 0.00 0.00 32.58 31.69 1pj9 s HIS 140 CO 0.81 -1.28 0.00 0.25 -2.00 0.00 0.00 174.74 172.52 1pj9 n THR 141 N -0.50 0.00 -4.02 -5.38 -2.24 -1.02 -4.64 114.28 96.48 1pj9 n THR 141 Ca -0.04 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.63 1pj9 n THR 141 Cb 0.61 -0.72 -0.04 0.00 -2.10 0.00 0.00 70.33 68.08 1pj9 n THR 141 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1pj9 s SER 142 N -0.69 0.41 0.27 3.42 1.04 -1.25 -1.28 113.70 115.60 1pj9 s SER 142 Ca 0.00 -1.23 -0.31 0.00 0.48 0.00 0.00 55.95 54.89 1pj9 s SER 142 Cb 0.00 0.65 -0.13 0.00 0.10 0.00 0.00 66.02 66.64 1pj9 s SER 142 CO 0.00 -1.28 1.48 -2.65 0.98 0.00 0.00 173.24 171.77 1pj9 n PRO 143 N -0.48 2.31 -3.86 4.02 -0.02 -1.26 -1.59 135.00 134.11 1pj9 n PRO 143 Ca -0.01 0.82 -0.09 0.00 -2.02 0.00 0.00 63.50 62.20 1pj9 n PRO 143 Cb 0.62 -2.53 -0.08 0.00 -0.02 0.00 0.00 33.50 31.49 1pj9 n PRO 143 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pj9 s ALA 144 N -0.11 -0.25 -0.16 3.55 0.00 0.14 -3.60 121.76 121.34 1pj9 s ALA 144 Ca 0.66 -0.49 -0.01 0.00 0.00 0.00 0.00 51.96 52.11 1pj9 s ALA 144 Cb -0.58 0.38 0.04 0.00 0.00 0.00 0.00 23.12 22.97 1pj9 s ALA 144 CO 0.50 -0.44 -0.03 0.45 0.00 0.00 0.00 175.76 176.24 1pj9 s SER 145 N -2.51 2.72 0.24 0.00 0.15 -1.26 -4.81 113.70 108.23 1pj9 s SER 145 Ca 0.00 -0.63 -0.05 0.00 0.70 0.00 0.00 55.95 55.97 1pj9 s SER 145 Cb 0.02 -0.81 0.35 0.00 -1.71 0.00 0.00 66.02 63.88 1pj9 s SER 145 CO -0.08 -0.21 1.84 -1.28 1.20 0.00 0.00 173.24 174.71 1pj9 h SER 146 N 8.16 0.77 -0.61 5.45 0.87 -1.98 -2.52 113.55 123.70 1pj9 h SER 146 Ca -0.22 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.37 1pj9 h SER 146 Cb 1.11 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 1pj9 h SER 146 CO 0.37 0.48 0.00 -0.90 -0.53 0.00 0.00 176.83 176.25 1pj9 n ASP 147 N -4.67 4.62 -3.01 6.23 5.75 -1.26 -4.50 116.55 119.71 1pj9 n ASP 147 Ca 0.13 -2.46 -0.16 0.00 -0.01 0.00 0.00 54.79 52.28 1pj9 n ASP 147 Cb 0.21 -0.56 -0.01 0.00 -1.03 0.00 0.00 41.12 39.74 1pj9 n ASP 147 CO 0.00 0.00 0.00 1.67 -0.11 0.00 0.00 177.20 178.76 1pj9 n GLN 148 N 0.99 0.84 0.21 0.11 7.27 -0.95 -4.99 117.38 120.85 1pj9 n GLN 148 Ca 0.25 -2.71 0.09 0.00 0.07 0.00 0.00 57.00 54.70 1pj9 n GLN 148 Cb 0.87 -1.37 0.49 0.00 2.41 0.00 0.00 30.24 32.64 1pj9 n GLN 148 CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 1pj9 h PRO 149 N 3.59 0.00 0.00 3.69 0.13 -1.78 0.33 132.00 137.97 1pj9 h PRO 149 Ca -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1pj9 h PRO 149 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.10 1pj9 h PRO 149 CO 0.39 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.03 1pj9 n SER 150 N -2.28 0.21 -4.70 1.44 3.41 -1.26 -4.19 113.62 106.24 1pj9 n SER 150 Ca -0.01 0.53 -0.42 0.00 -0.26 0.00 0.00 58.87 58.71 1pj9 n SER 150 Cb 0.32 -0.58 -0.03 0.00 -0.26 0.00 0.00 64.21 63.67 1pj9 n SER 150 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1pj9 s PHE 151 N -3.05 3.26 0.00 7.33 5.36 0.11 -4.81 117.98 126.18 1pj9 s PHE 151 Ca 0.11 1.18 0.00 0.00 -0.96 0.00 0.00 56.93 57.26 1pj9 s PHE 151 Cb 0.15 -3.48 0.00 0.00 -0.34 0.00 0.00 43.02 39.35 1pj9 s PHE 151 CO 0.46 -1.54 0.00 0.00 -1.46 0.00 0.00 175.22 172.68 1pj9 n ALA 152 N 4.52 0.00 -1.30 11.12 0.00 -1.26 -1.78 120.51 131.81 1pj9 n ALA 152 Ca 0.10 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.57 1pj9 n ALA 152 Cb 0.46 0.00 0.21 0.00 0.00 0.00 0.00 19.45 20.11 1pj9 n ALA 152 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1pj9 n GLU 153 N 14.00 1.97 -2.21 0.00 1.02 -1.26 -4.95 120.64 129.21 1pj9 n GLU 153 Ca 0.00 -3.03 -0.16 0.00 -0.02 0.00 0.00 57.16 53.95 1pj9 n GLU 153 Cb 0.00 -1.74 -0.02 0.00 -0.02 0.00 0.00 31.44 29.66 1pj9 n GLU 153 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1pj9 n ASN 154 N -1.03 -4.67 -1.68 1.62 4.05 -0.73 -1.16 115.26 111.65 1pj9 n ASN 154 Ca 0.25 0.17 -0.21 0.00 0.45 0.00 0.00 54.58 55.24 1pj9 n ASN 154 Cb 0.89 -3.99 -0.08 0.00 1.23 0.00 0.00 39.78 37.82 1pj9 n ASN 154 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1pj9 n GLY 155 N -0.76 1.73 3.68 8.20 0.00 -1.24 -0.49 105.19 116.31 1pj9 n GLY 155 Ca -0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.40 1pj9 n GLY 155 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pj9 n ARG 156 N -2.44 2.08 -4.70 1.61 1.74 -0.31 -4.55 116.66 110.10 1pj9 n ARG 156 Ca -0.21 0.74 -0.33 0.00 -0.77 0.00 0.00 57.85 57.28 1pj9 n ARG 156 Cb 0.68 -2.38 -0.14 0.00 -1.02 0.00 0.00 32.46 29.61 1pj9 n ARG 156 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1pj9 s LEU 157 N -0.21 2.85 0.15 0.55 2.96 -0.38 -4.59 118.68 120.01 1pj9 s LEU 157 Ca 0.64 -0.27 0.09 0.00 -0.22 0.00 0.00 54.13 54.38 1pj9 s LEU 157 Cb -0.62 -1.65 -0.04 0.00 0.50 0.00 0.00 46.19 44.38 1pj9 s LEU 157 CO 0.53 0.18 -0.17 -0.31 -1.32 0.00 0.00 176.35 175.26 1pj9 s TYR 158 N 0.25 2.51 -0.53 5.38 1.51 0.21 -0.42 117.35 126.26 1pj9 s TYR 158 Ca -0.08 -0.27 -0.00 0.00 -1.01 0.00 0.00 57.07 55.71 1pj9 s TYR 158 Cb -0.15 -1.29 0.14 0.00 -0.11 0.00 0.00 41.96 40.55 1pj9 s TYR 158 CO 0.05 0.44 0.31 0.34 -1.11 0.00 0.00 175.55 175.57 1pj9 s ASP 159 N -2.41 4.94 -1.38 2.29 2.15 0.15 -4.24 116.67 118.17 1pj9 s ASP 159 Ca 0.20 -2.68 -0.01 0.00 0.43 0.00 0.00 52.55 50.49 1pj9 s ASP 159 Cb -0.10 -1.77 0.01 0.00 -0.30 0.00 0.00 42.92 40.76 1pj9 s ASP 159 CO 0.11 -0.36 0.55 -3.20 -0.17 0.00 0.00 175.17 172.10 1pj9 n ASN 160 N 3.66 -0.84 0.00 -0.34 5.15 -1.26 -1.99 115.26 119.64 1pj9 n ASN 160 Ca 0.05 -0.93 0.00 0.00 -0.60 0.00 0.00 54.58 53.10 1pj9 n ASN 160 Cb 0.37 -3.45 0.00 0.00 -0.53 0.00 0.00 39.78 36.17 1pj9 n ASN 160 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1pj9 n GLY 161 N -1.81 3.00 3.65 8.20 0.00 -1.26 -5.04 105.19 111.94 1pj9 n GLY 161 Ca -0.29 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 1pj9 n GLY 161 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pj9 s THR 162 N -2.83 4.83 0.12 2.61 2.01 -0.84 -5.01 115.64 116.53 1pj9 s THR 162 Ca 0.00 1.60 -0.31 0.00 0.31 0.00 0.00 61.69 63.29 1pj9 s THR 162 Cb 0.00 -4.13 -0.09 0.00 0.01 0.00 0.00 72.50 68.29 1pj9 s THR 162 CO 0.00 -0.06 1.59 -0.22 -0.69 0.00 0.00 174.62 175.24 1pj9 s LEU 163 N 2.76 4.37 -0.19 4.42 2.96 -1.26 0.33 118.68 132.07 1pj9 s LEU 163 Ca 0.36 2.54 -0.07 0.00 -0.22 0.00 0.00 54.13 56.74 1pj9 s LEU 163 Cb -0.15 -3.58 -0.21 0.00 0.50 0.00 0.00 46.19 42.74 1pj9 s LEU 163 CO 0.08 -0.84 0.11 0.18 -1.32 0.00 0.00 176.35 174.55 1pj9 n LEU 164 N 4.64 2.54 0.00 -0.68 4.77 0.44 -4.89 117.00 123.82 1pj9 n LEU 164 Ca 0.15 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 1pj9 n LEU 164 Cb 0.40 -1.01 0.00 0.00 -2.33 0.00 0.00 43.42 40.48 1pj9 n LEU 164 CO 0.62 0.76 0.00 0.61 -1.33 0.00 0.00 177.39 178.05 1pj9 n GLY 165 N 1.90 1.51 3.70 -0.72 0.00 -1.20 -5.02 105.19 105.37 1pj9 n GLY 165 Ca -0.38 -1.01 -0.31 0.00 0.00 0.00 0.00 46.02 44.32 1pj9 n GLY 165 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pj9 s GLY 166 N 0.00 2.95 0.24 -0.02 0.00 -1.26 -1.25 107.32 107.97 1pj9 s GLY 166 Ca 0.00 -0.53 0.03 0.00 0.00 0.00 0.00 44.72 44.22 1pj9 s GLY 166 CO 0.00 -2.09 1.59 -1.82 0.00 0.00 0.00 173.10 170.77 1pj9 h TYR 167 N 1.45 0.40 -3.60 1.90 3.20 -1.03 -3.37 116.97 115.93 1pj9 h TYR 167 Ca -0.41 -0.14 -0.51 0.00 3.14 0.00 0.00 58.73 60.81 1pj9 h TYR 167 Cb 1.31 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 39.47 1pj9 h TYR 167 CO 1.59 0.79 0.24 0.99 -1.64 0.00 0.00 178.16 180.12 1pj9 s THR 168 N -3.93 4.27 -1.43 1.81 2.01 -1.26 -3.76 115.64 113.34 1pj9 s THR 168 Ca -0.05 1.83 -0.10 0.00 0.31 0.00 0.00 61.69 63.69 1pj9 s THR 168 Cb 0.12 -4.20 0.05 0.00 0.01 0.00 0.00 72.50 68.48 1pj9 s THR 168 CO 0.80 0.51 1.00 -3.20 -0.69 0.00 0.00 174.62 173.05 1pj9 n ASN 169 N 1.58 -4.57 -3.95 3.53 5.15 -1.26 -4.84 115.26 110.89 1pj9 n ASN 169 Ca -0.04 -0.71 -0.42 0.00 -0.60 0.00 0.00 54.58 52.81 1pj9 n ASN 169 Cb 0.48 -4.30 -0.01 0.00 -0.53 0.00 0.00 39.78 35.42 1pj9 n ASN 169 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1pj9 n ASP 170 N -2.94 3.93 0.26 1.20 2.03 -1.25 -4.70 116.55 115.08 1pj9 n ASP 170 Ca -0.04 -2.83 0.17 0.00 0.52 0.00 0.00 54.79 52.61 1pj9 n ASP 170 Cb 0.57 -1.62 0.68 0.00 -0.72 0.00 0.00 41.12 40.02 1pj9 n ASP 170 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1pj9 h THR 171 N 4.51 0.00 0.00 5.18 1.35 -1.91 -2.56 112.91 119.49 1pj9 h THR 171 Ca 0.51 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.93 1pj9 h THR 171 Cb 0.71 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 68.52 1pj9 h THR 171 CO 1.77 0.00 -0.42 1.56 -0.25 0.00 0.00 175.52 178.18 1pj9 h GLN 172 N 0.00 0.00 -4.42 4.72 4.20 -1.97 -3.48 115.11 114.16 1pj9 h GLN 172 Ca 0.00 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.46 1pj9 h GLN 172 Cb 0.46 0.00 0.11 0.00 0.30 0.00 0.00 27.48 28.35 1pj9 h GLN 172 CO 0.00 0.00 -0.50 0.09 -0.67 0.00 0.00 178.83 177.75 1pj9 n ASN 173 N -2.33 -3.41 0.18 1.46 5.03 -0.97 -4.91 115.26 110.31 1pj9 n ASN 173 Ca 0.04 -0.40 0.06 0.00 0.87 0.00 0.00 54.58 55.15 1pj9 n ASN 173 Cb 0.46 -3.64 0.26 0.00 -1.02 0.00 0.00 39.78 35.84 1pj9 n ASN 173 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 1pj9 h LEU 174 N -1.56 0.00 -9.45 3.41 3.38 -1.91 -3.44 115.31 105.74 1pj9 h LEU 174 Ca -0.40 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 56.99 1pj9 h LEU 174 Cb 1.24 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.86 1pj9 h LEU 174 CO 0.36 0.37 -0.64 -0.36 0.09 0.00 0.00 178.44 178.26 1pj9 s PHE 175 N -3.39 2.32 0.14 1.13 0.40 -1.26 -0.25 117.98 117.06 1pj9 s PHE 175 Ca 0.02 -0.66 -0.17 0.00 -0.60 0.00 0.00 56.93 55.52 1pj9 s PHE 175 Cb 0.09 -1.48 -0.07 0.00 0.51 0.00 0.00 43.02 42.07 1pj9 s PHE 175 CO 0.69 0.41 0.60 -1.01 0.70 0.00 0.00 175.22 176.61 1pj9 s HIS 176 N -2.80 3.69 -0.46 0.36 3.76 0.91 -4.70 115.29 116.05 1pj9 s HIS 176 Ca 0.34 1.21 0.08 0.00 -0.15 0.00 0.00 55.06 56.54 1pj9 s HIS 176 Cb 0.06 -2.47 0.38 0.00 1.11 0.00 0.00 32.58 31.66 1pj9 s HIS 176 CO 0.16 0.47 0.95 0.72 -0.85 0.00 0.00 174.74 176.19 1pj9 n HIS 177 N 1.13 2.70 -1.33 1.40 8.25 -1.26 -4.63 115.22 121.48 1pj9 n HIS 177 Ca -0.06 -3.54 0.01 0.00 -0.26 0.00 0.00 57.72 53.86 1pj9 n HIS 177 Cb 0.51 -0.35 0.21 0.00 1.12 0.00 0.00 29.99 31.48 1pj9 n HIS 177 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1pj9 n ASN 178 N -0.18 2.69 0.00 0.41 3.02 -1.26 -5.09 115.26 114.85 1pj9 n ASN 178 Ca 0.29 -3.56 0.00 0.00 -0.03 0.00 0.00 54.58 51.28 1pj9 n ASN 178 Cb 0.58 -0.59 0.00 0.00 -0.61 0.00 0.00 39.78 39.16 1pj9 n ASN 178 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pj9 n GLY 179 N -1.02 -0.52 3.62 7.41 0.00 -1.26 -4.75 105.19 108.67 1pj9 n GLY 179 Ca 0.28 -1.10 -0.30 0.00 0.00 0.00 0.00 46.02 44.90 1pj9 n GLY 179 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pj9 s GLY 180 N -0.95 1.83 0.39 -0.02 0.00 -1.26 -0.67 107.32 106.64 1pj9 s GLY 180 Ca 0.00 -1.22 -0.23 0.00 0.00 0.00 0.00 44.72 43.27 1pj9 s GLY 180 CO 0.00 -1.20 0.99 -1.08 0.00 0.00 0.00 173.10 171.81 1pj9 s THR 181 N -1.28 4.06 -0.61 0.90 -1.32 -0.26 -4.76 115.64 112.37 1pj9 s THR 181 Ca 0.23 1.50 0.12 0.00 -1.21 0.00 0.00 61.69 62.33 1pj9 s THR 181 Cb -0.11 -3.74 0.37 0.00 -1.51 0.00 0.00 72.50 67.51 1pj9 s THR 181 CO 0.15 -0.06 1.30 -0.90 -2.21 0.00 0.00 174.62 172.90 1pj9 n ASP 182 N -0.12 3.19 -1.68 8.08 5.75 -1.26 -4.81 116.55 125.70 1pj9 n ASP 182 Ca 0.05 -2.37 -0.20 0.00 -0.01 0.00 0.00 54.79 52.26 1pj9 n ASP 182 Cb 0.51 -0.33 -0.08 0.00 -1.03 0.00 0.00 41.12 40.20 1pj9 n ASP 182 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 1pj9 n PHE 183 N 0.07 -0.18 0.23 2.11 3.72 -1.26 -4.86 117.46 117.29 1pj9 n PHE 183 Ca 0.14 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.66 1pj9 n PHE 183 Cb 0.58 -3.42 0.47 0.00 -0.94 0.00 0.00 39.48 36.16 1pj9 n PHE 183 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1pj9 h SER 184 N 0.00 0.00 -5.03 4.37 4.64 -1.94 -3.46 113.55 112.13 1pj9 h SER 184 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1pj9 h SER 184 Cb 1.30 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.29 1pj9 h SER 184 CO 0.59 0.15 0.16 -0.94 -0.87 0.00 0.00 176.83 175.91 1pj9 s SER 185 N -6.05 -0.39 0.16 4.97 1.04 -1.26 -5.02 113.70 107.15 1pj9 s SER 185 Ca 0.02 -0.30 -0.14 0.00 0.48 0.00 0.00 55.95 56.01 1pj9 s SER 185 Cb 0.09 0.62 0.05 0.00 0.10 0.00 0.00 66.02 66.88 1pj9 s SER 185 CO 0.62 -1.09 1.79 1.88 0.98 0.00 0.00 173.24 177.42 1pj9 h TYR 186 N 2.07 0.68 -0.66 5.02 -1.99 -1.94 -1.47 116.97 118.67 1pj9 h TYR 186 Ca -0.29 -0.01 0.05 0.00 2.00 0.00 0.00 58.73 60.49 1pj9 h TYR 186 Cb 1.28 -0.22 -0.05 0.00 2.00 0.00 0.00 36.73 39.74 1pj9 h TYR 186 CO 0.32 0.48 0.38 1.49 -0.00 0.00 0.00 178.16 180.83 1pj9 h GLU 187 N 0.68 0.70 -0.62 4.88 4.81 -1.96 -0.95 114.58 122.11 1pj9 h GLU 187 Ca 0.18 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1pj9 h GLU 187 Cb 0.01 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.20 1pj9 h GLU 187 CO -0.03 0.46 0.24 0.22 -0.73 0.00 0.00 179.01 179.17 1pj9 h ASP 188 N 0.72 0.87 0.72 1.04 1.82 -1.85 -1.59 116.42 118.15 1pj9 h ASP 188 Ca 0.29 -0.18 0.00 0.00 -0.39 0.00 0.00 57.03 56.75 1pj9 h ASP 188 Cb 0.13 -0.23 0.00 0.00 0.68 0.00 0.00 39.33 39.92 1pj9 h ASP 188 CO -0.16 0.81 0.00 0.61 -1.61 0.00 0.00 179.24 178.90 1pj9 n GLY 189 N -0.80 -1.27 0.13 -0.78 0.00 -0.59 -2.84 105.19 99.04 1pj9 n GLY 189 Ca 0.04 -0.10 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 1pj9 n GLY 189 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1pj9 n ILE 190 N -1.43 1.56 0.40 -0.61 5.41 -0.41 -4.48 119.36 119.80 1pj9 n ILE 190 Ca 0.08 -0.42 0.12 0.00 1.00 0.00 0.00 62.75 63.52 1pj9 n ILE 190 Cb 0.26 -1.75 0.24 0.00 -0.71 0.00 0.00 39.64 37.68 1pj9 n ILE 190 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 1pj9 n TYR 191 N -3.85 0.49 -4.51 1.39 4.01 -0.65 -4.67 117.16 109.37 1pj9 n TYR 191 Ca -0.44 -0.25 -0.26 0.00 -0.16 0.00 0.00 57.90 56.80 1pj9 n TYR 191 Cb 0.91 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.84 1pj9 n TYR 191 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1pj9 s ARG 192 N -1.51 1.89 0.34 -0.72 0.52 -1.13 -4.49 118.95 113.85 1pj9 s ARG 192 Ca 0.38 -1.92 -0.27 0.00 -0.52 0.00 0.00 55.73 53.40 1pj9 s ARG 192 Cb 0.22 -1.74 -0.09 0.00 0.52 0.00 0.00 34.95 33.86 1pj9 s ARG 192 CO 0.31 0.11 1.19 -0.80 0.02 0.00 0.00 175.30 176.13 1pj9 s ASN 193 N -3.64 6.83 -0.51 0.23 0.01 0.15 -4.56 114.94 113.45 1pj9 s ASN 193 Ca 0.33 2.42 -0.25 0.00 -0.71 0.00 0.00 52.86 54.65 1pj9 s ASN 193 Cb 0.03 -2.63 0.03 0.00 0.41 0.00 0.00 41.25 39.09 1pj9 s ASN 193 CO 0.17 -0.47 0.94 -0.22 -1.51 0.00 0.00 177.10 176.02 1pj9 s LEU 194 N -1.97 4.03 0.00 0.60 2.96 -1.26 -1.11 118.68 121.94 1pj9 s LEU 194 Ca 0.51 -0.13 0.00 0.00 -0.22 0.00 0.00 54.13 54.29 1pj9 s LEU 194 Cb -0.34 -3.00 0.00 0.00 0.50 0.00 0.00 46.19 43.35 1pj9 s LEU 194 CO 0.43 -1.16 0.00 -1.22 -1.32 0.00 0.00 176.35 173.09 1pj9 n TYR 195 N 7.37 0.00 -0.63 5.38 4.01 -1.26 -1.79 117.16 130.24 1pj9 n TYR 195 Ca 0.04 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.86 1pj9 n TYR 195 Cb 0.48 0.00 0.26 0.00 -0.31 0.00 0.00 39.34 39.77 1pj9 n TYR 195 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1pj9 n ASP 196 N 6.28 3.91 -4.69 7.72 5.75 -1.26 -4.82 116.55 129.44 1pj9 n ASP 196 Ca 0.00 -2.53 -0.42 0.00 -0.01 0.00 0.00 54.79 51.83 1pj9 n ASP 196 Cb 0.00 -0.46 -0.03 0.00 -1.03 0.00 0.00 41.12 39.60 1pj9 n ASP 196 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1pj9 s LEU 197 N -1.97 4.30 -0.19 -2.12 1.43 -0.74 -0.68 118.68 118.71 1pj9 s LEU 197 Ca 0.39 1.76 -0.29 0.00 -1.03 0.00 0.00 54.13 54.97 1pj9 s LEU 197 Cb 0.27 -3.56 -0.06 0.00 0.03 0.00 0.00 46.19 42.87 1pj9 s LEU 197 CO 0.16 -0.49 2.19 0.00 0.23 0.00 0.00 176.35 178.44 1pj9 n ALA 198 N 4.77 1.74 -2.56 4.21 0.00 -0.62 -4.10 120.51 123.96 1pj9 n ALA 198 Ca 0.09 -0.19 -0.43 0.00 0.00 0.00 0.00 53.44 52.91 1pj9 n ALA 198 Cb 0.47 -2.88 -0.02 0.00 0.00 0.00 0.00 19.45 17.02 1pj9 n ALA 198 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1pj9 s ASP 199 N 7.84 6.88 0.37 0.00 2.15 -1.26 -2.45 116.67 130.19 1pj9 s ASP 199 Ca 1.00 1.18 -0.27 0.00 0.43 0.00 0.00 52.55 54.89 1pj9 s ASP 199 Cb -0.36 -2.54 -0.09 0.00 -0.30 0.00 0.00 42.92 39.62 1pj9 s ASP 199 CO 0.36 -0.91 1.27 -0.76 -0.17 0.00 0.00 175.17 174.97 1pj9 s LEU 200 N 3.80 4.32 -0.63 -1.34 1.43 -0.49 -0.06 118.68 125.71 1pj9 s LEU 200 Ca 0.49 2.60 -0.16 0.00 -1.03 0.00 0.00 54.13 56.04 1pj9 s LEU 200 Cb -0.15 -3.80 0.15 0.00 0.03 0.00 0.00 46.19 42.42 1pj9 s LEU 200 CO 0.17 -0.66 0.60 0.21 0.23 0.00 0.00 176.35 176.90 1pj9 s ASN 201 N -0.70 6.35 0.00 2.29 2.47 0.65 -4.67 114.94 121.33 1pj9 s ASN 201 Ca 0.53 -2.00 0.17 0.00 0.42 0.00 0.00 52.86 51.98 1pj9 s ASN 201 Cb -0.37 -2.22 0.86 0.00 -1.45 0.00 0.00 41.25 38.07 1pj9 s ASN 201 CO 0.49 -0.81 1.50 1.41 -3.72 0.00 0.00 177.10 175.96 1pj9 n HIS 202 N 5.03 0.00 0.91 0.43 8.25 -1.26 -1.68 115.22 126.91 1pj9 n HIS 202 Ca -0.06 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.53 1pj9 n HIS 202 Cb 0.42 -0.28 0.40 0.00 1.12 0.00 0.00 29.99 31.65 1pj9 n HIS 202 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1pj9 n ASN 203 N -1.28 0.36 -4.67 0.41 5.15 -1.26 -4.40 115.26 109.57 1pj9 n ASN 203 Ca 0.08 0.16 -0.42 0.00 -0.60 0.00 0.00 54.58 53.80 1pj9 n ASN 203 Cb 0.13 -0.15 -0.03 0.00 -0.53 0.00 0.00 39.78 39.20 1pj9 n ASN 203 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1pj9 s ASN 204 N -3.29 7.06 0.32 1.20 3.84 -0.67 -4.69 114.94 118.71 1pj9 s ASN 204 Ca 0.12 1.31 0.05 0.00 0.21 0.00 0.00 52.86 54.55 1pj9 s ASN 204 Cb 0.17 -2.50 0.68 0.00 -0.55 0.00 0.00 41.25 39.05 1pj9 s ASN 204 CO 0.63 -0.50 1.87 0.28 -2.79 0.00 0.00 177.10 176.58 1pj9 h SER 205 N 7.34 0.78 -0.04 -4.21 0.02 -1.87 -0.59 113.55 114.98 1pj9 h SER 205 Ca -0.26 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 60.73 1pj9 h SER 205 Cb 1.11 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 63.53 1pj9 h SER 205 CO 0.89 0.42 0.02 0.74 -1.14 0.00 0.00 176.83 177.76 1pj9 h THR 206 N 0.85 1.07 -0.44 -2.27 2.02 -1.94 -0.36 112.91 111.83 1pj9 h THR 206 Ca 0.45 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.43 1pj9 h THR 206 Cb 0.55 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 68.06 1pj9 h THR 206 CO -0.21 0.05 0.24 0.58 0.37 0.00 0.00 175.52 176.55 1pj9 h VAL 207 N -0.01 1.16 0.58 3.16 2.07 -1.68 -0.06 116.25 121.46 1pj9 h VAL 207 Ca 0.01 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 1pj9 h VAL 207 Cb 0.07 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1pj9 h VAL 207 CO -0.00 0.17 -0.40 -0.78 0.02 0.00 0.00 177.57 176.58 1pj9 h ASP 208 N 0.58 -1.04 -0.68 0.57 3.58 -0.94 -1.55 116.42 116.94 1pj9 h ASP 208 Ca 0.16 0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.67 1pj9 h ASP 208 Cb 0.06 0.32 -0.03 0.00 1.72 0.00 0.00 39.33 41.40 1pj9 h ASP 208 CO -0.02 -0.60 0.43 0.58 -2.88 0.00 0.00 179.24 176.74 1pj9 h VAL 209 N -0.94 1.19 -0.03 2.25 2.07 -1.04 -2.67 116.25 117.07 1pj9 h VAL 209 Ca -0.07 -0.39 0.03 0.00 0.82 0.00 0.00 66.70 67.09 1pj9 h VAL 209 Cb 0.78 0.22 -0.04 0.00 -1.52 0.00 0.00 31.29 30.74 1pj9 h VAL 209 CO 0.04 0.19 -0.18 0.22 0.02 0.00 0.00 177.57 177.86 1pj9 h TYR 210 N 0.93 -0.47 -0.42 1.57 3.20 -0.85 -0.32 116.97 120.60 1pj9 h TYR 210 Ca 0.25 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.06 1pj9 h TYR 210 Cb -0.06 0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 1pj9 h TYR 210 CO -0.02 -0.26 -0.03 -0.07 -1.64 0.00 0.00 178.16 176.14 1pj9 h LEU 211 N -0.28 0.68 -0.62 2.82 3.38 -1.20 0.05 115.31 120.14 1pj9 h LEU 211 Ca 0.07 -0.17 -0.14 0.00 0.09 0.00 0.00 57.88 57.73 1pj9 h LEU 211 Cb 0.37 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1pj9 h LEU 211 CO -0.19 0.77 -0.49 0.11 0.09 0.00 0.00 178.44 178.72 1pj9 h LYS 212 N 0.66 0.50 -0.48 1.13 1.57 -1.25 -1.84 116.57 116.85 1pj9 h LYS 212 Ca 0.13 -0.29 -0.12 0.00 -1.87 0.00 0.00 60.65 58.50 1pj9 h LYS 212 Cb 0.46 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 1pj9 h LYS 212 CO 0.02 0.88 -0.18 -0.44 -0.57 0.00 0.00 179.45 179.16 1pj9 h ASP 213 N 0.39 0.95 -0.14 0.86 3.32 -0.70 -2.95 116.42 118.14 1pj9 h ASP 213 Ca 0.02 -0.34 -0.00 0.00 0.02 0.00 0.00 57.03 56.73 1pj9 h ASP 213 Cb 1.01 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.29 1pj9 h ASP 213 CO 0.09 1.10 0.08 0.00 -1.72 0.00 0.00 179.24 178.80 1pj9 h ALA 214 N 0.97 0.18 -0.18 3.45 0.00 -0.69 -2.56 119.26 120.43 1pj9 h ALA 214 Ca 0.12 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1pj9 h ALA 214 Cb 0.73 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1pj9 h ALA 214 CO 0.06 -0.30 -0.02 0.97 0.00 0.00 0.00 179.25 179.96 1pj9 h ILE 215 N 0.15 1.13 -0.83 0.00 6.09 -1.35 -1.72 117.51 120.99 1pj9 h ILE 215 Ca 0.05 -0.52 -0.01 0.00 -1.37 0.00 0.00 64.86 63.00 1pj9 h ILE 215 Cb 0.04 1.02 -0.04 0.00 0.47 0.00 0.00 36.82 38.31 1pj9 h ILE 215 CO -0.01 0.17 0.46 0.11 -3.07 0.00 0.00 178.15 175.81 1pj9 h LYS 216 N 0.26 1.14 -0.33 2.19 1.57 -1.29 -0.06 116.57 120.06 1pj9 h LYS 216 Ca 0.06 -0.12 0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1pj9 h LYS 216 Cb 0.22 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1pj9 h LYS 216 CO 0.01 0.83 0.19 1.98 -0.57 0.00 0.00 179.45 181.88 1pj9 h MET 217 N 1.15 0.37 -0.31 3.15 4.05 -1.01 0.57 114.93 122.91 1pj9 h MET 217 Ca 0.29 -0.02 -0.10 0.00 -0.28 0.00 0.00 59.70 59.59 1pj9 h MET 217 Cb 0.01 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 30.71 1pj9 h MET 217 CO -0.05 0.25 -0.23 -1.49 0.23 0.00 0.00 176.91 175.62 1pj9 h TRP 218 N 0.38 0.66 -0.46 1.39 4.06 -1.29 -1.96 115.95 118.73 1pj9 h TRP 218 Ca 0.13 -0.14 -0.07 0.00 2.06 0.00 0.00 58.89 60.87 1pj9 h TRP 218 Cb 0.01 -0.16 -0.02 0.00 -1.00 0.00 0.00 29.16 27.98 1pj9 h TRP 218 CO -0.08 0.77 0.01 -0.07 -3.56 0.00 0.00 178.44 175.52 1pj9 h LEU 219 N 0.52 0.71 -1.42 -4.49 3.38 -0.58 -1.66 115.31 111.77 1pj9 h LEU 219 Ca 0.08 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1pj9 h LEU 219 Cb 0.68 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 1pj9 h LEU 219 CO 0.05 0.77 -0.11 0.44 0.09 0.00 0.00 178.44 179.68 1pj9 h ASP 220 N 0.70 0.00 0.30 -0.43 3.32 -0.33 -2.10 116.42 117.88 1pj9 h ASP 220 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1pj9 h ASP 220 Cb 0.41 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.96 1pj9 h ASP 220 CO 0.02 0.11 -0.02 0.18 -1.72 0.00 0.00 179.24 177.81 1pj9 n LEU 221 N -3.29 0.13 0.00 1.55 4.77 -0.63 -4.93 117.00 114.61 1pj9 n LEU 221 Ca -0.00 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 1pj9 n LEU 221 Cb 0.34 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1pj9 n LEU 221 CO 0.30 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 1pj9 n GLY 222 N 1.17 0.84 3.72 -0.72 0.00 -0.79 -4.92 105.19 104.50 1pj9 n GLY 222 Ca 0.18 -0.23 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 1pj9 n GLY 222 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1pj9 s ILE 223 N -2.00 2.33 -0.66 -0.61 -4.36 -1.21 -4.90 121.20 109.79 1pj9 s ILE 223 Ca 0.00 0.17 0.16 0.00 -0.26 0.00 0.00 60.65 60.71 1pj9 s ILE 223 Cb 0.00 -2.76 -0.18 0.00 1.25 0.00 0.00 42.46 40.77 1pj9 s ILE 223 CO 0.00 -0.08 0.63 0.47 0.24 0.00 0.00 174.94 176.20 1pj9 n ASP 224 N -2.64 0.80 -3.72 4.36 8.00 0.54 -4.93 116.55 118.97 1pj9 n ASP 224 Ca 0.13 -0.77 -0.03 0.00 0.71 0.00 0.00 54.79 54.83 1pj9 n ASP 224 Cb 0.50 1.08 -0.01 0.00 -0.02 0.00 0.00 41.12 42.67 1pj9 n ASP 224 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1pj9 s GLY 225 N -2.64 -0.28 -0.02 0.44 0.00 -1.08 -3.47 107.32 100.27 1pj9 s GLY 225 Ca 0.05 0.28 0.01 0.00 0.00 0.00 0.00 44.72 45.06 1pj9 s GLY 225 CO 0.65 0.05 -0.04 -0.42 0.00 0.00 0.00 173.10 173.34 1pj9 s ILE 226 N -3.13 0.40 -0.36 0.90 1.01 0.16 -2.45 121.20 117.74 1pj9 s ILE 226 Ca 0.12 -0.11 -0.08 0.00 0.00 0.00 0.00 60.65 60.58 1pj9 s ILE 226 Cb -0.00 -0.41 0.05 0.00 0.01 0.00 0.00 42.46 42.10 1pj9 s ILE 226 CO 0.01 0.16 0.15 -0.60 0.00 0.00 0.00 174.94 174.66 1pj9 s ARG 227 N 0.54 2.64 -0.17 2.79 3.00 -0.40 -1.10 118.95 126.25 1pj9 s ARG 227 Ca -0.06 -1.23 -0.26 0.00 -1.00 0.00 0.00 55.73 53.18 1pj9 s ARG 227 Cb -0.10 -3.57 -0.01 0.00 0.00 0.00 0.00 34.95 31.27 1pj9 s ARG 227 CO -0.00 -0.73 0.85 -1.64 0.00 0.00 0.00 175.30 173.77 1pj9 s MET 228 N 1.43 4.30 0.24 5.12 -1.94 0.76 -1.06 119.30 128.14 1pj9 s MET 228 Ca 0.00 1.05 -0.30 0.00 -1.71 0.00 0.00 55.69 54.74 1pj9 s MET 228 Cb -0.20 -3.58 -0.09 0.00 2.01 0.00 0.00 34.83 32.97 1pj9 s MET 228 CO 0.03 -0.35 0.97 0.34 -0.01 0.00 0.00 175.02 176.00 1pj9 s ASP 229 N 1.16 7.58 -1.41 3.03 2.15 -0.24 -0.40 116.67 128.55 1pj9 s ASP 229 Ca 0.39 1.99 -0.06 0.00 0.43 0.00 0.00 52.55 55.30 1pj9 s ASP 229 Cb -0.17 -2.61 0.00 0.00 -0.30 0.00 0.00 42.92 39.85 1pj9 s ASP 229 CO 0.12 0.10 0.34 0.00 -0.17 0.00 0.00 175.17 175.56 1pj9 n ALA 230 N 1.52 -2.14 0.33 3.66 0.00 -1.24 -4.68 120.51 117.96 1pj9 n ALA 230 Ca -0.02 -0.36 0.15 0.00 0.00 0.00 0.00 53.44 53.22 1pj9 n ALA 230 Cb 0.47 -1.63 0.63 0.00 0.00 0.00 0.00 19.45 18.92 1pj9 n ALA 230 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1pj9 h VAL 231 N -1.92 0.00 0.00 0.00 -1.51 -1.58 -1.17 116.25 110.07 1pj9 h VAL 231 Ca -0.65 -0.35 0.00 0.00 -1.23 0.00 0.00 66.70 64.46 1pj9 h VAL 231 Cb 1.39 1.22 0.00 0.00 -2.13 0.00 0.00 31.29 31.77 1pj9 h VAL 231 CO 0.63 0.00 0.00 1.17 -1.23 0.00 0.00 177.57 178.14 1pj9 n LYS 232 N -2.71 0.09 -0.26 5.19 4.81 -1.25 -3.19 118.16 120.84 1pj9 n LYS 232 Ca 0.01 0.23 0.07 0.00 -0.87 0.00 0.00 58.31 57.75 1pj9 n LYS 232 Cb 0.25 -1.64 0.20 0.00 0.02 0.00 0.00 35.03 33.87 1pj9 n LYS 232 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1pj9 n HIS 233 N -1.81 0.65 -4.34 5.64 8.25 -0.44 -4.56 115.22 118.61 1pj9 n HIS 233 Ca 0.04 -0.54 -0.23 0.00 -0.26 0.00 0.00 57.72 56.74 1pj9 n HIS 233 Cb 0.26 -0.06 -0.11 0.00 1.12 0.00 0.00 29.99 31.20 1pj9 n HIS 233 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1pj9 s MET 234 N -1.20 1.28 0.07 -0.41 -1.94 -1.19 -4.32 119.30 111.59 1pj9 s MET 234 Ca 0.31 -1.38 -0.33 0.00 -1.71 0.00 0.00 55.69 52.58 1pj9 s MET 234 Cb 0.17 -1.42 -0.12 0.00 2.01 0.00 0.00 34.83 35.48 1pj9 s MET 234 CO 0.19 0.30 1.77 -2.30 -0.01 0.00 0.00 175.02 174.97 1pj9 n PRO 235 N 0.42 2.42 -0.10 2.03 -0.02 -1.26 -4.85 135.00 133.64 1pj9 n PRO 235 Ca -0.14 0.88 0.02 0.00 -2.02 0.00 0.00 63.50 62.24 1pj9 n PRO 235 Cb 0.56 -2.72 0.32 0.00 -0.02 0.00 0.00 33.50 31.64 1pj9 n PRO 235 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 1pj9 h PHE 236 N 7.97 0.72 -0.46 6.00 0.04 -1.88 -1.43 116.94 127.90 1pj9 h PHE 236 Ca -0.47 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.19 1pj9 h PHE 236 Cb 1.25 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 39.15 1pj9 h PHE 236 CO 0.77 0.48 -0.17 0.78 -0.60 0.00 0.00 178.31 179.57 1pj9 h GLY 237 N 0.80 1.01 1.02 -1.45 0.00 -1.89 -1.73 103.07 100.83 1pj9 h GLY 237 Ca 0.20 -0.87 -0.06 0.00 0.00 0.00 0.00 47.33 46.60 1pj9 h GLY 237 CO -0.04 0.79 0.15 -0.25 0.00 0.00 0.00 176.54 177.19 1pj9 h TRP 238 N 0.77 1.00 -0.32 5.60 7.01 -1.62 -2.36 115.95 126.04 1pj9 h TRP 238 Ca 0.11 -0.12 -0.03 0.00 2.11 0.00 0.00 58.89 60.96 1pj9 h TRP 238 Cb 0.73 -0.28 -0.02 0.00 -2.10 0.00 0.00 29.16 27.49 1pj9 h TRP 238 CO 0.05 0.85 0.06 1.96 -2.79 0.00 0.00 178.44 178.57 1pj9 h GLN 239 N 0.87 0.46 -0.64 2.65 4.20 -1.11 0.77 115.11 122.31 1pj9 h GLN 239 Ca 0.19 -0.07 -0.07 0.00 0.06 0.00 0.00 58.65 58.76 1pj9 h GLN 239 Cb 0.35 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.02 1pj9 h GLN 239 CO 0.00 0.44 0.14 -0.22 -0.67 0.00 0.00 178.83 178.52 1pj9 h LYS 240 N 0.45 1.05 -0.00 1.46 3.64 -0.92 0.45 116.57 122.70 1pj9 h LYS 240 Ca 0.11 -0.26 -0.08 0.00 -1.27 0.00 0.00 60.65 59.15 1pj9 h LYS 240 Cb 0.20 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1pj9 h LYS 240 CO -0.00 0.95 -0.36 0.66 -2.27 0.00 0.00 179.45 178.43 1pj9 h SER 241 N 0.96 0.01 -0.13 4.20 4.64 -0.70 -0.61 113.55 121.93 1pj9 h SER 241 Ca 0.20 -0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.47 1pj9 h SER 241 Cb 0.39 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1pj9 h SER 241 CO 0.01 0.37 -0.11 0.15 -0.87 0.00 0.00 176.83 176.37 1pj9 h PHE 242 N 0.01 0.35 -0.22 4.77 3.57 -0.25 -1.69 116.94 123.47 1pj9 h PHE 242 Ca -0.00 -0.10 -0.03 0.00 3.53 0.00 0.00 57.97 61.36 1pj9 h PHE 242 Cb 0.65 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 1pj9 h PHE 242 CO 0.00 0.69 0.00 0.52 -2.23 0.00 0.00 178.31 177.29 1pj9 h MET 243 N -0.08 0.32 -0.52 1.11 2.86 -0.62 -1.59 114.93 116.41 1pj9 h MET 243 Ca 0.02 -0.05 -0.09 0.00 -2.06 0.00 0.00 59.70 57.52 1pj9 h MET 243 Cb 0.63 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.21 1pj9 h MET 243 CO 0.03 0.35 -0.02 0.00 1.06 0.00 0.00 176.91 178.33 1pj9 h ALA 244 N 1.69 0.70 -0.55 6.32 0.00 -0.96 0.21 119.26 126.66 1pj9 h ALA 244 Ca 0.07 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1pj9 h ALA 244 Cb 0.22 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1pj9 h ALA 244 CO 0.00 0.53 0.36 0.00 0.00 0.00 0.00 179.25 180.15 1pj9 h ALA 245 N 0.93 0.70 0.23 0.00 0.00 -0.57 0.26 119.26 120.81 1pj9 h ALA 245 Ca 0.14 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1pj9 h ALA 245 Cb 0.55 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1pj9 h ALA 245 CO 0.03 0.15 -0.11 0.28 0.00 0.00 0.00 179.25 179.60 1pj9 h VAL 246 N 0.75 0.84 -0.12 0.00 2.07 -1.06 -3.01 116.25 115.72 1pj9 h VAL 246 Ca 0.20 -0.44 -0.08 0.00 0.82 0.00 0.00 66.70 67.21 1pj9 h VAL 246 Cb -0.07 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1pj9 h VAL 246 CO -0.04 0.10 -0.27 0.78 0.02 0.00 0.00 177.57 178.15 1pj9 h ASN 247 N -0.53 0.21 -0.07 0.57 2.35 -0.40 0.45 115.58 118.16 1pj9 h ASN 247 Ca -0.03 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 1pj9 h ASN 247 Cb 0.39 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.71 1pj9 h ASN 247 CO 0.05 0.49 0.00 0.59 -1.65 0.00 0.00 177.43 176.91 1pj9 n ASN 248 N -4.15 0.65 0.00 5.81 3.02 0.89 -4.06 115.26 117.42 1pj9 n ASN 248 Ca -0.01 -1.55 0.00 0.00 -0.03 0.00 0.00 54.58 52.99 1pj9 n ASN 248 Cb 0.37 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.50 1pj9 n ASN 248 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pj9 n TYR 249 N -0.35 0.00 -3.46 3.10 9.36 -0.85 -5.03 117.16 119.94 1pj9 n TYR 249 Ca 0.14 0.00 -0.27 0.00 3.32 0.00 0.00 57.90 61.10 1pj9 n TYR 249 Cb 0.16 0.00 -0.12 0.00 -0.63 0.00 0.00 39.34 38.76 1pj9 n TYR 249 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1pj9 s LYS 250 N -0.46 0.49 0.23 2.98 1.02 0.09 -5.09 119.74 118.99 1pj9 s LYS 250 Ca 0.00 -1.08 -0.30 0.00 0.02 0.00 0.00 55.97 54.60 1pj9 s LYS 250 Cb 0.00 -1.16 -0.10 0.00 -0.52 0.00 0.00 37.83 36.05 1pj9 s LYS 250 CO 0.00 -1.17 1.46 -1.25 -0.92 0.00 0.00 175.35 173.47 1pj9 s PRO 251 N 1.34 4.26 0.02 -1.68 0.04 -1.14 -4.63 135.00 133.21 1pj9 s PRO 251 Ca 0.16 2.30 0.00 0.00 0.04 0.00 0.00 61.00 63.50 1pj9 s PRO 251 Cb -0.20 -3.12 -0.02 0.00 0.04 0.00 0.00 34.50 31.19 1pj9 s PRO 251 CO -0.07 -0.45 -0.03 0.14 0.04 0.00 0.00 177.00 176.63 1pj9 s VAL 252 N 0.26 0.14 -0.01 -0.36 -7.23 -1.26 -4.67 120.40 107.26 1pj9 s VAL 252 Ca 0.62 -0.74 -0.35 0.00 -1.81 0.00 0.00 61.98 59.70 1pj9 s VAL 252 Cb -0.42 -0.25 -0.14 0.00 0.56 0.00 0.00 36.38 36.14 1pj9 s VAL 252 CO 0.40 -0.38 1.70 0.33 -0.31 0.00 0.00 175.10 176.85 1pj9 n PHE 253 N 1.90 2.18 -4.58 2.82 7.35 0.56 -4.71 117.46 122.98 1pj9 n PHE 253 Ca -0.21 0.23 -0.23 0.00 -0.76 0.00 0.00 57.45 56.48 1pj9 n PHE 253 Cb 0.56 -2.56 -0.16 0.00 0.35 0.00 0.00 39.48 37.67 1pj9 n PHE 253 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1pj9 s THR 254 N 2.57 1.06 0.00 -2.13 2.01 -1.26 -0.66 115.64 117.23 1pj9 s THR 254 Ca 0.88 -0.50 0.01 0.00 0.31 0.00 0.00 61.69 62.39 1pj9 s THR 254 Cb -0.77 -0.93 -0.00 0.00 0.01 0.00 0.00 72.50 70.80 1pj9 s THR 254 CO 0.49 0.32 -0.04 0.72 -0.69 0.00 0.00 174.62 175.42 1pj9 s PHE 255 N 0.19 0.33 0.25 4.92 -0.71 -0.25 -1.51 117.98 121.20 1pj9 s PHE 255 Ca -0.05 -0.11 0.08 0.00 -1.04 0.00 0.00 56.93 55.82 1pj9 s PHE 255 Cb -0.10 -0.21 -0.04 0.00 -1.21 0.00 0.00 43.02 41.45 1pj9 s PHE 255 CO 0.01 -0.02 0.07 0.20 -1.34 0.00 0.00 175.22 174.14 1pj9 s GLY 256 N -0.25 1.58 -0.42 1.99 0.00 -0.17 -0.17 107.32 109.88 1pj9 s GLY 256 Ca -0.00 -1.53 -0.20 0.00 0.00 0.00 0.00 44.72 42.99 1pj9 s GLY 256 CO -0.00 -1.58 0.61 1.85 0.00 0.00 0.00 173.10 173.98 1pj9 s GLU 257 N -3.62 3.35 -0.46 2.90 2.12 0.46 -1.00 118.70 122.45 1pj9 s GLU 257 Ca 0.31 -0.33 0.03 0.00 0.36 0.00 0.00 54.97 55.34 1pj9 s GLU 257 Cb -0.07 -3.92 0.13 0.00 0.26 0.00 0.00 34.13 30.52 1pj9 s GLU 257 CO 0.21 -0.92 0.22 -0.46 -0.54 0.00 0.00 175.26 173.77 1pj9 s TRP 258 N 2.70 2.76 0.31 5.30 -0.11 -1.26 -1.92 118.94 126.72 1pj9 s TRP 258 Ca 0.22 -2.83 -0.30 0.00 1.22 0.00 0.00 56.10 54.41 1pj9 s TRP 258 Cb -0.15 -2.46 -0.12 0.00 -1.50 0.00 0.00 33.47 29.25 1pj9 s TRP 258 CO 0.17 -0.78 1.54 0.34 -4.62 0.00 0.00 176.95 173.60 1pj9 n PHE 259 N 3.46 2.79 -4.41 5.86 -0.00 -1.26 -4.72 117.46 119.18 1pj9 n PHE 259 Ca 0.06 0.32 -0.20 0.00 -0.00 0.00 0.00 57.45 57.64 1pj9 n PHE 259 Cb 0.34 -2.56 -0.15 0.00 -0.00 0.00 0.00 39.48 37.11 1pj9 n PHE 259 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 1pj9 s LEU 260 N -0.77 1.96 0.79 -2.13 1.43 -1.26 -5.10 118.68 113.60 1pj9 s LEU 260 Ca 0.62 -0.18 -0.04 0.00 -1.03 0.00 0.00 54.13 53.49 1pj9 s LEU 260 Cb -0.51 -0.52 0.16 0.00 0.03 0.00 0.00 46.19 45.35 1pj9 s LEU 260 CO 0.52 0.11 1.09 -0.83 0.23 0.00 0.00 176.35 177.47 1pj9 s GLY 261 N -0.12 1.76 0.28 -3.19 0.00 -1.26 -4.86 107.32 99.94 1pj9 s GLY 261 Ca 0.02 -1.71 -0.30 0.00 0.00 0.00 0.00 44.72 42.73 1pj9 s GLY 261 CO -0.00 -1.05 1.51 -0.62 0.00 0.00 0.00 173.10 172.94 1pj9 n VAL 262 N -3.09 1.10 -0.94 1.40 0.31 -1.26 -1.81 118.33 114.04 1pj9 n VAL 262 Ca 0.16 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 1pj9 n VAL 262 Cb 0.60 -1.78 0.00 0.00 -0.91 0.00 0.00 33.84 31.76 1pj9 n VAL 262 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1pj9 n ASN 263 N 2.00 -4.33 -4.66 4.52 3.02 -1.26 -4.97 115.26 109.58 1pj9 n ASN 263 Ca 0.09 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.24 1pj9 n ASN 263 Cb 0.35 -2.53 -0.06 0.00 -0.61 0.00 0.00 39.78 36.93 1pj9 n ASN 263 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1pj9 s GLU 264 N -1.33 4.21 -0.23 3.52 2.12 -0.75 -5.03 118.70 121.22 1pj9 s GLU 264 Ca 0.00 0.59 0.02 0.00 0.36 0.00 0.00 54.97 55.94 1pj9 s GLU 264 Cb 0.00 -3.57 0.05 0.00 0.26 0.00 0.00 34.13 30.87 1pj9 s GLU 264 CO 0.00 -0.22 -0.10 0.08 -0.54 0.00 0.00 175.26 174.48 1pj9 s VAL 265 N 1.84 1.87 -0.27 3.70 1.01 -1.26 -4.77 120.40 122.51 1pj9 s VAL 265 Ca 0.28 -1.32 -0.06 0.00 0.00 0.00 0.00 61.98 60.88 1pj9 s VAL 265 Cb -0.16 -1.98 -0.00 0.00 0.00 0.00 0.00 36.38 34.24 1pj9 s VAL 265 CO 0.10 0.05 0.06 -0.55 0.00 0.00 0.00 175.10 174.76 1pj9 s SER 266 N 1.26 4.98 0.32 3.32 0.15 -1.26 -4.98 113.70 117.49 1pj9 s SER 266 Ca -0.05 -0.52 0.01 0.00 0.70 0.00 0.00 55.95 56.09 1pj9 s SER 266 Cb -0.18 -1.87 0.53 0.00 -1.71 0.00 0.00 66.02 62.79 1pj9 s SER 266 CO -0.07 -0.12 1.92 -0.65 1.20 0.00 0.00 173.24 175.53 1pj9 h PRO 267 N 8.21 0.82 -0.54 5.44 0.11 -1.99 -1.55 132.00 142.50 1pj9 h PRO 267 Ca -0.35 -0.10 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 1pj9 h PRO 267 Cb 1.15 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 1pj9 h PRO 267 CO 0.60 0.64 0.14 0.93 -0.21 0.00 0.00 178.00 180.09 1pj9 h GLU 268 N 0.82 0.83 -0.03 1.05 3.07 -1.99 -1.08 114.58 117.25 1pj9 h GLU 268 Ca 0.20 -0.16 -0.00 0.00 -0.50 0.00 0.00 59.36 58.90 1pj9 h GLU 268 Cb 0.09 -0.13 -0.00 0.00 -0.84 0.00 0.00 28.75 27.87 1pj9 h GLU 268 CO -0.03 0.74 0.01 -0.97 -1.40 0.00 0.00 179.01 177.37 1pj9 h ASN 269 N 0.80 0.04 -0.38 1.42 -0.73 -1.73 -1.32 115.58 113.68 1pj9 h ASN 269 Ca 0.18 -0.11 0.03 0.00 1.87 0.00 0.00 56.30 58.27 1pj9 h ASN 269 Cb 0.28 -0.01 -0.03 0.00 0.27 0.00 0.00 38.32 38.83 1pj9 h ASN 269 CO -0.00 0.14 0.17 0.45 -0.37 0.00 0.00 177.43 177.82 1pj9 h HIS 270 N -0.07 0.31 -0.89 0.67 3.86 -1.05 -1.85 115.15 116.13 1pj9 h HIS 270 Ca 0.01 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.23 1pj9 h HIS 270 Cb 0.11 -0.08 -0.04 0.00 1.06 0.00 0.00 27.41 28.46 1pj9 h HIS 270 CO -0.04 0.15 0.53 -0.22 0.86 0.00 0.00 177.93 179.22 1pj9 h LYS 271 N 0.35 1.21 -0.08 2.45 3.64 -1.07 -0.53 116.57 122.54 1pj9 h LYS 271 Ca 0.16 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1pj9 h LYS 271 Cb 0.09 -0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 31.66 1pj9 h LYS 271 CO -0.13 0.85 0.04 0.35 -2.27 0.00 0.00 179.45 178.29 1pj9 h PHE 272 N 1.22 0.12 -0.18 1.91 3.57 -0.82 -0.08 116.94 122.69 1pj9 h PHE 272 Ca 0.32 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.77 1pj9 h PHE 272 Cb -0.04 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 1pj9 h PHE 272 CO 0.00 0.21 -0.06 0.00 -2.23 0.00 0.00 178.31 176.23 1pj9 h ALA 273 N 0.90 1.57 0.00 2.41 0.00 -1.11 -0.18 119.26 122.85 1pj9 h ALA 273 Ca 0.03 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 1pj9 h ALA 273 Cb 0.13 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1pj9 h ALA 273 CO -0.00 0.31 -0.47 -0.91 0.00 0.00 0.00 179.25 178.18 1pj9 h ASN 274 N 0.26 0.00 0.00 0.00 2.35 -0.71 -3.41 115.58 114.07 1pj9 h ASN 274 Ca 0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1pj9 h ASN 274 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 1pj9 h ASN 274 CO 0.01 0.29 0.00 -0.62 -1.65 0.00 0.00 177.43 175.46 1pj9 n GLU 275 N -3.10 1.57 0.08 0.81 1.02 -0.08 -4.84 120.64 116.10 1pj9 n GLU 275 Ca 0.01 -0.13 -0.04 0.00 -0.02 0.00 0.00 57.16 56.98 1pj9 n GLU 275 Cb 0.66 -0.52 -0.07 0.00 -0.02 0.00 0.00 31.44 31.49 1pj9 n GLU 275 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1pj9 h SER 276 N 0.00 0.00 0.00 1.62 4.64 -1.21 -3.48 113.55 115.12 1pj9 h SER 276 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1pj9 h SER 276 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1pj9 h SER 276 CO 0.00 0.81 0.00 0.61 -0.87 0.00 0.00 176.83 177.38 1pj9 n GLY 277 N 1.33 0.62 3.16 -0.77 0.00 -1.26 -4.20 105.19 104.08 1pj9 n GLY 277 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 1pj9 n GLY 277 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1pj9 s MET 278 N -0.71 0.81 0.00 1.61 0.23 -1.26 -4.85 119.30 115.12 1pj9 s MET 278 Ca 0.00 -1.24 0.00 0.00 -1.03 0.00 0.00 55.69 53.42 1pj9 s MET 278 Cb 0.00 -0.30 0.00 0.00 -1.53 0.00 0.00 34.83 33.00 1pj9 s MET 278 CO 0.00 0.01 0.00 -1.13 -2.03 0.00 0.00 175.02 171.87 1pj9 n SER 279 N 0.25 0.00 -4.16 -1.18 3.41 -0.57 -4.43 113.62 106.93 1pj9 n SER 279 Ca -0.14 -0.93 -0.11 0.00 -0.26 0.00 0.00 58.87 57.43 1pj9 n SER 279 Cb 0.59 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.44 1pj9 n SER 279 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1pj9 s LEU 280 N 0.00 2.49 0.17 1.04 1.43 -1.26 -1.00 118.68 121.55 1pj9 s LEU 280 Ca 0.00 -0.98 -0.31 0.00 -1.03 0.00 0.00 54.13 51.82 1pj9 s LEU 280 Cb 0.00 -0.08 -0.09 0.00 0.03 0.00 0.00 46.19 46.05 1pj9 s LEU 280 CO 0.00 -0.45 1.39 -0.76 0.23 0.00 0.00 176.35 176.77 1pj9 s LEU 281 N -2.95 4.39 -1.35 1.79 1.43 -0.17 -1.58 118.68 120.23 1pj9 s LEU 281 Ca 0.10 2.44 -0.15 0.00 -1.03 0.00 0.00 54.13 55.49 1pj9 s LEU 281 Cb 0.04 -3.60 0.08 0.00 0.03 0.00 0.00 46.19 42.74 1pj9 s LEU 281 CO -0.04 -0.64 1.91 -0.67 0.23 0.00 0.00 176.35 177.13 1pj9 n ASP 282 N 3.28 4.57 0.11 2.29 -0.08 0.13 -4.67 116.55 122.19 1pj9 n ASP 282 Ca 0.09 -2.91 0.02 0.00 -1.51 0.00 0.00 54.79 50.48 1pj9 n ASP 282 Cb 0.42 -1.67 0.36 0.00 2.34 0.00 0.00 41.12 42.56 1pj9 n ASP 282 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 1pj9 h PHE 283 N 6.76 0.26 -0.57 -0.67 -1.00 -1.85 -0.99 116.94 118.88 1pj9 h PHE 283 Ca 0.48 -0.04 0.00 0.00 2.81 0.00 0.00 57.97 61.23 1pj9 h PHE 283 Cb 0.76 -0.07 -0.03 0.00 3.61 0.00 0.00 35.95 40.22 1pj9 h PHE 283 CO 1.39 0.41 0.37 -0.09 -1.61 0.00 0.00 178.31 178.78 1pj9 h ARG 284 N 0.23 0.75 0.01 1.51 2.43 -1.87 0.26 114.38 117.70 1pj9 h ARG 284 Ca 0.04 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1pj9 h ARG 284 Cb 0.45 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1pj9 h ARG 284 CO 0.03 0.51 -0.01 0.35 -1.51 0.00 0.00 179.97 179.34 1pj9 h PHE 285 N 0.77 -0.01 -0.15 2.20 3.04 -1.85 -2.56 116.94 118.37 1pj9 h PHE 285 Ca 0.21 -0.00 0.02 0.00 3.98 0.00 0.00 57.97 62.17 1pj9 h PHE 285 Cb -0.07 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 38.43 1pj9 h PHE 285 CO -0.03 0.29 0.03 0.00 -2.02 0.00 0.00 178.31 176.58 1pj9 h ALA 286 N 0.66 0.15 -0.78 2.41 0.00 -0.89 -0.88 119.26 119.93 1pj9 h ALA 286 Ca -0.00 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1pj9 h ALA 286 Cb 0.31 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1pj9 h ALA 286 CO 0.00 -0.41 0.34 1.96 0.00 0.00 0.00 179.25 181.14 1pj9 h GLN 287 N 0.10 1.15 -0.41 0.00 1.08 -0.55 -1.52 115.11 114.96 1pj9 h GLN 287 Ca 0.07 -0.19 -0.14 0.00 -1.45 0.00 0.00 58.65 56.94 1pj9 h GLN 287 Cb 0.06 -0.20 -0.01 0.00 -0.05 0.00 0.00 27.48 27.28 1pj9 h GLN 287 CO -0.09 0.91 -0.29 -0.22 -0.95 0.00 0.00 178.83 178.20 1pj9 h LYS 288 N 1.13 0.88 -0.85 1.46 1.63 -1.24 -1.56 116.57 118.02 1pj9 h LYS 288 Ca 0.26 -0.41 -0.01 0.00 -0.85 0.00 0.00 60.65 59.65 1pj9 h LYS 288 Cb 0.17 -0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 31.74 1pj9 h LYS 288 CO -0.03 1.05 0.49 0.28 -3.45 0.00 0.00 179.45 177.80 1pj9 h VAL 289 N 0.75 1.24 -0.57 2.00 2.07 -0.82 -0.84 116.25 120.07 1pj9 h VAL 289 Ca 0.08 -0.56 -0.11 0.00 0.82 0.00 0.00 66.70 66.93 1pj9 h VAL 289 Cb 0.85 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 1pj9 h VAL 289 CO 0.07 0.26 -0.07 0.03 0.02 0.00 0.00 177.57 177.89 1pj9 h ARG 290 N 1.18 1.06 -0.55 1.57 3.08 -1.09 0.50 114.38 120.12 1pj9 h ARG 290 Ca 0.30 -0.37 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 1pj9 h ARG 290 Cb -0.01 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 29.93 1pj9 h ARG 290 CO -0.05 1.07 0.33 1.96 -1.07 0.00 0.00 179.97 182.21 1pj9 h GLN 291 N 0.95 0.75 0.10 0.04 4.20 -0.78 0.37 115.11 120.73 1pj9 h GLN 291 Ca 0.15 -0.07 -0.19 0.00 0.06 0.00 0.00 58.65 58.61 1pj9 h GLN 291 Cb 0.63 -0.16 0.02 0.00 0.30 0.00 0.00 27.48 28.28 1pj9 h GLN 291 CO 0.04 0.54 -0.79 0.28 -0.67 0.00 0.00 178.83 178.23 1pj9 h VAL 292 N 0.74 1.46 0.00 -0.54 2.07 -1.03 0.64 116.25 119.59 1pj9 h VAL 292 Ca 0.20 -2.38 -0.19 0.00 0.82 0.00 0.00 66.70 65.14 1pj9 h VAL 292 Cb -0.02 2.96 -0.04 0.00 -1.52 0.00 0.00 31.29 32.67 1pj9 h VAL 292 CO -0.04 0.68 -2.16 0.49 0.02 0.00 0.00 177.57 176.57 1pj9 n PHE 293 N -4.12 0.06 -0.07 1.57 3.72 0.15 -4.47 117.46 114.29 1pj9 n PHE 293 Ca -0.13 0.02 -0.13 0.00 -0.05 0.00 0.00 57.45 57.16 1pj9 n PHE 293 Cb 0.79 -0.78 -0.04 0.00 -0.94 0.00 0.00 39.48 38.51 1pj9 n PHE 293 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 1pj9 n ARG 294 N -2.54 0.42 0.00 -1.08 0.63 0.00 -4.81 116.66 109.28 1pj9 n ARG 294 Ca -0.19 0.17 0.12 0.00 -0.92 0.00 0.00 57.85 57.03 1pj9 n ARG 294 Cb 0.88 -1.22 0.09 0.00 0.45 0.00 0.00 32.46 32.66 1pj9 n ARG 294 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1pj9 n ASP 295 N -4.13 1.98 -3.79 6.15 8.00 0.11 -4.99 116.55 119.87 1pj9 n ASP 295 Ca -0.22 -1.48 -0.26 0.00 0.71 0.00 0.00 54.79 53.55 1pj9 n ASP 295 Cb 0.54 0.34 0.03 0.00 -0.02 0.00 0.00 41.12 42.02 1pj9 n ASP 295 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1pj9 n ASN 296 N 0.06 -3.23 -0.55 -2.24 5.15 -0.05 -4.89 115.26 109.52 1pj9 n ASN 296 Ca 0.11 -0.78 0.06 0.00 -0.60 0.00 0.00 54.58 53.37 1pj9 n ASN 296 Cb 0.46 -4.05 0.07 0.00 -0.53 0.00 0.00 39.78 35.73 1pj9 n ASN 296 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1pj9 n THR 297 N -4.52 0.13 -3.52 -0.44 -2.24 0.02 -5.00 114.28 98.71 1pj9 n THR 297 Ca -0.12 -0.56 -0.11 0.00 -2.27 0.00 0.00 64.05 60.99 1pj9 n THR 297 Cb 0.60 1.17 -0.02 0.00 -2.10 0.00 0.00 70.33 69.98 1pj9 n THR 297 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1pj9 s ASP 298 N -1.07 -0.49 0.00 3.42 -1.08 -1.20 -4.98 116.67 111.27 1pj9 s ASP 298 Ca 0.17 -0.14 0.00 0.00 -0.52 0.00 0.00 52.55 52.05 1pj9 s ASP 298 Cb 0.11 0.62 0.00 0.00 -1.46 0.00 0.00 42.92 42.19 1pj9 s ASP 298 CO 0.16 -1.04 0.00 -0.46 0.52 0.00 0.00 175.17 174.35 1pj9 n ASN 299 N -0.39 1.27 0.28 -0.34 0.23 -1.26 -4.00 115.26 111.05 1pj9 n ASN 299 Ca -0.14 -0.96 0.13 0.00 -0.53 0.00 0.00 54.58 53.08 1pj9 n ASN 299 Cb 0.64 0.00 0.80 0.00 -2.08 0.00 0.00 39.78 39.14 1pj9 n ASN 299 CO 0.00 0.00 0.00 0.24 -0.93 0.00 0.00 177.26 176.57 1pj9 h MET 300 N 0.00 0.00 -0.23 -3.83 2.86 -1.51 -0.94 114.93 111.28 1pj9 h MET 300 Ca 0.00 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.57 1pj9 h MET 300 Cb 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1pj9 h MET 300 CO 0.00 0.04 -0.17 1.88 1.06 0.00 0.00 176.91 179.73 1pj9 h TYR 301 N 0.00 0.43 -0.04 -0.22 0.05 -1.83 0.21 116.97 115.57 1pj9 h TYR 301 Ca -0.00 -0.07 -0.17 0.00 0.05 0.00 0.00 58.73 58.54 1pj9 h TYR 301 Cb 0.11 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 37.72 1pj9 h TYR 301 CO 0.00 0.55 -0.73 0.78 -1.05 0.00 0.00 178.16 177.71 1pj9 h GLY 302 N 0.92 0.28 0.80 3.88 0.00 -1.57 -0.62 103.07 106.77 1pj9 h GLY 302 Ca 0.07 -0.41 -0.05 0.00 0.00 0.00 0.00 47.33 46.93 1pj9 h GLY 302 CO 0.03 0.37 -0.09 -2.00 0.00 0.00 0.00 176.54 174.85 1pj9 h LEU 303 N 0.17 0.42 -0.50 3.11 5.85 -0.98 -1.97 115.31 121.41 1pj9 h LEU 303 Ca -0.03 -0.41 0.01 0.00 0.84 0.00 0.00 57.88 58.30 1pj9 h LEU 303 Cb 1.30 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 1pj9 h LEU 303 CO 0.12 0.73 0.32 0.50 -0.34 0.00 0.00 178.44 179.77 1pj9 h LYS 304 N 0.11 0.64 -0.94 1.25 3.64 -0.53 -1.72 116.57 119.02 1pj9 h LYS 304 Ca 0.04 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1pj9 h LYS 304 Cb 0.57 -0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.20 1pj9 h LYS 304 CO 0.03 0.42 0.62 0.00 -2.27 0.00 0.00 179.45 178.25 1pj9 h ALA 305 N 1.20 1.34 -0.57 5.00 0.00 -1.03 -0.79 119.26 124.41 1pj9 h ALA 305 Ca 0.19 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1pj9 h ALA 305 Cb -0.05 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.35 1pj9 h ALA 305 CO -0.06 0.61 0.06 1.98 0.00 0.00 0.00 179.25 181.84 1pj9 h MET 306 N 1.26 0.98 -0.20 0.00 1.85 -0.92 0.15 114.93 118.05 1pj9 h MET 306 Ca 0.35 -0.28 -0.02 0.00 -0.61 0.00 0.00 59.70 59.13 1pj9 h MET 306 Cb -0.13 -0.10 -0.01 0.00 0.43 0.00 0.00 31.60 31.79 1pj9 h MET 306 CO -0.08 0.95 0.03 -0.07 -0.40 0.00 0.00 176.91 177.33 1pj9 h LEU 307 N 0.87 0.32 -0.40 3.39 3.38 -0.72 -0.20 115.31 121.95 1pj9 h LEU 307 Ca 0.17 -0.27 -0.17 0.00 0.09 0.00 0.00 57.88 57.70 1pj9 h LEU 307 Cb 0.47 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1pj9 h LEU 307 CO 0.02 0.51 -0.48 -0.33 0.09 0.00 0.00 178.44 178.25 1pj9 h GLU 308 N 0.12 0.83 -0.04 1.13 5.08 -1.12 -2.14 114.58 118.43 1pj9 h GLU 308 Ca 0.06 -0.48 -0.01 0.00 -1.00 0.00 0.00 59.36 57.93 1pj9 h GLU 308 Cb 0.33 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 1pj9 h GLU 308 CO 0.00 1.12 -0.00 0.78 -1.00 0.00 0.00 179.01 179.91 1pj9 h GLY 309 N 0.81 0.08 1.63 -3.84 0.00 -0.66 -2.70 103.07 98.39 1pj9 h GLY 309 Ca 0.03 -0.06 -0.05 0.00 0.00 0.00 0.00 47.33 47.25 1pj9 h GLY 309 CO 0.11 0.06 -0.02 1.48 0.00 0.00 0.00 176.54 178.16 1pj9 h SER 310 N -0.23 0.44 0.21 0.19 4.64 -1.08 0.21 113.55 117.93 1pj9 h SER 310 Ca 0.01 -0.08 -0.05 0.00 -0.47 0.00 0.00 61.79 61.21 1pj9 h SER 310 Cb 0.34 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 1pj9 h SER 310 CO 0.00 0.52 -0.21 0.00 -0.87 0.00 0.00 176.83 176.27 1pj9 h ALA 311 N 1.54 1.63 0.12 5.18 0.00 -1.31 -1.59 119.26 124.83 1pj9 h ALA 311 Ca 0.10 -0.20 -0.33 0.00 0.00 0.00 0.00 54.91 54.48 1pj9 h ALA 311 Cb 0.33 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1pj9 h ALA 311 CO 0.01 0.28 -1.70 0.00 0.00 0.00 0.00 179.25 177.83 1pj9 h ALA 312 N 1.78 0.35 0.02 0.00 0.00 -0.92 -3.39 119.26 117.09 1pj9 h ALA 312 Ca -0.00 -1.23 -0.22 0.00 0.00 0.00 0.00 54.91 53.47 1pj9 h ALA 312 Cb 0.39 0.44 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1pj9 h ALA 312 CO 0.03 1.21 -0.96 -0.44 0.00 0.00 0.00 179.25 179.09 1pj9 h ASP 313 N 0.07 0.36 -3.52 0.00 3.32 -0.43 -3.43 116.42 112.79 1pj9 h ASP 313 Ca -0.31 -0.31 -0.61 0.00 0.02 0.00 0.00 57.03 55.82 1pj9 h ASP 313 Cb 2.04 -0.11 -0.12 0.00 0.22 0.00 0.00 39.33 41.35 1pj9 h ASP 313 CO 0.14 1.13 -0.21 -0.31 -1.72 0.00 0.00 179.24 178.27 1pj9 s TYR 314 N -3.12 3.35 0.26 4.55 2.02 -0.62 -4.86 117.35 118.93 1pj9 s TYR 314 Ca -0.04 0.57 -0.05 0.00 -0.37 0.00 0.00 57.07 57.18 1pj9 s TYR 314 Cb 0.09 -2.53 0.32 0.00 -0.40 0.00 0.00 41.96 39.44 1pj9 s TYR 314 CO 0.85 -0.05 1.92 0.00 -1.57 0.00 0.00 175.55 176.70 1pj9 h ALA 315 N 7.52 1.29 -2.50 3.71 0.00 -1.88 -3.20 119.26 124.20 1pj9 h ALA 315 Ca -0.35 -0.09 -0.60 0.00 0.00 0.00 0.00 54.91 53.87 1pj9 h ALA 315 Cb 1.16 -0.36 -0.41 0.00 0.00 0.00 0.00 17.79 18.18 1pj9 h ALA 315 CO 0.70 0.62 -0.66 1.04 0.00 0.00 0.00 179.25 180.96 1pj9 n GLN 316 N -4.37 1.96 0.29 0.00 3.00 -1.26 -4.91 117.38 112.08 1pj9 n GLN 316 Ca 0.10 -4.38 0.14 0.00 -0.01 0.00 0.00 57.00 52.85 1pj9 n GLN 316 Cb 0.05 -2.13 0.85 0.00 0.00 0.00 0.00 30.24 29.01 1pj9 n GLN 316 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.06 176.82 1pj9 h VAL 317 N 3.59 0.58 0.00 5.09 3.04 -1.86 -1.48 116.25 125.22 1pj9 h VAL 317 Ca 0.17 -0.13 0.00 0.00 -1.01 0.00 0.00 66.70 65.73 1pj9 h VAL 317 Cb 0.73 1.08 0.00 0.00 -2.01 0.00 0.00 31.29 31.09 1pj9 h VAL 317 CO 0.73 0.03 0.00 0.47 -1.01 0.00 0.00 177.57 177.79 1pj9 n ASP 318 N -3.86 0.00 -0.69 3.17 8.00 -1.26 -2.13 116.55 119.78 1pj9 n ASP 318 Ca -0.03 0.12 0.11 0.00 0.71 0.00 0.00 54.79 55.71 1pj9 n ASP 318 Cb 0.12 -0.33 0.05 0.00 -0.02 0.00 0.00 41.12 40.94 1pj9 n ASP 318 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1pj9 n ASP 319 N -1.33 2.42 -4.73 -2.24 8.00 -0.55 -4.01 116.55 114.12 1pj9 n ASP 319 Ca 0.08 -1.71 -0.41 0.00 0.71 0.00 0.00 54.79 53.45 1pj9 n ASP 319 Cb 0.15 0.28 -0.04 0.00 -0.02 0.00 0.00 41.12 41.49 1pj9 n ASP 319 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1pj9 s GLN 320 N -2.28 4.66 -0.46 -1.24 -1.52 -0.91 -4.49 119.66 113.43 1pj9 s GLN 320 Ca 0.23 1.51 -0.21 0.00 -1.95 0.00 0.00 55.36 54.94 1pj9 s GLN 320 Cb 0.19 -3.36 0.03 0.00 -0.22 0.00 0.00 33.01 29.65 1pj9 s GLN 320 CO 0.46 0.15 0.68 0.08 -0.25 0.00 0.00 175.29 176.41 1pj9 s VAL 321 N 0.06 4.78 0.51 1.09 1.01 -0.62 -0.80 120.40 126.45 1pj9 s VAL 321 Ca 0.48 0.04 -0.10 0.00 0.00 0.00 0.00 61.98 62.41 1pj9 s VAL 321 Cb -0.25 -4.26 -0.05 0.00 0.00 0.00 0.00 36.38 31.82 1pj9 s VAL 321 CO 0.31 -0.69 0.89 0.42 0.00 0.00 0.00 175.10 176.02 1pj9 s THR 322 N 2.92 4.77 0.04 3.92 -4.23 0.05 0.22 115.64 123.32 1pj9 s THR 322 Ca 0.22 0.65 -0.28 0.00 -1.18 0.00 0.00 61.69 61.11 1pj9 s THR 322 Cb -0.15 -3.81 0.09 0.00 1.34 0.00 0.00 72.50 69.97 1pj9 s THR 322 CO 0.18 -0.84 1.03 0.72 -0.54 0.00 0.00 174.62 175.17 1pj9 s PHE 323 N -2.77 -0.17 -0.20 3.99 -0.71 -1.26 -0.43 117.98 116.41 1pj9 s PHE 323 Ca 0.52 -0.02 0.06 0.00 -1.04 0.00 0.00 56.93 56.45 1pj9 s PHE 323 Cb -0.10 0.58 -0.07 0.00 -1.21 0.00 0.00 43.02 42.22 1pj9 s PHE 323 CO 0.43 -0.57 0.21 0.44 -1.34 0.00 0.00 175.22 174.39 1pj9 n ILE 324 N -0.37 0.00 -3.77 -4.49 -5.35 -1.26 -3.92 119.36 100.21 1pj9 n ILE 324 Ca -0.07 -0.32 -0.02 0.00 -0.27 0.00 0.00 62.75 62.08 1pj9 n ILE 324 Cb 0.61 0.86 -0.00 0.00 -1.74 0.00 0.00 39.64 39.37 1pj9 n ILE 324 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 1pj9 s ASP 325 N -1.77 -0.09 0.00 7.28 1.47 -1.26 -4.67 116.67 117.63 1pj9 s ASP 325 Ca 0.01 -0.40 0.00 0.00 1.18 0.00 0.00 52.55 53.34 1pj9 s ASP 325 Cb 0.04 0.40 0.00 0.00 -0.34 0.00 0.00 42.92 43.02 1pj9 s ASP 325 CO 0.23 -0.76 0.00 -0.46 0.68 0.00 0.00 175.17 174.86 1pj9 n ASN 326 N -0.69 0.00 0.00 2.11 0.23 -1.26 -4.54 115.26 111.11 1pj9 n ASN 326 Ca -0.05 -0.97 0.08 0.00 -0.53 0.00 0.00 54.58 53.11 1pj9 n ASN 326 Cb 0.61 0.00 0.41 0.00 -2.08 0.00 0.00 39.78 38.72 1pj9 n ASN 326 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1pj9 n HIS 327 N 0.00 0.00 -0.51 -2.53 1.44 -1.26 -2.52 115.22 109.84 1pj9 n HIS 327 Ca 0.00 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.77 1pj9 n HIS 327 Cb 0.00 -0.31 0.15 0.00 0.12 0.00 0.00 29.99 29.95 1pj9 n HIS 327 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1pj9 n ASP 328 N -1.31 2.88 -4.16 4.39 8.00 -1.26 -4.56 116.55 120.53 1pj9 n ASP 328 Ca 0.07 -2.46 -0.12 0.00 0.71 0.00 0.00 54.79 53.00 1pj9 n ASP 328 Cb 0.14 -0.30 -0.10 0.00 -0.02 0.00 0.00 41.12 40.84 1pj9 n ASP 328 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1pj9 s MET 329 N -1.80 0.81 0.40 -1.24 -1.94 -1.05 -4.89 119.30 109.59 1pj9 s MET 329 Ca 0.25 -1.25 -0.26 0.00 -1.71 0.00 0.00 55.69 52.71 1pj9 s MET 329 Cb 0.18 -0.28 -0.09 0.00 2.01 0.00 0.00 34.83 36.65 1pj9 s MET 329 CO 0.08 0.01 1.32 -1.21 -0.01 0.00 0.00 175.02 175.21 1pj9 s GLU 330 N -3.44 3.99 0.31 2.03 2.02 -1.26 -4.58 118.70 117.78 1pj9 s GLU 330 Ca 0.09 2.19 -0.28 0.00 0.02 0.00 0.00 54.97 56.99 1pj9 s GLU 330 Cb 0.02 -2.79 -0.13 0.00 0.10 0.00 0.00 34.13 31.33 1pj9 s GLU 330 CO -0.03 -0.48 1.07 0.54 0.02 0.00 0.00 175.26 176.38 1pj9 n ARG 331 N 0.18 1.54 -0.14 1.61 5.12 0.33 -4.79 116.66 120.51 1pj9 n ARG 331 Ca 0.03 0.54 -0.05 0.00 -1.93 0.00 0.00 57.85 56.44 1pj9 n ARG 331 Cb 0.43 -1.98 0.03 0.00 -1.16 0.00 0.00 32.46 29.79 1pj9 n ARG 331 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 1pj9 h PHE 332 N 2.08 0.38 -3.07 -1.55 3.04 -1.85 -3.40 116.94 112.57 1pj9 h PHE 332 Ca -0.42 0.02 -0.57 0.00 3.98 0.00 0.00 57.97 60.98 1pj9 h PHE 332 Cb 1.33 -0.11 -0.05 0.00 2.56 0.00 0.00 35.95 39.68 1pj9 h PHE 332 CO 0.48 0.19 0.89 -1.58 -2.02 0.00 0.00 178.31 176.26 1pj9 s HIS 333 N -6.14 2.96 0.13 0.41 2.46 -1.26 -4.97 115.29 108.88 1pj9 s HIS 333 Ca -0.13 1.10 -0.23 0.00 0.47 0.00 0.00 55.06 56.27 1pj9 s HIS 333 Cb 0.13 -3.59 -0.08 0.00 -0.13 0.00 0.00 32.58 28.91 1pj9 s HIS 333 CO 0.73 -1.30 0.70 0.00 -2.47 0.00 0.00 174.74 172.40 1pj9 s ALA 334 N 3.69 3.50 0.31 1.58 0.00 -1.26 -4.30 121.76 125.29 1pj9 s ALA 334 Ca 0.51 0.25 0.09 0.00 0.00 0.00 0.00 51.96 52.80 1pj9 s ALA 334 Cb -0.17 -2.84 0.89 0.00 0.00 0.00 0.00 23.12 20.99 1pj9 s ALA 334 CO 0.15 0.33 1.69 1.03 0.00 0.00 0.00 175.76 178.96 1pj9 h SER 335 N 4.39 0.43 -0.63 0.00 0.87 -1.95 0.27 113.55 116.94 1pj9 h SER 335 Ca -0.48 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.25 1pj9 h SER 335 Cb 1.21 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.30 1pj9 h SER 335 CO 0.65 -0.04 0.00 -0.46 -0.53 0.00 0.00 176.83 176.45 1pj9 n ASN 336 N -5.03 5.20 -4.94 6.23 6.94 -1.26 -4.98 115.26 117.42 1pj9 n ASN 336 Ca 0.26 -2.64 -0.25 0.00 -0.02 0.00 0.00 54.58 51.94 1pj9 n ASN 336 Cb 0.79 -0.63 -0.02 0.00 -2.36 0.00 0.00 39.78 37.56 1pj9 n ASN 336 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1pj9 s ALA 337 N -2.21 3.77 0.06 -2.53 0.00 0.08 -5.05 121.76 115.88 1pj9 s ALA 337 Ca 0.53 -0.92 -0.31 0.00 0.00 0.00 0.00 51.96 51.27 1pj9 s ALA 337 Cb 0.37 -2.02 -0.06 0.00 0.00 0.00 0.00 23.12 21.41 1pj9 s ALA 337 CO 0.22 0.18 1.32 1.21 0.00 0.00 0.00 175.76 178.69 1pj9 s ASN 338 N -3.70 6.93 0.60 0.00 3.84 -1.26 -4.88 114.94 116.47 1pj9 s ASN 338 Ca 0.39 2.14 0.40 0.00 0.21 0.00 0.00 52.86 55.99 1pj9 s ASN 338 Cb -0.10 -2.58 2.04 0.00 -0.55 0.00 0.00 41.25 40.06 1pj9 s ASN 338 CO 0.32 -0.61 2.20 0.03 -2.79 0.00 0.00 177.10 176.26 1pj9 h ARG 339 N 7.11 0.00 0.00 0.43 3.08 -1.96 -2.53 114.38 120.50 1pj9 h ARG 339 Ca -0.40 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.62 1pj9 h ARG 339 Cb 1.20 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.25 1pj9 h ARG 339 CO 0.86 0.00 -0.14 -0.09 -1.07 0.00 0.00 179.97 179.53 1pj9 h ARG 340 N 0.00 0.00 -0.34 0.04 9.65 -1.99 -2.11 114.38 119.63 1pj9 h ARG 340 Ca 0.00 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1pj9 h ARG 340 Cb 0.13 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.69 1pj9 h ARG 340 CO 0.00 0.14 0.21 0.87 2.80 0.00 0.00 179.97 183.99 1pj9 h LYS 341 N 0.00 0.46 -0.44 0.20 1.57 -1.77 0.49 116.57 117.08 1pj9 h LYS 341 Ca -0.00 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.67 1pj9 h LYS 341 Cb 0.26 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 1pj9 h LYS 341 CO 0.02 0.34 0.01 1.25 -0.57 0.00 0.00 179.45 180.50 1pj9 h LEU 342 N 0.45 0.75 -0.89 2.94 5.85 -1.64 -2.00 115.31 120.76 1pj9 h LEU 342 Ca 0.12 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.52 1pj9 h LEU 342 Cb -0.01 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 40.78 1pj9 h LEU 342 CO -0.02 0.86 0.48 -0.33 -0.34 0.00 0.00 178.44 179.09 1pj9 h GLU 343 N 0.61 1.25 -0.21 1.25 5.08 -1.06 -1.13 114.58 120.37 1pj9 h GLU 343 Ca 0.13 -0.15 -0.08 0.00 -1.00 0.00 0.00 59.36 58.25 1pj9 h GLU 343 Cb 0.47 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 1pj9 h GLU 343 CO 0.02 0.92 -0.17 1.96 -1.00 0.00 0.00 179.01 180.74 1pj9 h GLN 344 N 1.26 0.49 -0.85 2.33 4.20 -0.84 -1.68 115.11 120.01 1pj9 h GLN 344 Ca 0.31 -0.25 0.05 0.00 0.06 0.00 0.00 58.65 58.83 1pj9 h GLN 344 Cb 0.04 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.77 1pj9 h GLN 344 CO -0.05 0.81 0.56 0.00 -0.67 0.00 0.00 178.83 179.48 1pj9 h ALA 345 N 0.67 1.52 -0.13 3.87 0.00 -1.14 0.14 119.26 124.18 1pj9 h ALA 345 Ca 0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1pj9 h ALA 345 Cb 0.70 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1pj9 h ALA 345 CO 0.04 0.37 -0.03 -0.07 0.00 0.00 0.00 179.25 179.56 1pj9 h LEU 346 N 1.00 0.26 -0.99 0.00 3.38 -1.11 -1.22 115.31 116.62 1pj9 h LEU 346 Ca 0.35 -0.37 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1pj9 h LEU 346 Cb 0.12 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 1pj9 h LEU 346 CO -0.12 0.57 0.57 0.00 0.09 0.00 0.00 178.44 179.55 1pj9 h ALA 347 N 0.70 1.25 -0.14 1.53 0.00 -0.65 0.71 119.26 122.66 1pj9 h ALA 347 Ca 0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1pj9 h ALA 347 Cb 0.45 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1pj9 h ALA 347 CO 0.01 0.65 0.03 0.35 0.00 0.00 0.00 179.25 180.30 1pj9 h PHE 348 N 1.28 0.23 -0.51 0.00 3.57 -0.70 -2.73 116.94 118.09 1pj9 h PHE 348 Ca 0.34 -0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.77 1pj9 h PHE 348 Cb -0.07 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.58 1pj9 h PHE 348 CO 0.00 0.38 0.18 1.15 -2.23 0.00 0.00 178.31 177.79 1pj9 h THR 349 N 0.02 1.22 0.00 4.41 2.02 -0.81 -1.85 112.91 117.93 1pj9 h THR 349 Ca 0.04 -0.72 -0.02 0.00 0.77 0.00 0.00 66.41 66.49 1pj9 h THR 349 Cb 0.26 0.73 -0.00 0.00 -1.74 0.00 0.00 68.15 67.40 1pj9 h THR 349 CO 0.00 0.27 -0.08 -0.07 0.37 0.00 0.00 175.52 176.01 1pj9 h LEU 350 N 0.69 0.00 -1.74 2.58 3.38 -0.84 -2.85 115.31 116.52 1pj9 h LEU 350 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1pj9 h LEU 350 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1pj9 h LEU 350 CO -0.01 0.08 0.00 0.35 0.09 0.00 0.00 178.44 178.95 1pj9 n THR 351 N -3.41 0.15 -2.97 0.22 -2.24 -1.03 -4.85 114.28 100.14 1pj9 n THR 351 Ca -0.01 -0.57 -0.21 0.00 -2.27 0.00 0.00 64.05 60.98 1pj9 n THR 351 Cb 0.24 1.18 0.02 0.00 -2.10 0.00 0.00 70.33 69.67 1pj9 n THR 351 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1pj9 s SER 352 N -1.16 5.67 0.81 3.42 0.01 -0.71 -4.90 113.70 116.83 1pj9 s SER 352 Ca 0.19 0.03 -0.12 0.00 1.31 0.00 0.00 55.95 57.35 1pj9 s SER 352 Cb 0.12 -1.18 0.08 0.00 0.21 0.00 0.00 66.02 65.26 1pj9 s SER 352 CO 0.18 -0.79 1.16 0.00 0.41 0.00 0.00 173.24 174.20 1pj9 s ARG 353 N -4.53 1.73 0.00 12.44 3.03 -1.26 -4.82 118.95 125.54 1pj9 s ARG 353 Ca 0.51 1.58 0.00 0.00 2.03 0.00 0.00 55.73 59.85 1pj9 s ARG 353 Cb -0.10 -1.80 0.00 0.00 -1.03 0.00 0.00 34.95 32.02 1pj9 s ARG 353 CO 0.36 -2.11 0.00 0.41 -1.13 0.00 0.00 175.30 172.83 1pj9 n GLY 354 N 0.06 0.22 2.77 3.88 0.00 -1.26 -4.86 105.19 106.00 1pj9 n GLY 354 Ca 0.12 -1.85 -0.29 0.00 0.00 0.00 0.00 46.02 44.00 1pj9 n GLY 354 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pj9 s VAL 355 N 0.00 0.82 0.21 1.61 1.01 0.02 -4.57 120.40 119.50 1pj9 s VAL 355 Ca 0.00 -1.01 -0.30 0.00 0.00 0.00 0.00 61.98 60.67 1pj9 s VAL 355 Cb 0.00 -1.41 -0.09 0.00 0.00 0.00 0.00 36.38 34.88 1pj9 s VAL 355 CO 0.00 -0.39 1.38 -2.84 0.00 0.00 0.00 175.10 173.26 1pj9 s PRO 356 N 1.69 4.32 -0.07 2.72 0.02 -1.26 -0.77 135.00 141.65 1pj9 s PRO 356 Ca 0.03 2.17 0.03 0.00 0.02 0.00 0.00 61.00 63.24 1pj9 s PRO 356 Cb -0.17 -3.17 0.01 0.00 0.02 0.00 0.00 34.50 31.19 1pj9 s PRO 356 CO -0.15 -0.36 -0.15 0.00 -0.33 0.00 0.00 177.00 176.02 1pj9 s ALA 357 N 0.24 1.46 -0.19 -1.55 0.00 0.42 -0.44 121.76 121.70 1pj9 s ALA 357 Ca 0.59 -0.53 -0.02 0.00 0.00 0.00 0.00 51.96 52.00 1pj9 s ALA 357 Cb -0.39 -0.62 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 1pj9 s ALA 357 CO 0.39 0.14 -0.09 0.42 0.00 0.00 0.00 175.76 176.62 1pj9 s ILE 358 N 0.61 3.09 0.13 0.00 1.01 0.13 -4.36 121.20 121.81 1pj9 s ILE 358 Ca -0.15 -0.61 -0.31 0.00 0.00 0.00 0.00 60.65 59.58 1pj9 s ILE 358 Cb -0.16 -2.36 -0.08 0.00 0.01 0.00 0.00 42.46 39.87 1pj9 s ILE 358 CO 0.05 0.47 1.35 -0.47 0.00 0.00 0.00 174.94 176.34 1pj9 s TYR 359 N 1.09 3.27 0.28 3.97 5.04 -1.26 0.31 117.35 130.05 1pj9 s TYR 359 Ca 0.00 1.06 -0.28 0.00 -2.44 0.00 0.00 57.07 55.41 1pj9 s TYR 359 Cb -0.15 -3.63 -0.14 0.00 0.35 0.00 0.00 41.96 38.39 1pj9 s TYR 359 CO -0.02 -2.13 0.99 2.48 -1.34 0.00 0.00 175.55 175.53 1pj9 n TYR 360 N 3.59 1.16 0.00 4.97 4.11 -0.01 -1.83 117.16 129.15 1pj9 n TYR 360 Ca 0.10 0.72 0.00 0.00 -0.00 0.00 0.00 57.90 58.72 1pj9 n TYR 360 Cb 0.43 -2.23 0.00 0.00 -0.00 0.00 0.00 39.34 37.53 1pj9 n TYR 360 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1pj9 n GLY 361 N 1.32 2.04 0.33 -7.48 0.00 -1.26 -4.89 105.19 95.25 1pj9 n GLY 361 Ca 0.10 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.14 1pj9 n GLY 361 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1pj9 h THR 362 N 0.00 1.02 0.00 2.61 2.02 -1.71 0.20 112.91 117.04 1pj9 h THR 362 Ca 0.00 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 66.84 1pj9 h THR 362 Cb 0.00 -0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.36 1pj9 h THR 362 CO 0.00 0.18 0.00 -1.84 0.37 0.00 0.00 175.52 174.23 1pj9 n GLU 363 N -4.62 0.06 -0.32 6.66 0.00 -1.26 -1.46 120.64 119.70 1pj9 n GLU 363 Ca 0.14 0.24 0.08 0.00 0.00 0.00 0.00 57.16 57.62 1pj9 n GLU 363 Cb 0.21 -1.50 0.24 0.00 0.00 0.00 0.00 31.44 30.38 1pj9 n GLU 363 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1pj9 n GLN 364 N -1.43 2.99 -3.28 3.44 1.13 0.04 -4.06 117.38 116.21 1pj9 n GLN 364 Ca 0.04 -2.42 -0.22 0.00 -1.94 0.00 0.00 57.00 52.46 1pj9 n GLN 364 Cb 0.13 -1.50 0.06 0.00 0.11 0.00 0.00 30.24 29.04 1pj9 n GLN 364 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1pj9 n TYR 365 N 0.75 -2.35 -2.06 1.08 4.01 -0.54 -4.95 117.16 113.11 1pj9 n TYR 365 Ca 0.18 0.75 -0.41 0.00 -0.16 0.00 0.00 57.90 58.26 1pj9 n TYR 365 Cb 0.60 -4.64 -0.02 0.00 -0.31 0.00 0.00 39.34 34.98 1pj9 n TYR 365 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 1pj9 s MET 366 N -5.97 4.31 0.18 -0.72 -1.94 -1.12 -4.98 119.30 109.06 1pj9 s MET 366 Ca 0.43 2.28 0.11 0.00 -1.71 0.00 0.00 55.69 56.80 1pj9 s MET 366 Cb -0.19 -3.06 -0.04 0.00 2.01 0.00 0.00 34.83 33.54 1pj9 s MET 366 CO 0.54 -0.27 -0.23 -1.12 -0.01 0.00 0.00 175.02 173.93 1pj9 s SER 367 N -0.30 3.24 0.00 3.03 0.01 -1.26 -4.41 113.70 114.01 1pj9 s SER 367 Ca 0.51 -0.85 0.00 0.00 1.31 0.00 0.00 55.95 56.92 1pj9 s SER 367 Cb -0.41 -0.23 0.00 0.00 0.21 0.00 0.00 66.02 65.59 1pj9 s SER 367 CO 0.53 0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.88 1pj9 n GLY 368 N 0.33 2.49 0.00 3.44 0.00 -1.26 -4.88 105.19 105.31 1pj9 n GLY 368 Ca -0.13 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1pj9 n GLY 368 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pj9 n GLY 369 N -0.52 -0.59 3.72 -0.02 0.00 -1.26 -0.52 105.19 106.00 1pj9 n GLY 369 Ca 0.00 -1.53 -0.30 0.00 0.00 0.00 0.00 46.02 44.19 1pj9 n GLY 369 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pj9 s THR 370 N 0.00 2.70 -0.02 2.61 -4.23 -1.26 -2.47 115.64 112.97 1pj9 s THR 370 Ca 0.00 0.23 -0.33 0.00 -1.18 0.00 0.00 61.69 60.41 1pj9 s THR 370 Cb 0.00 -2.70 -0.16 0.00 1.34 0.00 0.00 72.50 70.97 1pj9 s THR 370 CO 0.00 -0.30 0.89 -0.67 -0.54 0.00 0.00 174.62 174.00 1pj9 n ASP 371 N -3.86 0.04 -1.04 3.99 2.03 -1.26 -1.55 116.55 114.90 1pj9 n ASP 371 Ca 0.07 0.94 0.11 0.00 0.52 0.00 0.00 54.79 56.43 1pj9 n ASP 371 Cb 0.55 -0.74 0.26 0.00 -0.72 0.00 0.00 41.12 40.47 1pj9 n ASP 371 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1pj9 n PRO 372 N 1.32 2.34 0.09 -0.67 -0.04 -1.26 -4.94 135.00 131.85 1pj9 n PRO 372 Ca 0.17 -2.05 0.08 0.00 -0.04 0.00 0.00 63.50 61.66 1pj9 n PRO 372 Cb 0.06 -1.48 0.38 0.00 -0.04 0.00 0.00 33.50 32.42 1pj9 n PRO 372 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1pj9 n ASP 373 N 1.22 0.37 -0.89 3.54 8.00 -0.59 -1.08 116.55 127.11 1pj9 n ASP 373 Ca 0.19 0.64 0.10 0.00 0.71 0.00 0.00 54.79 56.43 1pj9 n ASP 373 Cb 0.53 -0.70 0.27 0.00 -0.02 0.00 0.00 41.12 41.20 1pj9 n ASP 373 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1pj9 n ASN 374 N -1.96 2.64 -2.04 -2.24 0.23 -1.03 -4.17 115.26 106.68 1pj9 n ASN 374 Ca 0.00 -1.91 -0.22 0.00 -0.53 0.00 0.00 54.58 51.93 1pj9 n ASN 374 Cb 0.09 -0.24 0.02 0.00 -2.08 0.00 0.00 39.78 37.57 1pj9 n ASN 374 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1pj9 n ARG 375 N 0.95 3.49 -1.47 -3.83 1.74 -0.24 -4.87 116.66 112.42 1pj9 n ARG 375 Ca 0.18 -4.12 -0.30 0.00 -0.77 0.00 0.00 57.85 52.83 1pj9 n ARG 375 Cb 0.46 -2.23 0.09 0.00 -1.02 0.00 0.00 32.46 29.75 1pj9 n ARG 375 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1pj9 s ALA 376 N -3.60 2.28 0.29 7.54 0.00 -1.26 -4.88 121.76 122.13 1pj9 s ALA 376 Ca 0.50 -0.03 -0.29 0.00 0.00 0.00 0.00 51.96 52.13 1pj9 s ALA 376 Cb 0.40 -3.16 -0.10 0.00 0.00 0.00 0.00 23.12 20.26 1pj9 s ALA 376 CO 0.03 -1.67 1.32 0.50 0.00 0.00 0.00 175.76 175.95 1pj9 s ARG 377 N -5.05 4.36 0.10 0.00 3.52 -1.26 -4.89 118.95 115.72 1pj9 s ARG 377 Ca 0.60 2.18 -0.32 0.00 -0.13 0.00 0.00 55.73 58.07 1pj9 s ARG 377 Cb -0.15 -3.11 -0.12 0.00 -1.56 0.00 0.00 34.95 30.02 1pj9 s ARG 377 CO 0.55 -0.22 1.79 1.51 -0.81 0.00 0.00 175.30 178.12 1pj9 n ILE 378 N 1.44 0.31 0.43 4.11 3.06 -0.69 -4.87 119.36 123.15 1pj9 n ILE 378 Ca 0.02 -0.06 0.13 0.00 -2.50 0.00 0.00 62.75 60.35 1pj9 n ILE 378 Cb 0.42 -1.97 0.43 0.00 0.54 0.00 0.00 39.64 39.06 1pj9 n ILE 378 CO 0.00 0.00 0.00 1.55 -2.50 0.00 0.00 176.55 175.60 1pj9 h PRO 379 N 8.08 0.00 -2.77 9.51 0.13 -1.93 -3.47 132.00 141.55 1pj9 h PRO 379 Ca -0.46 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1pj9 h PRO 379 Cb 1.23 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.23 1pj9 h PRO 379 CO 0.94 0.00 0.24 0.45 -0.23 0.00 0.00 178.00 179.40 1pj9 s SER 380 N -4.96 -0.56 -0.31 1.44 0.15 -1.26 -5.03 113.70 103.16 1pj9 s SER 380 Ca 0.07 0.11 0.09 0.00 0.70 0.00 0.00 55.95 56.91 1pj9 s SER 380 Cb 0.10 0.57 0.46 0.00 -1.71 0.00 0.00 66.02 65.43 1pj9 s SER 380 CO 0.55 -0.87 1.16 0.49 1.20 0.00 0.00 173.24 175.76 1pj9 n PHE 381 N -0.17 2.66 -2.70 3.44 3.72 -1.26 -4.96 117.46 118.19 1pj9 n PHE 381 Ca -0.16 -2.38 -0.40 0.00 -0.05 0.00 0.00 57.45 54.45 1pj9 n PHE 381 Cb 0.63 -0.28 -0.05 0.00 -0.94 0.00 0.00 39.48 38.84 1pj9 n PHE 381 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1pj9 s SER 382 N -3.60 7.54 0.00 4.37 0.15 -1.26 -4.94 113.70 115.96 1pj9 s SER 382 Ca 0.47 1.93 0.23 0.00 0.70 0.00 0.00 55.95 59.29 1pj9 s SER 382 Cb 0.40 -2.60 0.43 0.00 -1.71 0.00 0.00 66.02 62.54 1pj9 s SER 382 CO -0.01 0.03 1.40 0.35 1.20 0.00 0.00 173.24 176.21 1pj9 n THR 383 N 1.99 0.29 1.15 6.45 -2.24 -1.26 -4.42 114.28 116.24 1pj9 n THR 383 Ca -0.00 -0.60 0.12 0.00 -2.27 0.00 0.00 64.05 61.31 1pj9 n THR 383 Cb 0.48 1.03 0.22 0.00 -2.10 0.00 0.00 70.33 69.95 1pj9 n THR 383 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1pj9 n SER 384 N 1.24 1.63 -4.76 3.42 7.64 -1.26 -4.48 113.62 117.04 1pj9 n SER 384 Ca 0.17 -1.29 -0.34 0.00 1.01 0.00 0.00 58.87 58.43 1pj9 n SER 384 Cb 0.56 0.25 0.04 0.00 -1.01 0.00 0.00 64.21 64.05 1pj9 n SER 384 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1pj9 s THR 385 N -2.41 3.06 0.29 0.44 -4.23 -1.26 -4.91 115.64 106.62 1pj9 s THR 385 Ca 0.24 0.55 0.00 0.00 -1.18 0.00 0.00 61.69 61.30 1pj9 s THR 385 Cb 0.19 -3.11 0.15 0.00 1.34 0.00 0.00 72.50 71.07 1pj9 s THR 385 CO 0.51 -0.24 1.83 0.74 -0.54 0.00 0.00 174.62 176.91 1pj9 h THR 386 N 0.39 1.22 -0.71 3.99 2.02 -1.92 -2.49 112.91 115.42 1pj9 h THR 386 Ca -0.48 -0.82 -0.03 0.00 0.77 0.00 0.00 66.41 65.85 1pj9 h THR 386 Cb 1.26 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 68.39 1pj9 h THR 386 CO 0.54 0.30 0.31 0.00 0.37 0.00 0.00 175.52 177.05 1pj9 h ALA 387 N 1.37 0.91 -0.62 6.16 0.00 -1.91 0.16 119.26 125.33 1pj9 h ALA 387 Ca 0.16 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1pj9 h ALA 387 Cb 0.32 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1pj9 h ALA 387 CO 0.00 0.50 0.33 -0.92 0.00 0.00 0.00 179.25 179.16 1pj9 h TYR 388 N 1.00 0.86 -0.27 0.00 5.03 -1.63 -2.09 116.97 119.86 1pj9 h TYR 388 Ca 0.24 -0.03 -0.07 0.00 2.58 0.00 0.00 58.73 61.45 1pj9 h TYR 388 Cb 0.16 -0.27 -0.02 0.00 1.55 0.00 0.00 36.73 38.15 1pj9 h TYR 388 CO 0.01 0.63 -0.14 1.96 -1.32 0.00 0.00 178.16 179.30 1pj9 h GLN 389 N 0.84 0.46 -0.20 1.82 4.20 -1.00 -0.26 115.11 120.97 1pj9 h GLN 389 Ca 0.22 -0.14 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 1pj9 h GLN 389 Cb 0.07 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 1pj9 h GLN 389 CO -0.03 0.60 0.09 0.28 -0.67 0.00 0.00 178.83 179.10 1pj9 h VAL 390 N 0.43 1.14 -0.37 -0.54 2.07 -0.48 -1.07 116.25 117.44 1pj9 h VAL 390 Ca 0.08 -0.42 -0.03 0.00 0.82 0.00 0.00 66.70 67.15 1pj9 h VAL 390 Cb 0.50 1.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 1pj9 h VAL 390 CO 0.03 0.14 0.12 0.40 0.02 0.00 0.00 177.57 178.28 1pj9 h ILE 391 N 0.19 1.21 -0.73 4.57 2.04 -1.16 -1.59 117.51 122.04 1pj9 h ILE 391 Ca 0.07 -0.70 0.07 0.00 1.00 0.00 0.00 64.86 65.30 1pj9 h ILE 391 Cb 0.14 0.96 -0.05 0.00 -0.74 0.00 0.00 36.82 37.13 1pj9 h ILE 391 CO -0.01 0.24 0.48 -0.61 0.00 0.00 0.00 178.15 178.26 1pj9 h GLN 392 N 0.46 0.72 0.04 2.37 4.15 -0.76 0.25 115.11 122.33 1pj9 h GLN 392 Ca 0.12 -0.04 -0.26 0.00 0.77 0.00 0.00 58.65 59.24 1pj9 h GLN 392 Cb 0.26 -0.16 -0.03 0.00 0.21 0.00 0.00 27.48 27.76 1pj9 h GLN 392 CO -0.00 0.48 -1.33 0.87 -1.93 0.00 0.00 178.83 176.92 1pj9 h LYS 393 N 0.74 0.07 0.01 1.69 1.57 -0.98 -3.41 116.57 116.26 1pj9 h LYS 393 Ca 0.32 -0.13 -0.37 0.00 -1.87 0.00 0.00 60.65 58.61 1pj9 h LYS 393 Cb 0.30 0.05 -0.07 0.00 0.08 0.00 0.00 32.23 32.59 1pj9 h LYS 393 CO -0.11 0.91 -2.34 1.28 -0.57 0.00 0.00 179.45 178.61 1pj9 n LEU 394 N -3.30 1.05 -0.22 2.94 4.77 -0.62 -4.52 117.00 117.10 1pj9 n LEU 394 Ca -0.09 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1pj9 n LEU 394 Cb 1.00 -0.00 0.12 0.00 -2.33 0.00 0.00 43.42 42.20 1pj9 n LEU 394 CO 0.48 0.63 1.01 0.00 -1.33 0.00 0.00 177.39 178.18 1pj9 h ALA 395 N 0.67 0.85 0.00 -1.18 0.00 -0.73 -1.31 119.26 117.56 1pj9 h ALA 395 Ca -0.53 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 1pj9 h ALA 395 Cb 2.12 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.93 1pj9 h ALA 395 CO 0.00 -0.15 -0.01 -1.35 0.00 0.00 0.00 179.25 177.74 1pj9 h PRO 396 N 0.47 0.00 0.00 0.00 0.11 -1.78 -2.26 132.00 128.54 1pj9 h PRO 396 Ca 0.32 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.40 1pj9 h PRO 396 Cb 0.38 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.48 1pj9 h PRO 396 CO -0.29 0.01 -0.13 -0.07 -0.21 0.00 0.00 178.00 177.30 1pj9 h LEU 397 N 0.00 0.00 -1.80 2.35 3.38 -1.46 -1.25 115.31 116.52 1pj9 h LEU 397 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1pj9 h LEU 397 Cb 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1pj9 h LEU 397 CO 0.00 0.13 -0.07 0.03 0.09 0.00 0.00 178.44 178.62 1pj9 h ARG 398 N 0.00 0.00 0.06 1.13 3.08 -1.52 0.41 114.38 117.53 1pj9 h ARG 398 Ca -0.00 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.76 1pj9 h ARG 398 Cb 0.27 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.29 1pj9 h ARG 398 CO 0.02 0.07 -1.56 0.87 -1.07 0.00 0.00 179.97 178.30 1pj9 h LYS 399 N 0.00 0.12 0.00 0.04 1.79 -1.33 -3.40 116.57 113.78 1pj9 h LYS 399 Ca -0.00 -0.20 -0.09 0.00 -2.18 0.00 0.00 60.65 58.18 1pj9 h LYS 399 Cb 0.41 0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.12 1pj9 h LYS 399 CO 0.01 1.10 -0.58 0.66 -1.08 0.00 0.00 179.45 179.55 1pj9 h SER 400 N -0.55 0.00 -3.61 0.86 4.64 -1.23 -3.42 113.55 110.24 1pj9 h SER 400 Ca -0.38 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.30 1pj9 h SER 400 Cb 1.61 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 63.30 1pj9 h SER 400 CO -0.08 0.39 -0.72 0.21 -0.87 0.00 0.00 176.83 175.76 1pj9 s ASN 401 N -6.24 4.56 0.34 4.97 3.84 0.14 -4.98 114.94 117.58 1pj9 s ASN 401 Ca 0.03 -2.11 0.23 0.00 0.21 0.00 0.00 52.86 51.22 1pj9 s ASN 401 Cb 0.07 -1.45 1.24 0.00 -0.55 0.00 0.00 41.25 40.56 1pj9 s ASN 401 CO 0.74 -0.38 1.70 1.55 -2.79 0.00 0.00 177.10 177.92 1pj9 h PRO 402 N 7.63 0.00 -0.44 0.43 0.13 -1.83 -0.92 132.00 137.01 1pj9 h PRO 402 Ca -0.06 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.98 1pj9 h PRO 402 Cb 1.01 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.12 1pj9 h PRO 402 CO 0.52 0.00 -0.07 0.00 -0.23 0.00 0.00 178.00 178.22 1pj9 h ALA 403 N 1.99 1.05 -0.01 -0.56 0.00 -1.83 0.17 119.26 120.08 1pj9 h ALA 403 Ca 0.00 -0.29 -0.20 0.00 0.00 0.00 0.00 54.91 54.42 1pj9 h ALA 403 Cb 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1pj9 h ALA 403 CO 0.00 0.58 -0.86 0.82 0.00 0.00 0.00 179.25 179.79 1pj9 h ILE 404 N 0.70 1.44 0.17 0.00 2.04 -1.46 0.25 117.51 120.65 1pj9 h ILE 404 Ca 0.13 -2.45 -0.31 0.00 1.00 0.00 0.00 64.86 63.23 1pj9 h ILE 404 Cb 0.53 2.37 0.03 0.00 -0.74 0.00 0.00 36.82 39.01 1pj9 h ILE 404 CO 0.03 0.72 -1.33 0.00 0.00 0.00 0.00 178.15 177.57 1pj9 h ALA 405 N 0.91 -0.03 0.00 1.87 0.00 -1.46 -3.41 119.26 117.14 1pj9 h ALA 405 Ca -0.05 -0.83 0.00 0.00 0.00 0.00 0.00 54.91 54.03 1pj9 h ALA 405 Cb 1.47 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1pj9 h ALA 405 CO 0.14 0.75 0.00 0.66 0.00 0.00 0.00 179.25 180.80 1pj9 n TYR 406 N -3.71 0.00 -1.17 0.00 4.01 0.58 -4.67 117.16 112.20 1pj9 n TYR 406 Ca -0.14 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.29 1pj9 n TYR 406 Cb 1.04 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 40.17 1pj9 n TYR 406 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1pj9 s GLY 407 N -0.06 1.75 0.93 2.72 0.00 0.87 -4.91 107.32 108.63 1pj9 s GLY 407 Ca 0.00 0.39 -0.13 0.00 0.00 0.00 0.00 44.72 44.99 1pj9 s GLY 407 CO 0.00 0.76 1.14 -1.35 0.00 0.00 0.00 173.10 173.65 1pj9 s SER 408 N -3.10 3.29 -0.09 1.64 1.04 -0.67 -4.71 113.70 111.11 1pj9 s SER 408 Ca 0.63 0.94 0.02 0.00 0.48 0.00 0.00 55.95 58.02 1pj9 s SER 408 Cb -0.19 -1.48 0.01 0.00 0.10 0.00 0.00 66.02 64.46 1pj9 s SER 408 CO 0.55 -2.68 -0.14 -0.89 0.98 0.00 0.00 173.24 171.06 1pj9 s THR 409 N -3.27 1.33 -0.03 2.02 2.01 -1.26 -2.91 115.64 113.54 1pj9 s THR 409 Ca 0.65 -0.56 0.00 0.00 0.31 0.00 0.00 61.69 62.09 1pj9 s THR 409 Cb -0.14 -1.21 0.03 0.00 0.01 0.00 0.00 72.50 71.18 1pj9 s THR 409 CO 0.54 0.40 0.01 -1.58 -0.69 0.00 0.00 174.62 173.30 1pj9 s GLN 410 N 0.83 0.20 0.01 4.92 0.74 -0.60 -4.97 119.66 120.79 1pj9 s GLN 410 Ca -0.11 0.10 -0.30 0.00 0.05 0.00 0.00 55.36 55.10 1pj9 s GLN 410 Cb -0.15 -0.41 -0.05 0.00 1.10 0.00 0.00 33.01 33.50 1pj9 s GLN 410 CO 0.01 -0.14 1.24 -2.00 -0.55 0.00 0.00 175.29 173.85 1pj9 s GLU 411 N 1.01 4.38 -0.01 1.67 -6.30 -1.26 -0.49 118.70 117.69 1pj9 s GLU 411 Ca -0.10 1.77 0.10 0.00 -2.50 0.00 0.00 54.97 54.25 1pj9 s GLU 411 Cb -0.13 -3.46 -0.16 0.00 0.00 0.00 0.00 34.13 30.38 1pj9 s GLU 411 CO -0.02 -0.38 0.25 0.54 0.02 0.00 0.00 175.26 175.67 1pj9 n ARG 412 N 4.64 0.72 -3.62 4.30 5.12 0.84 -4.94 116.66 123.72 1pj9 n ARG 412 Ca 0.10 -0.08 -0.14 0.00 -1.93 0.00 0.00 57.85 55.80 1pj9 n ARG 412 Cb 0.46 -1.22 -0.07 0.00 -1.16 0.00 0.00 32.46 30.47 1pj9 n ARG 412 CO 0.00 0.00 0.00 -0.46 -1.93 0.00 0.00 177.63 175.24 1pj9 s TRP 413 N -2.63 -0.74 -0.22 -1.55 -0.00 -0.98 -4.51 118.94 108.30 1pj9 s TRP 413 Ca -0.03 1.78 -0.27 0.00 -0.00 0.00 0.00 56.10 57.59 1pj9 s TRP 413 Cb 0.07 0.29 0.10 0.00 -0.00 0.00 0.00 33.47 33.92 1pj9 s TRP 413 CO 0.43 -0.37 0.86 -1.50 -0.00 0.00 0.00 176.95 176.37 1pj9 s ILE 414 N 0.27 0.00 0.00 5.86 2.07 -1.26 -0.80 121.20 127.34 1pj9 s ILE 414 Ca -0.00 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.24 1pj9 s ILE 414 Cb -0.05 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.54 1pj9 s ILE 414 CO 0.01 0.00 0.00 -0.46 -1.91 0.00 0.00 174.94 172.58 1pj9 n ASN 415 N 1.93 0.00 -0.27 4.50 0.23 -0.59 -4.97 115.26 116.08 1pj9 n ASN 415 Ca -0.14 -0.77 0.04 0.00 -0.53 0.00 0.00 54.58 53.19 1pj9 n ASN 415 Cb 0.56 0.00 0.18 0.00 -2.08 0.00 0.00 39.78 38.44 1pj9 n ASN 415 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 1pj9 h ASN 416 N 0.00 0.49 0.00 0.53 2.35 -1.99 -3.22 115.58 113.74 1pj9 h ASN 416 Ca 0.00 0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1pj9 h ASN 416 Cb 0.00 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1pj9 h ASN 416 CO 0.00 0.25 -0.90 0.47 -1.65 0.00 0.00 177.43 175.59 1pj9 n ASP 417 N -4.87 0.95 -4.42 5.81 8.00 -1.26 -1.65 116.55 119.12 1pj9 n ASP 417 Ca 0.14 -0.60 -0.32 0.00 0.71 0.00 0.00 54.79 54.71 1pj9 n ASP 417 Cb 0.35 1.17 -0.14 0.00 -0.02 0.00 0.00 41.12 42.48 1pj9 n ASP 417 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1pj9 s VAL 418 N -2.46 2.86 -0.05 2.53 1.01 -1.22 -1.39 120.40 121.68 1pj9 s VAL 418 Ca 0.02 -0.78 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 1pj9 s VAL 418 Cb 0.10 -2.12 0.03 0.00 0.00 0.00 0.00 36.38 34.39 1pj9 s VAL 418 CO 0.56 0.57 0.01 -0.22 0.00 0.00 0.00 175.10 176.03 1pj9 s LEU 419 N -0.44 0.74 -0.20 3.92 2.96 -0.53 -1.55 118.68 123.59 1pj9 s LEU 419 Ca 0.05 -0.04 0.01 0.00 -0.22 0.00 0.00 54.13 53.93 1pj9 s LEU 419 Cb -0.12 -0.31 0.03 0.00 0.50 0.00 0.00 46.19 46.28 1pj9 s LEU 419 CO 0.02 -0.16 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.08 1pj9 s ILE 420 N 1.63 2.14 0.24 6.68 1.01 0.02 -1.32 121.20 131.59 1pj9 s ILE 420 Ca -0.01 -1.05 0.11 0.00 0.00 0.00 0.00 60.65 59.70 1pj9 s ILE 420 Cb -0.13 -1.97 -0.05 0.00 0.01 0.00 0.00 42.46 40.33 1pj9 s ILE 420 CO -0.03 0.43 -0.19 -0.72 0.00 0.00 0.00 174.94 174.43 1pj9 s TYR 421 N 1.26 2.12 -0.05 3.97 1.13 -0.37 -0.11 117.35 125.31 1pj9 s TYR 421 Ca 0.02 -0.40 0.05 0.00 -1.41 0.00 0.00 57.07 55.33 1pj9 s TYR 421 Cb -0.14 -0.96 -0.00 0.00 -1.10 0.00 0.00 41.96 39.75 1pj9 s TYR 421 CO -0.11 0.58 -0.20 -2.00 -2.51 0.00 0.00 175.55 171.31 1pj9 s GLU 422 N -3.36 2.07 -0.10 -3.49 2.12 0.35 -0.91 118.70 115.39 1pj9 s GLU 422 Ca 0.26 -0.70 -0.03 0.00 0.36 0.00 0.00 54.97 54.86 1pj9 s GLU 422 Cb -0.05 -1.76 -0.03 0.00 0.26 0.00 0.00 34.13 32.55 1pj9 s GLU 422 CO 0.12 0.27 0.02 1.03 -0.54 0.00 0.00 175.26 176.15 1pj9 s ARG 423 N 0.03 3.13 -0.10 4.30 1.81 0.12 -1.55 118.95 126.68 1pj9 s ARG 423 Ca -0.05 -0.38 -0.06 0.00 -1.72 0.00 0.00 55.73 53.52 1pj9 s ARG 423 Cb -0.13 -2.87 0.04 0.00 -0.45 0.00 0.00 34.95 31.55 1pj9 s ARG 423 CO 0.03 0.66 0.25 0.21 -0.68 0.00 0.00 175.30 175.77 1pj9 s LYS 424 N -0.76 0.23 -0.23 3.54 2.20 -1.14 -1.39 119.74 122.17 1pj9 s LYS 424 Ca 0.12 0.50 -0.04 0.00 -0.36 0.00 0.00 55.97 56.19 1pj9 s LYS 424 Cb -0.12 -0.07 0.12 0.00 -1.51 0.00 0.00 37.83 36.26 1pj9 s LYS 424 CO 0.02 -0.14 0.41 0.12 -0.36 0.00 0.00 175.35 175.41 1pj9 s PHE 425 N 1.07 -0.89 0.00 4.03 5.36 -0.85 -1.67 117.98 125.02 1pj9 s PHE 425 Ca -0.08 1.16 0.00 0.00 -0.96 0.00 0.00 56.93 57.05 1pj9 s PHE 425 Cb -0.09 0.17 0.00 0.00 -0.34 0.00 0.00 43.02 42.76 1pj9 s PHE 425 CO -0.07 -0.66 0.00 0.41 -1.46 0.00 0.00 175.22 173.44 1pj9 n GLY 426 N 5.38 2.94 2.45 13.12 0.00 -1.26 -2.00 105.19 125.82 1pj9 n GLY 426 Ca -0.05 -0.34 -0.26 0.00 0.00 0.00 0.00 46.02 45.37 1pj9 n GLY 426 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1pj9 n SER 427 N 1.01 6.41 -3.84 1.61 7.64 -1.26 -4.84 113.62 120.34 1pj9 n SER 427 Ca 0.00 -3.17 -0.13 0.00 1.01 0.00 0.00 58.87 56.59 1pj9 n SER 427 Cb 0.00 -1.24 -0.14 0.00 -1.01 0.00 0.00 64.21 61.82 1pj9 n SER 427 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1pj9 s ASN 428 N 0.43 -0.01 0.01 6.43 0.01 -0.85 -2.03 114.94 118.93 1pj9 s ASN 428 Ca 0.59 0.05 -0.02 0.00 -0.71 0.00 0.00 52.86 52.77 1pj9 s ASN 428 Cb 0.38 0.03 -0.01 0.00 0.41 0.00 0.00 41.25 42.06 1pj9 s ASN 428 CO -0.21 -0.03 0.03 -0.69 -1.51 0.00 0.00 177.10 174.68 1pj9 s VAL 429 N 0.24 0.07 -0.04 1.60 1.01 0.57 -2.01 120.40 121.83 1pj9 s VAL 429 Ca -0.02 -0.60 -0.01 0.00 0.00 0.00 0.00 61.98 61.35 1pj9 s VAL 429 Cb -0.03 -0.24 0.03 0.00 0.00 0.00 0.00 36.38 36.15 1pj9 s VAL 429 CO -0.01 -0.33 0.08 0.00 0.00 0.00 0.00 175.10 174.84 1pj9 s ALA 430 N -1.00 -0.08 -0.10 5.51 0.00 -0.49 -0.88 121.76 124.72 1pj9 s ALA 430 Ca -0.11 0.45 0.03 0.00 0.00 0.00 0.00 51.96 52.34 1pj9 s ALA 430 Cb -0.07 -0.32 0.00 0.00 0.00 0.00 0.00 23.12 22.73 1pj9 s ALA 430 CO -0.00 -0.12 -0.22 0.08 0.00 0.00 0.00 175.76 175.50 1pj9 s VAL 431 N 1.04 1.88 -0.10 0.00 1.01 0.77 0.12 120.40 125.13 1pj9 s VAL 431 Ca -0.08 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.01 1pj9 s VAL 431 Cb -0.11 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.63 1pj9 s VAL 431 CO -0.04 0.52 -0.18 -0.69 0.00 0.00 0.00 175.10 174.71 1pj9 s VAL 432 N 0.46 1.67 -0.15 2.92 1.01 -0.09 -0.82 120.40 125.39 1pj9 s VAL 432 Ca -0.17 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.03 1pj9 s VAL 432 Cb -0.17 -1.48 -0.01 0.00 0.00 0.00 0.00 36.38 34.72 1pj9 s VAL 432 CO 0.07 0.47 -0.11 0.00 0.00 0.00 0.00 175.10 175.53 1pj9 s ALA 433 N 0.62 2.66 -0.07 5.51 0.00 -0.26 -1.23 121.76 129.00 1pj9 s ALA 433 Ca -0.14 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 50.89 1pj9 s ALA 433 Cb -0.16 -1.31 0.02 0.00 0.00 0.00 0.00 23.12 21.67 1pj9 s ALA 433 CO 0.04 0.12 -0.06 0.08 0.00 0.00 0.00 175.76 175.94 1pj9 s VAL 434 N 0.55 0.76 -0.35 0.00 1.01 -0.44 -1.13 120.40 120.80 1pj9 s VAL 434 Ca -0.07 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 61.73 1pj9 s VAL 434 Cb -0.15 -0.79 0.10 0.00 0.00 0.00 0.00 36.38 35.54 1pj9 s VAL 434 CO 0.03 0.30 0.07 0.21 0.00 0.00 0.00 175.10 175.72 1pj9 s ASN 435 N 1.31 4.89 0.52 3.32 2.47 -0.05 -1.46 114.94 125.94 1pj9 s ASN 435 Ca -0.04 -1.99 0.32 0.00 0.42 0.00 0.00 52.86 51.57 1pj9 s ASN 435 Cb -0.14 -1.68 1.23 0.00 -1.45 0.00 0.00 41.25 39.21 1pj9 s ASN 435 CO -0.03 -0.40 1.93 0.08 -3.72 0.00 0.00 177.10 174.96 1pj9 h ARG 436 N 7.77 0.00 -6.28 0.43 0.11 -1.52 -2.92 114.38 111.99 1pj9 h ARG 436 Ca -0.09 0.00 -0.58 0.00 0.10 0.00 0.00 59.98 59.41 1pj9 h ARG 436 Cb 1.03 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.08 1pj9 h ARG 436 CO 0.57 0.00 1.27 1.21 0.10 0.00 0.00 179.97 183.12 1pj9 s ASN 437 N -5.67 5.91 0.00 0.08 3.84 -1.26 -4.68 114.94 113.16 1pj9 s ASN 437 Ca 0.02 1.32 0.24 0.00 0.21 0.00 0.00 52.86 54.65 1pj9 s ASN 437 Cb 0.09 -2.53 1.05 0.00 -0.55 0.00 0.00 41.25 39.31 1pj9 s ASN 437 CO 0.55 -1.69 1.77 0.18 -2.79 0.00 0.00 177.10 175.12 1pj9 n LEU 438 N 10.20 0.00 -0.04 3.21 4.32 -1.26 -1.05 117.00 132.38 1pj9 n LEU 438 Ca 0.23 0.46 0.01 0.00 -0.02 0.00 0.00 56.01 56.69 1pj9 n LEU 438 Cb 0.47 -0.46 0.00 0.00 -1.62 0.00 0.00 43.42 41.81 1pj9 n LEU 438 CO 0.68 -0.09 0.15 0.59 -1.22 0.00 0.00 177.39 177.51 1pj9 n ASN 439 N -1.46 0.67 -3.71 -1.43 4.13 -1.26 -4.58 115.26 107.62 1pj9 n ASN 439 Ca 0.07 -0.84 -0.19 0.00 1.68 0.00 0.00 54.58 55.30 1pj9 n ASN 439 Cb 0.26 0.44 -0.17 0.00 -1.54 0.00 0.00 39.78 38.77 1pj9 n ASN 439 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1pj9 s ALA 440 N -0.59 0.27 0.95 5.41 0.00 -1.24 -5.00 121.76 121.56 1pj9 s ALA 440 Ca 0.01 0.17 -0.13 0.00 0.00 0.00 0.00 51.96 52.02 1pj9 s ALA 440 Cb 0.01 -0.54 0.16 0.00 0.00 0.00 0.00 23.12 22.75 1pj9 s ALA 440 CO 0.04 -0.38 1.14 -1.25 0.00 0.00 0.00 175.76 175.30 1pj9 s PRO 441 N 1.85 0.85 0.02 0.00 0.04 -1.26 -4.37 135.00 132.14 1pj9 s PRO 441 Ca 0.01 0.28 0.04 0.00 0.04 0.00 0.00 61.00 61.37 1pj9 s PRO 441 Cb -0.12 -1.81 -0.02 0.00 0.04 0.00 0.00 34.50 32.59 1pj9 s PRO 441 CO -0.03 -2.39 -0.13 0.00 0.04 0.00 0.00 177.00 174.48 1pj9 s ALA 442 N -3.23 1.10 -0.37 8.56 0.00 -0.12 -4.92 121.76 122.78 1pj9 s ALA 442 Ca 0.65 -0.72 -0.17 0.00 0.00 0.00 0.00 51.96 51.72 1pj9 s ALA 442 Cb -0.15 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 22.77 1pj9 s ALA 442 CO 0.54 0.22 0.46 0.45 0.00 0.00 0.00 175.76 177.43 1pj9 s SER 443 N -0.84 6.24 -0.47 0.00 0.15 -1.26 -0.30 113.70 117.22 1pj9 s SER 443 Ca 0.02 -0.27 -0.16 0.00 0.70 0.00 0.00 55.95 56.25 1pj9 s SER 443 Cb -0.07 -2.24 0.07 0.00 -1.71 0.00 0.00 66.02 62.07 1pj9 s SER 443 CO 0.01 -0.48 0.42 -0.63 1.20 0.00 0.00 173.24 173.76 1pj9 s ILE 444 N 2.24 5.19 0.05 6.45 -1.09 0.33 -4.99 121.20 129.38 1pj9 s ILE 444 Ca 0.15 -0.95 0.05 0.00 -2.23 0.00 0.00 60.65 57.67 1pj9 s ILE 444 Cb -0.16 -4.13 -0.02 0.00 -1.58 0.00 0.00 42.46 36.56 1pj9 s ILE 444 CO 0.13 -0.59 -0.14 -0.94 -1.23 0.00 0.00 174.94 172.18 1pj9 s SER 445 N 2.53 1.60 0.00 3.58 1.04 -1.26 -1.96 113.70 119.24 1pj9 s SER 445 Ca 0.06 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 55.99 1pj9 s SER 445 Cb -0.23 -0.08 0.00 0.00 0.10 0.00 0.00 66.02 65.80 1pj9 s SER 445 CO 0.08 -0.00 0.00 0.61 0.98 0.00 0.00 173.24 174.90 1pj9 n GLY 446 N 1.75 0.75 3.71 7.32 0.00 -1.26 -5.03 105.19 112.42 1pj9 n GLY 446 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 1pj9 n GLY 446 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1pj9 s LEU 447 N 0.00 4.35 -0.04 0.99 2.96 -1.26 -4.96 118.68 120.72 1pj9 s LEU 447 Ca 0.00 2.15 0.06 0.00 -0.22 0.00 0.00 54.13 56.13 1pj9 s LEU 447 Cb 0.00 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 43.10 1pj9 s LEU 447 CO 0.00 -0.62 -0.23 -0.69 -1.32 0.00 0.00 176.35 173.49 1pj9 s VAL 448 N 1.51 1.85 0.33 1.68 1.01 -1.26 -0.95 120.40 124.57 1pj9 s VAL 448 Ca 0.62 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 61.67 1pj9 s VAL 448 Cb -0.33 -1.56 -0.03 0.00 0.00 0.00 0.00 36.38 34.46 1pj9 s VAL 448 CO 0.28 0.52 0.18 0.42 0.00 0.00 0.00 175.10 176.51 1pj9 s THR 449 N -0.30 0.28 -2.06 3.92 -4.23 0.23 -4.89 115.64 108.61 1pj9 s THR 449 Ca 0.02 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 58.71 1pj9 s THR 449 Cb -0.11 -2.47 0.50 0.00 1.34 0.00 0.00 72.50 71.75 1pj9 s THR 449 CO 0.01 0.00 1.43 -1.20 -0.54 0.00 0.00 174.62 174.32 1pj9 n SER 450 N -1.14 3.05 -4.72 3.99 7.64 -1.26 -4.33 113.62 116.84 1pj9 n SER 450 Ca 0.01 -1.98 -0.42 0.00 1.01 0.00 0.00 58.87 57.49 1pj9 n SER 450 Cb 0.64 -0.36 -0.03 0.00 -1.01 0.00 0.00 64.21 63.45 1pj9 n SER 450 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1pj9 s LEU 451 N -1.07 4.41 0.61 -3.43 1.43 -1.26 -4.99 118.68 114.38 1pj9 s LEU 451 Ca 0.38 1.99 -0.19 0.00 -1.03 0.00 0.00 54.13 55.28 1pj9 s LEU 451 Cb 0.20 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.81 1pj9 s LEU 451 CO 0.27 -0.35 1.31 -2.84 0.23 0.00 0.00 176.35 174.97 1pj9 s PRO 452 N 0.54 2.76 0.31 1.29 0.02 -1.26 -4.33 135.00 134.33 1pj9 s PRO 452 Ca 0.54 2.10 -0.29 0.00 0.02 0.00 0.00 61.00 63.38 1pj9 s PRO 452 Cb -0.28 -1.98 -0.13 0.00 0.02 0.00 0.00 34.50 32.13 1pj9 s PRO 452 CO 0.31 -1.45 1.27 0.00 -0.33 0.00 0.00 177.00 176.81 1pj9 n GLN 453 N -1.61 1.98 -2.64 5.54 10.64 -1.26 -4.86 117.38 125.18 1pj9 n GLN 453 Ca 0.14 0.70 0.00 0.00 -1.83 0.00 0.00 57.00 56.01 1pj9 n GLN 453 Cb 0.47 -2.26 0.00 0.00 -0.86 0.00 0.00 30.24 27.59 1pj9 n GLN 453 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1pj9 n GLY 454 N 1.15 -0.92 3.71 2.61 0.00 0.05 -4.98 105.19 106.80 1pj9 n GLY 454 Ca 0.07 -1.49 -0.35 0.00 0.00 0.00 0.00 46.02 44.25 1pj9 n GLY 454 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1pj9 s SER 455 N -2.65 5.57 -0.13 1.61 0.15 -1.26 -0.57 113.70 116.42 1pj9 s SER 455 Ca 0.00 0.19 0.00 0.00 0.70 0.00 0.00 55.95 56.84 1pj9 s SER 455 Cb 0.00 -1.75 0.02 0.00 -1.71 0.00 0.00 66.02 62.58 1pj9 s SER 455 CO 0.00 0.32 -0.11 -0.31 1.20 0.00 0.00 173.24 174.34 1pj9 s TYR 456 N -0.53 1.84 0.31 3.44 2.02 0.47 -4.98 117.35 119.92 1pj9 s TYR 456 Ca 0.10 -0.99 -0.24 0.00 -0.37 0.00 0.00 57.07 55.58 1pj9 s TYR 456 Cb -0.12 -1.42 -0.10 0.00 -0.40 0.00 0.00 41.96 39.93 1pj9 s TYR 456 CO 0.02 -0.59 0.89 -0.80 -1.57 0.00 0.00 175.55 173.50 1pj9 s ASN 457 N 1.56 7.23 0.05 2.29 0.01 -1.26 -0.39 114.94 124.43 1pj9 s ASN 457 Ca 0.04 1.71 -0.30 0.00 -0.71 0.00 0.00 52.86 53.60 1pj9 s ASN 457 Cb -0.13 -2.53 -0.08 0.00 0.41 0.00 0.00 41.25 38.92 1pj9 s ASN 457 CO -0.09 -0.07 1.75 -0.62 -1.51 0.00 0.00 177.10 176.57 1pj9 s ASP 458 N -1.68 6.55 0.52 -1.22 2.15 -1.26 -4.68 116.67 117.05 1pj9 s ASP 458 Ca 0.49 2.53 0.17 0.00 0.43 0.00 0.00 52.55 56.17 1pj9 s ASP 458 Cb -0.17 -2.55 1.28 0.00 -0.30 0.00 0.00 42.92 41.17 1pj9 s ASP 458 CO 0.22 -0.95 2.12 0.58 -0.17 0.00 0.00 175.17 176.97 1pj9 h VAL 459 N 5.11 0.96 0.00 1.11 2.07 -1.07 0.15 116.25 124.57 1pj9 h VAL 459 Ca -0.44 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1pj9 h VAL 459 Cb 1.21 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 1pj9 h VAL 459 CO 0.94 0.00 0.00 0.18 0.02 0.00 0.00 177.57 178.71 1pj9 n LEU 460 N -4.51 0.00 -2.24 2.57 4.77 -1.26 -4.90 117.00 111.43 1pj9 n LEU 460 Ca -0.01 0.14 -0.18 0.00 -0.03 0.00 0.00 56.01 55.93 1pj9 n LEU 460 Cb 0.18 -0.14 -0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1pj9 n LEU 460 CO 0.35 -0.01 -0.22 0.61 -1.33 0.00 0.00 177.39 176.78 1pj9 n GLY 461 N 0.90 -0.06 2.28 -0.72 0.00 0.51 -1.10 105.19 107.00 1pj9 n GLY 461 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1pj9 n GLY 461 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pj9 n GLY 462 N -0.84 0.75 0.36 -0.02 0.00 -1.26 -4.92 105.19 99.26 1pj9 n GLY 462 Ca -0.21 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.89 1pj9 n GLY 462 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1pj9 h LEU 463 N 0.00 0.90 -3.86 0.99 5.85 -1.46 -0.24 115.31 117.49 1pj9 h LEU 463 Ca 0.00 0.05 -0.60 0.00 0.84 0.00 0.00 57.88 58.17 1pj9 h LEU 463 Cb 0.00 -0.13 -0.36 0.00 0.37 0.00 0.00 40.66 40.54 1pj9 h LEU 463 CO 0.00 0.46 -0.05 0.18 -0.34 0.00 0.00 178.44 178.69 1pj9 n LEU 464 N -4.63 6.16 -2.32 2.25 4.77 -1.26 -4.90 117.00 117.07 1pj9 n LEU 464 Ca 0.19 -4.53 -0.21 0.00 -0.03 0.00 0.00 56.01 51.43 1pj9 n LEU 464 Cb 0.38 -0.63 -0.02 0.00 -2.33 0.00 0.00 43.42 40.83 1pj9 n LEU 464 CO 0.27 1.81 -0.26 0.59 -1.33 0.00 0.00 177.39 178.47 1pj9 n ASN 465 N -0.81 -5.89 -4.51 -1.43 4.13 -0.10 -1.46 115.26 105.18 1pj9 n ASN 465 Ca 0.52 0.02 -0.29 0.00 1.68 0.00 0.00 54.58 56.52 1pj9 n ASN 465 Cb 0.83 -4.92 0.18 0.00 -1.54 0.00 0.00 39.78 34.33 1pj9 n ASN 465 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1pj9 s GLY 466 N -2.11 1.58 0.21 7.41 0.00 -1.21 -4.46 107.32 108.74 1pj9 s GLY 466 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 44.72 44.15 1pj9 s GLY 466 CO 0.00 0.09 0.09 0.54 0.00 0.00 0.00 173.10 173.82 1pj9 s ASN 467 N -3.77 0.78 0.34 1.64 2.20 -1.26 -4.44 114.94 110.43 1pj9 s ASN 467 Ca 0.66 -1.34 -0.26 0.00 -0.94 0.00 0.00 52.86 50.99 1pj9 s ASN 467 Cb -0.15 0.24 -0.09 0.00 -2.00 0.00 0.00 41.25 39.24 1pj9 s ASN 467 CO 0.56 -0.74 1.01 -0.89 -2.94 0.00 0.00 177.10 174.10 1pj9 s THR 468 N -3.90 3.88 -0.13 0.54 2.01 -1.26 -3.98 115.64 112.81 1pj9 s THR 468 Ca 0.35 1.57 -0.03 0.00 0.31 0.00 0.00 61.69 63.89 1pj9 s THR 468 Cb 0.07 -3.88 -0.03 0.00 0.01 0.00 0.00 72.50 68.68 1pj9 s THR 468 CO 0.10 0.14 -0.04 -0.22 -0.69 0.00 0.00 174.62 173.91 1pj9 s LEU 469 N -2.16 3.29 -0.32 4.42 2.96 0.48 -4.96 118.68 122.39 1pj9 s LEU 469 Ca 0.52 -0.06 -0.07 0.00 -0.22 0.00 0.00 54.13 54.30 1pj9 s LEU 469 Cb -0.22 -1.77 0.02 0.00 0.50 0.00 0.00 46.19 44.72 1pj9 s LEU 469 CO 0.28 0.24 0.10 -0.44 -1.32 0.00 0.00 176.35 175.22 1pj9 s SER 470 N -0.07 5.25 -0.20 3.68 0.01 -1.26 -0.39 113.70 120.72 1pj9 s SER 470 Ca 0.02 -0.89 -0.07 0.00 1.31 0.00 0.00 55.95 56.32 1pj9 s SER 470 Cb -0.13 -1.89 -0.04 0.00 0.21 0.00 0.00 66.02 64.17 1pj9 s SER 470 CO 0.03 -0.26 0.06 -0.69 0.41 0.00 0.00 173.24 172.78 1pj9 s VAL 471 N 1.47 4.60 0.00 3.43 1.01 0.26 -0.51 120.40 130.66 1pj9 s VAL 471 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 61.98 61.89 1pj9 s VAL 471 Cb -0.18 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.11 1pj9 s VAL 471 CO 0.03 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.17 1pj9 n GLY 472 N 3.86 3.04 3.62 4.51 0.00 0.14 -0.77 105.19 119.58 1pj9 n GLY 472 Ca -0.16 -2.03 -0.44 0.00 0.00 0.00 0.00 46.02 43.38 1pj9 n GLY 472 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1pj9 n SER 473 N 0.00 1.81 -0.19 1.61 7.64 -1.26 -2.01 113.62 121.22 1pj9 n SER 473 Ca 0.00 1.18 -0.03 0.00 1.01 0.00 0.00 58.87 61.04 1pj9 n SER 473 Cb 0.00 -1.35 -0.01 0.00 -1.01 0.00 0.00 64.21 61.84 1pj9 n SER 473 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1pj9 n GLY 474 N 1.24 0.41 1.55 0.23 0.00 -1.26 -2.62 105.19 104.75 1pj9 n GLY 474 Ca 0.09 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1pj9 n GLY 474 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pj9 n GLY 475 N -0.59 0.60 3.66 -0.02 0.00 -0.85 -4.69 105.19 103.31 1pj9 n GLY 475 Ca -0.03 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 1pj9 n GLY 475 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pj9 s ALA 476 N -2.00 3.61 0.23 4.61 0.00 -1.08 -0.60 121.76 126.54 1pj9 s ALA 476 Ca 0.00 0.17 -0.29 0.00 0.00 0.00 0.00 51.96 51.85 1pj9 s ALA 476 Cb 0.00 -3.47 -0.09 0.00 0.00 0.00 0.00 23.12 19.56 1pj9 s ALA 476 CO 0.00 -0.92 0.90 0.00 0.00 0.00 0.00 175.76 175.74 1pj9 s ALA 477 N 2.84 3.36 0.72 0.00 0.00 -0.13 0.23 121.76 128.78 1pj9 s ALA 477 Ca 0.43 0.55 -0.14 0.00 0.00 0.00 0.00 51.96 52.81 1pj9 s ALA 477 Cb -0.16 -3.14 0.03 0.00 0.00 0.00 0.00 23.12 19.85 1pj9 s ALA 477 CO 0.09 0.23 1.13 -1.12 0.00 0.00 0.00 175.76 176.09 1pj9 s SER 478 N -1.20 4.58 0.40 0.00 0.01 0.34 -4.52 113.70 113.30 1pj9 s SER 478 Ca 0.40 2.05 -0.26 0.00 1.31 0.00 0.00 55.95 59.45 1pj9 s SER 478 Cb -0.25 -2.55 -0.10 0.00 0.21 0.00 0.00 66.02 63.32 1pj9 s SER 478 CO 0.30 -1.99 1.33 0.59 0.41 0.00 0.00 173.24 173.88 1pj9 n ASN 479 N -2.90 2.91 -3.69 2.44 3.02 -1.26 -4.80 115.26 110.98 1pj9 n ASN 479 Ca 0.11 1.15 -0.10 0.00 -0.03 0.00 0.00 54.58 55.71 1pj9 n ASN 479 Cb 0.52 -1.53 -0.05 0.00 -0.61 0.00 0.00 39.78 38.11 1pj9 n ASN 479 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1pj9 s PHE 480 N -1.16 -0.11 -0.21 3.10 -0.71 -0.83 -5.02 117.98 113.05 1pj9 s PHE 480 Ca 0.58 -0.23 -0.13 0.00 -1.04 0.00 0.00 56.93 56.11 1pj9 s PHE 480 Cb -0.51 0.19 -0.05 0.00 -1.21 0.00 0.00 43.02 41.45 1pj9 s PHE 480 CO 0.60 -0.68 0.26 0.99 -1.34 0.00 0.00 175.22 175.05 1pj9 s THR 481 N -3.82 5.30 -0.43 -4.49 2.01 -1.26 -0.51 115.64 112.43 1pj9 s THR 481 Ca 0.04 0.42 -0.17 0.00 0.31 0.00 0.00 61.69 62.29 1pj9 s THR 481 Cb 0.02 -3.60 0.03 0.00 0.01 0.00 0.00 72.50 68.97 1pj9 s THR 481 CO -0.11 0.33 0.42 -0.22 -0.69 0.00 0.00 174.62 174.35 1pj9 s LEU 482 N 0.97 4.99 0.91 4.42 2.96 0.59 -4.92 118.68 128.60 1pj9 s LEU 482 Ca 0.13 -0.79 -0.12 0.00 -0.22 0.00 0.00 54.13 53.12 1pj9 s LEU 482 Cb -0.14 -2.33 0.07 0.00 0.50 0.00 0.00 46.19 44.29 1pj9 s LEU 482 CO 0.05 -0.59 0.71 0.00 -1.32 0.00 0.00 176.35 175.20 1pj9 n ALA 483 N 5.53 -1.72 -1.72 5.97 0.00 -1.26 -0.95 120.51 126.35 1pj9 n ALA 483 Ca -0.08 -0.53 -0.42 0.00 0.00 0.00 0.00 53.44 52.40 1pj9 n ALA 483 Cb 0.47 -1.97 -0.03 0.00 0.00 0.00 0.00 19.45 17.93 1pj9 n ALA 483 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pj9 n ALA 484 N -3.65 2.56 -1.23 0.00 0.00 -1.26 0.18 120.51 117.11 1pj9 n ALA 484 Ca 0.09 0.39 -0.08 0.00 0.00 0.00 0.00 53.44 53.85 1pj9 n ALA 484 Cb 0.52 -2.48 -0.03 0.00 0.00 0.00 0.00 19.45 17.46 1pj9 n ALA 484 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pj9 n GLY 485 N 3.16 0.85 3.77 0.00 0.00 -0.21 -4.90 105.19 107.85 1pj9 n GLY 485 Ca 0.13 -0.11 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 1pj9 n GLY 485 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pj9 s GLY 486 N -2.40 2.99 -0.08 -0.02 0.00 0.13 -4.79 107.32 103.14 1pj9 s GLY 486 Ca 0.00 1.11 -0.03 0.00 0.00 0.00 0.00 44.72 45.80 1pj9 s GLY 486 CO 0.00 1.72 0.17 -1.59 0.00 0.00 0.00 173.10 173.40 1pj9 s THR 487 N -1.21 -0.16 0.03 0.90 2.01 -0.54 -0.87 115.64 115.81 1pj9 s THR 487 Ca 0.50 0.25 0.01 0.00 0.31 0.00 0.00 61.69 62.76 1pj9 s THR 487 Cb -0.36 -0.29 -0.02 0.00 0.01 0.00 0.00 72.50 71.84 1pj9 s THR 487 CO 0.47 0.10 -0.05 0.00 -0.69 0.00 0.00 174.62 174.46 1pj9 s ALA 488 N 1.70 0.28 -0.07 7.40 0.00 -0.29 -3.29 121.76 127.50 1pj9 s ALA 488 Ca -0.04 -0.65 0.01 0.00 0.00 0.00 0.00 51.96 51.28 1pj9 s ALA 488 Cb -0.12 0.11 0.02 0.00 0.00 0.00 0.00 23.12 23.13 1pj9 s ALA 488 CO -0.06 -0.11 -0.07 0.08 0.00 0.00 0.00 175.76 175.60 1pj9 s VAL 489 N -1.43 0.85 0.07 0.00 1.01 -1.26 -1.10 120.40 118.54 1pj9 s VAL 489 Ca -0.14 -0.26 0.09 0.00 0.00 0.00 0.00 61.98 61.67 1pj9 s VAL 489 Cb -0.10 -0.85 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 1pj9 s VAL 489 CO -0.00 0.31 -0.23 0.26 0.00 0.00 0.00 175.10 175.44 1pj9 s TRP 490 N 1.18 2.01 0.17 5.22 0.51 -0.00 -0.35 118.94 127.67 1pj9 s TRP 490 Ca -0.06 -0.39 -0.11 0.00 -2.12 0.00 0.00 56.10 53.42 1pj9 s TRP 490 Cb -0.14 -1.16 -0.00 0.00 -0.81 0.00 0.00 33.47 31.35 1pj9 s TRP 490 CO -0.02 0.16 0.33 1.14 -0.51 0.00 0.00 176.95 178.05 1pj9 s GLN 491 N -1.47 1.20 -0.13 4.98 -2.07 -1.26 -0.16 119.66 120.75 1pj9 s GLN 491 Ca 0.09 -1.11 -0.07 0.00 -1.82 0.00 0.00 55.36 52.45 1pj9 s GLN 491 Cb -0.09 0.41 0.05 0.00 -1.09 0.00 0.00 33.01 32.28 1pj9 s GLN 491 CO 0.03 -0.46 0.31 -0.47 -1.32 0.00 0.00 175.29 173.38 1pj9 s TYR 492 N -3.95 -0.44 0.03 9.60 5.04 -0.06 -4.99 117.35 122.58 1pj9 s TYR 492 Ca 0.16 0.99 0.03 0.00 -2.44 0.00 0.00 57.07 55.80 1pj9 s TYR 492 Cb 0.02 0.12 -0.02 0.00 0.35 0.00 0.00 41.96 42.44 1pj9 s TYR 492 CO -0.00 -0.29 -0.09 0.95 -1.34 0.00 0.00 175.55 174.78 1pj9 s THR 493 N 1.42 0.69 0.07 4.34 -4.23 -1.26 -0.32 115.64 116.35 1pj9 s THR 493 Ca -0.09 -0.89 -0.26 0.00 -1.18 0.00 0.00 61.69 59.27 1pj9 s THR 493 Cb -0.10 -0.68 0.08 0.00 1.34 0.00 0.00 72.50 73.15 1pj9 s THR 493 CO -0.10 -0.17 0.81 0.00 -0.54 0.00 0.00 174.62 174.62 1pj9 s ALA 494 N -0.97 -1.71 0.32 3.99 0.00 -0.86 -5.00 121.76 117.53 1pj9 s ALA 494 Ca -0.04 0.70 -0.29 0.00 0.00 0.00 0.00 51.96 52.33 1pj9 s ALA 494 Cb -0.08 0.60 -0.11 0.00 0.00 0.00 0.00 23.12 23.53 1pj9 s ALA 494 CO 0.01 -0.77 1.50 0.00 0.00 0.00 0.00 175.76 176.49 1pj9 s ALA 495 N -3.36 3.63 -0.25 0.00 0.00 -1.26 -4.58 121.76 115.94 1pj9 s ALA 495 Ca 0.05 1.50 -0.14 0.00 0.00 0.00 0.00 51.96 53.37 1pj9 s ALA 495 Cb -0.01 -3.60 -0.04 0.00 0.00 0.00 0.00 23.12 19.47 1pj9 s ALA 495 CO -0.08 -0.94 0.34 0.99 0.00 0.00 0.00 175.76 176.08 1pj9 s THR 496 N -0.57 5.21 0.14 0.00 2.01 -1.26 -4.76 115.64 116.41 1pj9 s THR 496 Ca 0.57 0.53 0.04 0.00 0.31 0.00 0.00 61.69 63.13 1pj9 s THR 496 Cb -0.45 -3.67 -0.19 0.00 0.01 0.00 0.00 72.50 68.20 1pj9 s THR 496 CO 0.54 0.20 1.31 0.00 -0.69 0.00 0.00 174.62 175.98 1pj9 h ALA 497 N 7.98 0.41 -2.90 7.40 0.00 -1.93 -3.29 119.26 126.92 1pj9 h ALA 497 Ca -0.33 -0.82 -0.65 0.00 0.00 0.00 0.00 54.91 53.11 1pj9 h ALA 497 Cb 1.16 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.79 1pj9 h ALA 497 CO 0.65 1.05 -0.52 0.95 0.00 0.00 0.00 179.25 181.38 1pj9 s THR 498 N -2.94 5.16 0.08 0.00 -4.23 -1.26 -4.89 115.64 107.56 1pj9 s THR 498 Ca -0.01 -0.20 -0.33 0.00 -1.18 0.00 0.00 61.69 59.96 1pj9 s THR 498 Cb 0.10 -3.37 -0.13 0.00 1.34 0.00 0.00 72.50 70.44 1pj9 s THR 498 CO 0.83 0.38 1.72 -2.65 -0.54 0.00 0.00 174.62 174.36 1pj9 n PRO 499 N 1.20 2.29 -3.68 3.99 -0.02 -1.07 -4.29 135.00 133.42 1pj9 n PRO 499 Ca -0.13 0.83 -0.21 0.00 -2.02 0.00 0.00 63.50 61.97 1pj9 n PRO 499 Cb 0.53 -2.65 -0.18 0.00 -0.02 0.00 0.00 33.50 31.18 1pj9 n PRO 499 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1pj9 s THR 500 N 2.23 -0.03 -0.17 3.45 2.01 0.49 -4.02 115.64 119.60 1pj9 s THR 500 Ca 0.84 0.28 -0.22 0.00 0.31 0.00 0.00 61.69 62.89 1pj9 s THR 500 Cb -0.64 -0.29 -0.02 0.00 0.01 0.00 0.00 72.50 71.56 1pj9 s THR 500 CO 0.42 0.11 0.69 -0.63 -0.69 0.00 0.00 174.62 174.52 1pj9 s ILE 501 N 2.13 4.99 -0.05 1.82 1.01 -1.26 -1.37 121.20 128.47 1pj9 s ILE 501 Ca 0.04 1.35 0.15 0.00 0.00 0.00 0.00 60.65 62.19 1pj9 s ILE 501 Cb -0.13 -4.01 -0.23 0.00 0.01 0.00 0.00 42.46 38.10 1pj9 s ILE 501 CO -0.04 0.11 0.34 0.61 0.00 0.00 0.00 174.94 175.96 1pj9 n GLY 502 N 3.58 -0.67 3.57 6.18 0.00 0.99 -4.96 105.19 113.88 1pj9 n GLY 502 Ca 0.00 -0.36 -0.12 0.00 0.00 0.00 0.00 46.02 45.55 1pj9 n GLY 502 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1pj9 s HIS 503 N -3.01 -0.42 -0.01 1.61 5.65 -0.84 -4.81 115.29 113.46 1pj9 s HIS 503 Ca -0.05 0.74 0.01 0.00 0.25 0.00 0.00 55.06 56.00 1pj9 s HIS 503 Cb 0.10 0.44 0.01 0.00 -1.18 0.00 0.00 32.58 31.94 1pj9 s HIS 503 CO 0.62 -0.38 -0.01 0.08 -0.65 0.00 0.00 174.74 174.40 1pj9 s VAL 504 N -1.06 0.14 -0.22 0.89 1.01 -1.26 -0.63 120.40 119.26 1pj9 s VAL 504 Ca -0.03 -0.02 -0.27 0.00 0.00 0.00 0.00 61.98 61.66 1pj9 s VAL 504 Cb -0.01 -0.15 0.08 0.00 0.00 0.00 0.00 36.38 36.30 1pj9 s VAL 504 CO 0.03 0.07 0.75 -0.83 0.00 0.00 0.00 175.10 175.12 1pj9 s GLY 505 N 0.25 -0.50 0.94 4.51 0.00 -0.53 -4.51 107.32 107.48 1pj9 s GLY 505 Ca -0.02 1.93 -0.12 0.00 0.00 0.00 0.00 44.72 46.51 1pj9 s GLY 505 CO -0.01 1.55 1.11 2.56 0.00 0.00 0.00 173.10 178.32 1pj9 s PRO 506 N -0.05 0.94 0.00 2.90 0.04 -1.26 0.26 135.00 137.83 1pj9 s PRO 506 Ca -0.02 0.43 0.20 0.00 0.04 0.00 0.00 61.00 61.65 1pj9 s PRO 506 Cb -0.04 -1.80 0.54 0.00 0.04 0.00 0.00 34.50 33.24 1pj9 s PRO 506 CO 0.02 -2.36 1.45 -1.33 0.04 0.00 0.00 177.00 174.82 1pj9 n MET 507 N -3.91 2.67 -3.66 4.56 2.81 -1.26 -4.83 117.12 113.51 1pj9 n MET 507 Ca 0.06 -2.47 -0.06 0.00 -1.81 0.00 0.00 57.70 53.42 1pj9 n MET 507 Cb 0.58 -1.50 -0.07 0.00 -0.71 0.00 0.00 33.22 31.51 1pj9 n MET 507 CO 0.00 0.00 0.00 1.41 1.51 0.00 0.00 175.97 178.89 1pj9 s MET 508 N -1.08 0.44 -0.00 0.03 -2.45 -1.26 -1.16 119.30 113.81 1pj9 s MET 508 Ca 0.42 1.18 -0.30 0.00 -1.25 0.00 0.00 55.69 55.75 1pj9 s MET 508 Cb 0.22 0.50 0.11 0.00 1.25 0.00 0.00 34.83 36.91 1pj9 s MET 508 CO 0.30 -0.22 1.17 0.00 1.05 0.00 0.00 175.02 177.31 1pj9 s ALA 509 N 2.60 -2.04 0.55 4.11 0.00 -0.93 -4.83 121.76 121.21 1pj9 s ALA 509 Ca -0.04 0.73 -0.05 0.00 0.00 0.00 0.00 51.96 52.59 1pj9 s ALA 509 Cb -0.11 0.35 -0.01 0.00 0.00 0.00 0.00 23.12 23.35 1pj9 s ALA 509 CO -0.15 -0.95 0.86 -1.59 0.00 0.00 0.00 175.76 173.92 1pj9 s LYS 510 N -2.68 3.14 0.54 0.00 -2.85 -1.26 -0.34 119.74 116.29 1pj9 s LYS 510 Ca 0.12 0.05 -0.21 0.00 -1.00 0.00 0.00 55.97 54.94 1pj9 s LYS 510 Cb 0.02 -2.31 -0.06 0.00 -2.06 0.00 0.00 37.83 33.41 1pj9 s LYS 510 CO -0.03 -0.52 1.11 -2.30 0.10 0.00 0.00 175.35 173.71 1pj9 n PRO 511 N -2.46 1.30 0.00 1.78 -0.02 -1.26 -2.73 135.00 131.61 1pj9 n PRO 511 Ca 0.03 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1pj9 n PRO 511 Cb 0.57 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 1pj9 n PRO 511 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pj9 n GLY 512 N 1.08 3.31 3.77 -1.23 0.00 0.38 -4.93 105.19 107.57 1pj9 n GLY 512 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1pj9 n GLY 512 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pj9 s VAL 513 N -2.67 3.74 -0.14 1.61 1.01 -1.10 -4.61 120.40 118.23 1pj9 s VAL 513 Ca 0.00 1.49 -0.20 0.00 0.00 0.00 0.00 61.98 63.27 1pj9 s VAL 513 Cb 0.00 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 1pj9 s VAL 513 CO 0.00 0.16 0.59 -0.89 0.00 0.00 0.00 175.10 174.96 1pj9 s THR 514 N -1.47 5.09 0.30 3.92 2.01 -1.26 -1.08 115.64 123.14 1pj9 s THR 514 Ca 0.52 1.15 0.08 0.00 0.31 0.00 0.00 61.69 63.75 1pj9 s THR 514 Cb -0.25 -3.92 -0.04 0.00 0.01 0.00 0.00 72.50 68.31 1pj9 s THR 514 CO 0.31 0.22 0.15 0.27 -0.69 0.00 0.00 174.62 174.88 1pj9 s ILE 515 N 1.23 3.56 -0.18 1.82 -4.36 -0.26 -4.72 121.20 118.28 1pj9 s ILE 515 Ca 0.29 -1.62 -0.01 0.00 -0.26 0.00 0.00 60.65 59.05 1pj9 s ILE 515 Cb -0.16 -3.08 0.00 0.00 1.25 0.00 0.00 42.46 40.47 1pj9 s ILE 515 CO 0.12 -0.27 -0.13 -0.89 0.24 0.00 0.00 174.94 174.01 1pj9 s THR 516 N -2.31 2.69 -0.28 8.37 2.01 0.14 -2.13 115.64 124.13 1pj9 s THR 516 Ca 0.36 -0.74 -0.06 0.00 0.31 0.00 0.00 61.69 61.56 1pj9 s THR 516 Cb -0.05 -2.16 0.01 0.00 0.01 0.00 0.00 72.50 70.30 1pj9 s THR 516 CO 0.23 0.50 0.05 -0.63 -0.69 0.00 0.00 174.62 174.07 1pj9 s ILE 517 N 1.15 3.73 0.15 1.82 1.01 -0.08 -1.45 121.20 127.52 1pj9 s ILE 517 Ca 0.01 -0.74 0.08 0.00 0.00 0.00 0.00 60.65 60.00 1pj9 s ILE 517 Cb -0.14 -2.91 -0.04 0.00 0.01 0.00 0.00 42.46 39.38 1pj9 s ILE 517 CO -0.05 0.12 -0.07 -1.81 0.00 0.00 0.00 174.94 173.13 1pj9 s ASP 518 N 1.47 4.46 0.00 3.58 1.01 0.19 -0.55 116.67 126.82 1pj9 s ASP 518 Ca 0.02 -0.45 0.00 0.00 0.71 0.00 0.00 52.55 52.83 1pj9 s ASP 518 Cb -0.17 -0.85 0.00 0.00 1.01 0.00 0.00 42.92 42.91 1pj9 s ASP 518 CO 0.01 0.13 0.00 0.61 0.21 0.00 0.00 175.17 176.13 1pj9 n GLY 519 N 0.27 -0.68 3.16 0.21 0.00 -0.50 -0.01 105.19 107.64 1pj9 n GLY 519 Ca -0.12 -0.30 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 1pj9 n GLY 519 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pj9 s ARG 520 N -1.31 0.67 -0.31 1.61 1.81 -0.47 -4.28 118.95 116.67 1pj9 s ARG 520 Ca 0.00 -0.68 0.00 0.00 -1.72 0.00 0.00 55.73 53.33 1pj9 s ARG 520 Cb 0.00 0.27 0.00 0.00 -0.45 0.00 0.00 34.95 34.77 1pj9 s ARG 520 CO 0.00 -0.19 0.00 0.41 -0.68 0.00 0.00 175.30 174.84 1pj9 n GLY 521 N 0.68 0.61 0.23 -3.53 0.00 -1.15 -0.38 105.19 101.66 1pj9 n GLY 521 Ca -0.19 -0.69 0.11 0.00 0.00 0.00 0.00 46.02 45.26 1pj9 n GLY 521 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1pj9 h PHE 522 N 0.00 0.00 0.00 1.61 0.04 -1.61 -2.82 116.94 114.16 1pj9 h PHE 522 Ca -0.06 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.71 1pj9 h PHE 522 Cb 0.23 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.38 1pj9 h PHE 522 CO 0.11 0.18 0.00 0.41 -0.60 0.00 0.00 178.31 178.40 1pj9 n GLY 523 N 0.25 -0.71 0.10 -1.45 0.00 -1.26 -4.61 105.19 97.50 1pj9 n GLY 523 Ca 0.01 -1.69 0.01 0.00 0.00 0.00 0.00 46.02 44.35 1pj9 n GLY 523 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1pj9 h SER 524 N 0.00 0.00 -3.14 1.61 4.64 -1.89 -2.20 113.55 112.56 1pj9 h SER 524 Ca 0.00 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.73 1pj9 h SER 524 Cb 0.00 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.04 1pj9 h SER 524 CO 0.00 0.54 -0.18 -0.44 -0.87 0.00 0.00 176.83 175.87 1pj9 s SER 525 N -5.76 6.75 0.23 4.97 0.01 -1.26 -4.62 113.70 114.01 1pj9 s SER 525 Ca -0.03 0.93 -0.31 0.00 1.31 0.00 0.00 55.95 57.85 1pj9 s SER 525 Cb 0.09 -2.23 -0.14 0.00 0.21 0.00 0.00 66.02 63.95 1pj9 s SER 525 CO 0.81 0.20 1.34 0.29 0.41 0.00 0.00 173.24 176.29 1pj9 n LYS 526 N 1.14 1.84 0.00 12.44 5.02 -1.26 -4.26 118.16 133.08 1pj9 n LYS 526 Ca -0.09 0.66 0.00 0.00 -2.02 0.00 0.00 58.31 56.86 1pj9 n LYS 526 Cb 0.52 -2.27 0.00 0.00 -0.02 0.00 0.00 35.03 33.26 1pj9 n LYS 526 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1pj9 n GLY 527 N 2.05 2.28 3.11 0.72 0.00 -1.26 -4.26 105.19 107.83 1pj9 n GLY 527 Ca 0.12 -0.53 -0.19 0.00 0.00 0.00 0.00 46.02 45.42 1pj9 n GLY 527 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pj9 s THR 528 N 4.12 0.95 -0.07 2.61 2.01 0.00 -4.58 115.64 120.68 1pj9 s THR 528 Ca 0.00 -0.88 0.04 0.00 0.31 0.00 0.00 61.69 61.17 1pj9 s THR 528 Cb 0.00 -0.86 -0.01 0.00 0.01 0.00 0.00 72.50 71.63 1pj9 s THR 528 CO 0.00 -0.01 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.03 1pj9 s VAL 529 N -0.78 2.47 -0.10 3.82 1.01 0.72 -0.90 120.40 126.63 1pj9 s VAL 529 Ca 0.00 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.09 1pj9 s VAL 529 Cb -0.07 -1.94 -0.01 0.00 0.00 0.00 0.00 36.38 34.35 1pj9 s VAL 529 CO 0.01 0.57 -0.16 -0.31 0.00 0.00 0.00 175.10 175.20 1pj9 s TYR 530 N -0.19 2.72 -0.46 5.22 1.51 0.17 0.38 117.35 126.70 1pj9 s TYR 530 Ca -0.02 -0.61 -0.03 0.00 -1.01 0.00 0.00 57.07 55.40 1pj9 s TYR 530 Cb -0.13 -1.76 0.12 0.00 -0.11 0.00 0.00 41.96 40.08 1pj9 s TYR 530 CO 0.03 -0.16 0.26 -0.06 -1.11 0.00 0.00 175.55 174.52 1pj9 s PHE 531 N 0.09 3.54 0.00 2.71 0.40 -0.12 -2.37 117.98 122.23 1pj9 s PHE 531 Ca -0.07 -2.45 0.00 0.00 -0.60 0.00 0.00 56.93 53.81 1pj9 s PHE 531 Cb -0.15 -3.24 0.00 0.00 0.51 0.00 0.00 43.02 40.14 1pj9 s PHE 531 CO 0.05 -0.95 0.00 0.41 0.70 0.00 0.00 175.22 175.43 1pj9 n GLY 532 N 4.37 2.28 0.04 4.36 0.00 -0.06 -1.84 105.19 114.34 1pj9 n GLY 532 Ca -0.00 -0.35 0.12 0.00 0.00 0.00 0.00 46.02 45.78 1pj9 n GLY 532 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1pj9 n THR 533 N 0.00 0.21 -2.36 2.61 -2.24 -1.26 -4.89 114.28 106.35 1pj9 n THR 533 Ca 0.00 -0.15 -0.42 0.00 -2.27 0.00 0.00 64.05 61.21 1pj9 n THR 533 Cb 0.00 -0.08 -0.03 0.00 -2.10 0.00 0.00 70.33 68.13 1pj9 n THR 533 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1pj9 s THR 534 N -3.09 3.91 -0.12 4.28 2.01 -0.76 -5.02 115.64 116.85 1pj9 s THR 534 Ca 0.09 1.35 -0.10 0.00 0.31 0.00 0.00 61.69 63.34 1pj9 s THR 534 Cb 0.15 -3.87 -0.05 0.00 0.01 0.00 0.00 72.50 68.75 1pj9 s THR 534 CO 0.68 0.08 0.20 0.00 -0.69 0.00 0.00 174.62 174.90 1pj9 s ALA 535 N 1.34 3.79 -0.09 7.40 0.00 -1.26 -0.95 121.76 131.98 1pj9 s ALA 535 Ca 0.60 -0.55 0.02 0.00 0.00 0.00 0.00 51.96 52.03 1pj9 s ALA 535 Cb -0.30 -2.12 0.01 0.00 0.00 0.00 0.00 23.12 20.71 1pj9 s ALA 535 CO 0.28 0.46 -0.14 0.08 0.00 0.00 0.00 175.76 176.44 1pj9 s VAL 536 N -0.65 1.39 0.27 0.00 1.01 0.16 -4.98 120.40 117.61 1pj9 s VAL 536 Ca 0.16 -0.60 -0.11 0.00 0.00 0.00 0.00 61.98 61.42 1pj9 s VAL 536 Cb -0.13 -1.27 0.00 0.00 0.00 0.00 0.00 36.38 34.98 1pj9 s VAL 536 CO 0.05 0.42 0.50 -0.94 0.00 0.00 0.00 175.10 175.12 1pj9 s SER 537 N 0.88 0.06 0.30 3.32 1.04 -1.26 -0.20 113.70 117.83 1pj9 s SER 537 Ca -0.09 -1.03 0.00 0.00 0.48 0.00 0.00 55.95 55.31 1pj9 s SER 537 Cb -0.15 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.58 1pj9 s SER 537 CO 0.01 -1.20 0.00 0.61 0.98 0.00 0.00 173.24 173.64 1pj9 n GLY 538 N -0.42 0.75 0.33 7.32 0.00 -1.26 -4.15 105.19 107.77 1pj9 n GLY 538 Ca -0.02 -0.82 0.09 0.00 0.00 0.00 0.00 46.02 45.28 1pj9 n GLY 538 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pj9 h ALA 539 N -0.15 1.46 0.00 4.61 0.00 -2.00 -1.16 119.26 122.02 1pj9 h ALA 539 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1pj9 h ALA 539 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1pj9 h ALA 539 CO 0.00 -0.01 0.00 -0.25 0.00 0.00 0.00 179.25 178.99 1pj9 n ASP 540 N -4.79 0.40 -4.42 0.00 9.92 -1.26 -3.75 116.55 112.65 1pj9 n ASP 540 Ca 0.20 0.62 -0.44 0.00 -0.53 0.00 0.00 54.79 54.64 1pj9 n ASP 540 Cb 0.47 -0.70 -0.03 0.00 -0.64 0.00 0.00 41.12 40.22 1pj9 n ASP 540 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1pj9 s ILE 541 N -3.24 4.79 0.18 0.53 1.01 -0.44 -1.03 121.20 123.01 1pj9 s ILE 541 Ca 0.03 -1.40 -0.13 0.00 0.00 0.00 0.00 60.65 59.15 1pj9 s ILE 541 Cb 0.08 -4.68 0.10 0.00 0.01 0.00 0.00 42.46 37.97 1pj9 s ILE 541 CO 0.28 -1.38 1.73 0.74 0.00 0.00 0.00 174.94 176.31 1pj9 h THR 542 N 5.74 0.77 -3.24 2.92 2.02 -1.14 -3.45 112.91 116.53 1pj9 h THR 542 Ca 0.00 -0.10 -0.09 0.00 0.77 0.00 0.00 66.41 67.00 1pj9 h THR 542 Cb 1.04 0.46 -0.17 0.00 -1.74 0.00 0.00 68.15 67.75 1pj9 h THR 542 CO 1.07 0.05 -0.23 -0.94 0.37 0.00 0.00 175.52 175.85 1pj9 s SER 543 N -5.34 -0.15 -0.17 4.18 1.04 -1.10 -5.00 113.70 107.16 1pj9 s SER 543 Ca -0.13 -0.14 -0.08 0.00 0.48 0.00 0.00 55.95 56.08 1pj9 s SER 543 Cb 0.15 0.37 0.07 0.00 0.10 0.00 0.00 66.02 66.70 1pj9 s SER 543 CO 0.73 -0.61 0.38 0.86 0.98 0.00 0.00 173.24 175.58 1pj9 s TRP 544 N -2.45 -0.62 0.24 5.02 -0.11 -1.26 -1.13 118.94 118.61 1pj9 s TRP 544 Ca -0.06 1.29 -0.07 0.00 1.22 0.00 0.00 56.10 58.48 1pj9 s TRP 544 Cb -0.01 0.22 -0.02 0.00 -1.50 0.00 0.00 33.47 32.16 1pj9 s TRP 544 CO -0.03 -0.38 0.34 -1.83 -4.62 0.00 0.00 176.95 170.43 1pj9 s GLU 545 N 1.92 1.44 0.41 5.86 -1.05 -0.37 -4.73 118.70 122.18 1pj9 s GLU 545 Ca -0.06 -1.46 0.21 0.00 -0.15 0.00 0.00 54.97 53.51 1pj9 s GLU 545 Cb -0.10 0.39 1.16 0.00 -0.44 0.00 0.00 34.13 35.14 1pj9 s GLU 545 CO -0.12 -0.56 1.76 0.22 0.95 0.00 0.00 175.26 177.51 1pj9 h ASP 546 N 2.39 0.40 -0.00 0.83 3.58 -1.72 -2.61 116.42 119.28 1pj9 h ASP 546 Ca -0.30 0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.23 1pj9 h ASP 546 Cb 1.25 0.02 0.00 0.00 1.72 0.00 0.00 39.33 42.32 1pj9 h ASP 546 CO 0.43 0.05 -0.27 0.35 -2.88 0.00 0.00 179.24 176.92 1pj9 n THR 547 N -4.61 0.00 -3.73 2.25 -2.24 -1.26 -1.76 114.28 102.93 1pj9 n THR 547 Ca 0.26 -0.37 -0.12 0.00 -2.27 0.00 0.00 64.05 61.56 1pj9 n THR 547 Cb 0.95 1.07 -0.11 0.00 -2.10 0.00 0.00 70.33 70.15 1pj9 n THR 547 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1pj9 s GLN 548 N -1.47 0.39 -0.04 -0.78 0.74 -0.98 -1.41 119.66 116.10 1pj9 s GLN 548 Ca 0.06 0.60 0.05 0.00 0.05 0.00 0.00 55.36 56.12 1pj9 s GLN 548 Cb 0.07 0.09 -0.01 0.00 1.10 0.00 0.00 33.01 34.27 1pj9 s GLN 548 CO 0.28 -0.10 -0.18 0.42 -0.55 0.00 0.00 175.29 175.16 1pj9 s ILE 549 N 0.71 1.48 -0.20 -2.34 1.01 0.28 -1.24 121.20 120.90 1pj9 s ILE 549 Ca -0.04 -0.75 -0.02 0.00 0.00 0.00 0.00 60.65 59.83 1pj9 s ILE 549 Cb -0.05 -1.27 0.00 0.00 0.01 0.00 0.00 42.46 41.15 1pj9 s ILE 549 CO -0.05 0.43 -0.10 -0.54 0.00 0.00 0.00 174.94 174.68 1pj9 s LYS 550 N -0.04 3.24 -0.02 2.79 -0.14 -0.29 -0.90 119.74 124.38 1pj9 s LYS 550 Ca -0.02 -0.70 -0.02 0.00 -1.36 0.00 0.00 55.97 53.86 1pj9 s LYS 550 Cb -0.11 -2.85 0.00 0.00 -1.68 0.00 0.00 37.83 33.20 1pj9 s LYS 550 CO 0.02 -0.20 0.06 0.54 -0.76 0.00 0.00 175.35 175.01 1pj9 s VAL 551 N 1.40 0.01 0.13 3.17 0.11 -0.90 -0.97 120.40 123.35 1pj9 s VAL 551 Ca 0.05 -0.09 -0.30 0.00 -2.93 0.00 0.00 61.98 58.72 1pj9 s VAL 551 Cb -0.14 -0.12 -0.06 0.00 -1.53 0.00 0.00 36.38 34.53 1pj9 s VAL 551 CO -0.07 -0.05 0.94 -0.54 -3.33 0.00 0.00 175.10 172.06 1pj9 s LYS 552 N -0.13 4.71 0.13 1.54 1.02 -0.20 -1.10 119.74 125.72 1pj9 s LYS 552 Ca -0.02 1.43 -0.31 0.00 0.02 0.00 0.00 55.97 57.09 1pj9 s LYS 552 Cb -0.01 -3.36 -0.09 0.00 -0.52 0.00 0.00 37.83 33.85 1pj9 s LYS 552 CO 0.00 0.28 1.53 0.42 -0.92 0.00 0.00 175.35 176.66 1pj9 s ILE 553 N -0.25 2.92 0.69 2.17 1.01 -0.24 -4.83 121.20 122.67 1pj9 s ILE 553 Ca 0.45 0.61 -0.13 0.00 0.00 0.00 0.00 60.65 61.58 1pj9 s ILE 553 Cb -0.24 -3.39 0.02 0.00 0.01 0.00 0.00 42.46 38.86 1pj9 s ILE 553 CO 0.30 0.04 1.09 -2.16 0.00 0.00 0.00 174.94 174.21 1pj9 s PRO 554 N 1.44 2.69 -1.15 2.79 0.04 -1.26 -0.47 135.00 139.07 1pj9 s PRO 554 Ca 0.69 1.25 -0.08 0.00 0.04 0.00 0.00 61.00 62.91 1pj9 s PRO 554 Cb -0.41 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.10 1pj9 s PRO 554 CO 0.31 -1.32 2.64 0.00 0.04 0.00 0.00 177.00 178.67 1pj9 n ALA 555 N -2.82 6.19 -2.31 8.56 0.00 -1.26 -4.59 120.51 124.28 1pj9 n ALA 555 Ca 0.09 -2.68 -0.24 0.00 0.00 0.00 0.00 53.44 50.62 1pj9 n ALA 555 Cb 0.53 -3.10 0.01 0.00 0.00 0.00 0.00 19.45 16.89 1pj9 n ALA 555 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1pj9 s VAL 556 N 2.55 4.15 0.59 0.00 -7.23 -1.26 -5.05 120.40 114.15 1pj9 s VAL 556 Ca 0.56 -0.35 -0.20 0.00 -1.81 0.00 0.00 61.98 60.19 1pj9 s VAL 556 Cb 0.16 -3.55 -0.03 0.00 0.56 0.00 0.00 36.38 33.51 1pj9 s VAL 556 CO -0.04 -0.43 1.31 0.00 -0.31 0.00 0.00 175.10 175.63 1pj9 s ALA 557 N -2.62 2.61 0.45 1.32 0.00 -1.26 -4.92 121.76 117.34 1pj9 s ALA 557 Ca 0.48 1.23 -0.24 0.00 0.00 0.00 0.00 51.96 53.43 1pj9 s ALA 557 Cb -0.10 -3.54 -0.09 0.00 0.00 0.00 0.00 23.12 19.39 1pj9 s ALA 557 CO 0.40 -1.41 1.23 0.41 0.00 0.00 0.00 175.76 176.39 1pj9 n GLY 558 N 0.76 0.44 0.00 0.00 0.00 -1.26 -4.89 105.19 100.24 1pj9 n GLY 558 Ca 0.13 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.30 1pj9 n GLY 558 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pj9 n GLY 559 N 0.87 -2.12 3.70 -0.02 0.00 -0.36 -4.60 105.19 102.67 1pj9 n GLY 559 Ca 0.08 -1.30 -0.36 0.00 0.00 0.00 0.00 46.02 44.44 1pj9 n GLY 559 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1pj9 s ASN 560 N -1.93 6.18 0.07 1.61 2.47 -1.26 -0.59 114.94 121.50 1pj9 s ASN 560 Ca 0.00 0.20 0.06 0.00 0.42 0.00 0.00 52.86 53.54 1pj9 s ASN 560 Cb 0.00 -2.10 -0.03 0.00 -1.45 0.00 0.00 41.25 37.67 1pj9 s ASN 560 CO 0.00 0.13 -0.16 -0.31 -3.72 0.00 0.00 177.10 173.04 1pj9 s TYR 561 N 0.65 1.38 -0.03 0.43 1.51 0.19 -4.93 117.35 116.55 1pj9 s TYR 561 Ca 0.08 -0.42 -0.18 0.00 -1.01 0.00 0.00 57.07 55.54 1pj9 s TYR 561 Cb -0.12 -0.78 -0.05 0.00 -0.11 0.00 0.00 41.96 40.90 1pj9 s TYR 561 CO 0.01 0.09 0.51 -0.80 -1.11 0.00 0.00 175.55 174.25 1pj9 s ASN 562 N -1.61 6.86 -0.13 2.29 0.01 -1.26 -1.21 114.94 119.89 1pj9 s ASN 562 Ca 0.01 1.02 -0.09 0.00 -0.71 0.00 0.00 52.86 53.09 1pj9 s ASN 562 Cb -0.09 -2.31 -0.04 0.00 0.41 0.00 0.00 41.25 39.21 1pj9 s ASN 562 CO 0.02 0.14 0.18 -0.63 -1.51 0.00 0.00 177.10 175.31 1pj9 s ILE 563 N -0.25 5.41 0.00 0.60 -1.09 0.17 -0.88 121.20 125.16 1pj9 s ILE 563 Ca 0.27 0.31 -0.17 0.00 -2.23 0.00 0.00 60.65 58.84 1pj9 s ILE 563 Cb -0.17 -3.47 0.03 0.00 -1.58 0.00 0.00 42.46 37.27 1pj9 s ILE 563 CO 0.14 0.55 0.36 -0.75 -1.23 0.00 0.00 174.94 174.02 1pj9 s LYS 564 N -0.59 0.77 0.22 2.79 2.20 -1.00 -0.02 119.74 124.11 1pj9 s LYS 564 Ca 0.15 -0.24 0.04 0.00 -0.36 0.00 0.00 55.97 55.56 1pj9 s LYS 564 Cb -0.12 0.34 -0.05 0.00 -1.51 0.00 0.00 37.83 36.49 1pj9 s LYS 564 CO 0.04 -0.23 -0.04 0.14 -0.36 0.00 0.00 175.35 174.90 1pj9 s VAL 565 N -1.73 1.19 -0.01 4.02 -7.23 -1.26 0.42 120.40 115.79 1pj9 s VAL 565 Ca -0.10 -2.06 0.00 0.00 -1.81 0.00 0.00 61.98 58.01 1pj9 s VAL 565 Cb -0.03 -2.25 0.01 0.00 0.56 0.00 0.00 36.38 34.67 1pj9 s VAL 565 CO 0.02 -0.42 -0.00 0.00 -0.31 0.00 0.00 175.10 174.39 1pj9 s ALA 566 N -3.32 0.16 1.22 1.32 0.00 -0.08 -0.65 121.76 120.42 1pj9 s ALA 566 Ca 0.26 0.05 -0.20 0.00 0.00 0.00 0.00 51.96 52.06 1pj9 s ALA 566 Cb 0.04 -0.13 0.30 0.00 0.00 0.00 0.00 23.12 23.33 1pj9 s ALA 566 CO 0.07 -0.01 1.12 0.54 0.00 0.00 0.00 175.76 177.49 1pj9 s ASN 567 N 0.37 0.80 0.48 0.00 2.20 -0.75 -0.82 114.94 117.22 1pj9 s ASN 567 Ca -0.03 0.53 0.16 0.00 -0.94 0.00 0.00 52.86 52.58 1pj9 s ASN 567 Cb -0.06 -0.70 1.15 0.00 -2.00 0.00 0.00 41.25 39.65 1pj9 s ASN 567 CO -0.01 -4.19 2.04 0.00 -2.94 0.00 0.00 177.10 172.00 1pj9 h ALA 568 N -2.63 2.08 0.00 3.54 0.00 -1.74 -0.22 119.26 120.29 1pj9 h ALA 568 Ca -0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1pj9 h ALA 568 Cb 1.28 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1pj9 h ALA 568 CO 0.31 -0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.39 1pj9 h ALA 569 N 1.79 1.00 0.00 0.00 0.00 -1.93 -3.47 119.26 116.65 1pj9 h ALA 569 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1pj9 h ALA 569 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1pj9 h ALA 569 CO -0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.63 1pj9 n GLY 570 N 0.63 0.83 3.69 0.00 0.00 -0.09 -5.07 105.19 105.18 1pj9 n GLY 570 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1pj9 n GLY 570 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pj9 s THR 571 N -2.00 4.64 0.35 2.61 2.01 -1.26 -4.78 115.64 117.21 1pj9 s THR 571 Ca 0.00 1.92 -0.17 0.00 0.31 0.00 0.00 61.69 63.74 1pj9 s THR 571 Cb 0.00 -4.23 -0.10 0.00 0.01 0.00 0.00 72.50 68.18 1pj9 s THR 571 CO 0.00 0.03 0.81 0.00 -0.69 0.00 0.00 174.62 174.77 1pj9 s ALA 572 N 1.89 3.23 0.53 7.40 0.00 -1.26 -1.81 121.76 131.74 1pj9 s ALA 572 Ca 0.51 0.17 0.02 0.00 0.00 0.00 0.00 51.96 52.66 1pj9 s ALA 572 Cb -0.21 -2.90 0.08 0.00 0.00 0.00 0.00 23.12 20.09 1pj9 s ALA 572 CO 0.21 0.26 0.59 -1.13 0.00 0.00 0.00 175.76 175.69 1pj9 n SER 573 N -0.38 1.02 -4.77 0.00 3.41 0.18 -4.73 113.62 108.34 1pj9 n SER 573 Ca 0.04 -1.81 -0.30 0.00 -0.26 0.00 0.00 58.87 56.55 1pj9 n SER 573 Cb 0.53 -0.36 0.11 0.00 -0.26 0.00 0.00 64.21 64.22 1pj9 n SER 573 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1pj9 s ASN 574 N -3.48 4.16 -0.14 4.04 6.03 -1.26 -4.78 114.94 119.52 1pj9 s ASN 574 Ca 0.41 1.39 -0.13 0.00 -1.03 0.00 0.00 52.86 53.50 1pj9 s ASN 574 Cb -0.03 -2.11 -0.05 0.00 -3.03 0.00 0.00 41.25 36.04 1pj9 s ASN 574 CO 0.27 -2.19 0.29 -0.69 -2.03 0.00 0.00 177.10 172.74 1pj9 s VAL 575 N -3.07 5.29 -0.36 3.54 1.01 -1.26 -4.61 120.40 120.95 1pj9 s VAL 575 Ca 0.62 0.54 -0.06 0.00 0.00 0.00 0.00 61.98 63.07 1pj9 s VAL 575 Cb -0.16 -3.61 0.05 0.00 0.00 0.00 0.00 36.38 32.66 1pj9 s VAL 575 CO 0.55 0.44 0.13 -0.47 0.00 0.00 0.00 175.10 175.76 1pj9 s TYR 576 N 0.08 3.30 0.74 5.22 6.14 0.96 -4.94 117.35 128.85 1pj9 s TYR 576 Ca 0.17 -1.54 -0.04 0.00 0.64 0.00 0.00 57.07 56.30 1pj9 s TYR 576 Cb -0.13 -2.45 0.15 0.00 0.42 0.00 0.00 41.96 39.95 1pj9 s TYR 576 CO 0.05 -0.77 1.01 -0.40 0.64 0.00 0.00 175.55 176.08 1pj9 n ASP 577 N 4.80 1.00 -1.25 4.32 5.75 -1.26 0.41 116.55 130.32 1pj9 n ASP 577 Ca -0.11 -1.93 -0.12 0.00 -0.01 0.00 0.00 54.79 52.62 1pj9 n ASP 577 Cb 0.44 -0.69 -0.02 0.00 -1.03 0.00 0.00 41.12 39.83 1pj9 n ASP 577 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1pj9 n ASN 578 N -3.12 -3.94 -4.70 -1.12 5.15 -1.23 -4.84 115.26 101.46 1pj9 n ASN 578 Ca 0.16 0.06 -0.41 0.00 -0.60 0.00 0.00 54.58 53.78 1pj9 n ASN 578 Cb 0.55 -3.00 -0.04 0.00 -0.53 0.00 0.00 39.78 36.76 1pj9 n ASN 578 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 1pj9 s PHE 579 N -2.56 3.57 -0.27 1.20 5.36 -0.35 -4.86 117.98 120.08 1pj9 s PHE 579 Ca 0.00 1.42 -0.09 0.00 -0.96 0.00 0.00 56.93 57.31 1pj9 s PHE 579 Cb 0.00 -2.97 -0.03 0.00 -0.34 0.00 0.00 43.02 39.68 1pj9 s PHE 579 CO 0.00 -0.03 0.11 -2.00 -1.46 0.00 0.00 175.22 171.85 1pj9 s GLU 580 N 1.20 3.64 -0.24 10.12 2.12 -0.31 0.52 118.70 135.76 1pj9 s GLU 580 Ca 0.43 -0.50 -0.19 0.00 0.36 0.00 0.00 54.97 55.07 1pj9 s GLU 580 Cb -0.19 -3.45 -0.02 0.00 0.26 0.00 0.00 34.13 30.73 1pj9 s GLU 580 CO 0.20 -0.24 0.58 0.08 -0.54 0.00 0.00 175.26 175.35 1pj9 s VAL 581 N 1.64 5.03 0.66 3.70 1.01 0.24 -2.19 120.40 130.50 1pj9 s VAL 581 Ca 0.06 1.05 -0.11 0.00 0.00 0.00 0.00 61.98 62.98 1pj9 s VAL 581 Cb -0.16 -3.89 -0.02 0.00 0.00 0.00 0.00 36.38 32.31 1pj9 s VAL 581 CO 0.06 0.08 1.05 -0.76 0.00 0.00 0.00 175.10 175.52 1pj9 s LEU 582 N 2.22 3.18 0.00 3.92 1.43 0.54 -1.23 118.68 128.75 1pj9 s LEU 582 Ca 0.25 1.52 0.29 0.00 -1.03 0.00 0.00 54.13 55.16 1pj9 s LEU 582 Cb -0.16 -4.48 1.35 0.00 0.03 0.00 0.00 46.19 42.93 1pj9 s LEU 582 CO 0.09 -1.16 1.94 -1.20 0.23 0.00 0.00 176.35 176.25 1pj9 n SER 583 N -2.94 0.24 0.00 2.29 7.64 -1.26 -4.36 113.62 115.22 1pj9 n SER 583 Ca 0.07 -0.34 0.00 0.00 1.01 0.00 0.00 58.87 59.61 1pj9 n SER 583 Cb 0.54 -0.17 0.00 0.00 -1.01 0.00 0.00 64.21 63.57 1pj9 n SER 583 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1pj9 n GLY 584 N 1.29 -0.35 3.73 0.23 0.00 -1.26 -4.95 105.19 103.89 1pj9 n GLY 584 Ca 0.14 -1.38 -0.36 0.00 0.00 0.00 0.00 46.02 44.42 1pj9 n GLY 584 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1pj9 s ASP 585 N -4.00 4.46 0.05 1.61 1.01 -1.26 -4.74 116.67 113.80 1pj9 s ASP 585 Ca 0.00 2.50 0.05 0.00 0.71 0.00 0.00 52.55 55.81 1pj9 s ASP 585 Cb 0.00 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.29 1pj9 s ASP 585 CO 0.00 -2.09 -0.07 -1.10 0.21 0.00 0.00 175.17 172.12 1pj9 s GLN 586 N -3.58 2.42 0.07 8.23 -1.52 -1.26 -0.45 119.66 123.55 1pj9 s GLN 586 Ca 0.79 -0.83 0.05 0.00 -1.95 0.00 0.00 55.36 53.42 1pj9 s GLN 586 Cb -0.34 -2.44 -0.03 0.00 -0.22 0.00 0.00 33.01 29.98 1pj9 s GLN 586 CO 0.41 0.56 -0.14 0.14 -0.25 0.00 0.00 175.29 176.02 1pj9 s VAL 587 N -1.10 1.09 -0.29 1.09 -7.23 0.09 -4.79 120.40 109.26 1pj9 s VAL 587 Ca 0.19 -1.28 -0.18 0.00 -1.81 0.00 0.00 61.98 58.90 1pj9 s VAL 587 Cb -0.11 -1.05 -0.02 0.00 0.56 0.00 0.00 36.38 35.76 1pj9 s VAL 587 CO 0.11 -0.21 0.53 -0.55 -0.31 0.00 0.00 175.10 174.67 1pj9 s SER 588 N -1.69 6.42 -0.06 4.85 0.15 -1.26 -1.05 113.70 121.06 1pj9 s SER 588 Ca -0.02 0.40 0.05 0.00 0.70 0.00 0.00 55.95 57.08 1pj9 s SER 588 Cb -0.10 -2.29 -0.01 0.00 -1.71 0.00 0.00 66.02 61.92 1pj9 s SER 588 CO 0.02 -0.36 -0.22 -0.69 1.20 0.00 0.00 173.24 173.19 1pj9 s VAL 589 N 2.38 1.84 -0.19 4.45 1.01 0.11 -3.60 120.40 126.41 1pj9 s VAL 589 Ca 0.21 -0.94 -0.18 0.00 0.00 0.00 0.00 61.98 61.07 1pj9 s VAL 589 Cb -0.15 -1.57 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 1pj9 s VAL 589 CO 0.10 0.52 0.52 -0.60 0.00 0.00 0.00 175.10 175.64 1pj9 s ARG 590 N -0.02 4.20 -0.15 2.72 3.52 -0.24 -0.33 118.95 128.65 1pj9 s ARG 590 Ca -0.06 0.42 -0.07 0.00 -0.13 0.00 0.00 55.73 55.89 1pj9 s ARG 590 Cb -0.14 -3.55 -0.04 0.00 -1.56 0.00 0.00 34.95 29.66 1pj9 s ARG 590 CO 0.04 -0.13 0.10 -0.06 -0.81 0.00 0.00 175.30 174.44 1pj9 s PHE 591 N 1.57 3.40 -0.07 5.12 0.40 0.12 -0.62 117.98 127.89 1pj9 s PHE 591 Ca 0.24 0.31 0.01 0.00 -0.60 0.00 0.00 56.93 56.90 1pj9 s PHE 591 Cb -0.15 -2.02 0.02 0.00 0.51 0.00 0.00 43.02 41.38 1pj9 s PHE 591 CO 0.10 0.43 -0.10 0.08 0.70 0.00 0.00 175.22 176.42 1pj9 s VAL 592 N -0.26 0.99 -0.11 -0.44 1.01 0.55 -1.64 120.40 120.50 1pj9 s VAL 592 Ca 0.10 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 61.73 1pj9 s VAL 592 Cb -0.12 -0.94 0.01 0.00 0.00 0.00 0.00 36.38 35.33 1pj9 s VAL 592 CO 0.01 0.33 -0.20 0.54 0.00 0.00 0.00 175.10 175.79 1pj9 s VAL 593 N 0.91 1.81 0.11 2.92 0.11 -0.47 -0.78 120.40 125.02 1pj9 s VAL 593 Ca -0.10 -0.85 -0.08 0.00 -2.93 0.00 0.00 61.98 58.03 1pj9 s VAL 593 Cb -0.15 -1.61 -0.06 0.00 -1.53 0.00 0.00 36.38 33.04 1pj9 s VAL 593 CO 0.01 0.50 0.39 0.20 -3.33 0.00 0.00 175.10 172.87 1pj9 s ASN 594 N 0.73 6.57 -1.16 3.54 0.01 0.65 -1.45 114.94 123.83 1pj9 s ASN 594 Ca -0.11 0.71 -0.19 0.00 -0.71 0.00 0.00 52.86 52.56 1pj9 s ASN 594 Cb -0.16 -2.14 -0.01 0.00 0.41 0.00 0.00 41.25 39.35 1pj9 s ASN 594 CO 0.01 0.12 0.77 -3.20 -1.51 0.00 0.00 177.10 173.29 1pj9 n ASN 595 N 0.54 -4.91 -4.11 -1.22 5.15 -1.06 -1.25 115.26 108.39 1pj9 n ASN 595 Ca -0.06 -1.00 -0.37 0.00 -0.60 0.00 0.00 54.58 52.55 1pj9 n ASN 595 Cb 0.52 -3.42 -0.08 0.00 -0.53 0.00 0.00 39.78 36.27 1pj9 n ASN 595 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1pj9 s ALA 596 N -3.50 3.75 0.38 5.20 0.00 0.64 -4.56 121.76 123.67 1pj9 s ALA 596 Ca 0.43 -3.40 -0.25 0.00 0.00 0.00 0.00 51.96 48.75 1pj9 s ALA 596 Cb -0.15 -2.76 -0.09 0.00 0.00 0.00 0.00 23.12 20.12 1pj9 s ALA 596 CO 0.86 -2.14 1.04 0.95 0.00 0.00 0.00 175.76 176.47 1pj9 s THR 597 N -0.33 3.77 0.21 0.00 -4.23 -1.26 -4.80 115.64 109.01 1pj9 s THR 597 Ca 0.19 1.40 -0.04 0.00 -1.18 0.00 0.00 61.69 62.07 1pj9 s THR 597 Cb -0.17 -3.75 -0.03 0.00 1.34 0.00 0.00 72.50 69.89 1pj9 s THR 597 CO -0.06 0.05 0.22 0.42 -0.54 0.00 0.00 174.62 174.71 1pj9 s THR 598 N -1.61 0.00 0.19 3.99 -4.23 -1.26 -5.10 115.64 107.62 1pj9 s THR 598 Ca 0.56 -1.86 0.05 0.00 -1.18 0.00 0.00 61.69 59.26 1pj9 s THR 598 Cb -0.22 -2.43 -0.04 0.00 1.34 0.00 0.00 72.50 71.15 1pj9 s THR 598 CO 0.28 0.00 0.21 0.00 -0.54 0.00 0.00 174.62 174.57 1pj9 s ALA 599 N -4.11 3.70 0.14 3.99 0.00 -1.26 -5.01 121.76 119.21 1pj9 s ALA 599 Ca 0.35 -1.22 -0.35 0.00 0.00 0.00 0.00 51.96 50.74 1pj9 s ALA 599 Cb 0.05 -1.49 -0.15 0.00 0.00 0.00 0.00 23.12 21.54 1pj9 s ALA 599 CO 0.12 0.42 1.50 1.28 0.00 0.00 0.00 175.76 179.08 1pj9 n LEU 600 N -0.70 2.60 0.00 0.00 4.77 -1.26 -0.69 117.00 121.72 1pj9 n LEU 600 Ca -0.08 1.10 0.00 0.00 -0.03 0.00 0.00 56.01 57.00 1pj9 n LEU 600 Cb 0.55 -1.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.30 1pj9 n LEU 600 CO 0.45 -0.55 0.00 0.61 -1.33 0.00 0.00 177.39 176.57 1pj9 n GLY 601 N 3.11 2.14 3.82 -0.72 0.00 -1.26 -5.04 105.19 107.23 1pj9 n GLY 601 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 1pj9 n GLY 601 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1pj9 s GLN 602 N -0.89 3.80 0.09 1.61 0.74 0.13 -4.67 119.66 120.47 1pj9 s GLN 602 Ca 0.00 -0.03 0.04 0.00 0.05 0.00 0.00 55.36 55.42 1pj9 s GLN 602 Cb 0.00 -3.28 -0.03 0.00 1.10 0.00 0.00 33.01 30.80 1pj9 s GLN 602 CO 0.00 0.58 -0.12 -0.80 -0.55 0.00 0.00 175.29 174.40 1pj9 s ASN 603 N -0.50 1.56 0.11 6.67 0.01 -0.39 -4.61 114.94 117.78 1pj9 s ASN 603 Ca 0.15 -0.74 -0.21 0.00 -0.71 0.00 0.00 52.86 51.35 1pj9 s ASN 603 Cb -0.13 -0.02 -0.07 0.00 0.41 0.00 0.00 41.25 41.44 1pj9 s ASN 603 CO 0.04 -0.19 0.63 -0.69 -1.51 0.00 0.00 177.10 175.38 1pj9 s VAL 604 N -1.99 4.64 0.24 1.60 1.01 -1.26 -0.32 120.40 124.32 1pj9 s VAL 604 Ca 0.03 1.34 0.03 0.00 0.00 0.00 0.00 61.98 63.38 1pj9 s VAL 604 Cb -0.06 -3.95 -0.05 0.00 0.00 0.00 0.00 36.38 32.32 1pj9 s VAL 604 CO 0.01 0.52 0.01 -0.31 0.00 0.00 0.00 175.10 175.33 1pj9 s TYR 605 N -1.15 1.58 -0.08 5.22 1.51 0.82 -1.01 117.35 124.24 1pj9 s TYR 605 Ca 0.32 -0.96 0.04 0.00 -1.01 0.00 0.00 57.07 55.46 1pj9 s TYR 605 Cb -0.20 -0.93 -0.02 0.00 -0.11 0.00 0.00 41.96 40.70 1pj9 s TYR 605 CO 0.21 -0.07 -0.19 -1.17 -1.11 0.00 0.00 175.55 173.22 1pj9 s LEU 606 N -3.32 2.43 0.08 -1.29 2.96 0.41 -0.49 118.68 119.46 1pj9 s LEU 606 Ca 0.30 -0.38 0.02 0.00 -0.22 0.00 0.00 54.13 53.86 1pj9 s LEU 606 Cb 0.06 -1.49 -0.04 0.00 0.50 0.00 0.00 46.19 45.23 1pj9 s LEU 606 CO 0.10 0.25 -0.08 0.28 -1.32 0.00 0.00 176.35 175.58 1pj9 s THR 607 N -0.16 0.72 0.09 3.68 -1.32 -0.53 0.22 115.64 118.34 1pj9 s THR 607 Ca -0.02 -1.65 -0.13 0.00 -1.21 0.00 0.00 61.69 58.68 1pj9 s THR 607 Cb -0.14 -1.34 0.04 0.00 -1.51 0.00 0.00 72.50 69.56 1pj9 s THR 607 CO 0.04 -0.68 0.61 0.61 -2.21 0.00 0.00 174.62 172.99 1pj9 n GLY 608 N 0.47 0.84 0.22 6.08 0.00 -1.12 -1.46 105.19 110.22 1pj9 n GLY 608 Ca -0.16 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.82 1pj9 n GLY 608 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1pj9 n SER 609 N -0.95 0.45 -4.17 1.61 3.41 -0.25 -0.94 113.62 112.78 1pj9 n SER 609 Ca -0.01 -2.00 -0.14 0.00 -0.26 0.00 0.00 58.87 56.46 1pj9 n SER 609 Cb 0.33 -0.22 -0.11 0.00 -0.26 0.00 0.00 64.21 63.96 1pj9 n SER 609 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1pj9 s VAL 610 N -1.57 0.88 0.44 -3.33 -7.23 -1.26 -4.88 120.40 103.44 1pj9 s VAL 610 Ca 0.00 -1.64 0.14 0.00 -1.81 0.00 0.00 61.98 58.67 1pj9 s VAL 610 Cb 0.00 -1.35 0.32 0.00 0.56 0.00 0.00 36.38 35.91 1pj9 s VAL 610 CO 0.00 -0.59 2.00 0.77 -0.31 0.00 0.00 175.10 176.97 1pj9 h SER 611 N 3.54 0.35 -0.01 4.85 4.64 -1.87 0.16 113.55 125.22 1pj9 h SER 611 Ca -0.37 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1pj9 h SER 611 Cb 1.19 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1pj9 h SER 611 CO 0.54 0.22 0.05 -0.33 -0.87 0.00 0.00 176.83 176.44 1pj9 h GLU 612 N 0.39 0.00 -0.26 4.77 3.07 -1.93 0.13 114.58 120.76 1pj9 h GLU 612 Ca 0.25 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.11 1pj9 h GLU 612 Cb 0.47 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.38 1pj9 h GLU 612 CO -0.07 0.00 0.00 1.28 -1.40 0.00 0.00 179.01 178.82 1pj9 n LEU 613 N -3.18 2.96 0.00 1.33 4.77 0.48 -4.92 117.00 118.44 1pj9 n LEU 613 Ca -0.03 -2.27 0.00 0.00 -0.03 0.00 0.00 56.01 53.68 1pj9 n LEU 613 Cb 0.12 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 1pj9 n LEU 613 CO 0.20 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.56 1pj9 n GLY 614 N 0.04 0.68 4.08 -0.72 0.00 0.47 -2.80 105.19 106.95 1pj9 n GLY 614 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 1pj9 n GLY 614 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1pj9 n ASN 615 N 0.00 -0.52 0.00 1.61 3.02 -0.62 -1.16 115.26 117.59 1pj9 n ASN 615 Ca 0.00 -1.13 0.00 0.00 -0.03 0.00 0.00 54.58 53.42 1pj9 n ASN 615 Cb 0.00 -2.42 0.00 0.00 -0.61 0.00 0.00 39.78 36.75 1pj9 n ASN 615 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 1pj9 n TRP 616 N -4.51 0.00 -3.04 3.10 7.02 -0.12 -4.95 117.44 114.95 1pj9 n TRP 616 Ca -0.29 0.00 -0.43 0.00 -1.02 0.00 0.00 57.50 55.76 1pj9 n TRP 616 Cb 0.67 -1.03 -0.06 0.00 -2.42 0.00 0.00 31.31 28.48 1pj9 n TRP 616 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 1pj9 s ASP 617 N -2.17 6.36 0.46 -0.99 -1.08 -0.31 -4.93 116.67 114.01 1pj9 s ASP 617 Ca 0.00 -0.28 0.22 0.00 -0.52 0.00 0.00 52.55 51.97 1pj9 s ASP 617 Cb 0.00 -2.35 1.22 0.00 -1.46 0.00 0.00 42.92 40.33 1pj9 s ASP 617 CO 0.00 -0.87 1.88 -0.65 0.52 0.00 0.00 175.17 176.05 1pj9 h PRO 618 N 8.95 0.25 0.00 4.34 0.11 -1.93 0.40 132.00 144.12 1pj9 h PRO 618 Ca -0.25 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1pj9 h PRO 618 Cb 1.09 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1pj9 h PRO 618 CO 0.94 0.17 0.00 0.00 -0.21 0.00 0.00 178.00 178.89 1pj9 h ALA 619 N 1.61 1.00 -0.13 -0.75 0.00 -1.95 -2.27 119.26 116.78 1pj9 h ALA 619 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1pj9 h ALA 619 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1pj9 h ALA 619 CO -0.11 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.77 1pj9 n LYS 620 N -2.87 2.16 -2.02 0.00 5.02 0.14 -5.05 118.16 115.53 1pj9 n LYS 620 Ca -0.01 -2.61 -0.35 0.00 -2.02 0.00 0.00 58.31 53.32 1pj9 n LYS 620 Cb 0.17 -1.61 0.03 0.00 -0.02 0.00 0.00 35.03 33.60 1pj9 n LYS 620 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1pj9 s ALA 621 N -2.66 2.56 -0.01 7.82 0.00 -0.85 -3.99 121.76 124.63 1pj9 s ALA 621 Ca 0.34 0.82 -0.30 0.00 0.00 0.00 0.00 51.96 52.82 1pj9 s ALA 621 Cb 0.28 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.99 1pj9 s ALA 621 CO 0.06 -1.07 0.97 0.42 0.00 0.00 0.00 175.76 176.14 1pj9 s ILE 622 N -1.86 4.88 -5.00 0.00 -1.09 0.13 -4.82 121.20 113.43 1pj9 s ILE 622 Ca 0.73 2.02 0.00 0.00 -2.23 0.00 0.00 60.65 61.17 1pj9 s ILE 622 Cb -0.25 -4.30 0.00 0.00 -1.58 0.00 0.00 42.46 36.32 1pj9 s ILE 622 CO 0.33 0.16 0.00 0.61 -1.23 0.00 0.00 174.94 174.81 1pj9 n GLY 623 N 2.92 0.61 3.78 6.18 0.00 -1.26 -0.45 105.19 116.98 1pj9 n GLY 623 Ca 0.06 -1.76 -0.41 0.00 0.00 0.00 0.00 46.02 43.90 1pj9 n GLY 623 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1pj9 s PRO 624 N -2.00 4.15 0.93 1.61 0.04 -1.26 -5.08 135.00 133.39 1pj9 s PRO 624 Ca 0.00 2.51 -0.12 0.00 0.04 0.00 0.00 61.00 63.43 1pj9 s PRO 624 Cb 0.00 -2.99 0.15 0.00 0.04 0.00 0.00 34.50 31.70 1pj9 s PRO 624 CO 0.00 -0.48 1.10 -1.64 0.04 0.00 0.00 177.00 176.03 1pj9 s MET 625 N -2.01 0.99 0.22 4.56 -1.94 -0.18 -5.02 119.30 115.92 1pj9 s MET 625 Ca 0.52 0.56 0.05 0.00 -1.71 0.00 0.00 55.69 55.10 1pj9 s MET 625 Cb -0.45 -1.80 -0.03 0.00 2.01 0.00 0.00 34.83 34.56 1pj9 s MET 625 CO 0.61 -2.36 0.34 0.71 -0.01 0.00 0.00 175.02 174.32 1pj9 s TYR 626 N -3.05 3.45 -0.00 -0.03 2.02 0.33 -4.81 117.35 115.26 1pj9 s TYR 626 Ca 0.64 0.00 0.04 0.00 -0.37 0.00 0.00 57.07 57.38 1pj9 s TYR 626 Cb -0.17 -1.58 0.07 0.00 -0.40 0.00 0.00 41.96 39.87 1pj9 s TYR 626 CO 0.56 0.45 1.03 0.27 -1.57 0.00 0.00 175.55 176.30 1pj9 n ASN 627 N -1.26 -0.72 0.04 2.29 0.23 -1.26 -0.18 115.26 114.41 1pj9 n ASN 627 Ca -0.09 -2.00 -0.00 0.00 -0.53 0.00 0.00 54.58 51.96 1pj9 n ASN 627 Cb 0.57 0.22 -0.00 0.00 -2.08 0.00 0.00 39.78 38.48 1pj9 n ASN 627 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1pj9 n GLN 628 N 0.05 0.02 0.00 -3.83 6.02 -0.79 -1.05 117.38 117.80 1pj9 n GLN 628 Ca -0.23 0.01 0.00 0.00 -0.01 0.00 0.00 57.00 56.77 1pj9 n GLN 628 Cb 0.77 -0.53 0.00 0.00 1.02 0.00 0.00 30.24 31.50 1pj9 n GLN 628 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1pj9 n VAL 629 N -3.52 0.00 -0.16 5.09 0.31 -1.26 -4.44 118.33 114.36 1pj9 n VAL 629 Ca -0.01 0.39 -0.11 0.00 -0.01 0.00 0.00 64.34 64.61 1pj9 n VAL 629 Cb 0.02 -1.10 0.02 0.00 -0.91 0.00 0.00 33.84 31.87 1pj9 n VAL 629 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1pj9 h VAL 630 N 0.00 1.27 -3.76 2.52 2.07 -1.95 -3.44 116.25 112.96 1pj9 h VAL 630 Ca 0.00 -1.35 -0.34 0.00 0.82 0.00 0.00 66.70 65.83 1pj9 h VAL 630 Cb 0.00 1.09 -0.19 0.00 -1.52 0.00 0.00 31.29 30.67 1pj9 h VAL 630 CO 0.00 0.47 -0.74 -0.31 0.02 0.00 0.00 177.57 177.01 1pj9 s TYR 631 N -4.71 1.09 -0.02 1.57 1.51 -1.26 -5.15 117.35 110.38 1pj9 s TYR 631 Ca -0.11 -0.61 0.05 0.00 -1.01 0.00 0.00 57.07 55.39 1pj9 s TYR 631 Cb 0.13 -0.60 -0.03 0.00 -0.11 0.00 0.00 41.96 41.35 1pj9 s TYR 631 CO 0.87 0.02 -0.15 -0.65 -1.11 0.00 0.00 175.55 174.52 1pj9 s GLN 632 N -2.56 2.39 0.44 -0.62 1.11 -1.26 -1.89 119.66 117.28 1pj9 s GLN 632 Ca 0.04 -0.78 -0.23 0.00 0.01 0.00 0.00 55.36 54.41 1pj9 s GLN 632 Cb -0.04 -2.33 -0.11 0.00 -1.01 0.00 0.00 33.01 29.52 1pj9 s GLN 632 CO 0.01 0.60 0.77 0.98 0.01 0.00 0.00 175.29 177.65 1pj9 n TYR 633 N 2.06 0.27 1.08 0.91 4.19 -0.22 -0.58 117.16 124.87 1pj9 n TYR 633 Ca -0.17 0.56 0.00 0.00 3.31 0.00 0.00 57.90 61.61 1pj9 n TYR 633 Cb 0.52 -2.10 0.00 0.00 0.49 0.00 0.00 39.34 38.26 1pj9 n TYR 633 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 1pj9 n PRO 634 N 0.23 0.67 -3.71 2.98 -0.04 -1.26 -5.07 135.00 128.81 1pj9 n PRO 634 Ca 0.11 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.20 1pj9 n PRO 634 Cb 0.40 -1.14 -0.06 0.00 -0.04 0.00 0.00 33.50 32.67 1pj9 n PRO 634 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1pj9 s ASN 635 N -0.92 6.57 0.13 3.54 0.01 0.26 -0.26 114.94 124.26 1pj9 s ASN 635 Ca 0.00 0.67 0.07 0.00 -0.71 0.00 0.00 52.86 52.89 1pj9 s ASN 635 Cb 0.00 -2.14 -0.04 0.00 0.41 0.00 0.00 41.25 39.48 1pj9 s ASN 635 CO 0.00 0.33 -0.17 0.26 -1.51 0.00 0.00 177.10 176.01 1pj9 s TRP 636 N -1.14 1.64 0.08 2.20 0.52 -0.53 -4.17 118.94 117.53 1pj9 s TRP 636 Ca 0.22 -0.49 -0.10 0.00 0.02 0.00 0.00 56.10 55.76 1pj9 s TRP 636 Cb -0.14 -0.85 0.00 0.00 -1.15 0.00 0.00 33.47 31.34 1pj9 s TRP 636 CO 0.11 0.23 0.21 1.52 0.02 0.00 0.00 176.95 179.04 1pj9 s TYR 637 N -1.87 0.09 -0.23 -1.98 1.13 0.74 -1.37 117.35 113.87 1pj9 s TYR 637 Ca 0.11 -0.46 -0.27 0.00 -1.41 0.00 0.00 57.07 55.04 1pj9 s TYR 637 Cb -0.06 -0.02 0.11 0.00 -1.10 0.00 0.00 41.96 40.88 1pj9 s TYR 637 CO 0.05 -0.53 0.94 -0.47 -2.51 0.00 0.00 175.55 173.03 1pj9 s TYR 638 N -3.54 -0.52 -0.20 -3.49 5.04 -0.65 -0.51 117.35 113.48 1pj9 s TYR 638 Ca 0.02 1.17 -0.13 0.00 -2.44 0.00 0.00 57.07 55.70 1pj9 s TYR 638 Cb 0.03 0.37 -0.05 0.00 0.35 0.00 0.00 41.96 42.67 1pj9 s TYR 638 CO -0.09 -0.31 0.27 -0.51 -1.34 0.00 0.00 175.55 173.56 1pj9 s ASP 639 N -0.15 6.33 -0.02 4.32 1.01 -1.26 -0.71 116.67 126.19 1pj9 s ASP 639 Ca 0.00 0.38 0.03 0.00 0.71 0.00 0.00 52.55 53.67 1pj9 s ASP 639 Cb -0.04 -2.16 -0.01 0.00 1.01 0.00 0.00 42.92 41.72 1pj9 s ASP 639 CO -0.02 0.05 -0.12 -0.69 0.21 0.00 0.00 175.17 174.61 1pj9 s VAL 640 N 0.83 0.95 -0.27 -1.27 1.01 0.55 -3.50 120.40 118.70 1pj9 s VAL 640 Ca 0.14 -0.49 -0.28 0.00 0.00 0.00 0.00 61.98 61.35 1pj9 s VAL 640 Cb -0.13 -0.81 0.01 0.00 0.00 0.00 0.00 36.38 35.45 1pj9 s VAL 640 CO 0.04 0.28 1.00 -0.55 0.00 0.00 0.00 175.10 175.87 1pj9 s SER 641 N -0.12 6.96 0.13 3.32 0.15 -1.24 -0.71 113.70 122.21 1pj9 s SER 641 Ca 0.02 1.15 0.05 0.00 0.70 0.00 0.00 55.95 57.87 1pj9 s SER 641 Cb -0.06 -2.52 -0.04 0.00 -1.71 0.00 0.00 66.02 61.69 1pj9 s SER 641 CO 0.00 -0.72 -0.12 0.68 1.20 0.00 0.00 173.24 174.28 1pj9 s VAL 642 N 3.30 1.23 0.08 4.45 -7.23 -0.22 -4.85 120.40 117.16 1pj9 s VAL 642 Ca 0.42 -1.87 -0.31 0.00 -1.81 0.00 0.00 61.98 58.41 1pj9 s VAL 642 Cb -0.14 -1.66 -0.08 0.00 0.56 0.00 0.00 36.38 35.06 1pj9 s VAL 642 CO 0.10 -0.58 1.63 -2.16 -0.31 0.00 0.00 175.10 173.78 1pj9 s PRO 643 N -3.18 4.20 0.33 4.82 0.04 -1.26 -0.74 135.00 139.22 1pj9 s PRO 643 Ca 0.12 2.33 -0.29 0.00 0.04 0.00 0.00 61.00 63.20 1pj9 s PRO 643 Cb -0.01 -3.52 -0.12 0.00 0.04 0.00 0.00 34.50 30.89 1pj9 s PRO 643 CO 0.02 -0.71 1.49 0.00 0.04 0.00 0.00 177.00 177.84 1pj9 n ALA 644 N 5.30 2.18 -1.13 8.56 0.00 0.40 -2.85 120.51 132.97 1pj9 n ALA 644 Ca 0.15 0.36 -0.05 0.00 0.00 0.00 0.00 53.44 53.91 1pj9 n ALA 644 Cb 0.40 -2.40 -0.02 0.00 0.00 0.00 0.00 19.45 17.43 1pj9 n ALA 644 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pj9 n GLY 645 N 1.26 0.53 3.86 0.00 0.00 -0.57 -4.89 105.19 105.39 1pj9 n GLY 645 Ca 0.05 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1pj9 n GLY 645 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1pj9 s LYS 646 N -2.11 3.70 -0.20 1.61 2.20 -1.13 -4.72 119.74 119.09 1pj9 s LYS 646 Ca 0.00 0.13 -0.24 0.00 -0.36 0.00 0.00 55.97 55.50 1pj9 s LYS 646 Cb 0.00 -3.12 -0.01 0.00 -1.51 0.00 0.00 37.83 33.19 1pj9 s LYS 646 CO 0.00 0.66 0.77 0.99 -0.36 0.00 0.00 175.35 177.41 1pj9 s THR 647 N -1.21 4.91 -0.04 3.43 2.01 -1.26 -0.90 115.64 122.57 1pj9 s THR 647 Ca 0.26 1.48 0.04 0.00 0.31 0.00 0.00 61.69 63.78 1pj9 s THR 647 Cb -0.14 -4.07 -0.00 0.00 0.01 0.00 0.00 72.50 68.29 1pj9 s THR 647 CO 0.14 0.02 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.29 1pj9 s ILE 648 N 2.30 1.36 -0.06 1.82 1.01 0.68 -4.98 121.20 123.33 1pj9 s ILE 648 Ca 0.34 -0.67 -0.05 0.00 0.00 0.00 0.00 60.65 60.28 1pj9 s ILE 648 Cb -0.16 -1.18 -0.04 0.00 0.01 0.00 0.00 42.46 41.09 1pj9 s ILE 648 CO 0.10 0.40 0.16 -1.61 0.00 0.00 0.00 174.94 173.99 1pj9 s GLU 649 N 0.11 3.42 0.18 2.79 2.02 -1.26 -1.76 118.70 124.20 1pj9 s GLU 649 Ca -0.05 -0.23 -0.14 0.00 0.02 0.00 0.00 54.97 54.57 1pj9 s GLU 649 Cb -0.12 -3.13 0.01 0.00 0.10 0.00 0.00 34.13 30.99 1pj9 s GLU 649 CO 0.02 0.73 0.42 -0.59 0.02 0.00 0.00 175.26 175.86 1pj9 s PHE 650 N -1.17 0.09 0.10 1.61 -0.71 -0.00 -1.09 117.98 116.80 1pj9 s PHE 650 Ca 0.21 -0.44 -0.10 0.00 -1.04 0.00 0.00 56.93 55.56 1pj9 s PHE 650 Cb -0.12 0.20 0.01 0.00 -1.21 0.00 0.00 43.02 41.90 1pj9 s PHE 650 CO 0.11 -0.83 0.24 0.15 -1.34 0.00 0.00 175.22 173.55 1pj9 s LYS 651 N -3.91 0.89 0.18 1.99 1.02 -0.54 -0.40 119.74 118.98 1pj9 s LYS 651 Ca 0.12 -0.89 0.05 0.00 0.02 0.00 0.00 55.97 55.26 1pj9 s LYS 651 Cb 0.01 0.37 -0.04 0.00 -0.52 0.00 0.00 37.83 37.65 1pj9 s LYS 651 CO -0.02 -0.30 0.21 -0.06 -0.92 0.00 0.00 175.35 174.26 1pj9 s PHE 652 N -3.82 3.27 0.12 3.18 0.08 -1.26 -1.45 117.98 118.10 1pj9 s PHE 652 Ca 0.04 0.01 0.05 0.00 0.12 0.00 0.00 56.93 57.15 1pj9 s PHE 652 Cb 0.04 -1.55 -0.04 0.00 -0.57 0.00 0.00 43.02 40.91 1pj9 s PHE 652 CO -0.11 0.51 -0.12 -0.51 -0.10 0.00 0.00 175.22 174.89 1pj9 s LEU 653 N -3.33 2.44 -0.20 -0.37 1.43 0.36 -2.47 118.68 116.53 1pj9 s LEU 653 Ca 0.33 -0.87 0.00 0.00 -1.03 0.00 0.00 54.13 52.55 1pj9 s LEU 653 Cb -0.10 -0.43 0.02 0.00 0.03 0.00 0.00 46.19 45.71 1pj9 s LEU 653 CO 0.26 -0.23 -0.15 -0.54 0.23 0.00 0.00 176.35 175.92 1pj9 s LYS 654 N -3.03 2.95 0.04 1.70 1.02 -0.47 -0.13 119.74 121.82 1pj9 s LYS 654 Ca 0.11 -0.87 0.08 0.00 0.02 0.00 0.00 55.97 55.30 1pj9 s LYS 654 Cb -0.02 -2.73 -0.03 0.00 -0.52 0.00 0.00 37.83 34.53 1pj9 s LYS 654 CO 0.02 -0.27 -0.22 0.15 -0.92 0.00 0.00 175.35 174.11 1pj9 s LYS 655 N 1.31 1.45 -0.17 1.68 1.02 0.57 -0.76 119.74 124.83 1pj9 s LYS 655 Ca 0.03 -0.97 -0.04 0.00 0.02 0.00 0.00 55.97 55.01 1pj9 s LYS 655 Cb -0.14 -1.57 0.06 0.00 -0.52 0.00 0.00 37.83 35.65 1pj9 s LYS 655 CO -0.09 0.40 0.06 -1.14 -0.92 0.00 0.00 175.35 173.66 1pj9 s GLN 656 N -1.20 0.36 6.11 1.68 0.74 -0.69 -1.27 119.66 125.39 1pj9 s GLN 656 Ca 0.08 -0.22 0.00 0.00 0.05 0.00 0.00 55.36 55.27 1pj9 s GLN 656 Cb -0.09 -1.89 0.00 0.00 1.10 0.00 0.00 33.01 32.13 1pj9 s GLN 656 CO 0.02 -0.63 0.00 0.41 -0.55 0.00 0.00 175.29 174.54 1pj9 n GLY 657 N 5.17 2.57 0.97 2.59 0.00 -1.26 -1.63 105.19 113.59 1pj9 n GLY 657 Ca -0.08 -0.42 0.11 0.00 0.00 0.00 0.00 46.02 45.63 1pj9 n GLY 657 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1pj9 n SER 658 N 2.67 2.86 -4.71 1.61 3.41 -1.26 -4.89 113.62 113.31 1pj9 n SER 658 Ca 0.00 -1.92 -0.42 0.00 -0.26 0.00 0.00 58.87 56.27 1pj9 n SER 658 Cb 0.00 -0.25 -0.03 0.00 -0.26 0.00 0.00 64.21 63.67 1pj9 n SER 658 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1pj9 s THR 659 N -1.51 4.87 -0.01 6.66 2.01 -0.64 -5.02 115.64 121.99 1pj9 s THR 659 Ca 0.37 2.00 0.04 0.00 0.31 0.00 0.00 61.69 64.41 1pj9 s THR 659 Cb 0.21 -4.29 -0.01 0.00 0.01 0.00 0.00 72.50 68.41 1pj9 s THR 659 CO 0.29 0.18 -0.13 0.54 -0.69 0.00 0.00 174.62 174.80 1pj9 s VAL 660 N 0.94 1.05 -0.17 3.82 0.11 -1.26 -1.71 120.40 123.18 1pj9 s VAL 660 Ca 0.50 -0.57 -0.00 0.00 -2.93 0.00 0.00 61.98 58.98 1pj9 s VAL 660 Cb -0.21 -0.88 0.00 0.00 -1.53 0.00 0.00 36.38 33.76 1pj9 s VAL 660 CO 0.27 0.30 -0.14 -0.89 -3.33 0.00 0.00 175.10 171.31 1pj9 s THR 661 N -0.29 2.65 0.24 5.04 2.01 0.06 -4.97 115.64 120.38 1pj9 s THR 661 Ca 0.05 -0.76 -0.11 0.00 0.31 0.00 0.00 61.69 61.18 1pj9 s THR 661 Cb -0.05 -2.14 -0.07 0.00 0.01 0.00 0.00 72.50 70.24 1pj9 s THR 661 CO -0.00 0.50 0.58 0.26 -0.69 0.00 0.00 174.62 175.27 1pj9 s TRP 662 N 1.05 3.43 0.60 4.92 0.52 -1.26 -1.37 118.94 126.83 1pj9 s TRP 662 Ca -0.01 0.95 -0.19 0.00 0.02 0.00 0.00 56.10 56.87 1pj9 s TRP 662 Cb -0.15 -2.32 -0.03 0.00 -1.15 0.00 0.00 33.47 29.83 1pj9 s TRP 662 CO -0.04 0.26 1.25 -1.21 0.02 0.00 0.00 176.95 177.23 1pj9 s GLU 663 N -2.76 2.90 0.34 4.98 2.02 -1.03 -4.99 118.70 120.16 1pj9 s GLU 663 Ca 0.48 1.95 -0.01 0.00 0.02 0.00 0.00 54.97 57.40 1pj9 s GLU 663 Cb -0.11 -1.97 0.07 0.00 0.10 0.00 0.00 34.13 32.22 1pj9 s GLU 663 CO 0.20 -1.29 0.46 0.41 0.02 0.00 0.00 175.26 175.06 1pj9 n GLY 664 N 0.65 0.41 7.00 -1.39 0.00 0.29 -4.99 105.19 107.16 1pj9 n GLY 664 Ca 0.14 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.21 1pj9 n GLY 664 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pj9 n GLY 665 N 1.56 -0.70 3.90 -0.02 0.00 -1.26 -4.71 105.19 103.96 1pj9 n GLY 665 Ca 0.07 -1.12 -0.28 0.00 0.00 0.00 0.00 46.02 44.69 1pj9 n GLY 665 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pj9 s SER 666 N -4.00 6.06 0.57 1.61 0.01 -1.26 -5.04 113.70 111.66 1pj9 s SER 666 Ca 0.00 1.04 -0.20 0.00 1.31 0.00 0.00 55.95 58.10 1pj9 s SER 666 Cb 0.00 -2.18 -0.04 0.00 0.21 0.00 0.00 66.02 64.01 1pj9 s SER 666 CO 0.00 -0.81 1.24 0.20 0.41 0.00 0.00 173.24 174.27 1pj9 s ASN 667 N -4.19 5.27 0.66 2.44 0.01 -1.26 -5.01 114.94 112.86 1pj9 s ASN 667 Ca 0.52 2.46 -0.11 0.00 -0.71 0.00 0.00 52.86 55.02 1pj9 s ASN 667 Cb -0.11 -2.61 -0.02 0.00 0.41 0.00 0.00 41.25 38.93 1pj9 s ASN 667 CO 0.48 -1.54 1.05 -1.00 -1.51 0.00 0.00 177.10 174.58 1pj9 s HIS 668 N -1.52 3.44 0.02 2.20 3.76 0.46 -4.83 115.29 118.81 1pj9 s HIS 668 Ca 0.75 1.27 -0.11 0.00 -0.15 0.00 0.00 55.06 56.82 1pj9 s HIS 668 Cb -0.32 -2.83 0.01 0.00 1.11 0.00 0.00 32.58 30.55 1pj9 s HIS 668 CO 0.36 -0.93 0.23 -0.08 -0.85 0.00 0.00 174.74 173.47 1pj9 s THR 669 N -3.18 0.09 0.12 1.30 -1.32 -1.26 -0.82 115.64 110.56 1pj9 s THR 669 Ca 0.56 -0.71 -0.26 0.00 -1.21 0.00 0.00 61.69 60.08 1pj9 s THR 669 Cb -0.12 -0.74 0.07 0.00 -1.51 0.00 0.00 72.50 70.21 1pj9 s THR 669 CO 0.54 -0.39 0.95 0.72 -2.21 0.00 0.00 174.62 174.23 1pj9 s PHE 670 N -1.99 -0.17 -0.17 9.09 -0.71 -0.72 -5.01 117.98 118.30 1pj9 s PHE 670 Ca -0.09 -0.10 0.01 0.00 -1.04 0.00 0.00 56.93 55.71 1pj9 s PHE 670 Cb -0.03 0.62 0.02 0.00 -1.21 0.00 0.00 43.02 42.41 1pj9 s PHE 670 CO -0.00 -0.76 -0.19 0.99 -1.34 0.00 0.00 175.22 173.92 1pj9 s THR 671 N -3.23 1.94 0.57 -4.49 2.01 -1.26 -0.23 115.64 110.94 1pj9 s THR 671 Ca 0.11 -0.86 -0.21 0.00 0.31 0.00 0.00 61.69 61.04 1pj9 s THR 671 Cb -0.01 -1.76 -0.04 0.00 0.01 0.00 0.00 72.50 70.69 1pj9 s THR 671 CO -0.00 0.52 1.30 0.00 -0.69 0.00 0.00 174.62 175.75 1pj9 s ALA 672 N 1.33 2.69 0.75 7.40 0.00 -0.08 -4.90 121.76 128.95 1pj9 s ALA 672 Ca 0.05 1.22 -0.12 0.00 0.00 0.00 0.00 51.96 53.10 1pj9 s ALA 672 Cb -0.13 -3.53 0.05 0.00 0.00 0.00 0.00 23.12 19.51 1pj9 s ALA 672 CO -0.12 -1.32 1.11 -1.25 0.00 0.00 0.00 175.76 174.18 1pj9 s PRO 673 N -3.06 2.27 0.29 0.00 0.04 -1.26 -1.98 135.00 131.30 1pj9 s PRO 673 Ca 0.74 1.33 0.15 0.00 0.04 0.00 0.00 61.00 63.26 1pj9 s PRO 673 Cb -0.37 -1.89 0.31 0.00 0.04 0.00 0.00 34.50 32.59 1pj9 s PRO 673 CO 0.42 -1.66 1.56 0.66 0.04 0.00 0.00 177.00 178.02 1pj9 h SER 674 N -0.79 0.00 -5.02 6.66 4.64 -1.93 -1.50 113.55 115.60 1pj9 h SER 674 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1pj9 h SER 674 Cb 1.25 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.24 1pj9 h SER 674 CO 0.51 0.54 0.18 -0.94 -0.87 0.00 0.00 176.83 176.25 1pj9 s SER 675 N -6.53 -0.42 0.26 4.97 1.04 -1.26 -4.72 113.70 107.03 1pj9 s SER 675 Ca 0.01 -0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.18 1pj9 s SER 675 Cb 0.10 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.85 1pj9 s SER 675 CO 0.73 -1.09 0.00 0.61 0.98 0.00 0.00 173.24 174.48 1pj9 n GLY 676 N -0.39 -1.22 3.90 7.32 0.00 -1.26 -4.96 105.19 108.58 1pj9 n GLY 676 Ca -0.12 -1.24 -0.28 0.00 0.00 0.00 0.00 46.02 44.38 1pj9 n GLY 676 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pj9 s THR 677 N 0.00 1.45 0.04 2.61 -4.23 -1.26 -4.27 115.64 109.98 1pj9 s THR 677 Ca 0.00 -1.57 -0.27 0.00 -1.18 0.00 0.00 61.69 58.67 1pj9 s THR 677 Cb 0.00 -2.02 0.09 0.00 1.34 0.00 0.00 72.50 71.91 1pj9 s THR 677 CO 0.00 0.00 0.76 0.00 -0.54 0.00 0.00 174.62 174.84 1pj9 s ALA 678 N -2.82 -1.74 -0.11 3.99 0.00 -1.24 -4.89 121.76 114.95 1pj9 s ALA 678 Ca 0.27 0.88 0.00 0.00 0.00 0.00 0.00 51.96 53.11 1pj9 s ALA 678 Cb -0.02 0.48 0.02 0.00 0.00 0.00 0.00 23.12 23.60 1pj9 s ALA 678 CO 0.17 -0.66 -0.10 0.99 0.00 0.00 0.00 175.76 176.16 1pj9 s THR 679 N -3.05 1.19 -0.28 0.00 2.01 -1.26 -1.08 115.64 113.16 1pj9 s THR 679 Ca 0.01 -0.41 -0.07 0.00 0.31 0.00 0.00 61.69 61.53 1pj9 s THR 679 Cb -0.01 -1.15 0.00 0.00 0.01 0.00 0.00 72.50 71.35 1pj9 s THR 679 CO -0.08 0.39 0.07 -0.63 -0.69 0.00 0.00 174.62 173.68 1pj9 s ILE 680 N 1.44 3.99 -0.20 1.82 -1.09 0.21 -4.98 121.20 122.39 1pj9 s ILE 680 Ca 0.01 -0.57 -0.01 0.00 -2.23 0.00 0.00 60.65 57.85 1pj9 s ILE 680 Cb -0.13 -3.00 0.01 0.00 -1.58 0.00 0.00 42.46 37.76 1pj9 s ILE 680 CO -0.06 0.16 -0.15 0.21 -1.23 0.00 0.00 174.94 173.87 1pj9 s ASN 681 N 1.52 3.54 0.26 3.58 3.04 -1.26 -0.33 114.94 125.30 1pj9 s ASN 681 Ca 0.04 -0.59 0.01 0.00 0.04 0.00 0.00 52.86 52.36 1pj9 s ASN 681 Cb -0.17 -1.57 -0.04 0.00 -1.54 0.00 0.00 41.25 37.94 1pj9 s ASN 681 CO 0.02 -0.01 0.13 0.68 -3.04 0.00 0.00 177.10 174.88 1pj9 s VAL 682 N 1.35 0.34 -0.03 -5.21 -7.23 0.04 -4.99 120.40 104.67 1pj9 s VAL 682 Ca 0.05 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.20 1pj9 s VAL 682 Cb -0.14 -2.56 -0.04 0.00 0.56 0.00 0.00 36.38 34.21 1pj9 s VAL 682 CO -0.10 0.00 0.08 0.20 -0.31 0.00 0.00 175.10 174.98 1pj9 s ASN 683 N -3.30 5.73 0.17 4.85 0.01 -1.26 -0.26 114.94 120.88 1pj9 s ASN 683 Ca 0.37 0.19 -0.32 0.00 -0.71 0.00 0.00 52.86 52.40 1pj9 s ASN 683 Cb 0.07 -1.68 -0.10 0.00 0.41 0.00 0.00 41.25 39.95 1pj9 s ASN 683 CO 0.15 0.30 1.60 0.86 -1.51 0.00 0.00 177.10 178.50 1pj9 s TRP 684 N -1.14 3.00 -0.33 2.20 -0.11 -0.38 -4.80 118.94 117.39 1pj9 s TRP 684 Ca 0.21 0.57 -0.14 0.00 1.22 0.00 0.00 56.10 57.96 1pj9 s TRP 684 Cb -0.12 -3.96 -0.02 0.00 -1.50 0.00 0.00 33.47 27.87 1pj9 s TRP 684 CO 0.11 -3.58 0.29 -0.65 -4.62 0.00 0.00 176.95 168.50 1pj9 s GLN 685 N 1.23 3.61 0.00 5.86 -0.21 -1.26 -4.99 119.66 123.90 1pj9 s GLN 685 Ca 0.71 -0.48 0.07 0.00 0.02 0.00 0.00 55.36 55.69 1pj9 s GLN 685 Cb -0.44 -3.78 0.45 0.00 1.00 0.00 0.00 33.01 30.23 1pj9 s GLN 685 CO 0.31 -0.43 0.90 -0.35 -2.12 0.00 0.00 175.29 173.61