#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pmo s LEU 14 N 0.00 3.08 -0.16 2.23 1.43 -1.26 -0.08 118.68 123.92 1pmo s LEU 14 Ca 0.00 -0.81 -0.00 0.00 -1.03 0.00 0.00 54.13 52.29 1pmo s LEU 14 Cb 0.00 -1.55 -0.00 0.00 0.03 0.00 0.00 46.19 44.67 1pmo s LEU 14 CO 0.00 -0.11 -0.14 -0.62 0.23 0.00 0.00 176.35 175.71 1pmo s ASP 15 N -3.70 3.77 0.54 2.29 -1.08 -0.40 -4.56 116.67 113.53 1pmo s ASP 15 Ca 0.33 -0.45 0.35 0.00 -0.52 0.00 0.00 52.55 52.26 1pmo s ASP 15 Cb -0.04 -1.59 1.50 0.00 -1.46 0.00 0.00 42.92 41.33 1pmo s ASP 15 CO 0.20 0.07 2.02 0.77 0.52 0.00 0.00 175.17 178.75 1pmo h SER 16 N 7.40 0.00 0.02 -0.34 4.64 -1.97 0.18 113.55 123.48 1pmo h SER 16 Ca -0.34 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.98 1pmo h SER 16 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1pmo h SER 16 CO 0.58 0.00 -0.01 0.03 -0.87 0.00 0.00 176.83 176.56 1pmo h ARG 17 N 0.00 -0.03 -0.00 4.77 3.08 -1.96 -3.35 114.38 116.89 1pmo h ARG 17 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1pmo h ARG 17 Cb 0.42 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1pmo h ARG 17 CO 0.00 0.71 -0.48 1.19 -1.07 0.00 0.00 179.97 180.32 1pmo n PHE 18 N -4.71 0.00 -3.50 3.04 3.72 -1.21 -4.97 117.46 109.83 1pmo n PHE 18 Ca -0.08 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.06 1pmo n PHE 18 Cb 0.36 -0.18 0.03 0.00 -0.94 0.00 0.00 39.48 38.75 1pmo n PHE 18 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1pmo n GLY 19 N 1.45 -0.51 3.54 1.37 0.00 0.63 -4.96 105.19 106.71 1pmo n GLY 19 Ca 0.07 0.17 -0.12 0.00 0.00 0.00 0.00 46.02 46.14 1pmo n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pmo s ALA 20 N -3.19 0.31 -0.05 4.61 0.00 -1.22 -4.93 121.76 117.29 1pmo s ALA 20 Ca 0.50 -1.24 -0.40 0.00 0.00 0.00 0.00 51.96 50.82 1pmo s ALA 20 Cb -0.24 1.09 -0.19 0.00 0.00 0.00 0.00 23.12 23.79 1pmo s ALA 20 CO 0.62 -0.82 1.27 1.17 0.00 0.00 0.00 175.76 178.00 1pmo n LYS 21 N -0.49 0.45 -1.85 0.00 4.81 -1.26 -1.28 118.16 118.54 1pmo n LYS 21 Ca -0.01 0.16 -0.39 0.00 -0.87 0.00 0.00 58.31 57.20 1pmo n LYS 21 Cb 0.62 -1.72 0.02 0.00 0.02 0.00 0.00 35.03 33.96 1pmo n LYS 21 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1pmo s SER 22 N 0.78 5.88 -0.20 3.14 0.15 0.89 -4.68 113.70 119.65 1pmo s SER 22 Ca 0.91 2.83 0.01 0.00 0.70 0.00 0.00 55.95 60.40 1pmo s SER 22 Cb -1.18 -2.65 0.04 0.00 -1.71 0.00 0.00 66.02 60.53 1pmo s SER 22 CO 0.57 -1.17 -0.10 -0.63 1.20 0.00 0.00 173.24 173.12 1pmo s ILE 23 N -1.24 1.66 -0.14 6.45 1.01 -1.26 -4.99 121.20 122.70 1pmo s ILE 23 Ca 0.62 -1.05 -0.08 0.00 0.00 0.00 0.00 60.65 60.14 1pmo s ILE 23 Cb -0.42 -1.75 -0.04 0.00 0.01 0.00 0.00 42.46 40.26 1pmo s ILE 23 CO 0.53 0.14 0.13 -0.55 0.00 0.00 0.00 174.94 175.19 1pmo s SER 24 N 1.38 6.25 0.10 3.58 0.15 -1.26 -4.97 113.70 118.94 1pmo s SER 24 Ca -0.02 0.37 0.24 0.00 0.70 0.00 0.00 55.95 57.24 1pmo s SER 24 Cb -0.17 -2.04 0.34 0.00 -1.71 0.00 0.00 66.02 62.45 1pmo s SER 24 CO -0.08 0.34 1.31 0.35 1.20 0.00 0.00 173.24 176.36 1pmo n THR 25 N 2.48 0.31 -0.03 6.45 -2.24 -1.26 -4.13 114.28 115.85 1pmo n THR 25 Ca -0.19 -0.25 -0.20 0.00 -2.27 0.00 0.00 64.05 61.15 1pmo n THR 25 Cb 0.54 -0.08 -0.13 0.00 -2.10 0.00 0.00 70.33 68.56 1pmo n THR 25 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1pmo h ILE 26 N 0.00 1.17 0.00 2.28 2.04 -1.98 -3.36 117.51 117.66 1pmo h ILE 26 Ca 0.00 -2.35 0.00 0.00 1.00 0.00 0.00 64.86 63.51 1pmo h ILE 26 Cb 0.72 2.75 0.00 0.00 -0.74 0.00 0.00 36.82 39.56 1pmo h ILE 26 CO 0.00 0.60 0.00 0.00 0.00 0.00 0.00 178.15 178.75 1pmo n ALA 27 N -2.99 0.00 -2.10 1.87 0.00 -1.26 -2.21 120.51 113.83 1pmo n ALA 27 Ca -0.23 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.83 1pmo n ALA 27 Cb 0.77 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.23 1pmo n ALA 27 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1pmo n GLU 28 N 0.00 3.90 0.00 0.00 4.71 -1.26 -4.71 120.64 123.28 1pmo n GLU 28 Ca 0.00 -3.69 0.05 0.00 -0.01 0.00 0.00 57.16 53.51 1pmo n GLU 28 Cb 0.00 -2.37 0.22 0.00 -1.01 0.00 0.00 31.44 28.27 1pmo n GLU 28 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 1pmo n SER 29 N 0.24 0.00 -0.98 1.62 3.41 -0.94 -2.17 113.62 114.81 1pmo n SER 29 Ca 0.52 0.33 0.11 0.00 -0.26 0.00 0.00 58.87 59.57 1pmo n SER 29 Cb 0.30 -0.39 0.15 0.00 -0.26 0.00 0.00 64.21 64.01 1pmo n SER 29 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1pmo n LYS 30 N -1.39 2.22 -4.42 4.33 5.02 -1.26 -4.94 118.16 117.73 1pmo n LYS 30 Ca 0.03 -2.02 -0.25 0.00 -2.02 0.00 0.00 58.31 54.05 1pmo n LYS 30 Cb 0.09 -1.45 -0.13 0.00 -0.02 0.00 0.00 35.03 33.52 1pmo n LYS 30 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1pmo s ARG 31 N -1.58 1.25 0.11 1.97 0.52 -0.92 -5.10 118.95 115.21 1pmo s ARG 31 Ca 0.31 -1.12 -0.31 0.00 -0.52 0.00 0.00 55.73 54.09 1pmo s ARG 31 Cb 0.20 -1.49 -0.09 0.00 0.52 0.00 0.00 34.95 34.09 1pmo s ARG 31 CO 0.28 0.36 1.54 0.12 0.02 0.00 0.00 175.30 177.62 1pmo s PHE 32 N -1.03 2.90 0.38 -0.53 2.19 -1.26 -4.91 117.98 115.71 1pmo s PHE 32 Ca 0.08 0.62 -0.25 0.00 0.33 0.00 0.00 56.93 57.70 1pmo s PHE 32 Cb -0.10 -3.87 -0.12 0.00 -1.31 0.00 0.00 43.02 37.63 1pmo s PHE 32 CO 0.04 -3.26 0.97 -2.30 1.83 0.00 0.00 175.22 172.49 1pmo n PRO 33 N 4.54 1.29 0.01 10.12 -0.02 -1.26 -4.94 135.00 144.73 1pmo n PRO 33 Ca 0.14 0.46 -0.21 0.00 -2.02 0.00 0.00 63.50 61.87 1pmo n PRO 33 Cb 0.40 -1.93 -0.14 0.00 -0.02 0.00 0.00 33.50 31.81 1pmo n PRO 33 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1pmo n LEU 34 N 0.82 2.56 -4.79 2.45 4.77 -1.26 -5.00 117.00 116.55 1pmo n LEU 34 Ca 0.10 0.22 -0.22 0.00 -0.03 0.00 0.00 56.01 56.08 1pmo n LEU 34 Cb 0.37 -1.07 -0.05 0.00 -2.33 0.00 0.00 43.42 40.34 1pmo n LEU 34 CO 0.58 0.84 -0.15 -1.00 -1.33 0.00 0.00 177.39 176.33 1pmo s HIS 35 N -2.56 2.82 0.70 -1.77 3.76 -1.26 -5.13 115.29 111.84 1pmo s HIS 35 Ca -0.21 -0.33 -0.11 0.00 -0.15 0.00 0.00 55.06 54.25 1pmo s HIS 35 Cb 0.07 -1.69 0.01 0.00 1.11 0.00 0.00 32.58 32.07 1pmo s HIS 35 CO 0.77 0.28 1.07 -1.21 -0.85 0.00 0.00 174.74 174.81 1pmo s GLU 36 N -3.91 2.95 0.02 1.40 2.02 -1.26 -5.09 118.70 114.83 1pmo s GLU 36 Ca 0.39 0.64 -0.05 0.00 0.02 0.00 0.00 54.97 55.97 1pmo s GLU 36 Cb -0.04 -2.02 -0.01 0.00 0.10 0.00 0.00 34.13 32.16 1pmo s GLU 36 CO 0.24 -1.01 0.07 1.41 0.02 0.00 0.00 175.26 176.00 1pmo s MET 37 N -5.23 0.47 0.23 1.61 -2.45 -1.26 -5.12 119.30 107.55 1pmo s MET 37 Ca 0.58 -0.58 -0.31 0.00 -1.25 0.00 0.00 55.69 54.12 1pmo s MET 37 Cb -0.12 0.18 -0.12 0.00 1.25 0.00 0.00 34.83 36.03 1pmo s MET 37 CO 0.53 -0.11 1.70 1.03 1.05 0.00 0.00 175.02 179.22 1pmo s ARG 38 N -1.82 4.12 0.16 4.11 0.52 -1.26 -4.86 118.95 119.92 1pmo s ARG 38 Ca -0.12 2.61 -0.17 0.00 -0.52 0.00 0.00 55.73 57.53 1pmo s ARG 38 Cb -0.06 -3.06 0.07 0.00 0.52 0.00 0.00 34.95 32.42 1pmo s ARG 38 CO -0.01 -0.73 1.68 -0.44 0.02 0.00 0.00 175.30 175.82 1pmo h ASP 39 N 6.31 -0.31 0.42 0.23 3.32 -1.99 -0.62 116.42 123.78 1pmo h ASP 39 Ca -0.44 0.10 -0.02 0.00 0.02 0.00 0.00 57.03 56.70 1pmo h ASP 39 Cb 1.21 0.21 -0.00 0.00 0.22 0.00 0.00 39.33 40.96 1pmo h ASP 39 CO 0.92 -0.11 -0.09 0.44 -1.72 0.00 0.00 179.24 178.68 1pmo h ASP 40 N 0.01 0.00 0.07 6.45 5.19 -1.99 -0.13 116.42 126.01 1pmo h ASP 40 Ca 0.17 0.00 -0.18 0.00 -0.62 0.00 0.00 57.03 56.40 1pmo h ASP 40 Cb 0.26 0.00 0.02 0.00 0.18 0.00 0.00 39.33 39.79 1pmo h ASP 40 CO -0.36 0.09 -0.76 0.58 -3.12 0.00 0.00 179.24 175.67 1pmo h VAL 41 N 0.00 1.44 -0.92 -1.35 2.07 -1.59 -2.17 116.25 113.74 1pmo h VAL 41 Ca -0.00 -2.29 0.01 0.00 0.82 0.00 0.00 66.70 65.24 1pmo h VAL 41 Cb 0.32 2.83 -0.05 0.00 -1.52 0.00 0.00 31.29 32.87 1pmo h VAL 41 CO 0.01 0.66 0.60 0.00 0.02 0.00 0.00 177.57 178.86 1pmo h ALA 42 N 0.23 1.16 0.15 1.67 0.00 -0.53 -0.29 119.26 121.66 1pmo h ALA 42 Ca -0.11 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1pmo h ALA 42 Cb 1.51 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1pmo h ALA 42 CO 0.15 0.57 -0.07 0.35 0.00 0.00 0.00 179.25 180.24 1pmo h PHE 43 N 1.24 -0.19 -0.57 0.00 3.57 -1.07 -2.02 116.94 117.91 1pmo h PHE 43 Ca 0.33 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.82 1pmo h PHE 43 Cb -0.13 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.64 1pmo h PHE 43 CO -0.01 0.01 0.30 1.96 -2.23 0.00 0.00 178.31 178.34 1pmo h GLN 44 N -0.36 0.78 -0.19 1.11 4.20 -1.13 0.37 115.11 119.89 1pmo h GLN 44 Ca -0.02 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.59 1pmo h GLN 44 Cb 0.29 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 1pmo h GLN 44 CO 0.03 0.59 0.07 0.82 -0.67 0.00 0.00 178.83 179.67 1pmo h ILE 45 N 0.79 1.17 -0.35 2.54 2.04 -0.91 0.23 117.51 123.01 1pmo h ILE 45 Ca 0.20 -0.50 -0.16 0.00 1.00 0.00 0.00 64.86 65.40 1pmo h ILE 45 Cb 0.04 1.14 -0.00 0.00 -0.74 0.00 0.00 36.82 37.26 1pmo h ILE 45 CO -0.03 0.16 -0.41 0.40 0.00 0.00 0.00 178.15 178.27 1pmo h ILE 46 N 0.15 1.27 -0.54 -0.67 2.04 -0.96 -2.81 117.51 116.00 1pmo h ILE 46 Ca 0.06 -1.59 0.02 0.00 1.00 0.00 0.00 64.86 64.35 1pmo h ILE 46 Cb 0.18 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.69 1pmo h ILE 46 CO -0.00 0.53 0.34 -1.13 0.00 0.00 0.00 178.15 177.88 1pmo h ASN 47 N 0.71 0.56 -0.41 1.72 -1.24 -0.15 -2.23 115.58 114.54 1pmo h ASN 47 Ca 0.05 -0.00 -0.05 0.00 0.71 0.00 0.00 56.30 57.01 1pmo h ASN 47 Cb 1.01 -0.12 -0.02 0.00 0.73 0.00 0.00 38.32 39.91 1pmo h ASN 47 CO 0.10 0.40 0.11 0.44 -1.29 0.00 0.00 177.43 177.18 1pmo h ASP 48 N 0.67 0.68 1.22 1.15 3.32 -0.88 -2.73 116.42 119.86 1pmo h ASP 48 Ca 0.21 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1pmo h ASP 48 Cb -0.01 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.36 1pmo h ASP 48 CO -0.08 0.68 -0.21 -1.84 -1.72 0.00 0.00 179.24 176.07 1pmo n GLU 49 N -4.29 0.24 0.15 3.56 0.28 -1.05 -2.90 120.64 116.63 1pmo n GLU 49 Ca 0.03 0.15 0.13 0.00 -0.16 0.00 0.00 57.16 57.31 1pmo n GLU 49 Cb 0.22 -1.74 0.51 0.00 1.43 0.00 0.00 31.44 31.87 1pmo n GLU 49 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 1pmo h LEU 50 N 0.00 0.00 -1.52 -1.84 3.38 -1.08 -1.40 115.31 112.85 1pmo h LEU 50 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1pmo h LEU 50 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1pmo h LEU 50 CO 0.00 0.00 0.00 1.88 0.09 0.00 0.00 178.44 180.41 1pmo h TYR 51 N 0.00 0.00 0.00 1.13 -1.99 -1.57 -1.47 116.97 113.08 1pmo h TYR 51 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1pmo h TYR 51 Cb 0.39 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.12 1pmo h TYR 51 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 179.44 1pmo n LEU 52 N -2.66 0.42 -4.82 3.88 4.77 -0.53 -4.74 117.00 113.32 1pmo n LEU 52 Ca -0.00 0.57 -0.33 0.00 -0.03 0.00 0.00 56.01 56.22 1pmo n LEU 52 Cb 0.18 -0.47 -0.07 0.00 -2.33 0.00 0.00 43.42 40.73 1pmo n LEU 52 CO 0.20 -0.27 0.65 -1.81 -1.33 0.00 0.00 177.39 174.83 1pmo s ASP 53 N -3.79 6.92 0.77 -1.43 1.01 -0.55 -5.06 116.67 114.54 1pmo s ASP 53 Ca 0.09 1.71 -0.10 0.00 0.71 0.00 0.00 52.55 54.95 1pmo s ASP 53 Cb 0.12 -2.54 0.07 0.00 1.01 0.00 0.00 42.92 41.58 1pmo s ASP 53 CO 0.45 -0.38 1.12 -0.83 0.21 0.00 0.00 175.17 175.75 1pmo s GLY 54 N -2.16 1.62 0.00 0.21 0.00 -1.26 -4.98 107.32 100.75 1pmo s GLY 54 Ca 0.62 -0.74 0.19 0.00 0.00 0.00 0.00 44.72 44.80 1pmo s GLY 54 CO 0.14 -0.28 1.01 1.16 0.00 0.00 0.00 173.10 175.14 1pmo n ASN 55 N -3.18 2.08 0.00 1.64 0.23 -1.26 -4.98 115.26 109.79 1pmo n ASN 55 Ca 0.08 -1.54 0.00 0.00 -0.53 0.00 0.00 54.58 52.59 1pmo n ASN 55 Cb 0.61 0.32 0.00 0.00 -2.08 0.00 0.00 39.78 38.63 1pmo n ASN 55 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1pmo n ALA 56 N 0.30 0.00 0.04 -2.53 0.00 -1.26 -4.84 120.51 112.22 1pmo n ALA 56 Ca 0.09 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.56 1pmo n ALA 56 Cb 0.43 -0.85 0.39 0.00 0.00 0.00 0.00 19.45 19.42 1pmo n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pmo h ARG 57 N 0.64 0.43 -0.63 0.00 2.47 -1.93 -1.61 114.38 113.75 1pmo h ARG 57 Ca 0.00 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 1pmo h ARG 57 Cb 0.28 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.52 1pmo h ARG 57 CO 0.00 0.40 0.00 1.04 0.56 0.00 0.00 179.97 181.97 1pmo n GLN 58 N -4.38 3.04 -3.15 0.04 6.02 -1.26 -4.87 117.38 112.82 1pmo n GLN 58 Ca 0.01 -2.63 -0.41 0.00 -0.01 0.00 0.00 57.00 53.96 1pmo n GLN 58 Cb 0.16 -1.62 -0.07 0.00 1.02 0.00 0.00 30.24 29.73 1pmo n GLN 58 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1pmo s ASN 59 N -1.01 6.43 -0.25 1.08 3.84 -0.61 -1.65 114.94 122.77 1pmo s ASN 59 Ca 0.45 0.25 0.13 0.00 0.21 0.00 0.00 52.86 53.90 1pmo s ASN 59 Cb 0.26 -2.31 0.58 0.00 -0.55 0.00 0.00 41.25 39.22 1pmo s ASN 59 CO 0.27 -0.50 1.53 0.18 -2.79 0.00 0.00 177.10 175.80 1pmo n LEU 60 N 5.88 4.52 -0.10 3.21 4.77 -0.08 -4.51 117.00 130.69 1pmo n LEU 60 Ca -0.02 -3.29 -0.18 0.00 -0.03 0.00 0.00 56.01 52.49 1pmo n LEU 60 Cb 0.49 -0.62 -0.13 0.00 -2.33 0.00 0.00 43.42 40.83 1pmo n LEU 60 CO 0.46 0.87 -1.22 0.00 -1.33 0.00 0.00 177.39 176.18 1pmo n ALA 61 N -0.62 1.35 -1.86 -1.18 0.00 -1.22 -1.23 120.51 115.75 1pmo n ALA 61 Ca 0.30 -1.04 -0.32 0.00 0.00 0.00 0.00 53.44 52.38 1pmo n ALA 61 Cb 1.06 -0.22 -0.04 0.00 0.00 0.00 0.00 19.45 20.25 1pmo n ALA 61 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1pmo s THR 62 N -2.53 4.54 -0.20 0.00 -1.32 -1.26 -4.80 115.64 110.07 1pmo s THR 62 Ca -0.30 1.20 0.22 0.00 -1.21 0.00 0.00 61.69 61.61 1pmo s THR 62 Cb 0.08 -3.71 -0.29 0.00 -1.51 0.00 0.00 72.50 67.07 1pmo s THR 62 CO 0.66 -0.65 0.60 0.49 -2.21 0.00 0.00 174.62 173.51 1pmo n PHE 63 N -1.49 0.08 -2.22 9.09 3.01 -1.26 -4.87 117.46 119.79 1pmo n PHE 63 Ca 0.06 0.02 -0.39 0.00 1.01 0.00 0.00 57.45 58.16 1pmo n PHE 63 Cb 0.54 -0.46 -0.02 0.00 -0.01 0.00 0.00 39.48 39.53 1pmo n PHE 63 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1pmo n GLN 65 N 0.31 2.27 0.00 0.00 1.13 -0.47 -4.88 117.38 115.74 1pmo n GLN 65 Ca 0.03 0.82 0.00 0.00 -1.94 0.00 0.00 57.00 55.91 1pmo n GLN 65 Cb 0.45 -2.59 0.00 0.00 0.11 0.00 0.00 30.24 28.21 1pmo n GLN 65 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1pmo n THR 66 N 3.28 0.00 -1.92 5.09 -2.24 -1.26 -4.77 114.28 112.46 1pmo n THR 66 Ca 0.16 -0.20 -0.31 0.00 -2.27 0.00 0.00 64.05 61.43 1pmo n THR 66 Cb 0.30 1.51 0.01 0.00 -2.10 0.00 0.00 70.33 70.06 1pmo n THR 66 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1pmo s TRP 67 N -0.06 3.62 -0.13 4.78 -0.00 -1.26 -4.88 118.94 121.01 1pmo s TRP 67 Ca 0.00 1.26 0.01 0.00 -0.00 0.00 0.00 56.10 57.38 1pmo s TRP 67 Cb 0.00 -2.70 -0.00 0.00 -0.00 0.00 0.00 33.47 30.77 1pmo s TRP 67 CO 0.00 -0.66 -0.17 -0.51 -0.00 0.00 0.00 176.95 175.61 1pmo s ASP 68 N -4.16 3.59 -0.15 5.86 1.01 -1.26 -5.10 116.67 116.46 1pmo s ASP 68 Ca 0.55 -0.46 0.00 0.00 0.71 0.00 0.00 52.55 53.35 1pmo s ASP 68 Cb -0.11 -1.53 0.02 0.00 1.01 0.00 0.00 42.92 42.31 1pmo s ASP 68 CO 0.53 0.13 -0.15 -0.62 0.21 0.00 0.00 175.17 175.27 1pmo s ASP 69 N 0.55 2.76 0.26 0.27 -1.08 -1.26 -5.04 116.67 113.13 1pmo s ASP 69 Ca -0.11 -0.51 -0.02 0.00 -0.52 0.00 0.00 52.55 51.39 1pmo s ASP 69 Cb -0.16 -1.22 0.52 0.00 -1.46 0.00 0.00 42.92 40.60 1pmo s ASP 69 CO 0.04 -0.05 1.75 -0.08 0.52 0.00 0.00 175.17 177.35 1pmo h GLU 70 N 8.04 0.53 -0.42 4.34 4.81 -1.99 -1.50 114.58 128.39 1pmo h GLU 70 Ca -0.39 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 58.76 1pmo h GLU 70 Cb 1.14 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.38 1pmo h GLU 70 CO 0.54 0.35 0.05 -0.91 -0.73 0.00 0.00 179.01 178.32 1pmo h ASN 71 N 0.55 0.60 -0.11 1.04 2.35 -1.99 -1.36 115.58 116.66 1pmo h ASN 71 Ca 0.45 -0.11 -0.14 0.00 -0.55 0.00 0.00 56.30 55.95 1pmo h ASN 71 Cb 0.67 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 1pmo h ASN 71 CO -0.39 0.63 -0.42 0.58 -1.65 0.00 0.00 177.43 176.19 1pmo h VAL 72 N 0.62 1.30 -0.61 2.81 2.07 -1.72 -0.95 116.25 119.76 1pmo h VAL 72 Ca 0.13 -1.60 -0.04 0.00 0.82 0.00 0.00 66.70 66.02 1pmo h VAL 72 Cb 0.31 1.55 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 1pmo h VAL 72 CO 0.01 0.51 0.23 0.45 0.02 0.00 0.00 177.57 178.79 1pmo h HIS 73 N 0.52 0.93 -0.34 1.57 3.86 -0.85 -1.19 115.15 119.65 1pmo h HIS 73 Ca 0.04 -0.08 -0.03 0.00 -1.16 0.00 0.00 60.37 59.14 1pmo h HIS 73 Cb 0.95 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 29.13 1pmo h HIS 73 CO 0.04 0.75 0.09 0.87 0.86 0.00 0.00 177.93 180.54 1pmo h LYS 74 N 0.85 0.54 -0.74 2.45 1.57 -1.00 -0.27 116.57 119.96 1pmo h LYS 74 Ca 0.20 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 1pmo h LYS 74 Cb 0.22 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 1pmo h LYS 74 CO -0.01 0.59 0.26 -0.07 -0.57 0.00 0.00 179.45 179.64 1pmo h LEU 75 N 0.39 1.06 -0.38 2.94 3.38 -1.03 -1.60 115.31 120.07 1pmo h LEU 75 Ca 0.11 -0.18 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 1pmo h LEU 75 Cb 0.29 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1pmo h LEU 75 CO 0.00 0.96 -0.17 0.24 0.09 0.00 0.00 178.44 179.56 1pmo h MET 76 N 1.10 0.78 -0.98 1.13 2.86 -1.09 -2.44 114.93 116.30 1pmo h MET 76 Ca 0.24 -0.34 0.02 0.00 -2.06 0.00 0.00 59.70 57.57 1pmo h MET 76 Cb 0.27 -0.02 -0.05 0.00 0.06 0.00 0.00 31.60 31.85 1pmo h MET 76 CO -0.01 0.96 0.64 0.22 1.06 0.00 0.00 176.91 179.78 1pmo h ASP 77 N 0.58 1.09 0.93 1.22 3.58 -0.78 -1.68 116.42 121.36 1pmo h ASP 77 Ca 0.08 -0.02 -0.04 0.00 0.42 0.00 0.00 57.03 57.47 1pmo h ASP 77 Cb 0.72 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 41.50 1pmo h ASP 77 CO 0.05 0.77 -0.20 -0.07 -2.88 0.00 0.00 179.24 176.92 1pmo h LEU 78 N 1.28 0.00 -2.23 2.28 3.38 -1.17 -3.24 115.31 115.62 1pmo h LEU 78 Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.34 1pmo h LEU 78 Cb -0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1pmo h LEU 78 CO -0.10 0.20 0.00 -1.20 0.09 0.00 0.00 178.44 177.43 1pmo n SER 79 N -3.36 3.30 -0.37 -0.43 7.64 -0.67 -4.61 113.62 115.11 1pmo n SER 79 Ca 0.00 -1.97 0.29 0.00 1.01 0.00 0.00 58.87 58.20 1pmo n SER 79 Cb 0.41 -0.18 0.58 0.00 -1.01 0.00 0.00 64.21 64.01 1pmo n SER 79 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 1pmo h ILE 80 N 4.37 0.36 -0.08 0.44 2.10 -1.47 -0.95 117.51 122.29 1pmo h ILE 80 Ca 0.00 -0.09 0.00 0.00 1.08 0.00 0.00 64.86 65.85 1pmo h ILE 80 Cb 0.96 0.09 0.00 0.00 -1.09 0.00 0.00 36.82 36.78 1pmo h ILE 80 CO 0.00 0.05 0.00 0.59 -1.08 0.00 0.00 178.15 177.71 1pmo n ASN 81 N -4.62 2.39 -4.64 2.19 3.02 -1.26 -4.88 115.26 107.46 1pmo n ASN 81 Ca 0.30 -1.68 -0.43 0.00 -0.03 0.00 0.00 54.58 52.74 1pmo n ASN 81 Cb 1.11 -0.04 -0.02 0.00 -0.61 0.00 0.00 39.78 40.22 1pmo n ASN 81 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1pmo s LYS 82 N -1.23 4.00 -0.37 3.52 1.02 -0.36 -4.97 119.74 121.34 1pmo s LYS 82 Ca 0.19 1.40 -0.24 0.00 0.02 0.00 0.00 55.97 57.35 1pmo s LYS 82 Cb 0.13 -3.86 0.01 0.00 -0.52 0.00 0.00 37.83 33.60 1pmo s LYS 82 CO 0.19 -1.01 0.82 1.21 -0.92 0.00 0.00 175.35 175.64 1pmo s ASN 83 N 2.64 6.56 0.37 2.83 3.84 -1.26 -1.23 114.94 128.69 1pmo s ASN 83 Ca 0.57 0.36 0.12 0.00 0.21 0.00 0.00 52.86 54.11 1pmo s ASN 83 Cb -0.19 -2.41 0.90 0.00 -0.55 0.00 0.00 41.25 39.01 1pmo s ASN 83 CO 0.21 -0.78 1.85 -0.25 -2.79 0.00 0.00 177.10 175.34 1pmo h TRP 84 N 8.53 0.76 0.00 0.43 7.01 -0.95 -2.05 115.95 129.68 1pmo h TRP 84 Ca -0.24 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 60.76 1pmo h TRP 84 Cb 1.09 -0.23 -0.00 0.00 -2.10 0.00 0.00 29.16 27.91 1pmo h TRP 84 CO 0.80 0.23 -0.23 0.97 -2.79 0.00 0.00 178.44 177.43 1pmo h ILE 85 N 0.60 0.11 -1.63 2.65 6.09 -1.78 -3.40 117.51 120.14 1pmo h ILE 85 Ca 0.48 -1.16 -0.73 0.00 -1.37 0.00 0.00 64.86 62.08 1pmo h ILE 85 Cb 0.91 1.98 -0.14 0.00 0.47 0.00 0.00 36.82 40.03 1pmo h ILE 85 CO -0.22 0.06 1.76 -0.67 -3.07 0.00 0.00 178.15 176.00 1pmo n ASP 86 N -3.05 5.06 0.08 2.19 -0.08 -0.77 -4.79 116.55 115.19 1pmo n ASP 86 Ca 0.03 -2.98 0.10 0.00 -1.51 0.00 0.00 54.79 50.43 1pmo n ASP 86 Cb 0.56 -1.60 0.57 0.00 2.34 0.00 0.00 41.12 42.99 1pmo n ASP 86 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1pmo h LYS 87 N 6.92 0.21 0.24 -0.67 6.56 -1.81 -2.18 116.57 125.83 1pmo h LYS 87 Ca 0.37 -0.01 -0.01 0.00 -1.06 0.00 0.00 60.65 59.94 1pmo h LYS 87 Cb 0.82 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 32.43 1pmo h LYS 87 CO 1.39 0.14 -0.11 1.49 -2.06 0.00 0.00 179.45 180.30 1pmo h GLU 88 N 0.22 -0.30 0.00 3.15 4.81 -1.96 -2.95 114.58 117.55 1pmo h GLU 88 Ca 0.14 0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.23 1pmo h GLU 88 Cb 0.28 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 1pmo h GLU 88 CO -0.03 -0.02 -0.77 1.49 -0.73 0.00 0.00 179.01 178.96 1pmo h GLU 89 N -0.59 0.00 -2.16 1.92 4.57 -1.94 -3.37 114.58 113.02 1pmo h GLU 89 Ca -0.03 0.00 -0.59 0.00 -1.18 0.00 0.00 59.36 57.56 1pmo h GLU 89 Cb 0.43 0.00 -0.41 0.00 -0.16 0.00 0.00 28.75 28.60 1pmo h GLU 89 CO 0.05 0.77 -0.68 0.66 -1.18 0.00 0.00 179.01 178.63 1pmo n TYR 90 N -3.45 2.97 -0.24 0.92 4.02 -0.83 -4.93 117.16 115.63 1pmo n TYR 90 Ca 0.00 -4.05 -0.05 0.00 -0.01 0.00 0.00 57.90 53.78 1pmo n TYR 90 Cb 0.79 -0.52 0.05 0.00 -0.02 0.00 0.00 39.34 39.64 1pmo n TYR 90 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1pmo h PRO 91 N 4.10 0.88 -0.56 -0.72 0.11 -1.69 -2.46 132.00 131.66 1pmo h PRO 91 Ca 0.18 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 66.12 1pmo h PRO 91 Cb 0.69 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.59 1pmo h PRO 91 CO 0.77 0.59 -0.09 0.37 -0.21 0.00 0.00 178.00 179.43 1pmo h GLN 92 N 0.90 1.05 -0.71 1.05 5.75 -1.91 -0.51 115.11 120.74 1pmo h GLN 92 Ca 0.24 -0.38 -0.05 0.00 -0.15 0.00 0.00 58.65 58.31 1pmo h GLN 92 Cb -0.10 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.35 1pmo h GLN 92 CO -0.05 1.08 0.24 0.77 -2.65 0.00 0.00 178.83 178.21 1pmo h SER 93 N 0.94 1.00 -0.59 -0.69 0.02 -1.93 -0.96 113.55 111.35 1pmo h SER 93 Ca 0.15 -0.17 -0.08 0.00 -0.84 0.00 0.00 61.79 60.85 1pmo h SER 93 Cb 0.66 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 1pmo h SER 93 CO 0.05 0.92 0.08 0.00 -1.14 0.00 0.00 176.83 176.75 1pmo h ALA 94 N 1.21 0.99 -0.28 3.77 0.00 -1.12 -1.46 119.26 122.38 1pmo h ALA 94 Ca 0.23 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1pmo h ALA 94 Cb 0.27 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1pmo h ALA 94 CO -0.01 0.63 0.04 0.00 0.00 0.00 0.00 179.25 179.91 1pmo h ALA 95 N 1.14 0.37 -0.84 0.00 0.00 -0.63 -1.84 119.26 117.47 1pmo h ALA 95 Ca 0.19 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1pmo h ALA 95 Cb 0.43 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1pmo h ALA 95 CO 0.01 0.07 0.55 0.82 0.00 0.00 0.00 179.25 180.70 1pmo h ILE 96 N 0.28 1.22 -0.61 0.00 2.04 -1.01 -1.65 117.51 117.78 1pmo h ILE 96 Ca 0.08 -0.41 -0.03 0.00 1.00 0.00 0.00 64.86 65.51 1pmo h ILE 96 Cb 0.35 -0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.39 1pmo h ILE 96 CO 0.01 0.21 0.27 -0.78 0.00 0.00 0.00 178.15 177.86 1pmo h ASP 97 N 1.14 0.81 -0.52 1.72 3.58 -1.00 -1.87 116.42 120.28 1pmo h ASP 97 Ca 0.31 -0.15 -0.06 0.00 0.42 0.00 0.00 57.03 57.55 1pmo h ASP 97 Cb -0.12 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 40.69 1pmo h ASP 97 CO -0.06 0.73 0.11 -0.07 -2.88 0.00 0.00 179.24 177.07 1pmo h LEU 98 N 0.84 0.84 -0.26 2.28 3.38 -0.65 -2.18 115.31 119.56 1pmo h LEU 98 Ca 0.21 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1pmo h LEU 98 Cb 0.15 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1pmo h LEU 98 CO -0.02 0.84 0.16 0.03 0.09 0.00 0.00 178.44 179.54 1pmo h ARG 99 N 0.85 0.36 -0.73 1.13 3.08 -0.97 -2.21 114.38 115.90 1pmo h ARG 99 Ca 0.18 -0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.24 1pmo h ARG 99 Cb 0.35 -0.07 -0.05 0.00 0.08 0.00 0.00 29.97 30.28 1pmo h ARG 99 CO 0.00 0.29 0.44 0.00 -1.07 0.00 0.00 179.97 179.64 1pmo h VAL 101 N 0.82 1.15 -0.58 0.00 2.07 -1.16 -0.14 116.25 118.42 1pmo h VAL 101 Ca 0.31 -0.34 -0.05 0.00 0.82 0.00 0.00 66.70 67.44 1pmo h VAL 101 Cb 0.12 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 1pmo h VAL 101 CO -0.15 0.15 0.15 0.78 0.02 0.00 0.00 177.57 178.52 1pmo h ASN 102 N 0.64 0.87 -0.62 0.57 2.35 -0.78 -0.72 115.58 117.88 1pmo h ASN 102 Ca 0.17 -0.23 -0.07 0.00 -0.55 0.00 0.00 56.30 55.62 1pmo h ASN 102 Cb -0.01 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.11 1pmo h ASN 102 CO -0.03 0.87 0.11 0.24 -1.65 0.00 0.00 177.43 176.97 1pmo h MET 103 N 0.83 1.04 -0.37 0.81 2.86 -0.53 0.12 114.93 119.69 1pmo h MET 103 Ca 0.18 -0.27 -0.15 0.00 -2.06 0.00 0.00 59.70 57.40 1pmo h MET 103 Cb 0.33 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1pmo h MET 103 CO 0.00 0.96 -0.37 0.28 1.06 0.00 0.00 176.91 178.84 1pmo h VAL 104 N 0.98 1.28 -0.52 -2.22 2.07 -0.86 -0.52 116.25 116.46 1pmo h VAL 104 Ca 0.20 -1.54 0.01 0.00 0.82 0.00 0.00 66.70 66.19 1pmo h VAL 104 Cb 0.42 1.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 1pmo h VAL 104 CO 0.01 0.51 0.34 0.00 0.02 0.00 0.00 177.57 178.45 1pmo h ALA 105 N 0.76 0.66 -0.53 1.67 0.00 -0.76 -1.89 119.26 119.17 1pmo h ALA 105 Ca 0.06 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1pmo h ALA 105 Cb 0.96 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 1pmo h ALA 105 CO 0.09 0.08 0.32 0.22 0.00 0.00 0.00 179.25 179.97 1pmo h ASP 106 N 0.68 0.63 -0.70 0.00 3.58 -0.58 -1.35 116.42 118.69 1pmo h ASP 106 Ca 0.19 -0.05 0.10 0.00 0.42 0.00 0.00 57.03 57.69 1pmo h ASP 106 Cb -0.06 -0.16 -0.05 0.00 1.72 0.00 0.00 39.33 40.78 1pmo h ASP 106 CO -0.05 0.50 0.46 0.25 -2.88 0.00 0.00 179.24 177.52 1pmo h LEU 107 N 0.71 0.50 -2.69 2.28 5.85 -0.47 -1.72 115.31 119.77 1pmo h LEU 107 Ca 0.19 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.92 1pmo h LEU 107 Cb -0.02 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 40.92 1pmo h LEU 107 CO -0.04 0.30 0.00 0.79 -0.34 0.00 0.00 178.44 179.15 1pmo n TRP 108 N -4.49 1.26 -3.12 1.25 8.01 -0.77 -4.93 117.44 114.65 1pmo n TRP 108 Ca 0.12 -0.50 -0.22 0.00 -1.31 0.00 0.00 57.50 55.58 1pmo n TRP 108 Cb 0.36 -0.21 0.04 0.00 -2.01 0.00 0.00 31.31 29.50 1pmo n TRP 108 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.69 177.40 1pmo n HIS 109 N 0.95 -2.12 -2.15 -5.99 8.25 -0.65 -2.38 115.22 111.14 1pmo n HIS 109 Ca 0.22 0.61 -0.39 0.00 -0.26 0.00 0.00 57.72 57.90 1pmo n HIS 109 Cb 0.77 -4.56 -0.01 0.00 1.12 0.00 0.00 29.99 27.31 1pmo n HIS 109 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1pmo s ALA 110 N -3.20 3.20 0.43 -1.41 0.00 -0.56 -4.43 121.76 115.79 1pmo s ALA 110 Ca 0.35 1.12 -0.24 0.00 0.00 0.00 0.00 51.96 53.19 1pmo s ALA 110 Cb -0.16 -3.44 -0.10 0.00 0.00 0.00 0.00 23.12 19.42 1pmo s ALA 110 CO 0.44 -0.71 0.98 -2.30 0.00 0.00 0.00 175.76 174.17 1pmo n PRO 111 N 0.07 1.29 -1.72 0.00 -0.02 -1.26 -4.82 135.00 128.55 1pmo n PRO 111 Ca 0.04 0.46 -0.42 0.00 -2.02 0.00 0.00 63.50 61.56 1pmo n PRO 111 Cb 0.45 -2.02 -0.03 0.00 -0.02 0.00 0.00 33.50 31.88 1pmo n PRO 111 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pmo n ALA 112 N -0.57 2.82 -1.63 3.55 0.00 -1.26 -4.89 120.51 118.53 1pmo n ALA 112 Ca 0.10 0.39 -0.46 0.00 0.00 0.00 0.00 53.44 53.47 1pmo n ALA 112 Cb 0.40 -2.53 -0.03 0.00 0.00 0.00 0.00 19.45 17.28 1pmo n ALA 112 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1pmo n PRO 113 N 4.13 1.68 0.00 0.00 -0.02 -1.26 -4.85 135.00 134.68 1pmo n PRO 113 Ca 0.16 0.60 0.10 0.00 -2.02 0.00 0.00 63.50 62.34 1pmo n PRO 113 Cb 0.35 -2.18 0.52 0.00 -0.02 0.00 0.00 33.50 32.17 1pmo n PRO 113 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1pmo n LYS 114 N 1.86 0.31 0.00 -0.52 5.02 -1.26 -4.26 118.16 119.32 1pmo n LYS 114 Ca 0.13 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 1pmo n LYS 114 Cb 0.29 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 1pmo n LYS 114 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1pmo n ASN 115 N -1.27 0.00 0.00 4.39 6.94 -1.26 -5.07 115.26 119.00 1pmo n ASN 115 Ca 0.10 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.66 1pmo n ASN 115 Cb 0.16 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.58 1pmo n ASN 115 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1pmo n GLY 116 N 3.20 0.00 2.87 4.83 0.00 -1.26 -5.14 105.19 109.69 1pmo n GLY 116 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1pmo n GLY 116 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1pmo s GLN 117 N 0.00 0.67 0.78 1.61 2.00 -1.26 -4.99 119.66 118.48 1pmo s GLN 117 Ca 0.00 -0.06 -0.12 0.00 -2.00 0.00 0.00 55.36 53.19 1pmo s GLN 117 Cb 0.00 -0.72 0.07 0.00 0.80 0.00 0.00 33.01 33.15 1pmo s GLN 117 CO 0.00 -0.09 1.12 0.00 -0.50 0.00 0.00 175.29 175.82 1pmo s ALA 118 N 0.91 2.09 -0.37 1.58 0.00 -1.26 -4.81 121.76 119.90 1pmo s ALA 118 Ca -0.11 0.46 -0.16 0.00 0.00 0.00 0.00 51.96 52.15 1pmo s ALA 118 Cb -0.14 -3.35 -0.00 0.00 0.00 0.00 0.00 23.12 19.63 1pmo s ALA 118 CO -0.00 -1.94 0.41 0.08 0.00 0.00 0.00 175.76 174.31 1pmo s VAL 119 N -2.65 5.12 0.00 0.00 1.01 -1.26 -4.92 120.40 117.70 1pmo s VAL 119 Ca 0.65 -0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.62 1pmo s VAL 119 Cb -0.20 -3.91 0.00 0.00 0.00 0.00 0.00 36.38 32.27 1pmo s VAL 119 CO 0.53 -0.21 0.00 0.61 0.00 0.00 0.00 175.10 176.03 1pmo n GLY 120 N 4.97 -0.75 3.36 4.51 0.00 -1.26 -0.25 105.19 115.77 1pmo n GLY 120 Ca -0.08 -1.11 -0.12 0.00 0.00 0.00 0.00 46.02 44.72 1pmo n GLY 120 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1pmo s THR 121 N -2.00 0.04 0.44 2.61 -1.32 -0.39 -5.01 115.64 110.01 1pmo s THR 121 Ca 0.00 -0.33 -0.12 0.00 -1.21 0.00 0.00 61.69 60.03 1pmo s THR 121 Cb 0.00 -1.07 -0.07 0.00 -1.51 0.00 0.00 72.50 69.86 1pmo s THR 121 CO 0.00 -0.18 0.83 0.21 -2.21 0.00 0.00 174.62 173.27 1pmo s ASN 122 N -2.56 6.55 0.30 8.08 3.84 -1.26 -2.28 114.94 127.62 1pmo s ASN 122 Ca 0.00 1.27 0.03 0.00 0.21 0.00 0.00 52.86 54.36 1pmo s ASN 122 Cb 0.00 -2.38 -0.02 0.00 -0.55 0.00 0.00 41.25 38.30 1pmo s ASN 122 CO -0.09 -0.45 0.30 0.42 -2.79 0.00 0.00 177.10 174.48 1pmo s THR 123 N -2.44 0.00 0.24 -5.21 -4.23 -0.21 -4.93 115.64 98.85 1pmo s THR 123 Ca 0.54 -1.89 0.05 0.00 -1.18 0.00 0.00 61.69 59.21 1pmo s THR 123 Cb -0.10 -2.52 -0.03 0.00 1.34 0.00 0.00 72.50 71.18 1pmo s THR 123 CO 0.31 0.00 1.58 0.40 -0.54 0.00 0.00 174.62 176.37 1pmo h ILE 124 N 2.23 1.38 -1.71 2.99 1.08 -1.85 0.14 117.51 121.78 1pmo h ILE 124 Ca -0.28 -1.94 0.05 0.00 -0.39 0.00 0.00 64.86 62.29 1pmo h ILE 124 Cb 1.24 1.98 -0.01 0.00 -3.07 0.00 0.00 36.82 36.96 1pmo h ILE 124 CO 0.40 0.57 0.15 0.61 -0.69 0.00 0.00 178.15 179.19 1pmo n GLY 125 N 0.22 1.02 0.22 5.37 0.00 -1.26 -0.62 105.19 110.13 1pmo n GLY 125 Ca -0.02 -0.95 0.07 0.00 0.00 0.00 0.00 46.02 45.12 1pmo n GLY 125 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1pmo h SER 126 N 0.45 0.00 0.49 1.61 0.02 -1.84 -2.85 113.55 111.43 1pmo h SER 126 Ca -0.06 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 1pmo h SER 126 Cb 0.27 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 1pmo h SER 126 CO 0.08 0.27 -0.40 0.28 -1.14 0.00 0.00 176.83 175.93 1pmo h SER 127 N 0.00 -1.05 -0.73 3.07 0.02 -1.96 0.34 113.55 113.25 1pmo h SER 127 Ca -0.00 0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 1pmo h SER 127 Cb 0.61 0.33 -0.03 0.00 0.14 0.00 0.00 62.40 63.45 1pmo h SER 127 CO 0.04 -0.57 0.43 -0.08 -1.14 0.00 0.00 176.83 175.50 1pmo h GLU 128 N -0.88 0.99 -0.80 3.45 4.81 -1.97 -1.00 114.58 119.18 1pmo h GLU 128 Ca -0.05 -0.09 0.08 0.00 -0.13 0.00 0.00 59.36 59.17 1pmo h GLU 128 Cb 0.75 -0.21 -0.07 0.00 0.63 0.00 0.00 28.75 29.86 1pmo h GLU 128 CO -0.01 0.71 0.46 0.00 -0.73 0.00 0.00 179.01 179.44 1pmo h ALA 129 N 1.23 1.13 -0.38 2.92 0.00 -1.23 -0.32 119.26 122.60 1pmo h ALA 129 Ca 0.26 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 55.06 1pmo h ALA 129 Cb -0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1pmo h ALA 129 CO -0.05 0.12 -0.29 0.00 0.00 0.00 0.00 179.25 179.03 1pmo h MET 131 N 0.70 0.45 -0.48 0.00 2.86 -0.24 0.35 114.93 118.57 1pmo h MET 131 Ca 0.08 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1pmo h MET 131 Cb 0.84 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.40 1pmo h MET 131 CO 0.07 0.44 0.28 -0.07 1.06 0.00 0.00 176.91 178.70 1pmo h LEU 132 N 0.35 0.58 -0.86 1.22 3.38 -1.01 0.15 115.31 119.12 1pmo h LEU 132 Ca 0.10 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1pmo h LEU 132 Cb 0.15 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1pmo h LEU 132 CO -0.01 0.47 0.43 1.23 0.09 0.00 0.00 178.44 180.65 1pmo h GLY 133 N 0.64 1.31 1.02 0.83 0.00 -0.90 -1.66 103.07 104.32 1pmo h GLY 133 Ca 0.17 -0.64 -0.08 0.00 0.00 0.00 0.00 47.33 46.78 1pmo h GLY 133 CO -0.03 0.61 0.02 -1.33 0.00 0.00 0.00 176.54 175.81 1pmo h GLY 134 N 1.22 1.00 0.92 4.60 0.00 0.33 -1.51 103.07 109.62 1pmo h GLY 134 Ca 0.30 -0.72 -0.02 0.00 0.00 0.00 0.00 47.33 46.89 1pmo h GLY 134 CO -0.04 0.66 0.12 -0.33 0.00 0.00 0.00 176.54 176.95 1pmo h MET 135 N 0.80 0.46 -0.96 4.80 2.07 -0.49 -0.69 114.93 120.92 1pmo h MET 135 Ca 0.15 -0.09 0.01 0.00 -2.07 0.00 0.00 59.70 57.71 1pmo h MET 135 Cb 0.50 -0.07 -0.05 0.00 -1.87 0.00 0.00 31.60 30.11 1pmo h MET 135 CO 0.02 0.48 0.64 0.00 1.07 0.00 0.00 176.91 179.12 1pmo h ALA 136 N 0.96 1.22 -0.25 6.32 0.00 -1.21 0.35 119.26 126.65 1pmo h ALA 136 Ca 0.10 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1pmo h ALA 136 Cb 0.19 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1pmo h ALA 136 CO -0.01 0.61 0.15 1.98 0.00 0.00 0.00 179.25 181.98 1pmo h MET 137 N 1.30 0.34 -0.48 0.00 -1.53 -0.94 -0.56 114.93 113.06 1pmo h MET 137 Ca 0.35 -0.03 -0.01 0.00 -3.44 0.00 0.00 59.70 56.57 1pmo h MET 137 Cb -0.15 -0.07 -0.02 0.00 -0.55 0.00 0.00 31.60 30.81 1pmo h MET 137 CO -0.08 0.28 0.26 -0.22 0.14 0.00 0.00 176.91 177.29 1pmo h LYS 138 N 0.31 0.68 -0.52 0.39 3.64 -0.46 -1.74 116.57 118.86 1pmo h LYS 138 Ca 0.09 -0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 1pmo h LYS 138 Cb 0.02 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 1pmo h LYS 138 CO -0.02 0.53 0.19 -1.49 -2.27 0.00 0.00 179.45 176.39 1pmo h TRP 139 N 0.64 0.81 -0.57 1.91 6.55 -0.72 -0.03 115.95 124.55 1pmo h TRP 139 Ca 0.17 -0.07 -0.01 0.00 0.95 0.00 0.00 58.89 59.93 1pmo h TRP 139 Cb 0.05 -0.24 -0.03 0.00 -0.86 0.00 0.00 29.16 28.09 1pmo h TRP 139 CO -0.02 0.68 0.32 0.00 -1.05 0.00 0.00 178.44 178.37 1pmo h ARG 140 N 0.70 0.78 -0.56 0.49 3.08 -0.93 -0.84 114.38 117.10 1pmo h ARG 140 Ca 0.17 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 1pmo h ARG 140 Cb 0.23 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 1pmo h ARG 140 CO -0.01 0.59 0.25 2.35 -1.07 0.00 0.00 179.97 182.09 1pmo h TRP 141 N 0.76 0.82 -0.35 3.04 7.01 -1.08 -2.27 115.95 123.88 1pmo h TRP 141 Ca 0.20 -0.05 -0.01 0.00 2.11 0.00 0.00 58.89 61.14 1pmo h TRP 141 Cb 0.03 -0.25 -0.02 0.00 -2.10 0.00 0.00 29.16 26.83 1pmo h TRP 141 CO -0.02 0.65 0.18 0.00 -2.79 0.00 0.00 178.44 176.46 1pmo h ARG 142 N 0.76 0.50 -0.60 2.65 3.08 -0.65 -1.63 114.38 118.48 1pmo h ARG 142 Ca 0.19 -0.07 0.08 0.00 0.07 0.00 0.00 59.98 60.25 1pmo h ARG 142 Cb 0.15 -0.09 -0.06 0.00 0.08 0.00 0.00 29.97 30.04 1pmo h ARG 142 CO -0.02 0.44 0.26 0.87 -1.07 0.00 0.00 179.97 180.45 1pmo h LYS 143 N 0.44 0.46 0.02 0.04 1.57 -0.99 -1.71 116.57 116.39 1pmo h LYS 143 Ca 0.12 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1pmo h LYS 143 Cb 0.09 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1pmo h LYS 143 CO -0.02 0.30 -0.01 0.00 -0.57 0.00 0.00 179.45 179.16 1pmo h ARG 144 N 0.47 -0.02 -0.91 3.15 3.08 -1.09 -1.77 114.38 117.28 1pmo h ARG 144 Ca 0.29 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.34 1pmo h ARG 144 Cb 0.31 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.32 1pmo h ARG 144 CO -0.26 0.16 0.56 0.52 -1.07 0.00 0.00 179.97 179.88 1pmo h MET 145 N -0.21 1.23 -0.64 0.04 2.86 -1.18 -2.04 114.93 114.99 1pmo h MET 145 Ca -0.00 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.50 1pmo h MET 145 Cb 0.20 -0.26 -0.03 0.00 0.06 0.00 0.00 31.60 31.57 1pmo h MET 145 CO 0.00 0.85 0.29 0.93 1.06 0.00 0.00 176.91 180.05 1pmo h GLU 146 N 1.25 0.93 0.00 1.72 5.08 -1.24 0.00 114.58 122.33 1pmo h GLU 146 Ca 0.33 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1pmo h GLU 146 Cb -0.07 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.02 1pmo h GLU 146 CO -0.06 0.76 0.00 0.00 -1.00 0.00 0.00 179.01 178.71 1pmo n ALA 147 N -2.36 1.88 0.13 3.43 0.00 -0.67 -1.01 120.51 121.91 1pmo n ALA 147 Ca 0.04 -0.07 0.03 0.00 0.00 0.00 0.00 53.44 53.44 1pmo n ALA 147 Cb 0.14 -1.23 0.04 0.00 0.00 0.00 0.00 19.45 18.40 1pmo n ALA 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pmo n ALA 148 N -1.19 2.37 -1.05 0.00 0.00 -0.36 -4.98 120.51 115.31 1pmo n ALA 148 Ca 0.08 -0.69 -0.02 0.00 0.00 0.00 0.00 53.44 52.81 1pmo n ALA 148 Cb 0.09 -0.19 -0.01 0.00 0.00 0.00 0.00 19.45 19.34 1pmo n ALA 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pmo n GLY 149 N 0.21 0.40 3.94 0.00 0.00 -0.18 -5.00 105.19 104.56 1pmo n GLY 149 Ca 0.04 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 1pmo n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pmo s LYS 150 N -1.39 3.46 0.88 1.61 1.02 -0.16 -4.99 119.74 120.18 1pmo s LYS 150 Ca 0.00 -0.28 -0.11 0.00 0.02 0.00 0.00 55.97 55.61 1pmo s LYS 150 Cb 0.00 -2.62 0.12 0.00 -0.52 0.00 0.00 37.83 34.82 1pmo s LYS 150 CO 0.00 0.07 1.11 -2.14 -0.92 0.00 0.00 175.35 173.47 1pmo s PRO 151 N -4.39 1.32 -0.04 -1.68 0.02 -1.26 -4.19 135.00 124.77 1pmo s PRO 151 Ca 0.41 1.23 0.23 0.00 0.02 0.00 0.00 61.00 62.90 1pmo s PRO 151 Cb -0.10 -1.78 0.40 0.00 0.02 0.00 0.00 34.50 33.04 1pmo s PRO 151 CO 0.37 -2.32 1.15 0.25 -0.33 0.00 0.00 177.00 176.13 1pmo n THR 152 N -3.99 0.19 0.19 0.99 -2.24 -1.26 -4.88 114.28 103.28 1pmo n THR 152 Ca 0.09 -1.20 0.12 0.00 -2.27 0.00 0.00 64.05 60.79 1pmo n THR 152 Cb 0.53 1.00 0.05 0.00 -2.10 0.00 0.00 70.33 69.82 1pmo n THR 152 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 1pmo h ASP 153 N 1.15 0.00 -2.13 3.42 2.03 -2.01 -3.41 116.42 115.47 1pmo h ASP 153 Ca -0.25 -0.03 -0.57 0.00 -0.73 0.00 0.00 57.03 55.45 1pmo h ASP 153 Cb 1.75 0.00 -0.41 0.00 -0.83 0.00 0.00 39.33 39.85 1pmo h ASP 153 CO 0.07 0.01 -0.83 1.17 -1.03 0.00 0.00 179.24 178.64 1pmo n LYS 154 N -2.67 1.99 -2.37 4.15 4.81 -1.26 -5.10 118.16 117.70 1pmo n LYS 154 Ca 0.01 -4.15 -0.37 0.00 -0.87 0.00 0.00 58.31 52.93 1pmo n LYS 154 Cb 0.53 -1.90 -0.02 0.00 0.02 0.00 0.00 35.03 33.66 1pmo n LYS 154 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1pmo s PRO 155 N -2.35 4.03 0.13 1.64 0.02 -1.26 -4.81 135.00 132.40 1pmo s PRO 155 Ca 0.41 1.72 0.02 0.00 0.02 0.00 0.00 61.00 63.17 1pmo s PRO 155 Cb 0.21 -2.58 -0.04 0.00 0.02 0.00 0.00 34.50 32.11 1pmo s PRO 155 CO -0.07 -0.31 -0.05 0.54 -0.33 0.00 0.00 177.00 176.77 1pmo s ASN 156 N -1.32 1.29 -0.06 2.53 2.20 -0.32 -0.81 114.94 118.45 1pmo s ASN 156 Ca 0.59 -1.06 0.02 0.00 -0.94 0.00 0.00 52.86 51.46 1pmo s ASN 156 Cb -0.27 0.08 0.02 0.00 -2.00 0.00 0.00 41.25 39.08 1pmo s ASN 156 CO 0.34 -0.47 -0.08 -0.22 -2.94 0.00 0.00 177.10 173.72 1pmo s LEU 157 N -3.11 1.47 -0.16 3.54 0.20 0.60 -0.49 118.68 120.73 1pmo s LEU 157 Ca 0.17 -0.22 -0.11 0.00 0.69 0.00 0.00 54.13 54.66 1pmo s LEU 157 Cb 0.05 -0.65 -0.05 0.00 -0.43 0.00 0.00 46.19 45.11 1pmo s LEU 157 CO -0.01 -0.02 0.20 -0.69 -0.29 0.00 0.00 176.35 175.54 1pmo s VAL 158 N 0.84 5.38 0.35 1.68 1.01 -0.99 -0.12 120.40 128.54 1pmo s VAL 158 Ca -0.12 0.34 -0.16 0.00 0.00 0.00 0.00 61.98 62.05 1pmo s VAL 158 Cb -0.15 -3.52 0.04 0.00 0.00 0.00 0.00 36.38 32.75 1pmo s VAL 158 CO 0.01 0.48 0.73 0.00 0.00 0.00 0.00 175.10 176.33 1pmo n GLY 160 N -0.51 2.95 3.11 0.00 0.00 -1.26 -0.08 105.19 109.40 1pmo n GLY 160 Ca -0.06 -1.81 -0.43 0.00 0.00 0.00 0.00 46.02 43.72 1pmo n GLY 160 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1pmo n PRO 161 N 0.00 1.52 -1.26 1.61 -0.04 -1.26 -4.55 135.00 131.02 1pmo n PRO 161 Ca 0.00 -1.88 -0.30 0.00 -0.04 0.00 0.00 63.50 61.28 1pmo n PRO 161 Cb 0.00 -2.95 0.12 0.00 -0.04 0.00 0.00 33.50 30.62 1pmo n PRO 161 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1pmo s VAL 162 N 5.20 2.95 0.61 0.52 -7.23 -1.26 -4.64 120.40 116.55 1pmo s VAL 162 Ca 0.58 0.31 -0.12 0.00 -1.81 0.00 0.00 61.98 60.94 1pmo s VAL 162 Cb 0.14 -2.82 -0.04 0.00 0.56 0.00 0.00 36.38 34.22 1pmo s VAL 162 CO 0.12 -0.40 1.03 -1.58 -0.31 0.00 0.00 175.10 173.95 1pmo s GLN 163 N -4.94 3.55 0.58 4.82 -0.44 -1.26 -4.93 119.66 117.03 1pmo s GLN 163 Ca 0.62 0.83 0.30 0.00 -2.50 0.00 0.00 55.36 54.61 1pmo s GLN 163 Cb -0.17 -2.07 1.44 0.00 -1.64 0.00 0.00 33.01 30.56 1pmo s GLN 163 CO 0.56 -0.61 1.84 0.97 0.50 0.00 0.00 175.29 178.56 1pmo h ILE 164 N -0.14 0.37 -0.08 -2.34 2.10 -1.96 -1.53 117.51 113.92 1pmo h ILE 164 Ca -0.45 0.00 0.02 0.00 1.08 0.00 0.00 64.86 65.52 1pmo h ILE 164 Cb 1.19 0.54 -0.00 0.00 -1.09 0.00 0.00 36.82 37.46 1pmo h ILE 164 CO 0.61 0.00 0.07 0.00 -1.08 0.00 0.00 178.15 177.75 1pmo h TRP 166 N 0.00 0.00 -0.55 0.00 4.06 -1.64 -0.34 115.95 117.47 1pmo h TRP 166 Ca 0.04 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 60.88 1pmo h TRP 166 Cb 0.17 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.31 1pmo h TRP 166 CO 0.00 0.84 -0.08 0.45 -3.56 0.00 0.00 178.44 176.09 1pmo h HIS 167 N 0.00 1.12 -0.30 0.49 3.86 -1.34 -0.55 115.15 118.43 1pmo h HIS 167 Ca -0.01 -0.22 -0.04 0.00 -1.16 0.00 0.00 60.37 58.94 1pmo h HIS 167 Cb 1.56 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 29.73 1pmo h HIS 167 CO 0.00 1.03 0.04 0.87 0.86 0.00 0.00 177.93 180.72 1pmo h LYS 168 N 0.91 0.51 -0.10 2.45 1.57 -1.12 -1.19 116.57 119.61 1pmo h LYS 168 Ca 0.15 -0.15 0.02 0.00 -1.87 0.00 0.00 60.65 58.81 1pmo h LYS 168 Cb 0.63 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.86 1pmo h LYS 168 CO 0.04 0.62 -0.05 0.35 -0.57 0.00 0.00 179.45 179.85 1pmo h PHE 169 N 0.33 -0.12 -0.38 -1.35 3.57 -0.82 0.28 116.94 118.45 1pmo h PHE 169 Ca 0.09 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.64 1pmo h PHE 169 Cb 0.37 0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.14 1pmo h PHE 169 CO 0.03 -0.08 0.17 0.00 -2.23 0.00 0.00 178.31 176.19 1pmo h ALA 170 N 1.05 0.46 -0.02 2.41 0.00 -0.99 -0.72 119.26 121.44 1pmo h ALA 170 Ca 0.06 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1pmo h ALA 170 Cb 0.13 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1pmo h ALA 170 CO -0.13 -0.21 -0.00 -0.09 0.00 0.00 0.00 179.25 178.82 1pmo h ARG 171 N 0.35 0.03 0.00 0.00 9.65 -0.90 -0.19 114.38 123.33 1pmo h ARG 171 Ca 0.17 -0.01 -0.07 0.00 -1.10 0.00 0.00 59.98 58.97 1pmo h ARG 171 Cb 0.10 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.67 1pmo h ARG 171 CO -0.14 0.34 -0.32 1.88 2.80 0.00 0.00 179.97 184.53 1pmo h TYR 172 N -0.27 0.00 -0.27 2.20 0.05 -0.31 -3.12 116.97 115.25 1pmo h TYR 172 Ca 0.01 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.79 1pmo h TYR 172 Cb 0.32 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.06 1pmo h TYR 172 CO 0.03 0.32 0.00 0.91 -1.05 0.00 0.00 178.16 178.37 1pmo n TRP 173 N -3.91 0.88 -3.80 4.88 8.01 -0.29 -5.00 117.44 118.21 1pmo n TRP 173 Ca -0.02 -0.83 -0.29 0.00 -1.31 0.00 0.00 57.50 55.06 1pmo n TRP 173 Cb 0.39 -0.28 0.02 0.00 -2.01 0.00 0.00 31.31 29.42 1pmo n TRP 173 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1pmo n ASP 174 N -0.38 -2.98 -4.23 -0.99 8.00 -0.80 -4.99 116.55 110.18 1pmo n ASP 174 Ca 0.20 -1.01 -0.31 0.00 0.71 0.00 0.00 54.79 54.38 1pmo n ASP 174 Cb 0.83 -3.26 -0.17 0.00 -0.02 0.00 0.00 41.12 38.51 1pmo n ASP 174 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1pmo s VAL 175 N -3.68 1.98 0.01 2.53 1.01 -0.15 -4.71 120.40 117.39 1pmo s VAL 175 Ca 0.25 -1.00 -0.30 0.00 0.00 0.00 0.00 61.98 60.93 1pmo s VAL 175 Cb -0.09 -1.69 -0.06 0.00 0.00 0.00 0.00 36.38 34.54 1pmo s VAL 175 CO 0.87 0.55 1.43 -0.70 0.00 0.00 0.00 175.10 177.24 1pmo s GLU 176 N 0.12 4.27 -0.41 2.72 2.12 0.01 -4.51 118.70 123.02 1pmo s GLU 176 Ca -0.11 2.01 -0.19 0.00 0.36 0.00 0.00 54.97 57.04 1pmo s GLU 176 Cb -0.16 -3.57 0.01 0.00 0.26 0.00 0.00 34.13 30.68 1pmo s GLU 176 CO 0.06 -0.59 0.53 -1.17 -0.54 0.00 0.00 175.26 173.55 1pmo s LEU 177 N 2.40 4.57 -0.99 2.70 1.98 -1.26 -0.29 118.68 127.79 1pmo s LEU 177 Ca 0.65 -0.36 -0.10 0.00 -2.89 0.00 0.00 54.13 51.43 1pmo s LEU 177 Cb -0.32 -2.57 0.25 0.00 0.66 0.00 0.00 46.19 44.21 1pmo s LEU 177 CO 0.27 -0.62 0.96 -0.13 -1.89 0.00 0.00 176.35 174.94 1pmo s ARG 178 N 2.46 3.91 -0.31 1.98 0.52 0.83 -4.94 118.95 123.39 1pmo s ARG 178 Ca 0.18 -2.94 -0.22 0.00 -0.52 0.00 0.00 55.73 52.22 1pmo s ARG 178 Cb -0.15 -4.46 -0.00 0.00 0.52 0.00 0.00 34.95 30.85 1pmo s ARG 178 CO 0.16 -1.26 0.73 -2.00 0.02 0.00 0.00 175.30 172.94 1pmo s GLU 179 N -0.74 3.92 0.06 3.54 2.12 -1.26 -2.08 118.70 124.26 1pmo s GLU 179 Ca 0.26 0.45 -0.31 0.00 0.36 0.00 0.00 54.97 55.73 1pmo s GLU 179 Cb -0.10 -3.74 -0.08 0.00 0.26 0.00 0.00 34.13 30.47 1pmo s GLU 179 CO -0.08 -0.65 1.72 0.42 -0.54 0.00 0.00 175.26 176.12 1pmo s ILE 180 N 2.83 3.00 0.43 -3.70 1.09 0.88 -4.93 121.20 120.81 1pmo s ILE 180 Ca 0.29 0.38 -0.26 0.00 -1.10 0.00 0.00 60.65 59.96 1pmo s ILE 180 Cb -0.14 -3.24 -0.09 0.00 -1.06 0.00 0.00 42.46 37.93 1pmo s ILE 180 CO 0.13 -0.01 1.42 -2.84 -0.10 0.00 0.00 174.94 173.53 1pmo s PRO 181 N 3.03 3.81 0.17 2.79 0.02 -1.26 -4.34 135.00 139.22 1pmo s PRO 181 Ca 0.77 2.40 -0.30 0.00 0.02 0.00 0.00 61.00 63.89 1pmo s PRO 181 Cb -0.41 -2.73 -0.07 0.00 0.02 0.00 0.00 34.50 31.31 1pmo s PRO 181 CO 0.34 -0.71 1.02 -1.64 -0.33 0.00 0.00 177.00 175.68 1pmo s MET 182 N -2.35 4.69 0.00 5.54 -1.94 -1.26 -4.80 119.30 119.17 1pmo s MET 182 Ca 0.59 1.59 -0.05 0.00 -1.71 0.00 0.00 55.69 56.10 1pmo s MET 182 Cb -0.43 -3.31 -0.00 0.00 2.01 0.00 0.00 34.83 33.10 1pmo s MET 182 CO 0.56 0.22 0.10 1.03 -0.01 0.00 0.00 175.02 176.93 1pmo s ARG 183 N -0.48 0.41 -0.01 2.03 0.52 -0.36 -2.21 118.95 118.85 1pmo s ARG 183 Ca 0.46 -0.37 -0.35 0.00 -0.52 0.00 0.00 55.73 54.96 1pmo s ARG 183 Cb -0.27 0.17 -0.13 0.00 0.52 0.00 0.00 34.95 35.24 1pmo s ARG 183 CO 0.33 -0.09 1.73 -2.30 0.02 0.00 0.00 175.30 174.99 1pmo n PRO 184 N 1.68 1.99 -0.43 3.54 -0.02 -1.26 0.76 135.00 141.26 1pmo n PRO 184 Ca -0.22 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1pmo n PRO 184 Cb 0.56 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 1pmo n PRO 184 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pmo n GLY 185 N 3.91 1.13 2.73 -1.23 0.00 -1.26 -4.88 105.19 105.59 1pmo n GLY 185 Ca 0.21 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.16 1pmo n GLY 185 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pmo n GLN 186 N -2.00 0.60 0.13 1.61 10.64 0.23 -5.02 117.38 123.57 1pmo n GLN 186 Ca 0.00 -1.54 0.13 0.00 -1.83 0.00 0.00 57.00 53.76 1pmo n GLN 186 Cb 0.00 -1.18 0.40 0.00 -0.86 0.00 0.00 30.24 28.60 1pmo n GLN 186 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.06 175.16 1pmo h LEU 187 N 3.97 0.00 -9.65 2.61 3.38 -1.80 -0.94 115.31 112.88 1pmo h LEU 187 Ca -0.13 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.22 1pmo h LEU 187 Cb 1.08 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.70 1pmo h LEU 187 CO 0.18 0.00 -0.59 -0.36 0.09 0.00 0.00 178.44 177.76 1pmo s PHE 188 N -3.18 2.34 -0.39 1.13 0.08 -1.26 -4.51 117.98 112.19 1pmo s PHE 188 Ca 0.09 -0.76 -0.29 0.00 0.12 0.00 0.00 56.93 56.09 1pmo s PHE 188 Cb 0.11 -1.68 0.01 0.00 -0.57 0.00 0.00 43.02 40.89 1pmo s PHE 188 CO 0.57 0.34 1.43 1.41 -0.10 0.00 0.00 175.22 178.88 1pmo s MET 189 N -3.76 3.61 0.30 0.44 -2.45 -1.26 -5.00 119.30 111.18 1pmo s MET 189 Ca 0.31 1.04 0.04 0.00 -1.25 0.00 0.00 55.69 55.82 1pmo s MET 189 Cb 0.09 -4.02 -0.02 0.00 1.25 0.00 0.00 34.83 32.12 1pmo s MET 189 CO 0.15 -1.52 0.45 0.16 1.05 0.00 0.00 175.02 175.31 1pmo s ASP 190 N 3.97 6.21 0.21 1.11 -4.77 -1.26 -4.92 116.67 117.22 1pmo s ASP 190 Ca 0.62 0.13 -0.10 0.00 -3.30 0.00 0.00 52.55 49.90 1pmo s ASP 190 Cb -0.15 -1.76 0.29 0.00 -1.09 0.00 0.00 42.92 40.21 1pmo s ASP 190 CO 0.31 -0.24 1.70 -0.65 0.70 0.00 0.00 175.17 177.00 1pmo h PRO 191 N 0.96 0.23 0.82 2.11 0.11 -1.95 -1.26 132.00 133.03 1pmo h PRO 191 Ca -0.50 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 1pmo h PRO 191 Cb 1.23 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1pmo h PRO 191 CO 0.59 0.15 -0.45 -0.22 -0.21 0.00 0.00 178.00 177.87 1pmo h LYS 192 N 0.24 -1.13 0.00 1.05 3.64 -1.98 -1.36 116.57 117.04 1pmo h LYS 192 Ca 0.32 0.08 -0.03 0.00 -1.27 0.00 0.00 60.65 59.74 1pmo h LYS 192 Cb 0.48 0.26 -0.00 0.00 -0.41 0.00 0.00 32.23 32.55 1pmo h LYS 192 CO -0.42 -0.75 -0.17 0.00 -2.27 0.00 0.00 179.45 175.85 1pmo h ARG 193 N -1.17 0.00 0.10 1.90 3.08 -1.96 -1.69 114.38 114.64 1pmo h ARG 193 Ca -0.11 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.94 1pmo h ARG 193 Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.97 1pmo h ARG 193 CO 0.15 0.17 -0.05 1.98 -1.07 0.00 0.00 179.97 181.15 1pmo h MET 194 N 0.00 -0.12 -0.70 0.04 4.05 -1.00 -2.90 114.93 114.29 1pmo h MET 194 Ca -0.00 0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1pmo h MET 194 Cb 0.30 0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 31.10 1pmo h MET 194 CO 0.02 0.09 0.43 0.82 0.23 0.00 0.00 176.91 178.51 1pmo h ILE 195 N -0.33 1.19 0.00 1.77 1.08 -0.85 -1.39 117.51 118.99 1pmo h ILE 195 Ca -0.01 -0.41 -0.00 0.00 -0.39 0.00 0.00 64.86 64.04 1pmo h ILE 195 Cb 0.27 0.19 -0.00 0.00 -3.07 0.00 0.00 36.82 34.22 1pmo h ILE 195 CO 0.02 0.20 -0.01 -0.33 -0.69 0.00 0.00 178.15 177.34 1pmo h GLU 196 N 0.97 0.00 0.00 2.37 5.08 -1.18 -2.02 114.58 119.79 1pmo h GLU 196 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1pmo h GLU 196 Cb -0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1pmo h GLU 196 CO -0.05 0.01 -0.73 0.00 -1.00 0.00 0.00 179.01 177.24 1pmo n ALA 197 N -2.40 3.66 -2.01 3.43 0.00 -0.55 -4.95 120.51 117.68 1pmo n ALA 197 Ca -0.03 -0.40 -0.34 0.00 0.00 0.00 0.00 53.44 52.67 1pmo n ALA 197 Cb 0.10 -1.03 -0.06 0.00 0.00 0.00 0.00 19.45 18.46 1pmo n ALA 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pmo n ASP 199 N -0.01 -0.53 0.19 0.00 5.68 -1.26 -5.02 116.55 115.60 1pmo n ASP 199 Ca 0.03 -1.36 0.14 0.00 -0.50 0.00 0.00 54.79 53.09 1pmo n ASP 199 Cb 0.52 0.87 0.64 0.00 -1.14 0.00 0.00 41.12 42.02 1pmo n ASP 199 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1pmo h GLU 200 N 0.00 0.00 -0.01 0.11 4.11 -1.99 -2.38 114.58 114.41 1pmo h GLU 200 Ca -0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.35 1pmo h GLU 200 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1pmo h GLU 200 CO 0.10 0.00 -0.27 0.09 0.07 0.00 0.00 179.01 179.00 1pmo n ASN 201 N -2.49 1.57 -4.63 3.06 3.02 -1.26 -4.88 115.26 109.66 1pmo n ASN 201 Ca 0.00 -1.26 -0.43 0.00 -0.03 0.00 0.00 54.58 52.86 1pmo n ASN 201 Cb 0.16 0.21 -0.02 0.00 -0.61 0.00 0.00 39.78 39.53 1pmo n ASN 201 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1pmo s THR 202 N -2.38 3.95 -0.14 3.41 2.01 -0.90 -1.18 115.64 120.40 1pmo s THR 202 Ca 0.25 1.06 0.30 0.00 0.31 0.00 0.00 61.69 63.60 1pmo s THR 202 Cb 0.19 -4.00 0.35 0.00 0.01 0.00 0.00 72.50 69.05 1pmo s THR 202 CO 0.49 -0.45 1.86 0.16 -0.69 0.00 0.00 174.62 175.99 1pmo h ILE 203 N 6.10 0.00 0.00 1.82 3.07 -1.13 -3.48 117.51 123.90 1pmo h ILE 203 Ca -0.29 -0.56 0.00 0.00 1.55 0.00 0.00 64.86 65.56 1pmo h ILE 203 Cb 1.12 1.52 0.00 0.00 -0.27 0.00 0.00 36.82 39.19 1pmo h ILE 203 CO 1.03 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 178.74 1pmo n GLY 204 N 0.31 0.92 3.40 0.16 0.00 -1.26 -4.66 105.19 104.06 1pmo n GLY 204 Ca 0.02 -1.13 -0.32 0.00 0.00 0.00 0.00 46.02 44.58 1pmo n GLY 204 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pmo s VAL 205 N -2.00 2.68 -0.42 1.61 1.01 -0.46 -2.35 120.40 120.47 1pmo s VAL 205 Ca 0.00 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.15 1pmo s VAL 205 Cb 0.00 -2.02 0.11 0.00 0.00 0.00 0.00 36.38 34.48 1pmo s VAL 205 CO 0.00 0.58 0.15 -0.69 0.00 0.00 0.00 175.10 175.14 1pmo s VAL 206 N -0.56 2.47 0.36 2.92 1.01 -0.28 -1.75 120.40 124.57 1pmo s VAL 206 Ca 0.08 -2.75 -0.25 0.00 0.00 0.00 0.00 61.98 59.06 1pmo s VAL 206 Cb -0.11 -2.77 -0.10 0.00 0.00 0.00 0.00 36.38 33.40 1pmo s VAL 206 CO 0.01 -0.69 0.97 -2.84 0.00 0.00 0.00 175.10 172.55 1pmo s PRO 207 N 0.40 4.41 -0.44 2.72 0.02 -1.23 -4.17 135.00 136.71 1pmo s PRO 207 Ca 0.13 1.34 -0.12 0.00 0.02 0.00 0.00 61.00 62.37 1pmo s PRO 207 Cb -0.22 -2.62 0.07 0.00 0.02 0.00 0.00 34.50 31.75 1pmo s PRO 207 CO -0.05 0.11 0.31 0.99 -0.33 0.00 0.00 177.00 178.04 1pmo s THR 208 N -1.73 4.73 -1.40 0.99 2.01 -1.26 -1.77 115.64 117.21 1pmo s THR 208 Ca 0.54 -1.17 -0.14 0.00 0.31 0.00 0.00 61.69 61.23 1pmo s THR 208 Cb -0.18 -3.83 -0.00 0.00 0.01 0.00 0.00 72.50 68.50 1pmo s THR 208 CO 0.23 -0.50 2.31 0.33 -0.69 0.00 0.00 174.62 176.30 1pmo n PHE 209 N 5.06 3.15 0.00 4.92 7.35 -0.36 -2.56 117.46 135.01 1pmo n PHE 209 Ca -0.11 -2.86 0.00 0.00 -0.76 0.00 0.00 57.45 53.72 1pmo n PHE 209 Cb 0.44 -2.44 0.00 0.00 0.35 0.00 0.00 39.48 37.82 1pmo n PHE 209 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1pmo n GLY 210 N 4.05 0.78 3.70 7.13 0.00 -1.20 -2.33 105.19 117.33 1pmo n GLY 210 Ca 0.56 -0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1pmo n GLY 210 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pmo s VAL 211 N 0.00 2.65 0.22 1.61 1.01 0.79 -4.72 120.40 121.96 1pmo s VAL 211 Ca 0.00 0.27 -0.07 0.00 0.00 0.00 0.00 61.98 62.17 1pmo s VAL 211 Cb 0.00 -3.17 0.17 0.00 0.00 0.00 0.00 36.38 33.38 1pmo s VAL 211 CO 0.00 0.01 1.77 0.74 0.00 0.00 0.00 175.10 177.62 1pmo h THR 212 N 4.48 0.83 0.00 3.92 2.02 -1.90 0.42 112.91 122.68 1pmo h THR 212 Ca -0.44 -0.19 -0.07 0.00 0.77 0.00 0.00 66.41 66.48 1pmo h THR 212 Cb 1.21 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 1pmo h THR 212 CO 0.94 0.10 -0.32 1.88 0.37 0.00 0.00 175.52 178.49 1pmo h TYR 213 N 0.56 0.00 0.00 3.16 0.05 -1.88 -3.39 116.97 115.47 1pmo h TYR 213 Ca 0.34 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.12 1pmo h TYR 213 Cb 0.37 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.11 1pmo h TYR 213 CO -0.12 0.32 -0.63 0.25 -1.05 0.00 0.00 178.16 176.93 1pmo n THR 214 N -3.37 0.00 0.00 -2.88 -2.24 -1.10 -4.90 114.28 99.78 1pmo n THR 214 Ca 0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1pmo n THR 214 Cb 0.52 -0.57 0.00 0.00 -2.10 0.00 0.00 70.33 68.19 1pmo n THR 214 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pmo n GLY 215 N 2.22 0.29 3.81 3.38 0.00 0.15 -4.51 105.19 110.52 1pmo n GLY 215 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1pmo n GLY 215 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1pmo s ASN 216 N -2.15 5.98 0.11 1.61 0.01 -1.26 -1.40 114.94 117.85 1pmo s ASN 216 Ca 0.00 1.81 -0.16 0.00 -0.71 0.00 0.00 52.86 53.81 1pmo s ASN 216 Cb 0.00 -2.54 -0.07 0.00 0.41 0.00 0.00 41.25 39.06 1pmo s ASN 216 CO 0.00 -1.03 0.55 -0.31 -1.51 0.00 0.00 177.10 174.80 1pmo s TYR 217 N -2.37 3.68 -0.28 2.20 2.02 -0.15 -0.15 117.35 122.30 1pmo s TYR 217 Ca 0.64 1.13 -0.09 0.00 -0.37 0.00 0.00 57.07 58.37 1pmo s TYR 217 Cb -0.15 -2.41 -0.03 0.00 -0.40 0.00 0.00 41.96 38.97 1pmo s TYR 217 CO 0.33 0.49 0.14 -1.21 -1.57 0.00 0.00 175.55 173.73 1pmo s GLU 218 N -1.63 3.70 -0.33 -0.62 2.02 -1.06 -4.88 118.70 115.90 1pmo s GLU 218 Ca 0.34 -0.47 -0.28 0.00 0.02 0.00 0.00 54.97 54.58 1pmo s GLU 218 Cb -0.17 -3.52 0.02 0.00 0.10 0.00 0.00 34.13 30.56 1pmo s GLU 218 CO 0.19 -0.24 1.03 -0.06 0.02 0.00 0.00 175.26 176.20 1pmo s PHE 219 N 1.68 3.13 0.41 1.61 0.08 -1.26 -4.47 117.98 119.15 1pmo s PHE 219 Ca 0.06 1.07 0.12 0.00 0.12 0.00 0.00 56.93 58.31 1pmo s PHE 219 Cb -0.16 -3.68 0.86 0.00 -0.57 0.00 0.00 43.02 39.47 1pmo s PHE 219 CO 0.07 -0.78 1.93 -1.35 -0.10 0.00 0.00 175.22 174.99 1pmo h PRO 220 N 8.21 0.09 0.19 0.24 0.11 -1.89 -3.32 132.00 135.63 1pmo h PRO 220 Ca -0.21 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.88 1pmo h PRO 220 Cb 1.07 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 1pmo h PRO 220 CO 1.02 0.30 -0.24 0.37 -0.21 0.00 0.00 178.00 179.24 1pmo h GLN 221 N 0.09 -0.46 -0.65 1.05 4.15 -1.93 0.46 115.11 117.82 1pmo h GLN 221 Ca 0.02 0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1pmo h GLN 221 Cb 0.41 0.10 -0.03 0.00 0.21 0.00 0.00 27.48 28.17 1pmo h GLN 221 CO 0.03 -0.31 0.43 -1.35 -1.93 0.00 0.00 178.83 175.70 1pmo h PRO 222 N -0.48 0.86 -0.39 -2.39 0.11 -1.93 -0.39 132.00 127.39 1pmo h PRO 222 Ca 0.01 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 65.95 1pmo h PRO 222 Cb 0.47 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.37 1pmo h PRO 222 CO -0.09 0.57 -0.23 -0.07 -0.21 0.00 0.00 178.00 177.97 1pmo h LEU 223 N 0.88 0.80 -0.70 2.35 3.38 -1.56 -2.34 115.31 118.12 1pmo h LEU 223 Ca 0.24 -0.29 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1pmo h LEU 223 Cb -0.09 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 1pmo h LEU 223 CO -0.05 1.00 0.14 -0.74 0.09 0.00 0.00 178.44 178.88 1pmo h HIS 224 N 0.68 1.20 -0.36 1.13 2.76 0.11 -1.68 115.15 118.99 1pmo h HIS 224 Ca 0.09 -0.16 -0.00 0.00 -2.20 0.00 0.00 60.37 58.10 1pmo h HIS 224 Cb 0.75 -0.33 -0.02 0.00 1.55 0.00 0.00 27.41 29.36 1pmo h HIS 224 CO 0.04 0.99 0.22 -0.44 -1.30 0.00 0.00 177.93 177.43 1pmo h ASP 225 N 1.07 0.44 -0.59 3.26 3.32 -0.86 -1.57 116.42 121.48 1pmo h ASP 225 Ca 0.22 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1pmo h ASP 225 Cb 0.41 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.82 1pmo h ASP 225 CO 0.01 0.37 0.35 0.00 -1.72 0.00 0.00 179.24 178.25 1pmo h ALA 226 N 1.09 1.48 0.00 3.45 0.00 -1.12 -1.47 119.26 122.68 1pmo h ALA 226 Ca 0.13 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 1pmo h ALA 226 Cb 0.02 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1pmo h ALA 226 CO -0.02 0.44 -0.51 -0.07 0.00 0.00 0.00 179.25 179.09 1pmo h LEU 227 N 0.84 0.00 -0.29 0.00 3.38 -0.88 0.06 115.31 118.42 1pmo h LEU 227 Ca 0.22 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.08 1pmo h LEU 227 Cb -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 1pmo h LEU 227 CO -0.04 0.51 -0.26 0.44 0.09 0.00 0.00 178.44 179.18 1pmo h ASP 228 N 0.00 0.72 -0.48 -0.43 3.32 -0.38 -1.84 116.42 117.34 1pmo h ASP 228 Ca -0.01 -0.46 -0.07 0.00 0.02 0.00 0.00 57.03 56.51 1pmo h ASP 228 Cb 1.01 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.33 1pmo h ASP 228 CO 0.07 1.03 0.06 0.50 -1.72 0.00 0.00 179.24 179.18 1pmo h LYS 229 N 0.42 0.87 -0.32 3.56 3.64 -1.12 -2.02 116.57 121.60 1pmo h LYS 229 Ca 0.05 -0.22 -0.01 0.00 -1.27 0.00 0.00 60.65 59.20 1pmo h LYS 229 Cb 0.82 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.52 1pmo h LYS 229 CO 0.07 0.83 0.15 0.35 -2.27 0.00 0.00 179.45 178.57 1pmo h PHE 230 N 0.82 0.47 -0.38 1.91 3.57 -0.79 -0.52 116.94 122.02 1pmo h PHE 230 Ca 0.17 -0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.58 1pmo h PHE 230 Cb 0.41 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.99 1pmo h PHE 230 CO 0.02 0.42 -0.01 0.37 -2.23 0.00 0.00 178.31 176.89 1pmo h GLN 231 N 0.38 0.60 -0.57 1.11 4.15 -1.15 0.29 115.11 119.92 1pmo h GLN 231 Ca 0.11 -0.14 -0.06 0.00 0.77 0.00 0.00 58.65 59.33 1pmo h GLN 231 Cb 0.14 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.73 1pmo h GLN 231 CO -0.01 0.63 0.12 0.00 -1.93 0.00 0.00 178.83 177.63 1pmo h ALA 232 N 1.42 0.76 0.00 3.38 0.00 -0.88 0.53 119.26 124.47 1pmo h ALA 232 Ca 0.12 -0.24 -0.16 0.00 0.00 0.00 0.00 54.91 54.63 1pmo h ALA 232 Cb 0.38 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1pmo h ALA 232 CO 0.01 0.48 -0.84 -0.44 0.00 0.00 0.00 179.25 178.46 1pmo h ASP 233 N 0.83 0.00 0.00 0.00 3.32 -0.76 -3.40 116.42 116.41 1pmo h ASP 233 Ca 0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1pmo h ASP 233 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1pmo h ASP 233 CO 0.01 0.73 -0.43 0.35 -1.72 0.00 0.00 179.24 178.18 1pmo n THR 234 N -3.24 0.00 0.00 0.35 -2.24 0.06 -5.01 114.28 104.21 1pmo n THR 234 Ca -0.01 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1pmo n THR 234 Cb 0.84 0.61 0.00 0.00 -2.10 0.00 0.00 70.33 69.68 1pmo n THR 234 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pmo n GLY 235 N 1.36 2.05 3.64 3.38 0.00 0.18 -5.00 105.19 110.80 1pmo n GLY 235 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1pmo n GLY 235 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pmo s ILE 236 N -2.63 3.96 -0.48 -0.61 1.01 -1.26 -4.93 121.20 116.26 1pmo s ILE 236 Ca 0.00 1.10 -0.16 0.00 0.00 0.00 0.00 60.65 61.58 1pmo s ILE 236 Cb 0.00 -3.93 0.06 0.00 0.01 0.00 0.00 42.46 38.60 1pmo s ILE 236 CO 0.00 -0.34 0.45 -0.62 0.00 0.00 0.00 174.94 174.43 1pmo s ASP 237 N 3.26 6.17 -0.15 3.58 -1.08 -1.26 -3.62 116.67 123.57 1pmo s ASP 237 Ca 0.63 -1.18 -0.04 0.00 -0.52 0.00 0.00 52.55 51.44 1pmo s ASP 237 Cb -0.21 -2.21 -0.03 0.00 -1.46 0.00 0.00 42.92 39.01 1pmo s ASP 237 CO 0.25 -0.70 -0.04 -0.63 0.52 0.00 0.00 175.17 174.57 1pmo s ILE 238 N 1.93 3.91 0.54 4.11 1.01 -1.26 -5.07 121.20 126.36 1pmo s ILE 238 Ca 0.07 -0.35 0.09 0.00 0.00 0.00 0.00 60.65 60.46 1pmo s ILE 238 Cb -0.22 -2.71 0.06 0.00 0.01 0.00 0.00 42.46 39.60 1pmo s ILE 238 CO 0.08 0.50 0.71 -1.81 0.00 0.00 0.00 174.94 174.42 1pmo s ASP 239 N 0.32 5.18 0.11 3.58 1.01 -1.26 -4.95 116.67 120.66 1pmo s ASP 239 Ca -0.04 -0.79 0.06 0.00 0.71 0.00 0.00 52.55 52.50 1pmo s ASP 239 Cb -0.14 0.08 -0.04 0.00 1.01 0.00 0.00 42.92 43.84 1pmo s ASP 239 CO 0.03 -1.19 -0.15 -0.04 0.21 0.00 0.00 175.17 174.03 1pmo s MET 240 N -4.56 1.02 -0.11 8.23 -1.94 -0.48 -1.35 119.30 120.12 1pmo s MET 240 Ca 0.58 -1.19 0.01 0.00 -1.71 0.00 0.00 55.69 53.38 1pmo s MET 240 Cb -0.06 -0.99 0.02 0.00 2.01 0.00 0.00 34.83 35.80 1pmo s MET 240 CO 0.36 0.20 -0.12 -1.58 -0.01 0.00 0.00 175.02 173.88 1pmo s HIS 241 N -1.83 1.75 -0.23 -0.03 2.46 -0.72 -1.70 115.29 114.99 1pmo s HIS 241 Ca 0.07 -0.85 -0.17 0.00 0.47 0.00 0.00 55.06 54.58 1pmo s HIS 241 Cb -0.07 -1.33 -0.03 0.00 -0.13 0.00 0.00 32.58 31.02 1pmo s HIS 241 CO 0.03 -0.49 0.44 0.42 -2.47 0.00 0.00 174.74 172.67 1pmo s ILE 242 N 1.28 5.15 -0.89 0.89 1.09 -0.67 -3.50 121.20 124.54 1pmo s ILE 242 Ca -0.02 0.77 -0.19 0.00 -1.10 0.00 0.00 60.65 60.11 1pmo s ILE 242 Cb -0.14 -3.77 0.12 0.00 -1.06 0.00 0.00 42.46 37.61 1pmo s ILE 242 CO -0.05 0.18 1.12 -0.62 -0.10 0.00 0.00 174.94 175.47 1pmo s ASP 243 N 1.29 6.55 -0.55 3.58 -1.08 -0.73 -1.97 116.67 123.77 1pmo s ASP 243 Ca 0.20 -1.87 0.01 0.00 -0.52 0.00 0.00 52.55 50.37 1pmo s ASP 243 Cb -0.15 -2.41 0.45 0.00 -1.46 0.00 0.00 42.92 39.35 1pmo s ASP 243 CO 0.09 -1.14 1.75 0.00 0.52 0.00 0.00 175.17 176.39 1pmo n ALA 244 N 6.82 5.91 -0.35 3.66 0.00 -0.01 -1.23 120.51 135.31 1pmo n ALA 244 Ca 0.20 -3.62 0.13 0.00 0.00 0.00 0.00 53.44 50.16 1pmo n ALA 244 Cb 0.49 -1.30 0.27 0.00 0.00 0.00 0.00 19.45 18.91 1pmo n ALA 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pmo h ALA 245 N 2.11 1.09 0.00 0.00 0.00 -1.81 0.32 119.26 120.96 1pmo h ALA 245 Ca 0.53 0.35 -0.34 0.00 0.00 0.00 0.00 54.91 55.45 1pmo h ALA 245 Cb 1.02 0.63 -0.05 0.00 0.00 0.00 0.00 17.79 19.38 1pmo h ALA 245 CO 1.31 -0.55 -2.16 -1.13 0.00 0.00 0.00 179.25 176.72 1pmo n SER 246 N -5.52 1.68 0.28 0.00 3.41 -1.26 -1.18 113.62 111.02 1pmo n SER 246 Ca 0.22 0.18 0.13 0.00 -0.26 0.00 0.00 58.87 59.15 1pmo n SER 246 Cb 0.72 -0.55 0.80 0.00 -0.26 0.00 0.00 64.21 64.92 1pmo n SER 246 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1pmo h GLY 247 N -0.30 0.00 1.74 5.00 0.00 -1.41 -3.05 103.07 105.05 1pmo h GLY 247 Ca -0.51 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.82 1pmo h GLY 247 CO -0.27 0.00 0.13 -1.33 0.00 0.00 0.00 176.54 175.07 1pmo h GLY 248 N 0.36 0.00 -0.46 4.60 0.00 -1.15 -0.97 103.07 105.44 1pmo h GLY 248 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1pmo h GLY 248 CO 0.01 0.00 -0.13 0.69 0.00 0.00 0.00 176.54 177.11 1pmo n PHE 249 N -3.00 0.12 0.02 5.60 3.72 -1.15 -4.67 117.46 118.09 1pmo n PHE 249 Ca -0.03 -1.14 0.00 0.00 -0.05 0.00 0.00 57.45 56.23 1pmo n PHE 249 Cb 0.19 -0.20 0.00 0.00 -0.94 0.00 0.00 39.48 38.53 1pmo n PHE 249 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1pmo n LEU 250 N -1.27 0.39 -0.33 4.37 4.77 -0.40 -4.78 117.00 119.75 1pmo n LEU 250 Ca 0.18 0.06 0.10 0.00 -0.03 0.00 0.00 56.01 56.32 1pmo n LEU 250 Cb 0.69 -0.11 0.27 0.00 -2.33 0.00 0.00 43.42 41.94 1pmo n LEU 250 CO 0.02 -0.60 1.16 0.00 -1.33 0.00 0.00 177.39 176.64 1pmo h ALA 251 N 0.00 1.50 -0.06 -1.18 0.00 -1.79 -1.06 119.26 116.67 1pmo h ALA 251 Ca 0.00 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1pmo h ALA 251 Cb 0.00 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1pmo h ALA 251 CO 0.00 -0.03 0.13 -1.35 0.00 0.00 0.00 179.25 178.00 1pmo h PRO 252 N 0.74 0.00 0.00 0.00 0.11 -1.80 0.88 132.00 131.92 1pmo h PRO 252 Ca 0.53 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 66.28 1pmo h PRO 252 Cb 0.76 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.81 1pmo h PRO 252 CO -0.36 0.00 -2.26 1.19 -0.21 0.00 0.00 178.00 176.36 1pmo n PHE 253 N -3.40 0.00 0.44 0.65 3.72 -0.48 -4.40 117.46 113.99 1pmo n PHE 253 Ca -0.01 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.50 1pmo n PHE 253 Cb 0.22 -0.83 -0.08 0.00 -0.94 0.00 0.00 39.48 37.84 1pmo n PHE 253 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 1pmo n VAL 254 N -3.50 0.10 -2.97 -4.37 0.31 -0.71 -4.66 118.33 102.52 1pmo n VAL 254 Ca -0.41 -0.29 -0.14 0.00 -0.01 0.00 0.00 64.34 63.48 1pmo n VAL 254 Cb 0.87 0.29 0.02 0.00 -0.91 0.00 0.00 33.84 34.11 1pmo n VAL 254 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1pmo n ALA 255 N -1.92 0.60 0.19 3.52 0.00 0.24 -4.92 120.51 118.22 1pmo n ALA 255 Ca 0.00 -2.44 0.15 0.00 0.00 0.00 0.00 53.44 51.16 1pmo n ALA 255 Cb 0.46 -1.05 0.76 0.00 0.00 0.00 0.00 19.45 19.63 1pmo n ALA 255 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1pmo h PRO 256 N 3.34 0.00 0.00 0.00 0.11 -1.59 -2.61 132.00 131.25 1pmo h PRO 256 Ca -0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1pmo h PRO 256 Cb 1.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1pmo h PRO 256 CO 0.34 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 177.88 1pmo n ASP 257 N -4.11 0.67 -4.67 -2.05 8.00 -1.26 -4.67 116.55 108.45 1pmo n ASP 257 Ca 0.02 0.63 -0.43 0.00 0.71 0.00 0.00 54.79 55.72 1pmo n ASP 257 Cb 0.30 -0.78 -0.02 0.00 -0.02 0.00 0.00 41.12 40.59 1pmo n ASP 257 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1pmo s ILE 258 N -3.23 4.07 -0.55 0.53 1.01 -0.99 -4.95 121.20 117.10 1pmo s ILE 258 Ca 0.07 1.35 -0.19 0.00 0.00 0.00 0.00 60.65 61.87 1pmo s ILE 258 Cb 0.10 -3.87 0.07 0.00 0.01 0.00 0.00 42.46 38.78 1pmo s ILE 258 CO 0.45 -0.07 0.68 -0.69 0.00 0.00 0.00 174.94 175.31 1pmo s VAL 259 N 3.12 4.81 0.00 2.92 1.01 -1.26 -4.74 120.40 126.25 1pmo s VAL 259 Ca 0.59 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.94 1pmo s VAL 259 Cb -0.26 -4.39 0.00 0.00 0.00 0.00 0.00 36.38 31.73 1pmo s VAL 259 CO 0.20 -0.96 0.00 -2.67 0.00 0.00 0.00 175.10 171.67 1pmo n TRP 260 N 6.35 0.00 -0.50 5.22 4.27 -1.26 -3.86 117.44 127.67 1pmo n TRP 260 Ca -0.07 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.54 1pmo n TRP 260 Cb 0.44 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.39 1pmo n TRP 260 CO 0.00 0.00 0.00 -0.40 -2.29 0.00 0.00 177.69 175.00 1pmo n ASP 261 N -0.32 0.00 0.00 -0.67 5.68 -1.26 -4.86 116.55 115.12 1pmo n ASP 261 Ca 0.00 0.00 0.05 0.00 -0.50 0.00 0.00 54.79 54.34 1pmo n ASP 261 Cb 0.00 0.00 0.26 0.00 -1.14 0.00 0.00 41.12 40.24 1pmo n ASP 261 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 1pmo n PHE 262 N 0.00 0.00 0.28 2.11 3.72 -1.00 -1.71 117.46 120.86 1pmo n PHE 262 Ca 0.00 0.00 0.17 0.00 -0.05 0.00 0.00 57.45 57.57 1pmo n PHE 262 Cb 0.00 -0.21 0.77 0.00 -0.94 0.00 0.00 39.48 39.09 1pmo n PHE 262 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1pmo h ARG 263 N 0.00 0.00 -5.48 -1.08 3.08 -1.77 -3.40 114.38 105.73 1pmo h ARG 263 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 1pmo h ARG 263 Cb 0.07 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.00 1pmo h ARG 263 CO 0.00 0.04 0.08 -0.51 -1.07 0.00 0.00 179.97 178.51 1pmo s LEU 264 N -6.39 4.07 0.28 3.04 1.43 -0.70 -4.98 118.68 115.44 1pmo s LEU 264 Ca -0.01 0.66 0.01 0.00 -1.03 0.00 0.00 54.13 53.77 1pmo s LEU 264 Cb 0.10 -2.78 0.67 0.00 0.03 0.00 0.00 46.19 44.21 1pmo s LEU 264 CO 0.53 -0.32 1.67 -0.65 0.23 0.00 0.00 176.35 177.81 1pmo h PRO 265 N 7.85 0.26 0.00 1.29 0.11 -1.88 -2.00 132.00 137.62 1pmo h PRO 265 Ca -0.29 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1pmo h PRO 265 Cb 1.13 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1pmo h PRO 265 CO 0.75 0.17 0.00 0.00 -0.21 0.00 0.00 178.00 178.71 1pmo h ARG 266 N 0.26 0.00 -6.20 1.05 3.08 -1.93 -3.42 114.38 107.23 1pmo h ARG 266 Ca 0.53 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 60.05 1pmo h ARG 266 Cb 1.03 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.03 1pmo h ARG 266 CO -0.60 0.00 1.24 0.08 -1.07 0.00 0.00 179.97 179.62 1pmo s VAL 267 N -3.55 3.54 -0.14 2.04 1.01 -0.75 -1.38 120.40 121.17 1pmo s VAL 267 Ca 0.03 0.43 0.18 0.00 0.00 0.00 0.00 61.98 62.61 1pmo s VAL 267 Cb 0.08 -4.08 -0.13 0.00 0.00 0.00 0.00 36.38 32.25 1pmo s VAL 267 CO 0.56 -0.92 0.81 0.29 0.00 0.00 0.00 175.10 175.84 1pmo n LYS 268 N 8.85 0.62 -3.59 2.72 4.01 -0.69 -4.71 118.16 125.37 1pmo n LYS 268 Ca 0.18 0.18 -0.14 0.00 -0.51 0.00 0.00 58.31 58.02 1pmo n LYS 268 Cb 0.50 -1.79 -0.05 0.00 -0.51 0.00 0.00 35.03 33.18 1pmo n LYS 268 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1pmo s SER 269 N -5.65 -0.40 -0.00 4.39 1.04 -1.24 -0.96 113.70 110.88 1pmo s SER 269 Ca -0.03 0.12 -0.01 0.00 0.48 0.00 0.00 55.95 56.51 1pmo s SER 269 Cb 0.09 0.48 -0.00 0.00 0.10 0.00 0.00 66.02 66.68 1pmo s SER 269 CO 0.81 -0.71 0.01 -0.63 0.98 0.00 0.00 173.24 173.70 1pmo s ILE 270 N -2.50 0.03 0.10 -1.02 1.01 -0.35 -1.67 121.20 116.80 1pmo s ILE 270 Ca -0.05 -0.28 0.05 0.00 0.00 0.00 0.00 60.65 60.38 1pmo s ILE 270 Cb -0.01 -0.12 -0.03 0.00 0.01 0.00 0.00 42.46 42.31 1pmo s ILE 270 CO -0.02 -0.15 -0.13 -0.94 0.00 0.00 0.00 174.94 173.70 1pmo s SER 271 N -0.45 1.75 0.17 3.58 1.04 -0.83 -0.62 113.70 118.34 1pmo s SER 271 Ca -0.05 -0.74 -0.21 0.00 0.48 0.00 0.00 55.95 55.43 1pmo s SER 271 Cb -0.03 -0.04 0.05 0.00 0.10 0.00 0.00 66.02 66.10 1pmo s SER 271 CO -0.00 -0.15 0.56 0.00 0.98 0.00 0.00 173.24 174.63 1pmo s ALA 272 N -1.92 -1.36 -0.26 5.32 0.00 0.13 -0.83 121.76 122.84 1pmo s ALA 272 Ca 0.04 0.23 -0.10 0.00 0.00 0.00 0.00 51.96 52.13 1pmo s ALA 272 Cb -0.06 0.85 -0.05 0.00 0.00 0.00 0.00 23.12 23.86 1pmo s ALA 272 CO 0.02 -0.78 0.16 -1.12 0.00 0.00 0.00 175.76 174.04 1pmo s SER 273 N -2.79 5.89 0.22 0.00 0.01 -0.33 -0.77 113.70 115.93 1pmo s SER 273 Ca 0.03 -0.00 0.02 0.00 1.31 0.00 0.00 55.95 57.31 1pmo s SER 273 Cb -0.01 -2.08 0.22 0.00 0.21 0.00 0.00 66.02 64.36 1pmo s SER 273 CO -0.10 -0.00 1.55 1.23 0.41 0.00 0.00 173.24 176.33 1pmo h GLY 274 N 8.03 0.39 -0.32 3.44 0.00 -0.97 -3.02 103.07 110.61 1pmo h GLY 274 Ca -0.36 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 46.50 1pmo h GLY 274 CO 0.59 0.42 0.00 -2.39 0.00 0.00 0.00 176.54 175.16 1pmo n HIS 275 N -3.92 0.04 0.00 5.60 1.44 -0.98 -0.01 115.22 117.38 1pmo n HIS 275 Ca -0.03 -0.02 0.00 0.00 -2.01 0.00 0.00 57.72 55.67 1pmo n HIS 275 Cb 0.60 -0.03 0.00 0.00 0.12 0.00 0.00 29.99 30.68 1pmo n HIS 275 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1pmo n LYS 276 N -0.33 0.00 0.00 -1.40 5.02 -1.14 -1.37 118.16 118.94 1pmo n LYS 276 Ca 0.01 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.40 1pmo n LYS 276 Cb 0.08 0.00 0.57 0.00 -0.02 0.00 0.00 35.03 35.67 1pmo n LYS 276 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1pmo n PHE 277 N 0.00 0.00 0.54 2.13 3.72 -1.26 -1.57 117.46 121.02 1pmo n PHE 277 Ca 0.00 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.52 1pmo n PHE 277 Cb 0.00 -0.07 0.45 0.00 -0.94 0.00 0.00 39.48 38.92 1pmo n PHE 277 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1pmo n GLY 278 N 0.29 -1.42 2.57 1.37 0.00 -1.10 -4.86 105.19 102.04 1pmo n GLY 278 Ca 0.14 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1pmo n GLY 278 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pmo n LEU 279 N -2.11 0.31 -4.88 0.99 4.77 -0.43 -4.90 117.00 110.75 1pmo n LEU 279 Ca 0.04 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.72 1pmo n LEU 279 Cb 0.30 -0.96 0.01 0.00 -2.33 0.00 0.00 43.42 40.45 1pmo n LEU 279 CO 0.23 -0.27 0.64 0.00 -1.33 0.00 0.00 177.39 176.66 1pmo s ALA 280 N -2.04 3.16 0.65 -1.18 0.00 0.98 -4.97 121.76 118.37 1pmo s ALA 280 Ca 0.00 -0.28 -0.13 0.00 0.00 0.00 0.00 51.96 51.55 1pmo s ALA 280 Cb 0.00 -2.91 -0.01 0.00 0.00 0.00 0.00 23.12 20.20 1pmo s ALA 280 CO 0.00 -0.69 1.05 -1.25 0.00 0.00 0.00 175.76 174.88 1pmo s PRO 281 N -5.09 3.15 0.09 0.00 0.04 -1.26 -3.98 135.00 127.96 1pmo s PRO 281 Ca 0.54 1.02 -0.35 0.00 0.04 0.00 0.00 61.00 62.24 1pmo s PRO 281 Cb -0.11 -2.02 -0.19 0.00 0.04 0.00 0.00 34.50 32.23 1pmo s PRO 281 CO 0.51 -0.93 0.87 1.28 0.04 0.00 0.00 177.00 178.76 1pmo n LEU 282 N -2.69 -0.37 0.00 -3.56 4.77 -1.26 -3.88 117.00 110.01 1pmo n LEU 282 Ca 0.08 1.15 0.00 0.00 -0.03 0.00 0.00 56.01 57.20 1pmo n LEU 282 Cb 0.53 -0.95 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 1pmo n LEU 282 CO 0.53 -2.28 0.00 0.61 -1.33 0.00 0.00 177.39 174.92 1pmo n GLY 283 N 1.73 1.84 2.78 -0.72 0.00 -1.25 -4.93 105.19 104.64 1pmo n GLY 283 Ca 0.19 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.04 1pmo n GLY 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pmo s GLY 285 N 1.91 1.45 -0.05 0.00 0.00 0.49 -0.32 107.32 110.80 1pmo s GLY 285 Ca 0.00 -1.71 -0.06 0.00 0.00 0.00 0.00 44.72 42.95 1pmo s GLY 285 CO -0.04 -1.53 0.16 -0.98 0.00 0.00 0.00 173.10 170.71 1pmo s TRP 286 N -3.79 -0.14 -0.03 1.90 0.52 0.05 -1.05 118.94 116.39 1pmo s TRP 286 Ca 0.32 0.34 -0.01 0.00 0.02 0.00 0.00 56.10 56.77 1pmo s TRP 286 Cb 0.07 0.04 0.03 0.00 -1.15 0.00 0.00 33.47 32.46 1pmo s TRP 286 CO 0.09 -0.12 0.06 0.54 0.02 0.00 0.00 176.95 177.53 1pmo s VAL 287 N -0.17 -0.09 0.03 4.03 0.11 -0.97 -0.69 120.40 122.65 1pmo s VAL 287 Ca -0.03 0.30 0.08 0.00 -2.93 0.00 0.00 61.98 59.40 1pmo s VAL 287 Cb -0.02 -0.13 -0.03 0.00 -1.53 0.00 0.00 36.38 34.67 1pmo s VAL 287 CO 0.00 0.12 -0.25 -0.63 -3.33 0.00 0.00 175.10 171.02 1pmo s ILE 288 N 1.53 2.00 0.10 7.04 -1.09 0.21 -1.26 121.20 129.72 1pmo s ILE 288 Ca -0.04 -1.25 0.06 0.00 -2.23 0.00 0.00 60.65 57.19 1pmo s ILE 288 Cb -0.12 -1.70 -0.04 0.00 -1.58 0.00 0.00 42.46 39.02 1pmo s ILE 288 CO -0.03 0.40 -0.03 0.26 -1.23 0.00 0.00 174.94 174.30 1pmo s TRP 289 N -0.73 2.90 0.22 3.97 0.51 0.65 -1.21 118.94 125.26 1pmo s TRP 289 Ca 0.10 -0.07 -0.07 0.00 -2.12 0.00 0.00 56.10 53.94 1pmo s TRP 289 Cb -0.10 -1.50 0.32 0.00 -0.81 0.00 0.00 33.47 31.39 1pmo s TRP 289 CO 0.01 0.46 1.78 -0.09 -0.51 0.00 0.00 176.95 178.61 1pmo h ARG 290 N 3.47 0.59 0.00 4.98 2.43 -1.33 -3.39 114.38 121.12 1pmo h ARG 290 Ca -0.48 -0.04 0.13 0.00 -0.81 0.00 0.00 59.98 58.78 1pmo h ARG 290 Cb 1.17 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.56 1pmo h ARG 290 CO 0.57 0.39 0.51 -0.40 -1.51 0.00 0.00 179.97 179.53 1pmo n ASP 291 N -4.85 -1.64 -0.36 -3.80 5.68 -1.26 -4.09 116.55 106.23 1pmo n ASP 291 Ca 0.11 -1.90 0.05 0.00 -0.50 0.00 0.00 54.79 52.55 1pmo n ASP 291 Cb 0.26 2.67 0.22 0.00 -1.14 0.00 0.00 41.12 43.14 1pmo n ASP 291 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1pmo h GLU 292 N 0.00 1.03 -0.04 0.11 4.39 -1.92 -1.42 114.58 116.73 1pmo h GLU 292 Ca -0.25 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.38 1pmo h GLU 292 Cb 1.10 -0.23 -0.00 0.00 -0.10 0.00 0.00 28.75 29.51 1pmo h GLU 292 CO 0.34 0.68 0.02 1.49 -1.16 0.00 0.00 179.01 180.37 1pmo h GLU 293 N 1.06 0.05 0.00 2.33 4.81 -2.00 -1.82 114.58 119.00 1pmo h GLU 293 Ca 0.46 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.69 1pmo h GLU 293 Cb 0.36 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.73 1pmo h GLU 293 CO -0.22 0.04 0.00 0.00 -0.73 0.00 0.00 179.01 178.10 1pmo h ALA 294 N 1.97 1.00 -3.45 2.92 0.00 -1.61 -3.40 119.26 116.70 1pmo h ALA 294 Ca 0.01 0.00 -0.68 0.00 0.00 0.00 0.00 54.91 54.24 1pmo h ALA 294 Cb 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 17.79 17.44 1pmo h ALA 294 CO -0.00 0.00 -0.65 -1.17 0.00 0.00 0.00 179.25 177.42 1pmo s LEU 295 N -5.20 4.68 -0.05 0.00 2.96 -0.68 -4.88 118.68 115.51 1pmo s LEU 295 Ca 0.05 -1.87 -0.33 0.00 -0.22 0.00 0.00 54.13 51.76 1pmo s LEU 295 Cb 0.09 -1.72 -0.11 0.00 0.50 0.00 0.00 46.19 44.95 1pmo s LEU 295 CO 0.51 -0.41 1.88 -2.65 -1.32 0.00 0.00 176.35 174.35 1pmo n PRO 296 N 4.48 2.30 0.33 0.98 -0.02 -1.26 -4.84 135.00 136.97 1pmo n PRO 296 Ca -0.03 0.84 0.21 0.00 -2.02 0.00 0.00 63.50 62.50 1pmo n PRO 296 Cb 0.42 -2.70 1.12 0.00 -0.02 0.00 0.00 33.50 32.32 1pmo n PRO 296 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1pmo h GLN 297 N 9.19 0.00 0.00 -0.52 1.08 -1.95 -1.62 115.11 121.29 1pmo h GLN 297 Ca -0.48 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.72 1pmo h GLN 297 Cb 1.26 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.69 1pmo h GLN 297 CO 0.94 0.00 0.00 0.93 -0.95 0.00 0.00 178.83 179.75 1pmo h GLU 298 N 0.00 0.00 0.00 1.46 3.07 -2.03 -1.72 114.58 115.37 1pmo h GLU 298 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1pmo h GLU 298 Cb 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.07 1pmo h GLU 298 CO -0.00 0.00 -0.72 -0.07 -1.40 0.00 0.00 179.01 176.82 1pmo h LEU 299 N 0.00 0.00 -9.52 1.33 3.38 -1.67 -3.46 115.31 105.38 1pmo h LEU 299 Ca 0.00 -0.22 -0.58 0.00 0.09 0.00 0.00 57.88 57.17 1pmo h LEU 299 Cb 0.23 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.92 1pmo h LEU 299 CO 0.00 0.11 -0.10 -0.69 0.09 0.00 0.00 178.44 177.85 1pmo s VAL 300 N -3.19 5.00 -0.12 1.22 1.01 -0.65 -4.72 120.40 118.96 1pmo s VAL 300 Ca 0.05 1.05 -0.01 0.00 0.00 0.00 0.00 61.98 63.07 1pmo s VAL 300 Cb 0.13 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 1pmo s VAL 300 CO 0.74 0.45 -0.10 -0.36 0.00 0.00 0.00 175.10 175.82 1pmo s PHE 301 N -0.27 2.87 -0.25 5.22 0.40 -0.77 -4.93 117.98 120.25 1pmo s PHE 301 Ca 0.27 -0.45 -0.11 0.00 -0.60 0.00 0.00 56.93 56.04 1pmo s PHE 301 Cb -0.17 -1.85 -0.05 0.00 0.51 0.00 0.00 43.02 41.47 1pmo s PHE 301 CO 0.14 -0.08 0.19 -0.80 0.70 0.00 0.00 175.22 175.37 1pmo s ASN 302 N 0.16 6.11 -0.04 1.36 0.01 -1.26 -1.90 114.94 119.38 1pmo s ASN 302 Ca -0.05 0.11 0.06 0.00 -0.71 0.00 0.00 52.86 52.26 1pmo s ASN 302 Cb -0.15 -2.12 -0.02 0.00 0.41 0.00 0.00 41.25 39.37 1pmo s ASN 302 CO 0.04 0.02 -0.20 0.68 -1.51 0.00 0.00 177.10 176.14 1pmo s VAL 303 N 1.26 2.57 0.26 1.60 -7.23 -1.12 -5.00 120.40 112.75 1pmo s VAL 303 Ca 0.08 -0.91 -0.21 0.00 -1.81 0.00 0.00 61.98 59.13 1pmo s VAL 303 Cb -0.14 -1.96 -0.09 0.00 0.56 0.00 0.00 36.38 34.75 1pmo s VAL 303 CO 0.06 0.58 0.79 -1.81 -0.31 0.00 0.00 175.10 174.42 1pmo s ASP 304 N -0.64 7.11 0.25 4.85 1.01 -1.26 -2.53 116.67 125.45 1pmo s ASP 304 Ca 0.10 1.52 0.01 0.00 0.71 0.00 0.00 52.55 54.89 1pmo s ASP 304 Cb -0.10 -2.46 -0.05 0.00 1.01 0.00 0.00 42.92 41.32 1pmo s ASP 304 CO -0.00 -0.02 0.12 -0.31 0.21 0.00 0.00 175.17 175.17 1pmo s TYR 305 N -1.60 1.42 0.38 4.23 1.51 0.87 -4.96 117.35 119.21 1pmo s TYR 305 Ca 0.46 -1.28 0.09 0.00 -1.01 0.00 0.00 57.07 55.33 1pmo s TYR 305 Cb -0.16 -0.78 0.75 0.00 -0.11 0.00 0.00 41.96 41.66 1pmo s TYR 305 CO 0.21 -0.47 1.90 -0.07 -1.11 0.00 0.00 175.55 176.01 1pmo h LEU 306 N 2.44 0.22 0.00 -1.29 3.38 -1.98 -1.51 115.31 116.57 1pmo h LEU 306 Ca -0.37 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1pmo h LEU 306 Cb 1.25 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1pmo h LEU 306 CO 0.57 0.40 0.00 0.61 0.09 0.00 0.00 178.44 180.11 1pmo n GLY 307 N -0.81 -0.98 0.00 0.83 0.00 -1.26 -4.98 105.19 97.99 1pmo n GLY 307 Ca -0.01 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1pmo n GLY 307 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pmo n GLY 308 N 0.85 0.65 3.63 -0.02 0.00 -0.57 -5.05 105.19 104.68 1pmo n GLY 308 Ca 0.18 -0.91 -0.12 0.00 0.00 0.00 0.00 46.02 45.17 1pmo n GLY 308 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1pmo s GLN 309 N 0.00 0.79 0.05 1.61 -2.07 -1.26 -0.09 119.66 118.69 1pmo s GLN 309 Ca 0.00 1.00 0.07 0.00 -1.82 0.00 0.00 55.36 54.62 1pmo s GLN 309 Cb 0.00 0.35 -0.03 0.00 -1.09 0.00 0.00 33.01 32.25 1pmo s GLN 309 CO 0.00 -0.10 -0.20 0.42 -1.32 0.00 0.00 175.29 174.08 1pmo s ILE 310 N 0.57 1.62 0.03 3.63 1.01 -1.05 -4.97 121.20 122.04 1pmo s ILE 310 Ca -0.01 -1.22 -0.06 0.00 0.00 0.00 0.00 60.65 59.35 1pmo s ILE 310 Cb -0.05 -1.42 -0.05 0.00 0.01 0.00 0.00 42.46 40.95 1pmo s ILE 310 CO -0.03 0.15 0.28 -0.83 0.00 0.00 0.00 174.94 174.51 1pmo s GLY 311 N -1.26 2.25 -0.00 6.18 0.00 -1.26 -2.78 107.32 110.44 1pmo s GLY 311 Ca 0.07 -0.59 -0.04 0.00 0.00 0.00 0.00 44.72 44.15 1pmo s GLY 311 CO 0.02 -0.43 0.08 -0.51 0.00 0.00 0.00 173.10 172.27 1pmo s THR 312 N -1.35 0.07 -0.32 0.90 -4.23 -0.80 -4.96 115.64 104.95 1pmo s THR 312 Ca 0.29 -0.60 0.01 0.00 -1.18 0.00 0.00 61.69 60.22 1pmo s THR 312 Cb -0.13 -0.32 0.10 0.00 1.34 0.00 0.00 72.50 73.49 1pmo s THR 312 CO 0.18 -0.33 0.07 0.12 -0.54 0.00 0.00 174.62 174.12 1pmo s PHE 313 N -1.09 2.55 -0.00 3.99 5.36 -1.26 -1.85 117.98 125.67 1pmo s PHE 313 Ca -0.12 -2.24 -0.23 0.00 -0.96 0.00 0.00 56.93 53.38 1pmo s PHE 313 Cb -0.07 -2.20 0.05 0.00 -0.34 0.00 0.00 43.02 40.46 1pmo s PHE 313 CO 0.01 -0.90 0.50 0.00 -1.46 0.00 0.00 175.22 173.37 1pmo s ALA 314 N 1.33 -1.29 -0.08 11.12 0.00 -1.26 -4.94 121.76 126.64 1pmo s ALA 314 Ca 0.10 0.73 -0.06 0.00 0.00 0.00 0.00 51.96 52.73 1pmo s ALA 314 Cb -0.18 0.17 -0.27 0.00 0.00 0.00 0.00 23.12 22.84 1pmo s ALA 314 CO -0.18 -0.39 0.54 0.82 0.00 0.00 0.00 175.76 176.55 1pmo h ILE 315 N 3.17 0.80 -3.88 0.00 2.04 -1.98 -3.47 117.51 114.19 1pmo h ILE 315 Ca -0.29 -2.48 -0.46 0.00 1.00 0.00 0.00 64.86 62.62 1pmo h ILE 315 Cb 1.18 2.60 0.08 0.00 -0.74 0.00 0.00 36.82 39.94 1pmo h ILE 315 CO 0.40 0.84 0.25 0.20 0.00 0.00 0.00 178.15 179.84 1pmo s ASN 316 N -7.01 4.97 0.00 1.72 0.01 -1.26 -5.07 114.94 108.29 1pmo s ASN 316 Ca -0.17 0.58 0.00 0.00 -0.71 0.00 0.00 52.86 52.56 1pmo s ASN 316 Cb 0.06 -1.29 0.00 0.00 0.41 0.00 0.00 41.25 40.44 1pmo s ASN 316 CO 0.81 -1.51 0.00 0.33 -1.51 0.00 0.00 177.10 175.21 1pmo n PHE 317 N -2.91 0.00 -2.33 2.20 7.35 -1.26 -5.07 117.46 115.45 1pmo n PHE 317 Ca 0.07 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.36 1pmo n PHE 317 Cb 0.60 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.39 1pmo n PHE 317 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 1pmo s SER 318 N 1.00 7.05 -0.11 -2.13 0.01 -1.26 -4.26 113.70 114.01 1pmo s SER 318 Ca 0.00 2.38 -0.33 0.00 1.31 0.00 0.00 55.95 59.31 1pmo s SER 318 Cb 0.00 -2.62 0.13 0.00 0.21 0.00 0.00 66.02 63.73 1pmo s SER 318 CO 0.00 -0.35 1.19 0.00 0.41 0.00 0.00 173.24 174.49 1pmo s ARG 319 N -1.01 0.43 0.55 12.44 1.70 -1.26 -5.00 118.95 126.80 1pmo s ARG 319 Ca 0.49 -0.19 -0.20 0.00 -0.47 0.00 0.00 55.73 55.36 1pmo s ARG 319 Cb -0.35 0.18 -0.05 0.00 -0.57 0.00 0.00 34.95 34.16 1pmo s ARG 319 CO 0.42 -0.19 1.21 -2.14 -1.08 0.00 0.00 175.30 173.52 1pmo s PRO 320 N -2.53 3.24 0.00 3.89 0.02 -1.26 -0.39 135.00 137.97 1pmo s PRO 320 Ca 0.10 1.84 0.20 0.00 0.02 0.00 0.00 61.00 63.16 1pmo s PRO 320 Cb 0.01 -2.10 0.30 0.00 0.02 0.00 0.00 34.50 32.73 1pmo s PRO 320 CO -0.04 -0.99 1.26 0.00 -0.33 0.00 0.00 177.00 176.89 1pmo n ALA 321 N -1.21 2.41 -0.36 -1.55 0.00 -0.37 -4.50 120.51 114.93 1pmo n ALA 321 Ca 0.11 -0.88 -0.01 0.00 0.00 0.00 0.00 53.44 52.66 1pmo n ALA 321 Cb 0.49 -0.72 0.12 0.00 0.00 0.00 0.00 19.45 19.33 1pmo n ALA 321 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1pmo h GLY 322 N 3.88 1.40 1.09 0.00 0.00 -1.82 -2.48 103.07 105.13 1pmo h GLY 322 Ca 0.00 -0.50 -0.09 0.00 0.00 0.00 0.00 47.33 46.74 1pmo h GLY 322 CO 0.00 0.46 0.05 1.46 0.00 0.00 0.00 176.54 178.51 1pmo h GLN 323 N 1.28 1.09 -0.48 4.80 7.50 -1.88 0.96 115.11 128.39 1pmo h GLN 323 Ca 0.37 -0.32 0.00 0.00 0.50 0.00 0.00 58.65 59.20 1pmo h GLN 323 Cb -0.08 -0.11 -0.02 0.00 0.05 0.00 0.00 27.48 27.31 1pmo h GLN 323 CO -0.10 1.04 0.31 0.28 -1.50 0.00 0.00 178.83 178.86 1pmo h VAL 324 N 1.01 1.13 -0.47 -0.54 2.07 -1.84 0.36 116.25 117.98 1pmo h VAL 324 Ca 0.19 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.43 1pmo h VAL 324 Cb 0.51 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 1pmo h VAL 324 CO 0.02 0.13 0.19 0.40 0.02 0.00 0.00 177.57 178.33 1pmo h ILE 325 N 0.65 1.21 -0.30 4.57 2.04 -1.04 -0.66 117.51 123.98 1pmo h ILE 325 Ca 0.17 -0.64 -0.07 0.00 1.00 0.00 0.00 64.86 65.33 1pmo h ILE 325 Cb -0.06 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 1pmo h ILE 325 CO -0.04 0.24 -0.10 0.00 0.00 0.00 0.00 178.15 178.25 1pmo h ALA 326 N 1.03 1.27 -0.59 1.87 0.00 -0.34 -1.41 119.26 121.08 1pmo h ALA 326 Ca 0.16 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1pmo h ALA 326 Cb 0.19 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1pmo h ALA 326 CO -0.01 0.48 0.10 0.37 0.00 0.00 0.00 179.25 180.19 1pmo h GLN 327 N 0.46 0.98 -0.85 0.00 5.75 0.23 -2.14 115.11 119.55 1pmo h GLN 327 Ca 0.09 -0.26 -0.03 0.00 -0.15 0.00 0.00 58.65 58.29 1pmo h GLN 327 Cb 0.47 -0.11 -0.04 0.00 1.07 0.00 0.00 27.48 28.86 1pmo h GLN 327 CO 0.03 0.93 0.41 -0.92 -2.65 0.00 0.00 178.83 176.63 1pmo h TYR 328 N 0.89 1.22 -0.73 3.99 3.20 -0.65 -1.55 116.97 123.33 1pmo h TYR 328 Ca 0.18 -0.06 0.04 0.00 3.14 0.00 0.00 58.73 62.04 1pmo h TYR 328 Cb 0.42 -0.38 -0.05 0.00 1.54 0.00 0.00 36.73 38.26 1pmo h TYR 328 CO 0.03 0.88 0.45 -0.92 -1.64 0.00 0.00 178.16 176.96 1pmo h TYR 329 N 1.21 0.84 -0.26 -3.82 3.20 -0.75 0.69 116.97 118.09 1pmo h TYR 329 Ca 0.29 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.16 1pmo h TYR 329 Cb 0.11 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.10 1pmo h TYR 329 CO 0.01 0.45 0.05 0.93 -1.64 0.00 0.00 178.16 177.97 1pmo h GLU 330 N 0.86 0.42 -0.39 1.82 4.39 -0.82 -0.93 114.58 119.93 1pmo h GLU 330 Ca 0.31 -0.11 0.05 0.00 0.34 0.00 0.00 59.36 59.95 1pmo h GLU 330 Cb 0.08 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.64 1pmo h GLU 330 CO -0.14 0.53 0.12 0.74 -1.16 0.00 0.00 179.01 179.10 1pmo h PHE 331 N 0.24 0.20 -0.23 4.33 -1.00 -0.75 -1.43 116.94 118.31 1pmo h PHE 331 Ca 0.08 0.02 -0.03 0.00 2.81 0.00 0.00 57.97 60.85 1pmo h PHE 331 Cb 0.31 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 39.82 1pmo h PHE 331 CO 0.02 0.07 0.02 -0.07 -1.61 0.00 0.00 178.31 176.74 1pmo h LEU 332 N 0.26 0.38 -0.43 1.54 3.38 -0.75 -1.24 115.31 118.44 1pmo h LEU 332 Ca 0.18 -0.28 -0.11 0.00 0.09 0.00 0.00 57.88 57.75 1pmo h LEU 332 Cb 0.18 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1pmo h LEU 332 CO -0.20 0.56 -0.54 0.08 0.09 0.00 0.00 178.44 178.43 1pmo h ARG 333 N 0.17 0.00 0.00 1.13 0.11 -1.10 -3.39 114.38 111.30 1pmo h ARG 333 Ca 0.07 0.00 -0.28 0.00 0.10 0.00 0.00 59.98 59.87 1pmo h ARG 333 Cb 0.36 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.40 1pmo h ARG 333 CO 0.01 0.54 -1.92 1.28 0.10 0.00 0.00 179.97 179.98 1pmo n LEU 334 N -3.41 1.88 0.00 0.08 4.77 -0.54 -4.90 117.00 114.87 1pmo n LEU 334 Ca 0.01 0.32 0.04 0.00 -0.03 0.00 0.00 56.01 56.35 1pmo n LEU 334 Cb 0.67 -0.76 -0.01 0.00 -2.33 0.00 0.00 43.42 40.99 1pmo n LEU 334 CO 0.40 0.24 -0.05 0.61 -1.33 0.00 0.00 177.39 177.26 1pmo n GLY 335 N 1.42 -1.71 0.28 -0.72 0.00 -0.47 -0.27 105.19 103.72 1pmo n GLY 335 Ca -0.38 -1.25 -0.07 0.00 0.00 0.00 0.00 46.02 44.32 1pmo n GLY 335 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1pmo h ARG 336 N 0.00 0.95 -0.21 1.61 3.08 -1.98 -1.26 114.38 116.56 1pmo h ARG 336 Ca 0.01 -0.15 0.05 0.00 0.07 0.00 0.00 59.98 59.95 1pmo h ARG 336 Cb 0.26 -0.16 -0.06 0.00 0.08 0.00 0.00 29.97 30.09 1pmo h ARG 336 CO 0.00 0.78 -0.14 1.49 -1.07 0.00 0.00 179.97 181.03 1pmo h GLU 337 N 0.91 -0.13 -0.28 0.04 4.81 -2.01 -1.27 114.58 116.66 1pmo h GLU 337 Ca 0.22 0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 59.32 1pmo h GLU 337 Cb 0.16 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.56 1pmo h GLU 337 CO -0.02 -0.08 -0.36 0.78 -0.73 0.00 0.00 179.01 178.59 1pmo h GLY 338 N -0.13 0.80 1.32 1.92 0.00 -0.42 -3.10 103.07 103.45 1pmo h GLY 338 Ca 0.12 -0.87 -0.04 0.00 0.00 0.00 0.00 47.33 46.55 1pmo h GLY 338 CO -0.30 0.78 0.19 -0.97 0.00 0.00 0.00 176.54 176.25 1pmo h TYR 339 N 0.48 0.88 -0.64 5.60 -1.99 -1.11 -1.43 116.97 118.76 1pmo h TYR 339 Ca 0.03 -0.06 0.01 0.00 2.00 0.00 0.00 58.73 60.71 1pmo h TYR 339 Cb 0.94 -0.27 -0.03 0.00 2.00 0.00 0.00 36.73 39.38 1pmo h TYR 339 CO 0.08 0.71 0.42 1.15 -0.00 0.00 0.00 178.16 180.52 1pmo h THR 340 N 0.85 1.17 -0.29 -2.88 2.02 -1.24 0.46 112.91 113.00 1pmo h THR 340 Ca 0.19 -0.31 -0.15 0.00 0.77 0.00 0.00 66.41 66.92 1pmo h THR 340 Cb 0.23 0.23 -0.00 0.00 -1.74 0.00 0.00 68.15 66.86 1pmo h THR 340 CO -0.01 0.16 -0.40 0.11 0.37 0.00 0.00 175.52 175.75 1pmo h LYS 341 N 0.87 0.79 0.09 6.66 1.57 -1.42 -1.26 116.57 123.87 1pmo h LYS 341 Ca 0.23 -0.46 -0.00 0.00 -1.87 0.00 0.00 60.65 58.55 1pmo h LYS 341 Cb -0.09 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.25 1pmo h LYS 341 CO -0.05 1.09 -0.04 0.28 -0.57 0.00 0.00 179.45 180.15 1pmo h VAL 342 N 0.55 1.00 -0.59 0.50 2.07 -1.01 -1.77 116.25 117.00 1pmo h VAL 342 Ca 0.03 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 1pmo h VAL 342 Cb 1.00 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 1pmo h VAL 342 CO 0.09 0.08 0.24 1.56 0.02 0.00 0.00 177.57 179.56 1pmo h GLN 343 N -0.26 0.87 -0.91 1.57 7.50 -0.98 -2.73 115.11 120.18 1pmo h GLN 343 Ca -0.01 -0.15 0.03 0.00 0.50 0.00 0.00 58.65 59.02 1pmo h GLN 343 Cb 0.22 -0.14 -0.05 0.00 0.05 0.00 0.00 27.48 27.55 1pmo h GLN 343 CO 0.02 0.74 0.60 -0.97 -1.50 0.00 0.00 178.83 177.72 1pmo h ASN 344 N 0.81 0.99 -0.92 1.46 -1.24 -1.12 -1.88 115.58 113.69 1pmo h ASN 344 Ca 0.20 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.20 1pmo h ASN 344 Cb 0.19 -0.23 -0.05 0.00 0.73 0.00 0.00 38.32 38.97 1pmo h ASN 344 CO -0.02 0.68 0.59 0.00 -1.29 0.00 0.00 177.43 177.39 1pmo h ALA 345 N 1.47 1.30 -0.41 1.57 0.00 -1.01 -0.61 119.26 121.57 1pmo h ALA 345 Ca 0.36 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 55.04 1pmo h ALA 345 Cb 0.00 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 1pmo h ALA 345 CO -0.11 0.63 -0.34 0.77 0.00 0.00 0.00 179.25 180.20 1pmo h SER 346 N 1.26 1.00 -0.35 0.00 0.02 -1.23 -2.55 113.55 111.70 1pmo h SER 346 Ca 0.33 -0.44 -0.05 0.00 -0.84 0.00 0.00 61.79 60.79 1pmo h SER 346 Cb -0.10 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.14 1pmo h SER 346 CO -0.07 1.23 0.04 1.88 -1.14 0.00 0.00 176.83 178.78 1pmo h TYR 347 N 0.78 0.71 -0.49 3.45 0.05 -0.85 -1.10 116.97 119.53 1pmo h TYR 347 Ca 0.07 -0.07 -0.09 0.00 0.05 0.00 0.00 58.73 58.69 1pmo h TYR 347 Cb 0.93 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 38.45 1pmo h TYR 347 CO 0.06 0.65 -0.08 1.96 -1.05 0.00 0.00 178.16 179.70 1pmo h GLN 348 N 0.65 0.87 0.04 4.88 4.20 -0.93 0.15 115.11 124.97 1pmo h GLN 348 Ca 0.14 -0.28 -0.00 0.00 0.06 0.00 0.00 58.65 58.56 1pmo h GLN 348 Cb 0.34 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.05 1pmo h GLN 348 CO 0.01 0.92 -0.02 0.28 -0.67 0.00 0.00 178.83 179.34 1pmo h VAL 349 N 0.79 1.15 -0.15 -0.54 2.07 -1.04 -1.63 116.25 116.89 1pmo h VAL 349 Ca 0.14 -0.60 0.02 0.00 0.82 0.00 0.00 66.70 67.07 1pmo h VAL 349 Cb 0.58 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 1pmo h VAL 349 CO 0.04 0.15 0.02 0.00 0.02 0.00 0.00 177.57 177.80 1pmo h ALA 350 N 0.63 0.14 -0.80 1.67 0.00 -1.07 -1.07 119.26 118.77 1pmo h ALA 350 Ca -0.01 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1pmo h ALA 350 Cb 0.29 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1pmo h ALA 350 CO 0.01 -0.42 0.53 0.00 0.00 0.00 0.00 179.25 179.36 1pmo h ALA 351 N 1.11 1.46 -0.19 0.00 0.00 -0.96 -0.98 119.26 119.71 1pmo h ALA 351 Ca 0.07 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1pmo h ALA 351 Cb 0.06 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1pmo h ALA 351 CO -0.10 0.49 0.03 -0.92 0.00 0.00 0.00 179.25 178.76 1pmo h TYR 352 N 1.05 0.33 -0.54 0.00 3.20 -0.82 -2.14 116.97 118.05 1pmo h TYR 352 Ca 0.30 -0.04 0.01 0.00 3.14 0.00 0.00 58.73 62.13 1pmo h TYR 352 Cb -0.08 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.08 1pmo h TYR 352 CO -0.00 0.46 0.36 -0.07 -1.64 0.00 0.00 178.16 177.26 1pmo h LEU 353 N 0.10 0.61 -0.01 2.82 3.38 -0.73 -0.55 115.31 120.93 1pmo h LEU 353 Ca 0.06 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.02 1pmo h LEU 353 Cb 0.31 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1pmo h LEU 353 CO 0.00 0.44 -0.03 0.00 0.09 0.00 0.00 178.44 178.95 1pmo h ALA 354 N 1.20 -0.02 -0.71 1.53 0.00 -1.12 0.27 119.26 120.41 1pmo h ALA 354 Ca 0.20 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 1pmo h ALA 354 Cb -0.08 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1pmo h ALA 354 CO -0.05 -0.52 0.28 -0.44 0.00 0.00 0.00 179.25 178.52 1pmo h ASP 355 N -0.04 0.97 -0.09 0.00 5.19 -1.18 -1.81 116.42 119.46 1pmo h ASP 355 Ca 0.02 -0.14 -0.22 0.00 -0.62 0.00 0.00 57.03 56.06 1pmo h ASP 355 Cb 0.06 -0.25 0.01 0.00 0.18 0.00 0.00 39.33 39.34 1pmo h ASP 355 CO -0.04 0.86 -0.81 -0.33 -3.12 0.00 0.00 179.24 175.80 1pmo h GLU 356 N 1.03 0.70 -0.34 3.56 4.39 -0.83 -3.25 114.58 119.84 1pmo h GLU 356 Ca 0.24 -0.64 -0.07 0.00 0.34 0.00 0.00 59.36 59.23 1pmo h GLU 356 Cb 0.20 0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.99 1pmo h GLU 356 CO -0.02 1.24 -0.09 0.82 -1.16 0.00 0.00 179.01 179.81 1pmo h ILE 357 N 0.39 1.23 0.00 3.13 2.04 -0.39 -2.56 117.51 121.34 1pmo h ILE 357 Ca -0.08 -1.00 -0.00 0.00 1.00 0.00 0.00 64.86 64.78 1pmo h ILE 357 Cb 1.46 1.07 -0.00 0.00 -0.74 0.00 0.00 36.82 38.60 1pmo h ILE 357 CO 0.16 0.33 -0.01 0.00 0.00 0.00 0.00 178.15 178.64 1pmo h ALA 358 N 1.38 1.31 -0.01 1.87 0.00 -1.36 -0.87 119.26 121.58 1pmo h ALA 358 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1pmo h ALA 358 Cb 0.47 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1pmo h ALA 358 CO 0.03 0.01 -0.10 1.63 0.00 0.00 0.00 179.25 180.82 1pmo n LYS 359 N -3.55 1.06 0.00 0.00 5.02 -0.97 -4.05 118.16 115.68 1pmo n LYS 359 Ca -0.03 -0.49 0.10 0.00 -2.02 0.00 0.00 58.31 55.87 1pmo n LYS 359 Cb 0.09 -1.49 -0.11 0.00 -0.02 0.00 0.00 35.03 33.50 1pmo n LYS 359 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1pmo n LEU 360 N -0.54 1.06 -3.77 -0.35 4.77 -0.33 -5.05 117.00 112.79 1pmo n LEU 360 Ca 0.17 -0.52 -0.02 0.00 -0.03 0.00 0.00 56.01 55.61 1pmo n LEU 360 Cb 0.30 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.39 1pmo n LEU 360 CO 0.21 0.26 0.86 -0.83 -1.33 0.00 0.00 177.39 176.55 1pmo s GLY 361 N -2.93 -0.18 -1.24 -0.72 0.00 -1.25 -5.07 107.32 95.93 1pmo s GLY 361 Ca 0.09 0.14 -0.19 0.00 0.00 0.00 0.00 44.72 44.76 1pmo s GLY 361 CO 0.83 1.00 1.72 2.56 0.00 0.00 0.00 173.10 179.21 1pmo s PRO 362 N -2.70 3.75 0.13 2.90 0.04 -1.26 -4.88 135.00 132.98 1pmo s PRO 362 Ca 0.16 -1.76 0.08 0.00 0.04 0.00 0.00 61.00 59.52 1pmo s PRO 362 Cb -0.00 -5.48 -0.04 0.00 0.04 0.00 0.00 34.50 29.02 1pmo s PRO 362 CO 0.01 -2.46 -0.11 0.71 0.04 0.00 0.00 177.00 175.20 1pmo s TYR 363 N 5.16 2.69 -0.19 0.56 2.02 -1.26 -0.86 117.35 125.46 1pmo s TYR 363 Ca 0.55 -0.19 -0.01 0.00 -0.37 0.00 0.00 57.07 57.05 1pmo s TYR 363 Cb 0.03 -1.38 0.00 0.00 -0.40 0.00 0.00 41.96 40.21 1pmo s TYR 363 CO 0.06 0.44 -0.12 -2.00 -1.57 0.00 0.00 175.55 172.37 1pmo s GLU 364 N -2.37 3.22 -0.02 -0.62 2.12 0.31 -4.74 118.70 116.59 1pmo s GLU 364 Ca 0.22 -0.72 -0.15 0.00 0.36 0.00 0.00 54.97 54.68 1pmo s GLU 364 Cb -0.10 -2.78 -0.05 0.00 0.26 0.00 0.00 34.13 31.45 1pmo s GLU 364 CO 0.14 -0.15 0.42 -0.06 -0.54 0.00 0.00 175.26 175.07 1pmo s PHE 365 N 1.26 3.69 -0.16 5.30 0.40 -1.26 -1.29 117.98 125.91 1pmo s PHE 365 Ca 0.03 0.97 0.15 0.00 -0.60 0.00 0.00 56.93 57.49 1pmo s PHE 365 Cb -0.14 -2.34 -0.22 0.00 0.51 0.00 0.00 43.02 40.83 1pmo s PHE 365 CO -0.06 0.55 0.08 -0.89 0.70 0.00 0.00 175.22 175.60 1pmo n ILE 366 N 2.18 1.12 -3.72 0.64 5.41 0.84 -4.95 119.36 120.89 1pmo n ILE 366 Ca -0.13 -0.72 -0.12 0.00 1.00 0.00 0.00 62.75 62.78 1pmo n ILE 366 Cb 0.52 -0.51 -0.13 0.00 -0.71 0.00 0.00 39.64 38.81 1pmo n ILE 366 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1pmo n THR 368 N 4.36 1.81 -1.94 0.00 -2.24 -1.26 -1.28 114.28 113.74 1pmo n THR 368 Ca -0.23 -1.96 -0.07 0.00 -2.27 0.00 0.00 64.05 59.52 1pmo n THR 368 Cb 0.53 -0.11 -0.01 0.00 -2.10 0.00 0.00 70.33 68.64 1pmo n THR 368 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pmo n GLY 369 N -1.03 0.26 3.72 3.38 0.00 -0.49 -3.97 105.19 107.06 1pmo n GLY 369 Ca 0.15 -0.62 -0.38 0.00 0.00 0.00 0.00 46.02 45.16 1pmo n GLY 369 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pmo s ARG 370 N -3.98 4.37 0.44 1.61 3.00 -1.26 -4.25 118.95 118.88 1pmo s ARG 370 Ca 0.00 0.57 0.19 0.00 0.00 0.00 0.00 55.73 56.50 1pmo s ARG 370 Cb 0.00 -3.44 1.15 0.00 0.00 0.00 0.00 34.95 32.66 1pmo s ARG 370 CO 0.00 0.13 1.89 -1.35 0.00 0.00 0.00 175.30 175.96 1pmo h PRO 371 N 6.75 0.32 0.00 3.54 0.11 -1.91 -0.91 132.00 139.89 1pmo h PRO 371 Ca -0.41 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1pmo h PRO 371 Cb 1.18 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1pmo h PRO 371 CO 0.76 0.21 -0.09 -0.40 -0.21 0.00 0.00 178.00 178.26 1pmo n ASP 372 N -4.46 0.68 -0.05 -2.05 5.75 -1.26 -3.94 116.55 111.22 1pmo n ASP 372 Ca 0.17 0.49 -0.00 0.00 -0.01 0.00 0.00 54.79 55.44 1pmo n ASP 372 Cb 0.68 -0.61 -0.14 0.00 -1.03 0.00 0.00 41.12 40.03 1pmo n ASP 372 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1pmo n GLU 373 N -2.12 0.94 0.00 0.11 1.02 -0.42 -4.99 120.64 115.17 1pmo n GLU 373 Ca 0.05 -0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1pmo n GLU 373 Cb 0.42 -1.43 0.00 0.00 -0.02 0.00 0.00 31.44 30.41 1pmo n GLU 373 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1pmo n GLY 374 N 1.74 -0.87 3.98 0.62 0.00 -0.76 -0.98 105.19 108.94 1pmo n GLY 374 Ca -0.17 -0.17 -0.21 0.00 0.00 0.00 0.00 46.02 45.47 1pmo n GLY 374 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1pmo s ILE 375 N -4.00 2.58 -1.05 -0.61 -4.36 -0.49 -4.48 121.20 108.79 1pmo s ILE 375 Ca 0.00 -0.70 -0.22 0.00 -0.26 0.00 0.00 60.65 59.47 1pmo s ILE 375 Cb 0.00 -2.88 -0.10 0.00 1.25 0.00 0.00 42.46 40.73 1pmo s ILE 375 CO 0.00 0.00 1.92 -2.65 0.24 0.00 0.00 174.94 174.45 1pmo n PRO 376 N -2.38 1.69 -3.95 0.37 -0.02 -1.26 -4.42 135.00 125.03 1pmo n PRO 376 Ca 0.10 -2.29 -0.09 0.00 -2.02 0.00 0.00 63.50 59.20 1pmo n PRO 376 Cb 0.60 -3.41 -0.09 0.00 -0.02 0.00 0.00 33.50 30.58 1pmo n PRO 376 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pmo s ALA 377 N 8.27 0.03 -0.11 3.55 0.00 -1.26 -1.52 121.76 130.73 1pmo s ALA 377 Ca 0.63 -0.73 0.03 0.00 0.00 0.00 0.00 51.96 51.89 1pmo s ALA 377 Cb 0.05 0.31 0.01 0.00 0.00 0.00 0.00 23.12 23.50 1pmo s ALA 377 CO 0.12 -0.38 -0.19 0.08 0.00 0.00 0.00 175.76 175.40 1pmo s VAL 378 N -3.24 1.73 -0.04 0.00 1.01 -0.02 -1.40 120.40 118.44 1pmo s VAL 378 Ca 0.00 -0.80 -0.00 0.00 0.00 0.00 0.00 61.98 61.18 1pmo s VAL 378 Cb 0.03 -1.54 0.03 0.00 0.00 0.00 0.00 36.38 34.89 1pmo s VAL 378 CO -0.08 0.49 -0.00 0.00 0.00 0.00 0.00 175.10 175.51 1pmo s PHE 380 N 1.34 0.27 0.18 0.00 -0.71 -0.86 -0.11 117.98 118.08 1pmo s PHE 380 Ca -0.05 -0.62 0.01 0.00 -1.04 0.00 0.00 56.93 55.22 1pmo s PHE 380 Cb -0.13 0.09 -0.04 0.00 -1.21 0.00 0.00 43.02 41.72 1pmo s PHE 380 CO -0.02 -0.80 0.05 -1.59 -1.34 0.00 0.00 175.22 171.51 1pmo s LYS 381 N -3.95 1.12 0.31 1.99 -2.85 -0.41 -1.05 119.74 114.89 1pmo s LYS 381 Ca 0.16 -1.56 -0.28 0.00 -1.00 0.00 0.00 55.97 53.30 1pmo s LYS 381 Cb 0.02 -0.07 -0.09 0.00 -2.06 0.00 0.00 37.83 35.63 1pmo s LYS 381 CO 0.00 -0.22 1.05 -0.51 0.10 0.00 0.00 175.35 175.78 1pmo s LEU 382 N -3.16 4.44 0.43 2.77 1.43 -1.26 -0.53 118.68 122.80 1pmo s LEU 382 Ca 0.28 2.14 -0.26 0.00 -1.03 0.00 0.00 54.13 55.25 1pmo s LEU 382 Cb 0.07 -3.80 -0.09 0.00 0.03 0.00 0.00 46.19 42.40 1pmo s LEU 382 CO 0.06 -0.19 1.43 0.29 0.23 0.00 0.00 176.35 178.17 1pmo n LYS 383 N 0.85 2.33 -1.69 1.70 5.02 -0.04 -4.69 118.16 121.66 1pmo n LYS 383 Ca 0.01 0.83 -0.44 0.00 -2.02 0.00 0.00 58.31 56.68 1pmo n LYS 383 Cb 0.47 -2.61 -0.02 0.00 -0.02 0.00 0.00 35.03 32.84 1pmo n LYS 383 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1pmo n ASP 384 N 0.03 2.96 -0.94 4.39 8.00 -1.26 -1.57 116.55 128.17 1pmo n ASP 384 Ca 0.04 1.15 -0.12 0.00 0.71 0.00 0.00 54.79 56.57 1pmo n ASP 384 Cb 0.40 -1.46 -0.05 0.00 -0.02 0.00 0.00 41.12 40.00 1pmo n ASP 384 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1pmo n GLY 385 N 2.11 1.17 3.24 0.44 0.00 -1.26 -5.00 105.19 105.89 1pmo n GLY 385 Ca 0.11 -0.48 -0.33 0.00 0.00 0.00 0.00 46.02 45.32 1pmo n GLY 385 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1pmo s GLU 386 N -3.13 3.17 -0.42 1.61 2.56 -0.61 -5.08 118.70 116.80 1pmo s GLU 386 Ca 0.00 -0.77 0.04 0.00 0.00 0.00 0.00 54.97 54.24 1pmo s GLU 386 Cb 0.00 -2.60 0.11 0.00 2.00 0.00 0.00 34.13 33.65 1pmo s GLU 386 CO 0.00 -0.01 0.15 0.34 -0.56 0.00 0.00 175.26 175.18 1pmo s ASP 387 N 0.86 4.51 0.00 -1.70 -1.08 -1.26 -4.74 116.67 113.26 1pmo s ASP 387 Ca -0.05 -2.53 0.26 0.00 -0.52 0.00 0.00 52.55 49.71 1pmo s ASP 387 Cb -0.15 -1.59 1.27 0.00 -1.46 0.00 0.00 42.92 40.99 1pmo s ASP 387 CO -0.01 -0.31 1.86 -0.81 0.52 0.00 0.00 175.17 176.41 1pmo n PRO 388 N 3.76 0.33 0.00 4.34 -0.04 -1.26 -4.86 135.00 137.26 1pmo n PRO 388 Ca 0.04 0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1pmo n PRO 388 Cb 0.37 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.33 1pmo n PRO 388 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1pmo n GLY 389 N 0.91 1.26 3.59 0.55 0.00 -1.26 -5.00 105.19 105.24 1pmo n GLY 389 Ca 0.12 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.09 1pmo n GLY 389 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1pmo s TYR 390 N -2.00 -0.17 0.39 1.61 -0.85 -1.26 -4.55 117.35 110.52 1pmo s TYR 390 Ca 0.00 0.08 0.08 0.00 -0.52 0.00 0.00 57.07 56.70 1pmo s TYR 390 Cb 0.00 0.53 -0.03 0.00 0.38 0.00 0.00 41.96 42.84 1pmo s TYR 390 CO 0.00 -0.33 0.26 0.95 -1.52 0.00 0.00 175.55 174.91 1pmo s THR 391 N -2.64 2.72 0.24 -3.49 -4.23 -1.26 -4.99 115.64 102.00 1pmo s THR 391 Ca 0.09 -1.52 0.32 0.00 -1.18 0.00 0.00 61.69 59.40 1pmo s THR 391 Cb -0.00 -3.01 0.35 0.00 1.34 0.00 0.00 72.50 71.17 1pmo s THR 391 CO -0.05 -0.05 2.02 -0.07 -0.54 0.00 0.00 174.62 175.92 1pmo h LEU 392 N 1.27 0.00 -0.31 4.79 3.38 -1.96 -2.16 115.31 120.32 1pmo h LEU 392 Ca -0.43 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.44 1pmo h LEU 392 Cb 1.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 1pmo h LEU 392 CO 0.62 0.07 -0.23 1.88 0.09 0.00 0.00 178.44 180.87 1pmo h TYR 393 N 0.00 0.83 -0.58 1.13 0.05 -1.93 -0.82 116.97 115.65 1pmo h TYR 393 Ca -0.00 -0.23 -0.02 0.00 0.05 0.00 0.00 58.73 58.53 1pmo h TYR 393 Cb 0.46 -0.18 -0.03 0.00 1.01 0.00 0.00 36.73 37.99 1pmo h TYR 393 CO 0.00 0.96 0.28 -0.44 -1.05 0.00 0.00 178.16 177.91 1pmo h ASP 394 N 0.46 0.76 -0.72 3.88 3.32 -1.66 -1.81 116.42 120.65 1pmo h ASP 394 Ca 0.06 -0.13 -0.05 0.00 0.02 0.00 0.00 57.03 56.93 1pmo h ASP 394 Cb 0.78 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.11 1pmo h ASP 394 CO 0.06 0.68 0.25 0.25 -1.72 0.00 0.00 179.24 178.75 1pmo h LEU 395 N 0.79 1.02 -0.92 1.55 5.85 -1.34 -2.02 115.31 120.24 1pmo h LEU 395 Ca 0.20 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.74 1pmo h LEU 395 Cb 0.12 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.83 1pmo h LEU 395 CO -0.03 0.94 0.61 -1.28 -0.34 0.00 0.00 178.44 178.35 1pmo h SER 396 N 1.05 1.05 -0.45 1.25 0.87 -0.77 -1.48 113.55 115.07 1pmo h SER 396 Ca 0.23 -0.03 -0.10 0.00 -1.23 0.00 0.00 61.79 60.67 1pmo h SER 396 Cb 0.27 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 1pmo h SER 396 CO -0.01 0.76 -0.11 -0.08 -0.53 0.00 0.00 176.83 176.86 1pmo h GLU 397 N 1.24 0.86 -0.83 2.24 4.81 -0.93 -2.11 114.58 119.86 1pmo h GLU 397 Ca 0.34 -0.33 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1pmo h GLU 397 Cb -0.13 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.16 1pmo h GLU 397 CO -0.08 0.97 0.51 0.00 -0.73 0.00 0.00 179.01 179.68 1pmo h ARG 398 N 0.69 1.12 -0.05 1.92 2.47 -0.97 -1.83 114.38 117.72 1pmo h ARG 398 Ca 0.11 -0.09 -0.08 0.00 -1.26 0.00 0.00 59.98 58.66 1pmo h ARG 398 Cb 0.65 -0.24 -0.01 0.00 -1.65 0.00 0.00 29.97 28.72 1pmo h ARG 398 CO 0.04 0.77 -0.35 -0.07 0.56 0.00 0.00 179.97 180.93 1pmo h LEU 399 N 1.14 0.10 -0.98 3.04 3.38 -1.04 -2.60 115.31 118.35 1pmo h LEU 399 Ca 0.30 -0.04 -0.08 0.00 0.09 0.00 0.00 57.88 58.15 1pmo h LEU 399 Cb -0.06 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1pmo h LEU 399 CO -0.06 0.45 -0.14 0.03 0.09 0.00 0.00 178.44 178.81 1pmo h ARG 400 N 0.09 0.57 0.00 1.13 3.08 -0.65 -0.37 114.38 118.24 1pmo h ARG 400 Ca 0.01 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.88 1pmo h ARG 400 Cb 0.67 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.67 1pmo h ARG 400 CO 0.05 0.70 0.00 -0.07 -1.07 0.00 0.00 179.97 179.58 1pmo h LEU 401 N 0.52 0.00 -2.63 3.04 3.38 -1.14 0.11 115.31 118.60 1pmo h LEU 401 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1pmo h LEU 401 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1pmo h LEU 401 CO 0.04 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.11 1pmo n ARG 402 N -2.42 2.60 -0.17 1.13 5.12 -0.65 -4.96 116.66 117.32 1pmo n ARG 402 Ca 0.00 -2.32 0.00 0.00 -1.93 0.00 0.00 57.85 53.60 1pmo n ARG 402 Cb 0.15 -1.45 0.00 0.00 -1.16 0.00 0.00 32.46 30.00 1pmo n ARG 402 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1pmo n GLY 403 N 1.22 0.96 3.89 -0.13 0.00 0.39 -5.06 105.19 106.45 1pmo n GLY 403 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 1pmo n GLY 403 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1pmo s TRP 404 N -2.55 3.49 -0.41 1.61 0.52 -0.24 -4.71 118.94 116.65 1pmo s TRP 404 Ca 0.00 0.68 0.02 0.00 0.02 0.00 0.00 56.10 56.82 1pmo s TRP 404 Cb 0.00 -2.09 0.11 0.00 -1.15 0.00 0.00 33.47 30.34 1pmo s TRP 404 CO 0.00 0.42 0.14 -1.14 0.02 0.00 0.00 176.95 176.40 1pmo s GLN 405 N -2.50 1.74 -0.36 4.98 2.00 -0.66 -2.66 119.66 122.19 1pmo s GLN 405 Ca 0.40 -2.06 0.01 0.00 -2.00 0.00 0.00 55.36 51.71 1pmo s GLN 405 Cb -0.12 -3.33 0.10 0.00 0.80 0.00 0.00 33.01 30.45 1pmo s GLN 405 CO 0.22 -1.01 0.10 0.08 -0.50 0.00 0.00 175.29 174.18 1pmo s VAL 406 N 0.64 2.76 0.28 1.34 1.01 -1.26 -0.90 120.40 124.27 1pmo s VAL 406 Ca 0.12 -2.08 -0.30 0.00 0.00 0.00 0.00 61.98 59.72 1pmo s VAL 406 Cb -0.21 -2.89 -0.11 0.00 0.00 0.00 0.00 36.38 33.16 1pmo s VAL 406 CO -0.05 -0.55 1.59 -2.16 0.00 0.00 0.00 175.10 173.93 1pmo s PRO 407 N 1.05 4.13 -0.09 2.72 0.04 -1.26 -4.71 135.00 136.88 1pmo s PRO 407 Ca 0.07 2.56 0.03 0.00 0.04 0.00 0.00 61.00 63.71 1pmo s PRO 407 Cb -0.21 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.31 1pmo s PRO 407 CO -0.06 -0.63 -0.21 0.00 0.04 0.00 0.00 177.00 176.15 1pmo s ALA 408 N 0.07 1.91 0.31 8.56 0.00 -1.26 -2.26 121.76 129.10 1pmo s ALA 408 Ca 0.64 -0.81 -0.19 0.00 0.00 0.00 0.00 51.96 51.59 1pmo s ALA 408 Cb -0.48 -0.74 0.03 0.00 0.00 0.00 0.00 23.12 21.93 1pmo s ALA 408 CO 0.47 0.23 0.74 -0.59 0.00 0.00 0.00 175.76 176.61 1pmo s PHE 409 N 0.44 -0.09 0.13 0.00 -0.12 -0.33 -2.48 117.98 115.54 1pmo s PHE 409 Ca -0.18 -0.45 0.00 0.00 -0.05 0.00 0.00 56.93 56.26 1pmo s PHE 409 Cb -0.17 0.75 -0.04 0.00 -0.63 0.00 0.00 43.02 42.93 1pmo s PHE 409 CO 0.07 -1.35 0.29 0.95 -0.05 0.00 0.00 175.22 175.14 1pmo s THR 410 N -3.39 5.30 0.57 -4.49 -4.23 -1.26 -0.06 115.64 108.08 1pmo s THR 410 Ca 0.12 -0.42 -0.03 0.00 -1.18 0.00 0.00 61.69 60.18 1pmo s THR 410 Cb -0.06 -3.69 0.02 0.00 1.34 0.00 0.00 72.50 70.11 1pmo s THR 410 CO 0.08 -0.01 0.84 -0.76 -0.54 0.00 0.00 174.62 174.23 1pmo s LEU 411 N -2.93 3.27 0.00 4.79 1.43 -0.25 -4.94 118.68 120.05 1pmo s LEU 411 Ca 0.36 0.45 0.00 0.00 -1.03 0.00 0.00 54.13 53.92 1pmo s LEU 411 Cb -0.12 -3.27 0.00 0.00 0.03 0.00 0.00 46.19 42.83 1pmo s LEU 411 CO 0.28 -1.07 0.00 0.61 0.23 0.00 0.00 176.35 176.40 1pmo n GLY 412 N -2.48 0.44 7.00 -3.19 0.00 -1.26 -2.50 105.19 103.20 1pmo n GLY 412 Ca 0.05 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.21 1pmo n GLY 412 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pmo n GLY 413 N 5.00 3.22 0.78 -0.02 0.00 -1.26 -0.78 105.19 112.13 1pmo n GLY 413 Ca 0.00 -0.21 0.11 0.00 0.00 0.00 0.00 46.02 45.92 1pmo n GLY 413 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1pmo n GLU 414 N 13.85 2.03 -0.31 1.61 2.13 -0.94 -3.44 120.64 135.57 1pmo n GLU 414 Ca 0.00 -1.54 0.06 0.00 0.66 0.00 0.00 57.16 56.34 1pmo n GLU 414 Cb 0.00 -1.44 0.20 0.00 0.27 0.00 0.00 31.44 30.47 1pmo n GLU 414 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1pmo n ALA 415 N 0.78 2.70 0.34 4.31 0.00 0.04 -4.05 120.51 124.62 1pmo n ALA 415 Ca 0.17 -0.86 0.22 0.00 0.00 0.00 0.00 53.44 52.98 1pmo n ALA 415 Cb 0.44 -1.00 1.20 0.00 0.00 0.00 0.00 19.45 20.09 1pmo n ALA 415 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1pmo h THR 416 N 2.45 0.01 -0.54 0.00 2.02 -1.32 0.61 112.91 116.14 1pmo h THR 416 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1pmo h THR 416 Cb 0.81 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 68.20 1pmo h THR 416 CO 0.09 0.00 0.00 -0.67 0.37 0.00 0.00 175.52 175.31 1pmo n ASP 417 N -3.09 3.18 -4.36 4.18 2.03 -1.26 -4.61 116.55 112.62 1pmo n ASP 417 Ca -0.03 -2.10 -0.40 0.00 0.52 0.00 0.00 54.79 52.78 1pmo n ASP 417 Cb 0.09 -0.41 -0.11 0.00 -0.72 0.00 0.00 41.12 39.97 1pmo n ASP 417 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1pmo s ILE 418 N -1.41 4.47 -0.23 5.18 -1.09 0.21 -5.02 121.20 123.30 1pmo s ILE 418 Ca 0.37 -0.88 -0.14 0.00 -2.23 0.00 0.00 60.65 57.77 1pmo s ILE 418 Cb 0.21 -3.49 -0.04 0.00 -1.58 0.00 0.00 42.46 37.56 1pmo s ILE 418 CO 0.23 -0.22 0.32 -0.69 -1.23 0.00 0.00 174.94 173.36 1pmo s VAL 419 N 1.54 5.23 0.28 2.92 1.01 -1.26 -1.09 120.40 129.03 1pmo s VAL 419 Ca 0.02 0.52 0.09 0.00 0.00 0.00 0.00 61.98 62.60 1pmo s VAL 419 Cb -0.19 -3.66 -0.06 0.00 0.00 0.00 0.00 36.38 32.48 1pmo s VAL 419 CO 0.06 0.25 -0.12 0.68 0.00 0.00 0.00 175.10 175.97 1pmo s VAL 420 N 1.50 2.03 -0.08 2.92 -7.23 0.92 -4.37 120.40 116.08 1pmo s VAL 420 Ca 0.15 -2.24 0.04 0.00 -1.81 0.00 0.00 61.98 58.12 1pmo s VAL 420 Cb -0.15 -2.38 -0.00 0.00 0.56 0.00 0.00 36.38 34.41 1pmo s VAL 420 CO 0.08 -0.36 -0.22 -0.32 -0.31 0.00 0.00 175.10 173.97 1pmo s MET 421 N -3.63 2.66 -0.08 4.82 1.75 -0.21 -1.18 119.30 123.43 1pmo s MET 421 Ca 0.29 -0.79 0.04 0.00 -1.25 0.00 0.00 55.69 53.98 1pmo s MET 421 Cb 0.00 -2.08 -0.00 0.00 2.84 0.00 0.00 34.83 35.59 1pmo s MET 421 CO 0.13 0.20 -0.23 0.50 -0.65 0.00 0.00 175.02 174.97 1pmo s ARG 422 N 0.27 2.68 -0.15 4.11 3.52 -0.96 -2.02 118.95 126.41 1pmo s ARG 422 Ca -0.14 -0.82 0.02 0.00 -0.13 0.00 0.00 55.73 54.65 1pmo s ARG 422 Cb -0.16 -2.12 0.01 0.00 -1.56 0.00 0.00 34.95 31.11 1pmo s ARG 422 CO 0.07 0.23 -0.19 0.42 -0.81 0.00 0.00 175.30 175.01 1pmo s ILE 423 N 0.21 2.30 -0.17 4.11 1.01 0.14 -4.10 121.20 124.69 1pmo s ILE 423 Ca -0.13 -0.90 -0.07 0.00 0.00 0.00 0.00 60.65 59.55 1pmo s ILE 423 Cb -0.16 -1.94 -0.04 0.00 0.01 0.00 0.00 42.46 40.33 1pmo s ILE 423 CO 0.06 0.54 0.06 -0.04 0.00 0.00 0.00 174.94 175.56 1pmo s MET 424 N 0.81 3.90 -0.41 2.79 -1.94 -0.36 -0.84 119.30 123.25 1pmo s MET 424 Ca -0.06 -0.35 -0.05 0.00 -1.71 0.00 0.00 55.69 53.52 1pmo s MET 424 Cb -0.15 -3.18 0.10 0.00 2.01 0.00 0.00 34.83 33.61 1pmo s MET 424 CO -0.01 0.31 0.21 0.00 -0.01 0.00 0.00 175.02 175.52 1pmo s ARG 426 N 1.24 2.30 0.10 0.00 1.70 -1.26 -4.75 118.95 118.28 1pmo s ARG 426 Ca 0.05 -1.81 -0.35 0.00 -0.47 0.00 0.00 55.73 53.15 1pmo s ARG 426 Cb -0.23 -2.07 -0.15 0.00 -0.57 0.00 0.00 34.95 31.92 1pmo s ARG 426 CO -0.02 -0.19 1.48 -2.13 -1.08 0.00 0.00 175.30 173.35 1pmo n ARG 427 N -1.36 1.63 0.00 3.89 0.63 -1.26 -1.84 116.66 118.35 1pmo n ARG 427 Ca -0.01 0.59 0.00 0.00 -0.92 0.00 0.00 57.85 57.51 1pmo n ARG 427 Cb 0.64 -2.30 0.00 0.00 0.45 0.00 0.00 32.46 31.25 1pmo n ARG 427 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1pmo n GLY 428 N 3.03 1.65 3.32 5.14 0.00 -1.26 -4.38 105.19 112.69 1pmo n GLY 428 Ca 0.18 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 1pmo n GLY 428 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1pmo n PHE 429 N 0.00 4.39 -1.72 1.61 7.35 -0.76 -4.98 117.46 123.35 1pmo n PHE 429 Ca 0.00 -3.10 -0.29 0.00 -0.76 0.00 0.00 57.45 53.31 1pmo n PHE 429 Cb 0.00 -2.28 0.11 0.00 0.35 0.00 0.00 39.48 37.66 1pmo n PHE 429 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1pmo s GLU 430 N 2.11 1.57 0.35 -4.13 0.41 -1.26 -4.81 118.70 112.94 1pmo s GLU 430 Ca 0.45 0.21 0.12 0.00 -0.41 0.00 0.00 54.97 55.33 1pmo s GLU 430 Cb 0.03 -1.90 0.91 0.00 -1.78 0.00 0.00 34.13 31.39 1pmo s GLU 430 CO 0.01 -1.89 1.78 1.98 -0.49 0.00 0.00 175.26 176.66 1pmo h MET 431 N -1.27 0.57 -0.57 1.61 4.05 -1.93 -0.19 114.93 117.19 1pmo h MET 431 Ca -0.48 -0.03 -0.04 0.00 -0.28 0.00 0.00 59.70 58.87 1pmo h MET 431 Cb 1.33 -0.13 -0.03 0.00 -0.80 0.00 0.00 31.60 31.98 1pmo h MET 431 CO 0.64 0.38 0.20 -0.44 0.23 0.00 0.00 176.91 177.91 1pmo h ASP 432 N 0.58 0.78 0.12 1.39 3.32 -1.99 -1.73 116.42 118.89 1pmo h ASP 432 Ca 0.57 -0.11 -0.18 0.00 0.02 0.00 0.00 57.03 57.33 1pmo h ASP 432 Cb 1.15 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 40.49 1pmo h ASP 432 CO -0.34 0.72 -0.65 -0.26 -1.72 0.00 0.00 179.24 177.00 1pmo h PHE 433 N 0.83 0.66 -0.40 4.55 0.04 -1.41 -2.73 116.94 118.47 1pmo h PHE 433 Ca 0.19 -0.26 -0.05 0.00 2.80 0.00 0.00 57.97 60.65 1pmo h PHE 433 Cb 0.21 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 38.23 1pmo h PHE 433 CO 0.01 1.01 0.05 0.00 -0.60 0.00 0.00 178.31 178.79 1pmo h ALA 434 N 0.92 1.34 -0.36 2.45 0.00 -0.88 -0.62 119.26 122.12 1pmo h ALA 434 Ca -0.01 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.60 1pmo h ALA 434 Cb 1.21 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1pmo h ALA 434 CO 0.12 0.46 -0.22 1.49 0.00 0.00 0.00 179.25 181.10 1pmo h GLU 435 N 0.59 0.69 -0.59 0.00 4.57 -1.17 -1.01 114.58 117.65 1pmo h GLU 435 Ca 0.13 -0.27 -0.10 0.00 -1.18 0.00 0.00 59.36 57.95 1pmo h GLU 435 Cb 0.30 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.83 1pmo h GLU 435 CO 0.00 0.85 -0.00 1.25 -1.18 0.00 0.00 179.01 179.93 1pmo h LEU 436 N 0.61 1.03 -0.43 1.64 5.85 -1.07 -1.65 115.31 121.28 1pmo h LEU 436 Ca 0.09 -0.31 0.01 0.00 0.84 0.00 0.00 57.88 58.51 1pmo h LEU 436 Cb 0.70 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 1pmo h LEU 436 CO 0.05 1.08 0.28 0.25 -0.34 0.00 0.00 178.44 179.76 1pmo h LEU 437 N 0.94 0.47 -1.22 2.25 6.46 -0.72 -1.36 115.31 122.13 1pmo h LEU 437 Ca 0.17 -0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.90 1pmo h LEU 437 Cb 0.56 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 40.35 1pmo h LEU 437 CO 0.03 0.34 0.30 -0.07 -0.62 0.00 0.00 178.44 178.42 1pmo h LEU 438 N 0.56 0.76 -0.09 2.25 3.38 -0.89 0.30 115.31 121.58 1pmo h LEU 438 Ca 0.16 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 1pmo h LEU 438 Cb -0.04 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 1pmo h LEU 438 CO -0.05 0.63 0.04 -0.33 0.09 0.00 0.00 178.44 178.82 1pmo h GLU 439 N 0.85 0.13 0.00 1.13 5.08 -0.65 -0.98 114.58 120.13 1pmo h GLU 439 Ca 0.21 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.48 1pmo h GLU 439 Cb 0.07 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1pmo h GLU 439 CO -0.03 0.24 -0.32 -0.44 -1.00 0.00 0.00 179.01 177.46 1pmo h ASP 440 N -0.01 0.00 -0.14 1.42 3.32 -0.82 -1.05 116.42 119.14 1pmo h ASP 440 Ca 0.03 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 1pmo h ASP 440 Cb 0.16 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.71 1pmo h ASP 440 CO -0.00 0.32 -0.01 0.22 -1.72 0.00 0.00 179.24 178.05 1pmo h TYR 441 N 0.00 0.28 -0.62 4.55 5.03 -0.04 -0.88 116.97 125.29 1pmo h TYR 441 Ca -0.00 -0.05 -0.06 0.00 2.58 0.00 0.00 58.73 61.19 1pmo h TYR 441 Cb 0.65 -0.07 -0.03 0.00 1.55 0.00 0.00 36.73 38.83 1pmo h TYR 441 CO 0.00 0.50 0.14 0.87 -1.32 0.00 0.00 178.16 178.35 1pmo h LYS 442 N -0.02 1.00 -0.93 1.82 1.57 -0.89 -1.82 116.57 117.31 1pmo h LYS 442 Ca 0.04 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.57 1pmo h LYS 442 Cb 0.39 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 1pmo h LYS 442 CO 0.01 0.91 0.56 0.00 -0.57 0.00 0.00 179.45 180.36 1pmo h ALA 443 N 1.04 1.18 -0.76 3.86 0.00 -1.10 -1.71 119.26 121.77 1pmo h ALA 443 Ca 0.19 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1pmo h ALA 443 Cb 0.37 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1pmo h ALA 443 CO 0.00 0.64 0.25 0.77 0.00 0.00 0.00 179.25 180.91 1pmo h SER 444 N 1.28 1.10 -0.64 0.00 0.02 -0.79 -1.57 113.55 112.95 1pmo h SER 444 Ca 0.33 -0.20 -0.04 0.00 -0.84 0.00 0.00 61.79 61.04 1pmo h SER 444 Cb -0.06 -0.29 -0.03 0.00 0.14 0.00 0.00 62.40 62.17 1pmo h SER 444 CO -0.06 1.01 0.23 -0.07 -1.14 0.00 0.00 176.83 176.80 1pmo h LEU 445 N 1.13 0.90 -0.61 5.07 3.38 -0.71 -0.97 115.31 123.51 1pmo h LEU 445 Ca 0.25 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 1pmo h LEU 445 Cb 0.29 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1pmo h LEU 445 CO -0.01 0.84 0.05 0.50 0.09 0.00 0.00 178.44 179.91 1pmo h LYS 446 N 0.91 1.05 -0.35 1.13 3.64 -1.11 -0.94 116.57 120.89 1pmo h LYS 446 Ca 0.21 -0.31 -0.02 0.00 -1.27 0.00 0.00 60.65 59.26 1pmo h LYS 446 Cb 0.24 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1pmo h LYS 446 CO -0.01 1.00 0.13 -0.92 -2.27 0.00 0.00 179.45 177.39 1pmo h TYR 447 N 0.95 0.55 -0.39 1.91 3.20 -1.00 -0.40 116.97 121.78 1pmo h TYR 447 Ca 0.18 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.97 1pmo h TYR 447 Cb 0.50 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 1pmo h TYR 447 CO 0.04 0.51 0.11 -0.07 -1.64 0.00 0.00 178.16 177.11 1pmo h LEU 448 N 0.42 0.52 -0.54 2.82 3.38 -1.01 -0.33 115.31 120.57 1pmo h LEU 448 Ca 0.12 -0.07 -0.15 0.00 0.09 0.00 0.00 57.88 57.87 1pmo h LEU 448 Cb 0.20 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1pmo h LEU 448 CO -0.01 0.51 -0.46 -1.28 0.09 0.00 0.00 178.44 177.29 1pmo h SER 449 N 0.57 0.71 1.41 -0.43 0.87 -0.71 -3.02 113.55 112.94 1pmo h SER 449 Ca 0.13 -0.34 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 1pmo h SER 449 Cb 0.19 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 61.95 1pmo h SER 449 CO -0.01 1.06 -0.03 0.47 -0.53 0.00 0.00 176.83 177.79 1pmo n ASP 450 N -4.01 0.75 -3.25 6.23 8.00 -0.20 -4.21 116.55 119.85 1pmo n ASP 450 Ca -0.02 0.54 -0.25 0.00 0.71 0.00 0.00 54.79 55.77 1pmo n ASP 450 Cb 0.56 -0.72 -0.07 0.00 -0.02 0.00 0.00 41.12 40.87 1pmo n ASP 450 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1pmo n HIS 451 N -2.19 1.27 -0.22 1.24 8.25 -0.19 -4.97 115.22 118.40 1pmo n HIS 451 Ca 0.06 -3.81 0.30 0.00 -0.26 0.00 0.00 57.72 54.01 1pmo n HIS 451 Cb 0.42 -0.43 0.72 0.00 1.12 0.00 0.00 29.99 31.82 1pmo n HIS 451 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1pmo h PRO 452 N 3.92 0.02 0.00 -0.41 0.11 -1.72 -2.01 132.00 131.91 1pmo h PRO 452 Ca 0.12 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 1pmo h PRO 452 Cb 0.79 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.90 1pmo h PRO 452 CO 0.61 0.01 0.00 1.63 -0.21 0.00 0.00 178.00 180.04 1pmo n LYS 453 N -4.26 0.13 0.13 1.05 5.02 -1.26 -2.16 118.16 116.83 1pmo n LYS 453 Ca 0.20 0.58 -0.01 0.00 -2.02 0.00 0.00 58.31 57.07 1pmo n LYS 453 Cb 1.03 -1.90 0.23 0.00 -0.02 0.00 0.00 35.03 34.37 1pmo n LYS 453 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1pmo h LEU 454 N 0.00 0.09 -9.44 -0.35 3.38 -1.70 -3.45 115.31 103.83 1pmo h LEU 454 Ca 0.00 -0.04 -0.61 0.00 0.09 0.00 0.00 57.88 57.31 1pmo h LEU 454 Cb 0.07 -0.03 0.06 0.00 0.09 0.00 0.00 40.66 40.85 1pmo h LEU 454 CO 0.00 0.58 0.67 1.67 0.09 0.00 0.00 178.44 181.45 1pmo n GLN 455 N -3.94 1.83 -0.08 1.13 7.27 -0.92 -2.39 117.38 120.28 1pmo n GLN 455 Ca -0.02 0.66 0.00 0.00 0.07 0.00 0.00 57.00 57.71 1pmo n GLN 455 Cb 0.53 -2.37 0.00 0.00 2.41 0.00 0.00 30.24 30.80 1pmo n GLN 455 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1pmo n GLY 456 N 3.01 2.13 0.07 1.69 0.00 -1.26 -4.94 105.19 105.90 1pmo n GLY 456 Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 1pmo n GLY 456 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1pmo h ILE 457 N 0.00 1.30 -3.35 -0.61 2.04 -1.78 -3.43 117.51 111.67 1pmo h ILE 457 Ca 0.00 -1.15 -0.52 0.00 1.00 0.00 0.00 64.86 64.19 1pmo h ILE 457 Cb 0.00 2.06 0.02 0.00 -0.74 0.00 0.00 36.82 38.16 1pmo h ILE 457 CO 0.00 0.29 0.61 0.00 0.00 0.00 0.00 178.15 179.05 1pmo s ALA 458 N -4.17 3.48 0.00 1.87 0.00 -1.26 -4.92 121.76 116.76 1pmo s ALA 458 Ca -0.16 1.01 0.08 0.00 0.00 0.00 0.00 51.96 52.90 1pmo s ALA 458 Cb 0.01 -3.46 0.14 0.00 0.00 0.00 0.00 23.12 19.81 1pmo s ALA 458 CO 0.65 -0.47 1.02 0.00 0.00 0.00 0.00 175.76 176.96 1pmo n GLN 459 N 2.92 0.00 -4.51 0.00 10.64 -1.26 -4.61 117.38 120.56 1pmo n GLN 459 Ca 0.06 -1.25 -0.33 0.00 -1.83 0.00 0.00 57.00 53.65 1pmo n GLN 459 Cb 0.44 0.27 -0.13 0.00 -0.86 0.00 0.00 30.24 29.95 1pmo n GLN 459 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.06 174.09 1pmo s GLN 460 N 0.00 3.52 0.47 2.61 2.00 -1.26 -5.10 119.66 121.89 1pmo s GLN 460 Ca 0.11 -0.60 -0.22 0.00 -2.00 0.00 0.00 55.36 52.64 1pmo s GLN 460 Cb 0.12 -2.81 -0.07 0.00 0.80 0.00 0.00 33.01 31.06 1pmo s GLN 460 CO -0.05 0.18 1.14 -0.80 -0.50 0.00 0.00 175.29 175.26 1pmo s ASN 461 N 0.48 6.16 0.52 6.67 0.01 -1.26 -4.94 114.94 122.58 1pmo s ASN 461 Ca -0.06 2.25 -0.03 0.00 -0.71 0.00 0.00 52.86 54.31 1pmo s ASN 461 Cb -0.15 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 38.92 1pmo s ASN 461 CO 0.04 -0.92 0.79 -0.44 -1.51 0.00 0.00 177.10 175.06 1pmo s SER 462 N -1.47 5.72 0.17 -1.22 0.01 -1.03 -5.01 113.70 110.87 1pmo s SER 462 Ca 0.65 0.51 -0.32 0.00 1.31 0.00 0.00 55.95 58.10 1pmo s SER 462 Cb -0.27 -1.63 -0.11 0.00 0.21 0.00 0.00 66.02 64.22 1pmo s SER 462 CO 0.32 -0.88 1.79 0.12 0.41 0.00 0.00 173.24 175.00 1pmo s PHE 463 N -2.78 2.51 0.00 2.43 5.36 -1.26 -4.87 117.98 119.36 1pmo s PHE 463 Ca 0.51 0.14 0.00 0.00 -0.96 0.00 0.00 56.93 56.62 1pmo s PHE 463 Cb -0.10 -4.17 0.00 0.00 -0.34 0.00 0.00 43.02 38.40 1pmo s PHE 463 CO 0.42 -4.66 0.23 0.36 -1.46 0.00 0.00 175.22 170.10 1pmo n LYS 464 N 4.85 1.62 0.09 10.12 2.85 -1.26 -4.78 118.16 131.64 1pmo n LYS 464 Ca 0.17 -0.23 0.12 0.00 -1.05 0.00 0.00 58.31 57.32 1pmo n LYS 464 Cb 0.36 -0.68 0.45 0.00 -0.65 0.00 0.00 35.03 34.52 1pmo n LYS 464 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1pmo n HIS 465 N -0.30 0.62 0.00 5.58 8.25 -1.26 -4.73 115.22 123.39 1pmo n HIS 465 Ca 0.00 0.21 0.00 0.00 -0.26 0.00 0.00 57.72 57.67 1pmo n HIS 465 Cb 0.04 -0.85 0.00 0.00 1.12 0.00 0.00 29.99 30.30 1pmo n HIS 465 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61