#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pmo s LEU 13 N 0.00 4.45 0.33 -4.62 1.02 -1.26 -4.95 118.68 113.65 1pmo s LEU 13 Ca 0.00 2.39 0.09 0.00 0.02 0.00 0.00 54.13 56.63 1pmo s LEU 13 Cb 0.00 -3.62 -0.05 0.00 0.02 0.00 0.00 46.19 42.54 1pmo s LEU 13 CO 0.00 -0.42 0.05 -0.76 0.02 0.00 0.00 176.35 175.24 1pmo s LEU 14 N -0.71 3.08 -0.13 1.79 1.43 -1.26 0.15 118.68 123.04 1pmo s LEU 14 Ca 0.52 -0.90 -0.00 0.00 -1.03 0.00 0.00 54.13 52.71 1pmo s LEU 14 Cb -0.35 -1.49 -0.02 0.00 0.03 0.00 0.00 46.19 44.36 1pmo s LEU 14 CO 0.41 -0.24 -0.11 -0.62 0.23 0.00 0.00 176.35 176.02 1pmo s ASP 15 N -3.75 4.16 0.48 2.29 -1.08 0.51 -4.48 116.67 114.80 1pmo s ASP 15 Ca 0.35 -0.27 0.30 0.00 -0.52 0.00 0.00 52.55 52.41 1pmo s ASP 15 Cb -0.01 -1.57 1.04 0.00 -1.46 0.00 0.00 42.92 40.91 1pmo s ASP 15 CO 0.20 0.19 1.85 0.77 0.52 0.00 0.00 175.17 178.70 1pmo h SER 16 N 6.56 0.00 0.04 -0.34 4.64 -1.98 0.10 113.55 122.56 1pmo h SER 16 Ca -0.29 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 60.83 1pmo h SER 16 Cb 1.20 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.31 1pmo h SER 16 CO 0.56 0.00 -0.81 0.03 -0.87 0.00 0.00 176.83 175.74 1pmo h ARG 17 N 0.00 0.48 -0.01 4.77 3.08 -1.96 -3.35 114.38 117.39 1pmo h ARG 17 Ca 0.00 -0.57 0.00 0.00 0.07 0.00 0.00 59.98 59.48 1pmo h ARG 17 Cb 0.64 0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.86 1pmo h ARG 17 CO 0.00 1.21 -0.52 1.19 -1.07 0.00 0.00 179.97 180.78 1pmo n PHE 18 N -4.07 0.00 -3.76 3.04 3.72 -1.22 -4.98 117.46 110.19 1pmo n PHE 18 Ca -0.12 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.05 1pmo n PHE 18 Cb 0.78 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.34 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 1.31 -0.41 3.69 1.37 0.00 0.02 -4.96 105.19 106.21 1pmo n GLY 19 Ca 0.07 0.20 -0.10 0.00 0.00 0.00 0.00 46.02 46.19 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 -3.72 -0.41 0.21 4.61 0.00 -1.21 -4.95 121.76 116.29 1pmo s ALA 20 Ca 0.09 -0.84 -0.31 0.00 0.00 0.00 0.00 51.96 50.90 1pmo s ALA 20 Cb -0.03 0.92 -0.15 0.00 0.00 0.00 0.00 23.12 23.86 1pmo s ALA 20 CO 0.84 -0.92 1.09 1.17 0.00 0.00 0.00 175.76 177.94 1pmo n LYS 21 N -0.48 1.17 -2.05 0.00 4.81 -1.26 -0.36 118.16 119.98 1pmo n LYS 21 Ca -0.04 0.41 -0.40 0.00 -0.87 0.00 0.00 58.31 57.41 1pmo n LYS 21 Cb 0.61 -1.86 -0.01 0.00 0.02 0.00 0.00 35.03 33.79 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 -0.20 6.61 -0.30 3.14 0.15 0.12 -4.53 113.70 118.69 1pmo s SER 22 Ca 0.69 2.74 0.02 0.00 0.70 0.00 0.00 55.95 60.10 1pmo s SER 22 Cb -0.81 -2.65 0.08 0.00 -1.71 0.00 0.00 66.02 60.93 1pmo s SER 22 CO 0.54 -0.65 0.00 -0.63 1.20 0.00 0.00 173.24 173.70 1pmo s ILE 23 N -1.16 1.87 -0.04 6.45 1.01 -1.26 -4.98 121.20 123.10 1pmo s ILE 23 Ca 0.51 -1.82 -0.17 0.00 0.00 0.00 0.00 60.65 59.18 1pmo s ILE 23 Cb -0.41 -2.25 -0.05 0.00 0.01 0.00 0.00 42.46 39.76 1pmo s ILE 23 CO 0.54 -0.39 0.46 -0.55 0.00 0.00 0.00 174.94 175.00 1pmo s SER 24 N 1.16 6.80 0.12 3.58 0.15 -1.26 -4.97 113.70 119.27 1pmo s SER 24 Ca 0.03 0.95 0.23 0.00 0.70 0.00 0.00 55.95 57.86 1pmo s SER 24 Cb -0.19 -2.28 0.08 0.00 -1.71 0.00 0.00 66.02 61.92 1pmo s SER 24 CO -0.10 0.19 1.07 0.35 1.20 0.00 0.00 173.24 175.95 1pmo n THR 25 N 2.56 0.37 0.09 6.45 -2.24 -1.26 -3.95 114.28 116.29 1pmo n THR 25 Ca -0.11 -0.38 -0.15 0.00 -2.27 0.00 0.00 64.05 61.15 1pmo n THR 25 Cb 0.52 -0.09 -0.14 0.00 -2.10 0.00 0.00 70.33 68.52 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 1.46 -3.38 2.28 1.08 -1.97 -3.36 117.51 113.62 1pmo h ILE 26 Ca 0.00 -3.06 -0.55 0.00 -0.39 0.00 0.00 64.86 60.86 1pmo h ILE 26 Cb 0.85 2.89 -0.03 0.00 -3.07 0.00 0.00 36.82 37.46 1pmo h ILE 26 CO 0.00 0.88 0.38 0.00 -0.69 0.00 0.00 178.15 178.72 1pmo s ALA 27 N -2.66 3.22 -1.13 1.87 0.00 -1.25 -3.35 121.76 118.47 1pmo s ALA 27 Ca -0.04 0.47 -0.01 0.00 0.00 0.00 0.00 51.96 52.38 1pmo s ALA 27 Cb 0.07 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.87 1pmo s ALA 27 CO 0.87 -0.29 0.94 -1.91 0.00 0.00 0.00 175.76 175.37 1pmo n GLU 28 N 4.09 -6.25 -0.09 0.00 2.13 -1.26 -4.86 120.64 114.40 1pmo n GLU 28 Ca 0.06 0.79 0.10 0.00 0.66 0.00 0.00 57.16 58.76 1pmo n GLU 28 Cb 0.51 -5.64 0.14 0.00 0.27 0.00 0.00 31.44 26.72 1pmo n GLU 28 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1pmo n SER 29 N -2.96 2.91 0.00 4.31 3.41 -1.21 -4.14 113.62 115.94 1pmo n SER 29 Ca -0.25 -1.86 0.00 0.00 -0.26 0.00 0.00 58.87 56.50 1pmo n SER 29 Cb 0.65 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 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 1.14 0.84 -4.63 4.33 5.02 -1.26 -4.99 118.16 118.61 1pmo n LYS 30 Ca 0.14 -0.88 -0.24 0.00 -2.02 0.00 0.00 58.31 55.31 1pmo n LYS 30 Cb 0.50 -0.92 -0.16 0.00 -0.02 0.00 0.00 35.03 34.44 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 -0.42 1.51 0.15 1.97 0.52 -1.26 -5.11 118.95 116.32 1pmo s ARG 31 Ca 0.00 -0.46 -0.34 0.00 -0.52 0.00 0.00 55.73 54.42 1pmo s ARG 31 Cb 0.00 -1.31 -0.13 0.00 0.52 0.00 0.00 34.95 34.02 1pmo s ARG 31 CO 0.00 0.14 1.63 0.34 0.02 0.00 0.00 175.30 177.42 1pmo n PHE 32 N 3.39 2.34 -1.59 -0.53 -0.00 -1.26 -4.86 117.46 114.95 1pmo n PHE 32 Ca -0.20 0.21 -0.44 0.00 -0.00 0.00 0.00 57.45 57.03 1pmo n PHE 32 Cb 0.53 -2.57 -0.01 0.00 -0.00 0.00 0.00 39.48 37.43 1pmo n PHE 32 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 1pmo n PRO 33 N 3.80 1.34 -0.08 -7.13 -0.02 -1.26 -4.95 135.00 126.69 1pmo n PRO 33 Ca 0.17 0.47 -0.23 0.00 -2.02 0.00 0.00 63.50 61.90 1pmo n PRO 33 Cb 0.30 -1.88 -0.12 0.00 -0.02 0.00 0.00 33.50 31.78 1pmo n PRO 33 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1pmo n LEU 34 N 1.08 2.12 -5.00 2.45 7.94 -1.26 -4.99 117.00 119.34 1pmo n LEU 34 Ca 0.09 0.34 -0.18 0.00 -1.11 0.00 0.00 56.01 55.15 1pmo n LEU 34 Cb 0.34 -0.99 0.01 0.00 0.53 0.00 0.00 43.42 43.31 1pmo n LEU 34 CO 0.59 0.49 0.15 -1.00 -1.11 0.00 0.00 177.39 176.51 1pmo s HIS 35 N -2.44 2.64 0.45 1.96 3.76 -1.26 -5.13 115.29 115.27 1pmo s HIS 35 Ca -0.28 -0.45 0.08 0.00 -0.15 0.00 0.00 55.06 54.26 1pmo s HIS 35 Cb 0.07 -2.33 0.02 0.00 1.11 0.00 0.00 32.58 31.44 1pmo s HIS 35 CO 0.63 -0.47 0.55 -1.83 -0.85 0.00 0.00 174.74 172.77 1pmo s GLU 36 N -4.36 2.65 0.12 1.40 -1.05 -1.26 -5.13 118.70 111.07 1pmo s GLU 36 Ca 0.55 -1.41 -0.12 0.00 -0.15 0.00 0.00 54.97 53.84 1pmo s GLU 36 Cb -0.09 -2.62 0.01 0.00 -0.44 0.00 0.00 34.13 30.99 1pmo s GLU 36 CO 0.33 -0.36 0.31 0.00 0.95 0.00 0.00 175.26 176.49 1pmo s MET 37 N -4.35 1.02 0.18 -4.83 0.23 -1.26 -5.13 119.30 105.17 1pmo s MET 37 Ca 0.54 -0.88 -0.33 0.00 -1.03 0.00 0.00 55.69 53.98 1pmo s MET 37 Cb -0.07 0.41 -0.15 0.00 -1.53 0.00 0.00 34.83 33.48 1pmo s MET 37 CO 0.32 -0.38 1.22 0.54 -2.03 0.00 0.00 175.02 174.70 1pmo n ARG 38 N -0.17 1.31 -0.21 3.16 1.74 -1.26 -4.81 116.66 116.42 1pmo n ARG 38 Ca -0.14 0.47 -0.06 0.00 -0.77 0.00 0.00 57.85 57.35 1pmo n ARG 38 Cb 0.63 -2.00 0.04 0.00 -1.02 0.00 0.00 32.46 30.10 1pmo n ARG 38 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1pmo h ASP 39 N 3.62 0.70 0.63 0.55 3.32 -2.00 -0.49 116.42 122.75 1pmo h ASP 39 Ca -0.44 -0.04 -0.03 0.00 0.02 0.00 0.00 57.03 56.55 1pmo h ASP 39 Cb 1.33 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 40.70 1pmo h ASP 39 CO 0.72 0.53 -0.12 0.44 -1.72 0.00 0.00 179.24 179.08 1pmo h ASP 40 N 0.81 0.00 0.08 6.45 3.32 -1.99 0.22 116.42 125.30 1pmo h ASP 40 Ca 0.22 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 57.04 1pmo h ASP 40 Cb -0.06 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.51 1pmo h ASP 40 CO -0.04 0.12 -0.93 0.58 -1.72 0.00 0.00 179.24 177.25 1pmo h VAL 41 N 0.00 1.38 -0.84 -1.35 2.07 -1.68 -1.92 116.25 113.91 1pmo h VAL 41 Ca -0.00 -2.34 -0.01 0.00 0.82 0.00 0.00 66.70 65.16 1pmo h VAL 41 Cb 0.47 2.77 -0.04 0.00 -1.52 0.00 0.00 31.29 32.97 1pmo h VAL 41 CO 0.02 0.69 0.47 0.00 0.02 0.00 0.00 177.57 178.77 1pmo h ALA 42 N 0.25 1.07 0.01 1.67 0.00 -0.65 -0.39 119.26 121.23 1pmo h ALA 42 Ca -0.14 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 1pmo h ALA 42 Cb 1.65 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1pmo h ALA 42 CO 0.18 0.57 -0.01 0.35 0.00 0.00 0.00 179.25 180.34 1pmo h PHE 43 N 1.16 -0.02 -0.56 0.00 3.57 -0.98 -1.98 116.94 118.14 1pmo h PHE 43 Ca 0.30 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.77 1pmo h PHE 43 Cb 0.01 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 1pmo h PHE 43 CO 0.00 0.18 0.23 1.96 -2.23 0.00 0.00 178.31 178.45 1pmo h GLN 44 N -0.21 0.80 -0.41 1.11 4.20 -1.11 0.31 115.11 119.80 1pmo h GLN 44 Ca -0.00 -0.12 -0.03 0.00 0.06 0.00 0.00 58.65 58.56 1pmo h GLN 44 Cb 0.20 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 1pmo h GLN 44 CO 0.00 0.65 0.13 0.82 -0.67 0.00 0.00 178.83 179.76 1pmo h ILE 45 N 0.79 1.22 -0.25 2.54 2.04 -0.93 0.30 117.51 123.22 1pmo h ILE 45 Ca 0.19 -0.72 -0.15 0.00 1.00 0.00 0.00 64.86 65.19 1pmo h ILE 45 Cb 0.14 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 1pmo h ILE 45 CO -0.02 0.25 -0.42 0.40 0.00 0.00 0.00 178.15 178.36 1pmo h ILE 46 N 0.52 1.30 -0.66 -0.67 2.04 -0.98 -2.83 117.51 116.24 1pmo h ILE 46 Ca 0.13 -1.62 0.06 0.00 1.00 0.00 0.00 64.86 64.43 1pmo h ILE 46 Cb 0.26 1.73 -0.06 0.00 -0.74 0.00 0.00 36.82 38.01 1pmo h ILE 46 CO -0.00 0.51 0.35 -1.13 0.00 0.00 0.00 178.15 177.89 1pmo h ASN 47 N 0.45 0.51 -0.29 1.72 -1.24 -0.23 -2.03 115.58 114.47 1pmo h ASN 47 Ca 0.02 0.03 -0.09 0.00 0.71 0.00 0.00 56.30 56.98 1pmo h ASN 47 Cb 1.02 -0.06 -0.02 0.00 0.73 0.00 0.00 38.32 39.98 1pmo h ASN 47 CO 0.10 0.33 -0.11 0.44 -1.29 0.00 0.00 177.43 176.90 1pmo h ASP 48 N 0.65 0.69 1.53 1.15 3.32 -0.86 -2.83 116.42 120.07 1pmo h ASP 48 Ca 0.30 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1pmo h ASP 48 Cb 0.21 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1pmo h ASP 48 CO -0.19 0.83 -0.07 1.05 -1.72 0.00 0.00 179.24 179.14 1pmo h GLU 49 N 0.64 0.00 0.00 3.56 4.11 -1.22 -3.00 114.58 118.67 1pmo h GLU 49 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.54 1pmo h GLU 49 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1pmo h GLU 49 CO 0.03 0.00 0.00 -0.07 0.07 0.00 0.00 179.01 179.04 1pmo h LEU 50 N 0.00 0.00 -0.98 3.06 3.38 -1.11 -0.72 115.31 118.94 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 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 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 -1.73 116.97 112.81 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 0.31 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.04 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 -2.33 0.77 -4.82 3.88 4.77 -0.28 -4.75 117.00 114.25 1pmo n LEU 52 Ca 0.01 0.63 -0.33 0.00 -0.03 0.00 0.00 56.01 56.29 1pmo n LEU 52 Cb 0.19 -0.46 -0.05 0.00 -2.33 0.00 0.00 43.42 40.77 1pmo n LEU 52 CO 0.18 -0.40 0.67 -1.81 -1.33 0.00 0.00 177.39 174.70 1pmo s ASP 53 N -4.43 6.69 0.77 -1.43 1.01 -0.65 -5.06 116.67 113.57 1pmo s ASP 53 Ca 0.07 1.72 -0.10 0.00 0.71 0.00 0.00 52.55 54.95 1pmo s ASP 53 Cb 0.11 -2.54 0.08 0.00 1.01 0.00 0.00 42.92 41.58 1pmo s ASP 53 CO 0.49 -0.54 1.11 -0.83 0.21 0.00 0.00 175.17 175.61 1pmo s GLY 54 N -2.37 1.65 0.00 0.21 0.00 -1.26 -4.98 107.32 100.56 1pmo s GLY 54 Ca 0.62 -0.83 0.20 0.00 0.00 0.00 0.00 44.72 44.71 1pmo s GLY 54 CO 0.20 -0.35 0.98 1.16 0.00 0.00 0.00 173.10 175.09 1pmo n ASN 55 N -3.17 1.87 0.00 1.64 0.23 -1.26 -4.98 115.26 109.59 1pmo n ASN 55 Ca 0.09 -1.43 0.00 0.00 -0.53 0.00 0.00 54.58 52.70 1pmo n ASN 55 Cb 0.61 0.46 0.00 0.00 -2.08 0.00 0.00 39.78 38.77 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 -0.04 0.00 0.17 -2.53 0.00 -1.26 -4.83 120.51 112.02 1pmo n ALA 56 Ca 0.08 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.56 1pmo n ALA 56 Cb 0.41 -0.82 0.45 0.00 0.00 0.00 0.00 19.45 19.49 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 0.67 0.13 -0.64 0.00 2.47 -1.93 -1.64 114.38 113.44 1pmo h ARG 57 Ca 0.00 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1pmo h ARG 57 Cb 0.18 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.48 1pmo h ARG 57 CO 0.00 0.27 0.00 1.04 0.56 0.00 0.00 179.97 181.84 1pmo n GLN 58 N -4.32 2.83 -3.09 0.04 6.02 -1.26 -4.87 117.38 112.73 1pmo n GLN 58 Ca -0.01 -2.54 -0.42 0.00 -0.01 0.00 0.00 57.00 54.01 1pmo n GLN 58 Cb 0.24 -1.52 -0.06 0.00 1.02 0.00 0.00 30.24 29.91 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 -1.00 6.42 -0.28 1.08 3.84 -0.62 -1.76 114.94 122.63 1pmo s ASN 59 Ca 0.43 0.08 0.11 0.00 0.21 0.00 0.00 52.86 53.69 1pmo s ASN 59 Cb 0.23 -2.33 0.60 0.00 -0.55 0.00 0.00 41.25 39.20 1pmo s ASN 59 CO 0.29 -0.65 1.59 0.18 -2.79 0.00 0.00 177.10 175.71 1pmo n LEU 60 N 6.14 4.82 -0.10 3.21 4.77 -0.01 -4.47 117.00 131.37 1pmo n LEU 60 Ca -0.01 -3.35 -0.18 0.00 -0.03 0.00 0.00 56.01 52.45 1pmo n LEU 60 Cb 0.48 -0.65 -0.13 0.00 -2.33 0.00 0.00 43.42 40.79 1pmo n LEU 60 CO 0.50 0.92 -1.22 0.00 -1.33 0.00 0.00 177.39 176.26 1pmo n ALA 61 N -0.64 1.35 -1.92 -1.18 0.00 -1.23 -1.34 120.51 115.55 1pmo n ALA 61 Ca 0.33 -1.03 -0.32 0.00 0.00 0.00 0.00 53.44 52.43 1pmo n ALA 61 Cb 1.14 -0.23 -0.03 0.00 0.00 0.00 0.00 19.45 20.33 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 4.60 -0.25 0.00 -1.32 -1.26 -4.82 115.64 110.08 1pmo s THR 62 Ca -0.30 1.06 0.22 0.00 -1.21 0.00 0.00 61.69 61.46 1pmo s THR 62 Cb 0.08 -3.74 -0.30 0.00 -1.51 0.00 0.00 72.50 67.03 1pmo s THR 62 CO 0.66 -0.71 0.60 0.49 -2.21 0.00 0.00 174.62 173.45 1pmo n PHE 63 N -1.65 0.04 -2.24 9.09 3.01 -1.26 -4.86 117.46 119.59 1pmo n PHE 63 Ca 0.06 0.01 -0.39 0.00 1.01 0.00 0.00 57.45 58.14 1pmo n PHE 63 Cb 0.54 -0.41 -0.02 0.00 -0.01 0.00 0.00 39.48 39.58 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 0.25 2.20 0.00 0.00 1.13 -0.43 -4.89 117.38 115.63 1pmo n GLN 65 Ca 0.03 0.79 0.00 0.00 -1.94 0.00 0.00 57.00 55.88 1pmo n GLN 65 Cb 0.45 -2.52 0.00 0.00 0.11 0.00 0.00 30.24 28.28 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 2.81 0.00 -2.01 5.09 -2.24 -1.26 -4.77 114.28 111.90 1pmo n THR 66 Ca 0.14 -0.18 -0.30 0.00 -2.27 0.00 0.00 64.05 61.45 1pmo n THR 66 Cb 0.31 1.50 0.02 0.00 -2.10 0.00 0.00 70.33 70.05 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 -0.08 3.55 -0.14 4.78 -0.00 -1.26 -4.87 118.94 120.93 1pmo s TRP 67 Ca 0.00 1.15 0.02 0.00 -0.00 0.00 0.00 56.10 57.27 1pmo s TRP 67 Cb 0.00 -2.72 0.00 0.00 -0.00 0.00 0.00 33.47 30.75 1pmo s TRP 67 CO 0.00 -0.72 -0.20 -0.51 -0.00 0.00 0.00 176.95 175.52 1pmo s ASP 68 N -4.21 3.27 -0.15 5.86 1.01 -1.26 -5.10 116.67 116.09 1pmo s ASP 68 Ca 0.54 -0.56 0.01 0.00 0.71 0.00 0.00 52.55 53.26 1pmo s ASP 68 Cb -0.11 -1.47 0.02 0.00 1.01 0.00 0.00 42.92 42.37 1pmo s ASP 68 CO 0.52 0.10 -0.18 -0.62 0.21 0.00 0.00 175.17 175.20 1pmo s ASP 69 N 0.72 2.88 0.27 0.27 -1.08 -1.26 -5.04 116.67 113.42 1pmo s ASP 69 Ca -0.09 -0.55 -0.01 0.00 -0.52 0.00 0.00 52.55 51.38 1pmo s ASP 69 Cb -0.16 -1.32 0.52 0.00 -1.46 0.00 0.00 42.92 40.50 1pmo s ASP 69 CO 0.01 -0.00 1.79 -0.08 0.52 0.00 0.00 175.17 177.41 1pmo h GLU 70 N 7.80 0.74 -0.50 4.34 4.81 -1.99 -1.63 114.58 128.14 1pmo h GLU 70 Ca -0.39 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 58.76 1pmo h GLU 70 Cb 1.15 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.34 1pmo h GLU 70 CO 0.57 0.49 0.15 -0.91 -0.73 0.00 0.00 179.01 178.57 1pmo h ASN 71 N 0.76 0.68 -0.16 1.04 -0.26 -1.99 -1.21 115.58 114.45 1pmo h ASN 71 Ca 0.46 -0.10 -0.14 0.00 -0.56 0.00 0.00 56.30 55.96 1pmo h ASN 71 Cb 0.56 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.64 1pmo h ASN 71 CO -0.31 0.66 -0.38 0.58 -1.06 0.00 0.00 177.43 176.92 1pmo h VAL 72 N 0.73 1.29 -0.67 2.81 2.07 -1.74 -0.97 116.25 119.77 1pmo h VAL 72 Ca 0.17 -1.54 -0.06 0.00 0.82 0.00 0.00 66.70 66.09 1pmo h VAL 72 Cb 0.23 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 1pmo h VAL 72 CO -0.01 0.50 0.19 0.45 0.02 0.00 0.00 177.57 178.71 1pmo h HIS 73 N 0.57 1.10 -0.33 1.57 3.86 -0.82 -1.09 115.15 120.01 1pmo h HIS 73 Ca 0.05 -0.12 -0.04 0.00 -1.16 0.00 0.00 60.37 59.10 1pmo h HIS 73 Cb 0.90 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 29.05 1pmo h HIS 73 CO 0.04 0.90 0.05 0.87 0.86 0.00 0.00 177.93 180.65 1pmo h LYS 74 N 0.99 0.54 -0.67 2.45 1.57 -0.98 -0.55 116.57 119.91 1pmo h LYS 74 Ca 0.21 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 1pmo h LYS 74 Cb 0.33 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.55 1pmo h LYS 74 CO -0.00 0.63 0.23 -0.07 -0.57 0.00 0.00 179.45 179.66 1pmo h LEU 75 N 0.37 0.96 -0.48 2.94 3.38 -1.02 -1.72 115.31 119.75 1pmo h LEU 75 Ca 0.10 -0.20 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 1pmo h LEU 75 Cb 0.35 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1pmo h LEU 75 CO 0.01 0.90 -0.06 0.24 0.09 0.00 0.00 178.44 179.62 1pmo h MET 76 N 0.97 0.88 -0.74 1.13 2.86 -1.12 -2.31 114.93 116.60 1pmo h MET 76 Ca 0.22 -0.31 -0.01 0.00 -2.06 0.00 0.00 59.70 57.54 1pmo h MET 76 Cb 0.27 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.83 1pmo h MET 76 CO -0.01 0.95 0.43 0.22 1.06 0.00 0.00 176.91 179.56 1pmo h ASP 77 N 0.73 0.90 0.99 1.22 3.58 -0.82 -1.96 116.42 121.06 1pmo h ASP 77 Ca 0.13 -0.06 -0.04 0.00 0.42 0.00 0.00 57.03 57.47 1pmo h ASP 77 Cb 0.59 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.41 1pmo h ASP 77 CO 0.04 0.71 -0.20 -0.07 -2.88 0.00 0.00 179.24 176.83 1pmo h LEU 78 N 1.03 0.00 -1.86 2.28 3.38 -1.13 -3.24 115.31 115.76 1pmo h LEU 78 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1pmo h LEU 78 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1pmo h LEU 78 CO -0.05 0.20 0.00 -1.20 0.09 0.00 0.00 178.44 177.48 1pmo n SER 79 N -3.34 2.88 -0.39 -0.43 7.64 -0.78 -4.61 113.62 114.60 1pmo n SER 79 Ca 0.00 -1.95 0.32 0.00 1.01 0.00 0.00 58.87 58.25 1pmo n SER 79 Cb 0.43 -0.01 0.62 0.00 -1.01 0.00 0.00 64.21 64.24 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 4.48 0.32 -0.02 0.44 2.10 -1.48 -0.61 117.51 122.73 1pmo h ILE 80 Ca 0.00 -0.06 0.00 0.00 1.08 0.00 0.00 64.86 65.88 1pmo h ILE 80 Cb 0.95 0.12 0.00 0.00 -1.09 0.00 0.00 36.82 36.80 1pmo h ILE 80 CO 0.00 0.03 0.00 0.59 -1.08 0.00 0.00 178.15 177.69 1pmo n ASN 81 N -4.53 2.37 -4.63 2.19 3.02 -1.26 -4.88 115.26 107.54 1pmo n ASN 81 Ca 0.31 -1.68 -0.43 0.00 -0.03 0.00 0.00 54.58 52.75 1pmo n ASN 81 Cb 1.22 -0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 40.37 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 -1.37 3.90 -0.37 3.52 1.02 -0.24 -4.98 119.74 121.23 1pmo s LYS 82 Ca 0.19 1.37 -0.23 0.00 0.02 0.00 0.00 55.97 57.32 1pmo s LYS 82 Cb 0.14 -3.91 0.01 0.00 -0.52 0.00 0.00 37.83 33.55 1pmo s LYS 82 CO 0.21 -1.14 0.77 1.21 -0.92 0.00 0.00 175.35 175.48 1pmo s ASN 83 N 3.10 6.53 0.36 2.83 3.84 -1.26 -1.20 114.94 129.14 1pmo s ASN 83 Ca 0.60 0.30 0.11 0.00 0.21 0.00 0.00 52.86 54.08 1pmo s ASN 83 Cb -0.19 -2.39 0.89 0.00 -0.55 0.00 0.00 41.25 39.01 1pmo s ASN 83 CO 0.24 -0.74 1.84 -0.25 -2.79 0.00 0.00 177.10 175.40 1pmo h TRP 84 N 8.52 0.79 0.00 0.43 7.01 -1.04 -1.91 115.95 129.75 1pmo h TRP 84 Ca -0.25 0.02 -0.07 0.00 2.11 0.00 0.00 58.89 60.71 1pmo h TRP 84 Cb 1.09 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 27.90 1pmo h TRP 84 CO 0.79 0.23 -0.33 0.97 -2.79 0.00 0.00 178.44 177.31 1pmo h ILE 85 N 0.61 0.56 -1.46 2.65 6.09 -1.77 -3.40 117.51 120.79 1pmo h ILE 85 Ca 0.49 -1.79 -0.72 0.00 -1.37 0.00 0.00 64.86 61.46 1pmo h ILE 85 Cb 0.93 2.28 -0.13 0.00 0.47 0.00 0.00 36.82 40.36 1pmo h ILE 85 CO -0.24 0.32 1.89 -0.67 -3.07 0.00 0.00 178.15 176.38 1pmo n ASP 86 N -3.18 4.99 -0.05 2.19 -0.08 -0.72 -4.80 116.55 114.90 1pmo n ASP 86 Ca 0.03 -2.98 0.11 0.00 -1.51 0.00 0.00 54.79 50.44 1pmo n ASP 86 Cb 0.66 -1.60 0.50 0.00 2.34 0.00 0.00 41.12 43.02 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 6.82 0.39 0.56 -0.67 6.56 -1.81 -2.06 116.57 126.37 1pmo h LYS 87 Ca 0.39 -0.02 -0.03 0.00 -1.06 0.00 0.00 60.65 59.93 1pmo h LYS 87 Cb 0.80 -0.09 0.01 0.00 -0.57 0.00 0.00 32.23 32.37 1pmo h LYS 87 CO 1.44 0.26 -0.27 1.49 -2.06 0.00 0.00 179.45 180.32 1pmo h GLU 88 N 0.40 -0.72 -0.00 3.15 4.81 -1.96 -2.85 114.58 117.41 1pmo h GLU 88 Ca 0.25 0.05 -0.17 0.00 -0.13 0.00 0.00 59.36 59.36 1pmo h GLU 88 Cb 0.44 0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.96 1pmo h GLU 88 CO -0.06 -0.43 -0.78 1.49 -0.73 0.00 0.00 179.01 178.49 1pmo h GLU 89 N -0.87 0.01 -2.20 1.92 4.57 -1.94 -3.36 114.58 112.70 1pmo h GLU 89 Ca -0.08 -0.01 -0.59 0.00 -1.18 0.00 0.00 59.36 57.51 1pmo h GLU 89 Cb 0.62 0.00 -0.42 0.00 -0.16 0.00 0.00 28.75 28.79 1pmo h GLU 89 CO 0.13 0.79 -0.65 0.66 -1.18 0.00 0.00 179.01 178.75 1pmo n TYR 90 N -3.61 3.43 -0.19 0.92 4.01 -0.78 -4.93 117.16 116.01 1pmo n TYR 90 Ca -0.01 -4.07 -0.07 0.00 -0.16 0.00 0.00 57.90 53.60 1pmo n TYR 90 Cb 0.76 -0.52 0.03 0.00 -0.31 0.00 0.00 39.34 39.29 1pmo n TYR 90 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 1pmo h PRO 91 N 3.81 0.71 -0.37 -0.72 0.11 -1.67 -2.45 132.00 131.43 1pmo h PRO 91 Ca 0.17 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 66.13 1pmo h PRO 91 Cb 0.64 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.57 1pmo h PRO 91 CO 0.80 0.47 -0.20 0.37 -0.21 0.00 0.00 178.00 179.23 1pmo h GLN 92 N 0.73 0.71 -0.68 1.05 5.75 -1.91 -0.42 115.11 120.34 1pmo h GLN 92 Ca 0.20 -0.27 -0.04 0.00 -0.15 0.00 0.00 58.65 58.39 1pmo h GLN 92 Cb -0.08 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.39 1pmo h GLN 92 CO -0.04 0.86 0.28 0.77 -2.65 0.00 0.00 178.83 178.05 1pmo h SER 93 N 0.63 0.93 -0.66 -0.69 0.02 -1.93 -0.69 113.55 111.17 1pmo h SER 93 Ca 0.09 -0.17 -0.08 0.00 -0.84 0.00 0.00 61.79 60.80 1pmo h SER 93 Cb 0.69 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.96 1pmo h SER 93 CO 0.05 0.85 0.11 0.00 -1.14 0.00 0.00 176.83 176.70 1pmo h ALA 94 N 1.12 0.94 -0.29 3.77 0.00 -1.06 -1.50 119.26 122.24 1pmo h ALA 94 Ca 0.23 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1pmo h ALA 94 Cb 0.20 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1pmo h ALA 94 CO -0.02 0.66 0.09 0.00 0.00 0.00 0.00 179.25 179.98 1pmo h ALA 95 N 1.09 0.38 -0.74 0.00 0.00 -0.65 -1.68 119.26 117.65 1pmo h ALA 95 Ca 0.20 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.97 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 0.02 0.49 0.82 0.00 0.00 0.00 179.25 180.59 1pmo h ILE 96 N 0.31 1.19 -0.64 0.00 2.04 -0.98 -1.58 117.51 117.84 1pmo h ILE 96 Ca 0.09 -0.34 -0.04 0.00 1.00 0.00 0.00 64.86 65.57 1pmo h ILE 96 Cb 0.25 0.10 -0.03 0.00 -0.74 0.00 0.00 36.82 36.40 1pmo h ILE 96 CO -0.00 0.18 0.24 -0.78 0.00 0.00 0.00 178.15 177.79 1pmo h ASP 97 N 1.00 0.90 -0.62 1.72 3.58 -0.88 -1.88 116.42 120.24 1pmo h ASP 97 Ca 0.27 -0.18 -0.05 0.00 0.42 0.00 0.00 57.03 57.49 1pmo h ASP 97 Cb -0.11 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 40.68 1pmo h ASP 97 CO -0.06 0.84 0.20 -0.07 -2.88 0.00 0.00 179.24 177.26 1pmo h LEU 98 N 0.91 0.93 -0.38 2.28 3.38 -0.49 -2.13 115.31 119.80 1pmo h LEU 98 Ca 0.21 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1pmo h LEU 98 Cb 0.23 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1pmo h LEU 98 CO -0.01 0.88 0.22 0.03 0.09 0.00 0.00 178.44 179.65 1pmo h ARG 99 N 0.96 0.53 -0.77 1.13 3.08 -0.96 -2.14 114.38 116.21 1pmo h ARG 99 Ca 0.21 -0.05 0.04 0.00 0.07 0.00 0.00 59.98 60.25 1pmo h ARG 99 Cb 0.29 -0.11 -0.05 0.00 0.08 0.00 0.00 29.97 30.18 1pmo h ARG 99 CO -0.01 0.41 0.48 0.00 -1.07 0.00 0.00 179.97 179.78 1pmo h VAL 101 N 0.91 1.08 -0.50 0.00 2.07 -1.11 -0.15 116.25 118.54 1pmo h VAL 101 Ca 0.32 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.67 1pmo h VAL 101 Cb 0.09 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 1pmo h VAL 101 CO -0.14 0.08 0.23 0.78 0.02 0.00 0.00 177.57 178.54 1pmo h ASN 102 N 0.43 0.67 -0.79 0.57 2.35 -0.81 -0.54 115.58 117.47 1pmo h ASN 102 Ca 0.12 -0.14 -0.03 0.00 -0.55 0.00 0.00 56.30 55.69 1pmo h ASN 102 Cb -0.05 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 38.11 1pmo h ASN 102 CO -0.03 0.63 0.38 0.24 -1.65 0.00 0.00 177.43 177.00 1pmo h MET 103 N 0.67 1.14 -0.31 0.81 2.86 -0.52 0.18 114.93 119.76 1pmo h MET 103 Ca 0.17 -0.17 -0.15 0.00 -2.06 0.00 0.00 59.70 57.49 1pmo h MET 103 Cb 0.15 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 1pmo h MET 103 CO -0.02 0.89 -0.41 0.28 1.06 0.00 0.00 176.91 178.70 1pmo h VAL 104 N 1.12 1.29 -0.48 -2.22 2.07 -0.85 -0.40 116.25 116.78 1pmo h VAL 104 Ca 0.27 -1.59 0.00 0.00 0.82 0.00 0.00 66.70 66.20 1pmo h VAL 104 Cb 0.12 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 1pmo h VAL 104 CO -0.03 0.52 0.31 0.00 0.02 0.00 0.00 177.57 178.38 1pmo h ALA 105 N 0.90 0.61 -0.74 1.67 0.00 -0.59 -1.84 119.26 119.28 1pmo h ALA 105 Ca 0.05 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1pmo h ALA 105 Cb 0.97 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 1pmo h ALA 105 CO 0.09 0.08 0.28 0.22 0.00 0.00 0.00 179.25 179.92 1pmo h ASP 106 N 0.65 1.04 -0.64 0.00 3.58 -0.46 -1.28 116.42 119.31 1pmo h ASP 106 Ca 0.18 -0.18 0.07 0.00 0.42 0.00 0.00 57.03 57.51 1pmo h ASP 106 Cb -0.05 -0.27 -0.04 0.00 1.72 0.00 0.00 39.33 40.69 1pmo h ASP 106 CO -0.04 0.94 0.42 0.25 -2.88 0.00 0.00 179.24 177.93 1pmo h LEU 107 N 1.08 0.54 -2.97 2.28 5.85 -0.38 -1.84 115.31 119.87 1pmo h LEU 107 Ca 0.25 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.97 1pmo h LEU 107 Cb 0.23 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.15 1pmo h LEU 107 CO -0.02 0.34 0.00 0.79 -0.34 0.00 0.00 178.44 179.22 1pmo n TRP 108 N -4.48 1.54 -2.98 1.25 8.01 -0.76 -4.93 117.44 115.09 1pmo n TRP 108 Ca 0.09 -0.57 -0.22 0.00 -1.31 0.00 0.00 57.50 55.50 1pmo n TRP 108 Cb 0.25 -0.33 0.03 0.00 -2.01 0.00 0.00 31.31 29.26 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 0.78 -1.89 -2.12 -5.99 8.25 -0.69 -2.40 115.22 111.16 1pmo n HIS 109 Ca 0.23 0.50 -0.39 0.00 -0.26 0.00 0.00 57.72 57.81 1pmo n HIS 109 Cb 0.92 -4.38 -0.00 0.00 1.12 0.00 0.00 29.99 27.65 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 -3.16 3.13 0.55 -1.41 0.00 -0.52 -4.42 121.76 115.93 1pmo s ALA 110 Ca 0.29 1.12 -0.21 0.00 0.00 0.00 0.00 51.96 53.16 1pmo s ALA 110 Cb -0.13 -3.45 -0.05 0.00 0.00 0.00 0.00 23.12 19.49 1pmo s ALA 110 CO 0.36 -0.78 1.19 -2.30 0.00 0.00 0.00 175.76 174.23 1pmo n PRO 111 N -0.12 1.37 -1.69 0.00 -0.02 -1.26 -4.82 135.00 128.45 1pmo n PRO 111 Ca 0.05 0.51 -0.44 0.00 -2.02 0.00 0.00 63.50 61.60 1pmo n PRO 111 Cb 0.45 -2.38 -0.04 0.00 -0.02 0.00 0.00 33.50 31.52 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 -1.22 2.02 -1.68 3.55 0.00 -1.26 -4.92 120.51 117.00 1pmo n ALA 112 Ca 0.12 0.39 -0.39 0.00 0.00 0.00 0.00 53.44 53.56 1pmo n ALA 112 Cb 0.45 -2.47 0.04 0.00 0.00 0.00 0.00 19.45 17.46 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 4.32 1.40 0.08 0.00 -0.02 -1.26 -4.93 135.00 134.59 1pmo n PRO 113 Ca 0.17 0.52 -0.09 0.00 -2.02 0.00 0.00 63.50 62.08 1pmo n PRO 113 Cb 0.33 -2.34 -0.06 0.00 -0.02 0.00 0.00 33.50 31.40 1pmo n PRO 113 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1pmo h LYS 114 N 1.20 0.12 -0.15 -0.52 6.56 -1.91 -3.29 116.57 118.57 1pmo h LYS 114 Ca -0.49 -0.16 0.00 0.00 -1.06 0.00 0.00 60.65 58.94 1pmo h LYS 114 Cb 1.33 0.05 0.00 0.00 -0.57 0.00 0.00 32.23 33.04 1pmo h LYS 114 CO 0.55 1.00 0.00 0.27 -2.06 0.00 0.00 179.45 179.21 1pmo n ASN 115 N -3.52 2.38 0.00 0.86 6.94 -1.26 -5.00 115.26 115.66 1pmo n ASN 115 Ca -0.03 -1.69 0.00 0.00 -0.02 0.00 0.00 54.58 52.84 1pmo n ASN 115 Cb 0.89 -0.09 0.00 0.00 -2.36 0.00 0.00 39.78 38.21 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 0.67 3.42 3.45 4.83 0.00 -1.24 -5.04 105.19 111.27 1pmo n GLY 116 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.85 3.57 0.76 1.61 2.00 -1.26 -4.85 119.66 120.64 1pmo s GLN 117 Ca 0.00 -0.58 -0.12 0.00 -2.00 0.00 0.00 55.36 52.66 1pmo s GLN 117 Cb 0.00 -2.83 0.05 0.00 0.80 0.00 0.00 33.01 31.03 1pmo s GLN 117 CO 0.00 0.21 1.11 0.00 -0.50 0.00 0.00 175.29 176.11 1pmo s ALA 118 N 0.42 2.19 -0.37 1.58 0.00 -1.26 -4.80 121.76 119.52 1pmo s ALA 118 Ca -0.06 0.42 -0.17 0.00 0.00 0.00 0.00 51.96 52.15 1pmo s ALA 118 Cb -0.15 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.65 1pmo s ALA 118 CO 0.04 -1.80 0.43 0.08 0.00 0.00 0.00 175.76 174.51 1pmo s VAL 119 N -2.68 5.09 0.00 0.00 1.01 -1.26 -4.91 120.40 117.65 1pmo s VAL 119 Ca 0.64 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.63 1pmo s VAL 119 Cb -0.19 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 32.25 1pmo s VAL 119 CO 0.52 -0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.99 1pmo n GLY 120 N 4.96 -0.42 3.34 4.51 0.00 -1.26 -0.37 105.19 115.95 1pmo n GLY 120 Ca -0.07 -1.08 -0.12 0.00 0.00 0.00 0.00 46.02 44.75 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 0.05 0.46 2.61 -1.32 -0.46 -5.01 115.64 109.97 1pmo s THR 121 Ca 0.00 -0.42 -0.13 0.00 -1.21 0.00 0.00 61.69 59.93 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 -0.23 0.86 0.21 -2.21 0.00 0.00 174.62 173.25 1pmo s ASN 122 N -2.47 6.54 0.31 8.08 3.84 -1.26 -2.17 114.94 127.81 1pmo s ASN 122 Ca -0.01 1.30 0.04 0.00 0.21 0.00 0.00 52.86 54.40 1pmo s ASN 122 Cb 0.01 -2.40 -0.03 0.00 -0.55 0.00 0.00 41.25 38.28 1pmo s ASN 122 CO -0.08 -0.49 0.29 0.42 -2.79 0.00 0.00 177.10 174.45 1pmo s THR 123 N -2.50 0.00 0.24 -5.21 -4.23 -0.22 -4.93 115.64 98.78 1pmo s THR 123 Ca 0.54 -1.92 0.01 0.00 -1.18 0.00 0.00 61.69 59.14 1pmo s THR 123 Cb -0.10 -2.52 0.01 0.00 1.34 0.00 0.00 72.50 71.23 1pmo s THR 123 CO 0.32 0.00 1.62 0.40 -0.54 0.00 0.00 174.62 176.43 1pmo h ILE 124 N 2.22 1.31 -1.60 2.99 1.08 -1.85 0.20 117.51 121.85 1pmo h ILE 124 Ca -0.27 -1.58 0.03 0.00 -0.39 0.00 0.00 64.86 62.65 1pmo h ILE 124 Cb 1.24 1.62 -0.01 0.00 -3.07 0.00 0.00 36.82 36.60 1pmo h ILE 124 CO 0.40 0.49 0.09 0.61 -0.69 0.00 0.00 178.15 179.05 1pmo n GLY 125 N -0.05 1.06 0.22 5.37 0.00 -1.26 -0.56 105.19 109.96 1pmo n GLY 125 Ca -0.02 -0.93 0.08 0.00 0.00 0.00 0.00 46.02 45.16 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 0.27 0.00 0.62 1.61 0.02 -1.83 -2.81 113.55 111.42 1pmo h SER 126 Ca -0.04 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.89 1pmo h SER 126 Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 1pmo h SER 126 CO 0.05 0.26 -0.33 0.28 -1.14 0.00 0.00 176.83 175.95 1pmo h SER 127 N 0.00 -0.80 -0.64 3.07 0.02 -1.96 0.31 113.55 113.55 1pmo h SER 127 Ca -0.00 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1pmo h SER 127 Cb 0.63 0.22 -0.03 0.00 0.14 0.00 0.00 62.40 63.36 1pmo h SER 127 CO 0.03 -0.54 0.41 -0.08 -1.14 0.00 0.00 176.83 175.51 1pmo h GLU 128 N -0.88 0.85 -0.93 3.45 4.81 -1.96 -0.95 114.58 118.97 1pmo h GLU 128 Ca -0.08 -0.06 0.08 0.00 -0.13 0.00 0.00 59.36 59.17 1pmo h GLU 128 Cb 0.69 -0.19 -0.07 0.00 0.63 0.00 0.00 28.75 29.81 1pmo h GLU 128 CO 0.12 0.58 0.58 0.00 -0.73 0.00 0.00 179.01 179.55 1pmo h ALA 129 N 1.22 1.31 -0.26 2.92 0.00 -1.23 -0.47 119.26 122.76 1pmo h ALA 129 Ca 0.23 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.00 1pmo h ALA 129 Cb -0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1pmo h ALA 129 CO -0.05 0.29 -0.41 0.00 0.00 0.00 0.00 179.25 179.08 1pmo h MET 131 N 0.51 0.09 -0.38 0.00 2.07 -0.14 0.30 114.93 117.38 1pmo h MET 131 Ca 0.04 -0.01 0.02 0.00 -2.07 0.00 0.00 59.70 57.68 1pmo h MET 131 Cb 0.93 -0.02 -0.03 0.00 -1.87 0.00 0.00 31.60 30.61 1pmo h MET 131 CO 0.08 0.16 0.21 -0.07 1.07 0.00 0.00 176.91 178.36 1pmo h LEU 132 N 0.00 0.33 -0.96 1.22 3.38 -1.06 0.16 115.31 118.38 1pmo h LEU 132 Ca 0.02 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1pmo h LEU 132 Cb 0.10 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1pmo h LEU 132 CO -0.00 0.24 0.49 1.23 0.09 0.00 0.00 178.44 180.48 1pmo h GLY 133 N 0.43 1.31 1.03 0.83 0.00 -0.92 -1.67 103.07 104.08 1pmo h GLY 133 Ca 0.16 -0.58 -0.10 0.00 0.00 0.00 0.00 47.33 46.80 1pmo h GLY 133 CO -0.09 0.56 -0.10 -1.33 0.00 0.00 0.00 176.54 175.58 1pmo h GLY 134 N 1.24 0.97 0.96 4.60 0.00 0.38 -1.72 103.07 109.49 1pmo h GLY 134 Ca 0.31 -0.79 -0.03 0.00 0.00 0.00 0.00 47.33 46.82 1pmo h GLY 134 CO -0.05 0.72 0.17 -0.33 0.00 0.00 0.00 176.54 177.05 1pmo h MET 135 N 0.74 0.68 -0.91 4.80 2.07 -0.45 -0.72 114.93 121.13 1pmo h MET 135 Ca 0.12 -0.13 -0.02 0.00 -2.07 0.00 0.00 59.70 57.61 1pmo h MET 135 Cb 0.64 -0.11 -0.04 0.00 -1.87 0.00 0.00 31.60 30.22 1pmo h MET 135 CO 0.04 0.63 0.51 0.00 1.07 0.00 0.00 176.91 179.16 1pmo h ALA 136 N 1.02 1.17 -0.19 6.32 0.00 -1.23 0.25 119.26 126.60 1pmo h ALA 136 Ca 0.15 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1pmo h ALA 136 Cb 0.21 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1pmo h ALA 136 CO -0.01 0.67 0.11 0.52 0.00 0.00 0.00 179.25 180.54 1pmo h MET 137 N 1.28 0.27 -0.51 0.00 2.86 -0.94 -0.77 114.93 117.10 1pmo h MET 137 Ca 0.32 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.94 1pmo h MET 137 Cb 0.01 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.59 1pmo h MET 137 CO -0.05 0.24 0.34 -0.22 1.06 0.00 0.00 176.91 178.27 1pmo h LYS 138 N 0.22 0.67 -0.48 1.72 3.64 -0.59 -1.62 116.57 120.13 1pmo h LYS 138 Ca 0.07 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 1pmo h LYS 138 Cb 0.05 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 1pmo h LYS 138 CO -0.01 0.44 0.14 -1.49 -2.27 0.00 0.00 179.45 176.26 1pmo h TRP 139 N 0.69 0.78 -0.72 1.91 6.55 -0.79 0.14 115.95 124.51 1pmo h TRP 139 Ca 0.19 -0.08 -0.04 0.00 0.95 0.00 0.00 58.89 59.91 1pmo h TRP 139 Cb -0.07 -0.22 -0.03 0.00 -0.86 0.00 0.00 29.16 27.97 1pmo h TRP 139 CO -0.04 0.69 0.29 0.00 -1.05 0.00 0.00 178.44 178.33 1pmo h ARG 140 N 0.64 1.08 -0.43 0.49 3.08 -0.93 -0.92 114.38 117.39 1pmo h ARG 140 Ca 0.15 -0.20 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 1pmo h ARG 140 Cb 0.28 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 1pmo h ARG 140 CO -0.00 0.89 0.05 2.35 -1.07 0.00 0.00 179.97 182.19 1pmo h TRP 141 N 1.03 0.78 -0.25 3.04 7.01 -1.11 -1.90 115.95 124.56 1pmo h TRP 141 Ca 0.24 -0.12 0.01 0.00 2.11 0.00 0.00 58.89 61.14 1pmo h TRP 141 Cb 0.21 -0.21 -0.02 0.00 -2.10 0.00 0.00 29.16 27.04 1pmo h TRP 141 CO 0.02 0.75 0.13 -0.09 -2.79 0.00 0.00 178.44 176.45 1pmo h ARG 142 N 0.58 0.26 -0.30 2.65 2.43 -0.67 -1.76 114.38 117.56 1pmo h ARG 142 Ca 0.13 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.25 1pmo h ARG 142 Cb 0.41 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 1pmo h ARG 142 CO 0.01 0.17 0.07 0.87 -1.51 0.00 0.00 179.97 179.58 1pmo h LYS 143 N 0.27 0.49 -0.72 0.20 1.57 -1.09 0.41 116.57 117.69 1pmo h LYS 143 Ca 0.10 -0.12 0.12 0.00 -1.87 0.00 0.00 60.65 58.89 1pmo h LYS 143 Cb 0.02 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.22 1pmo h LYS 143 CO -0.06 0.57 0.48 0.00 -0.57 0.00 0.00 179.45 179.86 1pmo h ARG 144 N 0.33 0.47 -0.05 3.15 3.08 -1.21 0.38 114.38 120.53 1pmo h ARG 144 Ca 0.10 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.07 1pmo h ARG 144 Cb 0.30 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.24 1pmo h ARG 144 CO 0.00 0.31 -0.14 0.52 -1.07 0.00 0.00 179.97 179.59 1pmo h MET 145 N 0.48 0.18 -0.24 0.04 2.86 -0.30 -2.84 114.93 115.10 1pmo h MET 145 Ca 0.35 -0.13 -0.07 0.00 -2.06 0.00 0.00 59.70 57.79 1pmo h MET 145 Cb 0.69 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.35 1pmo h MET 145 CO -0.11 0.75 -0.16 0.93 1.06 0.00 0.00 176.91 179.37 1pmo h GLU 146 N -0.36 0.42 0.00 1.72 5.08 0.28 0.08 114.58 121.80 1pmo h GLU 146 Ca -0.00 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.19 1pmo h GLU 146 Cb 0.76 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 1pmo h GLU 146 CO 0.03 0.58 -0.20 0.00 -1.00 0.00 0.00 179.01 178.42 1pmo h ALA 147 N 1.44 1.14 -0.72 3.43 0.00 -0.98 -0.97 119.26 122.60 1pmo h ALA 147 Ca 0.07 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1pmo h ALA 147 Cb 0.52 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1pmo h ALA 147 CO 0.03 0.25 0.00 0.00 0.00 0.00 0.00 179.25 179.53 1pmo n ALA 148 N -2.26 2.60 -2.96 0.00 0.00 -0.63 -4.96 120.51 112.30 1pmo n ALA 148 Ca -0.01 -1.40 -0.21 0.00 0.00 0.00 0.00 53.44 51.82 1pmo n ALA 148 Cb 0.35 -0.96 0.01 0.00 0.00 0.00 0.00 19.45 18.85 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 1.53 -0.51 3.96 0.00 0.00 -0.37 -5.00 105.19 104.80 1pmo n GLY 149 Ca 0.25 0.09 -0.18 0.00 0.00 0.00 0.00 46.02 46.18 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 -5.61 2.75 0.10 1.61 -0.14 -0.10 -5.00 119.74 113.34 1pmo s LYS 150 Ca 0.25 -1.32 -0.30 0.00 -1.36 0.00 0.00 55.97 53.23 1pmo s LYS 150 Cb -0.12 -2.63 -0.06 0.00 -1.68 0.00 0.00 37.83 33.34 1pmo s LYS 150 CO 0.31 -0.21 1.12 -2.14 -0.76 0.00 0.00 175.35 173.67 1pmo s PRO 151 N -4.25 4.52 -0.34 -1.68 0.02 -1.26 -4.47 135.00 127.54 1pmo s PRO 151 Ca 0.52 1.69 0.07 0.00 0.02 0.00 0.00 61.00 63.30 1pmo s PRO 151 Cb -0.08 -3.34 0.52 0.00 0.02 0.00 0.00 34.50 31.62 1pmo s PRO 151 CO 0.31 -0.08 1.53 0.25 -0.33 0.00 0.00 177.00 178.68 1pmo n THR 152 N 3.28 2.70 0.82 0.99 -2.24 -1.26 -4.68 114.28 113.90 1pmo n THR 152 Ca 0.06 -2.83 0.09 0.00 -2.27 0.00 0.00 64.05 59.10 1pmo n THR 152 Cb 0.47 -0.47 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1pmo n THR 152 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1pmo n ASP 153 N -1.08 1.82 -3.03 3.42 5.75 -1.26 -4.68 116.55 117.49 1pmo n ASP 153 Ca 0.39 -1.41 -0.25 0.00 -0.01 0.00 0.00 54.79 53.51 1pmo n ASP 153 Cb 1.07 0.45 -0.04 0.00 -1.03 0.00 0.00 41.12 41.57 1pmo n ASP 153 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1pmo n LYS 154 N -0.03 2.75 -2.89 0.11 5.02 -1.26 -5.10 118.16 116.76 1pmo n LYS 154 Ca 0.08 -4.57 -0.34 0.00 -2.02 0.00 0.00 58.31 51.46 1pmo n LYS 154 Cb 0.39 -2.13 -0.07 0.00 -0.02 0.00 0.00 35.03 33.20 1pmo n LYS 154 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1pmo s PRO 155 N -3.16 4.23 0.11 1.97 0.04 -1.26 -4.75 135.00 132.17 1pmo s PRO 155 Ca 0.46 1.04 0.02 0.00 0.04 0.00 0.00 61.00 62.57 1pmo s PRO 155 Cb 0.28 -2.35 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 1pmo s PRO 155 CO -0.12 0.07 -0.06 0.54 0.04 0.00 0.00 177.00 177.47 1pmo s ASN 156 N -2.10 1.16 -0.06 6.66 2.20 -0.53 -0.99 114.94 121.28 1pmo s ASN 156 Ca 0.58 -1.02 0.01 0.00 -0.94 0.00 0.00 52.86 51.49 1pmo s ASN 156 Cb -0.11 0.09 0.02 0.00 -2.00 0.00 0.00 41.25 39.26 1pmo s ASN 156 CO 0.16 -0.47 -0.07 -0.22 -2.94 0.00 0.00 177.10 173.56 1pmo s LEU 157 N -3.06 1.37 -0.14 3.54 1.98 0.51 -0.52 118.68 122.36 1pmo s LEU 157 Ca 0.13 -0.20 -0.11 0.00 -2.89 0.00 0.00 54.13 51.06 1pmo s LEU 157 Cb 0.05 -0.60 -0.05 0.00 0.66 0.00 0.00 46.19 46.25 1pmo s LEU 157 CO -0.04 -0.04 0.22 -0.69 -1.89 0.00 0.00 176.35 173.92 1pmo s VAL 158 N 0.98 5.35 0.35 1.68 1.01 -0.96 -0.16 120.40 128.65 1pmo s VAL 158 Ca -0.10 0.40 -0.18 0.00 0.00 0.00 0.00 61.98 62.11 1pmo s VAL 158 Cb -0.14 -3.54 0.04 0.00 0.00 0.00 0.00 36.38 32.74 1pmo s VAL 158 CO 0.00 0.49 0.77 0.00 0.00 0.00 0.00 175.10 176.36 1pmo n GLY 160 N -0.51 2.88 3.03 0.00 0.00 -1.26 -0.24 105.19 109.09 1pmo n GLY 160 Ca -0.07 -1.78 -0.38 0.00 0.00 0.00 0.00 46.02 43.79 1pmo n GLY 160 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1pmo n PRO 161 N 0.00 1.43 -1.37 1.61 -0.02 -1.26 -4.55 135.00 130.84 1pmo n PRO 161 Ca 0.00 -1.64 -0.32 0.00 -2.02 0.00 0.00 63.50 59.52 1pmo n PRO 161 Cb 0.00 -2.75 0.08 0.00 -0.02 0.00 0.00 33.50 30.81 1pmo n PRO 161 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1pmo s VAL 162 N 4.85 3.16 0.62 -1.45 0.11 -1.26 -4.62 120.40 121.81 1pmo s VAL 162 Ca 0.52 0.43 -0.11 0.00 -2.93 0.00 0.00 61.98 59.90 1pmo s VAL 162 Cb 0.13 -2.89 -0.04 0.00 -1.53 0.00 0.00 36.38 32.05 1pmo s VAL 162 CO 0.10 -0.44 1.03 -1.58 -3.33 0.00 0.00 175.10 170.88 1pmo s GLN 163 N -4.59 3.57 0.63 1.54 -0.44 -1.26 -4.93 119.66 114.17 1pmo s GLN 163 Ca 0.64 0.73 0.30 0.00 -2.50 0.00 0.00 55.36 54.53 1pmo s GLN 163 Cb -0.19 -2.08 1.63 0.00 -1.64 0.00 0.00 33.01 30.73 1pmo s GLN 163 CO 0.51 -0.58 1.97 -0.84 0.50 0.00 0.00 175.29 176.85 1pmo h ILE 164 N -0.32 0.20 -0.11 -2.34 -0.00 -1.96 -1.79 117.51 111.19 1pmo h ILE 164 Ca -0.44 0.00 0.03 0.00 -0.00 0.00 0.00 64.86 64.45 1pmo h ILE 164 Cb 1.19 0.70 -0.00 0.00 -0.00 0.00 0.00 36.82 38.71 1pmo h ILE 164 CO 0.62 0.00 0.08 0.00 -0.00 0.00 0.00 178.15 178.85 1pmo h TRP 166 N 0.00 0.00 -0.39 0.00 4.06 -1.69 -0.63 115.95 117.30 1pmo h TRP 166 Ca 0.05 0.00 -0.15 0.00 2.06 0.00 0.00 58.89 60.85 1pmo h TRP 166 Cb 0.22 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.37 1pmo h TRP 166 CO 0.00 0.78 -0.34 0.45 -3.56 0.00 0.00 178.44 175.77 1pmo h HIS 167 N 0.00 1.07 -0.41 0.49 3.86 -1.35 -0.94 115.15 117.87 1pmo h HIS 167 Ca -0.01 -0.30 -0.04 0.00 -1.16 0.00 0.00 60.37 58.86 1pmo h HIS 167 Cb 1.51 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 29.73 1pmo h HIS 167 CO 0.00 1.11 0.08 0.87 0.86 0.00 0.00 177.93 180.85 1pmo h LYS 168 N 0.75 0.66 -0.11 2.45 1.57 -1.09 -1.22 116.57 119.59 1pmo h LYS 168 Ca 0.07 -0.17 0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1pmo h LYS 168 Cb 0.92 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.14 1pmo h LYS 168 CO 0.09 0.70 0.04 0.35 -0.57 0.00 0.00 179.45 180.05 1pmo h PHE 169 N 0.52 0.07 -0.31 -1.35 3.57 -0.95 0.28 116.94 118.77 1pmo h PHE 169 Ca 0.13 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.68 1pmo h PHE 169 Cb 0.34 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.02 1pmo h PHE 169 CO 0.02 0.04 0.03 0.00 -2.23 0.00 0.00 178.31 176.17 1pmo h ALA 170 N 1.06 0.30 -0.04 2.41 0.00 -1.04 -0.42 119.26 121.54 1pmo h ALA 170 Ca 0.05 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1pmo h ALA 170 Cb 0.02 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1pmo h ALA 170 CO -0.05 -0.38 -0.00 -0.09 0.00 0.00 0.00 179.25 178.73 1pmo h ARG 171 N 0.13 0.07 0.00 0.00 9.65 -0.95 -0.08 114.38 123.20 1pmo h ARG 171 Ca 0.15 -0.02 -0.07 0.00 -1.10 0.00 0.00 59.98 58.93 1pmo h ARG 171 Cb 0.18 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.74 1pmo h ARG 171 CO -0.22 0.38 -0.35 1.88 2.80 0.00 0.00 179.97 184.45 1pmo h TYR 172 N -0.24 0.00 -0.28 2.20 0.05 -0.28 -3.12 116.97 115.29 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 0.35 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.09 1pmo h TYR 172 CO 0.04 0.35 0.00 0.91 -1.05 0.00 0.00 178.16 178.41 1pmo n TRP 173 N -3.99 0.99 -3.86 4.88 8.01 -0.18 -5.00 117.44 118.29 1pmo n TRP 173 Ca -0.02 -0.85 -0.32 0.00 -1.31 0.00 0.00 57.50 55.01 1pmo n TRP 173 Cb 0.40 -0.31 0.01 0.00 -2.01 0.00 0.00 31.31 29.40 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 -0.39 -3.11 -4.20 -0.99 8.00 -0.83 -4.99 116.55 110.04 1pmo n ASP 174 Ca 0.21 -1.07 -0.31 0.00 0.71 0.00 0.00 54.79 54.34 1pmo n ASP 174 Cb 0.89 -2.95 -0.17 0.00 -0.02 0.00 0.00 41.12 38.88 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 -3.69 1.93 -0.01 2.53 1.01 -0.10 -4.72 120.40 117.35 1pmo s VAL 175 Ca 0.29 -0.95 -0.30 0.00 0.00 0.00 0.00 61.98 61.02 1pmo s VAL 175 Cb -0.12 -1.67 -0.07 0.00 0.00 0.00 0.00 36.38 34.53 1pmo s VAL 175 CO 0.89 0.53 1.65 -0.70 0.00 0.00 0.00 175.10 177.48 1pmo s GLU 176 N 0.30 4.19 -0.40 2.72 2.12 -0.16 -4.51 118.70 122.96 1pmo s GLU 176 Ca -0.16 2.24 -0.20 0.00 0.36 0.00 0.00 54.97 57.22 1pmo s GLU 176 Cb -0.17 -3.85 0.01 0.00 0.26 0.00 0.00 34.13 30.38 1pmo s GLU 176 CO 0.07 -0.80 0.59 -1.17 -0.54 0.00 0.00 175.26 173.41 1pmo s LEU 177 N 3.53 4.45 -1.00 2.70 1.98 -1.26 -0.36 118.68 128.71 1pmo s LEU 177 Ca 0.74 -0.20 -0.10 0.00 -2.89 0.00 0.00 54.13 51.68 1pmo s LEU 177 Cb -0.36 -2.67 0.25 0.00 0.66 0.00 0.00 46.19 44.08 1pmo s LEU 177 CO 0.31 -0.64 0.97 -0.13 -1.89 0.00 0.00 176.35 174.97 1pmo s ARG 178 N 2.62 3.94 -0.33 1.98 0.52 0.77 -4.94 118.95 123.50 1pmo s ARG 178 Ca 0.21 -2.97 -0.22 0.00 -0.52 0.00 0.00 55.73 52.23 1pmo s ARG 178 Cb -0.15 -4.47 -0.00 0.00 0.52 0.00 0.00 34.95 30.85 1pmo s ARG 178 CO 0.16 -1.26 0.70 -2.00 0.02 0.00 0.00 175.30 172.92 1pmo s GLU 179 N -0.79 3.84 -0.01 3.54 2.12 -1.26 -2.02 118.70 124.11 1pmo s GLU 179 Ca 0.26 0.32 -0.30 0.00 0.36 0.00 0.00 54.97 55.61 1pmo s GLU 179 Cb -0.10 -3.76 -0.07 0.00 0.26 0.00 0.00 34.13 30.46 1pmo s GLU 179 CO -0.08 -0.69 1.71 0.42 -0.54 0.00 0.00 175.26 176.08 1pmo s ILE 180 N 2.81 3.37 0.41 -3.70 1.09 0.67 -4.93 121.20 120.91 1pmo s ILE 180 Ca 0.28 0.54 -0.26 0.00 -1.10 0.00 0.00 60.65 60.11 1pmo s ILE 180 Cb -0.14 -3.35 -0.10 0.00 -1.06 0.00 0.00 42.46 37.81 1pmo s ILE 180 CO 0.14 -0.04 1.33 -2.65 -0.10 0.00 0.00 174.94 173.61 1pmo n PRO 181 N 6.86 2.11 -2.70 2.79 -0.02 -1.26 -4.34 135.00 138.44 1pmo n PRO 181 Ca 0.17 0.75 -0.41 0.00 -2.02 0.00 0.00 63.50 61.99 1pmo n PRO 181 Cb 0.42 -2.45 -0.05 0.00 -0.02 0.00 0.00 33.50 31.41 1pmo n PRO 181 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1pmo s MET 182 N -2.17 4.70 -0.01 -0.52 1.75 -1.26 -4.80 119.30 116.99 1pmo s MET 182 Ca 0.59 1.50 -0.05 0.00 -1.25 0.00 0.00 55.69 56.48 1pmo s MET 182 Cb -0.51 -3.35 0.00 0.00 2.84 0.00 0.00 34.83 33.82 1pmo s MET 182 CO 0.59 0.23 0.11 1.03 -0.65 0.00 0.00 175.02 176.34 1pmo s ARG 183 N -0.21 0.35 0.19 4.11 0.52 -1.06 0.52 118.95 123.36 1pmo s ARG 183 Ca 0.47 -0.24 -0.32 0.00 -0.52 0.00 0.00 55.73 55.11 1pmo s ARG 183 Cb -0.25 0.14 -0.16 0.00 0.52 0.00 0.00 34.95 35.21 1pmo s ARG 183 CO 0.31 -0.07 1.10 -2.30 0.02 0.00 0.00 175.30 174.36 1pmo n PRO 184 N 1.99 1.11 0.00 3.54 -0.02 -1.26 -0.97 135.00 139.39 1pmo n PRO 184 Ca -0.20 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 1pmo n PRO 184 Cb 0.57 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.20 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 1.87 2.27 2.51 -1.23 0.00 -1.26 -4.80 105.19 104.54 1pmo n GLY 185 Ca 0.14 -0.48 -0.28 0.00 0.00 0.00 0.00 46.02 45.41 1pmo n GLY 185 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1pmo s GLN 186 N 0.00 1.06 0.00 1.61 -2.07 -0.14 -4.96 119.66 115.16 1pmo s GLN 186 Ca 0.00 -2.07 0.28 0.00 -1.82 0.00 0.00 55.36 51.75 1pmo s GLN 186 Cb 0.00 -1.75 1.40 0.00 -1.09 0.00 0.00 33.01 31.56 1pmo s GLN 186 CO 0.00 -1.31 1.97 1.28 -1.32 0.00 0.00 175.29 175.91 1pmo n LEU 187 N 3.10 0.00 -4.65 2.60 4.77 -1.09 -2.57 117.00 119.16 1pmo n LEU 187 Ca 0.22 0.32 -0.29 0.00 -0.03 0.00 0.00 56.01 56.23 1pmo n LEU 187 Cb 0.42 -0.32 -0.10 0.00 -2.33 0.00 0.00 43.42 41.10 1pmo n LEU 187 CO 0.14 -0.02 -0.27 -0.36 -1.33 0.00 0.00 177.39 175.54 1pmo s PHE 188 N -2.63 2.25 -0.40 -1.77 0.08 -1.26 -4.52 117.98 109.73 1pmo s PHE 188 Ca 0.25 -0.80 -0.29 0.00 0.12 0.00 0.00 56.93 56.21 1pmo s PHE 188 Cb 0.19 -1.67 0.01 0.00 -0.57 0.00 0.00 43.02 40.98 1pmo s PHE 188 CO 0.44 0.33 1.32 1.41 -0.10 0.00 0.00 175.22 178.62 1pmo s MET 189 N -3.78 3.70 0.32 0.44 -2.45 -1.26 -4.99 119.30 111.29 1pmo s MET 189 Ca 0.26 0.93 0.03 0.00 -1.25 0.00 0.00 55.69 55.65 1pmo s MET 189 Cb 0.07 -3.96 -0.03 0.00 1.25 0.00 0.00 34.83 32.17 1pmo s MET 189 CO 0.13 -1.40 0.49 0.16 1.05 0.00 0.00 175.02 175.45 1pmo s ASP 190 N 3.28 6.22 0.21 1.11 -4.77 -1.26 -4.92 116.67 116.54 1pmo s ASP 190 Ca 0.57 0.25 -0.10 0.00 -3.30 0.00 0.00 52.55 49.97 1pmo s ASP 190 Cb -0.13 -1.84 0.27 0.00 -1.09 0.00 0.00 42.92 40.13 1pmo s ASP 190 CO 0.30 -0.28 1.75 -0.65 0.70 0.00 0.00 175.17 176.99 1pmo h PRO 191 N 0.87 0.42 0.68 2.11 0.11 -1.95 -1.18 132.00 133.05 1pmo h PRO 191 Ca -0.50 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.55 1pmo h PRO 191 Cb 1.23 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 32.25 1pmo h PRO 191 CO 0.60 0.28 -0.33 -0.22 -0.21 0.00 0.00 178.00 178.12 1pmo h LYS 192 N 0.43 -0.88 -0.03 1.05 3.64 -1.98 -1.33 116.57 117.48 1pmo h LYS 192 Ca 0.30 0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.71 1pmo h LYS 192 Cb 0.36 0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.37 1pmo h LYS 192 CO -0.29 -0.59 -0.16 0.00 -2.27 0.00 0.00 179.45 176.14 1pmo h ARG 193 N -0.92 0.04 -0.00 1.90 3.08 -1.96 -1.70 114.38 114.83 1pmo h ARG 193 Ca -0.09 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 1pmo h ARG 193 Cb 0.70 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.74 1pmo h ARG 193 CO 0.15 0.21 0.00 1.98 -1.07 0.00 0.00 179.97 181.24 1pmo h MET 194 N 0.04 0.01 -0.85 0.04 4.05 -0.98 -2.87 114.93 114.37 1pmo h MET 194 Ca 0.01 -0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 1pmo h MET 194 Cb 0.31 -0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 31.07 1pmo h MET 194 CO 0.02 0.19 0.48 0.97 0.23 0.00 0.00 176.91 178.80 1pmo h ILE 195 N -0.18 1.24 0.00 1.77 6.09 -0.83 -1.47 117.51 124.14 1pmo h ILE 195 Ca 0.00 -0.58 -0.00 0.00 -1.37 0.00 0.00 64.86 62.91 1pmo h ILE 195 Cb 0.18 0.08 -0.00 0.00 0.47 0.00 0.00 36.82 37.55 1pmo h ILE 195 CO -0.00 0.27 -0.01 -0.33 -3.07 0.00 0.00 178.15 175.01 1pmo h GLU 196 N 1.18 0.00 0.00 2.19 5.08 -1.17 -1.73 114.58 120.12 1pmo h GLU 196 Ca 0.30 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 1pmo h GLU 196 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1pmo h GLU 196 CO -0.05 0.01 -0.76 0.00 -1.00 0.00 0.00 179.01 177.21 1pmo n ALA 197 N -2.26 3.98 -2.04 3.43 0.00 -0.58 -4.96 120.51 118.08 1pmo n ALA 197 Ca -0.03 -0.45 -0.35 0.00 0.00 0.00 0.00 53.44 52.61 1pmo n ALA 197 Cb 0.09 -0.97 -0.06 0.00 0.00 0.00 0.00 19.45 18.51 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 0.34 -0.14 0.21 0.00 5.68 -1.26 -5.02 116.55 116.36 1pmo n ASP 199 Ca 0.00 -1.10 0.15 0.00 -0.50 0.00 0.00 54.79 53.34 1pmo n ASP 199 Cb 0.52 0.23 0.67 0.00 -1.14 0.00 0.00 41.12 41.39 1pmo n ASP 199 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1pmo h GLU 200 N 0.00 0.00 -0.15 0.11 3.07 -2.00 -2.36 114.58 113.25 1pmo h GLU 200 Ca -0.02 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 1pmo h GLU 200 Cb 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 1pmo h GLU 200 CO 0.03 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.73 1pmo n ASN 201 N -2.58 2.62 -4.61 1.42 3.02 -1.26 -4.88 115.26 109.00 1pmo n ASN 201 Ca 0.00 -1.86 -0.43 0.00 -0.03 0.00 0.00 54.58 52.27 1pmo n ASN 201 Cb 0.19 -0.09 -0.02 0.00 -0.61 0.00 0.00 39.78 39.24 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 -1.83 3.69 -0.58 3.41 2.01 -0.89 -1.46 115.64 119.99 1pmo s THR 202 Ca 0.34 0.72 0.25 0.00 0.31 0.00 0.00 61.69 63.31 1pmo s THR 202 Cb 0.21 -3.85 0.27 0.00 0.01 0.00 0.00 72.50 69.14 1pmo s THR 202 CO 0.31 -0.49 1.75 2.30 -0.69 0.00 0.00 174.62 177.80 1pmo n ILE 203 N 7.02 0.72 0.00 1.82 -5.35 0.32 -4.93 119.36 118.96 1pmo n ILE 203 Ca 0.20 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.65 1pmo n ILE 203 Cb 0.47 -0.89 0.00 0.00 -1.74 0.00 0.00 39.64 37.48 1pmo n ILE 203 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1pmo n GLY 204 N 0.63 2.03 3.48 3.28 0.00 -1.26 -4.67 105.19 108.68 1pmo n GLY 204 Ca 0.04 -1.09 -0.33 0.00 0.00 0.00 0.00 46.02 44.64 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 3.11 -0.43 1.61 1.01 -0.49 -2.25 120.40 120.95 1pmo s VAL 205 Ca 0.00 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.32 1pmo s VAL 205 Cb 0.00 -2.23 0.12 0.00 0.00 0.00 0.00 36.38 34.27 1pmo s VAL 205 CO 0.00 0.59 0.16 -0.69 0.00 0.00 0.00 175.10 175.16 1pmo s VAL 206 N -0.65 2.40 0.35 2.92 1.01 -0.19 -1.84 120.40 124.41 1pmo s VAL 206 Ca 0.10 -2.84 -0.26 0.00 0.00 0.00 0.00 61.98 58.99 1pmo s VAL 206 Cb -0.11 -2.72 -0.09 0.00 0.00 0.00 0.00 36.38 33.46 1pmo s VAL 206 CO 0.01 -0.71 1.03 -2.84 0.00 0.00 0.00 175.10 172.59 1pmo s PRO 207 N 0.29 4.38 -0.42 2.72 0.02 -1.22 -4.19 135.00 136.58 1pmo s PRO 207 Ca 0.14 1.51 -0.10 0.00 0.02 0.00 0.00 61.00 62.56 1pmo s PRO 207 Cb -0.23 -2.73 0.07 0.00 0.02 0.00 0.00 34.50 31.63 1pmo s PRO 207 CO -0.04 0.05 0.28 0.99 -0.33 0.00 0.00 177.00 177.94 1pmo s THR 208 N -1.56 4.43 -1.47 0.99 2.01 -1.26 -1.68 115.64 117.10 1pmo s THR 208 Ca 0.53 -1.28 -0.13 0.00 0.31 0.00 0.00 61.69 61.12 1pmo s THR 208 Cb -0.23 -3.67 0.03 0.00 0.01 0.00 0.00 72.50 68.64 1pmo s THR 208 CO 0.29 -0.49 2.30 0.33 -0.69 0.00 0.00 174.62 176.36 1pmo n PHE 209 N 4.97 3.33 0.00 4.92 7.35 -0.38 -2.44 117.46 135.21 1pmo n PHE 209 Ca -0.11 -2.98 0.00 0.00 -0.76 0.00 0.00 57.45 53.61 1pmo n PHE 209 Cb 0.43 -2.49 0.00 0.00 0.35 0.00 0.00 39.48 37.77 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 3.89 0.75 3.70 7.13 0.00 -1.21 -2.35 105.19 117.09 1pmo n GLY 210 Ca 0.55 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 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 2.84 0.20 1.61 1.01 0.80 -4.72 120.40 122.14 1pmo s VAL 211 Ca 0.00 0.42 -0.12 0.00 0.00 0.00 0.00 61.98 62.29 1pmo s VAL 211 Cb 0.00 -3.27 0.16 0.00 0.00 0.00 0.00 36.38 33.27 1pmo s VAL 211 CO 0.00 0.01 1.68 0.74 0.00 0.00 0.00 175.10 177.53 1pmo h THR 212 N 4.52 0.58 0.00 3.92 2.02 -1.90 0.50 112.91 122.56 1pmo h THR 212 Ca -0.43 -0.06 -0.08 0.00 0.77 0.00 0.00 66.41 66.62 1pmo h THR 212 Cb 1.20 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 1pmo h THR 212 CO 0.93 0.03 -0.37 1.88 0.37 0.00 0.00 175.52 178.36 1pmo h TYR 213 N 0.16 0.00 0.00 3.16 0.05 -1.87 -3.39 116.97 115.08 1pmo h TYR 213 Ca 0.29 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.07 1pmo h TYR 213 Cb 0.45 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.19 1pmo h TYR 213 CO -0.31 0.37 -0.67 0.25 -1.05 0.00 0.00 178.16 176.75 1pmo n THR 214 N -3.55 0.00 -0.00 -2.88 -2.24 -1.08 -4.92 114.28 99.62 1pmo n THR 214 Ca -0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1pmo n THR 214 Cb 0.50 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 68.07 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 2.16 0.08 3.80 3.38 0.00 0.17 -4.55 105.19 110.24 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 -2.08 5.95 0.10 1.61 0.01 -1.26 -1.49 114.94 117.77 1pmo s ASN 216 Ca 0.00 1.84 -0.15 0.00 -0.71 0.00 0.00 52.86 53.84 1pmo s ASN 216 Cb 0.00 -2.54 -0.07 0.00 0.41 0.00 0.00 41.25 39.05 1pmo s ASN 216 CO 0.00 -1.05 0.52 -0.31 -1.51 0.00 0.00 177.10 174.74 1pmo s TYR 217 N -2.33 3.67 -0.30 2.20 2.02 -0.13 -0.14 117.35 122.35 1pmo s TYR 217 Ca 0.65 1.08 -0.12 0.00 -0.37 0.00 0.00 57.07 58.31 1pmo s TYR 217 Cb -0.16 -2.37 -0.03 0.00 -0.40 0.00 0.00 41.96 39.00 1pmo s TYR 217 CO 0.32 0.51 0.20 -1.21 -1.57 0.00 0.00 175.55 173.81 1pmo s GLU 218 N -1.60 3.74 -0.35 -0.62 2.02 -1.02 -4.88 118.70 115.98 1pmo s GLU 218 Ca 0.33 -0.47 -0.29 0.00 0.02 0.00 0.00 54.97 54.56 1pmo s GLU 218 Cb -0.16 -3.70 0.02 0.00 0.10 0.00 0.00 34.13 30.38 1pmo s GLU 218 CO 0.18 -0.29 1.14 -0.06 0.02 0.00 0.00 175.26 176.25 1pmo s PHE 219 N 1.73 2.97 0.35 1.61 0.08 -1.26 -4.46 117.98 119.01 1pmo s PHE 219 Ca 0.07 1.01 0.05 0.00 0.12 0.00 0.00 56.93 58.17 1pmo s PHE 219 Cb -0.17 -3.92 0.66 0.00 -0.57 0.00 0.00 43.02 39.03 1pmo s PHE 219 CO 0.10 -1.09 1.93 -1.35 -0.10 0.00 0.00 175.22 174.71 1pmo h PRO 220 N 8.63 0.57 0.18 0.24 0.11 -1.89 -3.32 132.00 136.53 1pmo h PRO 220 Ca -0.22 -0.09 0.01 0.00 0.11 0.00 0.00 66.00 65.81 1pmo h PRO 220 Cb 1.07 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 32.03 1pmo h PRO 220 CO 1.06 0.51 -0.46 0.37 -0.21 0.00 0.00 178.00 179.27 1pmo h GLN 221 N 0.57 -0.71 -0.59 1.05 5.75 -1.93 0.40 115.11 119.64 1pmo h GLN 221 Ca 0.13 0.05 0.03 0.00 -0.15 0.00 0.00 58.65 58.71 1pmo h GLN 221 Cb 0.18 0.16 -0.03 0.00 1.07 0.00 0.00 27.48 28.86 1pmo h GLN 221 CO -0.01 -0.47 0.39 -1.35 -2.65 0.00 0.00 178.83 174.75 1pmo h PRO 222 N -0.73 0.70 -0.21 -2.39 0.11 -1.93 -0.44 132.00 127.10 1pmo h PRO 222 Ca 0.00 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 65.94 1pmo h PRO 222 Cb 0.73 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.67 1pmo h PRO 222 CO -0.22 0.46 -0.42 -0.07 -0.21 0.00 0.00 178.00 177.54 1pmo h LEU 223 N 0.72 0.54 -0.51 2.35 3.38 -1.54 -2.35 115.31 117.90 1pmo h LEU 223 Ca 0.23 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1pmo h LEU 223 Cb 0.04 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1pmo h LEU 223 CO -0.06 0.89 0.20 -0.74 0.09 0.00 0.00 178.44 178.82 1pmo h HIS 224 N 0.42 0.78 -0.54 1.13 2.76 0.12 -1.50 115.15 118.32 1pmo h HIS 224 Ca 0.03 -0.06 -0.00 0.00 -2.20 0.00 0.00 60.37 58.14 1pmo h HIS 224 Cb 0.91 -0.23 -0.03 0.00 1.55 0.00 0.00 27.41 29.61 1pmo h HIS 224 CO 0.03 0.65 0.33 -0.44 -1.30 0.00 0.00 177.93 177.21 1pmo h ASP 225 N 0.69 0.64 -0.46 3.26 3.32 -0.93 -1.44 116.42 121.50 1pmo h ASP 225 Ca 0.17 -0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 1pmo h ASP 225 Cb 0.21 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 1pmo h ASP 225 CO -0.01 0.50 0.22 0.00 -1.72 0.00 0.00 179.24 178.23 1pmo h ALA 226 N 1.17 1.45 -0.02 3.45 0.00 -1.10 -1.54 119.26 122.67 1pmo h ALA 226 Ca 0.20 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 1pmo h ALA 226 Cb -0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1pmo h ALA 226 CO -0.04 0.43 -0.55 -0.07 0.00 0.00 0.00 179.25 179.02 1pmo h LEU 227 N 0.70 0.06 -0.32 0.00 3.38 -0.74 0.09 115.31 118.49 1pmo h LEU 227 Ca 0.17 -0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.99 1pmo h LEU 227 Cb 0.10 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1pmo h LEU 227 CO -0.02 0.60 -0.27 0.44 0.09 0.00 0.00 178.44 179.28 1pmo h ASP 228 N 0.04 0.79 -0.00 -0.43 3.32 -0.41 -1.65 116.42 118.08 1pmo h ASP 228 Ca -0.00 -0.45 -0.09 0.00 0.02 0.00 0.00 57.03 56.50 1pmo h ASP 228 Cb 0.98 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 1pmo h ASP 228 CO 0.07 1.08 -0.26 0.50 -1.72 0.00 0.00 179.24 178.91 1pmo h LYS 229 N 0.51 0.42 -0.23 3.56 3.64 -1.12 -1.84 116.57 121.52 1pmo h LYS 229 Ca 0.06 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.27 1pmo h LYS 229 Cb 0.84 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.62 1pmo h LYS 229 CO 0.07 0.66 0.10 0.35 -2.27 0.00 0.00 179.45 178.35 1pmo h PHE 230 N 0.37 0.35 -0.47 1.91 3.57 -0.73 -0.18 116.94 121.76 1pmo h PHE 230 Ca 0.05 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 1pmo h PHE 230 Cb 0.66 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.27 1pmo h PHE 230 CO 0.02 0.37 0.15 0.37 -2.23 0.00 0.00 178.31 176.99 1pmo h GLN 231 N 0.23 0.69 -0.54 1.11 4.15 -1.12 0.39 115.11 120.03 1pmo h GLN 231 Ca 0.08 -0.11 -0.06 0.00 0.77 0.00 0.00 58.65 59.33 1pmo h GLN 231 Cb 0.16 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.72 1pmo h GLN 231 CO -0.01 0.60 0.11 0.00 -1.93 0.00 0.00 178.83 177.61 1pmo h ALA 232 N 1.49 0.71 0.00 3.38 0.00 -0.80 0.40 119.26 124.45 1pmo h ALA 232 Ca 0.16 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.68 1pmo h ALA 232 Cb 0.20 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1pmo h ALA 232 CO -0.01 0.43 -0.79 -0.44 0.00 0.00 0.00 179.25 178.44 1pmo h ASP 233 N 0.77 0.00 0.00 0.00 3.32 -0.59 -3.40 116.42 116.52 1pmo h ASP 233 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1pmo h ASP 233 Cb 0.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.92 1pmo h ASP 233 CO 0.01 0.75 -0.33 0.35 -1.72 0.00 0.00 179.24 178.30 1pmo n THR 234 N -3.27 0.00 0.00 0.35 -2.24 0.09 -5.01 114.28 104.20 1pmo n THR 234 Ca 0.00 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1pmo n THR 234 Cb 0.84 0.71 0.00 0.00 -2.10 0.00 0.00 70.33 69.78 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 1.21 2.16 3.66 3.38 0.00 0.14 -5.00 105.19 110.74 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 -2.60 4.29 -0.45 -0.61 1.01 -1.26 -4.93 121.20 116.64 1pmo s ILE 236 Ca 0.00 1.55 -0.14 0.00 0.00 0.00 0.00 60.65 62.07 1pmo s ILE 236 Cb 0.00 -4.01 0.07 0.00 0.01 0.00 0.00 42.46 38.54 1pmo s ILE 236 CO 0.00 -0.14 0.35 -0.62 0.00 0.00 0.00 174.94 174.53 1pmo s ASP 237 N 1.97 5.99 -0.14 3.58 2.15 -1.26 -3.56 116.67 125.40 1pmo s ASP 237 Ca 0.55 -1.35 -0.03 0.00 0.43 0.00 0.00 52.55 52.15 1pmo s ASP 237 Cb -0.21 -2.12 -0.03 0.00 -0.30 0.00 0.00 42.92 40.26 1pmo s ASP 237 CO 0.14 -0.60 -0.05 -0.63 -0.17 0.00 0.00 175.17 173.87 1pmo s ILE 238 N 1.58 3.82 0.56 4.11 1.01 -1.26 -5.07 121.20 125.95 1pmo s ILE 238 Ca 0.04 -0.39 0.09 0.00 0.00 0.00 0.00 60.65 60.38 1pmo s ILE 238 Cb -0.24 -2.65 0.08 0.00 0.01 0.00 0.00 42.46 39.66 1pmo s ILE 238 CO 0.05 0.51 0.78 -1.81 0.00 0.00 0.00 174.94 174.47 1pmo s ASP 239 N 0.18 5.12 0.11 3.58 1.01 -1.26 -4.94 116.67 120.47 1pmo s ASP 239 Ca -0.02 -0.74 0.06 0.00 0.71 0.00 0.00 52.55 52.56 1pmo s ASP 239 Cb -0.14 0.13 -0.04 0.00 1.01 0.00 0.00 42.92 43.88 1pmo s ASP 239 CO 0.03 -1.30 -0.15 -0.04 0.21 0.00 0.00 175.17 173.92 1pmo s MET 240 N -4.66 0.99 -0.09 8.23 -1.94 -0.34 -1.40 119.30 120.10 1pmo s MET 240 Ca 0.61 -1.16 0.01 0.00 -1.71 0.00 0.00 55.69 53.44 1pmo s MET 240 Cb -0.06 -0.96 0.02 0.00 2.01 0.00 0.00 34.83 35.83 1pmo s MET 240 CO 0.39 0.20 -0.11 -1.58 -0.01 0.00 0.00 175.02 173.90 1pmo s HIS 241 N -1.79 1.52 -0.25 -0.03 2.46 -0.77 -1.62 115.29 114.81 1pmo s HIS 241 Ca 0.06 -0.64 -0.16 0.00 0.47 0.00 0.00 55.06 54.78 1pmo s HIS 241 Cb -0.07 -1.16 -0.03 0.00 -0.13 0.00 0.00 32.58 31.19 1pmo s HIS 241 CO 0.03 -0.37 0.45 0.42 -2.47 0.00 0.00 174.74 172.79 1pmo s ILE 242 N 1.03 5.13 -0.89 0.89 -1.09 -0.65 -3.46 121.20 122.15 1pmo s ILE 242 Ca -0.08 0.74 -0.19 0.00 -2.23 0.00 0.00 60.65 58.89 1pmo s ILE 242 Cb -0.15 -3.77 0.12 0.00 -1.58 0.00 0.00 42.46 37.09 1pmo s ILE 242 CO -0.01 0.14 1.11 -0.62 -1.23 0.00 0.00 174.94 174.33 1pmo s ASP 243 N 1.49 6.56 -0.60 3.58 -1.08 -0.68 -1.85 116.67 124.09 1pmo s ASP 243 Ca 0.19 -1.88 0.01 0.00 -0.52 0.00 0.00 52.55 50.34 1pmo s ASP 243 Cb -0.16 -2.41 0.43 0.00 -1.46 0.00 0.00 42.92 39.33 1pmo s ASP 243 CO 0.09 -1.13 1.77 0.00 0.52 0.00 0.00 175.17 176.43 1pmo n ALA 244 N 6.76 5.98 -0.34 3.66 0.00 0.25 -1.25 120.51 135.57 1pmo n ALA 244 Ca 0.20 -3.74 0.08 0.00 0.00 0.00 0.00 53.44 49.98 1pmo n ALA 244 Cb 0.49 -1.39 0.17 0.00 0.00 0.00 0.00 19.45 18.71 1pmo n ALA 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pmo n ALA 245 N -0.77 0.29 -0.10 0.00 0.00 -1.21 -0.85 120.51 117.88 1pmo n ALA 245 Ca 0.55 1.06 -0.20 0.00 0.00 0.00 0.00 53.44 54.85 1pmo n ALA 245 Cb 0.65 -0.66 -0.08 0.00 0.00 0.00 0.00 19.45 19.36 1pmo n ALA 245 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1pmo n SER 246 N -5.54 1.80 0.27 0.00 3.41 -1.26 -1.07 113.62 111.23 1pmo n SER 246 Ca 0.17 0.14 0.11 0.00 -0.26 0.00 0.00 58.87 59.02 1pmo n SER 246 Cb 0.54 -0.51 0.74 0.00 -0.26 0.00 0.00 64.21 64.71 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 -0.01 0.00 1.57 5.00 0.00 -1.42 -3.06 103.07 105.15 1pmo h GLY 247 Ca -0.50 0.00 0.01 0.00 0.00 0.00 0.00 47.33 46.84 1pmo h GLY 247 CO -0.24 0.00 0.20 -1.33 0.00 0.00 0.00 176.54 175.17 1pmo h GLY 248 N 0.18 0.00 -0.52 4.60 0.00 -1.22 -0.88 103.07 105.24 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 -0.17 0.69 0.00 0.00 0.00 176.54 177.07 1pmo n PHE 249 N -3.15 0.10 0.02 5.60 3.72 -1.15 -4.66 117.46 117.94 1pmo n PHE 249 Ca -0.01 -1.18 0.00 0.00 -0.05 0.00 0.00 57.45 56.20 1pmo n PHE 249 Cb 0.27 -0.21 0.00 0.00 -0.94 0.00 0.00 39.48 38.60 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 0.36 -0.35 4.37 4.77 -0.36 -4.78 117.00 119.74 1pmo n LEU 250 Ca 0.18 0.05 0.09 0.00 -0.03 0.00 0.00 56.01 56.30 1pmo n LEU 250 Cb 0.69 -0.11 0.26 0.00 -2.33 0.00 0.00 43.42 41.94 1pmo n LEU 250 CO 0.01 -0.59 1.21 0.00 -1.33 0.00 0.00 177.39 176.69 1pmo h ALA 251 N 0.00 1.53 -0.08 -1.18 0.00 -1.79 -1.04 119.26 116.70 1pmo h ALA 251 Ca 0.00 0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1pmo h ALA 251 Cb 0.00 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1pmo h ALA 251 CO 0.00 0.11 0.16 -1.35 0.00 0.00 0.00 179.25 178.17 1pmo h PRO 252 N 0.88 0.00 0.00 0.00 0.11 -1.80 0.66 132.00 131.85 1pmo h PRO 252 Ca 0.52 0.00 -0.37 0.00 0.11 0.00 0.00 66.00 66.26 1pmo h PRO 252 Cb 0.63 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.68 1pmo h PRO 252 CO -0.31 0.00 -2.32 1.19 -0.21 0.00 0.00 178.00 176.34 1pmo n PHE 253 N -3.43 0.00 0.90 0.65 3.72 -0.48 -4.44 117.46 114.38 1pmo n PHE 253 Ca -0.01 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.49 1pmo n PHE 253 Cb 0.25 -0.88 -0.06 0.00 -0.94 0.00 0.00 39.48 37.85 1pmo n PHE 253 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 1pmo n VAL 254 N -3.51 0.00 -2.92 -4.37 0.24 -0.71 -4.69 118.33 102.37 1pmo n VAL 254 Ca -0.43 -0.15 -0.13 0.00 -2.04 0.00 0.00 64.34 61.58 1pmo n VAL 254 Cb 0.90 1.10 0.03 0.00 -1.47 0.00 0.00 33.84 34.39 1pmo n VAL 254 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1pmo n ALA 255 N -0.85 0.27 0.22 2.33 0.00 0.17 -4.91 120.51 117.74 1pmo n ALA 255 Ca 0.06 -2.24 0.13 0.00 0.00 0.00 0.00 53.44 51.39 1pmo n ALA 255 Cb 0.35 -1.09 0.74 0.00 0.00 0.00 0.00 19.45 19.46 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 3.39 0.00 0.00 0.00 0.11 -1.64 -2.69 132.00 131.18 1pmo h PRO 256 Ca -0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1pmo h PRO 256 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1pmo h PRO 256 CO 0.32 0.00 0.00 -0.44 -0.21 0.00 0.00 178.00 177.67 1pmo h ASP 257 N 0.00 0.00 -2.89 -2.05 3.32 -1.94 -3.43 116.42 109.43 1pmo h ASP 257 Ca 0.05 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.54 1pmo h ASP 257 Cb 0.23 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.75 1pmo h ASP 257 CO -0.00 0.00 0.89 -0.63 -1.72 0.00 0.00 179.24 177.78 1pmo s ILE 258 N -3.38 4.09 -0.54 0.35 1.01 -1.01 -4.96 121.20 116.76 1pmo s ILE 258 Ca 0.04 1.35 -0.20 0.00 0.00 0.00 0.00 60.65 61.85 1pmo s ILE 258 Cb 0.09 -3.87 0.07 0.00 0.01 0.00 0.00 42.46 38.76 1pmo s ILE 258 CO 0.48 -0.09 0.70 -0.69 0.00 0.00 0.00 174.94 175.34 1pmo s VAL 259 N 3.24 4.77 0.00 2.92 1.01 -1.26 -4.74 120.40 126.33 1pmo s VAL 259 Ca 0.59 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 62.09 1pmo s VAL 259 Cb -0.25 -4.39 0.00 0.00 0.00 0.00 0.00 36.38 31.73 1pmo s VAL 259 CO 0.20 -0.95 0.00 -2.67 0.00 0.00 0.00 175.10 171.68 1pmo n TRP 260 N 6.47 0.00 -0.50 5.22 4.27 -1.26 -3.82 117.44 127.81 1pmo n TRP 260 Ca -0.06 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.55 1pmo n TRP 260 Cb 0.45 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.40 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 -0.19 0.00 0.00 -0.67 5.68 -1.26 -4.87 116.55 115.24 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 0.25 0.00 -1.14 0.00 0.00 41.12 40.23 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 -1.01 -1.65 117.46 120.92 1pmo n PHE 262 Ca 0.00 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.56 1pmo n PHE 262 Cb 0.00 -0.25 0.79 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 -5.40 -1.08 3.08 -1.78 -3.39 114.38 105.81 1pmo h ARG 263 Ca 0.00 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.43 1pmo h ARG 263 Cb 0.08 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.00 1pmo h ARG 263 CO 0.00 0.06 0.04 -0.51 -1.07 0.00 0.00 179.97 178.49 1pmo s LEU 264 N -6.55 4.08 0.29 3.04 1.43 -0.66 -4.98 118.68 115.33 1pmo s LEU 264 Ca -0.01 0.53 0.03 0.00 -1.03 0.00 0.00 54.13 53.65 1pmo s LEU 264 Cb 0.11 -2.72 0.73 0.00 0.03 0.00 0.00 46.19 44.34 1pmo s LEU 264 CO 0.54 -0.34 1.66 -0.65 0.23 0.00 0.00 176.35 177.79 1pmo h PRO 265 N 8.03 0.27 0.00 1.29 0.11 -1.88 -1.65 132.00 138.17 1pmo h PRO 265 Ca -0.28 -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 32.18 1pmo h PRO 265 CO 0.74 0.18 0.00 0.00 -0.21 0.00 0.00 178.00 178.71 1pmo h ARG 266 N 0.28 0.00 -6.25 1.05 3.08 -1.93 -3.42 114.38 107.18 1pmo h ARG 266 Ca 0.56 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 60.07 1pmo h ARG 266 Cb 1.12 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.13 1pmo h ARG 266 CO -0.61 0.00 1.22 0.08 -1.07 0.00 0.00 179.97 179.59 1pmo s VAL 267 N -3.39 3.59 -0.15 2.04 1.01 -0.62 -1.20 120.40 121.68 1pmo s VAL 267 Ca 0.05 0.50 0.19 0.00 0.00 0.00 0.00 61.98 62.72 1pmo s VAL 267 Cb 0.09 -4.08 -0.13 0.00 0.00 0.00 0.00 36.38 32.25 1pmo s VAL 267 CO 0.53 -0.88 0.78 0.29 0.00 0.00 0.00 175.10 175.82 1pmo n LYS 268 N 8.72 0.63 -3.59 2.72 4.01 -0.64 -4.72 118.16 125.29 1pmo n LYS 268 Ca 0.18 0.13 -0.13 0.00 -0.51 0.00 0.00 58.31 57.97 1pmo n LYS 268 Cb 0.49 -1.76 -0.05 0.00 -0.51 0.00 0.00 35.03 33.20 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 -5.48 -0.39 -0.02 4.39 1.04 -1.24 -0.81 113.70 111.20 1pmo s SER 269 Ca -0.03 0.09 -0.02 0.00 0.48 0.00 0.00 55.95 56.46 1pmo s SER 269 Cb 0.09 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.70 1pmo s SER 269 CO 0.82 -0.73 0.06 -0.63 0.98 0.00 0.00 173.24 173.74 1pmo s ILE 270 N -2.61 0.02 0.11 -1.02 1.01 -0.25 -1.64 121.20 116.82 1pmo s ILE 270 Ca -0.04 -0.20 0.05 0.00 0.00 0.00 0.00 60.65 60.46 1pmo s ILE 270 Cb -0.00 -0.16 -0.04 0.00 0.01 0.00 0.00 42.46 42.27 1pmo s ILE 270 CO -0.03 -0.11 -0.13 -0.94 0.00 0.00 0.00 174.94 173.73 1pmo s SER 271 N -0.31 1.83 0.16 3.58 1.04 -0.77 -0.64 113.70 118.58 1pmo s SER 271 Ca -0.04 -0.77 -0.23 0.00 0.48 0.00 0.00 55.95 55.40 1pmo s SER 271 Cb -0.03 -0.05 0.07 0.00 0.10 0.00 0.00 66.02 66.11 1pmo s SER 271 CO 0.00 -0.15 0.62 0.00 0.98 0.00 0.00 173.24 174.69 1pmo s ALA 272 N -1.99 -1.59 -0.25 5.32 0.00 -0.09 -0.58 121.76 122.58 1pmo s ALA 272 Ca 0.06 0.47 -0.10 0.00 0.00 0.00 0.00 51.96 52.39 1pmo s ALA 272 Cb -0.06 0.86 -0.05 0.00 0.00 0.00 0.00 23.12 23.88 1pmo s ALA 272 CO 0.02 -0.78 0.16 -1.12 0.00 0.00 0.00 175.76 174.05 1pmo s SER 273 N -2.75 6.02 0.18 0.00 0.01 -0.23 -0.79 113.70 116.14 1pmo s SER 273 Ca 0.02 0.05 -0.04 0.00 1.31 0.00 0.00 55.95 57.29 1pmo s SER 273 Cb -0.01 -2.10 0.08 0.00 0.21 0.00 0.00 66.02 64.20 1pmo s SER 273 CO -0.12 0.02 1.48 1.23 0.41 0.00 0.00 173.24 176.26 1pmo h GLY 274 N 7.82 0.62 -0.13 3.44 0.00 -1.07 -3.07 103.07 110.68 1pmo h GLY 274 Ca -0.37 -0.75 0.00 0.00 0.00 0.00 0.00 47.33 46.22 1pmo h GLY 274 CO 0.62 0.67 0.00 -2.39 0.00 0.00 0.00 176.54 175.43 1pmo n HIS 275 N -3.94 0.00 0.00 5.60 1.44 -1.03 -0.41 115.22 116.88 1pmo n HIS 275 Ca -0.04 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.67 1pmo n HIS 275 Cb 0.63 -0.01 0.00 0.00 0.12 0.00 0.00 29.99 30.73 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 -0.43 0.00 0.00 -1.40 5.02 -1.16 -1.32 118.16 118.86 1pmo n LYS 276 Ca 0.00 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.39 1pmo n LYS 276 Cb 0.03 0.00 0.57 0.00 -0.02 0.00 0.00 35.03 35.61 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 0.68 2.13 3.01 -1.26 -1.73 117.46 120.28 1pmo n PHE 277 Ca 0.00 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.57 1pmo n PHE 277 Cb 0.00 -0.03 0.47 0.00 -0.01 0.00 0.00 39.48 39.90 1pmo n PHE 277 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1pmo n GLY 278 N 0.23 -1.36 2.71 1.37 0.00 -1.08 -4.86 105.19 102.20 1pmo n GLY 278 Ca 0.14 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 -1.79 0.34 -4.88 0.99 4.77 -0.49 -4.90 117.00 111.04 1pmo n LEU 279 Ca 0.05 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.73 1pmo n LEU 279 Cb 0.29 -0.92 0.02 0.00 -2.33 0.00 0.00 43.42 40.48 1pmo n LEU 279 CO 0.23 -0.27 0.67 0.00 -1.33 0.00 0.00 177.39 176.69 1pmo s ALA 280 N -2.16 3.10 0.73 -1.18 0.00 0.45 -4.97 121.76 117.73 1pmo s ALA 280 Ca 0.00 -0.28 -0.11 0.00 0.00 0.00 0.00 51.96 51.57 1pmo s ALA 280 Cb 0.00 -2.95 0.03 0.00 0.00 0.00 0.00 23.12 20.20 1pmo s ALA 280 CO 0.00 -0.79 1.08 -2.14 0.00 0.00 0.00 175.76 173.90 1pmo s PRO 281 N -5.16 2.64 0.10 0.00 0.02 -1.26 -3.96 135.00 127.38 1pmo s PRO 281 Ca 0.55 1.07 -0.36 0.00 0.02 0.00 0.00 61.00 62.29 1pmo s PRO 281 Cb -0.11 -1.95 -0.17 0.00 0.02 0.00 0.00 34.50 32.29 1pmo s PRO 281 CO 0.51 -1.34 1.13 1.28 -0.33 0.00 0.00 177.00 178.25 1pmo n LEU 282 N -3.25 0.88 0.00 -5.54 4.77 -1.26 -3.85 117.00 108.75 1pmo n LEU 282 Ca 0.08 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 57.20 1pmo n LEU 282 Cb 0.53 -1.10 0.00 0.00 -2.33 0.00 0.00 43.42 40.52 1pmo n LEU 282 CO 0.54 -1.55 0.00 0.61 -1.33 0.00 0.00 177.39 175.66 1pmo n GLY 283 N 2.02 1.73 2.84 -0.72 0.00 -1.25 -4.93 105.19 104.87 1pmo n GLY 283 Ca 0.18 0.00 -0.16 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 1.84 1.56 -0.08 0.00 0.00 0.69 -0.45 107.32 110.89 1pmo s GLY 285 Ca -0.01 -1.78 -0.08 0.00 0.00 0.00 0.00 44.72 42.86 1pmo s GLY 285 CO -0.05 -1.55 0.21 -0.98 0.00 0.00 0.00 173.10 170.73 1pmo s TRP 286 N -3.80 -0.23 -0.03 1.90 0.52 0.03 -1.06 118.94 116.28 1pmo s TRP 286 Ca 0.35 0.55 -0.01 0.00 0.02 0.00 0.00 56.10 57.01 1pmo s TRP 286 Cb 0.07 0.08 0.03 0.00 -1.15 0.00 0.00 33.47 32.50 1pmo s TRP 286 CO 0.11 -0.12 0.04 0.54 0.02 0.00 0.00 176.95 177.54 1pmo s VAL 287 N 0.05 -0.06 0.04 4.03 0.11 -0.92 -0.91 120.40 122.73 1pmo s VAL 287 Ca -0.01 0.28 0.09 0.00 -2.93 0.00 0.00 61.98 59.41 1pmo s VAL 287 Cb -0.02 -0.11 -0.03 0.00 -1.53 0.00 0.00 36.38 34.69 1pmo s VAL 287 CO 0.00 0.12 -0.24 -0.63 -3.33 0.00 0.00 175.10 171.02 1pmo s ILE 288 N 1.42 1.97 0.08 7.04 -1.09 0.19 -1.35 121.20 129.45 1pmo s ILE 288 Ca -0.05 -1.30 0.06 0.00 -2.23 0.00 0.00 60.65 57.13 1pmo s ILE 288 Cb -0.13 -1.69 -0.04 0.00 -1.58 0.00 0.00 42.46 39.03 1pmo s ILE 288 CO -0.03 0.33 -0.07 0.26 -1.23 0.00 0.00 174.94 174.20 1pmo s TRP 289 N -0.78 2.83 0.24 3.97 0.51 0.50 -1.09 118.94 125.11 1pmo s TRP 289 Ca 0.10 -0.10 -0.05 0.00 -2.12 0.00 0.00 56.10 53.93 1pmo s TRP 289 Cb -0.10 -1.50 0.40 0.00 -0.81 0.00 0.00 33.47 31.46 1pmo s TRP 289 CO 0.02 0.42 1.80 -0.09 -0.51 0.00 0.00 176.95 178.58 1pmo h ARG 290 N 3.81 0.70 0.00 4.98 2.43 -1.26 -3.39 114.38 121.65 1pmo h ARG 290 Ca -0.48 -0.04 0.12 0.00 -0.81 0.00 0.00 59.98 58.76 1pmo h ARG 290 Cb 1.17 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.54 1pmo h ARG 290 CO 0.54 0.46 0.46 -0.40 -1.51 0.00 0.00 179.97 179.52 1pmo n ASP 291 N -4.79 -1.45 -0.31 -3.80 5.68 -1.26 -4.12 116.55 106.50 1pmo n ASP 291 Ca 0.13 -1.79 0.04 0.00 -0.50 0.00 0.00 54.79 52.67 1pmo n ASP 291 Cb 0.30 2.37 0.18 0.00 -1.14 0.00 0.00 41.12 42.82 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 0.83 0.00 0.11 4.39 -1.92 -1.50 114.58 116.48 1pmo h GLU 292 Ca -0.23 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.42 1pmo h GLU 292 Cb 0.98 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 29.44 1pmo h GLU 292 CO 0.30 0.55 -0.03 0.93 -1.16 0.00 0.00 179.01 179.59 1pmo h GLU 293 N 0.85 0.00 0.00 2.33 4.39 -2.00 -1.80 114.58 118.35 1pmo h GLU 293 Ca 0.42 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.12 1pmo h GLU 293 Cb 0.37 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 1pmo h GLU 293 CO -0.25 0.03 0.00 0.00 -1.16 0.00 0.00 179.01 177.64 1pmo h ALA 294 N 1.97 1.00 -3.55 3.43 0.00 -1.62 -3.40 119.26 117.08 1pmo h ALA 294 Ca -0.00 0.00 -0.67 0.00 0.00 0.00 0.00 54.91 54.24 1pmo h ALA 294 Cb 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 17.79 17.48 1pmo h ALA 294 CO 0.00 0.00 -0.69 -1.17 0.00 0.00 0.00 179.25 177.40 1pmo s LEU 295 N -5.62 4.54 -0.09 0.00 2.96 -0.68 -4.88 118.68 114.90 1pmo s LEU 295 Ca 0.03 -1.86 -0.34 0.00 -0.22 0.00 0.00 54.13 51.73 1pmo s LEU 295 Cb 0.09 -1.68 -0.12 0.00 0.50 0.00 0.00 46.19 44.98 1pmo s LEU 295 CO 0.50 -0.37 1.88 -2.65 -1.32 0.00 0.00 176.35 174.39 1pmo n PRO 296 N 4.43 2.17 0.33 0.98 -0.02 -1.26 -4.83 135.00 136.78 1pmo n PRO 296 Ca -0.03 0.79 0.21 0.00 -2.02 0.00 0.00 63.50 62.45 1pmo n PRO 296 Cb 0.42 -2.64 1.11 0.00 -0.02 0.00 0.00 33.50 32.37 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 9.18 0.00 0.00 -0.52 1.08 -1.95 -1.56 115.11 121.34 1pmo h GLN 297 Ca -0.48 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 56.71 1pmo h GLN 297 Cb 1.27 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.70 1pmo h GLN 297 CO 0.95 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 -1.52 114.58 115.56 1pmo h GLU 298 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1pmo h GLU 298 Cb 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.03 1pmo h GLU 298 CO -0.00 0.00 -0.58 -0.07 -1.40 0.00 0.00 179.01 176.97 1pmo h LEU 299 N 0.00 0.00 -9.51 1.33 3.38 -1.65 -3.46 115.31 105.40 1pmo h LEU 299 Ca -0.00 -0.13 -0.58 0.00 0.09 0.00 0.00 57.88 57.27 1pmo h LEU 299 Cb 0.02 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.71 1pmo h LEU 299 CO 0.00 0.06 -0.06 -0.69 0.09 0.00 0.00 178.44 177.84 1pmo s VAL 300 N -3.20 4.97 -0.13 1.22 1.01 -0.57 -4.69 120.40 119.00 1pmo s VAL 300 Ca 0.05 1.13 -0.02 0.00 0.00 0.00 0.00 61.98 63.15 1pmo s VAL 300 Cb 0.12 -3.88 -0.02 0.00 0.00 0.00 0.00 36.38 32.59 1pmo s VAL 300 CO 0.72 0.43 -0.07 -0.36 0.00 0.00 0.00 175.10 175.81 1pmo s PHE 301 N -0.18 2.93 -0.22 5.22 0.40 -0.60 -4.89 117.98 120.65 1pmo s PHE 301 Ca 0.29 -0.34 -0.07 0.00 -0.60 0.00 0.00 56.93 56.21 1pmo s PHE 301 Cb -0.17 -1.87 -0.03 0.00 0.51 0.00 0.00 43.02 41.45 1pmo s PHE 301 CO 0.15 -0.01 0.07 -0.80 0.70 0.00 0.00 175.22 175.33 1pmo s ASN 302 N 0.11 5.36 0.15 1.36 0.01 -1.26 0.11 114.94 120.77 1pmo s ASN 302 Ca -0.03 -0.08 0.09 0.00 -0.71 0.00 0.00 52.86 52.13 1pmo s ASN 302 Cb -0.14 -1.94 -0.04 0.00 0.41 0.00 0.00 41.25 39.54 1pmo s ASN 302 CO 0.03 0.06 -0.13 0.68 -1.51 0.00 0.00 177.10 176.23 1pmo s VAL 303 N 1.06 3.06 0.50 1.60 -7.23 -0.77 -4.93 120.40 113.69 1pmo s VAL 303 Ca 0.04 -1.56 -0.13 0.00 -1.81 0.00 0.00 61.98 58.52 1pmo s VAL 303 Cb -0.14 -2.46 -0.06 0.00 0.56 0.00 0.00 36.38 34.27 1pmo s VAL 303 CO 0.03 -0.01 0.92 -1.81 -0.31 0.00 0.00 175.10 173.92 1pmo s ASP 304 N -2.49 6.48 -0.07 4.85 1.01 -1.26 -2.30 116.67 122.88 1pmo s ASP 304 Ca 0.22 1.36 -0.30 0.00 0.71 0.00 0.00 52.55 54.54 1pmo s ASP 304 Cb -0.10 -2.42 0.11 0.00 1.01 0.00 0.00 42.92 41.52 1pmo s ASP 304 CO 0.13 -0.59 0.95 -0.72 0.21 0.00 0.00 175.17 175.15 1pmo s TYR 305 N -2.68 -0.33 0.38 4.23 1.13 -1.08 -4.94 117.35 114.06 1pmo s TYR 305 Ca 0.55 0.31 0.18 0.00 -1.41 0.00 0.00 57.07 56.70 1pmo s TYR 305 Cb -0.10 0.51 1.14 0.00 -1.10 0.00 0.00 41.96 42.40 1pmo s TYR 305 CO 0.37 -0.45 1.70 -0.07 -2.51 0.00 0.00 175.55 174.59 1pmo h LEU 306 N 2.15 0.46 0.00 -3.49 3.38 -1.99 0.12 115.31 115.94 1pmo h LEU 306 Ca -0.20 0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1pmo h LEU 306 Cb 1.21 0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.04 1pmo h LEU 306 CO 0.30 -0.03 0.00 0.61 0.09 0.00 0.00 178.44 179.41 1pmo n GLY 307 N -1.41 -0.82 0.00 0.83 0.00 -1.26 -4.96 105.19 97.58 1pmo n GLY 307 Ca 0.30 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.25 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 0.45 1.33 3.61 -0.02 0.00 0.43 -5.04 105.19 105.95 1pmo n GLY 308 Ca 0.08 -0.81 -0.10 0.00 0.00 0.00 0.00 46.02 45.18 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 0.59 0.00 1.61 -2.07 -1.26 -2.62 119.66 115.90 1pmo s GLN 309 Ca 0.00 0.45 0.06 0.00 -1.82 0.00 0.00 55.36 54.05 1pmo s GLN 309 Cb 0.00 0.28 -0.02 0.00 -1.09 0.00 0.00 33.01 32.18 1pmo s GLN 309 CO 0.00 -0.12 -0.19 0.42 -1.32 0.00 0.00 175.29 174.08 1pmo s ILE 310 N -0.30 1.51 -0.03 3.63 1.01 -0.97 -4.94 121.20 121.11 1pmo s ILE 310 Ca 0.00 -0.90 -0.15 0.00 0.00 0.00 0.00 60.65 59.60 1pmo s ILE 310 Cb -0.03 -1.27 -0.05 0.00 0.01 0.00 0.00 42.46 41.11 1pmo s ILE 310 CO -0.02 0.35 0.40 -0.83 0.00 0.00 0.00 174.94 174.84 1pmo s GLY 311 N -0.65 2.44 -0.01 6.18 0.00 -1.26 -1.84 107.32 112.19 1pmo s GLY 311 Ca 0.07 -0.25 0.02 0.00 0.00 0.00 0.00 44.72 44.56 1pmo s GLY 311 CO -0.00 0.21 -0.07 -1.59 0.00 0.00 0.00 173.10 171.66 1pmo s THR 312 N -0.78 0.55 -0.39 0.90 2.01 0.12 -4.91 115.64 113.13 1pmo s THR 312 Ca 0.23 -0.27 0.02 0.00 0.31 0.00 0.00 61.69 61.98 1pmo s THR 312 Cb -0.16 -0.48 0.12 0.00 0.01 0.00 0.00 72.50 71.99 1pmo s THR 312 CO 0.12 0.16 0.16 0.12 -0.69 0.00 0.00 174.62 174.50 1pmo s PHE 313 N -0.02 2.38 0.01 4.92 5.36 -1.26 -1.56 117.98 127.80 1pmo s PHE 313 Ca 0.01 -2.42 -0.24 0.00 -0.96 0.00 0.00 56.93 53.31 1pmo s PHE 313 Cb -0.04 -2.15 0.05 0.00 -0.34 0.00 0.00 43.02 40.54 1pmo s PHE 313 CO -0.00 -0.84 0.54 0.00 -1.46 0.00 0.00 175.22 173.46 1pmo s ALA 314 N 0.76 -1.40 0.00 11.12 0.00 -1.26 -4.95 121.76 126.02 1pmo s ALA 314 Ca 0.14 0.80 -0.12 0.00 0.00 0.00 0.00 51.96 52.77 1pmo s ALA 314 Cb -0.22 0.21 -0.33 0.00 0.00 0.00 0.00 23.12 22.79 1pmo s ALA 314 CO -0.09 -0.43 0.87 0.82 0.00 0.00 0.00 175.76 176.94 1pmo h ILE 315 N 3.01 1.15 -3.73 0.00 2.04 -1.98 -3.46 117.51 114.54 1pmo h ILE 315 Ca -0.29 -2.66 -0.46 0.00 1.00 0.00 0.00 64.86 62.45 1pmo h ILE 315 Cb 1.18 2.91 0.07 0.00 -0.74 0.00 0.00 36.82 40.25 1pmo h ILE 315 CO 0.40 0.83 0.21 0.20 0.00 0.00 0.00 178.15 179.80 1pmo s ASN 316 N -7.41 5.10 0.00 1.72 0.01 -1.26 -5.07 114.94 108.02 1pmo s ASN 316 Ca -0.11 0.55 0.00 0.00 -0.71 0.00 0.00 52.86 52.59 1pmo s ASN 316 Cb 0.05 -1.32 0.00 0.00 0.41 0.00 0.00 41.25 40.39 1pmo s ASN 316 CO 0.90 -1.41 0.00 0.33 -1.51 0.00 0.00 177.10 175.42 1pmo n PHE 317 N -2.80 0.00 -2.26 2.20 7.35 -1.26 -5.06 117.46 115.62 1pmo n PHE 317 Ca 0.07 0.00 -0.42 0.00 -0.76 0.00 0.00 57.45 56.34 1pmo n PHE 317 Cb 0.59 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 6.93 -0.04 -2.13 0.01 -1.26 -4.41 113.70 113.80 1pmo s SER 318 Ca 0.00 2.26 -0.30 0.00 1.31 0.00 0.00 55.95 59.22 1pmo s SER 318 Cb 0.00 -2.59 0.11 0.00 0.21 0.00 0.00 66.02 63.75 1pmo s SER 318 CO 0.00 -0.55 0.93 0.00 0.41 0.00 0.00 173.24 174.04 1pmo s ARG 319 N 0.65 0.74 0.53 12.44 1.70 -1.26 -5.03 118.95 128.72 1pmo s ARG 319 Ca 0.60 -0.24 -0.21 0.00 -0.47 0.00 0.00 55.73 55.41 1pmo s ARG 319 Cb -0.34 0.34 -0.06 0.00 -0.57 0.00 0.00 34.95 34.32 1pmo s ARG 319 CO 0.33 -0.32 1.19 -1.25 -1.08 0.00 0.00 175.30 174.17 1pmo s PRO 320 N -2.87 3.37 0.00 3.89 0.04 -1.26 -0.51 135.00 137.67 1pmo s PRO 320 Ca 0.05 1.79 0.22 0.00 0.04 0.00 0.00 61.00 63.10 1pmo s PRO 320 Cb -0.01 -2.15 0.37 0.00 0.04 0.00 0.00 34.50 32.75 1pmo s PRO 320 CO -0.08 -0.87 1.34 0.00 0.04 0.00 0.00 177.00 177.43 1pmo n ALA 321 N -1.06 2.41 -0.32 8.56 0.00 -0.34 -4.57 120.51 125.19 1pmo n ALA 321 Ca 0.10 -0.95 0.01 0.00 0.00 0.00 0.00 53.44 52.61 1pmo n ALA 321 Cb 0.49 -0.81 0.15 0.00 0.00 0.00 0.00 19.45 19.28 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 4.24 1.33 1.37 0.00 0.00 -1.82 -2.52 103.07 105.68 1pmo h GLY 322 Ca 0.00 -0.39 -0.09 0.00 0.00 0.00 0.00 47.33 46.84 1pmo h GLY 322 CO 0.00 0.27 -0.12 1.46 0.00 0.00 0.00 176.54 178.15 1pmo h GLN 323 N 0.99 0.75 -0.34 4.80 7.50 -1.88 0.60 115.11 127.53 1pmo h GLN 323 Ca 0.39 -0.25 -0.01 0.00 0.50 0.00 0.00 58.65 59.28 1pmo h GLN 323 Cb 0.18 -0.06 -0.02 0.00 0.05 0.00 0.00 27.48 27.64 1pmo h GLN 323 CO -0.18 0.84 0.19 0.28 -1.50 0.00 0.00 178.83 178.45 1pmo h VAL 324 N 0.68 1.14 -0.53 -0.54 2.07 -1.82 0.27 116.25 117.51 1pmo h VAL 324 Ca 0.11 -0.36 -0.00 0.00 0.82 0.00 0.00 66.70 67.27 1pmo h VAL 324 Cb 0.59 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 1pmo h VAL 324 CO 0.04 0.14 0.32 0.40 0.02 0.00 0.00 177.57 178.49 1pmo h ILE 325 N 0.43 1.16 -0.45 4.57 2.04 -1.10 -0.14 117.51 124.02 1pmo h ILE 325 Ca 0.12 -0.36 -0.07 0.00 1.00 0.00 0.00 64.86 65.55 1pmo h ILE 325 Cb 0.06 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.56 1pmo h ILE 325 CO -0.02 0.16 0.00 0.00 0.00 0.00 0.00 178.15 178.30 1pmo h ALA 326 N 1.16 1.16 -0.64 1.87 0.00 -0.53 -1.31 119.26 120.97 1pmo h ALA 326 Ca 0.19 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1pmo h ALA 326 Cb -0.02 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1pmo h ALA 326 CO -0.04 0.55 0.08 0.37 0.00 0.00 0.00 179.25 180.21 1pmo h GLN 327 N 0.69 1.07 -0.74 0.00 5.75 0.23 -2.14 115.11 119.96 1pmo h GLN 327 Ca 0.14 -0.29 -0.06 0.00 -0.15 0.00 0.00 58.65 58.29 1pmo h GLN 327 Cb 0.42 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.82 1pmo h GLN 327 CO 0.02 0.99 0.24 -0.92 -2.65 0.00 0.00 178.83 176.51 1pmo h TYR 328 N 0.99 1.18 -0.79 3.99 3.20 -0.56 -1.65 116.97 123.33 1pmo h TYR 328 Ca 0.19 -0.11 0.05 0.00 3.14 0.00 0.00 58.73 62.00 1pmo h TYR 328 Cb 0.46 -0.34 -0.06 0.00 1.54 0.00 0.00 36.73 38.33 1pmo h TYR 328 CO 0.03 0.93 0.49 -0.92 -1.64 0.00 0.00 178.16 177.05 1pmo h TYR 329 N 1.10 0.91 -0.38 -3.82 3.20 -0.76 0.95 116.97 118.17 1pmo h TYR 329 Ca 0.24 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 62.08 1pmo h TYR 329 Cb 0.30 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 1pmo h TYR 329 CO 0.02 0.48 0.02 0.93 -1.64 0.00 0.00 178.16 177.97 1pmo h GLU 330 N 0.91 0.66 -0.29 1.82 4.39 -0.92 -0.89 114.58 120.25 1pmo h GLU 330 Ca 0.34 -0.20 0.01 0.00 0.34 0.00 0.00 59.36 59.86 1pmo h GLU 330 Cb 0.12 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.69 1pmo h GLU 330 CO -0.15 0.74 0.16 0.74 -1.16 0.00 0.00 179.01 179.34 1pmo h PHE 331 N 0.48 0.30 -0.14 4.33 0.04 -0.59 -1.79 116.94 119.58 1pmo h PHE 331 Ca 0.11 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.88 1pmo h PHE 331 Cb 0.43 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.48 1pmo h PHE 331 CO 0.03 0.18 0.04 -0.07 -0.60 0.00 0.00 178.31 177.89 1pmo h LEU 332 N 0.34 0.21 -0.61 1.54 3.38 -0.72 -1.03 115.31 118.41 1pmo h LEU 332 Ca 0.12 -0.21 -0.14 0.00 0.09 0.00 0.00 57.88 57.74 1pmo h LEU 332 Cb 0.01 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1pmo h LEU 332 CO -0.06 0.37 -0.64 0.08 0.09 0.00 0.00 178.44 178.27 1pmo h ARG 333 N 0.04 0.00 0.00 1.13 0.11 -1.14 -3.39 114.38 111.13 1pmo h ARG 333 Ca 0.04 0.00 -0.25 0.00 0.10 0.00 0.00 59.98 59.87 1pmo h ARG 333 Cb 0.24 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.28 1pmo h ARG 333 CO -0.00 0.64 -1.80 1.28 0.10 0.00 0.00 179.97 180.19 1pmo n LEU 334 N -3.64 1.94 0.00 0.08 4.77 -0.68 -4.91 117.00 114.56 1pmo n LEU 334 Ca -0.01 0.35 0.06 0.00 -0.03 0.00 0.00 56.01 56.38 1pmo n LEU 334 Cb 0.66 -0.80 -0.01 0.00 -2.33 0.00 0.00 43.42 40.94 1pmo n LEU 334 CO 0.42 0.19 -0.08 0.61 -1.33 0.00 0.00 177.39 177.20 1pmo n GLY 335 N 1.36 -1.82 0.32 -0.72 0.00 -0.39 -0.41 105.19 103.52 1pmo n GLY 335 Ca -0.36 -1.28 -0.04 0.00 0.00 0.00 0.00 46.02 44.34 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 1.10 -0.18 1.61 3.08 -1.98 -1.03 114.38 116.98 1pmo h ARG 336 Ca 0.01 -0.09 0.05 0.00 0.07 0.00 0.00 59.98 60.02 1pmo h ARG 336 Cb 0.39 -0.24 -0.05 0.00 0.08 0.00 0.00 29.97 30.16 1pmo h ARG 336 CO 0.00 0.76 -0.12 1.49 -1.07 0.00 0.00 179.97 181.03 1pmo h GLU 337 N 1.12 -0.11 -0.25 0.04 4.81 -2.00 -1.17 114.58 117.01 1pmo h GLU 337 Ca 0.30 0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.43 1pmo h GLU 337 Cb -0.07 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.33 1pmo h GLU 337 CO -0.06 -0.08 -0.25 0.78 -0.73 0.00 0.00 179.01 178.68 1pmo h GLY 338 N -0.12 0.67 1.14 1.92 0.00 -0.43 -3.08 103.07 103.17 1pmo h GLY 338 Ca 0.11 -0.68 0.00 0.00 0.00 0.00 0.00 47.33 46.76 1pmo h GLY 338 CO -0.26 0.62 0.54 -0.97 0.00 0.00 0.00 176.54 176.47 1pmo h TYR 339 N 0.33 1.11 -0.63 5.60 -1.99 -1.08 -1.12 116.97 119.19 1pmo h TYR 339 Ca 0.04 0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.77 1pmo h TYR 339 Cb 0.81 -0.37 -0.03 0.00 2.00 0.00 0.00 36.73 39.14 1pmo h TYR 339 CO 0.07 0.72 0.36 1.15 -0.00 0.00 0.00 178.16 180.47 1pmo h THR 340 N 1.18 1.19 -0.40 -2.88 2.02 -1.21 0.35 112.91 113.17 1pmo h THR 340 Ca 0.31 -0.46 -0.15 0.00 0.77 0.00 0.00 66.41 66.88 1pmo h THR 340 Cb -0.08 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 66.67 1pmo h THR 340 CO -0.06 0.21 -0.35 0.11 0.37 0.00 0.00 175.52 175.79 1pmo h LYS 341 N 0.86 0.93 -0.02 6.66 1.57 -1.37 -1.05 116.57 124.15 1pmo h LYS 341 Ca 0.22 -0.47 -0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1pmo h LYS 341 Cb 0.01 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 1pmo h LYS 341 CO -0.04 1.13 0.00 0.28 -0.57 0.00 0.00 179.45 180.25 1pmo h VAL 342 N 0.77 1.22 -0.41 0.50 2.07 -0.95 -1.96 116.25 117.49 1pmo h VAL 342 Ca 0.07 -0.66 -0.03 0.00 0.82 0.00 0.00 66.70 66.90 1pmo h VAL 342 Cb 0.94 1.63 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 1pmo h VAL 342 CO 0.09 0.18 0.16 1.56 0.02 0.00 0.00 177.57 179.57 1pmo h GLN 343 N -0.24 0.62 -0.48 1.57 7.50 -0.97 -2.77 115.11 120.35 1pmo h GLN 343 Ca 0.01 -0.12 0.01 0.00 0.50 0.00 0.00 58.65 59.05 1pmo h GLN 343 Cb 0.28 -0.10 -0.02 0.00 0.05 0.00 0.00 27.48 27.69 1pmo h GLN 343 CO 0.00 0.59 0.32 -0.91 -1.50 0.00 0.00 178.83 177.32 1pmo h ASN 344 N 0.52 0.54 -0.88 1.46 -0.26 -1.15 -1.55 115.58 114.25 1pmo h ASN 344 Ca 0.14 -0.01 -0.02 0.00 -0.56 0.00 0.00 56.30 55.84 1pmo h ASN 344 Cb 0.21 -0.13 -0.04 0.00 -1.06 0.00 0.00 38.32 37.29 1pmo h ASN 344 CO -0.01 0.39 0.47 0.00 -1.06 0.00 0.00 177.43 177.22 1pmo h ALA 345 N 1.71 1.17 -0.27 -0.83 0.00 -1.07 -0.29 119.26 119.68 1pmo h ALA 345 Ca 0.18 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 1pmo h ALA 345 Cb -0.05 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 1pmo h ALA 345 CO -0.04 0.66 -0.45 0.77 0.00 0.00 0.00 179.25 180.19 1pmo h SER 346 N 1.24 0.74 -0.25 0.00 0.02 -1.18 -2.63 113.55 111.50 1pmo h SER 346 Ca 0.31 -0.36 -0.06 0.00 -0.84 0.00 0.00 61.79 60.85 1pmo h SER 346 Cb 0.05 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.36 1pmo h SER 346 CO -0.05 1.08 -0.01 1.88 -1.14 0.00 0.00 176.83 178.59 1pmo h TYR 347 N 0.55 0.59 -0.46 3.45 0.05 -0.82 -1.08 116.97 119.26 1pmo h TYR 347 Ca 0.03 -0.07 -0.12 0.00 0.05 0.00 0.00 58.73 58.63 1pmo h TYR 347 Cb 1.00 -0.17 -0.02 0.00 1.01 0.00 0.00 36.73 38.56 1pmo h TYR 347 CO 0.05 0.59 -0.18 1.96 -1.05 0.00 0.00 178.16 179.52 1pmo h GLN 348 N 0.54 0.90 -0.14 4.88 4.20 -0.87 -0.33 115.11 124.29 1pmo h GLN 348 Ca 0.11 -0.35 -0.02 0.00 0.06 0.00 0.00 58.65 58.45 1pmo h GLN 348 Cb 0.37 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 1pmo h GLN 348 CO 0.01 1.00 0.01 0.28 -0.67 0.00 0.00 178.83 179.47 1pmo h VAL 349 N 0.79 1.24 0.04 -0.54 2.07 -1.10 -1.36 116.25 117.39 1pmo h VAL 349 Ca 0.11 -0.79 0.00 0.00 0.82 0.00 0.00 66.70 66.84 1pmo h VAL 349 Cb 0.72 1.49 -0.00 0.00 -1.52 0.00 0.00 31.29 31.98 1pmo h VAL 349 CO 0.06 0.23 -0.04 0.00 0.02 0.00 0.00 177.57 177.84 1pmo h ALA 350 N 0.77 -0.07 -0.90 1.67 0.00 -1.11 -0.79 119.26 118.83 1pmo h ALA 350 Ca 0.04 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.00 1pmo h ALA 350 Cb 0.35 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 1pmo h ALA 350 CO 0.01 -0.55 0.59 0.00 0.00 0.00 0.00 179.25 179.29 1pmo h ALA 351 N 0.87 1.50 -0.27 0.00 0.00 -1.05 -0.80 119.26 119.51 1pmo h ALA 351 Ca 0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1pmo h ALA 351 Cb 0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1pmo h ALA 351 CO -0.01 0.37 0.06 -0.92 0.00 0.00 0.00 179.25 178.75 1pmo h TYR 352 N 1.04 0.46 -0.72 0.00 3.20 -0.76 -2.20 116.97 118.00 1pmo h TYR 352 Ca 0.38 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 62.16 1pmo h TYR 352 Cb 0.17 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.28 1pmo h TYR 352 CO -0.00 0.53 0.31 -0.07 -1.64 0.00 0.00 178.16 177.29 1pmo h LEU 353 N 0.26 0.97 0.22 2.82 3.38 -0.58 -0.99 115.31 121.39 1pmo h LEU 353 Ca 0.08 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1pmo h LEU 353 Cb 0.30 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1pmo h LEU 353 CO 0.00 0.86 -0.17 0.00 0.09 0.00 0.00 178.44 179.21 1pmo h ALA 354 N 1.15 -0.39 -0.49 1.53 0.00 -1.08 0.30 119.26 120.29 1pmo h ALA 354 Ca 0.24 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1pmo h ALA 354 Cb 0.17 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1pmo h ALA 354 CO -0.02 -0.73 0.12 0.22 0.00 0.00 0.00 179.25 178.83 1pmo h ASP 355 N -0.41 0.68 -0.07 0.00 3.58 -1.27 -1.75 116.42 117.19 1pmo h ASP 355 Ca -0.01 -0.11 -0.17 0.00 0.42 0.00 0.00 57.03 57.15 1pmo h ASP 355 Cb 0.36 -0.18 0.01 0.00 1.72 0.00 0.00 39.33 41.24 1pmo h ASP 355 CO -0.01 0.68 -0.63 -0.08 -2.88 0.00 0.00 179.24 176.32 1pmo h GLU 356 N 0.72 0.55 -0.31 0.28 4.57 -0.92 -3.26 114.58 116.20 1pmo h GLU 356 Ca 0.16 -0.50 -0.08 0.00 -1.18 0.00 0.00 59.36 57.76 1pmo h GLU 356 Cb 0.27 0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.96 1pmo h GLU 356 CO -0.00 1.13 -0.15 0.82 -1.18 0.00 0.00 179.01 179.62 1pmo h ILE 357 N 0.15 1.24 -0.19 2.32 2.04 -0.31 -2.71 117.51 120.06 1pmo h ILE 357 Ca -0.06 -1.10 0.05 0.00 1.00 0.00 0.00 64.86 64.75 1pmo h ILE 357 Cb 1.29 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 38.53 1pmo h ILE 357 CO 0.13 0.36 0.18 0.00 0.00 0.00 0.00 178.15 178.82 1pmo h ALA 358 N 1.34 1.88 -0.00 1.87 0.00 -1.36 -0.11 119.26 122.88 1pmo h ALA 358 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1pmo h ALA 358 Cb 0.55 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1pmo h ALA 358 CO 0.04 -0.28 -0.10 1.63 0.00 0.00 0.00 179.25 180.54 1pmo n LYS 359 N -3.95 0.55 0.00 0.00 5.02 -1.02 -4.01 118.16 114.76 1pmo n LYS 359 Ca 0.02 -0.15 0.09 0.00 -2.02 0.00 0.00 58.31 56.25 1pmo n LYS 359 Cb 0.31 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.75 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 -1.09 1.24 -3.76 -0.35 4.77 -0.05 -5.05 117.00 112.70 1pmo n LEU 360 Ca 0.14 -0.58 -0.01 0.00 -0.03 0.00 0.00 56.01 55.52 1pmo n LEU 360 Cb 0.27 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1pmo n LEU 360 CO 0.24 0.27 0.87 -0.83 -1.33 0.00 0.00 177.39 176.62 1pmo s GLY 361 N -2.67 -0.20 -1.26 -0.72 0.00 -1.25 -5.07 107.32 96.16 1pmo s GLY 361 Ca 0.10 0.18 -0.19 0.00 0.00 0.00 0.00 44.72 44.81 1pmo s GLY 361 CO 0.71 1.04 1.82 -1.55 0.00 0.00 0.00 173.10 175.12 1pmo n PRO 362 N -0.56 2.64 -4.25 2.90 -0.04 -1.26 -4.87 135.00 129.55 1pmo n PRO 362 Ca -0.05 -2.98 -0.30 0.00 -0.04 0.00 0.00 63.50 60.13 1pmo n PRO 362 Cb 0.61 -3.56 -0.10 0.00 -0.04 0.00 0.00 33.50 30.41 1pmo n PRO 362 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1pmo s TYR 363 N 6.48 2.82 -0.23 0.54 2.02 -1.26 -0.68 117.35 127.04 1pmo s TYR 363 Ca 0.59 -0.11 -0.02 0.00 -0.37 0.00 0.00 57.07 57.16 1pmo s TYR 363 Cb 0.03 -1.49 0.01 0.00 -0.40 0.00 0.00 41.96 40.11 1pmo s TYR 363 CO 0.10 0.43 -0.08 -2.00 -1.57 0.00 0.00 175.55 172.42 1pmo s GLU 364 N -2.10 3.07 -0.04 -0.62 2.12 0.36 -4.75 118.70 116.75 1pmo s GLU 364 Ca 0.22 -0.81 -0.15 0.00 0.36 0.00 0.00 54.97 54.58 1pmo s GLU 364 Cb -0.11 -2.92 -0.05 0.00 0.26 0.00 0.00 34.13 31.30 1pmo s GLU 364 CO 0.14 -0.29 0.40 -0.06 -0.54 0.00 0.00 175.26 174.91 1pmo s PHE 365 N 1.38 3.67 -0.02 5.30 0.40 -1.26 -1.19 117.98 126.25 1pmo s PHE 365 Ca 0.03 0.93 0.14 0.00 -0.60 0.00 0.00 56.93 57.43 1pmo s PHE 365 Cb -0.15 -2.32 -0.22 0.00 0.51 0.00 0.00 43.02 40.83 1pmo s PHE 365 CO -0.06 0.54 0.31 0.44 0.70 0.00 0.00 175.22 177.15 1pmo n ILE 366 N 2.27 0.01 -3.70 0.64 -5.35 0.97 -4.94 119.36 109.26 1pmo n ILE 366 Ca -0.13 -0.33 -0.12 0.00 -0.27 0.00 0.00 62.75 61.90 1pmo n ILE 366 Cb 0.52 0.17 -0.13 0.00 -1.74 0.00 0.00 39.64 38.47 1pmo n ILE 366 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1pmo n THR 368 N 4.66 2.02 -2.04 0.00 -2.24 -1.26 -1.15 114.28 114.27 1pmo n THR 368 Ca -0.18 -2.36 -0.08 0.00 -2.27 0.00 0.00 64.05 59.16 1pmo n THR 368 Cb 0.52 -0.25 -0.01 0.00 -2.10 0.00 0.00 70.33 68.50 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 -1.24 0.16 3.71 3.38 0.00 -0.50 -3.97 105.19 106.72 1pmo n GLY 369 Ca 0.18 -0.57 -0.39 0.00 0.00 0.00 0.00 46.02 45.24 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 -4.18 4.38 0.41 1.61 0.52 -1.26 -4.28 118.95 116.14 1pmo s ARG 370 Ca 0.00 0.69 0.16 0.00 -0.52 0.00 0.00 55.73 56.06 1pmo s ARG 370 Cb 0.00 -3.46 1.03 0.00 0.52 0.00 0.00 34.95 33.04 1pmo s ARG 370 CO 0.00 0.07 1.87 -1.35 0.02 0.00 0.00 175.30 175.90 1pmo h PRO 371 N 6.82 0.45 0.00 3.54 0.11 -1.91 -1.10 132.00 139.91 1pmo h PRO 371 Ca -0.40 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 1pmo h PRO 371 Cb 1.18 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1pmo h PRO 371 CO 0.76 0.30 -0.02 -0.44 -0.21 0.00 0.00 178.00 178.38 1pmo h ASP 372 N 0.46 0.00 0.00 -2.05 3.32 -1.93 -3.34 116.42 112.89 1pmo h ASP 372 Ca 0.45 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.39 1pmo h ASP 372 Cb 1.04 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.57 1pmo h ASP 372 CO -0.18 0.02 -1.96 -0.62 -1.72 0.00 0.00 179.24 174.79 1pmo n GLU 373 N -3.11 0.81 0.00 3.56 1.02 -0.49 -5.00 120.64 117.43 1pmo n GLU 373 Ca 0.03 -0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 1pmo n GLU 373 Cb 0.45 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 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 1.65 -0.83 3.97 0.62 0.00 -0.75 -0.95 105.19 108.89 1pmo n GLY 374 Ca -0.12 -0.23 -0.22 0.00 0.00 0.00 0.00 46.02 45.44 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 2.53 -1.08 -0.61 -4.36 -0.55 -4.47 121.20 108.66 1pmo s ILE 375 Ca 0.00 -0.61 -0.21 0.00 -0.26 0.00 0.00 60.65 59.57 1pmo s ILE 375 Cb 0.00 -2.91 -0.08 0.00 1.25 0.00 0.00 42.46 40.72 1pmo s ILE 375 CO 0.00 0.00 1.93 -2.65 0.24 0.00 0.00 174.94 174.46 1pmo n PRO 376 N -2.49 1.89 -3.99 0.37 -0.02 -1.26 -4.40 135.00 125.10 1pmo n PRO 376 Ca 0.09 -2.37 -0.08 0.00 -2.02 0.00 0.00 63.50 59.12 1pmo n PRO 376 Cb 0.60 -3.37 -0.09 0.00 -0.02 0.00 0.00 33.50 30.62 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 7.26 0.18 -0.12 3.55 0.00 -1.26 -1.40 121.76 129.97 1pmo s ALA 377 Ca 0.61 -0.86 0.03 0.00 0.00 0.00 0.00 51.96 51.73 1pmo s ALA 377 Cb 0.07 0.29 0.01 0.00 0.00 0.00 0.00 23.12 23.48 1pmo s ALA 377 CO 0.10 -0.36 -0.20 0.08 0.00 0.00 0.00 175.76 175.39 1pmo s VAL 378 N -3.27 1.85 -0.05 0.00 1.01 0.03 -1.41 120.40 118.55 1pmo s VAL 378 Ca 0.01 -0.86 -0.00 0.00 0.00 0.00 0.00 61.98 61.12 1pmo s VAL 378 Cb 0.03 -1.64 0.03 0.00 0.00 0.00 0.00 36.38 34.80 1pmo s VAL 378 CO -0.08 0.51 0.00 0.00 0.00 0.00 0.00 175.10 175.53 1pmo s PHE 380 N 1.47 0.34 0.17 0.00 -0.71 -0.83 -0.02 117.98 118.40 1pmo s PHE 380 Ca -0.03 -0.70 -0.00 0.00 -1.04 0.00 0.00 56.93 55.16 1pmo s PHE 380 Cb -0.13 0.02 -0.04 0.00 -1.21 0.00 0.00 43.02 41.66 1pmo s PHE 380 CO -0.03 -0.77 0.06 -1.59 -1.34 0.00 0.00 175.22 171.55 1pmo s LYS 381 N -3.97 1.08 0.28 1.99 -2.85 -0.34 -0.95 119.74 114.99 1pmo s LYS 381 Ca 0.17 -1.54 -0.28 0.00 -1.00 0.00 0.00 55.97 53.32 1pmo s LYS 381 Cb 0.02 0.08 -0.09 0.00 -2.06 0.00 0.00 37.83 35.78 1pmo s LYS 381 CO 0.01 -0.26 0.99 -0.51 0.10 0.00 0.00 175.35 175.68 1pmo s LEU 382 N -3.13 4.51 0.27 2.77 1.43 -1.26 -0.49 118.68 122.78 1pmo s LEU 382 Ca 0.29 2.02 -0.30 0.00 -1.03 0.00 0.00 54.13 55.11 1pmo s LEU 382 Cb 0.07 -3.76 -0.13 0.00 0.03 0.00 0.00 46.19 42.41 1pmo s LEU 382 CO 0.06 -0.03 1.41 0.29 0.23 0.00 0.00 176.35 178.30 1pmo n LYS 383 N 1.06 2.15 -1.60 1.70 5.02 0.14 -4.70 118.16 121.93 1pmo n LYS 383 Ca -0.00 0.76 -0.51 0.00 -2.02 0.00 0.00 58.31 56.54 1pmo n LYS 383 Cb 0.47 -2.42 -0.05 0.00 -0.02 0.00 0.00 35.03 33.01 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 1.83 1.77 -3.02 4.39 8.00 -1.26 -3.47 116.55 124.79 1pmo n ASP 384 Ca 0.10 1.12 -0.06 0.00 0.71 0.00 0.00 54.79 56.66 1pmo n ASP 384 Cb 0.33 -1.23 0.01 0.00 -0.02 0.00 0.00 41.12 40.21 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 2.51 -1.74 0.00 0.44 0.00 -1.26 -4.96 105.19 100.18 1pmo n GLY 385 Ca 0.17 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.66 1pmo n GLY 385 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1pmo n GLU 386 N 0.71 0.00 -0.37 1.61 -0.58 -1.23 -5.11 120.64 115.67 1pmo n GLU 386 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1pmo n GLU 386 Cb 0.33 -0.05 0.00 0.00 -0.57 0.00 0.00 31.44 31.15 1pmo n GLU 386 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1pmo n ASP 387 N 0.00 0.00 0.00 1.62 2.03 -1.26 -4.78 116.55 114.16 1pmo n ASP 387 Ca 0.00 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.44 1pmo n ASP 387 Cb 0.13 0.00 0.73 0.00 -0.72 0.00 0.00 41.12 41.26 1pmo n ASP 387 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1pmo n PRO 388 N 0.16 0.59 0.00 -0.67 -0.04 -1.26 -4.84 135.00 128.94 1pmo n PRO 388 Ca 0.00 0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1pmo n PRO 388 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 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 0.86 1.24 3.60 0.55 0.00 -1.26 -5.01 105.19 105.17 1pmo n GLY 389 Ca 0.16 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.13 0.36 1.61 -0.85 -1.26 -4.56 117.35 110.52 1pmo s TYR 390 Ca 0.00 0.03 0.08 0.00 -0.52 0.00 0.00 57.07 56.66 1pmo s TYR 390 Cb 0.00 0.54 -0.03 0.00 0.38 0.00 0.00 41.96 42.84 1pmo s TYR 390 CO 0.00 -0.33 0.24 0.95 -1.52 0.00 0.00 175.55 174.90 1pmo s THR 391 N -2.59 3.03 0.16 -3.49 -4.23 -1.26 -4.99 115.64 102.27 1pmo s THR 391 Ca 0.10 -1.52 0.35 0.00 -1.18 0.00 0.00 61.69 59.45 1pmo s THR 391 Cb 0.01 -3.05 0.39 0.00 1.34 0.00 0.00 72.50 71.19 1pmo s THR 391 CO -0.04 -0.12 2.04 -0.07 -0.54 0.00 0.00 174.62 175.88 1pmo h LEU 392 N 1.33 0.00 -0.25 4.79 3.38 -1.97 -2.15 115.31 120.45 1pmo h LEU 392 Ca -0.43 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.47 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 0.61 0.00 -0.08 1.88 0.09 0.00 0.00 178.44 180.94 1pmo h TYR 393 N 0.00 0.57 -0.52 1.13 0.05 -1.93 -0.91 116.97 115.35 1pmo h TYR 393 Ca 0.00 -0.13 -0.02 0.00 0.05 0.00 0.00 58.73 58.63 1pmo h TYR 393 Cb 0.40 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 37.98 1pmo h TYR 393 CO 0.00 0.74 0.24 -0.44 -1.05 0.00 0.00 178.16 177.64 1pmo h ASP 394 N 0.23 0.70 -0.76 3.88 3.32 -1.66 -1.78 116.42 120.35 1pmo h ASP 394 Ca 0.06 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 56.95 1pmo h ASP 394 Cb 0.57 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.90 1pmo h ASP 394 CO 0.03 0.65 0.41 0.25 -1.72 0.00 0.00 179.24 178.85 1pmo h LEU 395 N 0.70 0.96 -0.93 1.55 5.85 -1.37 -1.90 115.31 120.16 1pmo h LEU 395 Ca 0.18 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1pmo h LEU 395 Cb 0.15 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 1pmo h LEU 395 CO -0.02 0.79 0.54 -1.28 -0.34 0.00 0.00 178.44 178.13 1pmo h SER 396 N 1.05 1.14 -0.49 1.25 0.87 -0.80 -1.55 113.55 115.03 1pmo h SER 396 Ca 0.27 -0.08 -0.11 0.00 -1.23 0.00 0.00 61.79 60.63 1pmo h SER 396 Cb 0.05 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 61.71 1pmo h SER 396 CO -0.04 0.89 -0.13 -0.08 -0.53 0.00 0.00 176.83 176.94 1pmo h GLU 397 N 1.30 0.95 -0.60 2.24 4.81 -0.88 -2.04 114.58 120.35 1pmo h GLU 397 Ca 0.33 -0.37 -0.04 0.00 -0.13 0.00 0.00 59.36 59.16 1pmo h GLU 397 Cb -0.02 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 1pmo h GLU 397 CO -0.06 1.03 0.23 0.00 -0.73 0.00 0.00 179.01 179.48 1pmo h ARG 398 N 0.80 0.88 -0.03 1.92 2.47 -0.97 -2.02 114.38 117.42 1pmo h ARG 398 Ca 0.12 -0.14 -0.08 0.00 -1.26 0.00 0.00 59.98 58.62 1pmo h ARG 398 Cb 0.69 -0.15 -0.01 0.00 -1.65 0.00 0.00 29.97 28.85 1pmo h ARG 398 CO 0.05 0.73 -0.36 -0.07 0.56 0.00 0.00 179.97 180.88 1pmo h LEU 399 N 0.87 0.07 -0.96 3.04 3.38 -1.05 -2.62 115.31 118.03 1pmo h LEU 399 Ca 0.20 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.07 1pmo h LEU 399 Cb 0.19 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1pmo h LEU 399 CO -0.02 0.43 -0.13 0.03 0.09 0.00 0.00 178.44 178.84 1pmo h ARG 400 N 0.06 0.60 0.00 1.13 3.08 -0.64 -0.25 114.38 118.36 1pmo h ARG 400 Ca 0.00 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 59.86 1pmo h ARG 400 Cb 0.67 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1pmo h ARG 400 CO 0.05 0.72 0.00 -0.07 -1.07 0.00 0.00 179.97 179.60 1pmo h LEU 401 N 0.55 0.00 -2.79 3.04 3.38 -1.16 0.11 115.31 118.44 1pmo h LEU 401 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1pmo h LEU 401 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1pmo h LEU 401 CO 0.03 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.10 1pmo n ARG 402 N -2.30 2.77 -0.34 1.13 5.12 -0.65 -4.95 116.66 117.44 1pmo n ARG 402 Ca 0.01 -2.45 0.00 0.00 -1.93 0.00 0.00 57.85 53.47 1pmo n ARG 402 Cb 0.16 -1.47 0.00 0.00 -1.16 0.00 0.00 32.46 29.99 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 1.27 0.87 3.88 -0.13 0.00 0.38 -5.06 105.19 106.40 1pmo n GLY 403 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.79 3.53 -0.42 1.61 0.52 -0.20 -4.71 118.94 116.48 1pmo s TRP 404 Ca 0.00 0.63 0.02 0.00 0.02 0.00 0.00 56.10 56.77 1pmo s TRP 404 Cb 0.00 -2.05 0.11 0.00 -1.15 0.00 0.00 33.47 30.38 1pmo s TRP 404 CO 0.00 0.50 0.17 -1.14 0.02 0.00 0.00 176.95 176.49 1pmo s GLN 405 N -2.23 1.80 -0.35 4.98 2.00 -0.72 -2.66 119.66 122.48 1pmo s GLN 405 Ca 0.36 -2.10 0.01 0.00 -2.00 0.00 0.00 55.36 51.62 1pmo s GLN 405 Cb -0.13 -3.36 0.09 0.00 0.80 0.00 0.00 33.01 30.42 1pmo s GLN 405 CO 0.21 -1.03 0.08 0.08 -0.50 0.00 0.00 175.29 174.13 1pmo s VAL 406 N 0.58 2.73 0.28 1.34 1.01 -1.26 -0.83 120.40 124.26 1pmo s VAL 406 Ca 0.12 -2.04 -0.30 0.00 0.00 0.00 0.00 61.98 59.76 1pmo s VAL 406 Cb -0.21 -2.86 -0.12 0.00 0.00 0.00 0.00 36.38 33.19 1pmo s VAL 406 CO -0.05 -0.51 1.63 -0.81 0.00 0.00 0.00 175.10 175.36 1pmo n PRO 407 N 4.44 2.74 -4.78 2.72 -0.04 -1.26 -4.71 135.00 134.12 1pmo n PRO 407 Ca -0.02 0.98 -0.29 0.00 -0.04 0.00 0.00 63.50 64.13 1pmo n PRO 407 Cb 0.42 -2.78 -0.17 0.00 -0.04 0.00 0.00 33.50 30.93 1pmo n PRO 407 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1pmo s ALA 408 N 0.19 1.76 0.30 0.55 0.00 -1.26 -2.23 121.76 121.08 1pmo s ALA 408 Ca 0.66 -0.74 -0.18 0.00 0.00 0.00 0.00 51.96 51.70 1pmo s ALA 408 Cb -0.49 -0.75 0.02 0.00 0.00 0.00 0.00 23.12 21.90 1pmo s ALA 408 CO 0.46 0.12 0.70 -0.59 0.00 0.00 0.00 175.76 176.44 1pmo s PHE 409 N 0.65 0.00 0.12 0.00 -0.12 -0.22 -2.58 117.98 115.83 1pmo s PHE 409 Ca -0.13 -0.49 -0.01 0.00 -0.05 0.00 0.00 56.93 56.25 1pmo s PHE 409 Cb -0.16 0.64 -0.04 0.00 -0.63 0.00 0.00 43.02 42.83 1pmo s PHE 409 CO 0.04 -1.28 0.29 0.95 -0.05 0.00 0.00 175.22 175.17 1pmo s THR 410 N -3.52 5.30 0.53 -4.49 -4.23 -1.26 0.07 115.64 108.04 1pmo s THR 410 Ca 0.14 -0.36 -0.06 0.00 -1.18 0.00 0.00 61.69 60.23 1pmo s THR 410 Cb -0.05 -3.67 -0.03 0.00 1.34 0.00 0.00 72.50 70.09 1pmo s THR 410 CO 0.09 0.02 0.85 -0.76 -0.54 0.00 0.00 174.62 174.28 1pmo s LEU 411 N -2.83 3.48 0.00 4.79 1.43 -0.67 -4.94 118.68 119.93 1pmo s LEU 411 Ca 0.37 0.98 0.00 0.00 -1.03 0.00 0.00 54.13 54.44 1pmo s LEU 411 Cb -0.12 -3.92 0.00 0.00 0.03 0.00 0.00 46.19 42.18 1pmo s LEU 411 CO 0.28 -0.73 0.00 0.61 0.23 0.00 0.00 176.35 176.74 1pmo n GLY 412 N -2.42 1.53 7.00 -3.19 0.00 -1.26 -3.62 105.19 103.23 1pmo n GLY 412 Ca 0.02 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.32 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 2.39 1.32 -0.02 0.00 -1.26 0.03 105.19 112.65 1pmo n GLY 413 Ca 0.00 0.36 0.09 0.00 0.00 0.00 0.00 46.02 46.46 1pmo n GLY 413 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1pmo n GLU 414 N 10.53 3.48 -0.63 1.61 4.71 0.18 -4.23 120.64 136.31 1pmo n GLU 414 Ca 0.00 -2.75 0.08 0.00 -0.01 0.00 0.00 57.16 54.48 1pmo n GLU 414 Cb 0.00 -1.79 0.32 0.00 -1.01 0.00 0.00 31.44 28.96 1pmo n GLU 414 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1pmo n ALA 415 N 0.76 3.33 -0.28 0.62 0.00 0.10 -4.43 120.51 120.61 1pmo n ALA 415 Ca 0.23 -2.10 0.31 0.00 0.00 0.00 0.00 53.44 51.87 1pmo n ALA 415 Cb 0.82 -0.88 0.69 0.00 0.00 0.00 0.00 19.45 20.08 1pmo n ALA 415 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1pmo h THR 416 N 2.77 0.48 0.00 0.00 1.35 -1.60 0.17 112.91 116.07 1pmo h THR 416 Ca 0.00 -0.03 -0.06 0.00 -0.55 0.00 0.00 66.41 65.77 1pmo h THR 416 Cb 1.64 0.38 -0.01 0.00 -1.73 0.00 0.00 68.15 68.43 1pmo h THR 416 CO 0.33 0.02 -0.29 0.44 -0.25 0.00 0.00 175.52 175.76 1pmo h ASP 417 N 0.09 0.00 -3.11 5.36 3.32 -1.86 -3.44 116.42 116.78 1pmo h ASP 417 Ca 0.53 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 57.03 1pmo h ASP 417 Cb 1.93 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.47 1pmo h ASP 417 CO -0.07 0.29 0.67 -0.63 -1.72 0.00 0.00 179.24 177.78 1pmo s ILE 418 N -3.36 4.24 -0.21 0.35 1.01 0.59 -5.00 121.20 118.82 1pmo s ILE 418 Ca 0.03 1.58 -0.04 0.00 0.00 0.00 0.00 60.65 62.21 1pmo s ILE 418 Cb 0.09 -4.01 -0.01 0.00 0.01 0.00 0.00 42.46 38.53 1pmo s ILE 418 CO 0.68 0.02 -0.04 -0.69 0.00 0.00 0.00 174.94 174.90 1pmo s VAL 419 N 2.01 3.44 0.31 2.92 1.01 -1.26 -1.66 120.40 127.16 1pmo s VAL 419 Ca 0.56 -0.48 0.11 0.00 0.00 0.00 0.00 61.98 62.17 1pmo s VAL 419 Cb -0.25 -2.56 -0.06 0.00 0.00 0.00 0.00 36.38 33.52 1pmo s VAL 419 CO 0.23 0.43 -0.15 0.68 0.00 0.00 0.00 175.10 176.29 1pmo s VAL 420 N 1.31 2.33 -0.09 2.92 -7.23 0.11 -4.37 120.40 115.38 1pmo s VAL 420 Ca 0.04 -2.31 0.04 0.00 -1.81 0.00 0.00 61.98 57.94 1pmo s VAL 420 Cb -0.14 -2.44 0.00 0.00 0.56 0.00 0.00 36.38 34.35 1pmo s VAL 420 CO -0.02 -0.32 -0.22 -0.32 -0.31 0.00 0.00 175.10 173.91 1pmo s MET 421 N -3.56 2.84 -0.10 4.82 1.75 -0.13 -1.06 119.30 123.87 1pmo s MET 421 Ca 0.31 -0.81 0.03 0.00 -1.25 0.00 0.00 55.69 53.97 1pmo s MET 421 Cb -0.01 -2.16 0.00 0.00 2.84 0.00 0.00 34.83 35.50 1pmo s MET 421 CO 0.15 0.16 -0.21 0.50 -0.65 0.00 0.00 175.02 174.97 1pmo s ARG 422 N 0.38 2.79 -0.15 4.11 3.52 -0.95 -1.96 118.95 126.70 1pmo s ARG 422 Ca -0.18 -0.79 0.00 0.00 -0.13 0.00 0.00 55.73 54.64 1pmo s ARG 422 Cb -0.18 -2.14 -0.00 0.00 -1.56 0.00 0.00 34.95 31.07 1pmo s ARG 422 CO 0.08 0.13 -0.16 0.42 -0.81 0.00 0.00 175.30 174.96 1pmo s ILE 423 N 0.46 2.61 -0.17 4.11 1.01 0.12 -4.10 121.20 125.25 1pmo s ILE 423 Ca -0.17 -0.79 -0.07 0.00 0.00 0.00 0.00 60.65 59.63 1pmo s ILE 423 Cb -0.17 -2.10 -0.04 0.00 0.01 0.00 0.00 42.46 40.16 1pmo s ILE 423 CO 0.07 0.52 0.06 -0.32 0.00 0.00 0.00 174.94 175.26 1pmo s MET 424 N 0.81 3.82 -0.43 2.79 1.75 -0.45 -0.79 119.30 126.80 1pmo s MET 424 Ca -0.06 -0.34 -0.05 0.00 -1.25 0.00 0.00 55.69 53.99 1pmo s MET 424 Cb -0.15 -3.15 0.11 0.00 2.84 0.00 0.00 34.83 34.47 1pmo s MET 424 CO -0.00 0.35 0.25 0.00 -0.65 0.00 0.00 175.02 174.97 1pmo s ARG 426 N 1.24 2.32 0.15 0.00 1.70 -1.26 -4.75 118.95 118.34 1pmo s ARG 426 Ca 0.06 -1.78 -0.34 0.00 -0.47 0.00 0.00 55.73 53.20 1pmo s ARG 426 Cb -0.24 -2.10 -0.15 0.00 -0.57 0.00 0.00 34.95 31.89 1pmo s ARG 426 CO -0.02 -0.19 1.45 -2.13 -1.08 0.00 0.00 175.30 173.33 1pmo n ARG 427 N -1.38 1.74 0.00 3.89 0.63 -1.26 -1.80 116.66 118.49 1pmo n ARG 427 Ca -0.00 0.63 0.00 0.00 -0.92 0.00 0.00 57.85 57.56 1pmo n ARG 427 Cb 0.64 -2.32 0.00 0.00 0.45 0.00 0.00 32.46 31.23 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 2.87 1.71 3.32 5.14 0.00 -1.26 -4.40 105.19 112.57 1pmo n GLY 428 Ca 0.17 -0.17 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 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 4.40 -1.79 1.61 7.35 -0.74 -4.98 117.46 123.31 1pmo n PHE 429 Ca 0.00 -3.10 -0.29 0.00 -0.76 0.00 0.00 57.45 53.30 1pmo n PHE 429 Cb 0.00 -2.28 0.10 0.00 0.35 0.00 0.00 39.48 37.65 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 2.10 1.84 0.35 -4.13 0.41 -1.26 -4.80 118.70 113.21 1pmo s GLU 430 Ca 0.45 0.22 0.13 0.00 -0.41 0.00 0.00 54.97 55.36 1pmo s GLU 430 Cb 0.03 -1.93 0.96 0.00 -1.78 0.00 0.00 34.13 31.41 1pmo s GLU 430 CO 0.01 -1.70 1.76 1.98 -0.49 0.00 0.00 175.26 176.82 1pmo h MET 431 N -1.14 0.51 -0.96 1.61 4.05 -1.93 0.16 114.93 117.23 1pmo h MET 431 Ca -0.47 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 58.92 1pmo h MET 431 Cb 1.32 -0.11 -0.05 0.00 -0.80 0.00 0.00 31.60 31.96 1pmo h MET 431 CO 0.64 0.34 0.59 -0.44 0.23 0.00 0.00 176.91 178.27 1pmo h ASP 432 N 0.52 1.14 0.20 1.39 3.32 -1.99 -1.77 116.42 119.24 1pmo h ASP 432 Ca 0.61 -0.06 -0.16 0.00 0.02 0.00 0.00 57.03 57.43 1pmo h ASP 432 Cb 1.29 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 40.55 1pmo h ASP 432 CO -0.37 0.87 -0.63 -0.26 -1.72 0.00 0.00 179.24 177.13 1pmo h PHE 433 N 1.32 0.53 -0.54 4.55 0.04 -1.34 -2.73 116.94 118.76 1pmo h PHE 433 Ca 0.34 -0.21 -0.06 0.00 2.80 0.00 0.00 57.97 60.85 1pmo h PHE 433 Cb -0.07 -0.09 -0.02 0.00 2.20 0.00 0.00 35.95 37.96 1pmo h PHE 433 CO 0.00 0.92 0.10 0.00 -0.60 0.00 0.00 178.31 178.74 1pmo h ALA 434 N 1.03 1.16 -0.45 2.45 0.00 -0.94 -0.66 119.26 121.85 1pmo h ALA 434 Ca -0.01 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.59 1pmo h ALA 434 Cb 1.17 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1pmo h ALA 434 CO 0.11 0.56 -0.09 0.93 0.00 0.00 0.00 179.25 180.76 1pmo h GLU 435 N 0.81 0.80 -0.52 0.00 4.39 -1.20 -0.96 114.58 117.91 1pmo h GLU 435 Ca 0.17 -0.26 -0.10 0.00 0.34 0.00 0.00 59.36 59.51 1pmo h GLU 435 Cb 0.34 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 1pmo h GLU 435 CO 0.00 0.86 -0.08 1.25 -1.16 0.00 0.00 179.01 179.89 1pmo h LEU 436 N 0.73 0.93 -0.54 1.33 5.85 -1.11 -1.44 115.31 121.06 1pmo h LEU 436 Ca 0.13 -0.28 -0.01 0.00 0.84 0.00 0.00 57.88 58.56 1pmo h LEU 436 Cb 0.57 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 1pmo h LEU 436 CO 0.04 1.03 0.31 0.25 -0.34 0.00 0.00 178.44 179.72 1pmo h LEU 437 N 0.85 0.66 -1.03 2.25 7.12 -0.66 -1.33 115.31 123.17 1pmo h LEU 437 Ca 0.14 -0.08 -0.00 0.00 0.13 0.00 0.00 57.88 58.07 1pmo h LEU 437 Cb 0.60 -0.17 -0.04 0.00 -0.53 0.00 0.00 40.66 40.52 1pmo h LEU 437 CO 0.04 0.55 0.55 -0.07 -0.13 0.00 0.00 178.44 179.38 1pmo h LEU 438 N 0.72 1.08 -0.04 2.25 3.38 -0.82 0.31 115.31 122.18 1pmo h LEU 438 Ca 0.19 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1pmo h LEU 438 Cb 0.02 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.50 1pmo h LEU 438 CO -0.03 0.82 0.02 -0.33 0.09 0.00 0.00 178.44 179.01 1pmo h GLU 439 N 1.24 0.06 0.00 1.13 5.08 -0.66 -0.62 114.58 120.81 1pmo h GLU 439 Ca 0.33 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.61 1pmo h GLU 439 Cb -0.07 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1pmo h GLU 439 CO -0.06 0.10 -0.33 -0.44 -1.00 0.00 0.00 179.01 177.28 1pmo h ASP 440 N -0.00 0.00 -0.15 1.42 3.32 -0.82 -1.29 116.42 118.89 1pmo h ASP 440 Ca 0.01 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 1pmo h ASP 440 Cb 0.06 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.61 1pmo h ASP 440 CO -0.00 0.33 -0.02 0.22 -1.72 0.00 0.00 179.24 178.04 1pmo h TYR 441 N 0.00 0.32 -0.29 4.55 5.03 0.07 -0.90 116.97 125.74 1pmo h TYR 441 Ca -0.00 -0.06 -0.01 0.00 2.58 0.00 0.00 58.73 61.24 1pmo h TYR 441 Cb 0.63 -0.08 -0.01 0.00 1.55 0.00 0.00 36.73 38.82 1pmo h TYR 441 CO 0.00 0.55 0.16 0.87 -1.32 0.00 0.00 178.16 178.42 1pmo h LYS 442 N -0.00 0.41 -0.79 1.82 1.57 -0.86 -1.88 116.57 116.84 1pmo h LYS 442 Ca 0.04 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1pmo h LYS 442 Cb 0.44 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.63 1pmo h LYS 442 CO 0.01 0.35 0.52 0.00 -0.57 0.00 0.00 179.45 179.76 1pmo h ALA 443 N 1.04 1.49 -0.56 3.86 0.00 -1.17 -1.34 119.26 122.57 1pmo h ALA 443 Ca 0.10 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1pmo h ALA 443 Cb 0.06 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1pmo h ALA 443 CO -0.02 0.45 -0.02 0.77 0.00 0.00 0.00 179.25 180.43 1pmo h SER 444 N 1.02 0.96 -0.65 0.00 0.02 -0.71 -1.81 113.55 112.38 1pmo h SER 444 Ca 0.30 -0.27 -0.06 0.00 -0.84 0.00 0.00 61.79 60.92 1pmo h SER 444 Cb -0.03 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.22 1pmo h SER 444 CO -0.08 1.03 0.19 -0.07 -1.14 0.00 0.00 176.83 176.76 1pmo h LEU 445 N 0.90 0.96 -0.68 5.07 3.38 -0.54 -0.97 115.31 123.43 1pmo h LEU 445 Ca 0.16 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 1pmo h LEU 445 Cb 0.56 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 1pmo h LEU 445 CO 0.03 0.93 0.13 0.50 0.09 0.00 0.00 178.44 180.13 1pmo h LYS 446 N 0.95 1.10 -0.34 1.13 3.64 -1.10 -0.84 116.57 121.11 1pmo h LYS 446 Ca 0.21 -0.28 -0.05 0.00 -1.27 0.00 0.00 60.65 59.26 1pmo h LYS 446 Cb 0.32 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 1pmo h LYS 446 CO -0.00 1.00 0.02 -0.92 -2.27 0.00 0.00 179.45 177.28 1pmo h TYR 447 N 1.03 0.64 -0.18 1.91 3.20 -0.99 -0.58 116.97 122.00 1pmo h TYR 447 Ca 0.21 -0.10 -0.05 0.00 3.14 0.00 0.00 58.73 61.93 1pmo h TYR 447 Cb 0.41 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 1pmo h TYR 447 CO 0.03 0.68 -0.11 -0.07 -1.64 0.00 0.00 178.16 177.05 1pmo h LEU 448 N 0.41 0.26 -0.43 2.82 3.38 -1.01 -0.68 115.31 120.06 1pmo h LEU 448 Ca 0.10 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 1pmo h LEU 448 Cb 0.41 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1pmo h LEU 448 CO 0.01 0.41 -0.01 -1.28 0.09 0.00 0.00 178.44 177.67 1pmo h SER 449 N 0.27 0.75 1.15 -0.43 0.87 -0.69 -2.93 113.55 112.53 1pmo h SER 449 Ca 0.05 -0.31 0.00 0.00 -1.23 0.00 0.00 61.79 60.30 1pmo h SER 449 Cb 0.37 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.13 1pmo h SER 449 CO 0.02 0.88 -0.00 0.47 -0.53 0.00 0.00 176.83 177.67 1pmo n ASP 450 N -4.40 0.25 -3.21 6.23 8.00 -0.27 -4.17 116.55 118.99 1pmo n ASP 450 Ca -0.00 0.52 -0.23 0.00 0.71 0.00 0.00 54.79 55.79 1pmo n ASP 450 Cb 0.30 -0.59 -0.06 0.00 -0.02 0.00 0.00 41.12 40.75 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 -1.74 1.07 -0.33 1.24 8.25 -0.30 -4.97 115.22 118.43 1pmo n HIS 451 Ca 0.07 -3.79 0.36 0.00 -0.26 0.00 0.00 57.72 54.09 1pmo n HIS 451 Cb 0.37 -0.42 0.75 0.00 1.12 0.00 0.00 29.99 31.80 1pmo n HIS 451 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1pmo h PRO 452 N 3.68 0.00 0.00 -0.41 0.13 -1.70 -1.91 132.00 131.78 1pmo h PRO 452 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1pmo h PRO 452 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1pmo h PRO 452 CO 0.59 0.00 0.00 0.87 -0.23 0.00 0.00 178.00 179.23 1pmo h LYS 453 N 0.00 0.00 0.00 0.86 1.57 -1.93 -2.48 116.57 114.59 1pmo h LYS 453 Ca 0.58 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 59.26 1pmo h LYS 453 Cb 2.36 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.65 1pmo h LYS 453 CO -0.01 0.00 -0.49 -0.07 -0.57 0.00 0.00 179.45 178.32 1pmo h LEU 454 N 0.00 0.00 -9.32 2.94 3.38 -1.69 -3.45 115.31 107.16 1pmo h LEU 454 Ca 0.00 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.32 1pmo h LEU 454 Cb 0.04 0.00 0.05 0.00 0.09 0.00 0.00 40.66 40.83 1pmo h LEU 454 CO 0.00 0.49 0.65 1.67 0.09 0.00 0.00 178.44 181.34 1pmo n GLN 455 N -3.95 1.51 -0.03 1.13 7.27 -0.94 -2.38 117.38 119.99 1pmo n GLN 455 Ca -0.02 0.55 0.00 0.00 0.07 0.00 0.00 57.00 57.60 1pmo n GLN 455 Cb 0.51 -2.25 0.00 0.00 2.41 0.00 0.00 30.24 30.91 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 3.11 2.17 0.14 1.69 0.00 -1.26 -4.93 105.19 106.11 1pmo n GLY 456 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 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 0.94 -3.44 -0.61 2.04 -1.78 -3.43 117.51 111.23 1pmo h ILE 457 Ca 0.00 -0.79 -0.52 0.00 1.00 0.00 0.00 64.86 64.55 1pmo h ILE 457 Cb 0.00 1.40 0.02 0.00 -0.74 0.00 0.00 36.82 37.51 1pmo h ILE 457 CO 0.00 0.18 0.60 0.00 0.00 0.00 0.00 178.15 178.93 1pmo s ALA 458 N -4.59 3.48 -0.06 1.87 0.00 -1.26 -4.92 121.76 116.27 1pmo s ALA 458 Ca -0.14 1.02 0.09 0.00 0.00 0.00 0.00 51.96 52.93 1pmo s ALA 458 Cb 0.02 -3.45 0.19 0.00 0.00 0.00 0.00 23.12 19.88 1pmo s ALA 458 CO 0.58 -0.45 1.12 0.00 0.00 0.00 0.00 175.76 177.01 1pmo n GLN 459 N 2.58 0.29 -4.55 0.00 10.64 -1.26 -4.62 117.38 120.46 1pmo n GLN 459 Ca 0.05 -1.40 -0.33 0.00 -1.83 0.00 0.00 57.00 53.49 1pmo n GLN 459 Cb 0.44 0.26 -0.14 0.00 -0.86 0.00 0.00 30.24 29.94 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 -0.20 3.44 0.45 2.61 2.00 -1.26 -5.10 119.66 121.60 1pmo s GLN 460 Ca 0.11 -0.64 -0.23 0.00 -2.00 0.00 0.00 55.36 52.59 1pmo s GLN 460 Cb 0.17 -2.75 -0.08 0.00 0.80 0.00 0.00 33.01 31.16 1pmo s GLN 460 CO -0.06 0.15 1.14 -0.80 -0.50 0.00 0.00 175.29 175.22 1pmo s ASN 461 N 0.55 6.26 0.52 6.67 0.01 -1.26 -4.94 114.94 122.75 1pmo s ASN 461 Ca -0.07 2.24 -0.02 0.00 -0.71 0.00 0.00 52.86 54.31 1pmo s ASN 461 Cb -0.15 -2.60 0.01 0.00 0.41 0.00 0.00 41.25 38.92 1pmo s ASN 461 CO 0.03 -0.85 0.78 -0.44 -1.51 0.00 0.00 177.10 175.12 1pmo s SER 462 N -1.43 5.64 0.15 -1.22 0.01 -1.06 -5.01 113.70 110.78 1pmo s SER 462 Ca 0.63 0.42 -0.31 0.00 1.31 0.00 0.00 55.95 58.00 1pmo s SER 462 Cb -0.27 -1.51 -0.11 0.00 0.21 0.00 0.00 66.02 64.34 1pmo s SER 462 CO 0.33 -0.92 1.81 0.12 0.41 0.00 0.00 173.24 174.99 1pmo s PHE 463 N -2.77 2.34 0.00 2.43 5.36 -1.26 -4.88 117.98 119.20 1pmo s PHE 463 Ca 0.52 0.05 0.00 0.00 -0.96 0.00 0.00 56.93 56.54 1pmo s PHE 463 Cb -0.10 -4.19 0.00 0.00 -0.34 0.00 0.00 43.02 38.39 1pmo s PHE 463 CO 0.41 -4.79 0.00 0.36 -1.46 0.00 0.00 175.22 169.74 1pmo n LYS 464 N 5.21 5.15 0.00 10.12 2.85 -1.26 -4.84 118.16 135.39 1pmo n LYS 464 Ca 0.17 0.00 -0.01 0.00 -1.05 0.00 0.00 58.31 57.43 1pmo n LYS 464 Cb 0.37 -0.54 0.28 0.00 -0.65 0.00 0.00 35.03 34.49 1pmo n LYS 464 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1pmo h HIS 465 N 0.00 0.54 0.00 5.58 3.86 -1.94 -3.44 115.15 119.75 1pmo h HIS 465 Ca 0.00 -0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.14 1pmo h HIS 465 Cb 0.00 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 28.32 1pmo h HIS 465 CO 0.00 0.57 0.00 -2.37 0.86 0.00 0.00 177.93 176.99