#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ry2 h ASP 75 N 0.00 -1.80 -0.92 1.08 3.45 -2.01 -2.62 116.42 113.61 1ry2 h ASP 75 Ca 0.00 0.24 0.11 0.00 0.43 0.00 0.00 57.03 57.81 1ry2 h ASP 75 Cb 0.00 0.75 -0.08 0.00 -0.56 0.00 0.00 39.33 39.44 1ry2 h ASP 75 CO 0.00 -0.35 0.55 0.22 -1.57 0.00 0.00 179.24 178.09 1ry2 h TYR 76 N -0.31 1.00 -0.62 4.55 3.20 -1.98 -1.07 116.97 121.74 1ry2 h TYR 76 Ca 0.08 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.99 1ry2 h TYR 76 Cb 0.53 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 38.45 1ry2 h TYR 76 CO -0.78 0.40 0.40 1.96 -1.64 0.00 0.00 178.16 178.51 1ry2 h GLN 77 N 0.90 0.82 0.09 1.82 7.50 -1.88 -2.01 115.11 122.36 1ry2 h GLN 77 Ca 0.45 -0.06 -0.00 0.00 0.50 0.00 0.00 58.65 59.54 1ry2 h GLN 77 Cb 0.43 -0.18 0.00 0.00 0.05 0.00 0.00 27.48 27.78 1ry2 h GLN 77 CO -0.26 0.56 -0.04 0.00 -1.50 0.00 0.00 178.83 177.58 1ry2 h ARG 78 N 0.84 -0.12 -1.19 1.46 3.08 -1.32 -3.15 114.38 113.98 1ry2 h ARG 78 Ca 0.23 0.01 0.40 0.00 0.07 0.00 0.00 59.98 60.68 1ry2 h ARG 78 Cb -0.08 0.03 -0.14 0.00 0.08 0.00 0.00 29.97 29.86 1ry2 h ARG 78 CO -0.05 -0.08 0.74 -0.07 -1.07 0.00 0.00 179.97 179.44 1ry2 h LEU 79 N -0.60 0.32 -0.03 3.04 3.38 -1.29 0.37 115.31 120.49 1ry2 h LEU 79 Ca -0.01 0.16 -0.26 0.00 0.09 0.00 0.00 57.88 57.86 1ry2 h LEU 79 Cb 0.10 0.14 0.01 0.00 0.09 0.00 0.00 40.66 40.99 1ry2 h LEU 79 CO 0.02 -0.18 -1.09 -0.74 0.09 0.00 0.00 178.44 176.54 1ry2 h HIS 80 N 0.15 0.69 -0.05 1.13 2.76 -1.50 -2.49 115.15 115.84 1ry2 h HIS 80 Ca 0.79 -0.42 -0.17 0.00 -2.20 0.00 0.00 60.37 58.37 1ry2 h HIS 80 Cb 2.27 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 31.16 1ry2 h HIS 80 CO -0.01 1.27 -0.73 -0.22 -1.30 0.00 0.00 177.93 176.93 1ry2 h LYS 81 N 0.21 0.28 -0.71 5.26 3.64 -0.57 -2.35 116.57 122.33 1ry2 h LYS 81 Ca -0.12 -0.23 -0.04 0.00 -1.27 0.00 0.00 60.65 58.98 1ry2 h LYS 81 Cb 1.75 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 33.60 1ry2 h LYS 81 CO 0.19 0.89 0.27 1.49 -2.27 0.00 0.00 179.45 180.02 1ry2 h GLU 82 N 0.18 1.07 0.00 1.90 4.81 -0.47 -0.72 114.58 121.36 1ry2 h GLU 82 Ca -0.03 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 59.00 1ry2 h GLU 82 Cb 1.30 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.51 1ry2 h GLU 82 CO 0.12 0.89 0.00 0.66 -0.73 0.00 0.00 179.01 179.95 1ry2 h SER 83 N 1.02 0.00 0.00 1.04 4.64 -1.25 -1.47 113.55 117.53 1ry2 h SER 83 Ca 0.23 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 61.16 1ry2 h SER 83 Cb 0.23 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.26 1ry2 h SER 83 CO -0.02 0.00 -2.16 -0.38 -0.87 0.00 0.00 176.83 173.40 1ry2 n ILE 84 N -2.48 1.53 0.67 0.95 -0.00 -0.90 -3.88 119.36 115.25 1ry2 n ILE 84 Ca 0.03 -0.29 0.12 0.00 -0.00 0.00 0.00 62.75 62.61 1ry2 n ILE 84 Cb 0.34 -1.91 0.18 0.00 -0.00 0.00 0.00 39.64 38.24 1ry2 n ILE 84 CO 0.00 0.00 0.00 -1.84 -0.00 0.00 0.00 176.55 174.71 1ry2 n GLU 85 N -4.26 0.22 -2.94 0.38 0.28 -0.32 -4.47 120.64 109.53 1ry2 n GLU 85 Ca -0.48 0.05 -0.13 0.00 -0.16 0.00 0.00 57.16 56.45 1ry2 n GLU 85 Cb 0.83 -1.63 0.02 0.00 1.43 0.00 0.00 31.44 32.09 1ry2 n GLU 85 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1ry2 n ASP 86 N -1.95 0.36 -0.09 -1.84 2.03 -0.56 -4.97 116.55 109.53 1ry2 n ASP 86 Ca 0.04 -2.98 0.10 0.00 0.52 0.00 0.00 54.79 52.47 1ry2 n ASP 86 Cb 0.41 -0.12 0.46 0.00 -0.72 0.00 0.00 41.12 41.16 1ry2 n ASP 86 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1ry2 h PRO 87 N 2.92 0.48 -0.38 -0.67 0.13 -1.66 -2.51 132.00 130.32 1ry2 h PRO 87 Ca -0.01 -0.03 0.08 0.00 -0.87 0.00 0.00 66.00 65.17 1ry2 h PRO 87 Cb 1.07 -0.11 -0.08 0.00 0.13 0.00 0.00 31.00 32.02 1ry2 h PRO 87 CO 0.41 0.32 -0.14 0.00 -0.23 0.00 0.00 178.00 178.35 1ry2 h ALA 88 N 1.69 0.17 -0.11 -0.56 0.00 -1.92 0.42 119.26 118.96 1ry2 h ALA 88 Ca 0.27 0.14 -0.15 0.00 0.00 0.00 0.00 54.91 55.17 1ry2 h ALA 88 Cb 0.41 0.37 0.01 0.00 0.00 0.00 0.00 17.79 18.58 1ry2 h ALA 88 CO -0.08 -0.51 -0.53 0.87 0.00 0.00 0.00 179.25 179.00 1ry2 h LYS 89 N -0.07 0.55 0.51 0.00 1.79 -1.83 -0.92 116.57 116.61 1ry2 h LYS 89 Ca 0.19 -0.45 -0.02 0.00 -2.18 0.00 0.00 60.65 58.18 1ry2 h LYS 89 Cb 0.35 0.09 -0.00 0.00 -1.58 0.00 0.00 32.23 31.09 1ry2 h LYS 89 CO -0.43 1.08 -0.28 0.35 -1.08 0.00 0.00 179.45 179.09 1ry2 h PHE 90 N 0.17 -0.73 0.00 -1.35 3.57 -1.13 -2.61 116.94 114.86 1ry2 h PHE 90 Ca -0.04 -0.01 -0.22 0.00 3.53 0.00 0.00 57.97 61.24 1ry2 h PHE 90 Cb 1.18 0.25 -0.03 0.00 2.79 0.00 0.00 35.95 40.14 1ry2 h PHE 90 CO 0.11 -0.44 -1.09 0.74 -2.23 0.00 0.00 178.31 175.40 1ry2 h PHE 91 N -0.74 0.00 -0.81 0.41 -1.00 -1.05 -3.03 116.94 110.72 1ry2 h PHE 91 Ca -0.06 0.00 0.01 0.00 2.81 0.00 0.00 57.97 60.72 1ry2 h PHE 91 Cb 0.59 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.11 1ry2 h PHE 91 CO -0.07 0.97 0.53 0.78 -1.61 0.00 0.00 178.31 178.91 1ry2 h GLY 92 N 3.12 1.14 0.93 -1.45 0.00 -1.20 0.27 103.07 105.88 1ry2 h GLY 92 Ca -0.06 -0.43 -0.11 0.00 0.00 0.00 0.00 47.33 46.73 1ry2 h GLY 92 CO 0.12 0.42 -0.30 0.23 0.00 0.00 0.00 176.54 177.01 1ry2 h SER 93 N 1.10 0.68 -0.47 0.19 0.87 -1.54 -3.01 113.55 111.36 1ry2 h SER 93 Ca 0.30 -0.50 -0.12 0.00 -1.23 0.00 0.00 61.79 60.24 1ry2 h SER 93 Cb -0.12 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 61.64 1ry2 h SER 93 CO -0.06 1.04 -0.17 0.11 -0.53 0.00 0.00 176.83 177.21 1ry2 h LYS 94 N 0.33 0.97 -0.94 2.24 1.79 -1.37 -2.41 116.57 117.18 1ry2 h LYS 94 Ca 0.03 -0.39 0.09 0.00 -2.18 0.00 0.00 60.65 58.21 1ry2 h LYS 94 Cb 0.87 -0.05 -0.07 0.00 -1.58 0.00 0.00 32.23 31.40 1ry2 h LYS 94 CO 0.07 1.06 0.60 0.00 -1.08 0.00 0.00 179.45 180.10 1ry2 h ALA 95 N 0.94 1.56 0.00 3.86 0.00 -0.45 0.28 119.26 125.45 1ry2 h ALA 95 Ca 0.12 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.87 1ry2 h ALA 95 Cb 0.74 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1ry2 h ALA 95 CO 0.06 0.25 -0.92 1.15 0.00 0.00 0.00 179.25 179.78 1ry2 h THR 96 N 0.97 0.98 0.43 0.00 2.02 -1.46 -3.17 112.91 112.69 1ry2 h THR 96 Ca 0.43 -2.50 -0.02 0.00 0.77 0.00 0.00 66.41 65.10 1ry2 h THR 96 Cb 0.37 2.44 0.00 0.00 -1.74 0.00 0.00 68.15 69.23 1ry2 h THR 96 CO -0.19 0.56 -0.21 -0.61 0.37 0.00 0.00 175.52 175.44 1ry2 h GLN 97 N 0.00 -0.56 0.00 6.66 4.15 -0.80 -3.38 115.11 121.18 1ry2 h GLN 97 Ca -0.06 0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.36 1ry2 h GLN 97 Cb 1.57 0.13 -0.01 0.00 0.21 0.00 0.00 27.48 29.38 1ry2 h GLN 97 CO 0.08 -0.38 -0.18 0.74 -1.93 0.00 0.00 178.83 177.16 1ry2 h PHE 98 N -1.10 0.00 -3.88 3.99 -1.00 -1.15 -3.46 116.94 110.34 1ry2 h PHE 98 Ca -0.06 0.00 -0.68 0.00 2.81 0.00 0.00 57.97 60.04 1ry2 h PHE 98 Cb 0.45 0.00 -0.21 0.00 3.61 0.00 0.00 35.95 39.80 1ry2 h PHE 98 CO 0.01 0.18 -0.82 -0.51 -1.61 0.00 0.00 178.31 175.56 1ry2 s LEU 99 N -6.39 2.55 -0.24 1.54 1.43 -1.20 -5.03 118.68 111.34 1ry2 s LEU 99 Ca 0.04 -0.56 -0.14 0.00 -1.03 0.00 0.00 54.13 52.44 1ry2 s LEU 99 Cb 0.07 -1.45 -0.04 0.00 0.03 0.00 0.00 46.19 44.80 1ry2 s LEU 99 CO 0.66 0.21 0.35 0.20 0.23 0.00 0.00 176.35 178.00 1ry2 s ASN 100 N -1.84 6.30 0.05 2.29 -0.87 -1.26 -4.71 114.94 114.90 1ry2 s ASN 100 Ca 0.16 0.35 0.02 0.00 -1.57 0.00 0.00 52.86 51.82 1ry2 s ASN 100 Cb -0.10 -2.20 -0.04 0.00 -0.02 0.00 0.00 41.25 38.89 1ry2 s ASN 100 CO 0.07 -0.10 0.05 0.26 -2.57 0.00 0.00 177.10 174.81 1ry2 s TRP 101 N 1.60 3.15 -0.04 2.20 0.52 -1.26 -4.58 118.94 120.52 1ry2 s TRP 101 Ca 0.15 0.08 0.02 0.00 0.02 0.00 0.00 56.10 56.37 1ry2 s TRP 101 Cb -0.15 -1.63 -0.25 0.00 -1.15 0.00 0.00 33.47 30.28 1ry2 s TRP 101 CO 0.08 0.51 0.67 0.77 0.02 0.00 0.00 176.95 179.00 1ry2 h SER 102 N 3.66 0.25 -3.02 2.95 0.02 -0.07 -3.46 113.55 113.88 1ry2 h SER 102 Ca -0.48 -0.45 -0.24 0.00 -0.84 0.00 0.00 61.79 59.79 1ry2 h SER 102 Cb 1.17 -0.08 -0.33 0.00 0.14 0.00 0.00 62.40 63.30 1ry2 h SER 102 CO 0.63 1.39 -0.56 -0.75 -1.14 0.00 0.00 176.83 176.40 1ry2 s LYS 103 N -2.60 0.12 0.47 3.45 2.20 -0.87 -4.96 119.74 117.55 1ry2 s LYS 103 Ca -0.11 0.65 -0.23 0.00 -0.36 0.00 0.00 55.97 55.92 1ry2 s LYS 103 Cb 0.07 -0.12 -0.09 0.00 -1.51 0.00 0.00 37.83 36.18 1ry2 s LYS 103 CO 0.82 -0.27 1.14 -0.35 -0.36 0.00 0.00 175.35 176.32 1ry2 n PRO 104 N 5.15 1.52 -2.84 4.03 -0.04 -1.26 -0.98 135.00 140.59 1ry2 n PRO 104 Ca -0.09 0.55 -0.36 0.00 -0.04 0.00 0.00 63.50 63.56 1ry2 n PRO 104 Cb 0.50 -2.25 -0.06 0.00 -0.04 0.00 0.00 33.50 31.65 1ry2 n PRO 104 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1ry2 s PHE 105 N -1.29 3.65 -0.01 0.54 -0.12 -1.26 -4.26 117.98 115.22 1ry2 s PHE 105 Ca 0.65 1.70 -0.00 0.00 -0.05 0.00 0.00 56.93 59.23 1ry2 s PHE 105 Cb -0.50 -2.87 -0.00 0.00 -0.63 0.00 0.00 43.02 39.02 1ry2 s PHE 105 CO 0.55 0.20 0.06 -0.44 -0.05 0.00 0.00 175.22 175.53 1ry2 h ASP 106 N 3.07 -0.01 -3.40 1.98 5.19 -0.16 -3.47 116.42 119.63 1ry2 h ASP 106 Ca -0.47 0.00 -0.67 0.00 -0.62 0.00 0.00 57.03 55.27 1ry2 h ASP 106 Cb 1.19 0.00 -0.14 0.00 0.18 0.00 0.00 39.33 40.56 1ry2 h ASP 106 CO 0.65 0.05 -0.65 -0.75 -3.12 0.00 0.00 179.24 175.41 1ry2 s LYS 107 N -1.19 2.76 0.14 3.56 2.20 -1.26 -4.91 119.74 121.04 1ry2 s LYS 107 Ca -0.00 -0.61 -0.11 0.00 -0.36 0.00 0.00 55.97 54.88 1ry2 s LYS 107 Cb 0.00 -2.65 -0.03 0.00 -1.51 0.00 0.00 37.83 33.63 1ry2 s LYS 107 CO 0.00 0.63 1.49 0.28 -0.36 0.00 0.00 175.35 177.39 1ry2 h VAL 108 N 3.60 1.27 -2.74 4.02 2.07 -1.92 0.24 116.25 122.79 1ry2 h VAL 108 Ca -0.49 -1.47 0.05 0.00 0.82 0.00 0.00 66.70 65.61 1ry2 h VAL 108 Cb 1.18 1.32 -0.11 0.00 -1.52 0.00 0.00 31.29 32.16 1ry2 h VAL 108 CO 0.57 0.49 0.32 0.72 0.02 0.00 0.00 177.57 179.69 1ry2 s PHE 109 N -4.49 -0.37 -0.38 1.57 -0.71 -1.25 -1.09 117.98 111.25 1ry2 s PHE 109 Ca -0.11 0.12 -0.16 0.00 -1.04 0.00 0.00 56.93 55.74 1ry2 s PHE 109 Cb 0.11 0.59 0.00 0.00 -1.21 0.00 0.00 43.02 42.52 1ry2 s PHE 109 CO 0.87 -0.85 0.39 0.42 -1.34 0.00 0.00 175.22 174.71 1ry2 s ILE 110 N -3.57 5.14 0.95 -4.49 1.01 -0.83 -4.99 121.20 114.42 1ry2 s ILE 110 Ca 0.05 -0.18 -0.15 0.00 0.00 0.00 0.00 60.65 60.38 1ry2 s ILE 110 Cb -0.02 -3.92 0.17 0.00 0.01 0.00 0.00 42.46 38.70 1ry2 s ILE 110 CO -0.06 -0.25 1.22 -2.16 0.00 0.00 0.00 174.94 173.68 1ry2 s PRO 111 N 2.04 0.80 -0.46 2.79 0.04 -1.26 -0.51 135.00 138.44 1ry2 s PRO 111 Ca 0.11 -0.07 -0.18 0.00 0.04 0.00 0.00 61.00 60.90 1ry2 s PRO 111 Cb -0.17 -1.83 0.04 0.00 0.04 0.00 0.00 34.50 32.58 1ry2 s PRO 111 CO 0.12 -2.36 0.53 0.34 0.04 0.00 0.00 177.00 175.67 1ry2 s ASP 112 N -4.47 6.22 0.53 6.66 3.68 -0.96 -4.32 116.67 124.02 1ry2 s ASP 112 Ca 0.68 -0.74 0.35 0.00 2.13 0.00 0.00 52.55 54.97 1ry2 s ASP 112 Cb -0.09 -2.26 1.51 0.00 -1.45 0.00 0.00 42.92 40.63 1ry2 s ASP 112 CO 0.53 -0.72 1.82 1.55 0.13 0.00 0.00 175.17 178.47 1ry2 h PRO 113 N 8.84 0.02 -2.32 4.34 0.13 -1.91 -1.57 132.00 139.54 1ry2 h PRO 113 Ca -0.27 -0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.81 1ry2 h PRO 113 Cb 1.10 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 1ry2 h PRO 113 CO 0.87 0.02 0.06 1.63 -0.23 0.00 0.00 178.00 180.35 1ry2 n LYS 114 N -4.22 0.70 -2.85 0.86 5.02 -1.26 -4.60 118.16 111.81 1ry2 n LYS 114 Ca 0.24 -0.25 -0.02 0.00 -2.02 0.00 0.00 58.31 56.26 1ry2 n LYS 114 Cb 1.17 -1.53 -0.02 0.00 -0.02 0.00 0.00 35.03 34.63 1ry2 n LYS 114 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1ry2 n THR 115 N 2.35 -7.97 -3.90 -0.18 -2.24 -1.04 -5.02 114.28 96.27 1ry2 n THR 115 Ca 0.11 1.51 -0.03 0.00 -2.27 0.00 0.00 64.05 63.38 1ry2 n THR 115 Cb 0.33 -5.05 0.02 0.00 -2.10 0.00 0.00 70.33 63.53 1ry2 n THR 115 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1ry2 s GLY 116 N -0.78 0.11 0.00 3.38 0.00 -0.62 -4.97 107.32 104.44 1ry2 s GLY 116 Ca -0.11 -0.33 0.00 0.00 0.00 0.00 0.00 44.72 44.28 1ry2 s GLY 116 CO 0.47 2.76 0.00 0.54 0.00 0.00 0.00 173.10 176.87 1ry2 n ARG 117 N -0.72 0.45 -1.65 2.90 1.74 -1.26 -4.13 116.66 113.99 1ry2 n ARG 117 Ca -0.02 0.00 -0.54 0.00 -0.77 0.00 0.00 57.85 56.52 1ry2 n ARG 117 Cb 0.59 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.97 1ry2 n ARG 117 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1ry2 n PRO 118 N -0.67 1.27 -1.85 5.56 -0.02 -1.26 -2.27 135.00 135.76 1ry2 n PRO 118 Ca 0.00 0.46 -0.40 0.00 -2.02 0.00 0.00 63.50 61.54 1ry2 n PRO 118 Cb 0.00 -2.14 0.01 0.00 -0.02 0.00 0.00 33.50 31.35 1ry2 n PRO 118 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1ry2 s SER 119 N 1.89 6.07 -0.09 2.55 0.15 0.33 -2.99 113.70 121.63 1ry2 s SER 119 Ca 0.90 2.90 -0.23 0.00 0.70 0.00 0.00 55.95 60.22 1ry2 s SER 119 Cb -0.97 -2.65 -0.29 0.00 -1.71 0.00 0.00 66.02 60.40 1ry2 s SER 119 CO 0.54 -1.04 0.78 -0.26 1.20 0.00 0.00 173.24 174.46 1ry2 h PHE 120 N 2.56 0.37 -0.54 3.44 0.05 -1.89 -2.18 116.94 118.75 1ry2 h PHE 120 Ca -0.51 -0.27 -0.07 0.00 3.82 0.00 0.00 57.97 60.94 1ry2 h PHE 120 Cb 1.26 -0.01 -0.02 0.00 2.00 0.00 0.00 35.95 39.17 1ry2 h PHE 120 CO 0.51 1.28 0.05 0.37 -0.18 0.00 0.00 178.31 180.34 1ry2 h GLN 121 N -0.55 0.88 -0.17 1.51 4.15 -1.98 -3.20 115.11 115.75 1ry2 h GLN 121 Ca -0.14 -0.23 -0.12 0.00 0.77 0.00 0.00 58.65 58.94 1ry2 h GLN 121 Cb 1.48 -0.11 -0.09 0.00 0.21 0.00 0.00 27.48 28.98 1ry2 h GLN 121 CO 0.08 0.85 -0.52 0.09 -1.93 0.00 0.00 178.83 177.40 1ry2 n ASN 122 N -4.22 2.38 -4.62 -0.69 3.02 -1.26 -5.06 115.26 104.81 1ry2 n ASN 122 Ca 0.03 -3.87 -0.56 0.00 -0.03 0.00 0.00 54.58 50.15 1ry2 n ASN 122 Cb 0.29 -0.51 -0.07 0.00 -0.61 0.00 0.00 39.78 38.88 1ry2 n ASN 122 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1ry2 n ASN 123 N -1.05 1.60 -3.63 6.41 4.05 -0.82 -4.69 115.26 117.13 1ry2 n ASN 123 Ca 0.25 1.12 -0.04 0.00 0.45 0.00 0.00 54.58 56.36 1ry2 n ASN 123 Cb 0.77 -1.12 -0.06 0.00 1.23 0.00 0.00 39.78 40.60 1ry2 n ASN 123 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1ry2 s ALA 124 N 1.48 -2.15 0.13 5.20 0.00 -1.26 -5.00 121.76 120.16 1ry2 s ALA 124 Ca 0.91 2.29 0.10 0.00 0.00 0.00 0.00 51.96 55.26 1ry2 s ALA 124 Cb -1.07 -1.63 -0.04 0.00 0.00 0.00 0.00 23.12 20.38 1ry2 s ALA 124 CO 0.56 -0.43 -0.26 -1.58 0.00 0.00 0.00 175.76 174.06 1ry2 s TRP 125 N 1.60 2.20 -1.29 0.00 0.52 -1.26 -1.96 118.94 118.75 1ry2 s TRP 125 Ca -0.09 -0.39 -0.00 0.00 0.02 0.00 0.00 56.10 55.64 1ry2 s TRP 125 Cb -0.05 -1.19 0.00 0.00 -1.15 0.00 0.00 33.47 31.09 1ry2 s TRP 125 CO -0.17 0.32 0.78 1.19 0.02 0.00 0.00 176.95 179.09 1ry2 n PHE 126 N 0.92 -2.00 -1.43 -1.98 3.72 -0.25 -4.56 117.46 111.88 1ry2 n PHE 126 Ca -0.18 0.87 -0.44 0.00 -0.05 0.00 0.00 57.45 57.65 1ry2 n PHE 126 Cb 0.53 -4.56 -0.01 0.00 -0.94 0.00 0.00 39.48 34.50 1ry2 n PHE 126 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1ry2 n LEU 127 N -4.25 -0.55 0.00 4.37 4.77 0.84 -1.55 117.00 120.62 1ry2 n LEU 127 Ca -0.29 1.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.69 1ry2 n LEU 127 Cb 0.67 -1.06 0.00 0.00 -2.33 0.00 0.00 43.42 40.70 1ry2 n LEU 127 CO 0.67 -2.89 0.00 0.59 -1.33 0.00 0.00 177.39 174.42 1ry2 n ASN 128 N 1.65 -4.11 -4.83 -1.43 5.03 -1.26 0.54 115.26 110.85 1ry2 n ASN 128 Ca 0.13 0.00 -0.33 0.00 0.87 0.00 0.00 54.58 55.25 1ry2 n ASN 128 Cb 0.34 -2.85 -0.07 0.00 -1.02 0.00 0.00 39.78 36.19 1ry2 n ASN 128 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1ry2 s GLY 129 N -1.68 2.37 -0.04 7.41 0.00 -0.60 -4.61 107.32 110.17 1ry2 s GLY 129 Ca 0.00 0.26 0.03 0.00 0.00 0.00 0.00 44.72 45.01 1ry2 s GLY 129 CO 0.00 0.51 -0.12 1.20 0.00 0.00 0.00 173.10 174.69 1ry2 s GLN 130 N -3.11 1.41 0.38 2.90 -0.21 -0.15 0.56 119.66 121.44 1ry2 s GLN 130 Ca 0.59 -0.42 -0.14 0.00 0.02 0.00 0.00 55.36 55.41 1ry2 s GLN 130 Cb -0.09 -1.23 0.05 0.00 1.00 0.00 0.00 33.01 32.73 1ry2 s GLN 130 CO 0.15 0.12 0.75 -0.48 -2.12 0.00 0.00 175.29 173.71 1ry2 s LEU 131 N 0.30 0.16 -0.06 2.90 2.34 -0.82 0.72 118.68 124.22 1ry2 s LEU 131 Ca -0.07 -1.21 -0.01 0.00 0.06 0.00 0.00 54.13 52.90 1ry2 s LEU 131 Cb -0.12 2.66 0.03 0.00 -0.56 0.00 0.00 46.19 48.20 1ry2 s LEU 131 CO 0.02 -1.65 0.01 0.21 -1.06 0.00 0.00 176.35 173.88 1ry2 s ASN 132 N -3.10 1.26 0.06 1.48 2.47 -1.26 -2.33 114.94 113.52 1ry2 s ASN 132 Ca 0.18 -0.04 -0.21 0.00 0.42 0.00 0.00 52.86 53.21 1ry2 s ASN 132 Cb -0.04 -0.33 -0.09 0.00 -1.45 0.00 0.00 41.25 39.33 1ry2 s ASN 132 CO 0.13 -0.19 1.34 0.00 -3.72 0.00 0.00 177.10 174.67 1ry2 h ALA 133 N 8.12 -0.83 -1.01 1.71 0.00 -1.91 -0.85 119.26 124.49 1ry2 h ALA 133 Ca -0.22 -0.07 0.24 0.00 0.00 0.00 0.00 54.91 54.85 1ry2 h ALA 133 Cb 1.13 0.73 -0.10 0.00 0.00 0.00 0.00 17.79 19.54 1ry2 h ALA 133 CO 0.28 -0.91 0.63 0.00 0.00 0.00 0.00 179.25 179.25 1ry2 h TYR 135 N 0.53 0.99 0.00 0.00 3.20 -1.76 0.12 116.97 120.05 1ry2 h TYR 135 Ca 0.59 -0.06 -0.05 0.00 3.14 0.00 0.00 58.73 62.35 1ry2 h TYR 135 Cb 1.25 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 39.21 1ry2 h TYR 135 CO -0.00 0.75 -0.26 -0.91 -1.64 0.00 0.00 178.16 176.10 1ry2 h ASN 136 N 0.94 0.00 0.72 -2.11 2.35 0.14 -2.82 115.58 114.80 1ry2 h ASN 136 Ca 0.23 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.98 1ry2 h ASN 136 Cb 0.16 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.53 1ry2 h ASN 136 CO -0.02 0.26 -1.12 0.00 -1.65 0.00 0.00 177.43 174.90 1ry2 n VAL 138 N -2.42 0.00 -0.02 0.00 0.31 0.38 -4.58 118.33 112.01 1ry2 n VAL 138 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1ry2 n VAL 138 Cb 0.52 -0.37 -0.00 0.00 -0.91 0.00 0.00 33.84 33.08 1ry2 n VAL 138 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1ry2 n ASP 139 N -1.97 -0.04 -0.37 4.52 9.92 -1.17 -0.89 116.55 126.56 1ry2 n ASP 139 Ca 0.00 0.74 0.38 0.00 -0.53 0.00 0.00 54.79 55.38 1ry2 n ASP 139 Cb 0.00 -0.35 0.76 0.00 -0.64 0.00 0.00 41.12 40.89 1ry2 n ASP 139 CO 0.00 0.00 0.00 0.08 0.13 0.00 0.00 177.20 177.41 1ry2 h ARG 140 N 0.00 0.00 0.00 -1.24 0.11 -1.82 0.42 114.38 111.85 1ry2 h ARG 140 Ca 0.01 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 60.00 1ry2 h ARG 140 Cb 0.01 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.08 1ry2 h ARG 140 CO -0.03 0.00 -1.10 0.45 0.10 0.00 0.00 179.97 179.39 1ry2 h HIS 141 N 0.00 0.00 0.00 4.08 3.86 -1.30 -3.24 115.15 118.55 1ry2 h HIS 141 Ca 0.61 0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 59.64 1ry2 h HIS 141 Cb 2.48 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 30.93 1ry2 h HIS 141 CO 0.00 0.30 -0.84 0.00 0.86 0.00 0.00 177.93 178.25 1ry2 h ALA 142 N 1.70 0.61 -0.24 2.45 0.00 0.68 -0.19 119.26 124.27 1ry2 h ALA 142 Ca -0.08 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.08 1ry2 h ALA 142 Cb 1.30 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1ry2 h ALA 142 CO 0.03 1.03 0.00 1.28 0.00 0.00 0.00 179.25 181.58 1ry2 n LEU 143 N -3.56 1.35 0.08 0.00 4.77 -0.52 -3.06 117.00 116.06 1ry2 n LEU 143 Ca -0.01 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.31 1ry2 n LEU 143 Cb 0.80 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.73 1ry2 n LEU 143 CO 0.45 0.33 0.00 0.29 -1.33 0.00 0.00 177.39 177.13 1ry2 n LYS 144 N 0.22 0.00 -3.40 3.23 5.02 -1.15 -4.94 118.16 117.14 1ry2 n LYS 144 Ca 0.10 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.12 1ry2 n LYS 144 Cb 0.22 -0.24 -0.08 0.00 -0.02 0.00 0.00 35.03 34.91 1ry2 n LYS 144 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1ry2 n THR 145 N -3.35 2.16 0.08 -0.18 -2.24 -0.09 -4.92 114.28 105.73 1ry2 n THR 145 Ca 0.00 -5.14 0.11 0.00 -2.27 0.00 0.00 64.05 56.74 1ry2 n THR 145 Cb 0.00 -2.09 0.58 0.00 -2.10 0.00 0.00 70.33 66.72 1ry2 n THR 145 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1ry2 h PRO 146 N 4.16 0.19 -0.00 -0.78 0.13 -1.58 -2.63 132.00 131.49 1ry2 h PRO 146 Ca 0.19 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1ry2 h PRO 146 Cb 0.68 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.76 1ry2 h PRO 146 CO 0.81 0.12 -0.27 0.09 -0.23 0.00 0.00 178.00 178.53 1ry2 n ASN 147 N -4.48 0.53 -4.79 1.44 3.02 -1.26 -2.63 115.26 107.09 1ry2 n ASN 147 Ca 0.04 -0.35 -0.36 0.00 -0.03 0.00 0.00 54.58 53.88 1ry2 n ASN 147 Cb 0.25 0.02 -0.05 0.00 -0.61 0.00 0.00 39.78 39.39 1ry2 n ASN 147 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1ry2 s LYS 148 N -2.76 4.32 0.22 3.52 2.20 -0.99 -4.85 119.74 121.40 1ry2 s LYS 148 Ca 0.19 1.36 -0.30 0.00 -0.36 0.00 0.00 55.97 56.87 1ry2 s LYS 148 Cb 0.19 -2.55 -0.09 0.00 -1.51 0.00 0.00 37.83 33.87 1ry2 s LYS 148 CO 0.58 0.03 1.10 0.15 -0.36 0.00 0.00 175.35 176.85 1ry2 s LYS 149 N -2.49 4.61 -0.20 4.03 1.02 -1.26 -1.45 119.74 124.00 1ry2 s LYS 149 Ca 0.56 1.76 -0.10 0.00 0.02 0.00 0.00 55.97 58.21 1ry2 s LYS 149 Cb -0.18 -3.24 -0.09 0.00 -0.52 0.00 0.00 37.83 33.81 1ry2 s LYS 149 CO 0.23 0.13 -0.27 0.00 -0.92 0.00 0.00 175.35 174.53 1ry2 n ALA 150 N 1.84 1.66 -3.12 5.17 0.00 0.14 -4.17 120.51 122.03 1ry2 n ALA 150 Ca 0.01 -0.82 -0.32 0.00 0.00 0.00 0.00 53.44 52.31 1ry2 n ALA 150 Cb 0.45 0.23 -0.16 0.00 0.00 0.00 0.00 19.45 19.97 1ry2 n ALA 150 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ry2 s ILE 151 N -2.39 2.26 -0.31 0.00 1.01 -0.87 -1.49 121.20 119.41 1ry2 s ILE 151 Ca -0.29 -0.96 0.01 0.00 0.00 0.00 0.00 60.65 59.41 1ry2 s ILE 151 Cb 0.11 -1.87 0.07 0.00 0.01 0.00 0.00 42.46 40.77 1ry2 s ILE 151 CO 0.36 0.56 -0.01 -0.63 0.00 0.00 0.00 174.94 175.22 1ry2 s ILE 152 N 0.26 2.63 0.28 2.92 1.01 -0.62 -0.79 121.20 126.90 1ry2 s ILE 152 Ca -0.15 -1.70 -0.07 0.00 0.00 0.00 0.00 60.65 58.72 1ry2 s ILE 152 Cb -0.17 -2.63 -0.06 0.00 0.01 0.00 0.00 42.46 39.61 1ry2 s ILE 152 CO 0.08 -0.23 0.58 0.12 0.00 0.00 0.00 174.94 175.49 1ry2 s PHE 153 N 1.13 3.46 -0.23 3.97 5.36 -0.16 -0.24 117.98 131.27 1ry2 s PHE 153 Ca -0.02 0.78 -0.03 0.00 -0.96 0.00 0.00 56.93 56.69 1ry2 s PHE 153 Cb -0.20 -2.21 0.10 0.00 -0.34 0.00 0.00 43.02 40.37 1ry2 s PHE 153 CO -0.04 0.17 0.22 -2.00 -1.46 0.00 0.00 175.22 172.12 1ry2 s GLU 154 N -3.31 0.21 1.39 10.12 2.56 0.20 -2.87 118.70 126.99 1ry2 s GLU 154 Ca 0.46 0.04 -0.21 0.00 0.00 0.00 0.00 54.97 55.26 1ry2 s GLU 154 Cb -0.11 -1.12 0.35 0.00 2.00 0.00 0.00 34.13 35.25 1ry2 s GLU 154 CO 0.27 -0.77 0.86 0.41 -0.56 0.00 0.00 175.26 175.46 1ry2 n GLY 155 N 5.31 -3.43 0.18 -1.50 0.00 -1.26 -2.61 105.19 101.88 1ry2 n GLY 155 Ca -0.05 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.44 1ry2 n GLY 155 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1ry2 h ASP 156 N -3.38 0.08 -3.07 1.61 -0.00 -1.84 -3.42 116.42 106.40 1ry2 h ASP 156 Ca -0.45 -0.03 -0.61 0.00 -0.00 0.00 0.00 57.03 55.94 1ry2 h ASP 156 Cb 1.31 -0.02 -0.06 0.00 -0.00 0.00 0.00 39.33 40.55 1ry2 h ASP 156 CO 0.30 0.52 -0.22 -1.61 -0.00 0.00 0.00 179.24 178.22 1ry2 s GLU 157 N -4.02 3.99 0.00 0.28 0.41 -1.26 -4.68 118.70 113.41 1ry2 s GLU 157 Ca -0.03 0.35 0.00 0.00 -0.41 0.00 0.00 54.97 54.88 1ry2 s GLU 157 Cb 0.14 -3.27 0.00 0.00 -1.78 0.00 0.00 34.13 29.21 1ry2 s GLU 157 CO 0.75 0.57 0.00 -2.30 -0.49 0.00 0.00 175.26 173.79 1ry2 n PRO 158 N 2.29 0.00 -0.89 0.39 -0.02 -1.26 -3.41 135.00 132.11 1ry2 n PRO 158 Ca -0.13 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 60.99 1ry2 n PRO 158 Cb 0.52 -0.01 -0.05 0.00 -0.02 0.00 0.00 33.50 33.94 1ry2 n PRO 158 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ry2 n GLY 159 N 0.00 2.34 0.32 -1.23 0.00 -1.26 -4.08 105.19 101.28 1ry2 n GLY 159 Ca 0.00 -1.05 0.03 0.00 0.00 0.00 0.00 46.02 45.00 1ry2 n GLY 159 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ry2 n GLN 160 N 6.41 0.49 -2.28 1.61 1.13 -1.22 -5.07 117.38 118.45 1ry2 n GLN 160 Ca 0.45 -1.49 -0.25 0.00 -1.94 0.00 0.00 57.00 53.77 1ry2 n GLN 160 Cb 0.32 -0.83 0.07 0.00 0.11 0.00 0.00 30.24 29.91 1ry2 n GLN 160 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1ry2 s GLY 161 N -1.54 1.72 -0.18 1.08 0.00 -1.26 -4.12 107.32 103.02 1ry2 s GLY 161 Ca 0.10 -1.05 -0.35 0.00 0.00 0.00 0.00 44.72 43.42 1ry2 s GLY 161 CO 0.01 -0.63 1.24 -2.52 0.00 0.00 0.00 173.10 171.19 1ry2 s TYR 162 N -3.20 -0.11 0.27 1.90 -0.85 -1.14 -5.00 117.35 109.22 1ry2 s TYR 162 Ca 0.61 0.06 0.11 0.00 -0.52 0.00 0.00 57.07 57.33 1ry2 s TYR 162 Cb -0.10 0.52 -0.05 0.00 0.38 0.00 0.00 41.96 42.71 1ry2 s TYR 162 CO 0.44 -0.19 -0.15 -1.12 -1.52 0.00 0.00 175.55 173.01 1ry2 s SER 163 N -2.26 3.84 -0.19 -0.18 0.01 -1.26 -0.99 113.70 112.67 1ry2 s SER 163 Ca 0.10 -0.92 0.01 0.00 1.31 0.00 0.00 55.95 56.45 1ry2 s SER 163 Cb -0.00 -0.44 0.04 0.00 0.21 0.00 0.00 66.02 65.82 1ry2 s SER 163 CO -0.04 0.03 -0.10 -0.63 0.41 0.00 0.00 173.24 172.91 1ry2 s ILE 164 N -2.42 1.60 1.21 1.44 1.01 0.03 -5.00 121.20 119.09 1ry2 s ILE 164 Ca 0.30 -0.96 -0.17 0.00 0.00 0.00 0.00 60.65 59.81 1ry2 s ILE 164 Cb -0.06 -1.68 0.29 0.00 0.01 0.00 0.00 42.46 41.03 1ry2 s ILE 164 CO 0.16 0.18 1.04 0.28 0.00 0.00 0.00 174.94 176.61 1ry2 s THR 165 N 1.42 1.67 0.19 2.92 -1.32 -1.26 0.26 115.64 119.51 1ry2 s THR 165 Ca -0.01 0.00 0.07 0.00 -1.21 0.00 0.00 61.69 60.54 1ry2 s THR 165 Cb -0.16 -2.30 -0.13 0.00 -1.51 0.00 0.00 72.50 68.40 1ry2 s THR 165 CO -0.08 0.00 1.42 1.88 -2.21 0.00 0.00 174.62 175.63 1ry2 h TYR 166 N -2.68 0.09 -0.44 9.09 -1.99 -1.28 -2.74 116.97 117.02 1ry2 h TYR 166 Ca -0.50 -0.05 -0.01 0.00 2.00 0.00 0.00 58.73 60.16 1ry2 h TYR 166 Cb 1.32 -0.01 -0.02 0.00 2.00 0.00 0.00 36.73 40.02 1ry2 h TYR 166 CO -1.42 0.86 0.23 -0.22 -0.00 0.00 0.00 178.16 177.62 1ry2 h LYS 167 N 0.03 0.62 -0.04 4.88 3.64 -1.78 -2.03 116.57 121.89 1ry2 h LYS 167 Ca -0.02 -0.08 -0.16 0.00 -1.27 0.00 0.00 60.65 59.12 1ry2 h LYS 167 Cb 1.46 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 33.15 1ry2 h LYS 167 CO 0.11 0.51 -0.67 0.93 -2.27 0.00 0.00 179.45 178.06 1ry2 h GLU 168 N 0.58 0.20 -0.55 1.90 5.08 -1.84 -2.57 114.58 117.37 1ry2 h GLU 168 Ca 0.15 -0.16 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 1ry2 h GLU 168 Cb 0.08 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1ry2 h GLU 168 CO -0.02 0.80 -0.03 1.25 -1.00 0.00 0.00 179.01 180.00 1ry2 h LEU 169 N 0.14 0.95 -0.16 1.33 5.85 -1.38 -0.40 115.31 121.64 1ry2 h LEU 169 Ca -0.01 -0.27 0.02 0.00 0.84 0.00 0.00 57.88 58.46 1ry2 h LEU 169 Cb 1.20 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.96 1ry2 h LEU 169 CO 0.10 1.02 0.02 0.25 -0.34 0.00 0.00 178.44 179.49 1ry2 h LEU 170 N 0.88 -0.02 -0.06 2.25 5.85 -1.16 0.15 115.31 123.20 1ry2 h LEU 170 Ca 0.16 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.93 1ry2 h LEU 170 Cb 0.56 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 1ry2 h LEU 170 CO 0.03 0.01 -0.10 -0.33 -0.34 0.00 0.00 178.44 177.72 1ry2 h GLU 171 N 0.08 -0.14 0.21 1.25 5.08 -1.08 -1.63 114.58 118.36 1ry2 h GLU 171 Ca 0.07 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 1ry2 h GLU 171 Cb 0.07 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1ry2 h GLU 171 CO -0.11 -0.09 -0.10 0.93 -1.00 0.00 0.00 179.01 178.64 1ry2 h GLU 172 N -0.14 -0.28 0.00 2.33 4.39 -0.70 -1.93 114.58 118.25 1ry2 h GLU 172 Ca 0.06 0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.77 1ry2 h GLU 172 Cb 0.22 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 28.94 1ry2 h GLU 172 CO -0.14 -0.18 -0.01 0.28 -1.16 0.00 0.00 179.01 177.79 1ry2 h VAL 173 N -0.29 0.25 0.10 3.13 2.07 -0.64 -2.11 116.25 118.76 1ry2 h VAL 173 Ca -0.03 -0.08 -0.27 0.00 0.82 0.00 0.00 66.70 67.14 1ry2 h VAL 173 Cb 0.22 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1ry2 h VAL 173 CO 0.05 0.01 -1.31 0.00 0.02 0.00 0.00 177.57 176.34 1ry2 h GLN 175 N 0.06 0.39 -0.05 0.00 4.20 -0.81 -2.89 115.11 116.01 1ry2 h GLN 175 Ca -0.15 -0.31 -0.18 0.00 0.06 0.00 0.00 58.65 58.06 1ry2 h GLN 175 Cb 1.96 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 29.79 1ry2 h GLN 175 CO 0.17 0.94 -0.76 0.28 -0.67 0.00 0.00 178.83 178.79 1ry2 h VAL 176 N 0.27 1.41 -0.60 -0.54 2.07 -1.48 -1.40 116.25 115.98 1ry2 h VAL 176 Ca -0.02 -2.26 -0.05 0.00 0.82 0.00 0.00 66.70 65.19 1ry2 h VAL 176 Cb 1.27 2.21 -0.03 0.00 -1.52 0.00 0.00 31.29 33.22 1ry2 h VAL 176 CO 0.12 0.67 0.16 0.00 0.02 0.00 0.00 177.57 178.54 1ry2 h ALA 177 N 0.97 1.14 0.00 1.67 0.00 -1.37 -1.31 119.26 120.36 1ry2 h ALA 177 Ca -0.03 -0.21 -0.15 0.00 0.00 0.00 0.00 54.91 54.51 1ry2 h ALA 177 Cb 1.35 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1ry2 h ALA 177 CO 0.13 0.58 -0.70 1.96 0.00 0.00 0.00 179.25 181.22 1ry2 h GLN 178 N 0.90 0.00 -0.46 0.00 4.20 -1.35 -2.24 115.11 116.16 1ry2 h GLN 178 Ca 0.20 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.85 1ry2 h GLN 178 Cb 0.31 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.07 1ry2 h GLN 178 CO -0.00 0.70 0.08 0.28 -0.67 0.00 0.00 178.83 179.22 1ry2 h VAL 179 N 0.00 1.25 -0.40 -0.54 2.07 -0.58 0.17 116.25 118.21 1ry2 h VAL 179 Ca -0.01 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.59 1ry2 h VAL 179 Cb 1.30 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 1ry2 h VAL 179 CO 0.09 0.32 0.17 -0.07 0.02 0.00 0.00 177.57 178.10 1ry2 h LEU 180 N 0.63 0.55 -0.01 2.57 3.38 -1.16 0.53 115.31 121.80 1ry2 h LEU 180 Ca 0.14 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1ry2 h LEU 180 Cb 0.38 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1ry2 h LEU 180 CO 0.01 0.56 -0.03 0.74 0.09 0.00 0.00 178.44 179.80 1ry2 h THR 181 N 0.51 1.48 0.10 0.22 2.02 -1.29 0.95 112.91 116.90 1ry2 h THR 181 Ca 0.14 -1.45 -0.34 0.00 0.77 0.00 0.00 66.41 65.53 1ry2 h THR 181 Cb 0.17 2.42 -0.02 0.00 -1.74 0.00 0.00 68.15 68.98 1ry2 h THR 181 CO -0.01 0.38 -1.86 1.88 0.37 0.00 0.00 175.52 176.28 1ry2 h TYR 182 N -0.55 0.40 0.02 3.16 0.05 -1.04 -3.01 116.97 116.00 1ry2 h TYR 182 Ca -0.00 -0.29 -0.29 0.00 0.05 0.00 0.00 58.73 58.20 1ry2 h TYR 182 Cb 0.64 -0.02 -0.04 0.00 1.01 0.00 0.00 36.73 38.32 1ry2 h TYR 182 CO 0.14 1.56 -1.64 0.77 -1.05 0.00 0.00 178.16 177.93 1ry2 h SER 183 N 0.06 0.07 0.00 3.88 0.02 -1.03 -3.40 113.55 113.15 1ry2 h SER 183 Ca -0.37 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 1ry2 h SER 183 Cb 2.04 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 64.55 1ry2 h SER 183 CO 0.10 1.12 -0.98 0.23 -1.14 0.00 0.00 176.83 176.16 1ry2 n MET 184 N -3.15 1.96 -1.77 3.45 2.81 -0.85 -5.03 117.12 114.54 1ry2 n MET 184 Ca -0.16 -0.05 -0.03 0.00 -1.81 0.00 0.00 57.70 55.65 1ry2 n MET 184 Cb 1.04 -1.09 -0.01 0.00 -0.71 0.00 0.00 33.22 32.46 1ry2 n MET 184 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ry2 n GLY 185 N 1.64 0.35 3.76 3.03 0.00 -0.41 -4.85 105.19 108.71 1ry2 n GLY 185 Ca -0.00 -0.80 -0.39 0.00 0.00 0.00 0.00 46.02 44.83 1ry2 n GLY 185 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ry2 s VAL 186 N -2.16 3.70 0.33 1.61 1.01 0.20 -4.97 120.40 120.12 1ry2 s VAL 186 Ca 0.00 1.60 0.06 0.00 0.00 0.00 0.00 61.98 63.65 1ry2 s VAL 186 Cb 0.00 -3.98 -0.06 0.00 0.00 0.00 0.00 36.38 32.34 1ry2 s VAL 186 CO 0.00 0.30 -0.02 -0.13 0.00 0.00 0.00 175.10 175.25 1ry2 s ARG 187 N -1.65 1.70 -0.03 2.72 1.81 -1.26 -4.38 118.95 117.86 1ry2 s ARG 187 Ca 0.47 -1.90 -0.31 0.00 -1.72 0.00 0.00 55.73 52.26 1ry2 s ARG 187 Cb -0.28 -1.27 -0.10 0.00 -0.45 0.00 0.00 34.95 32.85 1ry2 s ARG 187 CO 0.35 -0.02 1.97 1.17 -0.68 0.00 0.00 175.30 178.10 1ry2 n LYS 188 N -0.72 2.55 0.00 3.54 4.81 -1.25 -2.03 118.16 125.05 1ry2 n LYS 188 Ca -0.05 0.92 0.00 0.00 -0.87 0.00 0.00 58.31 58.31 1ry2 n LYS 188 Cb 0.65 -2.90 0.00 0.00 0.02 0.00 0.00 35.03 32.80 1ry2 n LYS 188 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ry2 n GLY 189 N 4.64 2.61 3.73 3.14 0.00 0.66 -4.93 105.19 115.05 1ry2 n GLY 189 Ca 0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 1ry2 n GLY 189 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ry2 s ASP 190 N -1.49 4.01 -0.28 1.61 1.11 -0.86 -4.63 116.67 116.14 1ry2 s ASP 190 Ca 0.00 2.07 -0.11 0.00 0.18 0.00 0.00 52.55 54.69 1ry2 s ASP 190 Cb 0.00 -2.55 -0.05 0.00 1.07 0.00 0.00 42.92 41.39 1ry2 s ASP 190 CO 0.00 -2.37 0.18 -0.89 1.18 0.00 0.00 175.17 173.27 1ry2 s THR 191 N -2.57 5.26 -0.29 -1.27 2.01 -1.26 -1.37 115.64 116.14 1ry2 s THR 191 Ca 0.66 0.15 -0.09 0.00 0.31 0.00 0.00 61.69 62.72 1ry2 s THR 191 Cb -0.22 -3.51 -0.01 0.00 0.01 0.00 0.00 72.50 68.77 1ry2 s THR 191 CO 0.53 0.25 0.13 -0.69 -0.69 0.00 0.00 174.62 174.15 1ry2 s VAL 192 N 1.75 4.57 0.13 3.82 1.01 -0.60 -3.80 120.40 127.28 1ry2 s VAL 192 Ca 0.07 -0.33 -0.28 0.00 0.00 0.00 0.00 61.98 61.44 1ry2 s VAL 192 Cb -0.16 -3.28 -0.07 0.00 0.00 0.00 0.00 36.38 32.88 1ry2 s VAL 192 CO 0.11 0.14 0.87 0.00 0.00 0.00 0.00 175.10 176.22 1ry2 s ALA 193 N 1.62 3.33 -0.16 5.51 0.00 -1.12 -0.53 121.76 130.40 1ry2 s ALA 193 Ca 0.05 0.47 0.00 0.00 0.00 0.00 0.00 51.96 52.49 1ry2 s ALA 193 Cb -0.17 -3.14 0.03 0.00 0.00 0.00 0.00 23.12 19.84 1ry2 s ALA 193 CO 0.06 0.09 -0.13 0.08 0.00 0.00 0.00 175.76 175.86 1ry2 s VAL 194 N -0.42 1.59 -0.62 0.00 1.01 0.06 -1.76 120.40 120.26 1ry2 s VAL 194 Ca 0.42 -0.73 0.05 0.00 0.00 0.00 0.00 61.98 61.71 1ry2 s VAL 194 Cb -0.23 -1.54 0.16 0.00 0.00 0.00 0.00 36.38 34.77 1ry2 s VAL 194 CO 0.28 0.38 0.43 -0.47 0.00 0.00 0.00 175.10 175.72 1ry2 s TYR 195 N 1.46 2.99 0.11 5.22 5.04 -0.03 0.00 117.35 132.14 1ry2 s TYR 195 Ca 0.03 -3.08 0.00 0.00 -2.44 0.00 0.00 57.07 51.58 1ry2 s TYR 195 Cb -0.14 -2.34 -0.04 0.00 0.35 0.00 0.00 41.96 39.79 1ry2 s TYR 195 CO -0.10 -0.63 -0.00 -1.64 -1.34 0.00 0.00 175.55 171.84 1ry2 s MET 196 N -0.96 0.86 0.82 4.97 -1.94 -1.26 -4.20 119.30 117.59 1ry2 s MET 196 Ca 0.25 -1.38 -0.05 0.00 -1.71 0.00 0.00 55.69 52.80 1ry2 s MET 196 Cb -0.06 0.05 0.17 0.00 2.01 0.00 0.00 34.83 37.00 1ry2 s MET 196 CO -0.15 -0.15 1.13 -1.25 -0.01 0.00 0.00 175.02 174.59 1ry2 s PRO 197 N -3.95 1.16 -1.21 2.03 0.04 -1.26 -4.13 135.00 127.68 1ry2 s PRO 197 Ca 0.17 -1.02 -0.20 0.00 0.04 0.00 0.00 61.00 59.99 1ry2 s PRO 197 Cb 0.07 -2.17 0.04 0.00 0.04 0.00 0.00 34.50 32.48 1ry2 s PRO 197 CO -0.02 -1.89 1.70 -1.64 0.04 0.00 0.00 177.00 175.19 1ry2 s MET 198 N -5.42 3.69 0.12 4.56 -1.94 -1.26 -4.65 119.30 114.39 1ry2 s MET 198 Ca 0.71 -1.64 0.03 0.00 -1.71 0.00 0.00 55.69 53.08 1ry2 s MET 198 Cb -0.03 -5.45 -0.04 0.00 2.01 0.00 0.00 34.83 31.31 1ry2 s MET 198 CO 0.48 -2.47 -0.09 0.14 -0.01 0.00 0.00 175.02 173.07 1ry2 s VAL 199 N 5.32 0.97 0.16 -6.03 -7.23 -1.26 -3.09 120.40 109.25 1ry2 s VAL 199 Ca 0.54 -1.94 -0.22 0.00 -1.81 0.00 0.00 61.98 58.56 1ry2 s VAL 199 Cb 0.02 -1.69 0.06 0.00 0.56 0.00 0.00 36.38 35.33 1ry2 s VAL 199 CO 0.04 -0.75 1.61 -0.65 -0.31 0.00 0.00 175.10 175.04 1ry2 h PRO 200 N 3.00 -0.23 -0.93 4.82 0.11 -1.92 -1.78 132.00 135.07 1ry2 h PRO 200 Ca -0.36 0.02 0.27 0.00 0.11 0.00 0.00 66.00 66.03 1ry2 h PRO 200 Cb 1.18 0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.31 1ry2 h PRO 200 CO 0.62 -0.15 0.89 0.93 -0.21 0.00 0.00 178.00 180.08 1ry2 h GLU 201 N -0.24 0.00 -0.23 1.05 3.07 -1.97 0.88 114.58 117.14 1ry2 h GLU 201 Ca 0.17 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.95 1ry2 h GLU 201 Cb 0.50 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.41 1ry2 h GLU 201 CO -0.48 0.00 -0.15 0.00 -1.40 0.00 0.00 179.01 176.98 1ry2 h ALA 202 N 1.10 0.33 -0.10 3.43 0.00 -1.59 -1.59 119.26 120.84 1ry2 h ALA 202 Ca 0.44 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1ry2 h ALA 202 Cb 2.22 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.93 1ry2 h ALA 202 CO -0.00 0.22 0.01 0.82 0.00 0.00 0.00 179.25 180.30 1ry2 h ILE 203 N 0.21 1.22 0.00 0.00 1.08 0.72 -2.20 117.51 118.54 1ry2 h ILE 203 Ca 0.05 -0.70 -0.06 0.00 -0.39 0.00 0.00 64.86 63.76 1ry2 h ILE 203 Cb 0.67 1.50 -0.01 0.00 -3.07 0.00 0.00 36.82 35.91 1ry2 h ILE 203 CO 0.04 0.20 -0.28 0.16 -0.69 0.00 0.00 178.15 177.58 1ry2 h ILE 204 N -0.07 1.12 0.18 -0.67 3.07 -1.37 -1.82 117.51 117.96 1ry2 h ILE 204 Ca 0.03 -0.99 -0.01 0.00 1.55 0.00 0.00 64.86 65.44 1ry2 h ILE 204 Cb 0.30 1.54 0.00 0.00 -0.27 0.00 0.00 36.82 38.39 1ry2 h ILE 204 CO 0.00 0.28 -0.09 0.74 -1.05 0.00 0.00 178.15 178.03 1ry2 h THR 205 N 0.00 0.86 -0.81 0.16 2.02 -1.08 0.29 112.91 114.35 1ry2 h THR 205 Ca -0.00 -0.21 0.06 0.00 0.77 0.00 0.00 66.41 67.03 1ry2 h THR 205 Cb 0.52 0.99 -0.06 0.00 -1.74 0.00 0.00 68.15 67.86 1ry2 h THR 205 CO 0.04 0.05 0.49 -0.07 0.37 0.00 0.00 175.52 176.40 1ry2 h LEU 206 N -0.35 0.76 -0.81 2.58 4.07 -1.07 -0.88 115.31 119.62 1ry2 h LEU 206 Ca -0.03 0.02 -0.12 0.00 0.08 0.00 0.00 57.88 57.84 1ry2 h LEU 206 Cb 0.27 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 41.86 1ry2 h LEU 206 CO 0.04 0.49 -0.40 -0.07 -1.08 0.00 0.00 178.44 177.41 1ry2 h LEU 207 N 0.90 0.42 -1.00 1.67 3.38 -1.10 -2.73 115.31 116.85 1ry2 h LEU 207 Ca 0.36 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 58.08 1ry2 h LEU 207 Cb 0.18 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1ry2 h LEU 207 CO -0.18 0.79 -0.00 0.00 0.09 0.00 0.00 178.44 179.13 1ry2 h ALA 208 N 1.24 1.17 -0.23 1.53 0.00 0.57 0.06 119.26 123.61 1ry2 h ALA 208 Ca 0.03 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1ry2 h ALA 208 Cb 0.86 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1ry2 h ALA 208 CO 0.07 0.54 0.02 0.82 0.00 0.00 0.00 179.25 180.70 1ry2 h ILE 209 N 0.67 1.24 -0.01 0.00 2.04 -0.95 -3.08 117.51 117.42 1ry2 h ILE 209 Ca 0.13 -0.83 -0.15 0.00 1.00 0.00 0.00 64.86 65.01 1ry2 h ILE 209 Cb 0.42 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 1ry2 h ILE 209 CO 0.02 0.26 -0.70 0.77 0.00 0.00 0.00 178.15 178.50 1ry2 h SER 210 N 0.17 0.09 -0.96 1.72 4.64 -1.23 -0.49 113.55 117.49 1ry2 h SER 210 Ca 0.07 -0.06 0.20 0.00 -0.47 0.00 0.00 61.79 61.53 1ry2 h SER 210 Cb 0.37 -0.03 -0.08 0.00 -0.31 0.00 0.00 62.40 62.35 1ry2 h SER 210 CO 0.01 0.76 0.61 -0.09 -0.87 0.00 0.00 176.83 177.25 1ry2 h ARG 211 N 0.05 0.54 -0.64 4.77 2.43 -0.90 0.92 114.38 121.54 1ry2 h ARG 211 Ca -0.01 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1ry2 h ARG 211 Cb 1.24 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 1ry2 h ARG 211 CO 0.10 0.36 0.00 0.44 -1.51 0.00 0.00 179.97 179.35 1ry2 n ILE 212 N -4.61 1.56 -1.51 1.20 -5.35 -1.16 -0.38 119.36 109.11 1ry2 n ILE 212 Ca 0.21 -1.02 -0.06 0.00 -0.27 0.00 0.00 62.75 61.61 1ry2 n ILE 212 Cb 0.66 0.10 -0.02 0.00 -1.74 0.00 0.00 39.64 38.64 1ry2 n ILE 212 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ry2 n GLY 213 N 1.09 0.59 3.97 3.28 0.00 0.32 -3.92 105.19 110.52 1ry2 n GLY 213 Ca 0.23 -0.72 -0.21 0.00 0.00 0.00 0.00 46.02 45.32 1ry2 n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ry2 s ALA 214 N -2.26 4.00 -0.29 4.61 0.00 -0.20 -0.24 121.76 127.37 1ry2 s ALA 214 Ca 0.00 -1.29 -0.02 0.00 0.00 0.00 0.00 51.96 50.66 1ry2 s ALA 214 Cb 0.00 -1.95 0.04 0.00 0.00 0.00 0.00 23.12 21.22 1ry2 s ALA 214 CO 0.00 -0.35 -0.01 0.42 0.00 0.00 0.00 175.76 175.82 1ry2 s ILE 215 N -2.47 2.97 0.22 0.00 1.01 -0.47 -4.07 121.20 118.39 1ry2 s ILE 215 Ca 0.50 -1.29 -0.24 0.00 0.00 0.00 0.00 60.65 59.61 1ry2 s ILE 215 Cb -0.10 -2.66 -0.09 0.00 0.01 0.00 0.00 42.46 39.62 1ry2 s ILE 215 CO 0.36 -0.03 0.81 -1.38 0.00 0.00 0.00 174.94 174.70 1ry2 s HIS 216 N 1.27 3.81 -0.36 3.97 -3.43 -1.22 -1.56 115.29 117.77 1ry2 s HIS 216 Ca -0.04 1.63 0.01 0.00 -0.80 0.00 0.00 55.06 55.86 1ry2 s HIS 216 Cb -0.19 -2.78 0.11 0.00 -1.43 0.00 0.00 32.58 28.29 1ry2 s HIS 216 CO -0.02 0.40 0.13 -1.12 -2.00 0.00 0.00 174.74 172.14 1ry2 s SER 217 N -1.37 4.13 0.08 7.38 0.01 0.31 -1.65 113.70 122.59 1ry2 s SER 217 Ca 0.41 -2.08 -0.28 0.00 1.31 0.00 0.00 55.95 55.31 1ry2 s SER 217 Cb -0.21 -1.13 -0.06 0.00 0.21 0.00 0.00 66.02 64.84 1ry2 s SER 217 CO 0.25 -0.36 0.87 -0.69 0.41 0.00 0.00 173.24 173.72 1ry2 s VAL 218 N 1.03 4.60 -0.04 3.43 1.01 -1.26 -0.76 120.40 128.41 1ry2 s VAL 218 Ca 0.12 1.88 0.05 0.00 0.00 0.00 0.00 61.98 64.03 1ry2 s VAL 218 Cb -0.20 -4.23 -0.01 0.00 0.00 0.00 0.00 36.38 31.94 1ry2 s VAL 218 CO -0.13 0.34 -0.20 -0.69 0.00 0.00 0.00 175.10 174.41 1ry2 s VAL 219 N -0.05 1.67 0.04 2.92 1.01 0.10 -4.61 120.40 121.49 1ry2 s VAL 219 Ca 0.43 -0.87 -0.36 0.00 0.00 0.00 0.00 61.98 61.18 1ry2 s VAL 219 Cb -0.22 -1.42 -0.15 0.00 0.00 0.00 0.00 36.38 34.59 1ry2 s VAL 219 CO 0.27 0.47 1.50 0.49 0.00 0.00 0.00 175.10 177.84 1ry2 n PHE 220 N 2.94 1.86 0.28 5.22 3.01 -1.26 -4.29 117.46 125.22 1ry2 n PHE 220 Ca -0.17 0.47 0.00 0.00 1.01 0.00 0.00 57.45 58.76 1ry2 n PHE 220 Cb 0.53 -2.43 0.00 0.00 -0.01 0.00 0.00 39.48 37.56 1ry2 n PHE 220 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ry2 n ALA 221 N 3.48 1.45 0.00 4.37 0.00 -1.26 -1.93 120.51 126.61 1ry2 n ALA 221 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1ry2 n ALA 221 Cb 0.22 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.67 1ry2 n ALA 221 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ry2 n GLY 222 N 0.38 0.00 3.56 0.00 0.00 -1.26 -4.94 105.19 102.93 1ry2 n GLY 222 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1ry2 n GLY 222 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ry2 n PHE 223 N -1.34 0.39 -0.66 1.61 3.01 -0.81 -4.94 117.46 114.71 1ry2 n PHE 223 Ca 0.00 0.49 -0.31 0.00 1.01 0.00 0.00 57.45 58.64 1ry2 n PHE 223 Cb 0.23 -2.10 0.18 0.00 -0.01 0.00 0.00 39.48 37.78 1ry2 n PHE 223 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1ry2 n SER 224 N 0.17 -0.14 0.25 4.37 3.41 -1.26 -4.77 113.62 115.66 1ry2 n SER 224 Ca 0.12 0.34 0.12 0.00 -0.26 0.00 0.00 58.87 59.18 1ry2 n SER 224 Cb 0.44 -1.43 0.65 0.00 -0.26 0.00 0.00 64.21 63.62 1ry2 n SER 224 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1ry2 h SER 225 N -1.98 0.00 -0.07 4.04 4.64 -1.92 -1.07 113.55 117.18 1ry2 h SER 225 Ca -0.45 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.72 1ry2 h SER 225 Cb 1.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.36 1ry2 h SER 225 CO 0.41 0.15 -0.45 0.78 -0.87 0.00 0.00 176.83 176.85 1ry2 h ASN 226 N 0.00 0.67 -0.19 4.97 4.21 -1.91 -1.31 115.58 122.02 1ry2 h ASN 226 Ca -0.00 -0.32 -0.16 0.00 1.21 0.00 0.00 56.30 57.03 1ry2 h ASN 226 Cb 0.46 -0.19 -0.01 0.00 -1.12 0.00 0.00 38.32 37.47 1ry2 h ASN 226 CO 0.02 1.02 -0.45 0.28 -1.29 0.00 0.00 177.43 177.02 1ry2 h SER 227 N 0.50 0.81 0.02 5.81 0.02 -1.61 -2.94 113.55 116.16 1ry2 h SER 227 Ca 0.03 -0.39 -0.00 0.00 -0.84 0.00 0.00 61.79 60.59 1ry2 h SER 227 Cb 0.98 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.29 1ry2 h SER 227 CO 0.09 1.14 -0.01 0.25 -1.14 0.00 0.00 176.83 177.16 1ry2 h LEU 228 N 0.60 -0.03 0.26 5.07 5.85 -1.00 -2.65 115.31 123.42 1ry2 h LEU 228 Ca 0.04 -0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.61 1ry2 h LEU 228 Cb 1.01 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.01 1ry2 h LEU 228 CO 0.10 0.14 -0.47 -0.09 -0.34 0.00 0.00 178.44 177.78 1ry2 h ARG 229 N -0.19 -0.77 -0.73 1.25 2.43 -1.26 -1.06 114.38 114.06 1ry2 h ARG 229 Ca -0.00 0.05 0.08 0.00 -0.81 0.00 0.00 59.98 59.30 1ry2 h ARG 229 Cb 0.18 0.18 -0.07 0.00 -0.42 0.00 0.00 29.97 29.84 1ry2 h ARG 229 CO 0.01 -0.51 0.39 -0.44 -1.51 0.00 0.00 179.97 177.90 1ry2 h ASP 230 N -0.80 0.55 -0.56 -3.80 3.32 -1.57 0.23 116.42 113.79 1ry2 h ASP 230 Ca -0.02 0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.02 1ry2 h ASP 230 Cb 0.76 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.23 1ry2 h ASP 230 CO -0.18 0.33 0.15 0.03 -1.72 0.00 0.00 179.24 177.85 1ry2 h ARG 231 N 0.68 0.93 -0.15 3.56 3.08 -1.28 0.11 114.38 121.31 1ry2 h ARG 231 Ca 0.35 -0.20 -0.12 0.00 0.07 0.00 0.00 59.98 60.08 1ry2 h ARG 231 Cb 0.30 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.22 1ry2 h ARG 231 CO -0.23 0.83 -0.37 0.82 -1.07 0.00 0.00 179.97 179.94 1ry2 h ILE 232 N 0.90 1.35 -0.26 2.04 2.04 -0.36 -0.91 117.51 122.31 1ry2 h ILE 232 Ca 0.19 -1.64 -0.00 0.00 1.00 0.00 0.00 64.86 64.41 1ry2 h ILE 232 Cb 0.32 2.01 -0.01 0.00 -0.74 0.00 0.00 36.82 38.39 1ry2 h ILE 232 CO -0.00 0.50 0.15 0.78 0.00 0.00 0.00 178.15 179.58 1ry2 h ASN 233 N 0.15 0.31 0.04 1.72 -0.26 -0.35 -0.35 115.58 116.83 1ry2 h ASN 233 Ca -0.00 -0.05 -0.10 0.00 -0.56 0.00 0.00 56.30 55.59 1ry2 h ASN 233 Cb 0.98 -0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 38.15 1ry2 h ASN 233 CO 0.08 0.27 -0.30 -0.78 -1.06 0.00 0.00 177.43 175.64 1ry2 h ASP 234 N 0.32 0.40 1.28 5.81 1.82 -0.83 -3.05 116.42 122.17 1ry2 h ASP 234 Ca 0.09 -0.14 0.00 0.00 -0.39 0.00 0.00 57.03 56.59 1ry2 h ASP 234 Cb 0.01 -0.11 0.00 0.00 0.68 0.00 0.00 39.33 39.91 1ry2 h ASP 234 CO -0.02 0.69 0.00 1.23 -1.61 0.00 0.00 179.24 179.53 1ry2 h GLY 235 N 1.06 0.00 -0.11 -0.78 0.00 -0.61 -3.47 103.07 99.16 1ry2 h GLY 235 Ca 0.05 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.33 1ry2 h GLY 235 CO 0.05 0.00 -0.04 1.34 0.00 0.00 0.00 176.54 177.89 1ry2 n ASP 236 N -3.06 -3.41 -4.58 0.19 -0.08 -0.19 -4.65 116.55 100.76 1ry2 n ASP 236 Ca 0.02 0.06 -0.41 0.00 -1.51 0.00 0.00 54.79 52.94 1ry2 n ASP 236 Cb 0.37 -1.11 -0.03 0.00 2.34 0.00 0.00 41.12 42.68 1ry2 n ASP 236 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1ry2 s SER 237 N -2.71 5.66 0.17 1.67 0.01 -1.04 -4.55 113.70 112.91 1ry2 s SER 237 Ca 0.00 1.03 0.26 0.00 1.31 0.00 0.00 55.95 58.55 1ry2 s SER 237 Cb 0.00 -2.53 0.81 0.00 0.21 0.00 0.00 66.02 64.51 1ry2 s SER 237 CO 0.00 -1.94 1.74 0.29 0.41 0.00 0.00 173.24 173.74 1ry2 n LYS 238 N 8.65 0.23 -4.30 12.44 5.02 -1.25 -4.35 118.16 134.60 1ry2 n LYS 238 Ca 0.23 0.17 -0.16 0.00 -2.02 0.00 0.00 58.31 56.53 1ry2 n LYS 238 Cb 0.49 -1.75 -0.10 0.00 -0.02 0.00 0.00 35.03 33.64 1ry2 n LYS 238 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1ry2 s VAL 239 N -3.09 1.04 0.11 -0.18 -7.23 -1.26 0.14 120.40 109.91 1ry2 s VAL 239 Ca 0.11 -2.04 -0.00 0.00 -1.81 0.00 0.00 61.98 58.23 1ry2 s VAL 239 Cb 0.13 -2.18 -0.04 0.00 0.56 0.00 0.00 36.38 34.85 1ry2 s VAL 239 CO 0.60 -0.46 0.01 -0.69 -0.31 0.00 0.00 175.10 174.26 1ry2 s VAL 240 N -3.42 0.26 -0.08 1.32 1.01 -0.86 -2.80 120.40 115.84 1ry2 s VAL 240 Ca 0.25 -1.89 -0.03 0.00 0.00 0.00 0.00 61.98 60.31 1ry2 s VAL 240 Cb 0.05 -1.86 0.04 0.00 0.00 0.00 0.00 36.38 34.61 1ry2 s VAL 240 CO 0.06 -0.67 0.15 -0.63 0.00 0.00 0.00 175.10 174.01 1ry2 s ILE 241 N -3.92 -0.18 0.00 2.22 -1.09 -0.72 -1.09 121.20 116.42 1ry2 s ILE 241 Ca 0.18 0.29 0.00 0.00 -2.23 0.00 0.00 60.65 58.89 1ry2 s ILE 241 Cb 0.07 -0.27 0.00 0.00 -1.58 0.00 0.00 42.46 40.68 1ry2 s ILE 241 CO -0.02 0.12 0.00 0.41 -1.23 0.00 0.00 174.94 174.22 1ry2 n THR 242 N 4.91 0.00 -4.68 2.92 -1.04 -0.44 -0.85 114.28 115.10 1ry2 n THR 242 Ca -0.13 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.58 1ry2 n THR 242 Cb 0.50 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.93 1ry2 n THR 242 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1ry2 s THR 243 N -2.58 1.08 -0.05 12.58 -4.23 -1.26 -0.86 115.64 120.32 1ry2 s THR 243 Ca 0.00 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.33 1ry2 s THR 243 Cb 0.00 -2.30 -0.31 0.00 1.34 0.00 0.00 72.50 71.24 1ry2 s THR 243 CO 0.00 0.00 0.79 -2.24 -0.54 0.00 0.00 174.62 172.63 1ry2 h ASP 244 N 1.52 0.51 -5.13 3.99 3.04 -1.93 -3.09 116.42 115.33 1ry2 h ASP 244 Ca -0.42 -0.91 -0.05 0.00 -3.24 0.00 0.00 57.03 52.41 1ry2 h ASP 244 Cb 1.30 -0.17 -0.12 0.00 -1.04 0.00 0.00 39.33 39.30 1ry2 h ASP 244 CO 0.70 1.54 -0.10 -1.61 -2.04 0.00 0.00 179.24 177.73 1ry2 s GLU 245 N -2.48 1.22 -0.12 4.15 2.02 -1.26 -2.82 118.70 119.41 1ry2 s GLU 245 Ca -0.15 -0.91 -0.02 0.00 0.02 0.00 0.00 54.97 53.91 1ry2 s GLU 245 Cb 0.03 0.46 0.04 0.00 0.10 0.00 0.00 34.13 34.76 1ry2 s GLU 245 CO 0.83 -0.49 0.03 -1.12 0.02 0.00 0.00 175.26 174.53 1ry2 s SER 246 N -2.88 2.11 -0.58 -0.19 0.01 0.69 -4.63 113.70 108.22 1ry2 s SER 246 Ca 0.09 -0.39 -0.26 0.00 1.31 0.00 0.00 55.95 56.70 1ry2 s SER 246 Cb 0.01 -0.45 0.04 0.00 0.21 0.00 0.00 66.02 65.83 1ry2 s SER 246 CO -0.05 -0.26 1.07 0.21 0.41 0.00 0.00 173.24 174.63 1ry2 s ASN 247 N 1.97 6.36 -0.13 2.44 2.47 -1.26 0.52 114.94 127.31 1ry2 s ASN 247 Ca 0.03 -0.21 0.00 0.00 0.42 0.00 0.00 52.86 53.10 1ry2 s ASN 247 Cb -0.14 -2.49 -0.01 0.00 -1.45 0.00 0.00 41.25 37.15 1ry2 s ASN 247 CO -0.06 -1.39 -0.14 -0.13 -3.72 0.00 0.00 177.10 171.65 1ry2 s ARG 248 N 4.51 3.35 -0.93 0.43 1.81 0.12 -4.62 118.95 123.62 1ry2 s ARG 248 Ca 0.35 -0.70 0.00 0.00 -1.72 0.00 0.00 55.73 53.66 1ry2 s ARG 248 Cb -0.10 -2.60 0.00 0.00 -0.45 0.00 0.00 34.95 31.80 1ry2 s ARG 248 CO 0.21 0.22 0.00 0.41 -0.68 0.00 0.00 175.30 175.46 1ry2 n GLY 249 N 3.50 0.84 0.33 -3.53 0.00 -1.26 0.13 105.19 105.19 1ry2 n GLY 249 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1ry2 n GLY 249 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ry2 n GLY 250 N -0.10 0.90 2.85 -0.02 0.00 -1.26 -4.84 105.19 102.71 1ry2 n GLY 250 Ca -0.09 -0.16 -0.26 0.00 0.00 0.00 0.00 46.02 45.51 1ry2 n GLY 250 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ry2 s LYS 251 N -0.39 1.16 0.51 1.61 1.02 0.34 -5.11 119.74 118.88 1ry2 s LYS 251 Ca 0.00 -0.23 -0.21 0.00 0.02 0.00 0.00 55.97 55.55 1ry2 s LYS 251 Cb 0.00 -1.56 -0.06 0.00 -0.52 0.00 0.00 37.83 35.69 1ry2 s LYS 251 CO 0.00 -0.35 1.18 0.14 -0.92 0.00 0.00 175.35 175.40 1ry2 s VAL 252 N 1.78 2.93 -0.08 3.17 -7.23 -1.26 0.16 120.40 119.88 1ry2 s VAL 252 Ca 0.03 0.64 -0.01 0.00 -1.81 0.00 0.00 61.98 60.84 1ry2 s VAL 252 Cb -0.14 -3.30 0.03 0.00 0.56 0.00 0.00 36.38 33.53 1ry2 s VAL 252 CO -0.07 -0.06 -0.01 -0.63 -0.31 0.00 0.00 175.10 174.01 1ry2 s ILE 253 N -1.59 0.47 -0.49 -0.62 1.01 0.18 -4.87 121.20 115.30 1ry2 s ILE 253 Ca 0.69 0.06 -0.28 0.00 0.00 0.00 0.00 60.65 61.12 1ry2 s ILE 253 Cb -0.29 -0.61 0.01 0.00 0.01 0.00 0.00 42.46 41.58 1ry2 s ILE 253 CO 0.34 0.27 1.50 -1.61 0.00 0.00 0.00 174.94 175.44 1ry2 s GLU 254 N 1.89 3.33 -0.23 2.79 2.02 -1.26 -0.22 118.70 127.02 1ry2 s GLU 254 Ca 0.04 0.74 -0.12 0.00 0.02 0.00 0.00 54.97 55.65 1ry2 s GLU 254 Cb -0.12 -4.12 -0.17 0.00 0.10 0.00 0.00 34.13 29.81 1ry2 s GLU 254 CO -0.05 -1.88 -0.06 0.25 0.02 0.00 0.00 175.26 173.53 1ry2 n THR 255 N 7.03 1.56 -0.16 3.63 -2.24 -1.19 -3.38 114.28 119.54 1ry2 n THR 255 Ca 0.16 -0.37 0.11 0.00 -2.27 0.00 0.00 64.05 61.67 1ry2 n THR 255 Cb 0.49 -1.81 0.43 0.00 -2.10 0.00 0.00 70.33 67.34 1ry2 n THR 255 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1ry2 h LYS 256 N -0.63 0.56 0.82 -0.78 1.63 -1.43 0.95 116.57 117.69 1ry2 h LYS 256 Ca -0.54 -0.03 -0.04 0.00 -0.85 0.00 0.00 60.65 59.18 1ry2 h LYS 256 Cb 1.66 -0.13 0.01 0.00 -0.60 0.00 0.00 32.23 33.17 1ry2 h LYS 256 CO -0.22 0.37 -0.39 -0.09 -3.45 0.00 0.00 179.45 175.66 1ry2 h ARG 257 N 0.57 -1.06 -0.81 1.90 9.65 -1.80 -1.40 114.38 121.43 1ry2 h ARG 257 Ca 0.33 0.07 0.16 0.00 -1.10 0.00 0.00 59.98 59.44 1ry2 h ARG 257 Cb 0.52 0.24 -0.06 0.00 -1.39 0.00 0.00 29.97 29.28 1ry2 h ARG 257 CO -0.11 -0.70 0.53 0.82 2.80 0.00 0.00 179.97 183.31 1ry2 h ILE 258 N -1.17 0.78 -0.26 1.20 2.04 -1.01 -1.12 117.51 117.97 1ry2 h ILE 258 Ca -0.11 -0.16 -0.04 0.00 1.00 0.00 0.00 64.86 65.55 1ry2 h ILE 258 Cb 0.85 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 1ry2 h ILE 258 CO 0.19 0.08 0.01 0.58 0.00 0.00 0.00 178.15 179.01 1ry2 h VAL 259 N 0.45 1.25 -0.57 1.67 2.07 0.12 -2.87 116.25 118.38 1ry2 h VAL 259 Ca 0.40 -0.88 -0.06 0.00 0.82 0.00 0.00 66.70 66.98 1ry2 h VAL 259 Cb 0.90 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.96 1ry2 h VAL 259 CO -0.14 0.28 0.13 0.44 0.02 0.00 0.00 177.57 178.29 1ry2 h ASP 260 N 0.24 0.87 -0.81 0.57 3.32 -0.11 -0.63 116.42 119.86 1ry2 h ASP 260 Ca 0.07 -0.24 0.03 0.00 0.02 0.00 0.00 57.03 56.92 1ry2 h ASP 260 Cb 0.40 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 39.67 1ry2 h ASP 260 CO 0.01 0.88 0.52 0.44 -1.72 0.00 0.00 179.24 179.37 1ry2 h ASP 261 N 0.81 0.86 -0.44 6.45 3.32 -1.41 -2.60 116.42 123.42 1ry2 h ASP 261 Ca 0.18 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.18 1ry2 h ASP 261 Cb 0.36 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 1ry2 h ASP 261 CO 0.00 0.59 0.10 0.00 -1.72 0.00 0.00 179.24 178.22 1ry2 h ALA 262 N 1.34 0.58 0.00 3.45 0.00 -1.24 -2.87 119.26 120.52 1ry2 h ALA 262 Ca 0.32 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1ry2 h ALA 262 Cb 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1ry2 h ALA 262 CO -0.11 0.26 0.00 1.28 0.00 0.00 0.00 179.25 180.68 1ry2 n LEU 263 N -4.52 0.00 0.00 0.00 4.77 -0.28 -1.86 117.00 115.11 1ry2 n LEU 263 Ca 0.00 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.12 1ry2 n LEU 263 Cb 0.21 0.00 0.69 0.00 -2.33 0.00 0.00 43.42 41.99 1ry2 n LEU 263 CO 0.39 0.00 0.96 0.54 -1.33 0.00 0.00 177.39 177.95 1ry2 n ARG 264 N -0.97 0.38 0.00 3.23 1.74 -1.08 -3.34 116.66 116.61 1ry2 n ARG 264 Ca 0.11 0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 1ry2 n ARG 264 Cb 0.05 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 29.99 1ry2 n ARG 264 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1ry2 n GLU 265 N -1.29 0.37 -3.52 5.56 1.02 -0.78 -4.96 120.64 117.04 1ry2 n GLU 265 Ca 0.13 -0.51 -0.42 0.00 -0.02 0.00 0.00 57.16 56.34 1ry2 n GLU 265 Cb 0.22 -0.66 -0.06 0.00 -0.02 0.00 0.00 31.44 30.92 1ry2 n GLU 265 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1ry2 s THR 266 N -0.17 4.64 0.39 2.62 2.01 -1.21 -4.94 115.64 118.97 1ry2 s THR 266 Ca 0.00 -2.58 0.10 0.00 0.31 0.00 0.00 61.69 59.52 1ry2 s THR 266 Cb 0.00 -3.94 0.32 0.00 0.01 0.00 0.00 72.50 68.89 1ry2 s THR 266 CO 0.00 -0.93 1.94 -0.65 -0.69 0.00 0.00 174.62 174.29 1ry2 h PRO 267 N 7.56 0.58 -0.08 4.92 0.11 -1.93 -2.99 132.00 140.18 1ry2 h PRO 267 Ca 0.01 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1ry2 h PRO 267 Cb 1.01 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1ry2 h PRO 267 CO 0.76 0.38 0.00 0.41 -0.21 0.00 0.00 178.00 179.34 1ry2 n GLY 268 N -1.48 0.10 3.59 -0.55 0.00 -1.26 -4.85 105.19 100.75 1ry2 n GLY 268 Ca 0.12 -0.43 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 1ry2 n GLY 268 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ry2 s VAL 269 N -1.91 3.97 -0.10 1.61 1.01 -1.13 -4.24 120.40 119.61 1ry2 s VAL 269 Ca 0.36 0.95 -0.21 0.00 0.00 0.00 0.00 61.98 63.07 1ry2 s VAL 269 Cb 0.19 -4.41 -0.27 0.00 0.00 0.00 0.00 36.38 31.89 1ry2 s VAL 269 CO 0.30 -0.97 0.68 -0.09 0.00 0.00 0.00 175.10 175.02 1ry2 h ARG 270 N 10.29 0.18 -4.88 2.72 2.43 0.82 -3.49 114.38 122.45 1ry2 h ARG 270 Ca -0.26 -0.31 -0.32 0.00 -0.81 0.00 0.00 59.98 58.28 1ry2 h ARG 270 Cb 1.09 0.12 -0.15 0.00 -0.42 0.00 0.00 29.97 30.61 1ry2 h ARG 270 CO 1.13 1.15 -0.65 -1.01 -1.51 0.00 0.00 179.97 179.08 1ry2 s HIS 271 N -2.39 1.38 -0.18 2.20 3.76 -1.15 -4.59 115.29 114.31 1ry2 s HIS 271 Ca -0.19 -1.05 -0.04 0.00 -0.15 0.00 0.00 55.06 53.63 1ry2 s HIS 271 Cb 0.02 -0.80 0.09 0.00 1.11 0.00 0.00 32.58 33.00 1ry2 s HIS 271 CO 0.75 -0.22 0.26 0.08 -0.85 0.00 0.00 174.74 174.76 1ry2 s VAL 272 N -3.65 -0.41 -0.18 -0.90 1.01 -0.53 -2.03 120.40 113.72 1ry2 s VAL 272 Ca 0.29 0.04 -0.18 0.00 0.00 0.00 0.00 61.98 62.13 1ry2 s VAL 272 Cb 0.07 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.80 1ry2 s VAL 272 CO 0.08 -0.07 0.50 -0.22 0.00 0.00 0.00 175.10 175.39 1ry2 s LEU 273 N 2.40 4.18 -0.17 3.92 2.96 -0.25 -0.58 118.68 131.14 1ry2 s LEU 273 Ca 0.06 0.70 0.02 0.00 -0.22 0.00 0.00 54.13 54.69 1ry2 s LEU 273 Cb -0.14 -2.69 0.02 0.00 0.50 0.00 0.00 46.19 43.87 1ry2 s LEU 273 CO -0.11 -0.13 -0.21 -0.69 -1.32 0.00 0.00 176.35 173.89 1ry2 s VAL 274 N 1.35 2.07 -0.51 1.68 1.01 -0.09 -1.33 120.40 124.58 1ry2 s VAL 274 Ca 0.24 -0.95 -0.16 0.00 0.00 0.00 0.00 61.98 61.11 1ry2 s VAL 274 Cb -0.15 -1.85 0.10 0.00 0.00 0.00 0.00 36.38 34.47 1ry2 s VAL 274 CO 0.10 0.54 0.47 -0.47 0.00 0.00 0.00 175.10 175.74 1ry2 s TYR 275 N 1.11 3.22 -0.30 5.22 5.04 -0.04 -0.75 117.35 130.86 1ry2 s TYR 275 Ca 0.01 -1.04 -0.28 0.00 -2.44 0.00 0.00 57.07 53.31 1ry2 s TYR 275 Cb -0.14 -3.49 -0.04 0.00 0.35 0.00 0.00 41.96 38.65 1ry2 s TYR 275 CO -0.09 -0.93 2.05 1.03 -1.34 0.00 0.00 175.55 176.27 1ry2 s ARG 276 N 1.75 3.11 -0.13 4.97 0.52 -1.26 -3.56 118.95 124.35 1ry2 s ARG 276 Ca 0.05 1.67 0.11 0.00 -0.52 0.00 0.00 55.73 57.04 1ry2 s ARG 276 Cb -0.26 -4.32 -0.24 0.00 0.52 0.00 0.00 34.95 30.65 1ry2 s ARG 276 CO 0.06 -2.13 0.34 1.17 0.02 0.00 0.00 175.30 174.75 1ry2 n LYS 277 N 8.67 0.67 -0.02 3.54 4.81 -1.26 -4.66 118.16 129.90 1ry2 n LYS 277 Ca 0.27 0.17 0.01 0.00 -0.87 0.00 0.00 58.31 57.89 1ry2 n LYS 277 Cb 0.47 -1.66 -0.08 0.00 0.02 0.00 0.00 35.03 33.78 1ry2 n LYS 277 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1ry2 n THR 278 N -3.02 0.29 -0.99 3.15 -2.24 -1.26 -5.03 114.28 105.18 1ry2 n THR 278 Ca -0.27 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.20 1ry2 n THR 278 Cb 1.08 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 69.12 1ry2 n THR 278 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1ry2 n ASN 279 N -2.07 -1.08 0.00 3.42 5.15 -1.26 -5.02 115.26 114.40 1ry2 n ASN 279 Ca -0.08 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.90 1ry2 n ASN 279 Cb 0.51 -0.27 0.00 0.00 -0.53 0.00 0.00 39.78 39.49 1ry2 n ASN 279 CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 1ry2 n ASN 280 N -0.63 0.00 -3.69 1.20 6.94 -1.26 -4.85 115.26 112.96 1ry2 n ASN 280 Ca 0.00 0.00 -0.41 0.00 -0.02 0.00 0.00 54.58 54.15 1ry2 n ASN 280 Cb 0.27 0.00 0.01 0.00 -2.36 0.00 0.00 39.78 37.70 1ry2 n ASN 280 CO 0.00 0.00 0.00 -2.65 -1.03 0.00 0.00 177.26 173.58 1ry2 n PRO 281 N 0.00 4.63 -3.15 -0.53 -0.02 -1.26 -4.57 135.00 130.09 1ry2 n PRO 281 Ca 0.00 -4.00 -0.14 0.00 -2.02 0.00 0.00 63.50 57.34 1ry2 n PRO 281 Cb 0.00 -2.62 0.07 0.00 -0.02 0.00 0.00 33.50 30.93 1ry2 n PRO 281 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1ry2 n SER 282 N 1.57 -3.41 -4.80 2.55 2.88 -1.26 -4.99 113.62 106.16 1ry2 n SER 282 Ca 0.47 -0.56 -0.36 0.00 -1.33 0.00 0.00 58.87 57.09 1ry2 n SER 282 Cb 0.29 -4.51 -0.06 0.00 -0.75 0.00 0.00 64.21 59.17 1ry2 n SER 282 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1ry2 s VAL 283 N -3.32 4.43 0.78 2.46 1.01 -1.26 -5.02 120.40 119.49 1ry2 s VAL 283 Ca 0.14 1.49 -0.15 0.00 0.00 0.00 0.00 61.98 63.46 1ry2 s VAL 283 Cb -0.02 -3.91 0.01 0.00 0.00 0.00 0.00 36.38 32.46 1ry2 s VAL 283 CO 0.63 0.17 0.72 0.00 0.00 0.00 0.00 175.10 176.63 1ry2 n ALA 284 N 0.64 -1.19 -3.20 5.51 0.00 -1.26 -5.02 120.51 115.99 1ry2 n ALA 284 Ca -0.01 -0.32 0.04 0.00 0.00 0.00 0.00 53.44 53.15 1ry2 n ALA 284 Cb 0.51 -1.97 -0.04 0.00 0.00 0.00 0.00 19.45 17.95 1ry2 n ALA 284 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1ry2 s PHE 285 N -2.03 -0.14 -0.00 0.00 5.36 -1.26 -5.01 117.98 114.89 1ry2 s PHE 285 Ca 0.67 0.23 -0.00 0.00 -0.96 0.00 0.00 56.93 56.87 1ry2 s PHE 285 Cb -0.31 0.08 -0.00 0.00 -0.34 0.00 0.00 43.02 42.45 1ry2 s PHE 285 CO 0.57 -0.07 -0.00 0.72 -1.46 0.00 0.00 175.22 174.98 1ry2 n HIS 286 N 4.64 0.00 -2.09 10.12 8.25 -1.26 -5.07 115.22 129.81 1ry2 n HIS 286 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1ry2 n HIS 286 Cb 0.55 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.65 1ry2 n HIS 286 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ry2 n ALA 287 N -2.61 0.00 0.87 -1.41 0.00 -1.26 -4.95 120.51 111.15 1ry2 n ALA 287 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.50 1ry2 n ALA 287 Cb 0.50 0.00 0.39 0.00 0.00 0.00 0.00 19.45 20.34 1ry2 n ALA 287 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1ry2 n PRO 288 N 0.00 0.43 0.11 0.00 -0.04 -1.26 -2.48 135.00 131.76 1ry2 n PRO 288 Ca 0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.33 1ry2 n PRO 288 Cb 0.00 -1.47 -0.08 0.00 -0.04 0.00 0.00 33.50 31.91 1ry2 n PRO 288 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1ry2 h ARG 289 N 0.00 -0.30 -6.68 0.54 2.43 -1.93 -3.44 114.38 105.01 1ry2 h ARG 289 Ca 0.00 0.02 -0.51 0.00 -0.81 0.00 0.00 59.98 58.68 1ry2 h ARG 289 Cb 0.00 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1ry2 h ARG 289 CO 0.00 0.06 0.40 -0.51 -1.51 0.00 0.00 179.97 178.41 1ry2 s ASP 290 N -5.24 7.46 0.06 -3.80 1.01 -1.04 -1.45 116.67 113.67 1ry2 s ASP 290 Ca -0.14 1.97 0.05 0.00 0.71 0.00 0.00 52.55 55.14 1ry2 s ASP 290 Cb 0.02 -2.60 -0.03 0.00 1.01 0.00 0.00 42.92 41.32 1ry2 s ASP 290 CO 0.54 -0.04 -0.13 -0.76 0.21 0.00 0.00 175.17 174.99 1ry2 s LEU 291 N -0.64 2.25 -0.12 1.23 1.43 0.25 -4.75 118.68 118.33 1ry2 s LEU 291 Ca 0.45 -0.57 -0.15 0.00 -1.03 0.00 0.00 54.13 52.84 1ry2 s LEU 291 Cb -0.27 -0.47 -0.05 0.00 0.03 0.00 0.00 46.19 45.44 1ry2 s LEU 291 CO 0.33 -0.07 0.36 -0.62 0.23 0.00 0.00 176.35 176.58 1ry2 s ASP 292 N -1.57 6.57 0.12 2.29 2.15 -1.26 -0.91 116.67 124.05 1ry2 s ASP 292 Ca -0.03 0.67 -0.27 0.00 0.43 0.00 0.00 52.55 53.35 1ry2 s ASP 292 Cb -0.09 -2.22 -0.07 0.00 -0.30 0.00 0.00 42.92 40.24 1ry2 s ASP 292 CO 0.02 0.11 1.62 -0.25 -0.17 0.00 0.00 175.17 176.50 1ry2 h TRP 293 N 6.36 -0.81 -0.13 -5.34 2.91 -1.30 0.02 115.95 117.65 1ry2 h TRP 293 Ca -0.43 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 59.60 1ry2 h TRP 293 Cb 1.18 0.35 -0.01 0.00 -0.51 0.00 0.00 29.16 30.18 1ry2 h TRP 293 CO 0.63 -0.40 0.03 0.00 -1.03 0.00 0.00 178.44 177.66 1ry2 h ALA 294 N 0.24 0.17 -0.39 2.65 0.00 -1.95 0.67 119.26 120.65 1ry2 h ALA 294 Ca 0.05 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.88 1ry2 h ALA 294 Cb 0.54 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.21 1ry2 h ALA 294 CO -0.21 -0.18 -0.08 1.15 0.00 0.00 0.00 179.25 179.93 1ry2 h THR 295 N -0.00 0.63 -0.12 0.00 2.02 -1.93 -2.75 112.91 110.76 1ry2 h THR 295 Ca 0.04 -0.01 -0.12 0.00 0.77 0.00 0.00 66.41 67.09 1ry2 h THR 295 Cb 0.28 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 1ry2 h THR 295 CO 0.00 0.00 -0.41 -0.33 0.37 0.00 0.00 175.52 175.15 1ry2 h GLU 296 N 0.02 0.49 -0.11 6.66 4.39 -0.95 -3.36 114.58 121.73 1ry2 h GLU 296 Ca 0.19 -0.37 0.04 0.00 0.34 0.00 0.00 59.36 59.57 1ry2 h GLU 296 Cb 0.29 0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 28.95 1ry2 h GLU 296 CO -0.39 0.99 -0.27 0.87 -1.16 0.00 0.00 179.01 179.06 1ry2 h LYS 297 N 0.09 -0.34 0.00 2.33 1.57 -0.65 -2.24 116.57 117.34 1ry2 h LYS 297 Ca -0.02 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1ry2 h LYS 297 Cb 1.04 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.43 1ry2 h LYS 297 CO 0.09 -0.22 0.30 1.63 -0.57 0.00 0.00 179.45 180.67 1ry2 n LYS 298 N -5.38 0.04 0.09 3.15 5.02 -1.05 -2.15 118.16 117.88 1ry2 n LYS 298 Ca -0.03 0.42 -0.02 0.00 -2.02 0.00 0.00 58.31 56.66 1ry2 n LYS 298 Cb 0.30 -1.94 -0.05 0.00 -0.02 0.00 0.00 35.03 33.32 1ry2 n LYS 298 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1ry2 h LYS 299 N 0.00 0.00 -6.07 1.97 1.57 -1.58 -3.47 116.57 108.99 1ry2 h LYS 299 Ca 0.00 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.19 1ry2 h LYS 299 Cb 0.60 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.86 1ry2 h LYS 299 CO 0.00 0.65 -0.53 0.71 -0.57 0.00 0.00 179.45 179.72 1ry2 s TYR 300 N -2.85 3.36 1.23 -1.35 2.02 -0.91 -5.11 117.35 113.73 1ry2 s TYR 300 Ca 0.02 0.11 -0.16 0.00 -0.37 0.00 0.00 57.07 56.68 1ry2 s TYR 300 Cb 0.09 -1.65 0.30 0.00 -0.40 0.00 0.00 41.96 40.30 1ry2 s TYR 300 CO 0.78 0.54 1.01 -1.59 -1.57 0.00 0.00 175.55 174.72 1ry2 s LYS 301 N -2.82 -1.40 0.02 -0.62 -2.85 -1.26 -4.85 119.74 105.96 1ry2 s LYS 301 Ca 0.33 0.56 0.24 0.00 -1.00 0.00 0.00 55.97 56.10 1ry2 s LYS 301 Cb -0.12 -1.52 0.38 0.00 -2.06 0.00 0.00 37.83 34.52 1ry2 s LYS 301 CO 0.26 -3.97 1.33 0.25 0.10 0.00 0.00 175.35 173.31 1ry2 n THR 302 N -5.05 0.07 -5.00 3.79 -2.24 -1.26 -4.15 114.28 100.44 1ry2 n THR 302 Ca 0.06 -0.07 -0.32 0.00 -2.27 0.00 0.00 64.05 61.45 1ry2 n THR 302 Cb 0.56 0.24 -0.15 0.00 -2.10 0.00 0.00 70.33 68.89 1ry2 n THR 302 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1ry2 s TYR 303 N -3.05 2.64 -0.08 4.78 5.04 -1.26 -4.05 117.35 121.37 1ry2 s TYR 303 Ca 0.09 -0.52 -0.04 0.00 -2.44 0.00 0.00 57.07 54.16 1ry2 s TYR 303 Cb 0.16 -1.68 0.04 0.00 0.35 0.00 0.00 41.96 40.83 1ry2 s TYR 303 CO 0.73 -0.09 0.18 -0.47 -1.34 0.00 0.00 175.55 174.56 1ry2 s TYR 304 N -0.19 -0.22 0.43 4.97 5.04 -1.26 -5.01 117.35 121.11 1ry2 s TYR 304 Ca -0.01 0.58 -0.25 0.00 -2.44 0.00 0.00 57.07 54.94 1ry2 s TYR 304 Cb -0.13 -0.01 -0.08 0.00 0.35 0.00 0.00 41.96 42.09 1ry2 s TYR 304 CO 0.03 -0.17 1.34 -1.25 -1.34 0.00 0.00 175.55 174.17 1ry2 s PRO 305 N 0.93 3.79 0.82 4.97 0.04 -1.26 -4.96 135.00 139.34 1ry2 s PRO 305 Ca -0.07 2.23 -0.12 0.00 0.04 0.00 0.00 61.00 63.08 1ry2 s PRO 305 Cb -0.09 -2.66 0.09 0.00 0.04 0.00 0.00 34.50 31.88 1ry2 s PRO 305 CO -0.05 -0.66 1.12 0.00 0.04 0.00 0.00 177.00 177.45 1ry2 s THR 307 N -3.28 3.03 0.43 0.00 2.01 0.49 -5.01 115.64 113.32 1ry2 s THR 307 Ca 0.62 -1.21 -0.26 0.00 0.31 0.00 0.00 61.69 61.15 1ry2 s THR 307 Cb -0.14 -2.66 -0.08 0.00 0.01 0.00 0.00 72.50 69.63 1ry2 s THR 307 CO 0.53 0.01 1.34 -2.84 -0.69 0.00 0.00 174.62 172.97 1ry2 s PRO 308 N 1.30 3.85 0.05 4.92 0.02 -1.26 -4.42 135.00 139.45 1ry2 s PRO 308 Ca -0.03 2.23 -0.01 0.00 0.02 0.00 0.00 61.00 63.20 1ry2 s PRO 308 Cb -0.18 -2.70 -0.03 0.00 0.02 0.00 0.00 34.50 31.60 1ry2 s PRO 308 CO -0.02 -0.62 -0.01 0.14 -0.33 0.00 0.00 177.00 176.16 1ry2 s VAL 309 N -1.25 0.20 0.43 3.83 -7.23 -0.98 -4.96 120.40 110.43 1ry2 s VAL 309 Ca 0.59 -1.65 -0.23 0.00 -1.81 0.00 0.00 61.98 58.87 1ry2 s VAL 309 Cb -0.40 -1.34 -0.08 0.00 0.56 0.00 0.00 36.38 35.12 1ry2 s VAL 309 CO 0.51 -0.91 1.11 -0.62 -0.31 0.00 0.00 175.10 174.88 1ry2 s ASP 310 N -2.72 6.45 0.31 4.85 -1.08 -1.26 -1.95 116.67 121.27 1ry2 s ASP 310 Ca 0.04 2.18 0.04 0.00 -0.52 0.00 0.00 52.55 54.29 1ry2 s ASP 310 Cb 0.05 -2.59 0.81 0.00 -1.46 0.00 0.00 42.92 39.73 1ry2 s ASP 310 CO -0.09 -0.71 1.60 -1.28 0.52 0.00 0.00 175.17 175.21 1ry2 h SER 311 N 2.26 -0.17 -0.33 -0.34 0.87 -0.16 0.97 113.55 116.66 1ry2 h SER 311 Ca -0.49 0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.31 1ry2 h SER 311 Cb 1.23 0.36 0.00 0.00 -0.44 0.00 0.00 62.40 63.55 1ry2 h SER 311 CO 0.61 -0.28 0.00 -0.62 -0.53 0.00 0.00 176.83 176.01 1ry2 n GLU 312 N -5.35 1.82 -2.67 2.24 -0.58 -1.26 -2.04 120.64 112.80 1ry2 n GLU 312 Ca 0.24 -1.26 -0.40 0.00 -0.42 0.00 0.00 57.16 55.32 1ry2 n GLU 312 Cb 0.79 -1.30 -0.05 0.00 -0.57 0.00 0.00 31.44 30.31 1ry2 n GLU 312 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1ry2 s ASP 313 N -1.09 7.50 0.16 1.62 -0.00 0.33 -4.74 116.67 120.45 1ry2 s ASP 313 Ca 0.25 1.99 -0.34 0.00 -0.00 0.00 0.00 52.55 54.45 1ry2 s ASP 313 Cb 0.13 -2.61 -0.15 0.00 -0.00 0.00 0.00 42.92 40.30 1ry2 s ASP 313 CO 0.18 0.01 1.36 -0.81 -0.00 0.00 0.00 175.17 175.91 1ry2 n PRO 314 N 1.85 1.57 -0.09 8.23 -0.04 -1.26 -2.58 135.00 142.68 1ry2 n PRO 314 Ca -0.00 0.56 -0.18 0.00 -0.04 0.00 0.00 63.50 63.84 1ry2 n PRO 314 Cb 0.47 -2.20 -0.11 0.00 -0.04 0.00 0.00 33.50 31.63 1ry2 n PRO 314 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1ry2 h LEU 315 N 4.49 0.00 0.00 1.53 5.85 -1.10 -3.44 115.31 122.64 1ry2 h LEU 315 Ca -0.45 -0.56 -0.10 0.00 0.84 0.00 0.00 57.88 57.61 1ry2 h LEU 315 Cb 1.31 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.32 1ry2 h LEU 315 CO 0.78 1.28 0.10 2.22 -0.34 0.00 0.00 178.44 182.48 1ry2 n PHE 316 N -4.50 -1.83 -4.27 1.25 1.16 -1.25 -3.40 117.46 104.62 1ry2 n PHE 316 Ca -0.24 -1.69 -0.18 0.00 -1.87 0.00 0.00 57.45 53.47 1ry2 n PHE 316 Cb 0.57 0.66 -0.13 0.00 -1.61 0.00 0.00 39.48 38.97 1ry2 n PHE 316 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1ry2 s LEU 317 N 0.00 2.15 -0.26 5.98 1.02 -0.66 -2.40 118.68 124.51 1ry2 s LEU 317 Ca 0.17 -0.39 -0.03 0.00 0.02 0.00 0.00 54.13 53.90 1ry2 s LEU 317 Cb -0.03 -0.45 0.10 0.00 0.02 0.00 0.00 46.19 45.84 1ry2 s LEU 317 CO 0.13 -0.00 0.19 -0.22 0.02 0.00 0.00 176.35 176.46 1ry2 s LEU 318 N -0.97 0.19 -0.34 1.79 2.96 -0.46 -4.01 118.68 117.84 1ry2 s LEU 318 Ca -0.01 -0.90 -0.28 0.00 -0.22 0.00 0.00 54.13 52.73 1ry2 s LEU 318 Cb -0.07 0.02 -0.02 0.00 0.50 0.00 0.00 46.19 46.62 1ry2 s LEU 318 CO 0.01 -0.40 1.81 -0.31 -1.32 0.00 0.00 176.35 176.13 1ry2 s TYR 319 N 2.21 1.79 -0.00 5.38 1.51 -1.24 -2.71 117.35 124.29 1ry2 s TYR 319 Ca 0.08 0.64 -0.30 0.00 -1.01 0.00 0.00 57.07 56.48 1ry2 s TYR 319 Cb -0.15 -4.12 -0.03 0.00 -0.11 0.00 0.00 41.96 37.54 1ry2 s TYR 319 CO -0.29 -2.92 1.03 0.99 -1.11 0.00 0.00 175.55 173.26 1ry2 s THR 320 N 7.03 4.67 -0.74 -0.71 2.01 -0.51 -4.89 115.64 122.51 1ry2 s THR 320 Ca 0.79 1.92 0.03 0.00 0.31 0.00 0.00 61.69 64.75 1ry2 s THR 320 Cb -0.22 -4.23 0.30 0.00 0.01 0.00 0.00 72.50 68.36 1ry2 s THR 320 CO 0.33 0.13 1.07 -1.20 -0.69 0.00 0.00 174.62 174.26 1ry2 n SER 321 N 4.09 4.90 0.00 3.53 7.64 -1.26 -3.44 113.62 129.08 1ry2 n SER 321 Ca 0.07 -3.56 0.00 0.00 1.01 0.00 0.00 58.87 56.39 1ry2 n SER 321 Cb 0.50 -0.79 0.00 0.00 -1.01 0.00 0.00 64.21 62.91 1ry2 n SER 321 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ry2 n GLY 322 N 0.40 -0.14 3.62 0.23 0.00 -1.26 -5.07 105.19 102.97 1ry2 n GLY 322 Ca 0.32 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.04 1ry2 n GLY 322 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ry2 s SER 323 N -0.91 1.09 0.65 1.61 1.04 -1.26 -5.02 113.70 110.90 1ry2 s SER 323 Ca 0.00 0.60 -0.13 0.00 0.48 0.00 0.00 55.95 56.90 1ry2 s SER 323 Cb 0.00 -0.83 -0.01 0.00 0.10 0.00 0.00 66.02 65.28 1ry2 s SER 323 CO 0.00 -4.02 1.06 0.28 0.98 0.00 0.00 173.24 171.54 1ry2 s THR 324 N -3.08 3.97 0.00 2.02 -1.32 -1.26 -4.94 115.64 111.03 1ry2 s THR 324 Ca 0.71 0.76 0.00 0.00 -1.21 0.00 0.00 61.69 61.95 1ry2 s THR 324 Cb -0.09 -3.41 0.00 0.00 -1.51 0.00 0.00 72.50 67.49 1ry2 s THR 324 CO 0.56 -0.72 0.00 0.61 -2.21 0.00 0.00 174.62 172.86 1ry2 n GLY 325 N -1.59 2.92 2.31 6.08 0.00 -1.26 -5.00 105.19 108.64 1ry2 n GLY 325 Ca 0.08 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 1ry2 n GLY 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ry2 n ALA 326 N 0.96 -0.70 -1.45 4.61 0.00 -1.26 -4.73 120.51 117.94 1ry2 n ALA 326 Ca 0.00 0.28 -0.50 0.00 0.00 0.00 0.00 53.44 53.22 1ry2 n ALA 326 Cb 0.00 -1.22 -0.04 0.00 0.00 0.00 0.00 19.45 18.19 1ry2 n ALA 326 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1ry2 n PRO 327 N 2.85 0.18 -3.41 0.00 -0.02 -1.26 -4.93 135.00 128.41 1ry2 n PRO 327 Ca 0.22 0.06 -0.37 0.00 -2.02 0.00 0.00 63.50 61.39 1ry2 n PRO 327 Cb -0.04 -1.23 -0.06 0.00 -0.02 0.00 0.00 33.50 32.15 1ry2 n PRO 327 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1ry2 s LYS 328 N -0.80 4.25 -1.22 -0.52 1.02 -1.22 -4.92 119.74 116.33 1ry2 s LYS 328 Ca 0.70 0.35 -0.12 0.00 0.02 0.00 0.00 55.97 56.91 1ry2 s LYS 328 Cb -0.98 -3.40 0.18 0.00 -0.52 0.00 0.00 37.83 33.12 1ry2 s LYS 328 CO 0.56 0.27 1.53 0.41 -0.92 0.00 0.00 175.35 177.20 1ry2 n GLY 329 N 3.06 3.83 3.67 -3.33 0.00 -1.26 -1.43 105.19 109.72 1ry2 n GLY 329 Ca -0.09 -2.09 -0.42 0.00 0.00 0.00 0.00 46.02 43.42 1ry2 n GLY 329 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ry2 s VAL 330 N 0.96 2.95 -0.23 1.61 1.01 -1.10 -0.21 120.40 125.39 1ry2 s VAL 330 Ca 0.41 0.07 -0.10 0.00 0.00 0.00 0.00 61.98 62.36 1ry2 s VAL 330 Cb 0.00 -3.04 -0.05 0.00 0.00 0.00 0.00 36.38 33.29 1ry2 s VAL 330 CO 0.00 -0.00 0.14 -1.58 0.00 0.00 0.00 175.10 173.66 1ry2 s GLN 331 N 4.10 4.04 0.10 2.72 -0.44 -0.47 -1.35 119.66 128.37 1ry2 s GLN 331 Ca 0.86 -0.29 0.05 0.00 -2.50 0.00 0.00 55.36 53.48 1ry2 s GLN 331 Cb -0.43 -3.48 -0.04 0.00 -1.64 0.00 0.00 33.01 27.42 1ry2 s GLN 331 CO 0.40 0.09 0.03 -1.01 0.50 0.00 0.00 175.29 175.30 1ry2 s HIS 332 N 0.96 3.03 0.72 1.67 3.76 -1.01 -0.67 115.29 123.76 1ry2 s HIS 332 Ca 0.07 -0.01 -0.12 0.00 -0.15 0.00 0.00 55.06 54.84 1ry2 s HIS 332 Cb -0.13 -1.54 0.17 0.00 1.11 0.00 0.00 32.58 32.19 1ry2 s HIS 332 CO 0.03 0.50 0.76 -1.13 -0.85 0.00 0.00 174.74 174.05 1ry2 n SER 333 N 0.40 -0.98 0.00 1.40 3.41 -1.26 -0.97 113.62 115.62 1ry2 n SER 333 Ca -0.10 -1.08 0.00 0.00 -0.26 0.00 0.00 58.87 57.43 1ry2 n SER 333 Cb 0.52 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.83 1ry2 n SER 333 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1ry2 n THR 334 N -3.67 0.00 -0.03 6.66 -1.04 -1.06 -3.54 114.28 111.60 1ry2 n THR 334 Ca 0.10 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 62.09 1ry2 n THR 334 Cb 0.37 -0.84 -0.01 0.00 -1.82 0.00 0.00 70.33 68.03 1ry2 n THR 334 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ry2 h ALA 335 N -2.00 -0.28 -0.96 2.41 0.00 -1.71 -0.77 119.26 115.94 1ry2 h ALA 335 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 54.91 55.10 1ry2 h ALA 335 Cb 0.00 0.85 -0.18 0.00 0.00 0.00 0.00 17.79 18.46 1ry2 h ALA 335 CO 0.00 -0.33 -0.26 0.41 0.00 0.00 0.00 179.25 179.07 1ry2 n GLY 336 N -1.05 -1.66 0.26 0.00 0.00 -1.26 -0.53 105.19 100.95 1ry2 n GLY 336 Ca -0.00 1.03 -0.10 0.00 0.00 0.00 0.00 46.02 46.95 1ry2 n GLY 336 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1ry2 h TYR 337 N 0.00 0.97 -0.41 1.61 3.20 -1.50 -2.77 116.97 118.07 1ry2 h TYR 337 Ca 0.44 -0.16 -0.06 0.00 3.14 0.00 0.00 58.73 62.09 1ry2 h TYR 337 Cb 0.68 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.68 1ry2 h TYR 337 CO -0.75 0.90 0.01 -0.07 -1.64 0.00 0.00 178.16 176.61 1ry2 h LEU 338 N 0.77 0.62 -0.54 2.82 4.07 0.65 -2.48 115.31 121.22 1ry2 h LEU 338 Ca 0.15 -0.13 -0.15 0.00 0.08 0.00 0.00 57.88 57.83 1ry2 h LEU 338 Cb 0.50 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.07 1ry2 h LEU 338 CO 0.02 0.69 -0.38 0.25 -1.08 0.00 0.00 178.44 177.94 1ry2 h LEU 339 N 0.62 0.81 -0.42 1.67 7.12 -0.83 -2.51 115.31 121.78 1ry2 h LEU 339 Ca 0.13 -0.36 -0.03 0.00 0.13 0.00 0.00 57.88 57.75 1ry2 h LEU 339 Cb 0.38 -0.23 -0.02 0.00 -0.53 0.00 0.00 40.66 40.26 1ry2 h LEU 339 CO 0.01 1.10 0.16 1.23 -0.13 0.00 0.00 178.44 180.81 1ry2 h GLY 340 N 0.92 0.68 2.00 3.75 0.00 -1.27 0.18 103.07 109.33 1ry2 h GLY 340 Ca 0.06 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 1ry2 h GLY 340 CO 0.09 0.36 -0.08 0.00 0.00 0.00 0.00 176.54 176.91 1ry2 h ALA 341 N 1.00 1.71 0.09 3.60 0.00 -1.38 -0.11 119.26 124.18 1ry2 h ALA 341 Ca 0.14 -0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 1ry2 h ALA 341 Cb 0.21 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.00 1ry2 h ALA 341 CO -0.01 0.09 -0.66 -0.07 0.00 0.00 0.00 179.25 178.60 1ry2 h LEU 342 N 0.00 0.30 -0.23 0.00 3.38 -0.94 -3.04 115.31 114.78 1ry2 h LEU 342 Ca -0.00 -0.94 0.01 0.00 0.09 0.00 0.00 57.88 57.04 1ry2 h LEU 342 Cb 0.15 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1ry2 h LEU 342 CO 0.01 1.31 0.13 -0.07 0.09 0.00 0.00 178.44 179.91 1ry2 h LEU 343 N -0.58 0.21 -1.92 1.67 4.07 -0.39 -2.51 115.31 115.86 1ry2 h LEU 343 Ca -0.13 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.81 1ry2 h LEU 343 Cb 1.45 -0.04 -0.00 0.00 1.08 0.00 0.00 40.66 43.15 1ry2 h LEU 343 CO 0.08 0.15 -0.10 0.71 -1.08 0.00 0.00 178.44 178.20 1ry2 h THR 344 N 0.27 0.86 0.03 0.22 1.35 -1.15 -2.05 112.91 112.44 1ry2 h THR 344 Ca 0.09 -0.39 -0.00 0.00 -0.55 0.00 0.00 66.41 65.56 1ry2 h THR 344 Cb 0.00 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 67.64 1ry2 h THR 344 CO -0.05 0.10 -0.01 0.24 -0.25 0.00 0.00 175.52 175.55 1ry2 h MET 345 N 0.00 -0.04 -0.59 4.72 2.86 -1.34 -1.79 114.93 118.75 1ry2 h MET 345 Ca -0.00 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 1ry2 h MET 345 Cb 0.21 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 1ry2 h MET 345 CO 0.01 0.55 0.20 -0.09 1.06 0.00 0.00 176.91 178.64 1ry2 h ARG 346 N -0.65 0.91 0.00 1.72 2.43 -1.30 -1.63 114.38 115.86 1ry2 h ARG 346 Ca -0.00 -0.18 -0.12 0.00 -0.81 0.00 0.00 59.98 58.86 1ry2 h ARG 346 Cb 0.60 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 1ry2 h ARG 346 CO 0.01 0.80 -0.88 1.88 -1.51 0.00 0.00 179.97 180.26 1ry2 h TYR 347 N 0.83 0.00 0.29 2.20 0.99 -1.49 -2.74 116.97 117.05 1ry2 h TYR 347 Ca 0.19 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.91 1ry2 h TYR 347 Cb 0.26 0.00 0.00 0.00 1.00 0.00 0.00 36.73 37.99 1ry2 h TYR 347 CO 0.02 0.76 -0.14 1.15 -0.00 0.00 0.00 178.16 179.94 1ry2 h THR 348 N -1.00 0.72 -0.01 -2.88 2.02 -1.50 -3.23 112.91 107.02 1ry2 h THR 348 Ca -0.18 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1ry2 h THR 348 Cb 0.91 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 68.04 1ry2 h THR 348 CO -0.11 0.00 -0.61 0.49 0.37 0.00 0.00 175.52 175.67 1ry2 n PHE 349 N -5.26 0.00 -3.73 3.16 3.72 -1.10 -0.98 117.46 113.27 1ry2 n PHE 349 Ca -0.10 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.02 1ry2 n PHE 349 Cb 0.18 -0.02 0.03 0.00 -0.94 0.00 0.00 39.48 38.73 1ry2 n PHE 349 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1ry2 n ASP 350 N -0.50 -3.69 -4.84 4.37 4.64 -0.68 -4.92 116.55 110.92 1ry2 n ASP 350 Ca 0.08 -0.98 -0.33 0.00 -1.38 0.00 0.00 54.79 52.18 1ry2 n ASP 350 Cb 0.42 -3.47 -0.06 0.00 -1.04 0.00 0.00 41.12 36.97 1ry2 n ASP 350 CO 0.00 0.00 0.00 0.28 -0.82 0.00 0.00 177.20 176.66 1ry2 s THR 351 N -3.60 4.64 0.00 5.18 -1.32 -0.80 -4.99 115.64 114.75 1ry2 s THR 351 Ca 0.31 1.05 0.00 0.00 -1.21 0.00 0.00 61.69 61.84 1ry2 s THR 351 Cb -0.11 -3.65 0.00 0.00 -1.51 0.00 0.00 72.50 67.23 1ry2 s THR 351 CO 0.86 -0.13 0.00 1.41 -2.21 0.00 0.00 174.62 174.55 1ry2 n HIS 352 N -0.21 0.00 -0.09 9.09 8.25 -1.26 -4.70 115.22 126.30 1ry2 n HIS 352 Ca 0.03 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.37 1ry2 n HIS 352 Cb 0.53 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.54 1ry2 n HIS 352 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1ry2 n GLN 353 N 0.00 0.82 -0.05 -0.41 1.13 -1.26 -4.49 117.38 113.11 1ry2 n GLN 353 Ca 0.00 0.07 0.05 0.00 -1.94 0.00 0.00 57.00 55.18 1ry2 n GLN 353 Cb 0.00 -1.39 0.22 0.00 0.11 0.00 0.00 30.24 29.18 1ry2 n GLN 353 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1ry2 n GLU 354 N -2.91 1.30 -1.25 -1.09 -0.58 -1.26 -4.09 120.64 110.75 1ry2 n GLU 354 Ca -0.32 -0.47 -0.30 0.00 -0.42 0.00 0.00 57.16 55.66 1ry2 n GLU 354 Cb 0.91 -1.19 0.14 0.00 -0.57 0.00 0.00 31.44 30.73 1ry2 n GLU 354 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1ry2 s ASP 355 N -1.22 3.50 -0.36 1.62 1.11 -1.26 -4.90 116.67 115.15 1ry2 s ASP 355 Ca 0.17 1.41 0.00 0.00 0.18 0.00 0.00 52.55 54.31 1ry2 s ASP 355 Cb 0.08 -2.09 0.12 0.00 1.07 0.00 0.00 42.92 42.10 1ry2 s ASP 355 CO 0.13 -2.61 0.17 -0.69 1.18 0.00 0.00 175.17 173.35 1ry2 s VAL 356 N -2.98 0.84 0.02 -1.27 1.01 -1.26 -1.98 120.40 114.78 1ry2 s VAL 356 Ca 0.63 -1.83 -0.23 0.00 0.00 0.00 0.00 61.98 60.56 1ry2 s VAL 356 Cb -0.17 -1.61 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 1ry2 s VAL 356 CO 0.57 -0.82 0.69 0.12 0.00 0.00 0.00 175.10 175.65 1ry2 s PHE 357 N 1.09 3.70 -0.28 5.22 5.36 0.44 -0.85 117.98 132.66 1ry2 s PHE 357 Ca 0.14 1.35 -0.00 0.00 -0.96 0.00 0.00 56.93 57.46 1ry2 s PHE 357 Cb -0.21 -2.74 0.08 0.00 -0.34 0.00 0.00 43.02 39.82 1ry2 s PHE 357 CO -0.11 0.29 0.04 0.12 -1.46 0.00 0.00 175.22 174.10 1ry2 s PHE 358 N -0.03 2.04 -0.34 10.12 5.36 0.14 -0.75 117.98 134.52 1ry2 s PHE 358 Ca 0.35 -1.77 -0.11 0.00 -0.96 0.00 0.00 56.93 54.45 1ry2 s PHE 358 Cb -0.19 -1.73 0.00 0.00 -0.34 0.00 0.00 43.02 40.76 1ry2 s PHE 358 CO 0.20 -0.82 0.18 0.99 -1.46 0.00 0.00 175.22 174.32 1ry2 s THR 359 N 1.51 4.70 -1.30 0.12 2.01 -1.26 -1.67 115.64 119.75 1ry2 s THR 359 Ca 0.04 -0.54 -0.13 0.00 0.31 0.00 0.00 61.69 61.38 1ry2 s THR 359 Cb -0.18 -3.48 0.13 0.00 0.01 0.00 0.00 72.50 68.99 1ry2 s THR 359 CO -0.15 -0.05 1.81 0.00 -0.69 0.00 0.00 174.62 175.53 1ry2 n ALA 360 N 5.01 4.75 -3.64 7.40 0.00 0.38 -4.85 120.51 129.57 1ry2 n ALA 360 Ca -0.13 -4.15 -0.09 0.00 0.00 0.00 0.00 53.44 49.07 1ry2 n ALA 360 Cb 0.48 -3.19 -0.07 0.00 0.00 0.00 0.00 19.45 16.67 1ry2 n ALA 360 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ry2 s GLY 361 N 2.28 -0.60 0.82 0.00 0.00 -1.26 -4.53 107.32 104.04 1ry2 s GLY 361 Ca 0.44 2.29 -0.13 0.00 0.00 0.00 0.00 44.72 47.32 1ry2 s GLY 361 CO -0.00 2.23 1.08 1.34 0.00 0.00 0.00 173.10 177.74 1ry2 n ASP 362 N 3.99 0.54 0.00 1.64 2.03 -1.26 -4.29 116.55 119.20 1ry2 n ASP 362 Ca -0.19 0.55 0.06 0.00 0.52 0.00 0.00 54.79 55.74 1ry2 n ASP 362 Cb 0.58 -1.46 0.37 0.00 -0.72 0.00 0.00 41.12 39.89 1ry2 n ASP 362 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ry2 n ILE 363 N -3.33 0.14 0.29 5.18 0.13 -1.26 -2.97 119.36 117.53 1ry2 n ILE 363 Ca 0.13 0.03 0.18 0.00 -1.10 0.00 0.00 62.75 61.99 1ry2 n ILE 363 Cb 0.51 -0.83 0.75 0.00 -0.84 0.00 0.00 39.64 39.22 1ry2 n ILE 363 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 1ry2 h GLY 364 N 2.01 0.00 -2.98 4.50 0.00 -1.91 -3.41 103.07 101.28 1ry2 h GLY 364 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.09 1ry2 h GLY 364 CO 0.00 0.00 -0.70 0.66 0.00 0.00 0.00 176.54 176.50 1ry2 s TRP 365 N -3.72 0.95 0.54 5.60 1.48 -1.16 -4.69 118.94 117.94 1ry2 s TRP 365 Ca 0.00 -0.91 0.48 0.00 -1.06 0.00 0.00 56.10 54.62 1ry2 s TRP 365 Cb 0.09 -0.54 1.71 0.00 -1.16 0.00 0.00 33.47 33.58 1ry2 s TRP 365 CO 0.53 -0.14 1.58 -0.84 -4.06 0.00 0.00 176.95 174.02 1ry2 h ILE 366 N 2.93 0.01 0.18 0.66 -0.00 -1.89 0.54 117.51 119.95 1ry2 h ILE 366 Ca -0.35 -0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.51 1ry2 h ILE 366 Cb 1.17 0.01 -0.01 0.00 -0.00 0.00 0.00 36.82 37.99 1ry2 h ILE 366 CO 0.64 0.00 -0.15 0.74 -0.00 0.00 0.00 178.15 179.38 1ry2 h THR 367 N 0.00 0.66 -0.01 0.16 2.02 -1.95 0.38 112.91 114.18 1ry2 h THR 367 Ca 0.93 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 68.03 1ry2 h THR 367 Cb 3.65 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 70.71 1ry2 h THR 367 CO -0.07 0.00 -0.38 1.23 0.37 0.00 0.00 175.52 176.67 1ry2 h GLY 368 N -0.35 0.03 0.58 2.16 0.00 0.06 0.27 103.07 105.82 1ry2 h GLY 368 Ca -0.00 -0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.28 1ry2 h GLY 368 CO -0.02 0.02 -0.18 0.45 0.00 0.00 0.00 176.54 176.81 1ry2 h HIS 369 N 0.02 -0.46 0.00 5.60 3.86 -0.79 -2.77 115.15 120.62 1ry2 h HIS 369 Ca -0.00 -0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.16 1ry2 h HIS 369 Cb 0.68 0.15 -0.01 0.00 1.06 0.00 0.00 27.41 29.30 1ry2 h HIS 369 CO 0.00 -0.13 -0.18 1.15 0.86 0.00 0.00 177.93 179.64 1ry2 h THR 370 N -0.93 0.31 0.00 2.45 2.02 -0.23 0.32 112.91 116.86 1ry2 h THR 370 Ca -0.05 -1.38 0.00 0.00 0.77 0.00 0.00 66.41 65.75 1ry2 h THR 370 Cb 0.54 2.10 0.00 0.00 -1.74 0.00 0.00 68.15 69.05 1ry2 h THR 370 CO 0.08 0.17 0.00 -1.22 0.37 0.00 0.00 175.52 174.93 1ry2 n TYR 371 N -3.16 0.00 -0.34 3.16 4.01 0.96 -0.59 117.16 121.21 1ry2 n TYR 371 Ca 0.03 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.78 1ry2 n TYR 371 Cb 0.58 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.63 1ry2 n TYR 371 CO 0.00 0.00 0.00 1.55 -0.46 0.00 0.00 176.86 177.95 1ry2 n VAL 372 N -0.06 0.95 0.00 -0.72 3.14 -1.06 -4.50 118.33 116.08 1ry2 n VAL 372 Ca 0.00 -1.01 0.00 0.00 -2.96 0.00 0.00 64.34 60.37 1ry2 n VAL 372 Cb 0.07 0.47 0.00 0.00 -1.06 0.00 0.00 33.84 33.32 1ry2 n VAL 372 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 1ry2 n VAL 373 N -0.54 0.00 0.31 1.55 0.31 -1.14 -4.92 118.33 113.89 1ry2 n VAL 373 Ca 0.02 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.23 1ry2 n VAL 373 Cb 0.35 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.22 1ry2 n VAL 373 CO 0.00 0.00 0.00 1.88 -1.32 0.00 0.00 176.83 177.39 1ry2 h TYR 374 N 0.00 -0.75 -0.06 3.52 0.05 -1.11 -2.06 116.97 116.55 1ry2 h TYR 374 Ca 0.00 -0.02 0.01 0.00 0.05 0.00 0.00 58.73 58.77 1ry2 h TYR 374 Cb 0.00 0.25 -0.03 0.00 1.01 0.00 0.00 36.73 37.96 1ry2 h TYR 374 CO 0.00 -0.47 -0.22 0.78 -1.05 0.00 0.00 178.16 177.20 1ry2 h GLY 375 N -1.08 -1.38 -0.00 3.88 0.00 -1.05 0.10 103.07 103.54 1ry2 h GLY 375 Ca -0.08 0.68 0.10 0.00 0.00 0.00 0.00 47.33 48.03 1ry2 h GLY 375 CO 0.14 -0.44 -0.10 -0.56 0.00 0.00 0.00 176.54 175.58 1ry2 h PRO 376 N -0.24 0.02 -0.04 4.80 0.13 -1.78 -1.54 132.00 133.35 1ry2 h PRO 376 Ca 0.01 -0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.03 1ry2 h PRO 376 Cb 0.28 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.39 1ry2 h PRO 376 CO -0.18 0.02 -0.50 -0.07 -0.23 0.00 0.00 178.00 177.03 1ry2 h LEU 377 N 0.02 0.12 -0.71 1.56 3.38 -1.22 -2.08 115.31 116.39 1ry2 h LEU 377 Ca 0.25 -0.06 -0.14 0.00 0.09 0.00 0.00 57.88 58.03 1ry2 h LEU 377 Cb 0.39 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1ry2 h LEU 377 CO -0.51 0.61 -0.54 -0.07 0.09 0.00 0.00 178.44 178.02 1ry2 h LEU 378 N 0.09 0.32 -0.30 1.67 3.38 -0.38 -3.11 115.31 116.98 1ry2 h LEU 378 Ca 0.00 -0.17 -0.13 0.00 0.09 0.00 0.00 57.88 57.67 1ry2 h LEU 378 Cb 0.92 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 1ry2 h LEU 378 CO 0.07 0.80 -0.63 0.22 0.09 0.00 0.00 178.44 178.99 1ry2 h TYR 379 N 0.23 0.00 0.00 1.13 3.20 -1.03 -3.46 116.97 117.03 1ry2 h TYR 379 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1ry2 h TYR 379 Cb 1.02 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.29 1ry2 h TYR 379 CO 0.02 0.63 0.00 0.41 -1.64 0.00 0.00 178.16 177.58 1ry2 n GLY 380 N 0.93 0.91 0.00 1.82 0.00 -0.80 -4.87 105.19 103.17 1ry2 n GLY 380 Ca 0.01 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1ry2 n GLY 380 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ry2 s ALA 382 N -2.00 3.70 -0.04 0.00 0.00 -0.84 -4.68 121.76 117.90 1ry2 s ALA 382 Ca 0.00 -0.70 0.06 0.00 0.00 0.00 0.00 51.96 51.33 1ry2 s ALA 382 Cb 0.00 -1.82 -0.01 0.00 0.00 0.00 0.00 23.12 21.29 1ry2 s ALA 382 CO 0.00 0.62 -0.24 -0.08 0.00 0.00 0.00 175.76 176.06 1ry2 s THR 383 N -1.00 1.91 -0.13 0.00 -1.32 -0.56 -0.42 115.64 114.12 1ry2 s THR 383 Ca 0.15 -1.00 -0.16 0.00 -1.21 0.00 0.00 61.69 59.47 1ry2 s THR 383 Cb -0.12 -1.60 -0.04 0.00 -1.51 0.00 0.00 72.50 69.22 1ry2 s THR 383 CO 0.04 0.53 0.39 -0.22 -2.21 0.00 0.00 174.62 173.15 1ry2 s LEU 384 N -0.27 4.27 -0.34 9.08 0.20 0.07 -1.58 118.68 130.11 1ry2 s LEU 384 Ca 0.01 0.68 -0.02 0.00 0.69 0.00 0.00 54.13 55.49 1ry2 s LEU 384 Cb -0.12 -2.54 0.07 0.00 -0.43 0.00 0.00 46.19 43.17 1ry2 s LEU 384 CO 0.02 0.07 0.08 -0.69 -0.29 0.00 0.00 176.35 175.53 1ry2 s VAL 385 N 0.45 3.14 -0.24 1.68 1.01 0.67 -4.54 120.40 122.56 1ry2 s VAL 385 Ca 0.21 -1.62 -0.04 0.00 0.00 0.00 0.00 61.98 60.54 1ry2 s VAL 385 Cb -0.14 -2.94 0.00 0.00 0.00 0.00 0.00 36.38 33.30 1ry2 s VAL 385 CO 0.07 -0.33 -0.02 0.12 0.00 0.00 0.00 175.10 174.94 1ry2 s PHE 386 N 1.22 3.02 -0.47 5.22 5.36 -1.26 -0.63 117.98 130.43 1ry2 s PHE 386 Ca 0.00 -1.10 0.09 0.00 -0.96 0.00 0.00 56.93 54.96 1ry2 s PHE 386 Cb -0.21 -2.12 0.55 0.00 -0.34 0.00 0.00 43.02 40.90 1ry2 s PHE 386 CO -0.02 -0.60 1.37 -0.85 -1.46 0.00 0.00 175.22 173.67 1ry2 n GLU 387 N 4.78 3.52 -0.89 10.12 0.28 -1.07 -4.82 120.64 132.56 1ry2 n GLU 387 Ca -0.17 -2.14 0.00 0.00 -0.16 0.00 0.00 57.16 54.69 1ry2 n GLU 387 Cb 0.49 -2.01 0.00 0.00 1.43 0.00 0.00 31.44 31.36 1ry2 n GLU 387 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1ry2 n GLY 388 N 0.34 4.43 3.55 -1.84 0.00 -1.26 -4.56 105.19 105.85 1ry2 n GLY 388 Ca 0.21 -2.11 -0.27 0.00 0.00 0.00 0.00 46.02 43.84 1ry2 n GLY 388 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ry2 s THR 389 N 0.48 3.11 0.56 2.61 -4.23 -1.26 -4.82 115.64 112.09 1ry2 s THR 389 Ca 0.00 -1.63 0.30 0.00 -1.18 0.00 0.00 61.69 59.18 1ry2 s THR 389 Cb 0.00 -2.52 0.35 0.00 1.34 0.00 0.00 72.50 71.67 1ry2 s THR 389 CO 0.00 -0.07 2.23 -0.65 -0.54 0.00 0.00 174.62 175.59 1ry2 h PRO 390 N 3.08 0.00 0.00 3.99 0.11 -1.99 -2.40 132.00 134.79 1ry2 h PRO 390 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1ry2 h PRO 390 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1ry2 h PRO 390 CO 0.53 0.02 -0.94 0.00 -0.21 0.00 0.00 178.00 177.40 1ry2 n ALA 391 N -2.31 4.01 -2.80 -0.75 0.00 -1.26 -4.18 120.51 113.22 1ry2 n ALA 391 Ca -0.03 -0.48 -0.35 0.00 0.00 0.00 0.00 53.44 52.58 1ry2 n ALA 391 Cb 0.11 -0.91 -0.09 0.00 0.00 0.00 0.00 19.45 18.56 1ry2 n ALA 391 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1ry2 s TYR 392 N -3.08 3.31 -2.13 0.00 5.04 -0.90 -0.73 117.35 118.86 1ry2 s TYR 392 Ca 0.07 0.19 0.17 0.00 -2.44 0.00 0.00 57.07 55.05 1ry2 s TYR 392 Cb 0.16 -2.01 0.71 0.00 0.35 0.00 0.00 41.96 41.16 1ry2 s TYR 392 CO 0.81 0.32 1.49 -0.35 -1.34 0.00 0.00 175.55 176.48 1ry2 n PRO 393 N 3.04 1.48 -3.61 4.97 -0.04 -1.26 -4.57 135.00 135.00 1ry2 n PRO 393 Ca -0.17 -0.73 -0.03 0.00 -0.04 0.00 0.00 63.50 62.53 1ry2 n PRO 393 Cb 0.53 -1.31 -0.02 0.00 -0.04 0.00 0.00 33.50 32.66 1ry2 n PRO 393 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1ry2 s ASN 394 N -1.43 -0.08 0.00 3.54 2.20 0.10 -5.03 114.94 114.24 1ry2 s ASN 394 Ca 0.27 -0.02 0.06 0.00 -0.94 0.00 0.00 52.86 52.24 1ry2 s ASN 394 Cb 0.14 0.10 0.30 0.00 -2.00 0.00 0.00 41.25 39.78 1ry2 s ASN 394 CO 0.21 -0.16 1.15 -1.22 -2.94 0.00 0.00 177.10 174.14 1ry2 n TYR 395 N -0.13 0.00 0.33 1.54 4.02 -1.24 -1.40 117.16 120.28 1ry2 n TYR 395 Ca 0.01 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.02 1ry2 n TYR 395 Cb 0.58 -0.42 0.16 0.00 -0.02 0.00 0.00 39.34 39.65 1ry2 n TYR 395 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1ry2 h SER 396 N 0.00 0.00 -0.54 7.72 0.87 -1.85 -3.38 113.55 116.37 1ry2 h SER 396 Ca 0.00 -0.05 0.10 0.00 -1.23 0.00 0.00 61.79 60.61 1ry2 h SER 396 Cb 0.09 0.00 -0.11 0.00 -0.44 0.00 0.00 62.40 61.94 1ry2 h SER 396 CO 0.00 0.03 -0.29 -0.09 -0.53 0.00 0.00 176.83 175.94 1ry2 h ARG 397 N 0.00 -0.15 -0.89 2.24 9.65 -1.49 -0.01 114.38 123.73 1ry2 h ARG 397 Ca 0.00 0.01 0.18 0.00 -1.10 0.00 0.00 59.98 59.07 1ry2 h ARG 397 Cb 0.90 0.03 -0.11 0.00 -1.39 0.00 0.00 29.97 29.41 1ry2 h ARG 397 CO 0.00 -0.10 0.45 1.88 2.80 0.00 0.00 179.97 185.00 1ry2 h TYR 398 N -0.16 0.77 0.00 2.20 -1.99 -1.76 -0.30 116.97 115.73 1ry2 h TYR 398 Ca 0.23 0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.99 1ry2 h TYR 398 Cb 0.53 -0.21 0.00 0.00 2.00 0.00 0.00 36.73 39.05 1ry2 h TYR 398 CO -0.58 0.11 -0.30 -1.49 -0.00 0.00 0.00 178.16 175.90 1ry2 h TRP 399 N 0.56 0.00 -0.35 4.88 6.55 -1.49 -3.23 115.95 122.87 1ry2 h TRP 399 Ca 0.51 0.00 -0.14 0.00 0.95 0.00 0.00 58.89 60.22 1ry2 h TRP 399 Cb 0.83 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.13 1ry2 h TRP 399 CO -0.09 0.00 -0.32 -0.44 -1.05 0.00 0.00 178.44 176.54 1ry2 h ASP 400 N 0.00 0.89 1.15 -3.49 3.32 0.76 -3.00 116.42 116.05 1ry2 h ASP 400 Ca 0.00 -0.46 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1ry2 h ASP 400 Cb 0.87 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1ry2 h ASP 400 CO 0.00 1.16 0.00 2.30 -1.72 0.00 0.00 179.24 180.98 1ry2 n ILE 401 N -4.16 0.52 0.07 0.35 -5.35 -1.03 -3.26 119.36 106.49 1ry2 n ILE 401 Ca -0.03 -0.08 -0.14 0.00 -0.27 0.00 0.00 62.75 62.23 1ry2 n ILE 401 Cb 0.50 -0.70 -0.14 0.00 -1.74 0.00 0.00 39.64 37.56 1ry2 n ILE 401 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1ry2 h ILE 402 N 0.00 1.34 0.00 7.28 2.04 -1.55 -3.22 117.51 123.40 1ry2 h ILE 402 Ca 0.00 -2.99 -0.13 0.00 1.00 0.00 0.00 64.86 62.74 1ry2 h ILE 402 Cb 0.57 2.80 -0.02 0.00 -0.74 0.00 0.00 36.82 39.44 1ry2 h ILE 402 CO 0.00 0.84 -0.94 -2.24 0.00 0.00 0.00 178.15 175.81 1ry2 h ASP 403 N 0.05 0.00 0.62 1.72 3.04 -1.55 -1.46 116.42 118.84 1ry2 h ASP 403 Ca -0.17 0.00 -0.28 0.00 -3.24 0.00 0.00 57.03 53.34 1ry2 h ASP 403 Cb 1.95 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 40.24 1ry2 h ASP 403 CO 0.16 0.50 -1.33 1.05 -2.04 0.00 0.00 179.24 177.58 1ry2 h GLU 404 N 0.00 0.21 -0.02 4.15 4.11 -1.70 -3.27 114.58 118.07 1ry2 h GLU 404 Ca -0.08 -0.36 0.00 0.00 0.07 0.00 0.00 59.36 59.00 1ry2 h GLU 404 Cb 1.44 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.83 1ry2 h GLU 404 CO 0.05 1.11 -0.02 0.72 0.07 0.00 0.00 179.01 180.94 1ry2 n HIS 405 N -3.45 0.00 -3.96 2.06 8.25 -1.22 -4.94 115.22 111.96 1ry2 n HIS 405 Ca -0.10 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.06 1ry2 n HIS 405 Cb 1.02 -0.01 0.01 0.00 1.12 0.00 0.00 29.99 32.13 1ry2 n HIS 405 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1ry2 n LYS 406 N 0.26 -4.50 -1.66 -0.41 4.76 -1.05 -4.83 118.16 110.74 1ry2 n LYS 406 Ca 0.18 0.52 -0.50 0.00 -2.87 0.00 0.00 58.31 55.64 1ry2 n LYS 406 Cb 0.39 -5.18 -0.05 0.00 -1.84 0.00 0.00 35.03 28.35 1ry2 n LYS 406 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1ry2 n VAL 407 N -4.50 0.20 0.87 -0.18 0.31 -0.57 -4.70 118.33 109.75 1ry2 n VAL 407 Ca -0.07 -0.04 0.10 0.00 -0.01 0.00 0.00 64.34 64.32 1ry2 n VAL 407 Cb 0.57 -1.43 0.05 0.00 -0.91 0.00 0.00 33.84 32.12 1ry2 n VAL 407 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1ry2 n THR 408 N 3.85 0.00 -3.55 2.52 -2.24 -0.03 -2.91 114.28 111.91 1ry2 n THR 408 Ca 0.20 -0.41 -0.17 0.00 -2.27 0.00 0.00 64.05 61.41 1ry2 n THR 408 Cb 0.25 1.34 -0.13 0.00 -2.10 0.00 0.00 70.33 69.68 1ry2 n THR 408 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1ry2 s GLN 409 N -1.95 0.16 -0.10 -0.78 -1.52 -1.12 -2.56 119.66 111.78 1ry2 s GLN 409 Ca 0.21 0.38 -0.00 0.00 -1.95 0.00 0.00 55.36 54.00 1ry2 s GLN 409 Cb 0.17 -0.80 -0.02 0.00 -0.22 0.00 0.00 33.01 32.13 1ry2 s GLN 409 CO 0.37 -0.52 -0.09 0.12 -0.25 0.00 0.00 175.29 174.92 1ry2 s PHE 410 N 2.34 2.89 -0.20 0.91 5.36 -1.06 0.25 117.98 128.47 1ry2 s PHE 410 Ca 0.05 -0.26 -0.04 0.00 -0.96 0.00 0.00 56.93 55.72 1ry2 s PHE 410 Cb -0.14 -1.79 0.09 0.00 -0.34 0.00 0.00 43.02 40.84 1ry2 s PHE 410 CO -0.10 0.08 0.24 -0.47 -1.46 0.00 0.00 175.22 173.50 1ry2 s TYR 411 N -0.20 -0.34 0.24 10.12 5.04 -0.67 -1.58 117.35 129.96 1ry2 s TYR 411 Ca 0.02 0.35 0.02 0.00 -2.44 0.00 0.00 57.07 55.02 1ry2 s TYR 411 Cb -0.13 -0.29 -0.04 0.00 0.35 0.00 0.00 41.96 41.85 1ry2 s TYR 411 CO 0.03 -0.59 0.18 0.54 -1.34 0.00 0.00 175.55 174.37 1ry2 s VAL 412 N 2.36 0.00 0.10 3.14 0.11 -1.00 -0.47 120.40 124.63 1ry2 s VAL 412 Ca 0.07 -2.00 -0.03 0.00 -2.93 0.00 0.00 61.98 57.09 1ry2 s VAL 412 Cb -0.15 -2.50 -0.05 0.00 -1.53 0.00 0.00 36.38 32.15 1ry2 s VAL 412 CO -0.12 0.00 0.30 0.00 -3.33 0.00 0.00 175.10 171.94 1ry2 s ALA 413 N -3.92 3.89 0.35 1.54 0.00 -1.26 -2.59 121.76 119.78 1ry2 s ALA 413 Ca 0.40 -0.69 0.11 0.00 0.00 0.00 0.00 51.96 51.78 1ry2 s ALA 413 Cb 0.05 -1.99 0.87 0.00 0.00 0.00 0.00 23.12 22.06 1ry2 s ALA 413 CO 0.17 0.74 1.82 -1.35 0.00 0.00 0.00 175.76 177.14 1ry2 h PRO 414 N 3.02 0.61 -0.14 0.00 0.11 -1.87 -1.97 132.00 131.76 1ry2 h PRO 414 Ca -0.46 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 65.66 1ry2 h PRO 414 Cb 1.16 -0.14 -0.05 0.00 0.11 0.00 0.00 31.00 32.08 1ry2 h PRO 414 CO 0.74 0.40 -0.20 1.15 -0.21 0.00 0.00 178.00 179.88 1ry2 h THR 415 N 0.63 0.50 -0.07 -1.15 2.02 -1.93 0.30 112.91 113.21 1ry2 h THR 415 Ca 0.52 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.71 1ry2 h THR 415 Cb 0.97 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.87 1ry2 h THR 415 CO -0.27 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.62 1ry2 h ALA 416 N 0.77 0.07 0.00 6.16 0.00 -1.78 -0.88 119.26 123.59 1ry2 h ALA 416 Ca 0.10 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1ry2 h ALA 416 Cb 0.40 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1ry2 h ALA 416 CO -0.28 -0.47 0.00 1.28 0.00 0.00 0.00 179.25 179.78 1ry2 n LEU 417 N -5.10 0.11 -0.04 0.00 4.77 -0.80 -1.39 117.00 114.55 1ry2 n LEU 417 Ca -0.05 0.54 -0.08 0.00 -0.03 0.00 0.00 56.01 56.39 1ry2 n LEU 417 Cb 0.05 -0.55 -0.14 0.00 -2.33 0.00 0.00 43.42 40.46 1ry2 n LEU 417 CO 0.31 -0.51 -0.67 -1.14 -1.33 0.00 0.00 177.39 174.05 1ry2 n ARG 418 N -1.64 0.65 0.03 3.23 0.63 0.98 -3.46 116.66 117.08 1ry2 n ARG 418 Ca 0.01 0.20 -0.05 0.00 -0.92 0.00 0.00 57.85 57.08 1ry2 n ARG 418 Cb 0.05 -1.72 -0.10 0.00 0.45 0.00 0.00 32.46 31.14 1ry2 n ARG 418 CO 0.00 0.00 0.00 1.25 -2.51 0.00 0.00 177.63 176.37 1ry2 h LEU 419 N 0.00 0.00 -0.29 6.15 5.85 -0.53 -3.27 115.31 123.22 1ry2 h LEU 419 Ca -0.34 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.19 1ry2 h LEU 419 Cb 2.01 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 43.03 1ry2 h LEU 419 CO 0.06 0.86 -0.86 -0.07 -0.34 0.00 0.00 178.44 178.08 1ry2 h LEU 420 N 0.00 0.29 -0.02 2.25 3.38 -1.50 -2.87 115.31 116.84 1ry2 h LEU 420 Ca -0.15 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1ry2 h LEU 420 Cb 1.79 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.45 1ry2 h LEU 420 CO 0.09 1.02 0.00 1.17 0.09 0.00 0.00 178.44 180.81 1ry2 n LYS 421 N -3.68 0.01 0.07 1.13 4.81 -1.22 -2.98 118.16 116.29 1ry2 n LYS 421 Ca -0.04 0.16 -0.22 0.00 -0.87 0.00 0.00 58.31 57.34 1ry2 n LYS 421 Cb 0.80 -1.51 -0.15 0.00 0.02 0.00 0.00 35.03 34.18 1ry2 n LYS 421 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ry2 h ARG 422 N 0.00 0.38 0.00 1.64 3.08 -1.55 -3.34 114.38 114.59 1ry2 h ARG 422 Ca 0.00 -0.65 0.00 0.00 0.07 0.00 0.00 59.98 59.40 1ry2 h ARG 422 Cb 0.35 0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.64 1ry2 h ARG 422 CO 0.00 1.29 0.00 0.00 -1.07 0.00 0.00 179.97 180.19 1ry2 h ALA 423 N 0.16 1.00 0.00 0.04 0.00 -1.51 -3.48 119.26 115.47 1ry2 h ALA 423 Ca -0.34 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1ry2 h ALA 423 Cb 2.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.88 1ry2 h ALA 423 CO 0.18 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.84 1ry2 n GLY 424 N -0.73 0.42 1.30 0.00 0.00 -1.25 -4.64 105.19 100.29 1ry2 n GLY 424 Ca -0.01 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.54 1ry2 n GLY 424 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ry2 n ASP 425 N -0.38 1.37 -0.02 1.61 5.75 -1.26 -2.97 116.55 120.65 1ry2 n ASP 425 Ca 0.00 -1.00 -0.10 0.00 -0.01 0.00 0.00 54.79 53.69 1ry2 n ASP 425 Cb 0.00 -0.26 -0.14 0.00 -1.03 0.00 0.00 41.12 39.69 1ry2 n ASP 425 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1ry2 n SER 426 N 1.18 0.92 0.12 -1.12 3.41 -1.26 -3.25 113.62 113.62 1ry2 n SER 426 Ca 0.00 0.38 0.13 0.00 -0.26 0.00 0.00 58.87 59.11 1ry2 n SER 426 Cb 0.18 -0.06 0.34 0.00 -0.26 0.00 0.00 64.21 64.41 1ry2 n SER 426 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 1ry2 h TYR 427 N 0.01 0.00 0.00 7.33 -1.99 -1.85 -3.17 116.97 117.29 1ry2 h TYR 427 Ca -0.31 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.42 1ry2 h TYR 427 Cb 2.03 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.76 1ry2 h TYR 427 CO 0.01 0.00 -0.96 -0.89 -0.00 0.00 0.00 178.16 176.32 1ry2 n ILE 428 N -2.42 0.01 0.00 -2.88 5.41 -1.25 -4.72 119.36 113.50 1ry2 n ILE 428 Ca 0.05 -0.03 0.00 0.00 1.00 0.00 0.00 62.75 63.77 1ry2 n ILE 428 Cb 0.45 0.82 0.00 0.00 -0.71 0.00 0.00 39.64 40.20 1ry2 n ILE 428 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1ry2 n GLU 429 N -1.54 0.00 -0.11 0.38 0.00 -1.20 -2.78 120.64 115.39 1ry2 n GLU 429 Ca 0.04 0.49 0.15 0.00 0.00 0.00 0.00 57.16 57.84 1ry2 n GLU 429 Cb 0.34 -1.11 0.54 0.00 0.00 0.00 0.00 31.44 31.21 1ry2 n GLU 429 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.13 176.16 1ry2 h ASN 430 N 0.00 0.30 -2.32 4.31 -0.00 -1.84 -3.43 115.58 112.60 1ry2 h ASN 430 Ca 0.00 0.01 -0.55 0.00 -0.00 0.00 0.00 56.30 55.77 1ry2 h ASN 430 Cb 0.00 -0.05 0.03 0.00 -0.00 0.00 0.00 38.32 38.30 1ry2 h ASN 430 CO 0.00 0.17 1.17 1.41 -0.00 0.00 0.00 177.43 180.18 1ry2 n HIS 431 N -4.46 2.50 -0.01 0.67 8.25 -1.12 -4.88 115.22 116.18 1ry2 n HIS 431 Ca 0.12 -0.24 -0.22 0.00 -0.26 0.00 0.00 57.72 57.13 1ry2 n HIS 431 Cb 0.50 -2.76 -0.14 0.00 1.12 0.00 0.00 29.99 28.72 1ry2 n HIS 431 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1ry2 h SER 432 N 9.73 0.35 -6.82 0.41 4.64 -1.86 -3.49 113.55 116.52 1ry2 h SER 432 Ca -0.49 -0.86 -0.55 0.00 -0.47 0.00 0.00 61.79 59.43 1ry2 h SER 432 Cb 1.24 -0.11 -0.21 0.00 -0.31 0.00 0.00 62.40 63.01 1ry2 h SER 432 CO 0.94 1.76 -0.85 0.00 -0.87 0.00 0.00 176.83 177.82 1ry2 n LEU 433 N -3.73 -0.83 0.00 5.97 -0.00 -1.26 -4.78 117.00 112.37 1ry2 n LEU 433 Ca -0.31 -1.12 0.11 0.00 -0.00 0.00 0.00 56.01 54.69 1ry2 n LEU 433 Cb 0.96 -1.40 0.64 0.00 -0.00 0.00 0.00 43.42 43.63 1ry2 n LEU 433 CO 0.39 0.36 0.91 0.29 -0.00 0.00 0.00 177.39 179.34 1ry2 n LYS 434 N -4.08 0.99 0.23 1.47 4.76 -1.26 -3.41 118.16 116.87 1ry2 n LYS 434 Ca -0.23 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.33 1ry2 n LYS 434 Cb 0.58 -1.34 0.50 0.00 -1.84 0.00 0.00 35.03 32.93 1ry2 n LYS 434 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1ry2 h SER 435 N 0.00 0.00 -4.11 4.39 4.64 -1.86 -3.45 113.55 113.15 1ry2 h SER 435 Ca 0.00 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.84 1ry2 h SER 435 Cb 0.00 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.14 1ry2 h SER 435 CO 0.00 0.16 0.39 -0.76 -0.87 0.00 0.00 176.83 175.76 1ry2 s LEU 436 N -6.61 3.71 0.00 5.97 2.01 -1.15 -3.95 118.68 118.67 1ry2 s LEU 436 Ca 0.01 1.96 0.00 0.00 0.01 0.00 0.00 54.13 56.11 1ry2 s LEU 436 Cb 0.10 -4.56 0.00 0.00 0.01 0.00 0.00 46.19 41.74 1ry2 s LEU 436 CO 0.62 -1.02 0.00 0.54 1.01 0.00 0.00 176.35 177.49 1ry2 n ARG 437 N -1.40 3.12 -3.74 1.70 1.74 -1.06 -4.99 116.66 112.04 1ry2 n ARG 437 Ca 0.10 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 57.04 1ry2 n ARG 437 Cb 0.52 -0.69 -0.09 0.00 -1.02 0.00 0.00 32.46 31.18 1ry2 n ARG 437 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ry2 s LEU 439 N -0.86 2.45 -0.02 0.00 1.43 -0.69 -2.57 118.68 118.42 1ry2 s LEU 439 Ca -0.09 -0.88 -0.13 0.00 -1.03 0.00 0.00 54.13 52.00 1ry2 s LEU 439 Cb -0.04 -1.09 0.02 0.00 0.03 0.00 0.00 46.19 45.11 1ry2 s LEU 439 CO 0.04 0.08 0.28 -0.83 0.23 0.00 0.00 176.35 176.15 1ry2 s GLY 440 N -2.74 -0.12 -0.01 -3.19 0.00 -0.61 -0.90 107.32 99.75 1ry2 s GLY 440 Ca 0.20 0.27 0.04 0.00 0.00 0.00 0.00 44.72 45.24 1ry2 s GLY 440 CO 0.10 0.08 -0.15 -0.45 0.00 0.00 0.00 173.10 172.67 1ry2 s SER 441 N -1.27 1.76 0.12 1.64 0.15 0.07 -2.38 113.70 113.79 1ry2 s SER 441 Ca -0.13 -0.27 -0.16 0.00 0.70 0.00 0.00 55.95 56.09 1ry2 s SER 441 Cb -0.06 -0.23 0.03 0.00 -1.71 0.00 0.00 66.02 64.05 1ry2 s SER 441 CO 0.04 0.18 0.39 0.54 1.20 0.00 0.00 173.24 175.58 1ry2 s VAL 442 N -0.29 0.07 0.00 4.45 0.11 -1.07 0.34 120.40 124.01 1ry2 s VAL 442 Ca 0.05 -0.60 0.00 0.00 -2.93 0.00 0.00 61.98 58.49 1ry2 s VAL 442 Cb -0.06 -1.17 0.00 0.00 -1.53 0.00 0.00 36.38 33.61 1ry2 s VAL 442 CO -0.00 -0.33 0.00 0.61 -3.33 0.00 0.00 175.10 172.04 1ry2 n GLY 443 N -0.21 3.03 3.85 6.54 0.00 -1.26 -4.03 105.19 113.10 1ry2 n GLY 443 Ca -0.16 -0.83 -0.07 0.00 0.00 0.00 0.00 46.02 44.96 1ry2 n GLY 443 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ry2 s GLU 444 N 0.00 1.77 0.40 1.61 -1.05 -1.26 -4.89 118.70 115.28 1ry2 s GLU 444 Ca 0.00 -1.00 -0.24 0.00 -0.15 0.00 0.00 54.97 53.58 1ry2 s GLU 444 Cb 0.00 0.59 -0.11 0.00 -0.44 0.00 0.00 34.13 34.17 1ry2 s GLU 444 CO 0.00 -0.81 0.92 -2.30 0.95 0.00 0.00 175.26 174.02 1ry2 n PRO 445 N -0.47 1.19 -4.06 -4.83 -0.02 -1.26 -4.79 135.00 120.76 1ry2 n PRO 445 Ca -0.05 0.43 -0.33 0.00 -2.02 0.00 0.00 63.50 61.53 1ry2 n PRO 445 Cb 0.59 -1.91 -0.15 0.00 -0.02 0.00 0.00 33.50 32.01 1ry2 n PRO 445 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1ry2 s ILE 446 N -1.27 2.30 1.06 4.25 2.07 -1.26 -4.93 121.20 123.42 1ry2 s ILE 446 Ca 0.63 -1.24 -0.15 0.00 -1.41 0.00 0.00 60.65 58.47 1ry2 s ILE 446 Cb -0.59 -2.18 0.11 0.00 0.13 0.00 0.00 42.46 39.94 1ry2 s ILE 446 CO 0.57 0.23 0.37 0.00 -1.91 0.00 0.00 174.94 174.20 1ry2 n ALA 447 N 4.56 -3.22 -0.03 1.50 0.00 -1.26 -4.54 120.51 117.51 1ry2 n ALA 447 Ca -0.17 -1.00 -0.14 0.00 0.00 0.00 0.00 53.44 52.13 1ry2 n ALA 447 Cb 0.46 -1.73 -0.10 0.00 0.00 0.00 0.00 19.45 18.08 1ry2 n ALA 447 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ry2 h ALA 448 N -1.98 0.06 -0.26 0.00 0.00 -1.91 -2.06 119.26 113.12 1ry2 h ALA 448 Ca -0.51 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.04 1ry2 h ALA 448 Cb 1.32 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1ry2 h ALA 448 CO 0.39 -0.02 0.15 1.05 0.00 0.00 0.00 179.25 180.81 1ry2 h GLU 449 N -0.41 0.34 0.00 0.00 4.11 -1.94 0.27 114.58 116.95 1ry2 h GLU 449 Ca -0.01 -0.03 -0.13 0.00 0.07 0.00 0.00 59.36 59.27 1ry2 h GLU 449 Cb 0.76 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.92 1ry2 h GLU 449 CO 0.03 0.25 -0.63 -0.24 0.07 0.00 0.00 179.01 178.48 1ry2 h VAL 450 N 0.35 1.15 -0.10 -1.06 3.04 -1.92 -1.13 116.25 116.57 1ry2 h VAL 450 Ca 0.09 -2.45 -0.13 0.00 -1.01 0.00 0.00 66.70 63.20 1ry2 h VAL 450 Cb -0.00 2.45 0.01 0.00 -2.01 0.00 0.00 31.29 31.73 1ry2 h VAL 450 CO -0.02 0.62 -0.46 -0.25 -1.01 0.00 0.00 177.57 176.46 1ry2 h TRP 451 N 0.00 0.65 0.36 3.17 7.01 -0.44 -1.84 115.95 124.86 1ry2 h TRP 451 Ca -0.01 -0.28 -0.02 0.00 2.11 0.00 0.00 58.89 60.69 1ry2 h TRP 451 Cb 1.40 -0.10 0.00 0.00 -2.10 0.00 0.00 29.16 28.36 1ry2 h TRP 451 CO 0.00 1.05 -0.17 0.93 -2.79 0.00 0.00 178.44 177.46 1ry2 h GLU 452 N 0.07 -0.46 -0.88 2.65 4.39 -0.50 0.38 114.58 120.22 1ry2 h GLU 452 Ca -0.03 0.03 0.18 0.00 0.34 0.00 0.00 59.36 59.88 1ry2 h GLU 452 Cb 1.10 0.11 -0.11 0.00 -0.10 0.00 0.00 28.75 29.75 1ry2 h GLU 452 CO 0.09 -0.29 0.43 2.35 -1.16 0.00 0.00 179.01 180.44 1ry2 h TRP 453 N -0.52 0.73 -0.32 4.33 7.01 -1.24 0.45 115.95 126.39 1ry2 h TRP 453 Ca -0.05 0.04 -0.07 0.00 2.11 0.00 0.00 58.89 60.92 1ry2 h TRP 453 Cb 0.39 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 27.25 1ry2 h TRP 453 CO -0.04 0.08 -0.07 -0.92 -2.79 0.00 0.00 178.44 174.70 1ry2 h TYR 454 N 0.53 0.69 0.00 2.65 3.20 -0.89 -0.98 116.97 122.17 1ry2 h TYR 454 Ca 0.51 -0.15 -0.06 0.00 3.14 0.00 0.00 58.73 62.17 1ry2 h TYR 454 Cb 0.85 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 1ry2 h TYR 454 CO -0.11 0.79 -0.31 1.03 -1.64 0.00 0.00 178.16 177.92 1ry2 h SER 455 N 0.39 0.00 0.00 -2.11 0.87 0.26 -2.01 113.55 110.96 1ry2 h SER 455 Ca 0.08 0.00 -0.42 0.00 -1.23 0.00 0.00 61.79 60.22 1ry2 h SER 455 Cb 0.56 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 62.45 1ry2 h SER 455 CO 0.03 0.31 -2.48 1.21 -0.53 0.00 0.00 176.83 175.36 1ry2 n GLU 456 N -3.93 0.61 0.08 2.24 2.13 0.13 -0.76 120.64 121.12 1ry2 n GLU 456 Ca -0.02 0.20 -0.08 0.00 0.66 0.00 0.00 57.16 57.92 1ry2 n GLU 456 Cb 0.38 -1.49 -0.05 0.00 0.27 0.00 0.00 31.44 30.55 1ry2 n GLU 456 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1ry2 h LYS 457 N -0.48 -0.27 0.03 5.31 1.79 -1.33 -2.34 116.57 119.28 1ry2 h LYS 457 Ca -0.63 0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 57.86 1ry2 h LYS 457 Cb 1.74 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 32.46 1ry2 h LYS 457 CO -0.25 0.02 -0.01 0.82 -1.08 0.00 0.00 179.45 178.95 1ry2 h ILE 458 N -0.99 1.43 0.00 1.86 5.03 -1.66 -3.31 117.51 119.87 1ry2 h ILE 458 Ca -0.03 -1.67 0.00 0.00 -0.12 0.00 0.00 64.86 63.04 1ry2 h ILE 458 Cb 0.42 2.51 0.00 0.00 -3.03 0.00 0.00 36.82 36.72 1ry2 h ILE 458 CO 0.05 0.41 0.00 0.61 -0.68 0.00 0.00 178.15 178.54 1ry2 n GLY 459 N 0.96 -1.24 2.96 5.37 0.00 -0.76 -4.86 105.19 107.61 1ry2 n GLY 459 Ca -0.09 -0.08 -0.19 0.00 0.00 0.00 0.00 46.02 45.66 1ry2 n GLY 459 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ry2 n LYS 460 N -1.47 -3.20 -1.67 1.61 4.76 -0.88 -3.21 118.16 114.09 1ry2 n LYS 460 Ca 0.06 0.60 -0.11 0.00 -2.87 0.00 0.00 58.31 55.99 1ry2 n LYS 460 Cb 0.25 -5.29 0.01 0.00 -1.84 0.00 0.00 35.03 28.16 1ry2 n LYS 460 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 1ry2 n ASN 461 N -2.15 -1.48 0.00 4.39 6.94 0.06 -4.76 115.26 118.25 1ry2 n ASN 461 Ca -0.08 -0.04 0.00 0.00 -0.02 0.00 0.00 54.58 54.43 1ry2 n ASN 461 Cb 0.58 -0.43 0.00 0.00 -2.36 0.00 0.00 39.78 37.57 1ry2 n ASN 461 CO 0.00 0.00 0.00 -1.84 -1.03 0.00 0.00 177.26 174.39 1ry2 n GLU 462 N -0.04 0.00 -4.17 -3.83 0.28 -1.20 -5.06 120.64 106.62 1ry2 n GLU 462 Ca -0.02 0.00 -0.18 0.00 -0.16 0.00 0.00 57.16 56.80 1ry2 n GLU 462 Cb 0.19 0.00 -0.15 0.00 1.43 0.00 0.00 31.44 32.90 1ry2 n GLU 462 CO 0.00 0.00 0.00 -1.50 -0.16 0.00 0.00 177.13 175.47 1ry2 s ILE 463 N 0.00 0.47 0.98 3.84 1.10 -1.25 -5.12 121.20 121.21 1ry2 s ILE 463 Ca 0.00 -0.19 -0.13 0.00 -0.51 0.00 0.00 60.65 59.82 1ry2 s ILE 463 Cb 0.00 -0.44 0.05 0.00 0.15 0.00 0.00 42.46 42.22 1ry2 s ILE 463 CO 0.00 0.16 0.37 -2.65 -2.11 0.00 0.00 174.94 170.71 1ry2 n PRO 464 N 3.36 -0.49 -3.55 3.50 -0.02 -1.26 -4.80 135.00 131.73 1ry2 n PRO 464 Ca -0.18 -0.10 -0.25 0.00 -2.02 0.00 0.00 63.50 60.94 1ry2 n PRO 464 Cb 0.55 -1.84 -0.15 0.00 -0.02 0.00 0.00 33.50 32.03 1ry2 n PRO 464 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1ry2 s ILE 465 N -2.38 -0.14 -0.44 4.25 1.01 -1.26 -1.70 121.20 120.54 1ry2 s ILE 465 Ca 0.57 -0.36 -0.17 0.00 0.00 0.00 0.00 60.65 60.69 1ry2 s ILE 465 Cb -0.20 -0.74 0.04 0.00 0.01 0.00 0.00 42.46 41.56 1ry2 s ILE 465 CO 0.67 -0.42 0.44 0.68 0.00 0.00 0.00 174.94 176.31 1ry2 s VAL 466 N 2.17 5.10 -0.81 2.92 -7.23 -0.08 -4.92 120.40 117.56 1ry2 s VAL 466 Ca 0.05 -0.53 -0.20 0.00 -1.81 0.00 0.00 61.98 59.49 1ry2 s VAL 466 Cb -0.16 -4.08 0.10 0.00 0.56 0.00 0.00 36.38 32.81 1ry2 s VAL 466 CO -0.20 -0.49 1.05 -0.62 -0.31 0.00 0.00 175.10 174.53 1ry2 s ASP 467 N 2.05 6.43 -0.45 4.85 2.15 -1.26 -0.75 116.67 129.69 1ry2 s ASP 467 Ca 0.10 -1.59 -0.29 0.00 0.43 0.00 0.00 52.55 51.20 1ry2 s ASP 467 Cb -0.19 -2.41 0.02 0.00 -0.30 0.00 0.00 42.92 40.05 1ry2 s ASP 467 CO 0.12 -1.23 1.23 0.42 -0.17 0.00 0.00 175.17 175.54 1ry2 s THR 468 N 3.29 4.11 -0.19 1.71 -4.23 0.15 -4.48 115.64 116.01 1ry2 s THR 468 Ca 0.28 1.14 -0.19 0.00 -1.18 0.00 0.00 61.69 61.74 1ry2 s THR 468 Cb -0.10 -4.46 -0.03 0.00 1.34 0.00 0.00 72.50 69.25 1ry2 s THR 468 CO -0.01 -0.90 0.56 -0.47 -0.54 0.00 0.00 174.62 173.25 1ry2 s TYR 469 N 4.75 3.39 0.00 3.99 5.04 -0.49 -4.53 117.35 129.51 1ry2 s TYR 469 Ca 0.52 0.85 0.00 0.00 -2.44 0.00 0.00 57.07 56.00 1ry2 s TYR 469 Cb -0.10 -2.71 0.00 0.00 0.35 0.00 0.00 41.96 39.51 1ry2 s TYR 469 CO 0.31 -0.10 0.00 -2.67 -1.34 0.00 0.00 175.55 171.76 1ry2 n TRP 470 N 4.75 0.00 -4.59 4.97 4.27 -1.26 0.11 117.44 125.68 1ry2 n TRP 470 Ca -0.04 0.00 -0.27 0.00 -3.89 0.00 0.00 57.50 53.30 1ry2 n TRP 470 Cb 0.50 0.00 -0.10 0.00 -1.36 0.00 0.00 31.31 30.36 1ry2 n TRP 470 CO 0.00 0.00 0.00 -0.65 -2.29 0.00 0.00 177.69 174.75 1ry2 s GLN 471 N -2.00 1.92 0.46 -2.67 -0.21 -1.26 -4.87 119.66 111.03 1ry2 s GLN 471 Ca 0.00 -2.13 0.14 0.00 0.02 0.00 0.00 55.36 53.39 1ry2 s GLN 471 Cb 0.00 -1.26 1.06 0.00 1.00 0.00 0.00 33.01 33.81 1ry2 s GLN 471 CO 0.00 -0.21 2.04 1.15 -2.12 0.00 0.00 175.29 176.15 1ry2 h THR 472 N 1.78 1.09 0.00 -0.19 2.02 -1.98 -1.85 112.91 113.78 1ry2 h THR 472 Ca -0.42 -0.38 -0.20 0.00 0.77 0.00 0.00 66.41 66.17 1ry2 h THR 472 Cb 1.26 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 68.78 1ry2 h THR 472 CO 0.73 0.12 -1.00 -0.33 0.37 0.00 0.00 175.52 175.41 1ry2 h GLU 473 N 0.07 0.00 0.00 6.66 3.07 -1.95 -3.22 114.58 119.20 1ry2 h GLU 473 Ca 0.02 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.85 1ry2 h GLU 473 Cb 0.18 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.09 1ry2 h GLU 473 CO 0.01 0.91 -0.13 0.66 -1.40 0.00 0.00 179.01 179.06 1ry2 h SER 474 N 0.00 0.00 0.00 1.42 4.64 -1.61 0.90 113.55 118.91 1ry2 h SER 474 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1ry2 h SER 474 Cb 1.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.84 1ry2 h SER 474 CO 0.12 0.13 0.00 0.61 -0.87 0.00 0.00 176.83 176.82 1ry2 n GLY 475 N 0.20 1.11 3.23 -0.77 0.00 -1.03 -3.90 105.19 104.03 1ry2 n GLY 475 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.89 1ry2 n GLY 475 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ry2 s SER 476 N 0.00 0.50 0.07 1.61 1.04 -1.26 -4.81 113.70 110.85 1ry2 s SER 476 Ca 0.00 -1.45 -0.37 0.00 0.48 0.00 0.00 55.95 54.61 1ry2 s SER 476 Cb 0.00 0.39 -0.18 0.00 0.10 0.00 0.00 66.02 66.33 1ry2 s SER 476 CO 0.00 -0.86 1.12 1.41 0.98 0.00 0.00 173.24 175.89 1ry2 n HIS 477 N -0.35 0.92 -0.02 5.02 -0.00 -1.26 -4.66 115.22 114.88 1ry2 n HIS 477 Ca 0.03 0.86 -0.01 0.00 -0.00 0.00 0.00 57.72 58.60 1ry2 n HIS 477 Cb 0.65 -2.18 -0.00 0.00 -0.00 0.00 0.00 29.99 28.46 1ry2 n HIS 477 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 1ry2 h LEU 478 N 3.38 0.00 -7.93 2.41 5.85 0.35 -3.43 115.31 115.93 1ry2 h LEU 478 Ca -0.47 0.00 -0.51 0.00 0.84 0.00 0.00 57.88 57.74 1ry2 h LEU 478 Cb 1.39 0.00 -0.34 0.00 0.37 0.00 0.00 40.66 42.08 1ry2 h LEU 478 CO 0.69 0.18 -0.81 0.68 -0.34 0.00 0.00 178.44 178.84 1ry2 s VAL 479 N -1.30 1.09 0.17 1.05 -7.23 -0.89 -0.43 120.40 112.86 1ry2 s VAL 479 Ca -0.03 -0.44 -0.20 0.00 -1.81 0.00 0.00 61.98 59.50 1ry2 s VAL 479 Cb 0.00 -1.02 0.05 0.00 0.56 0.00 0.00 36.38 35.98 1ry2 s VAL 479 CO 0.05 0.35 0.55 0.28 -0.31 0.00 0.00 175.10 176.02 1ry2 s THR 480 N 0.82 0.02 0.44 5.32 -1.32 0.27 -1.39 115.64 119.79 1ry2 s THR 480 Ca -0.12 -0.36 -0.15 0.00 -1.21 0.00 0.00 61.69 59.85 1ry2 s THR 480 Cb -0.15 -1.23 -0.08 0.00 -1.51 0.00 0.00 72.50 69.53 1ry2 s THR 480 CO 0.02 -0.09 0.88 -2.84 -2.21 0.00 0.00 174.62 170.38 1ry2 s PRO 481 N -3.80 3.96 -0.16 7.08 0.02 -1.12 -3.47 135.00 137.50 1ry2 s PRO 481 Ca 0.04 0.81 -0.13 0.00 0.02 0.00 0.00 61.00 61.73 1ry2 s PRO 481 Cb -0.01 -2.26 -0.05 0.00 0.02 0.00 0.00 34.50 32.21 1ry2 s PRO 481 CO -0.09 -0.11 0.28 -0.51 -0.33 0.00 0.00 177.00 176.24 1ry2 s LEU 482 N -3.71 4.24 0.64 -5.54 1.43 -1.26 -4.79 118.68 109.69 1ry2 s LEU 482 Ca 0.57 0.49 0.19 0.00 -1.03 0.00 0.00 54.13 54.34 1ry2 s LEU 482 Cb -0.10 -2.35 0.94 0.00 0.03 0.00 0.00 46.19 44.71 1ry2 s LEU 482 CO 0.26 0.11 1.50 0.00 0.23 0.00 0.00 176.35 178.45 1ry2 h ALA 483 N 6.67 2.01 0.00 4.21 0.00 -1.08 -3.28 119.26 127.78 1ry2 h ALA 483 Ca -0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1ry2 h ALA 483 Cb 1.16 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1ry2 h ALA 483 CO 0.76 -0.89 0.00 0.41 0.00 0.00 0.00 179.25 179.53 1ry2 n GLY 484 N -1.46 -0.01 0.33 0.00 0.00 -1.26 -4.82 105.19 97.97 1ry2 n GLY 484 Ca 0.05 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.23 1ry2 n GLY 484 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ry2 h GLY 485 N 0.00 1.74 -7.37 -0.02 0.00 -1.87 -3.35 103.07 92.20 1ry2 h GLY 485 Ca 0.00 -0.25 -0.68 0.00 0.00 0.00 0.00 47.33 46.40 1ry2 h GLY 485 CO 0.00 -0.24 -0.21 -1.34 0.00 0.00 0.00 176.54 174.75 1ry2 s VAL 486 N -5.83 5.10 0.11 4.60 -7.23 -1.24 -4.69 120.40 111.23 1ry2 s VAL 486 Ca -0.11 -0.14 -0.15 0.00 -1.81 0.00 0.00 61.98 59.77 1ry2 s VAL 486 Cb 0.26 -3.97 -0.05 0.00 0.56 0.00 0.00 36.38 33.18 1ry2 s VAL 486 CO 0.79 -0.30 1.49 0.74 -0.31 0.00 0.00 175.10 177.51 1ry2 h THR 487 N 5.66 1.29 -2.72 5.32 2.02 -1.89 -3.43 112.91 119.15 1ry2 h THR 487 Ca -0.28 -1.27 -0.44 0.00 0.77 0.00 0.00 66.41 65.19 1ry2 h THR 487 Cb 1.12 1.37 0.05 0.00 -1.74 0.00 0.00 68.15 68.96 1ry2 h THR 487 CO 0.76 0.42 0.01 -2.84 0.37 0.00 0.00 175.52 174.24 1ry2 s PRO 488 N -4.63 2.48 -0.25 6.66 0.02 -1.26 -5.12 135.00 132.89 1ry2 s PRO 488 Ca -0.13 -0.70 -0.21 0.00 0.02 0.00 0.00 61.00 59.99 1ry2 s PRO 488 Cb 0.09 -2.43 0.07 0.00 0.02 0.00 0.00 34.50 32.25 1ry2 s PRO 488 CO 0.82 -0.81 0.67 -1.64 -0.33 0.00 0.00 177.00 175.70 1ry2 s MET 489 N -4.85 0.75 -0.28 5.54 -1.94 -1.26 -4.99 119.30 112.28 1ry2 s MET 489 Ca 0.58 0.99 0.03 0.00 -1.71 0.00 0.00 55.69 55.58 1ry2 s MET 489 Cb -0.10 0.32 0.07 0.00 2.01 0.00 0.00 34.83 37.12 1ry2 s MET 489 CO 0.39 -0.11 -0.07 0.15 -0.01 0.00 0.00 175.02 175.38 1ry2 s LYS 490 N 0.66 2.04 0.09 2.03 1.02 -1.26 -5.03 119.74 119.29 1ry2 s LYS 490 Ca -0.02 -1.46 0.07 0.00 0.02 0.00 0.00 55.97 54.58 1ry2 s LYS 490 Cb -0.05 -2.95 0.28 0.00 -0.52 0.00 0.00 37.83 34.59 1ry2 s LYS 490 CO -0.04 -0.66 0.28 -2.30 -0.92 0.00 0.00 175.35 171.71 1ry2 n PRO 491 N 4.40 -0.00 -0.08 -1.68 -0.02 -1.26 0.19 135.00 136.55 1ry2 n PRO 491 Ca -0.10 0.21 0.06 0.00 -2.02 0.00 0.00 63.50 61.65 1ry2 n PRO 491 Cb 0.42 -0.44 0.09 0.00 -0.02 0.00 0.00 33.50 33.55 1ry2 n PRO 491 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ry2 n GLY 492 N -1.12 0.96 3.87 -1.23 0.00 -1.26 -4.63 105.19 101.77 1ry2 n GLY 492 Ca 0.07 -0.36 -0.22 0.00 0.00 0.00 0.00 46.02 45.51 1ry2 n GLY 492 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ry2 s SER 493 N -0.98 5.78 -0.17 1.61 0.15 0.51 -4.48 113.70 116.11 1ry2 s SER 493 Ca 0.18 -0.14 0.17 0.00 0.70 0.00 0.00 55.95 56.86 1ry2 s SER 493 Cb 0.11 -1.56 0.52 0.00 -1.71 0.00 0.00 66.02 63.38 1ry2 s SER 493 CO 0.15 -0.04 1.41 0.00 1.20 0.00 0.00 173.24 175.97 1ry2 n ALA 494 N -1.17 2.95 -1.00 5.45 0.00 -0.89 -4.72 120.51 121.13 1ry2 n ALA 494 Ca -0.08 -2.27 0.00 0.00 0.00 0.00 0.00 53.44 51.09 1ry2 n ALA 494 Cb 0.57 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 19.32 1ry2 n ALA 494 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1ry2 n SER 495 N -0.48 0.00 -4.44 0.00 7.64 -1.26 -2.17 113.62 112.91 1ry2 n SER 495 Ca 0.21 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.83 1ry2 n SER 495 Cb 0.87 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.96 1ry2 n SER 495 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1ry2 s PHE 496 N 0.00 2.30 0.33 1.43 0.40 -1.23 -1.49 117.98 119.73 1ry2 s PHE 496 Ca 0.00 -0.35 -0.29 0.00 -0.60 0.00 0.00 56.93 55.70 1ry2 s PHE 496 Cb 0.00 -1.09 -0.12 0.00 0.51 0.00 0.00 43.02 42.32 1ry2 s PHE 496 CO 0.00 0.58 1.45 -2.30 0.70 0.00 0.00 175.22 175.65 1ry2 n PRO 497 N -0.05 2.47 -1.17 0.24 -0.02 -1.26 -0.57 135.00 134.64 1ry2 n PRO 497 Ca -0.10 0.87 -0.29 0.00 -2.02 0.00 0.00 63.50 61.96 1ry2 n PRO 497 Cb 0.57 -2.57 0.17 0.00 -0.02 0.00 0.00 33.50 31.65 1ry2 n PRO 497 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1ry2 s PHE 498 N -0.74 2.14 0.14 6.00 5.36 0.43 -4.80 117.98 126.51 1ry2 s PHE 498 Ca 0.58 1.07 -0.31 0.00 -0.96 0.00 0.00 56.93 57.30 1ry2 s PHE 498 Cb -0.52 -3.23 -0.10 0.00 -0.34 0.00 0.00 43.02 38.82 1ry2 s PHE 498 CO 0.58 -2.78 1.68 -0.06 -1.46 0.00 0.00 175.22 173.18 1ry2 s PHE 499 N -2.95 2.67 0.00 10.12 0.08 -1.26 -2.06 117.98 124.59 1ry2 s PHE 499 Ca 0.65 0.35 0.00 0.00 0.12 0.00 0.00 56.93 58.05 1ry2 s PHE 499 Cb -0.19 -4.03 0.00 0.00 -0.57 0.00 0.00 43.02 38.23 1ry2 s PHE 499 CO 0.58 -4.02 0.00 0.41 -0.10 0.00 0.00 175.22 172.09 1ry2 n GLY 500 N 3.96 2.81 3.64 4.36 0.00 -1.26 -5.04 105.19 113.66 1ry2 n GLY 500 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1ry2 n GLY 500 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ry2 s ILE 501 N -2.67 5.17 -0.68 -0.61 1.09 -0.87 -4.66 121.20 117.97 1ry2 s ILE 501 Ca 0.00 0.68 -0.07 0.00 -1.10 0.00 0.00 60.65 60.16 1ry2 s ILE 501 Cb 0.00 -3.73 0.18 0.00 -1.06 0.00 0.00 42.46 37.85 1ry2 s ILE 501 CO 0.00 0.19 0.54 -0.62 -0.10 0.00 0.00 174.94 174.96 1ry2 s ASP 502 N 1.32 5.76 -0.01 3.58 3.68 -1.26 -4.63 116.67 125.11 1ry2 s ASP 502 Ca 0.18 -2.74 -0.27 0.00 2.13 0.00 0.00 52.55 51.85 1ry2 s ASP 502 Cb -0.15 -1.98 -0.04 0.00 -1.45 0.00 0.00 42.92 39.30 1ry2 s ASP 502 CO 0.09 -0.45 0.84 0.00 0.13 0.00 0.00 175.17 175.77 1ry2 s ALA 503 N 0.10 3.26 0.06 3.66 0.00 -1.26 -0.88 121.76 126.70 1ry2 s ALA 503 Ca 0.17 0.35 -0.00 0.00 0.00 0.00 0.00 51.96 52.47 1ry2 s ALA 503 Cb -0.17 -3.14 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 1ry2 s ALA 503 CO -0.05 -0.12 -0.04 0.14 0.00 0.00 0.00 175.76 175.69 1ry2 s VAL 504 N 0.71 0.35 -0.20 0.00 -7.23 -0.30 -4.99 120.40 108.73 1ry2 s VAL 504 Ca 0.44 -1.81 -0.05 0.00 -1.81 0.00 0.00 61.98 58.75 1ry2 s VAL 504 Cb -0.20 -1.52 -0.02 0.00 0.56 0.00 0.00 36.38 35.19 1ry2 s VAL 504 CO 0.24 -0.95 -0.00 -0.69 -0.31 0.00 0.00 175.10 173.39 1ry2 s VAL 505 N -3.75 3.90 0.33 1.32 1.01 -1.26 -1.91 120.40 120.04 1ry2 s VAL 505 Ca 0.08 -0.33 0.08 0.00 0.00 0.00 0.00 61.98 61.80 1ry2 s VAL 505 Cb 0.07 -2.77 -0.03 0.00 0.00 0.00 0.00 36.38 33.65 1ry2 s VAL 505 CO -0.08 0.42 0.25 -0.76 0.00 0.00 0.00 175.10 174.93 1ry2 s LEU 506 N 1.09 3.54 -0.27 3.92 1.43 0.58 -0.01 118.68 128.95 1ry2 s LEU 506 Ca 0.02 -0.54 -0.23 0.00 -1.03 0.00 0.00 54.13 52.36 1ry2 s LEU 506 Cb -0.14 -2.11 -0.01 0.00 0.03 0.00 0.00 46.19 43.95 1ry2 s LEU 506 CO 0.01 -0.31 0.74 -0.62 0.23 0.00 0.00 176.35 176.40 1ry2 s ASP 507 N -3.95 6.68 0.54 2.29 3.68 -0.97 -1.40 116.67 123.55 1ry2 s ASP 507 Ca 0.39 0.79 0.24 0.00 2.13 0.00 0.00 52.55 56.10 1ry2 s ASP 507 Cb -0.05 -2.39 1.52 0.00 -1.45 0.00 0.00 42.92 40.55 1ry2 s ASP 507 CO 0.25 -0.49 2.17 1.55 0.13 0.00 0.00 175.17 178.79 1ry2 h PRO 508 N 7.90 0.00 0.00 4.34 0.13 -1.93 -3.37 132.00 139.07 1ry2 h PRO 508 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1ry2 h PRO 508 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1ry2 h PRO 508 CO 0.84 0.04 0.00 0.09 -0.23 0.00 0.00 178.00 178.73 1ry2 n ASN 509 N -4.08 0.00 -4.57 1.44 3.02 -1.26 -4.82 115.26 105.00 1ry2 n ASN 509 Ca -0.03 0.05 -0.33 0.00 -0.03 0.00 0.00 54.58 54.24 1ry2 n ASN 509 Cb 0.12 -0.19 -0.04 0.00 -0.61 0.00 0.00 39.78 39.07 1ry2 n ASN 509 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1ry2 s THR 510 N -0.37 3.68 0.02 3.41 2.01 -1.26 -4.90 115.64 118.23 1ry2 s THR 510 Ca 0.00 -0.84 0.00 0.00 0.31 0.00 0.00 61.69 61.16 1ry2 s THR 510 Cb 0.00 -4.57 0.00 0.00 0.01 0.00 0.00 72.50 67.94 1ry2 s THR 510 CO 0.00 -1.35 0.00 0.61 -0.69 0.00 0.00 174.62 173.19 1ry2 n GLY 511 N 6.37 -0.37 2.34 4.40 0.00 -1.26 -3.78 105.19 112.89 1ry2 n GLY 511 Ca 0.41 -0.34 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 1ry2 n GLY 511 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1ry2 n GLU 512 N -0.90 3.50 -2.85 1.61 -0.00 -1.26 -4.00 120.64 116.74 1ry2 n GLU 512 Ca 0.00 -2.44 -0.41 0.00 -0.00 0.00 0.00 57.16 54.31 1ry2 n GLU 512 Cb 0.05 -2.50 -0.04 0.00 -0.00 0.00 0.00 31.44 28.95 1ry2 n GLU 512 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 1ry2 s GLU 513 N 0.24 4.48 -0.30 3.44 2.02 -1.25 -4.91 118.70 122.43 1ry2 s GLU 513 Ca 0.62 1.18 -0.29 0.00 0.02 0.00 0.00 54.97 56.50 1ry2 s GLU 513 Cb 0.24 -3.47 0.01 0.00 0.10 0.00 0.00 34.13 31.00 1ry2 s GLU 513 CO -0.09 -0.05 1.19 -0.51 0.02 0.00 0.00 175.26 175.82 1ry2 s LEU 514 N 1.11 3.93 -0.19 1.80 1.43 -1.26 -2.29 118.68 123.22 1ry2 s LEU 514 Ca 0.45 1.18 -0.27 0.00 -1.03 0.00 0.00 54.13 54.46 1ry2 s LEU 514 Cb -0.19 -3.54 -0.01 0.00 0.03 0.00 0.00 46.19 42.48 1ry2 s LEU 514 CO 0.22 -0.96 0.92 0.20 0.23 0.00 0.00 176.35 176.96 1ry2 s ASN 515 N 2.18 7.02 -0.16 2.29 0.02 0.98 -4.95 114.94 122.33 1ry2 s ASN 515 Ca 0.51 1.26 -0.12 0.00 -1.02 0.00 0.00 52.86 53.49 1ry2 s ASN 515 Cb -0.15 -2.49 -0.05 0.00 0.02 0.00 0.00 41.25 38.58 1ry2 s ASN 515 CO 0.19 -0.51 -0.22 1.07 0.02 0.00 0.00 177.10 177.65 1ry2 n THR 516 N 4.97 1.45 -1.02 1.60 5.66 -1.26 -4.46 114.28 121.22 1ry2 n THR 516 Ca 0.07 0.18 -0.32 0.00 -3.05 0.00 0.00 64.05 60.93 1ry2 n THR 516 Cb 0.48 -2.36 0.13 0.00 -1.55 0.00 0.00 70.33 67.03 1ry2 n THR 516 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1ry2 s SER 517 N -5.86 3.67 -0.59 1.09 1.04 -1.26 -4.80 113.70 106.99 1ry2 s SER 517 Ca -0.20 2.11 -0.35 0.00 0.48 0.00 0.00 55.95 57.99 1ry2 s SER 517 Cb 0.03 -2.56 -0.16 0.00 0.10 0.00 0.00 66.02 63.43 1ry2 s SER 517 CO 0.30 -2.60 2.35 1.57 0.98 0.00 0.00 173.24 175.84 1ry2 n HIS 518 N -3.70 1.17 -3.61 5.02 -0.00 -1.26 -4.86 115.22 107.97 1ry2 n HIS 518 Ca 0.11 0.42 -0.09 0.00 -0.00 0.00 0.00 57.72 58.16 1ry2 n HIS 518 Cb 0.52 -2.44 -0.02 0.00 -0.00 0.00 0.00 29.99 28.05 1ry2 n HIS 518 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1ry2 s ALA 519 N 8.04 -1.49 -0.10 1.57 0.00 -1.26 -5.02 121.76 123.50 1ry2 s ALA 519 Ca 1.18 0.22 -0.04 0.00 0.00 0.00 0.00 51.96 53.33 1ry2 s ALA 519 Cb -1.06 0.82 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 1ry2 s ALA 519 CO 0.51 -0.88 0.05 -1.83 0.00 0.00 0.00 175.76 173.61 1ry2 s GLU 520 N -3.73 3.20 0.02 0.00 -1.05 -1.26 -3.71 118.70 112.18 1ry2 s GLU 520 Ca 0.06 -0.32 -0.05 0.00 -0.15 0.00 0.00 54.97 54.51 1ry2 s GLU 520 Cb -0.03 -2.95 0.02 0.00 -0.44 0.00 0.00 34.13 30.73 1ry2 s GLU 520 CO -0.05 0.69 0.22 0.41 0.95 0.00 0.00 175.26 177.49 1ry2 n GLY 521 N 2.20 0.96 3.75 -3.83 0.00 0.21 -4.95 105.19 103.53 1ry2 n GLY 521 Ca -0.19 -0.94 -0.41 0.00 0.00 0.00 0.00 46.02 44.49 1ry2 n GLY 521 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ry2 s VAL 522 N -2.36 3.64 0.19 1.61 1.01 -0.49 0.19 120.40 124.19 1ry2 s VAL 522 Ca 0.05 1.52 -0.16 0.00 0.00 0.00 0.00 61.98 63.39 1ry2 s VAL 522 Cb -0.00 -3.97 -0.08 0.00 0.00 0.00 0.00 36.38 32.33 1ry2 s VAL 522 CO 0.01 0.31 0.63 -0.22 0.00 0.00 0.00 175.10 175.82 1ry2 s LEU 523 N -0.87 4.31 0.25 3.92 2.96 0.07 -0.31 118.68 129.02 1ry2 s LEU 523 Ca 0.47 1.21 -0.20 0.00 -0.22 0.00 0.00 54.13 55.40 1ry2 s LEU 523 Cb -0.31 -3.46 0.02 0.00 0.50 0.00 0.00 46.19 42.95 1ry2 s LEU 523 CO 0.38 0.05 0.66 0.00 -1.32 0.00 0.00 176.35 176.12 1ry2 s ALA 524 N -1.54 -1.13 -0.03 5.97 0.00 -0.80 -3.03 121.76 121.21 1ry2 s ALA 524 Ca 0.41 -0.27 0.06 0.00 0.00 0.00 0.00 51.96 52.17 1ry2 s ALA 524 Cb -0.15 0.88 -0.01 0.00 0.00 0.00 0.00 23.12 23.83 1ry2 s ALA 524 CO 0.20 -0.97 -0.21 0.08 0.00 0.00 0.00 175.76 174.86 1ry2 s VAL 525 N -3.91 1.71 0.06 0.00 1.01 -1.10 -1.15 120.40 117.03 1ry2 s VAL 525 Ca 0.11 -0.91 -0.13 0.00 0.00 0.00 0.00 61.98 61.05 1ry2 s VAL 525 Cb -0.04 -1.43 -0.29 0.00 0.00 0.00 0.00 36.38 34.61 1ry2 s VAL 525 CO 0.04 0.48 1.11 0.11 0.00 0.00 0.00 175.10 176.85 1ry2 h LYS 526 N 5.80 0.56 -5.69 2.72 1.57 -1.34 0.11 116.57 120.30 1ry2 h LYS 526 Ca -0.37 -0.77 -0.49 0.00 -1.87 0.00 0.00 60.65 57.15 1ry2 h LYS 526 Cb 1.15 0.26 -0.14 0.00 0.08 0.00 0.00 32.23 33.58 1ry2 h LYS 526 CO 0.48 1.35 -0.73 0.00 -0.57 0.00 0.00 179.45 179.97 1ry2 s ALA 527 N -2.93 2.21 0.67 3.86 0.00 -1.26 -4.63 121.76 119.68 1ry2 s ALA 527 Ca -0.08 -1.74 -0.08 0.00 0.00 0.00 0.00 51.96 50.06 1ry2 s ALA 527 Cb 0.06 -0.09 0.03 0.00 0.00 0.00 0.00 23.12 23.12 1ry2 s ALA 527 CO 0.92 0.10 1.00 0.00 0.00 0.00 0.00 175.76 177.78 1ry2 s ALA 528 N -2.88 3.12 0.36 0.00 0.00 -1.16 -4.61 121.76 116.59 1ry2 s ALA 528 Ca 0.25 -0.69 0.04 0.00 0.00 0.00 0.00 51.96 51.55 1ry2 s ALA 528 Cb -0.01 -2.72 -0.03 0.00 0.00 0.00 0.00 23.12 20.36 1ry2 s ALA 528 CO 0.09 -1.10 0.13 1.67 0.00 0.00 0.00 175.76 176.55 1ry2 s TRP 529 N -3.20 1.76 0.16 0.00 -2.14 -1.26 -4.45 118.94 109.80 1ry2 s TRP 529 Ca 0.57 -1.27 -0.11 0.00 2.66 0.00 0.00 56.10 57.96 1ry2 s TRP 529 Cb -0.11 -1.08 0.01 0.00 -3.10 0.00 0.00 33.47 29.20 1ry2 s TRP 529 CO 0.47 -0.33 1.56 -1.00 -2.66 0.00 0.00 176.95 174.99 1ry2 h PRO 530 N 1.98 0.97 0.00 3.25 0.13 -1.95 -3.20 132.00 133.17 1ry2 h PRO 530 Ca -0.35 -0.38 0.00 0.00 -0.87 0.00 0.00 66.00 64.39 1ry2 h PRO 530 Cb 1.26 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1ry2 h PRO 530 CO 0.57 1.05 0.00 0.43 -0.23 0.00 0.00 178.00 179.82 1ry2 n SER 531 N -4.18 0.00 -4.71 1.44 7.64 -1.18 -3.80 113.62 108.84 1ry2 n SER 531 Ca 0.00 -1.36 -0.42 0.00 1.01 0.00 0.00 58.87 58.10 1ry2 n SER 531 Cb 0.41 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.58 1ry2 n SER 531 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1ry2 s PHE 532 N -2.00 3.48 0.32 1.43 5.36 -1.21 -3.41 117.98 121.96 1ry2 s PHE 532 Ca 0.14 1.39 -0.27 0.00 -0.96 0.00 0.00 56.93 57.23 1ry2 s PHE 532 Cb 0.06 -3.35 -0.13 0.00 -0.34 0.00 0.00 43.02 39.26 1ry2 s PHE 532 CO 0.11 -1.00 0.90 0.00 -1.46 0.00 0.00 175.22 173.77 1ry2 n ALA 533 N 3.94 -0.56 0.09 11.12 0.00 0.31 -4.74 120.51 130.67 1ry2 n ALA 533 Ca 0.08 0.33 0.08 0.00 0.00 0.00 0.00 53.44 53.94 1ry2 n ALA 533 Cb 0.47 -1.96 -0.02 0.00 0.00 0.00 0.00 19.45 17.95 1ry2 n ALA 533 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ry2 h ARG 534 N 1.65 0.00 0.00 0.00 2.47 -1.25 -3.49 114.38 113.76 1ry2 h ARG 534 Ca -0.40 0.00 0.03 0.00 -1.26 0.00 0.00 59.98 58.36 1ry2 h ARG 534 Cb 1.36 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.67 1ry2 h ARG 534 CO 0.58 0.08 0.09 -2.37 0.56 0.00 0.00 179.97 178.91 1ry2 n THR 535 N -2.75 0.00 -4.04 2.04 5.66 -1.22 -5.03 114.28 108.93 1ry2 n THR 535 Ca -0.02 -0.01 -0.31 0.00 -3.05 0.00 0.00 64.05 60.65 1ry2 n THR 535 Cb 0.63 0.05 -0.16 0.00 -1.55 0.00 0.00 70.33 69.30 1ry2 n THR 535 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 1ry2 s ILE 536 N -2.11 1.76 -0.30 1.09 1.01 -1.26 -1.36 121.20 120.01 1ry2 s ILE 536 Ca 0.03 -0.87 -0.28 0.00 0.00 0.00 0.00 60.65 59.53 1ry2 s ILE 536 Cb -0.00 -1.69 -0.12 0.00 0.01 0.00 0.00 42.46 40.66 1ry2 s ILE 536 CO -0.00 0.38 1.08 1.87 0.00 0.00 0.00 174.94 178.27 1ry2 n TRP 537 N 4.69 0.95 -0.80 3.97 -0.00 0.71 -1.47 117.44 125.49 1ry2 n TRP 537 Ca -0.17 0.62 0.00 0.00 -0.00 0.00 0.00 57.50 57.95 1ry2 n TRP 537 Cb 0.49 -1.37 0.00 0.00 -0.00 0.00 0.00 31.31 30.43 1ry2 n TRP 537 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 1ry2 n LYS 538 N 3.15 -0.61 -3.09 5.87 4.76 -1.26 -4.78 118.16 122.19 1ry2 n LYS 538 Ca 0.24 0.15 -0.03 0.00 -2.87 0.00 0.00 58.31 55.80 1ry2 n LYS 538 Cb -0.03 -4.12 -0.01 0.00 -1.84 0.00 0.00 35.03 29.02 1ry2 n LYS 538 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1ry2 s ASN 539 N -2.17 -1.17 0.00 4.39 2.20 -0.54 -4.96 114.94 112.69 1ry2 s ASN 539 Ca 0.00 -1.22 0.07 0.00 -0.94 0.00 0.00 52.86 50.77 1ry2 s ASN 539 Cb 0.00 1.74 0.35 0.00 -2.00 0.00 0.00 41.25 41.35 1ry2 s ASN 539 CO 0.00 -0.14 1.14 1.57 -2.94 0.00 0.00 177.10 176.73 1ry2 n HIS 540 N 3.89 0.00 -0.03 1.54 -0.00 -1.25 -2.72 115.22 116.65 1ry2 n HIS 540 Ca 0.14 0.00 -0.15 0.00 0.46 0.00 0.00 57.72 58.17 1ry2 n HIS 540 Cb 0.55 -0.35 -0.11 0.00 -0.12 0.00 0.00 29.99 29.96 1ry2 n HIS 540 CO 0.00 0.00 0.00 0.22 0.46 0.00 0.00 176.34 177.02 1ry2 h ASP 541 N 0.00 0.21 -0.50 0.26 3.58 -1.93 -2.82 116.42 115.23 1ry2 h ASP 541 Ca 0.00 -0.74 -0.02 0.00 0.42 0.00 0.00 57.03 56.70 1ry2 h ASP 541 Cb 0.09 -0.06 -0.03 0.00 1.72 0.00 0.00 39.33 41.04 1ry2 h ASP 541 CO 0.00 0.92 0.26 -0.09 -2.88 0.00 0.00 179.24 177.45 1ry2 h ARG 542 N -0.47 0.74 0.02 0.28 2.43 -1.90 -2.38 114.38 113.11 1ry2 h ARG 542 Ca -0.02 -0.09 0.03 0.00 -0.81 0.00 0.00 59.98 59.09 1ry2 h ARG 542 Cb 0.94 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 30.31 1ry2 h ARG 542 CO 0.04 0.58 -0.22 -0.92 -1.51 0.00 0.00 179.97 177.94 1ry2 h TYR 543 N 0.75 -0.58 0.13 2.20 3.20 -1.62 -0.48 116.97 120.57 1ry2 h TYR 543 Ca 0.19 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.07 1ry2 h TYR 543 Cb 0.08 0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.60 1ry2 h TYR 543 CO 0.01 -0.31 -0.06 -0.07 -1.64 0.00 0.00 178.16 176.09 1ry2 h LEU 544 N -0.36 -0.15 -1.06 2.82 3.38 -1.18 -0.90 115.31 117.86 1ry2 h LEU 544 Ca 0.05 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1ry2 h LEU 544 Cb 0.43 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 41.16 1ry2 h LEU 544 CO -0.18 -0.06 0.64 0.44 0.09 0.00 0.00 178.44 179.37 1ry2 h ASP 545 N -0.22 1.10 0.01 -0.43 5.19 -1.38 0.67 116.42 121.36 1ry2 h ASP 545 Ca -0.02 -0.03 -0.12 0.00 -0.62 0.00 0.00 57.03 56.24 1ry2 h ASP 545 Cb 0.18 -0.27 0.01 0.00 0.18 0.00 0.00 39.33 39.43 1ry2 h ASP 545 CO 0.03 0.79 -0.49 0.74 -3.12 0.00 0.00 179.24 177.19 1ry2 h THR 546 N 1.29 1.48 0.00 0.35 2.02 -0.99 -3.33 112.91 113.73 1ry2 h THR 546 Ca 0.36 -2.08 -0.25 0.00 0.77 0.00 0.00 66.41 65.20 1ry2 h THR 546 Cb -0.13 2.73 -0.05 0.00 -1.74 0.00 0.00 68.15 68.96 1ry2 h THR 546 CO -0.08 0.59 -1.94 -1.22 0.37 0.00 0.00 175.52 173.24 1ry2 n TYR 547 N -4.31 0.00 0.12 3.16 4.01 -0.35 -4.75 117.16 115.03 1ry2 n TYR 547 Ca -0.10 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.66 1ry2 n TYR 547 Cb 0.63 -0.67 -0.03 0.00 -0.31 0.00 0.00 39.34 38.95 1ry2 n TYR 547 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1ry2 n LEU 548 N -2.52 0.12 0.00 7.72 4.77 -0.05 -1.81 117.00 125.22 1ry2 n LEU 548 Ca -0.23 -0.26 -0.05 0.00 -0.03 0.00 0.00 56.01 55.44 1ry2 n LEU 548 Cb 0.94 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.91 1ry2 n LEU 548 CO 0.28 0.03 -0.42 0.59 -1.33 0.00 0.00 177.39 176.54 1ry2 n ASN 549 N -1.38 0.87 0.09 -1.43 3.02 0.22 -3.76 115.26 112.88 1ry2 n ASN 549 Ca 0.00 0.40 0.05 0.00 -0.03 0.00 0.00 54.58 55.01 1ry2 n ASN 549 Cb 0.10 0.02 0.49 0.00 -0.61 0.00 0.00 39.78 39.79 1ry2 n ASN 549 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1ry2 h PRO 550 N 0.00 0.36 -2.16 3.52 0.13 -1.80 -3.31 132.00 128.74 1ry2 h PRO 550 Ca -0.23 -0.02 -0.56 0.00 -0.87 0.00 0.00 66.00 64.31 1ry2 h PRO 550 Cb 1.83 -0.08 -0.37 0.00 0.13 0.00 0.00 31.00 32.51 1ry2 h PRO 550 CO 0.07 0.24 -1.01 0.66 -0.23 0.00 0.00 178.00 177.73 1ry2 n TYR 551 N -4.49 -0.85 -1.40 1.56 4.01 -1.26 -5.06 117.16 109.66 1ry2 n TYR 551 Ca 0.01 -3.32 -0.55 0.00 -0.16 0.00 0.00 57.90 53.88 1ry2 n TYR 551 Cb 0.07 0.10 -0.08 0.00 -0.31 0.00 0.00 39.34 39.13 1ry2 n TYR 551 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1ry2 n PRO 552 N 2.31 0.00 0.00 -0.72 -0.02 -1.25 -2.12 135.00 133.21 1ry2 n PRO 552 Ca 0.26 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 1ry2 n PRO 552 Cb 0.50 -1.35 0.00 0.00 -0.02 0.00 0.00 33.50 32.63 1ry2 n PRO 552 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ry2 n GLY 553 N 1.80 2.62 2.72 -1.23 0.00 -1.26 -5.00 105.19 104.85 1ry2 n GLY 553 Ca 0.20 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 1ry2 n GLY 553 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ry2 n TYR 554 N -0.00 0.34 -4.26 1.61 4.02 -0.90 -4.80 117.16 113.18 1ry2 n TYR 554 Ca 0.00 -1.81 -0.34 0.00 -0.01 0.00 0.00 57.90 55.74 1ry2 n TYR 554 Cb 0.00 -0.27 -0.12 0.00 -0.02 0.00 0.00 39.34 38.93 1ry2 n TYR 554 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 1ry2 s TYR 555 N -2.25 3.06 -0.63 -0.72 5.04 0.03 -4.69 117.35 117.19 1ry2 s TYR 555 Ca 0.07 -0.28 -0.22 0.00 -2.44 0.00 0.00 57.07 54.20 1ry2 s TYR 555 Cb -0.01 -2.01 0.08 0.00 0.35 0.00 0.00 41.96 40.37 1ry2 s TYR 555 CO 0.04 -0.06 0.88 0.12 -1.34 0.00 0.00 175.55 175.20 1ry2 s PHE 556 N 0.52 2.78 0.33 4.97 5.36 -0.75 -2.69 117.98 128.50 1ry2 s PHE 556 Ca -0.02 -0.63 0.02 0.00 -0.96 0.00 0.00 56.93 55.35 1ry2 s PHE 556 Cb -0.14 -4.18 0.57 0.00 -0.34 0.00 0.00 43.02 38.93 1ry2 s PHE 556 CO 0.02 -1.52 1.90 1.79 -1.46 0.00 0.00 175.22 175.96 1ry2 h THR 557 N 5.96 1.19 0.00 0.12 1.35 -1.88 -3.45 112.91 116.20 1ry2 h THR 557 Ca -0.29 -0.64 0.00 0.00 -0.55 0.00 0.00 66.41 64.94 1ry2 h THR 557 Cb 1.08 0.67 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 1ry2 h THR 557 CO 1.15 0.24 0.00 0.61 -0.25 0.00 0.00 175.52 177.27 1ry2 n GLY 558 N -1.04 0.30 3.65 5.82 0.00 -1.26 -5.07 105.19 107.58 1ry2 n GLY 558 Ca 0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.81 1ry2 n GLY 558 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ry2 s ASP 559 N -2.59 4.28 0.18 1.61 1.11 -1.26 -3.08 116.67 116.92 1ry2 s ASP 559 Ca 0.00 -0.94 0.06 0.00 0.18 0.00 0.00 52.55 51.85 1ry2 s ASP 559 Cb 0.00 -0.58 -0.04 0.00 1.07 0.00 0.00 42.92 43.37 1ry2 s ASP 559 CO 0.00 -0.24 0.11 -0.83 1.18 0.00 0.00 175.17 175.39 1ry2 s GLY 560 N -3.74 1.69 0.26 0.21 0.00 -1.26 -0.75 107.32 103.73 1ry2 s GLY 560 Ca 0.35 -1.28 -0.11 0.00 0.00 0.00 0.00 44.72 43.68 1ry2 s GLY 560 CO 0.20 -1.29 0.57 0.00 0.00 0.00 0.00 173.10 172.58 1ry2 n ALA 561 N -0.39 -1.31 -3.61 3.20 0.00 0.51 0.07 120.51 118.98 1ry2 n ALA 561 Ca -0.08 -0.87 -0.10 0.00 0.00 0.00 0.00 53.44 52.38 1ry2 n ALA 561 Cb 0.55 0.67 -0.06 0.00 0.00 0.00 0.00 19.45 20.61 1ry2 n ALA 561 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ry2 s ALA 562 N -1.75 -1.94 -0.21 0.00 0.00 -1.00 0.63 121.76 117.50 1ry2 s ALA 562 Ca 0.12 1.74 -0.08 0.00 0.00 0.00 0.00 51.96 53.73 1ry2 s ALA 562 Cb -0.03 -1.07 -0.04 0.00 0.00 0.00 0.00 23.12 21.98 1ry2 s ALA 562 CO 0.08 -0.28 0.09 0.15 0.00 0.00 0.00 175.76 175.80 1ry2 s LYS 563 N -0.36 3.92 0.99 0.00 1.02 -1.24 -1.16 119.74 122.92 1ry2 s LYS 563 Ca 0.00 -0.36 -0.15 0.00 0.02 0.00 0.00 55.97 55.48 1ry2 s LYS 563 Cb -0.03 -3.32 0.19 0.00 -0.52 0.00 0.00 37.83 34.15 1ry2 s LYS 563 CO -0.02 0.12 1.20 0.16 -0.92 0.00 0.00 175.35 175.88 1ry2 s ASP 564 N 0.82 2.82 0.30 2.83 1.47 -0.70 -4.06 116.67 120.15 1ry2 s ASP 564 Ca 0.05 0.64 0.05 0.00 1.18 0.00 0.00 52.55 54.47 1ry2 s ASP 564 Cb -0.13 -0.95 0.81 0.00 -0.34 0.00 0.00 42.92 42.30 1ry2 s ASP 564 CO 0.02 -2.95 1.65 0.11 0.68 0.00 0.00 175.17 174.69 1ry2 h LYS 565 N -1.78 0.24 -0.07 2.11 1.57 -1.97 0.35 116.57 117.02 1ry2 h LYS 565 Ca -0.47 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1ry2 h LYS 565 Cb 1.29 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.55 1ry2 h LYS 565 CO 0.48 0.16 0.00 -0.25 -0.57 0.00 0.00 179.45 179.27 1ry2 n ASP 566 N -5.17 0.49 0.00 0.86 8.00 -1.26 -4.92 116.55 114.55 1ry2 n ASP 566 Ca 0.24 -1.76 0.00 0.00 0.71 0.00 0.00 54.79 53.98 1ry2 n ASP 566 Cb 0.76 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.81 1ry2 n ASP 566 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ry2 n GLY 567 N 0.76 3.14 3.48 0.44 0.00 0.12 -5.04 105.19 108.09 1ry2 n GLY 567 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 1ry2 n GLY 567 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ry2 n TYR 568 N -2.00 -0.74 -4.78 1.61 4.02 -1.26 -4.56 117.16 109.45 1ry2 n TYR 568 Ca 0.00 0.33 -0.33 0.00 -0.01 0.00 0.00 57.90 57.89 1ry2 n TYR 568 Cb 0.00 -1.91 -0.13 0.00 -0.02 0.00 0.00 39.34 37.28 1ry2 n TYR 568 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1ry2 s ILE 569 N -2.03 3.18 -0.19 -0.72 1.01 -0.56 -1.72 121.20 120.17 1ry2 s ILE 569 Ca 0.64 -0.64 -0.01 0.00 0.00 0.00 0.00 60.65 60.64 1ry2 s ILE 569 Cb -0.31 -2.31 0.01 0.00 0.01 0.00 0.00 42.46 39.86 1ry2 s ILE 569 CO 0.59 0.55 -0.15 0.26 0.00 0.00 0.00 174.94 176.20 1ry2 s TRP 570 N -0.14 2.84 -0.15 3.97 0.52 -0.31 -2.10 118.94 123.57 1ry2 s TRP 570 Ca -0.00 -1.39 -0.29 0.00 0.02 0.00 0.00 56.10 54.43 1ry2 s TRP 570 Cb -0.13 -1.98 -0.01 0.00 -1.15 0.00 0.00 33.47 30.20 1ry2 s TRP 570 CO 0.03 -0.71 1.08 0.42 0.02 0.00 0.00 176.95 177.79 1ry2 s ILE 571 N 1.34 4.60 -2.00 2.03 -1.09 -1.26 -2.37 121.20 122.46 1ry2 s ILE 571 Ca 0.05 1.91 0.28 0.00 -2.23 0.00 0.00 60.65 60.66 1ry2 s ILE 571 Cb -0.13 -4.23 0.47 0.00 -1.58 0.00 0.00 42.46 36.99 1ry2 s ILE 571 CO -0.09 -0.08 1.77 0.18 -1.23 0.00 0.00 174.94 175.48 1ry2 n LEU 572 N 5.73 0.94 -0.23 2.97 4.77 0.11 -4.86 117.00 126.44 1ry2 n LEU 572 Ca 0.11 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1ry2 n LEU 572 Cb 0.47 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1ry2 n LEU 572 CO 0.53 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.36 1ry2 n GLY 573 N 1.24 0.82 2.39 -0.72 0.00 -1.26 -1.76 105.19 105.90 1ry2 n GLY 573 Ca 0.16 -0.21 -0.03 0.00 0.00 0.00 0.00 46.02 45.94 1ry2 n GLY 573 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ry2 n ARG 574 N -0.23 -3.41 0.00 1.61 0.63 -1.26 -4.64 116.66 109.36 1ry2 n ARG 574 Ca 0.00 2.71 0.00 0.00 -0.92 0.00 0.00 57.85 59.64 1ry2 n ARG 574 Cb 0.17 -4.32 0.00 0.00 0.45 0.00 0.00 32.46 28.76 1ry2 n ARG 574 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 1ry2 n VAL 575 N 1.11 0.30 0.54 5.15 0.24 -1.18 -1.80 118.33 122.70 1ry2 n VAL 575 Ca -0.24 0.00 0.09 0.00 -2.04 0.00 0.00 64.34 62.15 1ry2 n VAL 575 Cb 0.37 -0.56 -0.13 0.00 -1.47 0.00 0.00 33.84 32.06 1ry2 n VAL 575 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1ry2 n ASP 576 N 0.59 0.73 -0.58 -1.34 8.00 -1.26 -4.06 116.55 118.63 1ry2 n ASP 576 Ca 0.00 -0.57 0.07 0.00 0.71 0.00 0.00 54.79 54.99 1ry2 n ASP 576 Cb 0.19 1.36 0.17 0.00 -0.02 0.00 0.00 41.12 42.83 1ry2 n ASP 576 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1ry2 n ASP 577 N -1.75 3.10 -4.69 -2.24 8.00 -0.74 -5.01 116.55 113.22 1ry2 n ASP 577 Ca 0.01 -2.52 -0.42 0.00 0.71 0.00 0.00 54.79 52.56 1ry2 n ASP 577 Cb 0.39 -0.34 -0.03 0.00 -0.02 0.00 0.00 41.12 41.12 1ry2 n ASP 577 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1ry2 s VAL 578 N -1.93 4.08 -0.46 2.53 -7.23 -1.26 -4.67 120.40 111.46 1ry2 s VAL 578 Ca 0.28 1.42 -0.22 0.00 -1.81 0.00 0.00 61.98 61.66 1ry2 s VAL 578 Cb 0.21 -3.91 0.03 0.00 0.56 0.00 0.00 36.38 33.27 1ry2 s VAL 578 CO 0.09 -0.01 0.73 0.54 -0.31 0.00 0.00 175.10 176.14 1ry2 s VAL 579 N 2.35 4.71 -0.73 1.32 0.11 -0.58 -4.70 120.40 122.88 1ry2 s VAL 579 Ca 0.58 0.18 -0.22 0.00 -2.93 0.00 0.00 61.98 59.59 1ry2 s VAL 579 Cb -0.27 -4.30 0.08 0.00 -1.53 0.00 0.00 36.38 30.37 1ry2 s VAL 579 CO 0.23 -0.73 1.03 0.21 -3.33 0.00 0.00 175.10 172.51 1ry2 s ASN 580 N 2.23 6.28 -0.43 3.54 2.47 -1.26 -0.73 114.94 127.04 1ry2 s ASN 580 Ca 0.25 -1.22 -0.17 0.00 0.42 0.00 0.00 52.86 52.14 1ry2 s ASN 580 Cb -0.14 -2.42 0.03 0.00 -1.45 0.00 0.00 41.25 37.26 1ry2 s ASN 580 CO 0.20 -1.38 0.43 -0.69 -3.72 0.00 0.00 177.10 171.94 1ry2 s VAL 581 N 3.86 5.11 -1.20 -5.21 1.01 -1.26 -3.68 120.40 119.04 1ry2 s VAL 581 Ca 0.26 -0.45 -0.09 0.00 0.00 0.00 0.00 61.98 61.70 1ry2 s VAL 581 Cb -0.13 -4.05 -0.02 0.00 0.00 0.00 0.00 36.38 32.18 1ry2 s VAL 581 CO 0.05 -0.44 0.77 -1.20 0.00 0.00 0.00 175.10 174.28 1ry2 n SER 582 N 5.55 -3.69 -3.48 3.32 7.64 -1.25 -3.20 113.62 118.51 1ry2 n SER 582 Ca -0.08 -0.87 -0.21 0.00 1.01 0.00 0.00 58.87 58.72 1ry2 n SER 582 Cb 0.47 -4.03 0.04 0.00 -1.01 0.00 0.00 64.21 59.68 1ry2 n SER 582 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ry2 n GLY 583 N -1.55 -1.11 0.00 0.23 0.00 -1.26 -4.94 105.19 96.56 1ry2 n GLY 583 Ca -0.18 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.34 1ry2 n GLY 583 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ry2 n HIS 584 N -3.36 0.00 -2.89 1.61 8.25 -1.19 -5.11 115.22 112.52 1ry2 n HIS 584 Ca -0.09 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.35 1ry2 n HIS 584 Cb 0.59 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.69 1ry2 n HIS 584 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1ry2 n ARG 585 N -0.68 -2.50 -3.61 -0.41 1.74 -1.26 -4.90 116.66 105.03 1ry2 n ARG 585 Ca 0.00 2.12 -0.40 0.00 -0.77 0.00 0.00 57.85 58.80 1ry2 n ARG 585 Cb 0.03 -3.13 -0.11 0.00 -1.02 0.00 0.00 32.46 28.23 1ry2 n ARG 585 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ry2 s LEU 586 N -0.82 4.59 0.42 0.55 1.43 0.09 -4.92 118.68 120.03 1ry2 s LEU 586 Ca -0.08 -0.91 -0.24 0.00 -1.03 0.00 0.00 54.13 51.87 1ry2 s LEU 586 Cb 0.01 -2.02 -0.08 0.00 0.03 0.00 0.00 46.19 44.13 1ry2 s LEU 586 CO 0.41 -0.35 1.09 -0.94 0.23 0.00 0.00 176.35 176.79 1ry2 s SER 587 N 1.56 6.54 0.18 2.29 1.04 -1.26 -1.52 113.70 122.53 1ry2 s SER 587 Ca 0.02 2.14 -0.04 0.00 0.48 0.00 0.00 55.95 58.55 1ry2 s SER 587 Cb -0.19 -2.59 0.08 0.00 0.10 0.00 0.00 66.02 63.42 1ry2 s SER 587 CO 0.06 -0.65 1.48 0.71 0.98 0.00 0.00 173.24 175.82 1ry2 h THR 588 N 2.07 1.33 -0.66 2.02 1.35 -1.81 -3.36 112.91 113.85 1ry2 h THR 588 Ca -0.49 -1.87 0.06 0.00 -0.55 0.00 0.00 66.41 63.56 1ry2 h THR 588 Cb 1.23 1.85 -0.09 0.00 -1.73 0.00 0.00 68.15 69.40 1ry2 h THR 588 CO 0.61 0.58 -0.46 0.00 -0.25 0.00 0.00 175.52 176.00 1ry2 h ALA 589 N 0.93 -0.51 0.15 6.62 0.00 -1.64 -1.28 119.26 123.52 1ry2 h ALA 589 Ca -0.00 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ry2 h ALA 589 Cb 1.15 1.23 -0.01 0.00 0.00 0.00 0.00 17.79 20.16 1ry2 h ALA 589 CO 0.11 -0.81 -0.11 1.49 0.00 0.00 0.00 179.25 179.93 1ry2 h GLU 590 N -0.09 -0.26 -0.57 0.00 4.81 -1.82 -2.07 114.58 114.58 1ry2 h GLU 590 Ca 0.11 0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.33 1ry2 h GLU 590 Cb 0.37 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 1ry2 h GLU 590 CO -0.67 -0.17 0.25 0.82 -0.73 0.00 0.00 179.01 178.51 1ry2 h ILE 591 N -0.27 1.22 -0.15 2.32 2.04 -1.65 -2.78 117.51 118.23 1ry2 h ILE 591 Ca -0.00 -0.64 -0.21 0.00 1.00 0.00 0.00 64.86 65.00 1ry2 h ILE 591 Cb 0.24 0.57 0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1ry2 h ILE 591 CO -0.01 0.25 -0.73 -0.33 0.00 0.00 0.00 178.15 177.33 1ry2 h GLU 592 N 0.78 0.76 -0.84 2.37 5.08 -1.26 -2.85 114.58 118.63 1ry2 h GLU 592 Ca 0.19 -0.62 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 1ry2 h GLU 592 Cb 0.16 0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 1ry2 h GLU 592 CO -0.02 1.23 0.53 0.00 -1.00 0.00 0.00 179.01 179.75 1ry2 h ALA 593 N 0.54 1.06 -0.01 3.43 0.00 -1.40 0.03 119.26 122.91 1ry2 h ALA 593 Ca -0.05 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1ry2 h ALA 593 Cb 1.37 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1ry2 h ALA 593 CO 0.15 0.50 -0.26 0.00 0.00 0.00 0.00 179.25 179.65 1ry2 h ALA 594 N 1.29 1.57 0.22 0.00 0.00 -1.51 -1.32 119.26 119.51 1ry2 h ALA 594 Ca 0.30 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1ry2 h ALA 594 Cb -0.08 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1ry2 h ALA 594 CO -0.06 0.33 -0.11 0.82 0.00 0.00 0.00 179.25 180.23 1ry2 h ILE 595 N 0.01 0.00 -1.03 0.00 1.08 -0.96 -3.25 117.51 113.36 1ry2 h ILE 595 Ca -0.00 -0.43 0.29 0.00 -0.39 0.00 0.00 64.86 64.34 1ry2 h ILE 595 Cb 0.46 0.00 -0.05 0.00 -3.07 0.00 0.00 36.82 34.16 1ry2 h ILE 595 CO 0.03 0.00 0.73 0.16 -0.69 0.00 0.00 178.15 178.39 1ry2 h ILE 596 N -0.73 0.49 0.00 -0.67 3.07 -1.05 -1.31 117.51 117.31 1ry2 h ILE 596 Ca -0.03 -0.02 -0.01 0.00 1.55 0.00 0.00 64.86 66.34 1ry2 h ILE 596 Cb 0.23 0.42 -0.00 0.00 -0.27 0.00 0.00 36.82 37.20 1ry2 h ILE 596 CO 0.05 0.01 -0.01 1.21 -1.05 0.00 0.00 178.15 178.36 1ry2 n GLU 597 N -4.29 0.74 -3.96 0.16 2.13 -0.50 -4.47 120.64 110.46 1ry2 n GLU 597 Ca 0.22 -0.07 -0.20 0.00 0.66 0.00 0.00 57.16 57.78 1ry2 n GLU 597 Cb 1.06 -1.23 -0.17 0.00 0.27 0.00 0.00 31.44 31.37 1ry2 n GLU 597 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1ry2 s ASP 598 N 2.03 0.91 0.60 4.31 -1.08 -0.50 -4.99 116.67 117.95 1ry2 s ASP 598 Ca 0.05 -0.07 0.28 0.00 -0.52 0.00 0.00 52.55 52.29 1ry2 s ASP 598 Cb 0.02 -0.35 1.16 0.00 -1.46 0.00 0.00 42.92 42.30 1ry2 s ASP 598 CO 0.00 -0.11 1.54 -0.65 0.52 0.00 0.00 175.17 176.47 1ry2 h PRO 599 N 7.53 0.00 0.00 4.34 0.11 -1.89 0.21 132.00 142.30 1ry2 h PRO 599 Ca -0.34 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.73 1ry2 h PRO 599 Cb 1.14 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1ry2 h PRO 599 CO 0.41 0.00 -0.17 0.82 -0.21 0.00 0.00 178.00 178.85 1ry2 h ILE 600 N 0.00 0.36 -2.91 4.15 1.08 -1.93 -3.45 117.51 114.81 1ry2 h ILE 600 Ca 0.40 -1.13 -0.45 0.00 -0.39 0.00 0.00 64.86 63.29 1ry2 h ILE 600 Cb 2.29 1.86 -0.14 0.00 -3.07 0.00 0.00 36.82 37.75 1ry2 h ILE 600 CO -0.00 0.17 -0.64 0.54 -0.69 0.00 0.00 178.15 177.52 1ry2 s VAL 601 N -3.46 1.28 0.00 1.67 0.11 0.73 -3.26 120.40 117.47 1ry2 s VAL 601 Ca 0.03 -2.04 0.00 0.00 -2.93 0.00 0.00 61.98 57.03 1ry2 s VAL 601 Cb 0.08 -2.58 0.00 0.00 -1.53 0.00 0.00 36.38 32.35 1ry2 s VAL 601 CO 0.64 -0.17 0.43 0.00 -3.33 0.00 0.00 175.10 172.67 1ry2 n ALA 602 N -0.59 0.96 -3.65 1.54 0.00 -1.20 -4.54 120.51 113.02 1ry2 n ALA 602 Ca -0.04 -0.43 -0.01 0.00 0.00 0.00 0.00 53.44 52.97 1ry2 n ALA 602 Cb 0.65 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.04 1ry2 n ALA 602 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1ry2 s GLU 603 N 0.00 0.15 0.04 0.00 2.12 -1.25 -4.98 118.70 114.78 1ry2 s GLU 603 Ca 0.00 0.23 0.01 0.00 0.36 0.00 0.00 54.97 55.57 1ry2 s GLU 603 Cb 0.00 0.04 -0.03 0.00 0.26 0.00 0.00 34.13 34.41 1ry2 s GLU 603 CO 0.00 -0.03 -0.05 0.00 -0.54 0.00 0.00 175.26 174.64 1ry2 s ALA 605 N -2.19 -0.66 -0.12 0.00 0.00 -1.07 -4.98 121.76 112.74 1ry2 s ALA 605 Ca -0.06 0.15 -0.15 0.00 0.00 0.00 0.00 51.96 51.90 1ry2 s ALA 605 Cb -0.05 -1.71 -0.05 0.00 0.00 0.00 0.00 23.12 21.32 1ry2 s ALA 605 CO -0.03 -1.51 0.37 0.08 0.00 0.00 0.00 175.76 174.67 1ry2 s VAL 606 N 2.42 5.23 0.00 0.00 1.01 -1.26 -0.96 120.40 126.84 1ry2 s VAL 606 Ca 0.10 0.72 0.00 0.00 0.00 0.00 0.00 61.98 62.80 1ry2 s VAL 606 Cb -0.14 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.53 1ry2 s VAL 606 CO -0.24 0.39 0.00 1.33 0.00 0.00 0.00 175.10 176.58 1ry2 n VAL 607 N 3.36 0.00 -2.87 2.92 0.24 -0.68 -4.95 118.33 116.34 1ry2 n VAL 607 Ca -0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 1ry2 n VAL 607 Cb 0.52 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.89 1ry2 n VAL 607 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ry2 n GLY 608 N 0.13 2.09 3.58 7.63 0.00 -1.26 -3.72 105.19 113.64 1ry2 n GLY 608 Ca 0.00 -0.96 -0.05 0.00 0.00 0.00 0.00 46.02 45.01 1ry2 n GLY 608 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ry2 s PHE 609 N -7.73 -0.22 -0.80 1.61 5.36 -1.26 -3.93 117.98 111.01 1ry2 s PHE 609 Ca 0.00 0.08 -0.30 0.00 -0.96 0.00 0.00 56.93 55.76 1ry2 s PHE 609 Cb 0.00 0.55 -0.17 0.00 -0.34 0.00 0.00 43.02 43.06 1ry2 s PHE 609 CO 0.00 -0.46 2.57 0.09 -1.46 0.00 0.00 175.22 175.96 1ry2 n ASN 610 N -0.26 1.02 -4.15 6.13 3.02 -1.26 -4.86 115.26 114.90 1ry2 n ASN 610 Ca -0.06 -0.02 -0.32 0.00 -0.03 0.00 0.00 54.58 54.15 1ry2 n ASN 610 Cb 0.61 -1.15 -0.16 0.00 -0.61 0.00 0.00 39.78 38.47 1ry2 n ASN 610 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ry2 s ASP 611 N 9.88 3.06 0.00 6.41 2.15 -1.26 -5.05 116.67 131.86 1ry2 s ASP 611 Ca 1.22 -0.60 0.00 0.00 0.43 0.00 0.00 52.55 53.60 1ry2 s ASP 611 Cb -0.91 -1.42 0.00 0.00 -0.30 0.00 0.00 42.92 40.29 1ry2 s ASP 611 CO 0.42 0.06 0.00 -0.67 -0.17 0.00 0.00 175.17 174.81 1ry2 n ASP 612 N 4.19 0.00 -4.68 -0.34 2.03 -1.26 -4.66 116.55 111.83 1ry2 n ASP 612 Ca -0.20 0.35 -0.29 0.00 0.52 0.00 0.00 54.79 55.17 1ry2 n ASP 612 Cb 0.51 -0.35 0.14 0.00 -0.72 0.00 0.00 41.12 40.70 1ry2 n ASP 612 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1ry2 s LEU 613 N -3.12 2.09 0.00 -2.67 1.43 -1.26 -3.76 118.68 111.39 1ry2 s LEU 613 Ca 0.00 0.84 0.00 0.00 -1.03 0.00 0.00 54.13 53.94 1ry2 s LEU 613 Cb 0.00 -3.13 0.00 0.00 0.03 0.00 0.00 46.19 43.09 1ry2 s LEU 613 CO 0.00 -2.55 0.00 0.41 0.23 0.00 0.00 176.35 174.44 1ry2 n THR 614 N -3.75 0.00 0.00 5.49 -1.04 -1.26 -4.13 114.28 109.60 1ry2 n THR 614 Ca 0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 1ry2 n THR 614 Cb 0.60 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.11 1ry2 n THR 614 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ry2 n GLY 615 N -1.68 1.90 3.53 3.41 0.00 -1.25 -3.77 105.19 107.33 1ry2 n GLY 615 Ca 0.00 -0.53 -0.00 0.00 0.00 0.00 0.00 46.02 45.49 1ry2 n GLY 615 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ry2 s GLN 616 N 0.00 0.30 0.51 1.61 0.74 -1.24 -4.65 119.66 116.94 1ry2 s GLN 616 Ca 0.00 0.61 -0.02 0.00 0.05 0.00 0.00 55.36 56.00 1ry2 s GLN 616 Cb 0.00 0.21 0.01 0.00 1.10 0.00 0.00 33.01 34.33 1ry2 s GLN 616 CO 0.00 -0.08 0.77 0.00 -0.55 0.00 0.00 175.29 175.43 1ry2 s ALA 617 N 1.78 3.60 -0.34 1.58 0.00 -1.26 -3.98 121.76 123.13 1ry2 s ALA 617 Ca -0.06 -0.95 -0.10 0.00 0.00 0.00 0.00 51.96 50.85 1ry2 s ALA 617 Cb -0.04 -2.31 0.01 0.00 0.00 0.00 0.00 23.12 20.78 1ry2 s ALA 617 CO -0.15 -0.58 0.17 0.08 0.00 0.00 0.00 175.76 175.27 1ry2 s VAL 618 N -2.74 4.45 -0.12 0.00 1.01 -1.26 -4.68 120.40 117.05 1ry2 s VAL 618 Ca 0.51 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.81 1ry2 s VAL 618 Cb -0.10 -3.40 0.00 0.00 0.00 0.00 0.00 36.38 32.89 1ry2 s VAL 618 CO 0.41 -0.10 -0.23 0.00 0.00 0.00 0.00 175.10 175.18 1ry2 s ALA 619 N 1.56 2.22 -0.16 5.51 0.00 -1.24 0.17 121.76 129.80 1ry2 s ALA 619 Ca 0.03 -1.03 -0.01 0.00 0.00 0.00 0.00 51.96 50.95 1ry2 s ALA 619 Cb -0.18 -0.90 -0.01 0.00 0.00 0.00 0.00 23.12 22.03 1ry2 s ALA 619 CO 0.06 0.14 -0.12 0.00 0.00 0.00 0.00 175.76 175.85 1ry2 s ALA 620 N 0.56 2.63 -0.68 0.00 0.00 -0.43 -1.69 121.76 122.15 1ry2 s ALA 620 Ca -0.13 -1.01 -0.21 0.00 0.00 0.00 0.00 51.96 50.61 1ry2 s ALA 620 Cb -0.17 -1.34 0.09 0.00 0.00 0.00 0.00 23.12 21.70 1ry2 s ALA 620 CO 0.04 -0.01 0.93 -0.06 0.00 0.00 0.00 175.76 176.66 1ry2 s PHE 621 N 0.77 2.82 -0.00 0.00 0.40 -0.13 0.41 117.98 122.25 1ry2 s PHE 621 Ca -0.05 -0.79 -0.15 0.00 -0.60 0.00 0.00 56.93 55.35 1ry2 s PHE 621 Cb -0.15 -4.22 -0.06 0.00 0.51 0.00 0.00 43.02 39.10 1ry2 s PHE 621 CO 0.01 -1.54 0.40 0.08 0.70 0.00 0.00 175.22 174.87 1ry2 s VAL 622 N 3.50 5.04 -0.18 -0.44 1.01 0.21 -2.59 120.40 126.96 1ry2 s VAL 622 Ca 0.21 0.82 0.01 0.00 0.00 0.00 0.00 61.98 63.02 1ry2 s VAL 622 Cb -0.17 -3.70 0.03 0.00 0.00 0.00 0.00 36.38 32.54 1ry2 s VAL 622 CO 0.06 0.58 -0.11 0.54 0.00 0.00 0.00 175.10 176.17 1ry2 s VAL 623 N -1.07 1.55 0.59 2.92 0.11 -1.12 -0.97 120.40 122.40 1ry2 s VAL 623 Ca 0.23 -0.82 -0.17 0.00 -2.93 0.00 0.00 61.98 58.30 1ry2 s VAL 623 Cb -0.17 -1.57 -0.04 0.00 -1.53 0.00 0.00 36.38 33.07 1ry2 s VAL 623 CO 0.13 0.27 1.07 -0.76 -3.33 0.00 0.00 175.10 172.48 1ry2 s LEU 624 N 1.46 3.55 0.47 2.54 1.43 -1.26 -3.26 118.68 123.61 1ry2 s LEU 624 Ca 0.01 1.90 0.27 0.00 -1.03 0.00 0.00 54.13 55.28 1ry2 s LEU 624 Cb -0.15 -4.55 1.04 0.00 0.03 0.00 0.00 46.19 42.57 1ry2 s LEU 624 CO -0.09 -1.21 1.87 0.50 0.23 0.00 0.00 176.35 177.65 1ry2 h LYS 625 N 0.59 0.00 -1.29 1.70 3.64 -1.84 -3.45 116.57 115.92 1ry2 h LYS 625 Ca -0.47 0.00 -0.47 0.00 -1.27 0.00 0.00 60.65 58.43 1ry2 h LYS 625 Cb 1.23 0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 32.64 1ry2 h LYS 625 CO 0.57 0.16 -0.97 1.28 -2.27 0.00 0.00 179.45 178.22 1ry2 n LEU 638 N -3.32 3.02 0.00 5.20 4.77 -1.26 -5.05 117.00 120.36 1ry2 n LEU 638 Ca 0.00 -4.49 0.00 0.00 -0.03 0.00 0.00 56.01 51.50 1ry2 n LEU 638 Cb 0.39 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 1ry2 n LEU 638 CO 0.32 1.91 0.00 1.67 -1.33 0.00 0.00 177.39 179.96 1ry2 n GLN 639 N -0.25 0.00 -1.23 3.23 7.27 -1.26 -4.98 117.38 120.16 1ry2 n GLN 639 Ca 0.24 0.00 -0.10 0.00 0.07 0.00 0.00 57.00 57.21 1ry2 n GLN 639 Cb 0.73 0.00 -0.04 0.00 2.41 0.00 0.00 30.24 33.34 1ry2 n GLN 639 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1ry2 n ASP 640 N 0.00 -2.85 0.11 1.69 -0.08 -1.26 -4.74 116.55 109.42 1ry2 n ASP 640 Ca 0.00 0.24 -0.00 0.00 -1.51 0.00 0.00 54.79 53.51 1ry2 n ASP 640 Cb 0.00 -2.66 -0.02 0.00 2.34 0.00 0.00 41.12 40.78 1ry2 n ASP 640 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 1ry2 h ILE 641 N 0.00 1.07 0.26 5.18 2.04 -2.02 -3.29 117.51 120.75 1ry2 h ILE 641 Ca -0.20 -2.53 -0.01 0.00 1.00 0.00 0.00 64.86 63.12 1ry2 h ILE 641 Cb 0.68 2.51 0.00 0.00 -0.74 0.00 0.00 36.82 39.27 1ry2 h ILE 641 CO 0.29 0.61 -0.13 0.11 0.00 0.00 0.00 178.15 179.03 1ry2 h LYS 642 N 0.00 -0.34 -0.98 2.37 1.57 -1.97 -3.31 116.57 113.91 1ry2 h LYS 642 Ca -0.02 0.02 0.24 0.00 -1.87 0.00 0.00 60.65 59.03 1ry2 h LYS 642 Cb 1.51 0.08 -0.18 0.00 0.08 0.00 0.00 32.23 33.71 1ry2 h LYS 642 CO 0.08 -0.01 -0.07 0.87 -0.57 0.00 0.00 179.45 179.75 1ry2 h LYS 643 N -0.95 0.01 0.07 3.15 1.57 -1.96 -0.98 116.57 117.47 1ry2 h LYS 643 Ca -0.04 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1ry2 h LYS 643 Cb 0.49 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 1ry2 h LYS 643 CO 0.06 0.00 -0.21 1.25 -0.57 0.00 0.00 179.45 179.98 1ry2 h HIS 644 N 0.01 -0.61 0.00 -1.35 2.76 -1.65 0.28 115.15 114.59 1ry2 h HIS 644 Ca 0.55 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.74 1ry2 h HIS 644 Cb 1.05 0.26 0.00 0.00 1.55 0.00 0.00 27.41 30.26 1ry2 h HIS 644 CO -0.59 -0.24 0.43 -0.07 -1.30 0.00 0.00 177.93 176.16 1ry2 h LEU 645 N -0.32 0.00 0.09 0.26 -0.00 -1.29 0.24 115.31 114.28 1ry2 h LEU 645 Ca -0.01 0.00 -0.27 0.00 -0.00 0.00 0.00 57.88 57.61 1ry2 h LEU 645 Cb 0.31 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.96 1ry2 h LEU 645 CO -0.10 0.00 -1.41 0.58 -0.00 0.00 0.00 178.44 177.51 1ry2 h VAL 646 N 0.00 0.97 0.00 1.22 2.07 -0.05 -3.19 116.25 117.27 1ry2 h VAL 646 Ca 0.00 -2.34 0.00 0.00 0.82 0.00 0.00 66.70 65.18 1ry2 h VAL 646 Cb 0.86 2.60 0.00 0.00 -1.52 0.00 0.00 31.29 33.23 1ry2 h VAL 646 CO 0.00 0.64 0.00 -0.26 0.02 0.00 0.00 177.57 177.97 1ry2 h PHE 647 N -0.43 0.00 0.00 1.57 0.05 0.27 -1.90 116.94 116.50 1ry2 h PHE 647 Ca -0.32 0.00 -0.16 0.00 3.82 0.00 0.00 57.97 61.31 1ry2 h PHE 647 Cb 1.67 0.00 -0.02 0.00 2.00 0.00 0.00 35.95 39.59 1ry2 h PHE 647 CO 0.12 0.00 -0.93 0.00 -0.18 0.00 0.00 178.31 177.32 1ry2 h THR 648 N 0.00 0.94 -0.42 -1.55 1.03 -1.26 -2.40 112.91 109.24 1ry2 h THR 648 Ca 0.00 -2.44 -0.14 0.00 -0.01 0.00 0.00 66.41 63.82 1ry2 h THR 648 Cb 0.43 2.41 -0.01 0.00 -1.07 0.00 0.00 68.15 69.91 1ry2 h THR 648 CO 0.00 0.53 -0.29 0.58 -0.01 0.00 0.00 175.52 176.34 1ry2 h VAL 649 N 0.00 1.27 -0.00 0.00 2.07 -1.33 -2.93 116.25 115.33 1ry2 h VAL 649 Ca -0.07 -1.45 -0.16 0.00 0.82 0.00 0.00 66.70 65.84 1ry2 h VAL 649 Cb 1.56 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 32.58 1ry2 h VAL 649 CO 0.07 0.49 -0.78 0.08 0.02 0.00 0.00 177.57 177.46 1ry2 h ARG 650 N 0.77 0.01 -0.92 1.57 0.11 -1.57 -0.89 114.38 113.46 1ry2 h ARG 650 Ca 0.08 -0.01 0.11 0.00 0.10 0.00 0.00 59.98 60.26 1ry2 h ARG 650 Cb 0.87 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 31.88 1ry2 h ARG 650 CO 0.08 0.78 0.59 -0.22 0.10 0.00 0.00 179.97 181.30 1ry2 h LYS 651 N 0.01 0.86 0.00 0.08 1.63 -1.24 -3.12 116.57 114.79 1ry2 h LYS 651 Ca -0.01 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1ry2 h LYS 651 Cb 1.38 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 32.81 1ry2 h LYS 651 CO 0.10 0.57 -0.90 -0.25 -3.45 0.00 0.00 179.45 175.52 1ry2 n ASP 652 N -4.55 4.51 -0.11 4.20 8.00 -1.20 -4.89 116.55 122.51 1ry2 n ASP 652 Ca 0.16 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.43 1ry2 n ASP 652 Cb 0.34 0.77 -0.08 0.00 -0.02 0.00 0.00 41.12 42.13 1ry2 n ASP 652 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1ry2 n ILE 653 N -1.50 1.25 0.00 0.53 -0.00 -0.41 -5.13 119.36 114.10 1ry2 n ILE 653 Ca 0.00 -0.29 0.00 0.00 -0.00 0.00 0.00 62.75 62.46 1ry2 n ILE 653 Cb 0.13 -1.83 0.00 0.00 -0.00 0.00 0.00 39.64 37.95 1ry2 n ILE 653 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1ry2 n GLY 654 N 1.59 4.04 0.08 7.39 0.00 -0.78 -4.93 105.19 112.57 1ry2 n GLY 654 Ca -0.43 -1.04 0.11 0.00 0.00 0.00 0.00 46.02 44.66 1ry2 n GLY 654 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ry2 n PRO 655 N -1.54 0.14 -0.53 1.61 -0.04 -1.26 -2.26 135.00 131.12 1ry2 n PRO 655 Ca 0.00 0.32 0.10 0.00 -0.04 0.00 0.00 63.50 63.88 1ry2 n PRO 655 Cb 0.00 -1.74 0.34 0.00 -0.04 0.00 0.00 33.50 32.07 1ry2 n PRO 655 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1ry2 n PHE 656 N -1.99 1.30 0.00 0.54 7.35 -1.26 -3.87 117.46 119.53 1ry2 n PHE 656 Ca 0.03 -0.55 0.00 0.00 -0.76 0.00 0.00 57.45 56.17 1ry2 n PHE 656 Cb 0.25 -0.16 0.00 0.00 0.35 0.00 0.00 39.48 39.92 1ry2 n PHE 656 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1ry2 n ALA 657 N 1.30 1.84 -1.74 3.13 0.00 -0.96 -4.89 120.51 119.20 1ry2 n ALA 657 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.27 1ry2 n ALA 657 Cb 0.79 0.03 -0.03 0.00 0.00 0.00 0.00 19.45 20.24 1ry2 n ALA 657 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ry2 s ALA 658 N -1.84 3.72 0.58 0.00 0.00 -1.12 -4.92 121.76 118.17 1ry2 s ALA 658 Ca 0.00 1.39 -0.20 0.00 0.00 0.00 0.00 51.96 53.15 1ry2 s ALA 658 Cb 0.00 -3.77 -0.05 0.00 0.00 0.00 0.00 23.12 19.30 1ry2 s ALA 658 CO 0.00 -1.28 1.11 -2.30 0.00 0.00 0.00 175.76 173.30 1ry2 n PRO 659 N 6.03 1.17 0.02 0.00 -0.02 -1.26 -4.85 135.00 136.09 1ry2 n PRO 659 Ca 0.18 0.44 0.13 0.00 -2.02 0.00 0.00 63.50 62.23 1ry2 n PRO 659 Cb 0.39 -2.31 0.42 0.00 -0.02 0.00 0.00 33.50 31.99 1ry2 n PRO 659 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1ry2 n LYS 660 N -1.02 0.07 -3.59 -0.52 4.76 0.44 -4.84 118.16 113.46 1ry2 n LYS 660 Ca 0.13 0.04 -0.01 0.00 -2.87 0.00 0.00 58.31 55.60 1ry2 n LYS 660 Cb 0.46 -1.56 -0.06 0.00 -1.84 0.00 0.00 35.03 32.02 1ry2 n LYS 660 CO 0.00 0.00 0.00 -0.48 -1.37 0.00 0.00 177.40 175.55 1ry2 s LEU 661 N -3.36 -0.47 -0.11 -0.35 2.34 -1.19 -5.03 118.68 110.50 1ry2 s LEU 661 Ca 0.12 0.72 -0.01 0.00 0.06 0.00 0.00 54.13 55.02 1ry2 s LEU 661 Cb 0.17 1.65 -0.03 0.00 -0.56 0.00 0.00 46.19 47.42 1ry2 s LEU 661 CO 0.61 -0.11 -0.07 0.27 -1.06 0.00 0.00 176.35 175.99 1ry2 s ILE 662 N 1.55 3.62 -0.16 1.48 -4.36 -1.26 -1.31 121.20 120.75 1ry2 s ILE 662 Ca -0.08 -0.48 -0.05 0.00 -0.26 0.00 0.00 60.65 59.79 1ry2 s ILE 662 Cb -0.04 -2.53 -0.03 0.00 1.25 0.00 0.00 42.46 41.11 1ry2 s ILE 662 CO -0.15 0.54 0.00 -0.63 0.24 0.00 0.00 174.94 174.95 1ry2 s ILE 663 N -0.12 4.25 -0.54 8.37 1.09 0.17 -4.93 121.20 129.48 1ry2 s ILE 663 Ca 0.01 -0.23 -0.20 0.00 -1.10 0.00 0.00 60.65 59.13 1ry2 s ILE 663 Cb -0.13 -2.88 0.06 0.00 -1.06 0.00 0.00 42.46 38.45 1ry2 s ILE 663 CO 0.03 0.49 0.73 -0.76 -0.10 0.00 0.00 174.94 175.33 1ry2 s LEU 664 N 0.25 4.81 0.25 2.97 2.01 -1.26 0.65 118.68 128.36 1ry2 s LEU 664 Ca -0.00 -0.89 0.11 0.00 0.01 0.00 0.00 54.13 53.36 1ry2 s LEU 664 Cb -0.13 -2.50 -0.05 0.00 0.01 0.00 0.00 46.19 43.53 1ry2 s LEU 664 CO 0.02 -1.03 -0.13 0.68 1.01 0.00 0.00 176.35 176.90 1ry2 s VAL 665 N 3.01 2.88 0.20 -1.59 -7.23 -0.15 -4.98 120.40 112.55 1ry2 s VAL 665 Ca 0.18 -2.07 0.07 0.00 -1.81 0.00 0.00 61.98 58.35 1ry2 s VAL 665 Cb -0.18 -2.49 -0.11 0.00 0.56 0.00 0.00 36.38 34.16 1ry2 s VAL 665 CO 0.12 -0.30 1.46 0.44 -0.31 0.00 0.00 175.10 176.52 1ry2 h ASP 666 N 2.40 0.09 -1.55 4.85 5.19 -1.96 -3.35 116.42 122.10 1ry2 h ASP 666 Ca -0.43 -0.07 -0.00 0.00 -0.62 0.00 0.00 57.03 55.90 1ry2 h ASP 666 Cb 1.24 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.72 1ry2 h ASP 666 CO 0.57 0.83 0.10 -0.90 -3.12 0.00 0.00 179.24 176.72 1ry2 n ASP 667 N -3.66 -0.68 -4.16 6.45 3.85 -1.26 -4.89 116.55 112.19 1ry2 n ASP 667 Ca -0.02 -1.46 -0.21 0.00 -0.71 0.00 0.00 54.79 52.39 1ry2 n ASP 667 Cb 0.75 1.13 -0.14 0.00 -1.35 0.00 0.00 41.12 41.52 1ry2 n ASP 667 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 1ry2 s LEU 668 N 0.00 2.16 -0.34 -2.12 1.43 -1.26 -5.01 118.68 113.54 1ry2 s LEU 668 Ca 0.05 -0.46 -0.28 0.00 -1.03 0.00 0.00 54.13 52.41 1ry2 s LEU 668 Cb -0.01 -0.69 -0.04 0.00 0.03 0.00 0.00 46.19 45.48 1ry2 s LEU 668 CO 0.03 0.07 2.10 -2.16 0.23 0.00 0.00 176.35 176.62 1ry2 s PRO 669 N -1.11 2.93 0.26 1.29 0.04 -1.26 -4.93 135.00 132.22 1ry2 s PRO 669 Ca 0.03 1.59 0.11 0.00 0.04 0.00 0.00 61.00 62.77 1ry2 s PRO 669 Cb -0.08 -4.37 -0.05 0.00 0.04 0.00 0.00 34.50 30.05 1ry2 s PRO 669 CO 0.01 -2.33 -0.16 0.15 0.04 0.00 0.00 177.00 174.71 1ry2 s LYS 670 N 6.60 1.80 0.20 4.56 1.02 -1.26 -0.39 119.74 132.27 1ry2 s LYS 670 Ca 0.90 -1.64 -0.07 0.00 0.02 0.00 0.00 55.97 55.18 1ry2 s LYS 670 Cb -0.25 -1.88 -0.06 0.00 -0.52 0.00 0.00 37.83 35.12 1ry2 s LYS 670 CO 0.31 0.35 0.48 0.95 -0.92 0.00 0.00 175.35 176.53 1ry2 s THR 671 N -2.32 5.03 0.59 2.17 -4.23 -0.88 -4.93 115.64 111.07 1ry2 s THR 671 Ca 0.29 0.25 0.11 0.00 -1.18 0.00 0.00 61.69 61.16 1ry2 s THR 671 Cb -0.06 -3.63 0.11 0.00 1.34 0.00 0.00 72.50 70.26 1ry2 s THR 671 CO 0.15 -0.06 1.31 -0.09 -0.54 0.00 0.00 174.62 175.40 1ry2 h ARG 672 N 2.54 0.00 0.06 3.99 9.65 -1.98 1.25 114.38 129.90 1ry2 h ARG 672 Ca -0.47 0.00 -0.24 0.00 -1.10 0.00 0.00 59.98 58.17 1ry2 h ARG 672 Cb 1.17 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.74 1ry2 h ARG 672 CO 0.70 0.00 -1.09 0.77 2.80 0.00 0.00 179.97 183.15 1ry2 h SER 673 N 0.00 0.32 0.00 -3.80 0.02 -2.00 -3.49 113.55 104.60 1ry2 h SER 673 Ca 0.00 -0.31 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 1ry2 h SER 673 Cb 1.40 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.84 1ry2 h SER 673 CO 0.00 1.20 0.00 0.61 -1.14 0.00 0.00 176.83 177.50 1ry2 n GLY 674 N 1.29 1.30 3.62 -3.77 0.00 0.43 -5.00 105.19 103.07 1ry2 n GLY 674 Ca -0.06 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 1ry2 n GLY 674 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ry2 n LYS 675 N 0.00 1.44 -3.00 1.61 -0.00 -1.26 -4.61 118.16 112.34 1ry2 n LYS 675 Ca 0.00 0.52 -0.40 0.00 -0.00 0.00 0.00 58.31 58.42 1ry2 n LYS 675 Cb 0.00 -2.08 -0.05 0.00 -0.00 0.00 0.00 35.03 32.91 1ry2 n LYS 675 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1ry2 s ILE 676 N -1.24 4.99 -1.13 0.58 1.01 -1.26 -2.08 121.20 122.06 1ry2 s ILE 676 Ca 0.62 1.47 -0.18 0.00 0.00 0.00 0.00 60.65 62.57 1ry2 s ILE 676 Cb -0.56 -4.06 0.11 0.00 0.01 0.00 0.00 42.46 37.96 1ry2 s ILE 676 CO 0.57 0.16 1.45 -0.04 0.00 0.00 0.00 174.94 177.08 1ry2 s MET 677 N 1.39 3.85 0.35 2.79 -1.94 0.47 -4.79 119.30 121.43 1ry2 s MET 677 Ca 0.37 -1.95 0.18 0.00 -1.71 0.00 0.00 55.69 52.57 1ry2 s MET 677 Cb -0.17 -5.22 0.56 0.00 2.01 0.00 0.00 34.83 32.01 1ry2 s MET 677 CO 0.15 -1.99 1.68 0.00 -0.01 0.00 0.00 175.02 174.85 1ry2 h ARG 678 N 8.17 0.00 0.00 2.03 3.08 -1.94 -2.89 114.38 122.83 1ry2 h ARG 678 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1ry2 h ARG 678 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.98 1ry2 h ARG 678 CO 1.31 0.42 0.00 2.89 -1.07 0.00 0.00 179.97 183.52 1ry2 n ARG 679 N -3.50 0.17 0.04 0.04 1.85 -1.26 -0.52 116.66 113.48 1ry2 n ARG 679 Ca 0.00 0.53 -0.18 0.00 -1.00 0.00 0.00 57.85 57.20 1ry2 n ARG 679 Cb 0.56 -1.91 -0.14 0.00 -1.05 0.00 0.00 32.46 29.91 1ry2 n ARG 679 CO 0.00 0.00 0.00 0.82 -0.01 0.00 0.00 177.63 178.44 1ry2 h ILE 680 N 0.00 0.99 -0.03 8.89 5.03 -1.85 -1.69 117.51 128.86 1ry2 h ILE 680 Ca 0.00 -2.65 -0.11 0.00 -0.12 0.00 0.00 64.86 61.97 1ry2 h ILE 680 Cb 0.19 2.68 -0.01 0.00 -3.03 0.00 0.00 36.82 36.64 1ry2 h ILE 680 CO 0.00 0.80 -0.51 -0.07 -0.68 0.00 0.00 178.15 177.70 1ry2 h LEU 681 N 0.07 0.07 0.00 1.44 3.38 -1.05 -3.22 115.31 116.00 1ry2 h LEU 681 Ca -0.30 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1ry2 h LEU 681 Cb 2.03 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.76 1ry2 h LEU 681 CO 0.14 0.57 0.00 0.54 0.09 0.00 0.00 178.44 179.78 1ry2 n ARG 682 N -3.94 0.00 0.00 1.13 1.74 0.32 -4.05 116.66 111.87 1ry2 n ARG 682 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 1ry2 n ARG 682 Cb 0.53 -0.35 0.00 0.00 -1.02 0.00 0.00 32.46 31.62 1ry2 n ARG 682 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1ry2 n LYS 683 N -0.25 0.00 -4.18 5.56 4.81 -0.63 -3.97 118.16 119.49 1ry2 n LYS 683 Ca 0.00 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.33 1ry2 n LYS 683 Cb 0.00 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 34.95 1ry2 n LYS 683 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1ry2 s ILE 684 N -1.33 0.70 -0.40 3.15 1.01 -1.22 -4.88 121.20 118.24 1ry2 s ILE 684 Ca 0.00 -1.95 -0.05 0.00 0.00 0.00 0.00 60.65 58.65 1ry2 s ILE 684 Cb 0.00 -1.75 -0.15 0.00 0.01 0.00 0.00 42.46 40.57 1ry2 s ILE 684 CO 0.00 -0.81 2.63 0.18 0.00 0.00 0.00 174.94 176.93 1ry2 n LEU 685 N -0.07 4.62 0.00 2.97 4.77 -1.26 -4.12 117.00 123.90 1ry2 n LEU 685 Ca -0.11 -2.76 0.00 0.00 -0.03 0.00 0.00 56.01 53.11 1ry2 n LEU 685 Cb 0.61 -1.10 0.00 0.00 -2.33 0.00 0.00 43.42 40.60 1ry2 n LEU 685 CO 0.31 1.10 0.00 0.00 -1.33 0.00 0.00 177.39 177.46 1ry2 n ALA 686 N 3.10 0.00 0.00 -1.18 0.00 -1.25 -4.32 120.51 116.86 1ry2 n ALA 686 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1ry2 n ALA 686 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 1ry2 n ALA 686 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ry2 n ASN 700 N 0.00 0.00 -4.20 0.00 3.02 -1.26 -4.61 115.26 108.22 1ry2 n ASN 700 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.20 1ry2 n ASN 700 Cb 0.00 0.00 0.11 0.00 -0.61 0.00 0.00 39.78 39.28 1ry2 n ASN 700 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1ry2 n PRO 701 N 0.00 -0.79 0.26 3.52 -0.02 -1.26 -4.75 135.00 131.97 1ry2 n PRO 701 Ca 0.00 -0.21 0.13 0.00 -2.02 0.00 0.00 63.50 61.40 1ry2 n PRO 701 Cb 0.00 -1.46 0.81 0.00 -0.02 0.00 0.00 33.50 32.83 1ry2 n PRO 701 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1ry2 h GLY 702 N -1.58 0.00 1.00 -1.23 0.00 -2.05 -1.70 103.07 97.51 1ry2 h GLY 702 Ca -0.47 0.00 0.10 0.00 0.00 0.00 0.00 47.33 46.96 1ry2 h GLY 702 CO 0.31 0.00 0.41 -2.22 0.00 0.00 0.00 176.54 175.05 1ry2 h ILE 703 N 0.00 0.88 0.34 2.60 2.04 -2.00 -3.15 117.51 118.23 1ry2 h ILE 703 Ca 0.02 -0.14 -0.02 0.00 1.00 0.00 0.00 64.86 65.73 1ry2 h ILE 703 Cb 0.10 0.44 0.00 0.00 -0.74 0.00 0.00 36.82 36.63 1ry2 h ILE 703 CO -0.00 0.07 -0.16 0.58 0.00 0.00 0.00 178.15 178.64 1ry2 h VAL 704 N 0.41 0.00 -0.37 1.67 2.07 -1.60 -1.96 116.25 116.47 1ry2 h VAL 704 Ca 0.29 -0.01 0.07 0.00 0.82 0.00 0.00 66.70 67.87 1ry2 h VAL 704 Cb 0.58 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.27 1ry2 h VAL 704 CO -0.08 0.00 -0.35 -0.09 0.02 0.00 0.00 177.57 177.07 1ry2 h ARG 705 N -0.47 -0.28 -0.27 1.57 9.65 -1.71 0.68 114.38 123.56 1ry2 h ARG 705 Ca -0.05 0.02 0.08 0.00 -1.10 0.00 0.00 59.98 58.93 1ry2 h ARG 705 Cb 0.35 0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 28.98 1ry2 h ARG 705 CO 0.08 -0.18 0.20 1.25 2.80 0.00 0.00 179.97 184.11 1ry2 h HIS 706 N -0.29 0.00 0.00 2.20 2.76 -1.64 0.56 115.15 118.75 1ry2 h HIS 706 Ca 0.16 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.33 1ry2 h HIS 706 Cb 0.55 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.51 1ry2 h HIS 706 CO -0.55 0.00 -0.39 1.28 -1.30 0.00 0.00 177.93 176.97 1ry2 n LEU 707 N -4.45 0.53 0.08 0.26 4.32 0.69 -1.86 117.00 116.57 1ry2 n LEU 707 Ca 0.04 0.26 0.12 0.00 -0.02 0.00 0.00 56.01 56.41 1ry2 n LEU 707 Cb 0.36 -0.28 0.25 0.00 -1.62 0.00 0.00 43.42 42.13 1ry2 n LEU 707 CO 0.35 -0.01 0.55 0.40 -1.22 0.00 0.00 177.39 177.47 1ry2 h ILE 708 N 0.00 0.00 0.00 -0.08 1.08 0.56 -3.36 117.51 115.71 1ry2 h ILE 708 Ca 0.00 -0.52 -0.25 0.00 -0.39 0.00 0.00 64.86 63.70 1ry2 h ILE 708 Cb 0.63 1.27 -0.05 0.00 -3.07 0.00 0.00 36.82 35.60 1ry2 h ILE 708 CO 0.00 0.00 -1.96 0.47 -0.69 0.00 0.00 178.15 175.97 1ry2 n ASP 709 N -2.22 2.34 -0.09 1.72 10.43 -0.71 -4.24 116.55 123.78 1ry2 n ASP 709 Ca 0.04 -0.06 0.00 0.00 2.57 0.00 0.00 54.79 57.34 1ry2 n ASP 709 Cb 0.44 0.09 0.00 0.00 1.84 0.00 0.00 41.12 43.50 1ry2 n ASP 709 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1ry2 n SER 710 N -2.83 0.05 0.00 -2.24 7.64 -0.78 -2.17 113.62 113.28 1ry2 n SER 710 Ca -0.28 -0.57 0.00 0.00 1.01 0.00 0.00 58.87 59.04 1ry2 n SER 710 Cb 0.86 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 64.04 1ry2 n SER 710 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1ry2 n VAL 711 N -0.35 0.00 -0.01 0.44 0.24 -1.26 -4.72 118.33 112.67 1ry2 n VAL 711 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.19 1ry2 n VAL 711 Cb 0.01 -0.56 -0.05 0.00 -1.47 0.00 0.00 33.84 31.77 1ry2 n VAL 711 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1ry2 h LYS 712 N 0.00 0.16 -0.01 7.34 1.79 -1.61 -3.53 116.57 120.71 1ry2 h LYS 712 Ca 0.00 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1ry2 h LYS 712 Cb 0.68 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.30 1ry2 h LYS 712 CO 0.00 0.14 0.00 -0.11 -1.08 0.00 0.00 179.45 178.40