#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1foo n PRO 68 N 0.00 1.99 -1.46 1.61 -0.02 -1.26 -4.88 135.00 130.98 1foo n PRO 68 Ca 0.00 0.71 -0.26 0.00 -2.02 0.00 0.00 63.50 61.92 1foo n PRO 68 Cb 0.00 -2.40 -0.07 0.00 -0.02 0.00 0.00 33.50 31.01 1foo n PRO 68 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1foo n LYS 69 N 0.08 2.71 -4.05 -0.52 5.02 -1.26 -4.85 118.16 115.29 1foo n LYS 69 Ca 0.06 -2.23 -0.08 0.00 -2.02 0.00 0.00 58.31 54.04 1foo n LYS 69 Cb 0.39 -2.22 -0.09 0.00 -0.02 0.00 0.00 35.03 33.09 1foo n LYS 69 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1foo s PHE 70 N -0.88 0.53 0.18 2.13 0.40 -1.26 -5.11 117.98 113.96 1foo s PHE 70 Ca 0.60 -1.00 -0.33 0.00 -0.60 0.00 0.00 56.93 55.60 1foo s PHE 70 Cb 0.33 -0.33 -0.14 0.00 0.51 0.00 0.00 43.02 43.39 1foo s PHE 70 CO -0.15 -0.47 1.52 -2.30 0.70 0.00 0.00 175.22 174.52 1foo n PRO 71 N 0.00 2.07 -3.26 0.24 -0.02 -1.26 -4.78 135.00 127.99 1foo n PRO 71 Ca -0.12 0.74 -0.40 0.00 -2.02 0.00 0.00 63.50 61.70 1foo n PRO 71 Cb 0.62 -2.48 -0.08 0.00 -0.02 0.00 0.00 33.50 31.54 1foo n PRO 71 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1foo s ARG 72 N 0.56 3.86 -0.18 -0.52 3.52 -1.26 -1.84 118.95 123.09 1foo s ARG 72 Ca 0.76 0.06 -0.06 0.00 -0.13 0.00 0.00 55.73 56.37 1foo s ARG 72 Cb -0.69 -3.72 -0.03 0.00 -1.56 0.00 0.00 34.95 28.95 1foo s ARG 72 CO 0.41 -0.47 0.02 0.08 -0.81 0.00 0.00 175.30 174.52 1foo s VAL 73 N 2.31 4.25 0.10 7.11 1.01 0.87 -4.98 120.40 131.08 1foo s VAL 73 Ca 0.19 -0.22 0.09 0.00 0.00 0.00 0.00 61.98 62.04 1foo s VAL 73 Cb -0.16 -2.91 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 1foo s VAL 73 CO 0.11 0.45 -0.19 -0.75 0.00 0.00 0.00 175.10 174.72 1foo s LYS 74 N 0.64 1.79 -0.29 2.72 2.20 -1.26 -1.16 119.74 124.38 1foo s LYS 74 Ca 0.01 -1.16 -0.02 0.00 -0.36 0.00 0.00 55.97 54.43 1foo s LYS 74 Cb -0.14 -2.10 0.04 0.00 -1.51 0.00 0.00 37.83 34.12 1foo s LYS 74 CO 0.02 0.49 -0.01 1.21 -0.36 0.00 0.00 175.35 176.69 1foo s ASN 75 N -2.00 4.76 0.10 1.43 3.84 -0.62 -1.24 114.94 121.21 1foo s ASN 75 Ca 0.17 -1.15 0.22 0.00 0.21 0.00 0.00 52.86 52.31 1foo s ASN 75 Cb -0.10 -1.71 0.88 0.00 -0.55 0.00 0.00 41.25 39.77 1foo s ASN 75 CO 0.09 -0.22 1.68 0.79 -2.79 0.00 0.00 177.10 176.65 1foo n TRP 76 N 4.65 0.36 0.01 0.43 7.02 -0.39 0.39 117.44 129.91 1foo n TRP 76 Ca -0.14 0.13 -0.20 0.00 -1.02 0.00 0.00 57.50 56.27 1foo n TRP 76 Cb 0.44 -0.70 -0.14 0.00 -2.42 0.00 0.00 31.31 28.49 1foo n TRP 76 CO 0.00 0.00 0.00 1.49 -2.02 0.00 0.00 177.69 177.16 1foo h GLU 77 N 0.00 0.23 0.00 -0.99 4.81 -1.95 -3.37 114.58 113.31 1foo h GLU 77 Ca 0.00 -0.39 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 1foo h GLU 77 Cb 0.41 0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1foo h GLU 77 CO 0.00 1.19 -1.17 1.28 -0.73 0.00 0.00 179.01 179.57 1foo n LEU 78 N -4.17 0.63 0.00 1.64 4.77 -1.19 -4.97 117.00 113.71 1foo n LEU 78 Ca -0.17 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.62 1foo n LEU 78 Cb 0.78 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.82 1foo n LEU 78 CO 0.43 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 1foo n GLY 79 N 1.40 0.34 3.87 -0.72 0.00 0.16 -5.00 105.19 105.25 1foo n GLY 79 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 1foo n GLY 79 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1foo s SER 80 N -2.09 6.40 0.05 1.61 1.04 -1.19 -4.86 113.70 114.67 1foo s SER 80 Ca 0.00 1.34 0.05 0.00 0.48 0.00 0.00 55.95 57.82 1foo s SER 80 Cb 0.00 -2.42 -0.02 0.00 0.10 0.00 0.00 66.02 63.67 1foo s SER 80 CO 0.00 -0.66 -0.14 -0.63 0.98 0.00 0.00 173.24 172.79 1foo s ILE 81 N -2.81 1.11 0.10 -1.02 -1.09 -1.26 -1.59 121.20 114.63 1foo s ILE 81 Ca 0.54 -1.10 -0.06 0.00 -2.23 0.00 0.00 60.65 57.80 1foo s ILE 81 Cb -0.10 -1.03 -0.02 0.00 -1.58 0.00 0.00 42.46 39.73 1foo s ILE 81 CO 0.42 -0.07 0.13 0.42 -1.23 0.00 0.00 174.94 174.61 1foo s THR 82 N -0.99 0.15 -0.05 2.92 -4.23 -0.31 -5.00 115.64 108.13 1foo s THR 82 Ca 0.00 -1.45 0.06 0.00 -1.18 0.00 0.00 61.69 59.12 1foo s THR 82 Cb -0.09 -1.54 -0.01 0.00 1.34 0.00 0.00 72.50 72.20 1foo s THR 82 CO 0.02 -0.66 -0.24 -0.31 -0.54 0.00 0.00 174.62 172.88 1foo s TYR 83 N -3.91 2.44 -0.41 3.99 1.51 -1.26 -0.09 117.35 119.61 1foo s TYR 83 Ca 0.09 -0.61 -0.17 0.00 -1.01 0.00 0.00 57.07 55.37 1foo s TYR 83 Cb 0.06 -1.58 0.02 0.00 -0.11 0.00 0.00 41.96 40.34 1foo s TYR 83 CO -0.08 -0.15 0.44 0.34 -1.11 0.00 0.00 175.55 175.00 1foo s ASP 84 N -0.30 6.20 -0.01 2.29 -1.08 -0.76 -4.71 116.67 118.30 1foo s ASP 84 Ca 0.01 -0.59 0.19 0.00 -0.52 0.00 0.00 52.55 51.64 1foo s ASP 84 Cb -0.13 -2.23 -0.24 0.00 -1.46 0.00 0.00 42.92 38.87 1foo s ASP 84 CO 0.02 -0.56 0.68 0.35 0.52 0.00 0.00 175.17 176.18 1foo n THR 85 N 5.43 0.00 0.18 1.71 -2.24 -0.59 -3.99 114.28 114.78 1foo n THR 85 Ca -0.07 -0.19 0.03 0.00 -2.27 0.00 0.00 64.05 61.55 1foo n THR 85 Cb 0.48 0.68 0.37 0.00 -2.10 0.00 0.00 70.33 69.75 1foo n THR 85 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1foo h LEU 86 N 0.00 0.02 -2.83 3.22 5.85 -1.69 -2.53 115.31 117.35 1foo h LEU 86 Ca 0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1foo h LEU 86 Cb 0.60 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.63 1foo h LEU 86 CO 0.00 0.36 0.00 0.00 -0.34 0.00 0.00 178.44 178.46 1foo h ALA 88 N 2.00 1.00 -0.00 0.00 0.00 -1.75 -2.11 119.26 118.40 1foo h ALA 88 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1foo h ALA 88 Cb 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1foo h ALA 88 CO 0.00 0.00 -0.20 1.04 0.00 0.00 0.00 179.25 180.09 1foo n GLN 89 N -3.09 0.48 -2.11 0.00 1.13 0.21 -4.89 117.38 109.10 1foo n GLN 89 Ca -0.01 -0.20 -0.42 0.00 -1.94 0.00 0.00 57.00 54.43 1foo n GLN 89 Cb 0.20 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 29.03 1foo n GLN 89 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1foo s SER 90 N -2.66 6.77 0.00 1.08 0.15 -0.80 -4.91 113.70 113.34 1foo s SER 90 Ca 0.22 2.38 0.06 0.00 0.70 0.00 0.00 55.95 59.31 1foo s SER 90 Cb 0.19 -2.58 0.17 0.00 -1.71 0.00 0.00 66.02 62.09 1foo s SER 90 CO 0.54 -0.71 1.13 0.00 1.20 0.00 0.00 173.24 175.40 1foo n GLN 91 N 4.17 2.84 -3.97 5.44 6.02 -1.26 -4.96 117.38 125.67 1foo n GLN 91 Ca 0.12 -1.78 -0.26 0.00 -0.01 0.00 0.00 57.00 55.07 1foo n GLN 91 Cb 0.42 -1.15 -0.17 0.00 1.02 0.00 0.00 30.24 30.36 1foo n GLN 91 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1foo s GLN 92 N -0.99 1.36 0.42 -1.09 -0.21 -1.26 -5.13 119.66 112.77 1foo s GLN 92 Ca 0.13 -0.21 -0.25 0.00 0.02 0.00 0.00 55.36 55.06 1foo s GLN 92 Cb 0.07 -1.43 -0.08 0.00 1.00 0.00 0.00 33.01 32.56 1foo s GLN 92 CO 0.09 -0.23 1.22 -0.51 -2.12 0.00 0.00 175.29 173.74 1foo s ASP 93 N 1.60 6.31 0.25 5.90 1.01 -1.26 -4.38 116.67 126.10 1foo s ASP 93 Ca 0.02 2.46 0.00 0.00 0.71 0.00 0.00 52.55 55.74 1foo s ASP 93 Cb -0.13 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.18 1foo s ASP 93 CO -0.06 -0.83 0.00 0.61 0.21 0.00 0.00 175.17 175.10 1foo n GLY 94 N 0.62 0.94 0.05 0.21 0.00 -1.26 -4.79 105.19 100.97 1foo n GLY 94 Ca 0.05 -1.96 0.12 0.00 0.00 0.00 0.00 46.02 44.24 1foo n GLY 94 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1foo n PRO 95 N -0.76 0.20 -2.15 1.61 -0.04 -1.26 -4.96 135.00 127.64 1foo n PRO 95 Ca 0.00 0.09 -0.29 0.00 -0.04 0.00 0.00 63.50 63.26 1foo n PRO 95 Cb 0.00 -1.66 0.03 0.00 -0.04 0.00 0.00 33.50 31.83 1foo n PRO 95 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1foo s THR 97 N -3.11 0.08 0.61 0.00 -4.23 -1.00 -5.02 115.64 102.97 1foo s THR 97 Ca 0.54 -1.10 0.32 0.00 -1.18 0.00 0.00 61.69 60.27 1foo s THR 97 Cb -0.11 -1.57 0.37 0.00 1.34 0.00 0.00 72.50 72.53 1foo s THR 97 CO 0.49 -0.35 2.15 -0.65 -0.54 0.00 0.00 174.62 175.72 1foo h PRO 98 N 2.50 0.00 -0.16 3.99 0.11 -2.05 -2.30 132.00 134.09 1foo h PRO 98 Ca -0.32 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.63 1foo h PRO 98 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1foo h PRO 98 CO 0.48 0.00 -0.51 0.00 -0.21 0.00 0.00 178.00 177.76 1foo h ARG 99 N 0.00 0.62 -2.39 1.05 2.47 -2.02 -3.47 114.38 110.64 1foo h ARG 99 Ca 0.05 -0.46 -0.08 0.00 -1.26 0.00 0.00 59.98 58.23 1foo h ARG 99 Cb 0.35 0.08 -0.20 0.00 -1.65 0.00 0.00 29.97 28.55 1foo h ARG 99 CO -0.00 1.08 -0.01 -0.98 0.56 0.00 0.00 179.97 180.62 1foo s ARG 100 N -3.86 0.82 -0.20 0.04 3.03 -0.87 -5.15 118.95 112.77 1foo s ARG 100 Ca -0.12 0.33 -0.15 0.00 2.03 0.00 0.00 55.73 57.82 1foo s ARG 100 Cb 0.07 0.39 -0.04 0.00 -1.03 0.00 0.00 34.95 34.34 1foo s ARG 100 CO 0.84 -0.20 0.37 0.00 -1.13 0.00 0.00 175.30 175.18 1foo n LEU 102 N 4.44 3.61 0.27 0.00 4.77 -1.26 -4.78 117.00 124.05 1foo n LEU 102 Ca -0.09 -3.69 0.15 0.00 -0.03 0.00 0.00 56.01 52.35 1foo n LEU 102 Cb 0.51 -0.59 0.88 0.00 -2.33 0.00 0.00 43.42 41.90 1foo n LEU 102 CO 0.39 1.20 1.13 1.23 -1.33 0.00 0.00 177.39 180.01 1foo h GLY 103 N 1.00 0.00 1.87 -0.72 0.00 -1.94 -2.42 103.07 100.87 1foo h GLY 103 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1foo h GLY 103 CO 0.25 0.00 -0.07 -1.14 0.00 0.00 0.00 176.54 175.57 1foo n SER 104 N -3.89 0.30 -4.70 0.19 3.41 -1.26 -4.85 113.62 102.82 1foo n SER 104 Ca -0.02 0.44 -0.42 0.00 -0.26 0.00 0.00 58.87 58.61 1foo n SER 104 Cb 0.14 -0.49 -0.03 0.00 -0.26 0.00 0.00 64.21 63.57 1foo n SER 104 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1foo s LEU 105 N -3.47 4.36 0.03 1.04 1.02 -0.91 -4.91 118.68 115.84 1foo s LEU 105 Ca 0.12 2.47 -0.21 0.00 0.02 0.00 0.00 54.13 56.54 1foo s LEU 105 Cb 0.17 -3.58 -0.15 0.00 0.02 0.00 0.00 46.19 42.65 1foo s LEU 105 CO 0.57 -0.81 1.32 0.58 0.02 0.00 0.00 176.35 178.03 1foo h VAL 106 N 4.42 1.36 -2.97 -1.59 2.07 -1.90 -3.39 116.25 114.25 1foo h VAL 106 Ca -0.42 -1.34 -0.62 0.00 0.82 0.00 0.00 66.70 65.15 1foo h VAL 106 Cb 1.20 1.95 -0.41 0.00 -1.52 0.00 0.00 31.29 32.51 1foo h VAL 106 CO 0.91 0.39 -0.65 -0.76 0.02 0.00 0.00 177.57 177.48 1foo s LEU 107 N -9.07 4.14 0.04 2.57 1.43 -1.26 -5.09 118.68 111.44 1foo s LEU 107 Ca -0.14 -3.64 -0.26 0.00 -1.03 0.00 0.00 54.13 49.06 1foo s LEU 107 Cb 0.05 -1.41 -0.05 0.00 0.03 0.00 0.00 46.19 44.81 1foo s LEU 107 CO 0.75 -0.11 0.80 -2.16 0.23 0.00 0.00 176.35 175.86 1foo s PRO 108 N -1.08 4.52 -0.12 1.29 0.04 -1.26 -4.90 135.00 133.49 1foo s PRO 108 Ca 0.26 1.13 -0.20 0.00 0.04 0.00 0.00 61.00 62.22 1foo s PRO 108 Cb -0.05 -3.38 -0.23 0.00 0.04 0.00 0.00 34.50 30.88 1foo s PRO 108 CO -0.16 0.24 1.48 0.54 0.04 0.00 0.00 177.00 179.14 1foo n ARG 109 N 2.94 0.26 0.00 4.56 5.12 -1.26 -4.19 116.66 124.09 1foo n ARG 109 Ca -0.01 -0.96 0.00 0.00 -1.93 0.00 0.00 57.85 54.94 1foo n ARG 109 Cb 0.50 -2.40 0.00 0.00 -1.16 0.00 0.00 32.46 29.41 1foo n ARG 109 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1foo n LYS 110 N 6.84 0.00 -0.29 5.56 4.76 -1.26 -4.88 118.16 128.89 1foo n LYS 110 Ca 0.34 0.00 0.03 0.00 -2.87 0.00 0.00 58.31 55.81 1foo n LYS 110 Cb 0.28 0.00 0.17 0.00 -1.84 0.00 0.00 35.03 33.65 1foo n LYS 110 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1foo h LEU 111 N 0.00 0.67 0.00 -0.35 4.07 -1.87 -3.45 115.31 114.38 1foo h LEU 111 Ca 0.00 0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.01 1foo h LEU 111 Cb 0.00 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 41.66 1foo h LEU 111 CO 0.00 0.37 0.00 1.67 -1.08 0.00 0.00 178.44 179.40 1foo n GLN 112 N -4.75 0.00 -1.50 1.13 -0.06 -1.26 -4.70 117.38 106.23 1foo n GLN 112 Ca 0.14 0.00 -0.41 0.00 -2.00 0.00 0.00 57.00 54.73 1foo n GLN 112 Cb 0.29 0.00 -0.02 0.00 -4.06 0.00 0.00 30.24 26.46 1foo n GLN 112 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 1foo n THR 113 N 0.00 3.23 -1.67 1.69 -2.24 -0.79 -4.96 114.28 109.54 1foo n THR 113 Ca 0.00 -2.60 -0.44 0.00 -2.27 0.00 0.00 64.05 58.74 1foo n THR 113 Cb 0.00 -2.53 -0.02 0.00 -2.10 0.00 0.00 70.33 65.68 1foo n THR 113 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1foo n ARG 114 N 5.77 2.00 -1.48 -0.78 3.00 -1.26 -4.37 116.66 119.54 1foo n ARG 114 Ca 0.55 0.71 -0.44 0.00 -0.00 0.00 0.00 57.85 58.67 1foo n ARG 114 Cb 0.35 -2.31 -0.08 0.00 0.00 0.00 0.00 32.46 30.42 1foo n ARG 114 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 1foo n PRO 115 N 1.38 0.72 -3.22 -0.14 -0.02 -1.26 -4.86 135.00 127.60 1foo n PRO 115 Ca 0.09 0.12 -0.45 0.00 -2.02 0.00 0.00 63.50 61.23 1foo n PRO 115 Cb 0.33 -2.42 -0.01 0.00 -0.02 0.00 0.00 33.50 31.39 1foo n PRO 115 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1foo s SER 116 N 9.06 7.05 0.00 2.55 1.04 -1.26 -4.96 113.70 127.17 1foo s SER 116 Ca 1.14 -3.07 0.00 0.00 0.48 0.00 0.00 55.95 54.51 1foo s SER 116 Cb -0.82 -2.27 0.00 0.00 0.10 0.00 0.00 66.02 63.04 1foo s SER 116 CO 0.44 -0.54 0.52 -2.65 0.98 0.00 0.00 173.24 171.99 1foo n PRO 117 N 4.03 0.00 -1.54 4.02 -0.02 -1.26 -4.66 135.00 135.57 1foo n PRO 117 Ca 0.24 0.32 -0.47 0.00 -2.02 0.00 0.00 63.50 61.57 1foo n PRO 117 Cb 0.43 -1.02 -0.03 0.00 -0.02 0.00 0.00 33.50 32.87 1foo n PRO 117 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1foo n GLY 118 N -0.81 -0.56 3.45 -1.23 0.00 -1.26 -3.84 105.19 100.94 1foo n GLY 118 Ca 0.00 0.40 -0.45 0.00 0.00 0.00 0.00 46.02 45.97 1foo n GLY 118 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1foo n PRO 119 N 1.08 0.49 -2.39 1.61 -0.02 -1.26 -4.91 135.00 129.59 1foo n PRO 119 Ca 0.13 0.17 -0.39 0.00 -2.02 0.00 0.00 63.50 61.40 1foo n PRO 119 Cb 0.28 -1.35 -0.03 0.00 -0.02 0.00 0.00 33.50 32.38 1foo n PRO 119 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1foo s PRO 120 N -1.30 4.29 -0.44 0.52 0.04 -1.26 -4.89 135.00 131.96 1foo s PRO 120 Ca 0.62 1.78 -0.38 0.00 0.04 0.00 0.00 61.00 63.06 1foo s PRO 120 Cb -0.74 -2.84 -0.15 0.00 0.04 0.00 0.00 34.50 30.80 1foo s PRO 120 CO 0.58 -0.10 2.20 -2.30 0.04 0.00 0.00 177.00 177.43 1foo n PRO 121 N 0.46 0.60 -0.41 0.56 -0.02 -1.26 -4.76 135.00 130.17 1foo n PRO 121 Ca 0.02 0.15 0.39 0.00 -2.02 0.00 0.00 63.50 62.04 1foo n PRO 121 Cb 0.46 -2.06 0.76 0.00 -0.02 0.00 0.00 33.50 32.64 1foo n PRO 121 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1foo h ALA 122 N 11.20 3.24 -0.21 3.55 0.00 -1.90 0.28 119.26 135.43 1foo h ALA 122 Ca -0.19 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.52 1foo h ALA 122 Cb 1.36 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.25 1foo h ALA 122 CO 1.07 -1.64 -0.48 1.49 0.00 0.00 0.00 179.25 179.69 1foo h GLU 123 N 0.02 0.69 -0.28 0.00 4.81 -1.99 -1.30 114.58 116.52 1foo h GLU 123 Ca 0.65 -0.46 -0.19 0.00 -0.13 0.00 0.00 59.36 59.23 1foo h GLU 123 Cb 2.57 0.07 0.00 0.00 0.63 0.00 0.00 28.75 32.01 1foo h GLU 123 CO -0.03 1.08 -0.55 0.37 -0.73 0.00 0.00 179.01 179.16 1foo h GLN 124 N 0.39 0.86 -0.51 1.92 4.15 -0.87 -2.69 115.11 118.35 1foo h GLN 124 Ca -0.00 -0.55 -0.07 0.00 0.77 0.00 0.00 58.65 58.81 1foo h GLN 124 Cb 1.09 0.07 -0.02 0.00 0.21 0.00 0.00 27.48 28.82 1foo h GLN 124 CO 0.10 1.18 0.06 1.25 -1.93 0.00 0.00 178.83 179.49 1foo h LEU 125 N 0.66 0.84 -0.06 -2.39 5.85 -1.18 -2.40 115.31 116.62 1foo h LEU 125 Ca 0.01 -0.28 0.01 0.00 0.84 0.00 0.00 57.88 58.47 1foo h LEU 125 Cb 1.16 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 1foo h LEU 125 CO 0.12 0.90 0.01 0.25 -0.34 0.00 0.00 178.44 179.38 1foo h LEU 126 N 0.75 -0.01 -1.00 2.25 7.12 -1.21 0.27 115.31 123.47 1foo h LEU 126 Ca 0.15 0.01 -0.01 0.00 0.13 0.00 0.00 57.88 58.16 1foo h LEU 126 Cb 0.44 0.02 -0.04 0.00 -0.53 0.00 0.00 40.66 40.54 1foo h LEU 126 CO 0.01 0.01 0.51 0.77 -0.13 0.00 0.00 178.44 179.61 1foo h SER 127 N 0.03 1.07 -0.41 1.25 4.64 -1.44 0.33 113.55 119.02 1foo h SER 127 Ca 0.03 -0.07 -0.11 0.00 -0.47 0.00 0.00 61.79 61.16 1foo h SER 127 Cb 0.03 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 61.83 1foo h SER 127 CO -0.04 0.83 -0.14 1.56 -0.87 0.00 0.00 176.83 178.18 1foo h GLN 128 N 1.22 0.89 -0.29 4.77 4.20 -1.03 -1.29 115.11 123.57 1foo h GLN 128 Ca 0.31 -0.32 -0.06 0.00 0.06 0.00 0.00 58.65 58.64 1foo h GLN 128 Cb -0.02 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 1foo h GLN 128 CO -0.06 0.97 -0.04 0.00 -0.67 0.00 0.00 178.83 179.03 1foo h ALA 129 N 1.05 0.40 -0.73 3.87 0.00 0.42 -2.06 119.26 122.20 1foo h ALA 129 Ca 0.12 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1foo h ALA 129 Cb 0.66 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1foo h ALA 129 CO 0.05 0.18 0.28 0.00 0.00 0.00 0.00 179.25 179.76 1foo h ARG 130 N 0.31 1.09 -0.09 0.00 3.08 -0.25 -0.79 114.38 117.72 1foo h ARG 130 Ca 0.08 -0.20 0.01 0.00 0.07 0.00 0.00 59.98 59.94 1foo h ARG 130 Cb 0.50 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 1foo h ARG 130 CO 0.02 0.89 0.03 0.22 -1.07 0.00 0.00 179.97 180.07 1foo h ASP 131 N 1.06 0.04 -0.39 7.04 3.58 -1.10 -1.23 116.42 125.43 1foo h ASP 131 Ca 0.24 0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.68 1foo h ASP 131 Cb 0.22 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.26 1foo h ASP 131 CO -0.02 0.04 0.16 0.15 -2.88 0.00 0.00 179.24 176.69 1foo h PHE 132 N 0.08 0.59 -0.44 0.28 3.57 -1.00 -1.45 116.94 118.57 1foo h PHE 132 Ca 0.04 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1foo h PHE 132 Cb 0.02 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.56 1foo h PHE 132 CO -0.09 0.52 0.24 0.82 -2.23 0.00 0.00 178.31 177.57 1foo h ILE 133 N 0.48 1.13 -0.48 1.41 1.08 -1.01 0.13 117.51 120.26 1foo h ILE 133 Ca 0.13 -0.33 -0.09 0.00 -0.39 0.00 0.00 64.86 64.18 1foo h ILE 133 Cb 0.18 0.54 -0.02 0.00 -3.07 0.00 0.00 36.82 34.45 1foo h ILE 133 CO -0.01 0.15 -0.06 0.78 -0.69 0.00 0.00 178.15 178.32 1foo h ASN 134 N 0.60 0.88 -0.63 1.72 2.35 -0.85 -0.38 115.58 119.27 1foo h ASN 134 Ca 0.16 -0.34 -0.01 0.00 -0.55 0.00 0.00 56.30 55.56 1foo h ASN 134 Cb 0.01 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.11 1foo h ASN 134 CO -0.03 1.01 0.36 1.56 -1.65 0.00 0.00 177.43 178.68 1foo h GLN 135 N 0.73 0.87 -0.04 0.81 4.20 -0.17 0.07 115.11 121.57 1foo h GLN 135 Ca 0.13 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 1foo h GLN 135 Cb 0.59 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.20 1foo h GLN 135 CO 0.04 0.64 0.02 -0.92 -0.67 0.00 0.00 178.83 177.93 1foo h TYR 136 N 0.85 0.06 0.00 2.96 3.20 -0.50 -1.07 116.97 122.46 1foo h TYR 136 Ca 0.22 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.04 1foo h TYR 136 Cb 0.02 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 1foo h TYR 136 CO -0.01 0.19 -0.22 1.88 -1.64 0.00 0.00 178.16 178.35 1foo h TYR 137 N -0.09 0.00 -0.23 -3.82 -1.99 -0.91 -2.33 116.97 107.61 1foo h TYR 137 Ca 0.01 0.00 -0.18 0.00 2.00 0.00 0.00 58.73 60.57 1foo h TYR 137 Cb 0.15 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.89 1foo h TYR 137 CO -0.02 0.22 -0.54 0.77 -0.00 0.00 0.00 178.16 178.59 1foo h SER 138 N 0.00 0.87 -0.10 3.88 0.02 -0.77 0.72 113.55 118.17 1foo h SER 138 Ca -0.00 -0.56 -0.02 0.00 -0.84 0.00 0.00 61.79 60.37 1foo h SER 138 Cb 0.57 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 1foo h SER 138 CO 0.03 1.28 0.02 0.77 -1.14 0.00 0.00 176.83 177.78 1foo h SER 139 N 0.51 0.21 -0.65 3.07 4.64 -0.67 -1.05 113.55 119.61 1foo h SER 139 Ca -0.00 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1foo h SER 139 Cb 1.16 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1foo h SER 139 CO 0.12 0.25 0.00 2.30 -0.87 0.00 0.00 176.83 178.63 1foo n ILE 140 N -4.41 1.99 -3.73 0.95 -5.35 -0.98 -4.97 119.36 102.86 1foo n ILE 140 Ca -0.00 -1.23 -0.22 0.00 -0.27 0.00 0.00 62.75 61.02 1foo n ILE 140 Cb 0.16 0.07 0.03 0.00 -1.74 0.00 0.00 39.64 38.15 1foo n ILE 140 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1foo n LYS 141 N 1.09 -4.94 -1.45 6.28 4.76 -0.40 -4.90 118.16 118.60 1foo n LYS 141 Ca 0.27 0.61 0.04 0.00 -2.87 0.00 0.00 58.31 56.36 1foo n LYS 141 Cb 0.95 -5.19 0.03 0.00 -1.84 0.00 0.00 35.03 28.98 1foo n LYS 141 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1foo n ARG 142 N -4.32 0.09 -2.05 1.97 5.12 0.21 -5.03 116.66 112.64 1foo n ARG 142 Ca -0.27 -2.07 -0.42 0.00 -1.93 0.00 0.00 57.85 53.16 1foo n ARG 142 Cb 0.66 -0.09 -0.03 0.00 -1.16 0.00 0.00 32.46 31.84 1foo n ARG 142 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1foo s SER 143 N -2.07 6.71 0.00 0.55 0.15 -1.13 -1.87 113.70 116.05 1foo s SER 143 Ca 0.34 2.40 0.00 0.00 0.70 0.00 0.00 55.95 59.40 1foo s SER 143 Cb 0.39 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 62.12 1foo s SER 143 CO -0.16 -0.77 0.00 0.61 1.20 0.00 0.00 173.24 174.12 1foo n GLY 144 N 3.72 2.04 3.53 9.45 0.00 -1.26 -5.05 105.19 117.61 1foo n GLY 144 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 1foo n GLY 144 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1foo s SER 145 N -1.81 1.24 0.28 1.61 1.04 -0.78 -4.78 113.70 110.50 1foo s SER 145 Ca 0.00 1.42 0.02 0.00 0.48 0.00 0.00 55.95 57.86 1foo s SER 145 Cb 0.00 -2.19 0.39 0.00 0.10 0.00 0.00 66.02 64.33 1foo s SER 145 CO 0.00 -4.02 1.72 -0.61 0.98 0.00 0.00 173.24 171.31 1foo h GLN 146 N -2.50 0.53 -0.32 4.02 4.15 -1.97 -2.41 115.11 116.60 1foo h GLN 146 Ca -0.61 -0.19 -0.08 0.00 0.77 0.00 0.00 58.65 58.54 1foo h GLN 146 Cb 1.34 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.97 1foo h GLN 146 CO 0.52 0.72 -0.14 0.00 -1.93 0.00 0.00 178.83 178.00 1foo h ALA 147 N 1.29 1.15 0.02 3.38 0.00 -1.91 -1.72 119.26 121.47 1foo h ALA 147 Ca 0.07 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1foo h ALA 147 Cb 0.65 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1foo h ALA 147 CO 0.05 0.54 -0.01 1.25 0.00 0.00 0.00 179.25 181.07 1foo h HIS 148 N 0.52 -0.02 -0.13 0.00 -0.00 -1.71 -0.92 115.15 112.89 1foo h HIS 148 Ca 0.09 -0.00 -0.08 0.00 -0.00 0.00 0.00 60.37 60.38 1foo h HIS 148 Cb 0.55 0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 27.95 1foo h HIS 148 CO 0.02 0.32 -0.30 0.93 -0.00 0.00 0.00 177.93 178.90 1foo h GLU 149 N -0.37 0.24 -0.13 5.26 4.39 -1.41 -1.26 114.58 121.30 1foo h GLU 149 Ca -0.00 -0.09 -0.20 0.00 0.34 0.00 0.00 59.36 59.41 1foo h GLU 149 Cb 0.35 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.99 1foo h GLU 149 CO 0.00 0.52 -0.74 0.93 -1.16 0.00 0.00 179.01 178.57 1foo h GLU 150 N 0.21 0.63 -0.40 2.33 5.08 -1.29 -1.84 114.58 119.30 1foo h GLU 150 Ca 0.03 -0.50 -0.09 0.00 -1.00 0.00 0.00 59.36 57.80 1foo h GLU 150 Cb 0.64 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 1foo h GLU 150 CO 0.05 1.12 -0.13 -0.09 -1.00 0.00 0.00 179.01 178.96 1foo h ARG 151 N 0.43 0.72 -0.65 2.33 9.65 -0.90 -0.34 114.38 125.63 1foo h ARG 151 Ca -0.04 -0.24 -0.07 0.00 -1.10 0.00 0.00 59.98 58.53 1foo h ARG 151 Cb 1.34 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 29.83 1foo h ARG 151 CO 0.14 0.82 0.12 -0.07 2.80 0.00 0.00 179.97 183.79 1foo h LEU 152 N 0.65 1.01 -0.60 3.80 3.38 -1.10 -1.54 115.31 120.90 1foo h LEU 152 Ca 0.11 -0.23 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 1foo h LEU 152 Cb 0.59 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1foo h LEU 152 CO 0.04 0.99 -0.23 1.56 0.09 0.00 0.00 178.44 180.89 1foo h GLN 153 N 1.00 0.86 -0.62 1.13 1.08 -0.86 -2.05 115.11 115.65 1foo h GLN 153 Ca 0.20 -0.36 -0.07 0.00 -1.45 0.00 0.00 58.65 56.97 1foo h GLN 153 Cb 0.40 -0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 27.78 1foo h GLN 153 CO 0.01 1.00 0.10 1.49 -0.95 0.00 0.00 178.83 180.48 1foo h GLU 154 N 0.74 1.01 -0.09 1.46 4.81 -0.80 -0.70 114.58 121.02 1foo h GLU 154 Ca 0.10 -0.26 -0.03 0.00 -0.13 0.00 0.00 59.36 59.04 1foo h GLU 154 Cb 0.77 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.03 1foo h GLU 154 CO 0.06 0.94 -0.05 0.28 -0.73 0.00 0.00 179.01 179.51 1foo h VAL 155 N 0.95 1.33 -0.57 0.32 2.07 -1.14 -1.08 116.25 118.13 1foo h VAL 155 Ca 0.19 -1.08 -0.01 0.00 0.82 0.00 0.00 66.70 66.62 1foo h VAL 155 Cb 0.42 1.85 -0.03 0.00 -1.52 0.00 0.00 31.29 32.01 1foo h VAL 155 CO 0.01 0.30 0.30 -0.33 0.02 0.00 0.00 177.57 177.88 1foo h GLU 156 N -0.17 0.79 0.02 1.57 5.08 -1.30 -1.48 114.58 119.09 1foo h GLU 156 Ca 0.02 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1foo h GLU 156 Cb 0.51 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1foo h GLU 156 CO 0.01 0.59 -0.01 0.00 -1.00 0.00 0.00 179.01 178.60 1foo h ALA 157 N 1.54 -0.03 -0.89 3.43 0.00 -1.05 -0.98 119.26 121.28 1foo h ALA 157 Ca 0.20 -0.22 0.08 0.00 0.00 0.00 0.00 54.91 54.97 1foo h ALA 157 Cb 0.04 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 1foo h ALA 157 CO -0.03 -0.30 0.57 1.49 0.00 0.00 0.00 179.25 180.99 1foo h GLU 158 N -0.47 0.92 -0.09 0.00 4.81 -0.93 -0.50 114.58 118.32 1foo h GLU 158 Ca -0.00 -0.06 -0.17 0.00 -0.13 0.00 0.00 59.36 59.00 1foo h GLU 158 Cb 0.45 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 1foo h GLU 158 CO 0.00 0.61 -0.68 0.28 -0.73 0.00 0.00 179.01 178.49 1foo h VAL 159 N 0.94 1.37 -0.43 0.32 2.07 -1.09 -1.34 116.25 118.10 1foo h VAL 159 Ca 0.39 -2.06 0.03 0.00 0.82 0.00 0.00 66.70 65.88 1foo h VAL 159 Cb 0.30 2.04 -0.03 0.00 -1.52 0.00 0.00 31.29 32.08 1foo h VAL 159 CO -0.16 0.62 0.24 0.00 0.02 0.00 0.00 177.57 178.29 1foo h ALA 160 N 0.99 0.55 0.00 1.67 0.00 0.31 0.33 119.26 123.11 1foo h ALA 160 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1foo h ALA 160 Cb 1.23 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1foo h ALA 160 CO 0.12 -0.10 -1.11 -1.13 0.00 0.00 0.00 179.25 177.03 1foo n SER 161 N -4.87 0.62 0.00 0.00 3.41 -0.81 -4.54 113.62 107.43 1foo n SER 161 Ca 0.02 0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 1foo n SER 161 Cb 0.08 0.76 0.00 0.00 -0.26 0.00 0.00 64.21 64.79 1foo n SER 161 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1foo n THR 162 N -2.29 0.00 0.00 6.66 -2.24 -0.51 -5.02 114.28 110.89 1foo n THR 162 Ca 0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1foo n THR 162 Cb 0.50 0.34 0.00 0.00 -2.10 0.00 0.00 70.33 69.07 1foo n THR 162 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1foo n GLY 163 N 2.41 1.39 1.62 3.38 0.00 0.12 -4.99 105.19 109.11 1foo n GLY 163 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1foo n GLY 163 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1foo n THR 164 N -2.00 0.00 -3.99 2.61 5.66 -1.26 -4.87 114.28 110.43 1foo n THR 164 Ca 0.00 -1.01 -0.13 0.00 -3.05 0.00 0.00 64.05 59.86 1foo n THR 164 Cb 0.00 0.56 -0.02 0.00 -1.55 0.00 0.00 70.33 69.33 1foo n THR 164 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1foo s TYR 165 N -3.42 0.73 0.11 1.09 -0.85 -1.26 -2.76 117.35 110.98 1foo s TYR 165 Ca 0.17 -1.11 0.05 0.00 -0.52 0.00 0.00 57.07 55.66 1foo s TYR 165 Cb 0.00 0.24 -0.04 0.00 0.38 0.00 0.00 41.96 42.55 1foo s TYR 165 CO 0.12 -1.29 -0.13 -1.01 -1.52 0.00 0.00 175.55 171.72 1foo s HIS 166 N -2.82 1.30 0.05 -3.49 3.76 -1.26 -5.04 115.29 107.79 1foo s HIS 166 Ca 0.25 -0.55 -0.06 0.00 -0.15 0.00 0.00 55.06 54.54 1foo s HIS 166 Cb -0.02 -0.69 -0.05 0.00 1.11 0.00 0.00 32.58 32.93 1foo s HIS 166 CO 0.17 0.10 0.31 -0.51 -0.85 0.00 0.00 174.74 173.96 1foo s LEU 167 N -2.30 4.35 0.70 0.89 1.43 -1.26 -5.05 118.68 117.44 1foo s LEU 167 Ca 0.06 0.58 -0.11 0.00 -1.03 0.00 0.00 54.13 53.64 1foo s LEU 167 Cb -0.06 -2.87 0.01 0.00 0.03 0.00 0.00 46.19 43.31 1foo s LEU 167 CO 0.02 0.19 1.06 -0.13 0.23 0.00 0.00 176.35 177.73 1foo s ARG 168 N -2.01 2.86 0.13 1.70 0.52 -1.26 -4.83 118.95 116.05 1foo s ARG 168 Ca 0.32 0.99 -0.29 0.00 -0.52 0.00 0.00 55.73 56.22 1foo s ARG 168 Cb -0.13 -1.98 -0.05 0.00 0.52 0.00 0.00 34.95 33.31 1foo s ARG 168 CO 0.19 -1.16 1.58 1.49 0.02 0.00 0.00 175.30 177.42 1foo h GLU 169 N -0.76 -0.46 0.00 3.54 4.81 -2.00 -1.72 114.58 117.99 1foo h GLU 169 Ca -0.44 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 58.82 1foo h GLU 169 Cb 1.21 0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.70 1foo h GLU 169 CO 0.56 -0.30 -0.03 0.66 -0.73 0.00 0.00 179.01 179.16 1foo h SER 170 N -0.47 0.00 -0.34 1.04 4.64 -1.99 -1.26 113.55 115.16 1foo h SER 170 Ca 0.08 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.23 1foo h SER 170 Cb 0.62 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1foo h SER 170 CO -0.41 0.03 -0.45 -0.33 -0.87 0.00 0.00 176.83 174.80 1foo h GLU 171 N 0.00 0.92 -0.43 4.77 5.08 -1.71 -1.47 114.58 121.73 1foo h GLU 171 Ca -0.00 -0.52 -0.02 0.00 -1.00 0.00 0.00 59.36 57.82 1foo h GLU 171 Cb 0.06 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1foo h GLU 171 CO 0.00 1.17 0.21 1.25 -1.00 0.00 0.00 179.01 180.64 1foo h LEU 172 N 0.73 0.56 -0.52 1.33 5.85 -0.42 0.17 115.31 123.02 1foo h LEU 172 Ca 0.04 -0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.64 1foo h LEU 172 Cb 1.06 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.92 1foo h LEU 172 CO 0.11 0.53 0.34 0.58 -0.34 0.00 0.00 178.44 179.66 1foo h VAL 173 N 0.55 1.12 -0.16 1.05 2.07 -1.29 0.56 116.25 120.15 1foo h VAL 173 Ca 0.15 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 1foo h VAL 173 Cb 0.12 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 1foo h VAL 173 CO -0.02 0.13 0.08 0.15 0.02 0.00 0.00 177.57 177.92 1foo h PHE 174 N 0.69 0.24 -0.69 1.57 3.57 -0.89 -2.52 116.94 118.91 1foo h PHE 174 Ca 0.19 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.62 1foo h PHE 174 Cb -0.07 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.57 1foo h PHE 174 CO -0.04 0.28 0.20 0.78 -2.23 0.00 0.00 178.31 177.30 1foo h GLY 175 N 0.13 1.15 0.94 2.40 0.00 -0.37 -0.99 103.07 106.33 1foo h GLY 175 Ca 0.06 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 46.67 1foo h GLY 175 CO -0.01 0.63 0.07 0.00 0.00 0.00 0.00 176.54 177.23 1foo h ALA 176 N 1.19 0.54 -0.69 3.60 0.00 -0.85 -1.70 119.26 121.36 1foo h ALA 176 Ca 0.22 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1foo h ALA 176 Cb 0.30 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1foo h ALA 176 CO -0.01 0.24 0.14 0.87 0.00 0.00 0.00 179.25 180.50 1foo h LYS 177 N 0.52 1.12 -0.58 0.00 1.57 -1.25 -2.74 116.57 115.20 1foo h LYS 177 Ca 0.12 -0.28 -0.05 0.00 -1.87 0.00 0.00 60.65 58.58 1foo h LYS 177 Cb 0.36 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 1foo h LYS 177 CO 0.01 1.00 0.17 1.96 -0.57 0.00 0.00 179.45 182.01 1foo h GLN 178 N 1.05 0.88 -0.68 3.15 1.08 -1.03 -0.51 115.11 119.05 1foo h GLN 178 Ca 0.21 -0.17 0.01 0.00 -1.45 0.00 0.00 58.65 57.25 1foo h GLN 178 Cb 0.40 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.66 1foo h GLN 178 CO 0.01 0.77 0.45 0.00 -0.95 0.00 0.00 178.83 179.10 1foo h ALA 179 N 1.33 0.86 0.00 3.87 0.00 -1.02 0.41 119.26 124.72 1foo h ALA 179 Ca 0.19 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1foo h ALA 179 Cb 0.27 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1foo h ALA 179 CO -0.01 0.30 -0.00 2.35 0.00 0.00 0.00 179.25 181.89 1foo h TRP 180 N 0.92 -0.00 -0.95 0.00 7.01 -1.23 -2.15 115.95 119.56 1foo h TRP 180 Ca 0.25 -0.00 0.18 0.00 2.11 0.00 0.00 58.89 61.43 1foo h TRP 180 Cb -0.10 0.00 -0.08 0.00 -2.10 0.00 0.00 29.16 26.88 1foo h TRP 180 CO -0.02 0.33 0.60 -0.09 -2.79 0.00 0.00 178.44 176.47 1foo h ARG 181 N -0.34 0.63 0.00 2.65 2.43 -0.63 -1.18 114.38 117.94 1foo h ARG 181 Ca -0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1foo h ARG 181 Cb 0.34 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 1foo h ARG 181 CO 0.00 0.42 -0.14 0.09 -1.51 0.00 0.00 179.97 178.83 1foo n ASN 182 N -4.62 0.48 -4.57 -3.80 3.02 0.14 -4.86 115.26 101.05 1foo n ASN 182 Ca 0.20 0.40 -0.40 0.00 -0.03 0.00 0.00 54.58 54.76 1foo n ASN 182 Cb 0.58 -0.45 -0.03 0.00 -0.61 0.00 0.00 39.78 39.27 1foo n ASN 182 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1foo s ALA 183 N -3.06 2.29 0.55 5.41 0.00 -0.45 -4.70 121.76 121.80 1foo s ALA 183 Ca 0.11 0.15 0.24 0.00 0.00 0.00 0.00 51.96 52.47 1foo s ALA 183 Cb 0.15 -4.19 1.48 0.00 0.00 0.00 0.00 23.12 20.56 1foo s ALA 183 CO 0.60 -3.52 2.09 -1.35 0.00 0.00 0.00 175.76 173.58 1foo h PRO 184 N 16.07 0.00 -0.01 0.00 0.11 -1.89 -2.86 132.00 143.43 1foo h PRO 184 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1foo h PRO 184 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1foo h PRO 184 CO 1.09 0.00 -0.35 0.54 -0.21 0.00 0.00 178.00 179.07 1foo n ARG 185 N -4.19 0.92 -3.15 1.05 1.74 -1.26 -0.36 116.66 111.41 1foo n ARG 185 Ca 0.03 -0.63 -0.40 0.00 -0.77 0.00 0.00 57.85 56.07 1foo n ARG 185 Cb 0.34 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.23 1foo n ARG 185 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1foo n VAL 187 N 4.91 0.00 -0.36 0.00 3.14 -1.26 -3.94 118.33 120.81 1foo n VAL 187 Ca -0.02 -0.01 0.06 0.00 -2.96 0.00 0.00 64.34 61.40 1foo n VAL 187 Cb 0.50 0.02 0.30 0.00 -1.06 0.00 0.00 33.84 33.60 1foo n VAL 187 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1foo n GLY 188 N 1.47 2.52 0.00 7.55 0.00 -1.26 -4.49 105.19 110.98 1foo n GLY 188 Ca 0.07 -0.69 0.05 0.00 0.00 0.00 0.00 46.02 45.45 1foo n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1foo n ARG 189 N 0.54 0.14 0.26 1.61 1.74 -1.25 -2.47 116.66 117.22 1foo n ARG 189 Ca 0.21 0.19 0.17 0.00 -0.77 0.00 0.00 57.85 57.64 1foo n ARG 189 Cb 0.92 -1.50 0.73 0.00 -1.02 0.00 0.00 32.46 31.58 1foo n ARG 189 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 1foo h ILE 190 N 0.00 0.00 -0.10 0.55 2.10 -1.87 -1.86 117.51 116.34 1foo h ILE 190 Ca 0.00 -0.37 0.00 0.00 1.08 0.00 0.00 64.86 65.57 1foo h ILE 190 Cb 0.09 1.30 0.00 0.00 -1.09 0.00 0.00 36.82 37.12 1foo h ILE 190 CO 0.00 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 177.07 1foo n GLN 191 N -2.90 1.91 -0.34 2.19 1.13 -1.03 -4.60 117.38 113.74 1foo n GLN 191 Ca 0.00 -1.33 0.21 0.00 -1.94 0.00 0.00 57.00 53.94 1foo n GLN 191 Cb 0.25 -1.46 0.44 0.00 0.11 0.00 0.00 30.24 29.58 1foo n GLN 191 CO 0.00 0.00 0.00 0.11 -1.44 0.00 0.00 177.06 175.73 1foo h TRP 192 N 3.02 0.94 0.00 1.08 5.08 -1.53 0.14 115.95 124.68 1foo h TRP 192 Ca 0.00 0.04 0.00 0.00 1.08 0.00 0.00 58.89 60.01 1foo h TRP 192 Cb 0.65 -0.25 0.00 0.00 -3.00 0.00 0.00 29.16 26.55 1foo h TRP 192 CO 0.05 -0.09 0.00 0.78 -1.28 0.00 0.00 178.44 177.90 1foo h GLY 193 N 0.41 0.00 -3.29 11.11 0.00 -1.84 -3.22 103.07 106.24 1foo h GLY 193 Ca 0.70 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.99 1foo h GLY 193 CO -0.56 0.00 0.04 0.28 0.00 0.00 0.00 176.54 176.30 1foo n LYS 194 N -2.58 4.42 -2.13 4.80 5.02 0.04 -4.99 118.16 122.73 1foo n LYS 194 Ca 0.01 -3.12 -0.41 0.00 -2.02 0.00 0.00 58.31 52.77 1foo n LYS 194 Cb 0.23 -2.20 -0.03 0.00 -0.02 0.00 0.00 35.03 33.01 1foo n LYS 194 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1foo s LEU 195 N -2.83 4.42 -0.34 -0.35 2.96 -1.22 -4.76 118.68 116.56 1foo s LEU 195 Ca 0.53 2.58 -0.16 0.00 -0.22 0.00 0.00 54.13 56.86 1foo s LEU 195 Cb 0.41 -3.63 -0.01 0.00 0.50 0.00 0.00 46.19 43.46 1foo s LEU 195 CO 0.14 -0.57 0.41 -1.58 -1.32 0.00 0.00 176.35 173.44 1foo s GLN 196 N -0.80 3.61 -0.41 1.98 2.00 -0.97 -4.98 119.66 120.09 1foo s GLN 196 Ca 0.54 -0.30 -0.15 0.00 -2.00 0.00 0.00 55.36 53.45 1foo s GLN 196 Cb -0.39 -3.79 0.02 0.00 0.80 0.00 0.00 33.01 29.64 1foo s GLN 196 CO 0.45 -0.55 0.31 0.08 -0.50 0.00 0.00 175.29 175.09 1foo s VAL 197 N 2.14 5.24 -0.25 1.34 1.01 -1.26 -1.38 120.40 127.25 1foo s VAL 197 Ca 0.14 -0.61 -0.18 0.00 0.00 0.00 0.00 61.98 61.33 1foo s VAL 197 Cb -0.16 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 1foo s VAL 197 CO 0.12 -0.32 0.52 -0.36 0.00 0.00 0.00 175.10 175.07 1foo s PHE 198 N 1.73 3.29 -0.35 5.22 0.08 0.52 -5.00 117.98 123.49 1foo s PHE 198 Ca 0.06 0.68 -0.24 0.00 0.12 0.00 0.00 56.93 57.55 1foo s PHE 198 Cb -0.19 -2.72 0.01 0.00 -0.57 0.00 0.00 43.02 39.55 1foo s PHE 198 CO 0.10 -0.25 0.83 0.34 -0.10 0.00 0.00 175.22 176.14 1foo s ASP 199 N 1.46 6.62 -0.18 1.36 3.68 -1.26 -1.12 116.67 127.23 1foo s ASP 199 Ca 0.22 0.51 0.13 0.00 2.13 0.00 0.00 52.55 55.55 1foo s ASP 199 Cb -0.16 -2.42 0.42 0.00 -1.45 0.00 0.00 42.92 39.32 1foo s ASP 199 CO 0.09 -0.73 1.21 0.00 0.13 0.00 0.00 175.17 175.87 1foo n ALA 200 N 6.46 3.52 1.26 3.66 0.00 0.83 -4.79 120.51 131.44 1foo n ALA 200 Ca 0.04 -3.18 0.08 0.00 0.00 0.00 0.00 53.44 50.38 1foo n ALA 200 Cb 0.48 -0.41 0.45 0.00 0.00 0.00 0.00 19.45 19.98 1foo n ALA 200 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1foo n ARG 201 N -0.87 0.63 0.00 0.00 1.74 -1.05 -1.87 116.66 115.24 1foo n ARG 201 Ca 0.18 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.35 1foo n ARG 201 Cb 0.77 -1.38 -0.08 0.00 -1.02 0.00 0.00 32.46 30.74 1foo n ARG 201 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1foo n ASP 202 N -0.88 1.20 -4.67 0.55 5.75 -1.26 -4.52 116.55 112.71 1foo n ASP 202 Ca 0.11 -1.10 -0.46 0.00 -0.01 0.00 0.00 54.79 53.34 1foo n ASP 202 Cb 0.05 0.86 -0.04 0.00 -1.03 0.00 0.00 41.12 40.96 1foo n ASP 202 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1foo n SER 204 N 3.66 1.17 -3.70 0.00 3.41 -1.26 -4.75 113.62 112.16 1foo n SER 204 Ca 0.17 -1.44 -0.11 0.00 -0.26 0.00 0.00 58.87 57.24 1foo n SER 204 Cb 0.29 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.18 1foo n SER 204 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1foo s SER 205 N -0.44 -0.16 0.35 4.04 1.04 -1.26 -4.96 113.70 112.30 1foo s SER 205 Ca 0.00 -0.31 0.04 0.00 0.48 0.00 0.00 55.95 56.16 1foo s SER 205 Cb 0.00 0.42 0.64 0.00 0.10 0.00 0.00 66.02 67.18 1foo s SER 205 CO 0.00 -0.76 1.94 0.00 0.98 0.00 0.00 173.24 175.40 1foo h ALA 206 N 2.68 1.46 -0.66 5.32 0.00 -1.92 0.20 119.26 126.34 1foo h ALA 206 Ca -0.33 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.39 1foo h ALA 206 Cb 1.23 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1foo h ALA 206 CO 0.48 0.41 0.15 0.37 0.00 0.00 0.00 179.25 180.66 1foo h GLN 207 N 0.64 1.06 -0.09 0.00 5.75 -1.96 -1.79 115.11 118.74 1foo h GLN 207 Ca 0.16 -0.26 -0.11 0.00 -0.15 0.00 0.00 58.65 58.28 1foo h GLN 207 Cb 0.14 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 1foo h GLN 207 CO -0.02 0.96 -0.45 1.49 -2.65 0.00 0.00 178.83 178.17 1foo h GLU 208 N 0.99 0.20 -0.78 1.69 4.81 -1.73 -2.28 114.58 117.49 1foo h GLU 208 Ca 0.21 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 1foo h GLU 208 Cb 0.38 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.72 1foo h GLU 208 CO 0.00 0.62 0.39 0.52 -0.73 0.00 0.00 179.01 179.81 1foo h MET 209 N 0.17 1.10 -0.62 1.92 2.86 -0.37 -1.27 114.93 118.73 1foo h MET 209 Ca 0.01 -0.15 -0.04 0.00 -2.06 0.00 0.00 59.70 57.46 1foo h MET 209 Cb 0.86 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 32.28 1foo h MET 209 CO 0.07 0.84 0.22 0.35 1.06 0.00 0.00 176.91 179.45 1foo h PHE 210 N 1.10 0.97 0.14 -0.22 -0.00 -0.80 0.40 116.94 118.53 1foo h PHE 210 Ca 0.27 -0.08 -0.01 0.00 -0.00 0.00 0.00 57.97 58.15 1foo h PHE 210 Cb 0.08 -0.29 0.00 0.00 -0.00 0.00 0.00 35.95 35.75 1foo h PHE 210 CO 0.01 0.78 -0.07 1.15 -0.00 0.00 0.00 178.31 180.18 1foo h THR 211 N 0.88 0.90 -0.73 4.41 2.02 -0.96 -0.13 112.91 119.30 1foo h THR 211 Ca 0.20 -0.19 0.08 0.00 0.77 0.00 0.00 66.41 67.27 1foo h THR 211 Cb 0.24 1.03 -0.07 0.00 -1.74 0.00 0.00 68.15 67.61 1foo h THR 211 CO -0.01 0.05 0.39 1.88 0.37 0.00 0.00 175.52 178.20 1foo h TYR 212 N -0.28 0.71 -0.60 3.16 -1.99 -1.03 -0.79 116.97 116.15 1foo h TYR 212 Ca -0.02 0.03 -0.08 0.00 2.00 0.00 0.00 58.73 60.66 1foo h TYR 212 Cb 0.22 -0.21 -0.02 0.00 2.00 0.00 0.00 36.73 38.72 1foo h TYR 212 CO -0.04 0.30 0.08 0.82 -0.00 0.00 0.00 178.16 179.32 1foo h ILE 213 N 0.69 1.26 -0.50 -2.88 2.04 -0.70 -1.20 117.51 116.22 1foo h ILE 213 Ca 0.34 -1.02 -0.06 0.00 1.00 0.00 0.00 64.86 65.12 1foo h ILE 213 Cb 0.29 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 1foo h ILE 213 CO -0.23 0.38 0.06 0.00 0.00 0.00 0.00 178.15 178.35 1foo h ASN 215 N 0.76 0.96 0.30 0.00 2.35 -0.88 -1.03 115.58 118.04 1foo h ASN 215 Ca 0.16 -0.34 -0.01 0.00 -0.55 0.00 0.00 56.30 55.55 1foo h ASN 215 Cb 0.38 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.49 1foo h ASN 215 CO 0.01 1.11 -0.15 -0.74 -1.65 0.00 0.00 177.43 176.01 1foo h HIS 216 N 0.84 -0.38 -0.84 1.19 2.76 -0.68 0.16 115.15 118.19 1foo h HIS 216 Ca 0.12 -0.01 0.09 0.00 -2.20 0.00 0.00 60.37 58.37 1foo h HIS 216 Cb 0.72 0.13 -0.07 0.00 1.55 0.00 0.00 27.41 29.73 1foo h HIS 216 CO 0.05 -0.19 0.49 0.82 -1.30 0.00 0.00 177.93 177.79 1foo h ILE 217 N -0.47 0.93 -0.27 6.26 2.04 -0.96 0.24 117.51 125.28 1foo h ILE 217 Ca -0.04 -0.29 -0.04 0.00 1.00 0.00 0.00 64.86 65.49 1foo h ILE 217 Cb 0.36 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.45 1foo h ILE 217 CO 0.07 0.15 -0.00 0.11 0.00 0.00 0.00 178.15 178.48 1foo h LYS 218 N 0.83 0.48 -0.19 2.37 1.57 -0.90 -1.19 116.57 119.55 1foo h LYS 218 Ca 0.40 -0.15 -0.04 0.00 -1.87 0.00 0.00 60.65 58.98 1foo h LYS 218 Cb 0.34 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1foo h LYS 218 CO -0.24 0.64 -0.05 -0.92 -0.57 0.00 0.00 179.45 178.32 1foo h TYR 219 N 0.26 0.41 -0.61 -1.35 5.03 -0.46 -2.28 116.97 117.99 1foo h TYR 219 Ca 0.08 -0.09 -0.08 0.00 2.58 0.00 0.00 58.73 61.22 1foo h TYR 219 Cb 0.43 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.58 1foo h TYR 219 CO 0.04 0.63 0.08 0.00 -1.32 0.00 0.00 178.16 177.58 1foo h ALA 220 N 0.73 0.81 -0.24 1.82 0.00 -0.57 -3.18 119.26 118.63 1foo h ALA 220 Ca 0.05 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 1foo h ALA 220 Cb 0.50 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1foo h ALA 220 CO 0.02 0.58 -0.16 1.15 0.00 0.00 0.00 179.25 180.83 1foo h THR 221 N 0.92 1.31 -6.93 0.00 2.02 -1.26 -0.17 112.91 108.80 1foo h THR 221 Ca 0.18 -1.29 -0.59 0.00 0.77 0.00 0.00 66.41 65.49 1foo h THR 221 Cb 0.45 1.63 -0.19 0.00 -1.74 0.00 0.00 68.15 68.31 1foo h THR 221 CO 0.02 0.40 -0.94 -3.20 0.37 0.00 0.00 175.52 172.17 1foo n ASN 222 N -4.45 0.13 -2.49 4.18 5.15 -0.86 -0.65 115.26 116.28 1foo n ASN 222 Ca -0.04 -1.19 -0.15 0.00 -0.60 0.00 0.00 54.58 52.60 1foo n ASN 222 Cb 0.38 -2.03 -0.01 0.00 -0.53 0.00 0.00 39.78 37.60 1foo n ASN 222 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1foo n ARG 223 N -4.48 -2.25 0.00 1.20 1.74 -1.26 -2.34 116.66 109.26 1foo n ARG 223 Ca -0.26 0.68 0.00 0.00 -0.77 0.00 0.00 57.85 57.50 1foo n ARG 223 Cb 0.66 -5.31 0.00 0.00 -1.02 0.00 0.00 32.46 26.79 1foo n ARG 223 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1foo n GLY 224 N -0.88 2.62 3.11 -0.13 0.00 0.18 -4.93 105.19 105.15 1foo n GLY 224 Ca -0.16 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.42 1foo n GLY 224 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1foo n ASN 225 N 0.00 6.08 -4.61 1.61 5.15 -0.99 -0.64 115.26 121.87 1foo n ASN 225 Ca 0.00 -3.28 -0.42 0.00 -0.60 0.00 0.00 54.58 50.28 1foo n ASN 225 Cb 0.00 -1.32 0.01 0.00 -0.53 0.00 0.00 39.78 37.94 1foo n ASN 225 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1foo n LEU 226 N 1.92 2.49 -4.01 1.20 4.32 -1.24 -4.61 117.00 117.08 1foo n LEU 226 Ca 0.26 1.06 -0.24 0.00 -0.02 0.00 0.00 56.01 57.07 1foo n LEU 226 Cb 0.35 -1.35 -0.17 0.00 -1.62 0.00 0.00 43.42 40.64 1foo n LEU 226 CO 0.65 -1.46 -0.46 -0.13 -1.22 0.00 0.00 177.39 174.77 1foo s ARG 227 N -1.94 1.65 0.36 3.23 0.52 -0.07 -5.01 118.95 117.68 1foo s ARG 227 Ca 0.62 -0.39 -0.28 0.00 -0.52 0.00 0.00 55.73 55.16 1foo s ARG 227 Cb -0.58 -1.37 -0.11 0.00 0.52 0.00 0.00 34.95 33.41 1foo s ARG 227 CO 0.57 0.02 1.45 -1.12 0.02 0.00 0.00 175.30 176.24 1foo s SER 228 N 0.70 6.44 0.15 0.23 0.01 -1.26 -4.45 113.70 115.52 1foo s SER 228 Ca -0.14 2.97 -0.24 0.00 1.31 0.00 0.00 55.95 59.85 1foo s SER 228 Cb -0.16 -2.66 0.07 0.00 0.21 0.00 0.00 66.02 63.48 1foo s SER 228 CO 0.03 -0.80 0.66 0.00 0.41 0.00 0.00 173.24 173.54 1foo s ALA 229 N -1.09 -1.58 -0.07 1.44 0.00 -0.41 -2.30 121.76 117.76 1foo s ALA 229 Ca 0.52 0.45 -0.09 0.00 0.00 0.00 0.00 51.96 52.84 1foo s ALA 229 Cb -0.45 0.82 0.02 0.00 0.00 0.00 0.00 23.12 23.51 1foo s ALA 229 CO 0.60 -0.80 0.23 -1.50 0.00 0.00 0.00 175.76 174.29 1foo s ILE 230 N -3.68 0.02 -0.19 0.00 2.07 -0.48 -0.65 121.20 118.28 1foo s ILE 230 Ca 0.03 -0.14 0.01 0.00 -1.41 0.00 0.00 60.65 59.14 1foo s ILE 230 Cb -0.02 -0.37 0.02 0.00 0.13 0.00 0.00 42.46 42.23 1foo s ILE 230 CO -0.10 -0.08 -0.18 -0.89 -1.91 0.00 0.00 174.94 171.78 1foo s THR 231 N -0.22 2.12 -0.34 4.00 2.01 -0.52 -0.35 115.64 122.35 1foo s THR 231 Ca -0.03 -1.01 -0.12 0.00 0.31 0.00 0.00 61.69 60.84 1foo s THR 231 Cb -0.03 -1.94 -0.01 0.00 0.01 0.00 0.00 72.50 70.54 1foo s THR 231 CO 0.01 0.47 0.21 -0.69 -0.69 0.00 0.00 174.62 173.93 1foo s VAL 232 N 1.27 5.03 0.69 3.82 1.01 -0.27 -3.10 120.40 128.85 1foo s VAL 232 Ca 0.03 -0.35 -0.04 0.00 0.00 0.00 0.00 61.98 61.62 1foo s VAL 232 Cb -0.14 -3.60 0.08 0.00 0.00 0.00 0.00 36.38 32.72 1foo s VAL 232 CO -0.12 -0.02 0.98 -0.36 0.00 0.00 0.00 175.10 175.58 1foo s PHE 233 N 1.68 2.53 0.40 5.22 0.08 -0.59 -0.12 117.98 127.17 1foo s PHE 233 Ca 0.05 0.18 -0.25 0.00 0.12 0.00 0.00 56.93 57.04 1foo s PHE 233 Cb -0.17 -3.13 -0.11 0.00 -0.57 0.00 0.00 43.02 39.04 1foo s PHE 233 CO 0.09 -1.44 0.94 -2.30 -0.10 0.00 0.00 175.22 172.40 1foo n PRO 234 N -2.83 1.22 -1.48 0.24 -0.02 -1.25 -4.66 135.00 126.22 1foo n PRO 234 Ca 0.10 0.44 -0.30 0.00 -2.02 0.00 0.00 63.50 61.72 1foo n PRO 234 Cb 0.60 -1.93 0.11 0.00 -0.02 0.00 0.00 33.50 32.27 1foo n PRO 234 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1foo s GLN 235 N -1.88 1.63 0.35 -0.52 -2.07 -1.26 -4.62 119.66 111.29 1foo s GLN 235 Ca 0.63 0.57 -0.27 0.00 -1.82 0.00 0.00 55.36 54.46 1foo s GLN 235 Cb -0.59 -1.87 -0.09 0.00 -1.09 0.00 0.00 33.01 29.37 1foo s GLN 235 CO 0.57 -1.92 1.21 1.03 -1.32 0.00 0.00 175.29 174.86 1foo s ARG 236 N -5.15 4.29 0.12 9.60 0.52 0.69 -4.90 118.95 124.12 1foo s ARG 236 Ca 0.62 1.98 0.08 0.00 -0.52 0.00 0.00 55.73 57.89 1foo s ARG 236 Cb -0.15 -2.94 -0.04 0.00 0.52 0.00 0.00 34.95 32.34 1foo s ARG 236 CO 0.55 -0.15 -0.19 0.00 0.02 0.00 0.00 175.30 175.52 1foo s ALA 237 N -1.25 1.80 0.10 2.13 0.00 -1.26 -4.80 121.76 118.47 1foo s ALA 237 Ca 0.51 -1.30 -0.36 0.00 0.00 0.00 0.00 51.96 50.82 1foo s ALA 237 Cb -0.34 -0.21 -0.15 0.00 0.00 0.00 0.00 23.12 22.41 1foo s ALA 237 CO 0.45 0.30 1.48 -2.30 0.00 0.00 0.00 175.76 175.68 1foo n PRO 238 N 0.86 1.60 0.00 0.00 -0.02 -1.26 -2.50 135.00 133.67 1foo n PRO 238 Ca -0.18 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 1foo n PRO 238 Cb 0.55 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 1foo n PRO 238 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1foo n GLY 239 N 3.03 0.21 3.77 -1.23 0.00 -1.25 -4.90 105.19 104.82 1foo n GLY 239 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 1foo n GLY 239 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1foo s ARG 240 N 0.00 4.58 0.92 1.61 3.00 -1.04 -5.03 118.95 122.98 1foo s ARG 240 Ca 0.00 1.17 -0.12 0.00 -1.00 0.00 0.00 55.73 55.78 1foo s ARG 240 Cb 0.00 -3.28 0.08 0.00 0.00 0.00 0.00 34.95 31.75 1foo s ARG 240 CO 0.00 0.53 0.73 0.41 0.00 0.00 0.00 175.30 176.97 1foo n GLY 241 N 1.69 -1.28 3.91 8.12 0.00 -1.26 -4.38 105.19 111.99 1foo n GLY 241 Ca -0.05 -0.70 -0.27 0.00 0.00 0.00 0.00 46.02 44.99 1foo n GLY 241 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1foo s ASP 242 N -2.22 6.37 -0.04 1.61 -0.00 -1.26 -4.48 116.67 116.66 1foo s ASP 242 Ca 0.62 0.74 -0.23 0.00 -0.00 0.00 0.00 52.55 53.68 1foo s ASP 242 Cb -0.23 -2.16 -0.04 0.00 -0.00 0.00 0.00 42.92 40.49 1foo s ASP 242 CO 0.63 -0.33 0.67 -0.36 -0.00 0.00 0.00 175.17 175.77 1foo s PHE 243 N -2.33 3.62 -0.00 4.23 0.40 -1.26 -3.76 117.98 118.88 1foo s PHE 243 Ca 0.44 1.24 -0.05 0.00 -0.60 0.00 0.00 56.93 57.97 1foo s PHE 243 Cb -0.10 -2.74 -0.00 0.00 0.51 0.00 0.00 43.02 40.68 1foo s PHE 243 CO 0.35 0.18 0.10 1.03 0.70 0.00 0.00 175.22 177.58 1foo s ARG 244 N 0.43 0.37 -0.25 0.44 1.81 0.20 -3.44 118.95 118.51 1foo s ARG 244 Ca 0.35 -0.32 -0.04 0.00 -1.72 0.00 0.00 55.73 54.00 1foo s ARG 244 Cb -0.18 0.15 0.01 0.00 -0.45 0.00 0.00 34.95 34.48 1foo s ARG 244 CO 0.18 -0.08 -0.02 0.42 -0.68 0.00 0.00 175.30 175.12 1foo s ILE 245 N -1.08 3.33 0.22 1.52 1.01 -1.26 -0.61 121.20 124.33 1foo s ILE 245 Ca -0.12 -0.73 -0.03 0.00 0.00 0.00 0.00 60.65 59.78 1foo s ILE 245 Cb -0.07 -2.63 0.02 0.00 0.01 0.00 0.00 42.46 39.80 1foo s ILE 245 CO 0.01 0.26 1.62 -0.50 0.00 0.00 0.00 174.94 176.33 1foo h TRP 246 N 8.11 0.76 -4.06 3.97 4.06 -1.49 -3.42 115.95 123.88 1foo h TRP 246 Ca -0.36 -0.19 -0.54 0.00 2.06 0.00 0.00 58.89 59.86 1foo h TRP 246 Cb 1.13 -0.18 0.12 0.00 -1.00 0.00 0.00 29.16 29.23 1foo h TRP 246 CO 0.59 0.88 0.54 -0.80 -3.56 0.00 0.00 178.44 176.09 1foo s ASN 247 N -6.80 5.38 0.38 -3.49 -0.87 -1.26 -4.93 114.94 103.36 1foo s ASN 247 Ca -0.08 2.55 0.21 0.00 -1.57 0.00 0.00 52.86 53.97 1foo s ASN 247 Cb 0.13 -2.62 0.40 0.00 -0.02 0.00 0.00 41.25 39.14 1foo s ASN 247 CO 0.83 -1.47 1.61 0.77 -2.57 0.00 0.00 177.10 176.26 1foo h SER 248 N 1.36 0.00 -5.11 -1.22 4.64 -1.90 -3.34 113.55 107.98 1foo h SER 248 Ca -0.50 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.69 1foo h SER 248 Cb 1.29 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.21 1foo h SER 248 CO 0.57 0.24 -0.53 -1.10 -0.87 0.00 0.00 176.83 175.14 1foo s GLN 249 N -3.22 0.61 0.39 4.77 -0.21 -1.26 -0.74 119.66 120.01 1foo s GLN 249 Ca 0.04 -0.82 0.15 0.00 0.02 0.00 0.00 55.36 54.75 1foo s GLN 249 Cb 0.07 0.24 0.79 0.00 1.00 0.00 0.00 33.01 35.10 1foo s GLN 249 CO 0.69 -0.15 1.84 -0.07 -2.12 0.00 0.00 175.29 175.47 1foo h LEU 250 N 3.53 0.00 -7.92 2.90 3.38 -1.52 -3.40 115.31 112.28 1foo h LEU 250 Ca -0.33 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.04 1foo h LEU 250 Cb 1.18 0.00 -0.36 0.00 0.09 0.00 0.00 40.66 41.58 1foo h LEU 250 CO 0.52 0.35 -0.84 -0.69 0.09 0.00 0.00 178.44 177.88 1foo s VAL 251 N -4.13 1.59 -0.04 1.22 1.01 -1.26 -4.93 120.40 113.86 1foo s VAL 251 Ca -0.02 -0.65 -0.15 0.00 0.00 0.00 0.00 61.98 61.15 1foo s VAL 251 Cb 0.14 -1.48 0.03 0.00 0.00 0.00 0.00 36.38 35.07 1foo s VAL 251 CO 0.71 0.46 0.33 -0.13 0.00 0.00 0.00 175.10 176.47 1foo s ARG 252 N 1.39 0.64 0.05 2.72 1.81 -1.26 -4.86 118.95 119.43 1foo s ARG 252 Ca 0.03 -0.04 -0.14 0.00 -1.72 0.00 0.00 55.73 53.85 1foo s ARG 252 Cb -0.13 0.29 -0.06 0.00 -0.45 0.00 0.00 34.95 34.60 1foo s ARG 252 CO -0.09 -0.16 0.45 0.71 -0.68 0.00 0.00 175.30 175.52 1foo s TYR 253 N -1.04 3.69 0.74 -0.53 2.02 -1.26 -0.28 117.35 120.69 1foo s TYR 253 Ca -0.11 1.00 -0.14 0.00 -0.37 0.00 0.00 57.07 57.45 1foo s TYR 253 Cb -0.04 -2.30 0.04 0.00 -0.40 0.00 0.00 41.96 39.26 1foo s TYR 253 CO 0.04 0.58 1.16 0.00 -1.57 0.00 0.00 175.55 175.76 1foo s ALA 254 N -1.20 2.15 -0.23 3.71 0.00 0.70 -4.39 121.76 122.49 1foo s ALA 254 Ca 0.28 0.69 -0.01 0.00 0.00 0.00 0.00 51.96 52.93 1foo s ALA 254 Cb -0.16 -3.41 0.07 0.00 0.00 0.00 0.00 23.12 19.62 1foo s ALA 254 CO 0.16 -1.81 0.00 0.20 0.00 0.00 0.00 175.76 174.31 1foo s GLY 255 N -2.39 1.06 -0.32 0.00 0.00 -1.25 -1.49 107.32 102.93 1foo s GLY 255 Ca 0.70 -1.17 -0.13 0.00 0.00 0.00 0.00 44.72 44.11 1foo s GLY 255 CO 0.47 1.19 0.28 -0.19 0.00 0.00 0.00 173.10 174.85 1foo s TYR 256 N 1.58 3.22 0.18 1.90 1.51 0.47 -4.29 117.35 121.93 1foo s TYR 256 Ca -0.02 -0.02 -0.31 0.00 -1.01 0.00 0.00 57.07 55.71 1foo s TYR 256 Cb -0.18 -2.52 -0.09 0.00 -0.11 0.00 0.00 41.96 39.06 1foo s TYR 256 CO -0.09 -0.32 1.45 0.50 -1.11 0.00 0.00 175.55 175.98 1foo s ARG 257 N 1.85 4.28 0.44 -0.62 6.06 -1.26 -1.12 118.95 128.58 1foo s ARG 257 Ca 0.09 2.23 0.06 0.00 -2.50 0.00 0.00 55.73 55.62 1foo s ARG 257 Cb -0.17 -3.17 0.01 0.00 0.06 0.00 0.00 34.95 31.69 1foo s ARG 257 CO 0.11 -0.46 0.61 -0.65 -2.50 0.00 0.00 175.30 172.40 1foo s GLN 258 N 0.51 2.79 0.20 5.12 -1.52 0.89 -4.93 119.66 122.72 1foo s GLN 258 Ca 0.64 -1.12 -0.10 0.00 -1.95 0.00 0.00 55.36 52.82 1foo s GLN 258 Cb -0.41 -2.71 0.13 0.00 -0.22 0.00 0.00 33.01 29.81 1foo s GLN 258 CO 0.36 -0.34 1.79 1.96 -0.25 0.00 0.00 175.29 178.80 1foo h GLN 259 N 0.54 1.04 0.00 2.91 7.50 -1.95 -1.83 115.11 123.32 1foo h GLN 259 Ca -0.41 -0.16 0.00 0.00 0.50 0.00 0.00 58.65 58.59 1foo h GLN 259 Cb 1.28 -0.19 0.00 0.00 0.05 0.00 0.00 27.48 28.63 1foo h GLN 259 CO 0.47 0.82 0.00 -0.40 -1.50 0.00 0.00 178.83 178.22 1foo n ASP 260 N -4.41 0.00 0.00 1.46 5.68 -1.26 -4.86 116.55 113.15 1foo n ASP 260 Ca 0.06 -1.30 0.00 0.00 -0.50 0.00 0.00 54.79 53.05 1foo n ASP 260 Cb 0.14 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.12 1foo n ASP 260 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1foo n GLY 261 N 0.65 0.99 2.55 6.12 0.00 -0.69 -5.06 105.19 109.75 1foo n GLY 261 Ca 0.12 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.95 1foo n GLY 261 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1foo n SER 262 N 0.00 -0.01 -3.99 1.61 3.41 -1.26 -4.68 113.62 108.71 1foo n SER 262 Ca 0.00 -1.30 -0.22 0.00 -0.26 0.00 0.00 58.87 57.09 1foo n SER 262 Cb 0.00 -0.67 -0.16 0.00 -0.26 0.00 0.00 64.21 63.12 1foo n SER 262 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1foo s VAL 263 N -2.90 0.85 -0.21 -3.33 1.01 -1.26 -0.08 120.40 114.48 1foo s VAL 263 Ca 0.50 -0.36 -0.08 0.00 0.00 0.00 0.00 61.98 62.04 1foo s VAL 263 Cb -0.01 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.54 1foo s VAL 263 CO 0.35 0.28 0.09 -0.60 0.00 0.00 0.00 175.10 175.21 1foo s ARG 264 N 0.46 3.93 0.00 2.72 3.52 -0.27 -4.91 118.95 124.40 1foo s ARG 264 Ca -0.08 -0.35 0.00 0.00 -0.13 0.00 0.00 55.73 55.17 1foo s ARG 264 Cb -0.12 -3.31 0.00 0.00 -1.56 0.00 0.00 34.95 29.96 1foo s ARG 264 CO 0.01 0.13 0.00 0.41 -0.81 0.00 0.00 175.30 175.05 1foo n GLY 265 N 3.98 0.64 3.48 8.12 0.00 -1.26 -0.39 105.19 119.76 1foo n GLY 265 Ca -0.16 -1.73 -0.42 0.00 0.00 0.00 0.00 46.02 43.71 1foo n GLY 265 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1foo s ASP 266 N -4.00 6.11 0.58 1.61 3.68 -0.56 -4.73 116.67 119.36 1foo s ASP 266 Ca 0.00 -0.72 0.28 0.00 2.13 0.00 0.00 52.55 54.24 1foo s ASP 266 Cb 0.00 -2.16 1.61 0.00 -1.45 0.00 0.00 42.92 40.91 1foo s ASP 266 CO 0.00 -0.40 2.09 -0.65 0.13 0.00 0.00 175.17 176.34 1foo h PRO 267 N 8.60 0.00 0.00 4.34 0.11 -1.82 -1.69 132.00 141.53 1foo h PRO 267 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1foo h PRO 267 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1foo h PRO 267 CO 0.71 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.50 1foo h ALA 268 N 1.77 1.00 -0.33 -0.75 0.00 -1.93 -3.13 119.26 115.88 1foo h ALA 268 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 1foo h ALA 268 Cb 0.53 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.24 1foo h ALA 268 CO -0.00 0.00 -0.03 0.09 0.00 0.00 0.00 179.25 179.30 1foo n ASN 269 N -2.76 2.90 -0.16 0.00 3.02 -0.63 -4.71 115.26 112.93 1foo n ASN 269 Ca 0.01 -3.53 -0.09 0.00 -0.03 0.00 0.00 54.58 50.93 1foo n ASN 269 Cb 0.24 -0.61 -0.00 0.00 -0.61 0.00 0.00 39.78 38.80 1foo n ASN 269 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1foo h VAL 270 N 1.19 1.23 -0.21 2.41 2.07 -1.68 -1.87 116.25 119.41 1foo h VAL 270 Ca 0.16 -0.82 -0.03 0.00 0.82 0.00 0.00 66.70 66.83 1foo h VAL 270 Cb 1.61 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.27 1foo h VAL 270 CO 0.35 0.29 0.01 -0.08 0.02 0.00 0.00 177.57 178.15 1foo h GLU 271 N 0.61 0.36 -0.30 1.57 4.81 -1.87 -1.78 114.58 117.97 1foo h GLU 271 Ca 0.14 -0.11 -0.07 0.00 -0.13 0.00 0.00 59.36 59.19 1foo h GLU 271 Cb 0.32 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 1foo h GLU 271 CO 0.00 0.55 -0.12 0.97 -0.73 0.00 0.00 179.01 179.68 1foo h ILE 272 N 0.13 1.23 -0.53 2.32 6.09 -1.90 -1.32 117.51 123.53 1foo h ILE 272 Ca 0.06 -1.00 -0.08 0.00 -1.37 0.00 0.00 64.86 62.47 1foo h ILE 272 Cb 0.38 1.13 -0.02 0.00 0.47 0.00 0.00 36.82 38.78 1foo h ILE 272 CO 0.01 0.33 0.04 0.74 -3.07 0.00 0.00 178.15 176.20 1foo h THR 273 N 0.47 1.26 -0.22 2.19 2.02 -1.19 -0.74 112.91 116.69 1foo h THR 273 Ca 0.09 -1.04 -0.10 0.00 0.77 0.00 0.00 66.41 66.13 1foo h THR 273 Cb 0.48 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 1foo h THR 273 CO 0.03 0.37 -0.29 -0.33 0.37 0.00 0.00 175.52 175.67 1foo h GLU 274 N 0.79 0.44 -0.43 6.66 5.08 -0.95 -2.19 114.58 123.97 1foo h GLU 274 Ca 0.15 -0.18 -0.14 0.00 -1.00 0.00 0.00 59.36 58.20 1foo h GLU 274 Cb 0.48 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1foo h GLU 274 CO 0.02 0.69 -0.27 -0.07 -1.00 0.00 0.00 179.01 178.38 1foo h LEU 275 N 0.38 0.94 -0.92 1.33 3.38 -0.91 -0.09 115.31 119.43 1foo h LEU 275 Ca 0.05 -0.38 -0.04 0.00 0.09 0.00 0.00 57.88 57.60 1foo h LEU 275 Cb 0.71 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 1foo h LEU 275 CO 0.05 1.15 0.27 0.00 0.09 0.00 0.00 178.44 180.00 1foo h ILE 277 N 1.03 1.28 0.00 0.00 2.04 -1.15 0.07 117.51 120.78 1foo h ILE 277 Ca 0.24 -0.84 0.00 0.00 1.00 0.00 0.00 64.86 65.26 1foo h ILE 277 Cb 0.22 1.82 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 1foo h ILE 277 CO -0.02 0.22 0.07 1.56 0.00 0.00 0.00 178.15 179.99 1foo h GLN 278 N -0.32 0.00 -0.35 2.37 4.20 -0.73 -0.88 115.11 119.41 1foo h GLN 278 Ca 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1foo h GLN 278 Cb 0.36 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 1foo h GLN 278 CO 0.00 0.00 0.01 0.72 -0.67 0.00 0.00 178.83 178.89 1foo n HIS 279 N -2.25 1.25 -0.10 2.96 8.25 -0.73 -4.95 115.22 119.64 1foo n HIS 279 Ca -0.01 -0.90 0.00 0.00 -0.26 0.00 0.00 57.72 56.55 1foo n HIS 279 Cb 0.11 -0.38 0.00 0.00 1.12 0.00 0.00 29.99 30.83 1foo n HIS 279 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1foo n GLY 280 N -0.31 0.60 3.71 -1.41 0.00 -0.33 -4.81 105.19 102.64 1foo n GLY 280 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 1foo n GLY 280 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1foo s TRP 281 N -2.18 3.63 -0.52 1.61 -0.00 -0.04 -4.98 118.94 116.46 1foo s TRP 281 Ca 0.00 1.66 -0.24 0.00 -0.00 0.00 0.00 56.10 57.52 1foo s TRP 281 Cb 0.00 -3.15 0.04 0.00 -0.00 0.00 0.00 33.47 30.36 1foo s TRP 281 CO 0.00 -0.12 0.89 0.99 -0.00 0.00 0.00 176.95 178.72 1foo s THR 282 N 1.13 4.47 0.76 5.86 2.01 -1.26 -4.34 115.64 124.27 1foo s THR 282 Ca 0.52 0.32 -0.14 0.00 0.31 0.00 0.00 61.69 62.70 1foo s THR 282 Cb -0.21 -4.48 0.05 0.00 0.01 0.00 0.00 72.50 67.88 1foo s THR 282 CO 0.27 -0.99 1.19 -2.16 -0.69 0.00 0.00 174.62 172.23 1foo s PRO 283 N 3.73 2.01 0.00 4.92 0.04 -1.26 -5.07 135.00 139.37 1foo s PRO 283 Ca 0.30 1.68 0.00 0.00 0.04 0.00 0.00 61.00 63.03 1foo s PRO 283 Cb -0.13 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.59 1foo s PRO 283 CO 0.20 -1.92 0.00 0.41 0.04 0.00 0.00 177.00 175.73 1foo n GLY 284 N 0.24 2.36 0.68 0.56 0.00 -1.26 -5.07 105.19 102.70 1foo n GLY 284 Ca 0.13 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 44.11 1foo n GLY 284 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1foo n ASN 285 N -0.08 0.13 -4.61 1.61 2.04 -1.26 -5.07 115.26 108.02 1foo n ASN 285 Ca 0.00 -1.86 -0.25 0.00 -0.44 0.00 0.00 54.58 52.04 1foo n ASN 285 Cb 0.00 -0.17 0.12 0.00 -2.53 0.00 0.00 39.78 37.19 1foo n ASN 285 CO 0.00 0.00 0.00 -0.83 -0.44 0.00 0.00 177.26 175.99 1foo s GLY 286 N -1.02 1.76 0.07 4.83 0.00 -1.26 -5.01 107.32 106.69 1foo s GLY 286 Ca 0.06 -1.59 0.23 0.00 0.00 0.00 0.00 44.72 43.42 1foo s GLY 286 CO -0.03 -1.01 1.12 -2.13 0.00 0.00 0.00 173.10 171.05 1foo n ARG 287 N -2.97 0.28 -2.71 2.90 0.63 -1.26 -4.36 116.66 109.18 1foo n ARG 287 Ca 0.14 0.02 -0.13 0.00 -0.92 0.00 0.00 57.85 56.97 1foo n ARG 287 Cb 0.60 -1.62 0.02 0.00 0.45 0.00 0.00 32.46 31.91 1foo n ARG 287 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1foo n PHE 288 N -1.99 1.38 -2.94 -0.14 3.01 -1.26 -4.22 117.46 111.29 1foo n PHE 288 Ca 0.02 -2.98 -0.41 0.00 1.01 0.00 0.00 57.45 55.09 1foo n PHE 288 Cb 0.43 -0.35 -0.04 0.00 -0.01 0.00 0.00 39.48 39.51 1foo n PHE 288 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1foo s ASP 289 N -3.10 6.87 0.11 4.37 1.01 -1.26 -4.92 116.67 119.75 1foo s ASP 289 Ca 0.32 1.07 -0.31 0.00 0.71 0.00 0.00 52.55 54.33 1foo s ASP 289 Cb 0.44 -2.43 -0.08 0.00 1.01 0.00 0.00 42.92 41.86 1foo s ASP 289 CO -0.01 -0.41 1.42 -0.69 0.21 0.00 0.00 175.17 175.70 1foo s VAL 290 N 2.30 3.24 0.57 -1.27 1.01 -1.26 -0.22 120.40 124.77 1foo s VAL 290 Ca 0.35 0.87 -0.15 0.00 0.00 0.00 0.00 61.98 63.06 1foo s VAL 290 Cb -0.16 -3.56 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 1foo s VAL 290 CO 0.11 0.06 1.02 -0.76 0.00 0.00 0.00 175.10 175.53 1foo s LEU 291 N 1.25 3.48 0.68 3.92 1.43 0.61 -4.85 118.68 125.20 1foo s LEU 291 Ca 0.65 1.65 -0.06 0.00 -1.03 0.00 0.00 54.13 55.34 1foo s LEU 291 Cb -0.37 -4.51 0.05 0.00 0.03 0.00 0.00 46.19 41.38 1foo s LEU 291 CO 0.30 -0.92 0.98 -2.16 0.23 0.00 0.00 176.35 174.79 1foo s PRO 292 N -4.31 2.35 -0.12 1.29 0.04 -1.26 -4.74 135.00 128.25 1foo s PRO 292 Ca 0.60 -0.22 -0.06 0.00 0.04 0.00 0.00 61.00 61.35 1foo s PRO 292 Cb -0.13 -2.20 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 1foo s PRO 292 CO 0.38 -1.11 0.12 -0.51 0.04 0.00 0.00 177.00 175.92 1foo s LEU 293 N -5.18 4.26 -0.42 -3.56 1.43 0.14 -4.91 118.68 110.44 1foo s LEU 293 Ca 0.59 0.41 -0.07 0.00 -1.03 0.00 0.00 54.13 54.03 1foo s LEU 293 Cb -0.11 -2.03 0.09 0.00 0.03 0.00 0.00 46.19 44.17 1foo s LEU 293 CO 0.45 0.39 0.25 -0.76 0.23 0.00 0.00 176.35 176.91 1foo s LEU 294 N -0.94 5.22 -0.16 1.79 1.43 -1.26 -0.86 118.68 123.91 1foo s LEU 294 Ca 0.14 -1.69 -0.06 0.00 -1.03 0.00 0.00 54.13 51.49 1foo s LEU 294 Cb -0.12 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 1foo s LEU 294 CO 0.03 -0.56 0.04 -0.76 0.23 0.00 0.00 176.35 175.33 1foo s LEU 295 N 1.34 3.70 -0.18 1.79 1.43 -0.20 -1.22 118.68 125.35 1foo s LEU 295 Ca 0.04 0.07 0.01 0.00 -1.03 0.00 0.00 54.13 53.22 1foo s LEU 295 Cb -0.24 -1.91 0.03 0.00 0.03 0.00 0.00 46.19 44.10 1foo s LEU 295 CO -0.00 0.21 -0.14 -1.58 0.23 0.00 0.00 176.35 175.07 1foo s GLN 296 N 0.13 2.33 0.52 1.70 0.74 0.22 -0.51 119.66 124.78 1foo s GLN 296 Ca 0.03 -0.75 -0.04 0.00 0.05 0.00 0.00 55.36 54.65 1foo s GLN 296 Cb -0.13 -2.34 -0.01 0.00 1.10 0.00 0.00 33.01 31.63 1foo s GLN 296 CO 0.01 -0.32 0.81 0.00 -0.55 0.00 0.00 175.29 175.25 1foo s ALA 297 N 1.40 3.42 0.03 1.58 0.00 -1.26 -0.63 121.76 126.30 1foo s ALA 297 Ca 0.02 -0.69 -0.36 0.00 0.00 0.00 0.00 51.96 50.93 1foo s ALA 297 Cb -0.14 -2.51 -0.15 0.00 0.00 0.00 0.00 23.12 20.32 1foo s ALA 297 CO -0.10 -0.55 1.56 -2.30 0.00 0.00 0.00 175.76 174.38 1foo n PRO 298 N -2.37 1.66 -3.15 0.00 -0.02 -1.25 -2.70 135.00 127.18 1foo n PRO 298 Ca 0.02 0.60 -0.23 0.00 -2.02 0.00 0.00 63.50 61.88 1foo n PRO 298 Cb 0.57 -2.33 0.03 0.00 -0.02 0.00 0.00 33.50 31.75 1foo n PRO 298 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1foo n ASP 299 N 3.88 -5.70 -4.05 2.55 8.00 -1.26 -4.83 116.55 115.14 1foo n ASP 299 Ca 0.20 -0.34 -0.12 0.00 0.71 0.00 0.00 54.79 55.24 1foo n ASP 299 Cb 0.23 -4.61 -0.11 0.00 -0.02 0.00 0.00 41.12 36.61 1foo n ASP 299 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1foo s GLU 300 N -5.83 0.50 0.73 -1.24 2.02 -1.10 -5.06 118.70 108.72 1foo s GLU 300 Ca 0.35 -0.75 -0.14 0.00 0.02 0.00 0.00 54.97 54.45 1foo s GLU 300 Cb -0.16 -0.22 0.04 0.00 0.10 0.00 0.00 34.13 33.89 1foo s GLU 300 CO 0.44 0.03 1.17 0.00 0.02 0.00 0.00 175.26 176.92 1foo s ALA 301 N -1.46 2.16 0.53 5.21 0.00 -1.26 -4.56 121.76 122.37 1foo s ALA 301 Ca -0.10 0.75 -0.20 0.00 0.00 0.00 0.00 51.96 52.40 1foo s ALA 301 Cb -0.10 -3.42 -0.06 0.00 0.00 0.00 0.00 23.12 19.54 1foo s ALA 301 CO -0.00 -1.79 1.16 -1.25 0.00 0.00 0.00 175.76 173.87 1foo s PRO 302 N -4.06 3.39 0.06 0.00 0.04 -1.26 -4.74 135.00 128.43 1foo s PRO 302 Ca 0.71 1.70 0.04 0.00 0.04 0.00 0.00 61.00 63.50 1foo s PRO 302 Cb -0.26 -2.10 -0.04 0.00 0.04 0.00 0.00 34.50 32.15 1foo s PRO 302 CO 0.46 -0.84 -0.04 -1.21 0.04 0.00 0.00 177.00 175.40 1foo s GLU 303 N -3.14 2.49 -0.16 4.56 2.02 0.33 -4.88 118.70 119.92 1foo s GLU 303 Ca 0.71 -0.82 -0.13 0.00 0.02 0.00 0.00 54.97 54.75 1foo s GLU 303 Cb -0.27 -2.49 -0.05 0.00 0.10 0.00 0.00 34.13 31.42 1foo s GLU 303 CO 0.30 0.56 0.28 -1.17 0.02 0.00 0.00 175.26 175.26 1foo s LEU 304 N -1.93 4.25 -0.04 1.80 2.96 -1.26 -1.04 118.68 123.43 1foo s LEU 304 Ca 0.21 0.50 0.02 0.00 -0.22 0.00 0.00 54.13 54.64 1foo s LEU 304 Cb -0.11 -2.35 0.01 0.00 0.50 0.00 0.00 46.19 44.23 1foo s LEU 304 CO 0.13 0.12 -0.07 -0.36 -1.32 0.00 0.00 176.35 174.85 1foo s PHE 305 N 0.40 0.87 -0.24 5.38 0.40 -0.04 -4.97 117.98 119.78 1foo s PHE 305 Ca 0.16 -0.24 -0.11 0.00 -0.60 0.00 0.00 56.93 56.14 1foo s PHE 305 Cb -0.13 -0.68 -0.05 0.00 0.51 0.00 0.00 43.02 42.67 1foo s PHE 305 CO 0.04 -0.15 0.20 0.08 0.70 0.00 0.00 175.22 176.09 1foo s VAL 306 N 0.53 5.33 0.12 -0.44 1.01 -1.26 0.25 120.40 125.93 1foo s VAL 306 Ca -0.08 0.26 -0.31 0.00 0.00 0.00 0.00 61.98 61.85 1foo s VAL 306 Cb -0.11 -3.54 -0.07 0.00 0.00 0.00 0.00 36.38 32.65 1foo s VAL 306 CO 0.01 0.31 1.31 -0.76 0.00 0.00 0.00 175.10 175.97 1foo s LEU 307 N 1.24 4.38 0.10 3.92 1.43 -1.26 -4.94 118.68 123.56 1foo s LEU 307 Ca 0.09 2.24 -0.31 0.00 -1.03 0.00 0.00 54.13 55.13 1foo s LEU 307 Cb -0.14 -3.59 -0.10 0.00 0.03 0.00 0.00 46.19 42.39 1foo s LEU 307 CO 0.06 -0.56 1.89 -2.65 0.23 0.00 0.00 176.35 175.32 1foo n PRO 308 N 3.62 2.85 -0.33 1.29 -0.02 -1.26 -4.85 135.00 136.30 1foo n PRO 308 Ca 0.09 1.04 0.22 0.00 -2.02 0.00 0.00 63.50 62.83 1foo n PRO 308 Cb 0.44 -2.96 0.44 0.00 -0.02 0.00 0.00 33.50 31.39 1foo n PRO 308 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1foo h PRO 309 N 9.27 0.26 0.00 0.52 0.11 -1.94 0.32 132.00 140.53 1foo h PRO 309 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1foo h PRO 309 Cb 1.23 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1foo h PRO 309 CO 0.95 0.17 0.00 1.05 -0.21 0.00 0.00 178.00 179.96 1foo h GLU 310 N 0.27 0.00 0.00 1.05 9.09 -2.03 -1.67 114.58 121.28 1foo h GLU 310 Ca 0.70 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 60.10 1foo h GLU 310 Cb 1.58 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.67 1foo h GLU 310 CO -0.64 0.00 -1.01 -0.07 0.05 0.00 0.00 179.01 177.35 1foo h LEU 311 N 0.00 0.00 -7.98 3.06 3.38 -0.72 -3.43 115.31 109.62 1foo h LEU 311 Ca 0.00 0.00 -0.75 0.00 0.09 0.00 0.00 57.88 57.22 1foo h LEU 311 Cb 0.05 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 40.56 1foo h LEU 311 CO 0.00 0.04 0.12 -0.69 0.09 0.00 0.00 178.44 177.99 1foo s VAL 312 N -3.33 5.24 0.01 1.22 1.01 -0.63 -4.83 120.40 119.08 1foo s VAL 312 Ca -0.01 -1.81 -0.30 0.00 0.00 0.00 0.00 61.98 59.86 1foo s VAL 312 Cb 0.09 -4.48 -0.05 0.00 0.00 0.00 0.00 36.38 31.94 1foo s VAL 312 CO 0.79 -1.07 1.29 -0.22 0.00 0.00 0.00 175.10 175.89 1foo s LEU 313 N 1.36 4.32 0.23 3.92 2.96 -1.26 -5.00 118.68 125.21 1foo s LEU 313 Ca 0.15 2.02 0.09 0.00 -0.22 0.00 0.00 54.13 56.17 1foo s LEU 313 Cb -0.17 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 42.90 1foo s LEU 313 CO -0.03 -0.62 -0.17 -1.61 -1.32 0.00 0.00 176.35 172.61 1foo s GLU 314 N 1.93 1.46 -0.18 1.98 2.02 -1.26 -1.09 118.70 123.56 1foo s GLU 314 Ca 0.60 -1.64 0.00 0.00 0.02 0.00 0.00 54.97 53.95 1foo s GLU 314 Cb -0.29 -1.40 0.04 0.00 0.10 0.00 0.00 34.13 32.58 1foo s GLU 314 CO 0.26 0.25 -0.08 0.08 0.02 0.00 0.00 175.26 175.79 1foo s VAL 315 N -2.70 1.40 0.33 2.63 1.01 0.59 -4.88 120.40 118.78 1foo s VAL 315 Ca 0.25 -0.81 -0.28 0.00 0.00 0.00 0.00 61.98 61.14 1foo s VAL 315 Cb -0.03 -1.51 -0.10 0.00 0.00 0.00 0.00 36.38 34.75 1foo s VAL 315 CO 0.10 0.18 1.23 -2.84 0.00 0.00 0.00 175.10 173.77 1foo s PRO 316 N 1.51 4.37 -0.13 2.72 0.02 -1.26 -2.41 135.00 139.81 1foo s PRO 316 Ca 0.00 2.06 -0.15 0.00 0.02 0.00 0.00 61.00 62.93 1foo s PRO 316 Cb -0.15 -3.03 -0.05 0.00 0.02 0.00 0.00 34.50 31.29 1foo s PRO 316 CO -0.08 -0.12 0.36 -0.51 -0.33 0.00 0.00 177.00 176.32 1foo s LEU 317 N -1.83 4.28 0.04 -5.54 1.43 -0.17 -4.85 118.68 112.03 1foo s LEU 317 Ca 0.49 0.64 -0.01 0.00 -1.03 0.00 0.00 54.13 54.22 1foo s LEU 317 Cb -0.36 -2.48 -0.03 0.00 0.03 0.00 0.00 46.19 43.34 1foo s LEU 317 CO 0.48 0.10 -0.01 -1.83 0.23 0.00 0.00 176.35 175.31 1foo s GLU 318 N 0.35 0.50 -0.02 1.70 -1.05 -1.26 -4.17 118.70 114.75 1foo s GLU 318 Ca 0.20 -0.95 -0.03 0.00 -0.15 0.00 0.00 54.97 54.05 1foo s GLU 318 Cb -0.14 0.18 -0.04 0.00 -0.44 0.00 0.00 34.13 33.69 1foo s GLU 318 CO 0.07 -0.09 0.16 -1.58 0.95 0.00 0.00 175.26 174.76 1foo s HIS 319 N -2.89 3.50 0.45 4.83 5.65 -1.26 -4.29 115.29 121.27 1foo s HIS 319 Ca -0.03 0.34 0.11 0.00 0.25 0.00 0.00 55.06 55.73 1foo s HIS 319 Cb 0.00 -1.82 1.01 0.00 -1.18 0.00 0.00 32.58 30.59 1foo s HIS 319 CO -0.06 0.64 2.07 -1.00 -0.65 0.00 0.00 174.74 175.74 1foo h PRO 320 N 4.00 0.36 0.00 2.88 0.13 -1.91 -3.37 132.00 134.09 1foo h PRO 320 Ca -0.50 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 1foo h PRO 320 Cb 1.19 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1foo h PRO 320 CO 0.66 0.24 -0.87 0.25 -0.23 0.00 0.00 178.00 178.06 1foo n THR 321 N -4.49 0.00 -2.32 1.56 -2.24 -1.26 -4.93 114.28 100.60 1foo n THR 321 Ca 0.02 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.43 1foo n THR 321 Cb 0.12 -0.47 -0.03 0.00 -2.10 0.00 0.00 70.33 67.84 1foo n THR 321 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1foo s LEU 322 N -4.63 3.28 0.57 3.22 1.43 -1.26 -4.84 118.68 116.45 1foo s LEU 322 Ca 0.00 -0.55 0.26 0.00 -1.03 0.00 0.00 54.13 52.81 1foo s LEU 322 Cb 0.00 -2.55 1.66 0.00 0.03 0.00 0.00 46.19 45.33 1foo s LEU 322 CO 0.00 -2.09 2.20 -0.33 0.23 0.00 0.00 176.35 176.36 1foo h GLU 323 N 11.47 0.00 0.00 1.70 5.08 -1.92 -2.48 114.58 128.43 1foo h GLU 323 Ca -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1foo h GLU 323 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 1foo h GLU 323 CO 1.29 0.00 0.00 0.11 -1.00 0.00 0.00 179.01 179.41 1foo h TRP 324 N 0.00 0.00 -0.93 4.33 5.08 -1.95 -3.30 115.95 119.17 1foo h TRP 324 Ca 0.02 0.00 0.10 0.00 1.08 0.00 0.00 58.89 60.10 1foo h TRP 324 Cb 0.13 0.00 -0.07 0.00 -3.00 0.00 0.00 29.16 26.21 1foo h TRP 324 CO 0.00 0.00 0.60 0.35 -1.28 0.00 0.00 178.44 178.11 1foo h PHE 325 N 0.00 1.02 -0.14 0.12 3.57 -1.82 -0.57 116.94 119.12 1foo h PHE 325 Ca 0.00 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 1foo h PHE 325 Cb 0.73 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 39.13 1foo h PHE 325 CO 0.00 0.45 0.04 0.00 -2.23 0.00 0.00 178.31 176.57 1foo h ALA 326 N 1.54 1.80 0.00 2.41 0.00 -1.72 -1.41 119.26 121.88 1foo h ALA 326 Ca 0.44 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1foo h ALA 326 Cb 0.43 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1foo h ALA 326 CO -0.20 0.16 0.00 0.00 0.00 0.00 0.00 179.25 179.21 1foo h ALA 327 N 1.84 1.00 0.00 0.00 0.00 -1.32 -2.51 119.26 118.28 1foo h ALA 327 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1foo h ALA 327 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1foo h ALA 327 CO -0.00 0.00 0.00 -0.07 0.00 0.00 0.00 179.25 179.18 1foo h LEU 328 N 0.00 0.00 1.29 0.00 4.07 -1.28 -3.46 115.31 115.93 1foo h LEU 328 Ca 0.00 0.00 -0.28 0.00 0.08 0.00 0.00 57.88 57.68 1foo h LEU 328 Cb 0.24 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 41.91 1foo h LEU 328 CO 0.00 0.00 -0.31 0.61 -1.08 0.00 0.00 178.44 177.66 1foo n GLY 329 N -0.65 0.68 3.87 0.83 0.00 -0.95 -5.01 105.19 103.97 1foo n GLY 329 Ca -0.01 -0.33 -0.30 0.00 0.00 0.00 0.00 46.02 45.38 1foo n GLY 329 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1foo s LEU 330 N -3.59 3.58 0.21 0.99 1.43 -1.26 -4.97 118.68 115.06 1foo s LEU 330 Ca 0.00 1.25 -0.23 0.00 -1.03 0.00 0.00 54.13 54.13 1foo s LEU 330 Cb 0.00 -4.21 0.06 0.00 0.03 0.00 0.00 46.19 42.07 1foo s LEU 330 CO 0.00 -0.61 0.93 0.00 0.23 0.00 0.00 176.35 176.91 1foo s ARG 331 N -4.46 1.43 0.07 1.70 1.70 -1.26 -1.00 118.95 117.13 1foo s ARG 331 Ca 0.53 -0.85 -0.25 0.00 -0.47 0.00 0.00 55.73 54.69 1foo s ARG 331 Cb -0.10 0.45 0.06 0.00 -0.57 0.00 0.00 34.95 34.79 1foo s ARG 331 CO 0.40 -0.66 0.60 -0.46 -1.08 0.00 0.00 175.30 174.10 1foo s TRP 332 N -2.94 -0.54 0.36 5.89 -0.11 -1.01 -4.93 118.94 115.65 1foo s TRP 332 Ca 0.15 0.58 -0.14 0.00 1.22 0.00 0.00 56.10 57.91 1foo s TRP 332 Cb -0.03 0.46 -0.09 0.00 -1.50 0.00 0.00 33.47 32.32 1foo s TRP 332 CO 0.05 -0.73 0.77 1.52 -4.62 0.00 0.00 176.95 173.94 1foo s TYR 333 N -2.72 3.39 0.17 5.86 -0.85 -1.26 -0.30 117.35 121.64 1foo s TYR 333 Ca -0.04 1.22 0.07 0.00 -0.52 0.00 0.00 57.07 57.80 1foo s TYR 333 Cb -0.01 -2.55 -0.03 0.00 0.38 0.00 0.00 41.96 39.75 1foo s TYR 333 CO -0.04 0.02 1.38 0.00 -1.52 0.00 0.00 175.55 175.39 1foo h ALA 334 N 1.96 0.53 -2.57 9.51 0.00 -1.45 -3.45 119.26 123.80 1foo h ALA 334 Ca -0.48 -0.79 -0.71 0.00 0.00 0.00 0.00 54.91 52.93 1foo h ALA 334 Cb 1.18 -0.13 -0.21 0.00 0.00 0.00 0.00 17.79 18.63 1foo h ALA 334 CO 0.65 1.07 -0.45 -1.17 0.00 0.00 0.00 179.25 179.35 1foo s LEU 335 N -7.05 4.96 -0.48 0.00 2.96 -1.26 -4.53 118.68 113.28 1foo s LEU 335 Ca -0.00 -0.83 -0.23 0.00 -0.22 0.00 0.00 54.13 52.85 1foo s LEU 335 Cb 0.11 -2.14 0.03 0.00 0.50 0.00 0.00 46.19 44.69 1foo s LEU 335 CO 0.81 -0.41 0.81 -2.16 -1.32 0.00 0.00 176.35 174.08 1foo s PRO 336 N 1.67 3.36 -0.39 0.98 0.04 -1.26 -4.69 135.00 134.71 1foo s PRO 336 Ca 0.05 -0.22 0.02 0.00 0.04 0.00 0.00 61.00 60.89 1foo s PRO 336 Cb -0.19 -3.98 0.12 0.00 0.04 0.00 0.00 34.50 30.49 1foo s PRO 336 CO 0.10 -1.22 0.17 0.00 0.04 0.00 0.00 177.00 176.09 1foo s ALA 337 N 3.40 2.13 0.16 8.56 0.00 -1.26 -3.27 121.76 131.49 1foo s ALA 337 Ca 0.29 -2.35 -0.32 0.00 0.00 0.00 0.00 51.96 49.58 1foo s ALA 337 Cb -0.13 -1.84 -0.11 0.00 0.00 0.00 0.00 23.12 21.05 1foo s ALA 337 CO 0.21 -1.90 1.66 0.08 0.00 0.00 0.00 175.76 175.81 1foo s VAL 338 N 0.76 2.46 0.00 0.00 1.01 -0.72 -1.31 120.40 122.60 1foo s VAL 338 Ca 0.14 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.39 1foo s VAL 338 Cb -0.22 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 32.99 1foo s VAL 338 CO -0.08 0.02 0.51 -1.54 0.00 0.00 0.00 175.10 174.01 1foo n SER 339 N 4.35 0.87 -0.63 3.32 3.41 0.09 -1.82 113.62 123.20 1foo n SER 339 Ca 0.15 -1.25 0.06 0.00 -0.26 0.00 0.00 58.87 57.57 1foo n SER 339 Cb 0.38 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.47 1foo n SER 339 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1foo n ASN 340 N -0.13 2.81 -4.90 4.04 2.04 -1.22 -4.51 115.26 113.39 1foo n ASN 340 Ca 0.00 -1.92 -0.29 0.00 -0.44 0.00 0.00 54.58 51.93 1foo n ASN 340 Cb 0.20 -0.20 -0.03 0.00 -2.53 0.00 0.00 39.78 37.21 1foo n ASN 340 CO 0.00 0.00 0.00 -0.04 -0.44 0.00 0.00 177.26 176.78 1foo s MET 341 N -0.99 3.67 -0.17 -3.83 -1.94 -1.26 -4.40 119.30 110.38 1foo s MET 341 Ca 0.22 0.11 -0.08 0.00 -1.71 0.00 0.00 55.69 54.23 1foo s MET 341 Cb 0.12 -2.61 -0.04 0.00 2.01 0.00 0.00 34.83 34.31 1foo s MET 341 CO 0.16 0.18 0.11 -1.17 -0.01 0.00 0.00 175.02 174.30 1foo s LEU 342 N -3.52 4.14 -0.35 -0.03 0.20 0.05 -4.43 118.68 114.74 1foo s LEU 342 Ca 0.45 0.26 -0.14 0.00 0.69 0.00 0.00 54.13 55.40 1foo s LEU 342 Cb -0.11 -2.04 -0.01 0.00 -0.43 0.00 0.00 46.19 43.60 1foo s LEU 342 CO 0.29 0.26 0.27 -0.22 -0.29 0.00 0.00 176.35 176.66 1foo s LEU 343 N -0.11 4.62 -0.22 -0.68 2.96 -0.77 -0.64 118.68 123.85 1foo s LEU 343 Ca 0.09 -0.48 -0.07 0.00 -0.22 0.00 0.00 54.13 53.45 1foo s LEU 343 Cb -0.12 -2.18 -0.03 0.00 0.50 0.00 0.00 46.19 44.37 1foo s LEU 343 CO 0.00 -0.29 0.05 -0.70 -1.32 0.00 0.00 176.35 174.09 1foo s GLU 344 N 1.77 3.75 -0.12 1.98 -6.30 -0.08 -0.53 118.70 119.17 1foo s GLU 344 Ca 0.07 -0.44 -0.02 0.00 -2.50 0.00 0.00 54.97 52.08 1foo s GLU 344 Cb -0.18 -3.23 0.04 0.00 0.00 0.00 0.00 34.13 30.76 1foo s GLU 344 CO 0.11 0.01 0.01 0.42 0.02 0.00 0.00 175.26 175.82 1foo s ILE 345 N 1.06 0.51 -1.61 -3.70 1.01 -0.44 -1.98 121.20 116.04 1foo s ILE 345 Ca 0.04 -0.17 -0.16 0.00 0.00 0.00 0.00 60.65 60.36 1foo s ILE 345 Cb -0.14 -0.78 0.12 0.00 0.01 0.00 0.00 42.46 41.67 1foo s ILE 345 CO 0.03 0.10 0.87 0.61 0.00 0.00 0.00 174.94 176.55 1foo n GLY 346 N 5.09 -0.46 1.83 6.18 0.00 -1.26 -0.73 105.19 115.83 1foo n GLY 346 Ca -0.08 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1foo n GLY 346 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1foo n GLY 347 N -1.55 2.84 3.77 -0.02 0.00 -1.26 -3.26 105.19 105.70 1foo n GLY 347 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1foo n GLY 347 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1foo s LEU 348 N 0.00 4.01 -0.19 0.99 1.43 0.09 -5.03 118.68 119.98 1foo s LEU 348 Ca 0.00 2.26 0.01 0.00 -1.03 0.00 0.00 54.13 55.38 1foo s LEU 348 Cb 0.00 -4.26 0.03 0.00 0.03 0.00 0.00 46.19 42.00 1foo s LEU 348 CO 0.00 -0.88 -0.16 -1.61 0.23 0.00 0.00 176.35 173.93 1foo s GLU 349 N -2.71 2.62 -0.86 1.70 2.02 -1.26 -1.33 118.70 118.87 1foo s GLU 349 Ca 0.63 -0.90 -0.10 0.00 0.02 0.00 0.00 54.97 54.63 1foo s GLU 349 Cb -0.27 -2.55 0.22 0.00 0.10 0.00 0.00 34.13 31.62 1foo s GLU 349 CO 0.33 -0.32 0.78 -0.06 0.02 0.00 0.00 175.26 176.02 1foo s PHE 350 N 1.29 3.82 0.61 1.61 0.08 0.32 -0.22 117.98 125.48 1foo s PHE 350 Ca 0.01 -2.39 0.34 0.00 0.12 0.00 0.00 56.93 55.01 1foo s PHE 350 Cb -0.15 -3.64 1.98 0.00 -0.57 0.00 0.00 43.02 40.63 1foo s PHE 350 CO -0.10 -0.93 2.27 0.66 -0.10 0.00 0.00 175.22 177.02 1foo h SER 351 N 7.21 0.00 -3.49 1.36 4.64 -1.82 -2.04 113.55 119.41 1foo h SER 351 Ca 0.11 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.83 1foo h SER 351 Cb 0.96 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.66 1foo h SER 351 CO 0.81 0.00 -0.77 0.00 -0.87 0.00 0.00 176.83 176.00 1foo s ALA 352 N -4.49 1.82 -0.49 5.18 0.00 -1.22 -4.66 121.76 117.90 1foo s ALA 352 Ca -0.05 -1.43 0.06 0.00 0.00 0.00 0.00 51.96 50.54 1foo s ALA 352 Cb 0.14 -1.48 0.24 0.00 0.00 0.00 0.00 23.12 22.02 1foo s ALA 352 CO 0.50 -1.33 0.87 0.00 0.00 0.00 0.00 175.76 175.81 1foo n ALA 353 N 4.72 -1.28 -1.78 0.00 0.00 -1.26 -1.55 120.51 119.37 1foo n ALA 353 Ca -0.08 -1.47 -0.41 0.00 0.00 0.00 0.00 53.44 51.48 1foo n ALA 353 Cb 0.44 -1.32 -0.01 0.00 0.00 0.00 0.00 19.45 18.56 1foo n ALA 353 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1foo s PRO 354 N 0.63 4.20 0.11 0.00 0.04 -1.18 -4.71 135.00 134.09 1foo s PRO 354 Ca 0.32 2.44 0.04 0.00 0.04 0.00 0.00 61.00 63.84 1foo s PRO 354 Cb 0.22 -3.01 -0.04 0.00 0.04 0.00 0.00 34.50 31.72 1foo s PRO 354 CO -0.24 -0.41 -0.10 -0.59 0.04 0.00 0.00 177.00 175.70 1foo s PHE 355 N -1.12 1.12 0.01 0.56 -0.12 -0.76 -1.44 117.98 116.23 1foo s PHE 355 Ca 0.51 -0.71 -0.19 0.00 -0.05 0.00 0.00 56.93 56.50 1foo s PHE 355 Cb -0.44 -0.60 0.04 0.00 -0.63 0.00 0.00 43.02 41.39 1foo s PHE 355 CO 0.59 0.01 0.41 -1.54 -0.05 0.00 0.00 175.22 174.65 1foo s SER 356 N -2.70 -0.30 0.00 1.98 1.04 0.17 -1.75 113.70 112.14 1foo s SER 356 Ca 0.09 0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.65 1foo s SER 356 Cb -0.01 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.51 1foo s SER 356 CO -0.00 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.25 1foo n GLY 357 N 0.82 3.70 3.17 7.32 0.00 -1.20 -1.28 105.19 117.72 1foo n GLY 357 Ca -0.20 -0.42 -0.09 0.00 0.00 0.00 0.00 46.02 45.32 1foo n GLY 357 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1foo s TRP 358 N 3.16 0.23 0.48 1.61 -2.14 -1.26 -4.59 118.94 116.44 1foo s TRP 358 Ca 0.00 -0.65 -0.21 0.00 2.66 0.00 0.00 56.10 57.90 1foo s TRP 358 Cb 0.00 -0.14 -0.08 0.00 -3.10 0.00 0.00 33.47 30.15 1foo s TRP 358 CO 0.00 -0.48 1.05 0.71 -2.66 0.00 0.00 176.95 175.58 1foo s TYR 359 N -3.62 2.97 -0.19 1.66 2.02 -1.26 -4.94 117.35 113.99 1foo s TYR 359 Ca 0.03 1.58 -0.08 0.00 -0.37 0.00 0.00 57.07 58.23 1foo s TYR 359 Cb 0.04 -3.11 -0.04 0.00 -0.40 0.00 0.00 41.96 38.45 1foo s TYR 359 CO -0.09 -0.93 0.07 1.41 -1.57 0.00 0.00 175.55 174.44 1foo s MET 360 N -3.16 3.98 0.45 -0.62 -2.45 -1.26 -1.56 119.30 114.68 1foo s MET 360 Ca 0.67 -0.34 0.26 0.00 -1.25 0.00 0.00 55.69 55.03 1foo s MET 360 Cb -0.18 -3.26 1.29 0.00 1.25 0.00 0.00 34.83 33.94 1foo s MET 360 CO 0.22 0.23 1.77 0.66 1.05 0.00 0.00 175.02 178.95 1foo h SER 361 N 6.84 0.27 0.85 1.11 4.64 -1.22 -0.82 113.55 125.22 1foo h SER 361 Ca -0.37 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1foo h SER 361 Cb 1.17 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1foo h SER 361 CO 0.70 0.03 0.00 0.71 -0.87 0.00 0.00 176.83 177.39 1foo h THR 362 N 0.22 0.00 -0.58 2.95 1.35 -1.94 -0.79 112.91 114.13 1foo h THR 362 Ca 0.61 -0.41 -0.04 0.00 -0.55 0.00 0.00 66.41 66.02 1foo h THR 362 Cb 1.89 1.38 -0.03 0.00 -1.73 0.00 0.00 68.15 69.67 1foo h THR 362 CO -0.21 0.00 0.21 -0.33 -0.25 0.00 0.00 175.52 174.94 1foo h GLU 363 N 0.00 0.88 0.00 4.72 5.08 -1.55 -1.15 114.58 122.55 1foo h GLU 363 Ca 0.00 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1foo h GLU 363 Cb 0.42 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1foo h GLU 363 CO 0.00 0.77 -0.12 0.82 -1.00 0.00 0.00 179.01 179.48 1foo h ILE 364 N 0.80 0.00 -0.64 3.13 2.04 -1.61 -1.31 117.51 119.92 1foo h ILE 364 Ca 0.19 -0.83 -0.02 0.00 1.00 0.00 0.00 64.86 65.20 1foo h ILE 364 Cb 0.23 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.28 1foo h ILE 364 CO -0.01 0.00 0.33 1.23 0.00 0.00 0.00 178.15 179.69 1foo h GLY 365 N -0.83 0.97 0.00 5.37 0.00 -1.26 -1.13 103.07 106.18 1foo h GLY 365 Ca 0.00 -0.44 -0.27 0.00 0.00 0.00 0.00 47.33 46.62 1foo h GLY 365 CO 0.00 0.42 -1.83 2.41 0.00 0.00 0.00 176.54 177.55 1foo n THR 366 N -4.36 1.51 0.07 4.70 -1.04 -0.52 -3.99 114.28 110.66 1foo n THR 366 Ca 0.06 -0.15 -0.04 0.00 -2.04 0.00 0.00 64.05 61.88 1foo n THR 366 Cb 0.12 -2.08 -0.02 0.00 -1.82 0.00 0.00 70.33 66.53 1foo n THR 366 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 1foo h ARG 367 N -1.00 -0.23 -0.83 -2.82 2.47 -1.39 -1.90 114.38 108.69 1foo h ARG 367 Ca -0.40 0.02 0.01 0.00 -1.26 0.00 0.00 59.98 58.34 1foo h ARG 367 Cb 1.33 0.05 -0.04 0.00 -1.65 0.00 0.00 29.97 29.66 1foo h ARG 367 CO -0.25 -0.15 0.55 -0.91 0.56 0.00 0.00 179.97 179.77 1foo h ASN 368 N -0.63 0.94 0.51 7.04 2.35 -1.23 -1.07 115.58 123.49 1foo h ASN 368 Ca -0.02 -0.02 -0.29 0.00 -0.55 0.00 0.00 56.30 55.41 1foo h ASN 368 Cb 0.18 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.28 1foo h ASN 368 CO 0.04 0.68 -1.61 -0.07 -1.65 0.00 0.00 177.43 174.82 1foo h LEU 369 N 1.11 0.11 0.00 1.61 3.38 -1.38 -2.58 115.31 117.57 1foo h LEU 369 Ca 0.30 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1foo h LEU 369 Cb -0.12 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.59 1foo h LEU 369 CO -0.07 1.17 -1.02 0.00 0.09 0.00 0.00 178.44 178.62 1foo n ASP 371 N -1.57 1.96 -0.02 0.00 10.43 -0.41 -4.49 116.55 122.45 1foo n ASP 371 Ca 0.01 1.06 0.04 0.00 2.57 0.00 0.00 54.79 58.46 1foo n ASP 371 Cb 0.27 -1.44 0.41 0.00 1.84 0.00 0.00 41.12 42.19 1foo n ASP 371 CO 0.00 0.00 0.00 -0.65 -1.07 0.00 0.00 177.20 175.48 1foo h PRO 372 N 1.77 0.59 -0.54 -0.24 0.11 -1.94 -2.10 132.00 129.63 1foo h PRO 372 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1foo h PRO 372 Cb 1.32 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1foo h PRO 372 CO 0.58 0.39 0.00 -2.39 -0.21 0.00 0.00 178.00 176.37 1foo n HIS 373 N -4.47 0.82 0.00 0.65 1.44 -1.26 -4.61 115.22 107.79 1foo n HIS 373 Ca 0.04 -0.35 0.00 0.00 -2.01 0.00 0.00 57.72 55.39 1foo n HIS 373 Cb 0.06 -0.10 0.00 0.00 0.12 0.00 0.00 29.99 30.07 1foo n HIS 373 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 1foo n ARG 374 N 0.75 2.07 0.29 -1.40 5.12 -0.81 -4.32 116.66 118.35 1foo n ARG 374 Ca 0.16 0.00 0.16 0.00 -1.93 0.00 0.00 57.85 56.24 1foo n ARG 374 Cb 0.52 0.00 0.86 0.00 -1.16 0.00 0.00 32.46 32.68 1foo n ARG 374 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 1foo h TYR 375 N 0.00 0.00 -6.61 -1.55 -1.99 -1.63 -3.42 116.97 101.77 1foo h TYR 375 Ca 0.00 0.00 -0.52 0.00 2.00 0.00 0.00 58.73 60.21 1foo h TYR 375 Cb 0.00 0.00 -0.09 0.00 2.00 0.00 0.00 36.73 38.64 1foo h TYR 375 CO 0.00 0.06 -0.89 -1.71 -0.00 0.00 0.00 178.16 175.62 1foo n ASN 376 N -3.46 -0.46 -0.47 3.88 4.05 -0.83 -4.87 115.26 113.10 1foo n ASN 376 Ca -0.02 -1.05 0.10 0.00 0.45 0.00 0.00 54.58 54.06 1foo n ASN 376 Cb 0.19 -2.81 0.37 0.00 1.23 0.00 0.00 39.78 38.76 1foo n ASN 376 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 177.26 176.51 1foo n ILE 377 N -4.43 0.20 -0.06 -1.44 -5.35 -0.22 -4.48 119.36 103.58 1foo n ILE 377 Ca -0.27 -0.30 -0.10 0.00 -0.27 0.00 0.00 62.75 61.81 1foo n ILE 377 Cb 0.67 0.26 -0.04 0.00 -1.74 0.00 0.00 39.64 38.79 1foo n ILE 377 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 1foo h LEU 378 N 1.85 -1.20 -0.49 7.28 5.85 -1.85 -2.13 115.31 124.62 1foo h LEU 378 Ca 0.00 0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 1foo h LEU 378 Cb 0.41 0.52 -0.02 0.00 0.37 0.00 0.00 40.66 41.93 1foo h LEU 378 CO 0.00 -0.37 0.30 -0.08 -0.34 0.00 0.00 178.44 177.95 1foo h GLU 379 N -0.37 0.66 -0.21 1.25 4.81 -1.97 -0.55 114.58 118.19 1foo h GLU 379 Ca 0.12 -0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.35 1foo h GLU 379 Cb 0.57 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.76 1foo h GLU 379 CO -0.46 0.47 -0.12 -0.44 -0.73 0.00 0.00 179.01 177.72 1foo h ASP 380 N 0.65 -0.40 -0.61 1.04 3.32 -1.78 0.45 116.42 119.08 1foo h ASP 380 Ca 0.18 0.09 -0.07 0.00 0.02 0.00 0.00 57.03 57.25 1foo h ASP 380 Cb -0.03 0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.71 1foo h ASP 380 CO -0.03 -0.16 0.12 0.58 -1.72 0.00 0.00 179.24 178.03 1foo h VAL 381 N -0.11 1.25 -0.51 -1.35 2.07 -1.22 -1.90 116.25 114.48 1foo h VAL 381 Ca 0.12 -0.97 -0.01 0.00 0.82 0.00 0.00 66.70 66.66 1foo h VAL 381 Cb 0.28 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1foo h VAL 381 CO -0.28 0.37 0.29 0.00 0.02 0.00 0.00 177.57 177.97 1foo h ALA 382 N 1.16 0.66 -0.72 1.67 0.00 -0.45 -0.23 119.26 121.34 1foo h ALA 382 Ca 0.20 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1foo h ALA 382 Cb 0.39 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1foo h ALA 382 CO 0.01 0.16 0.48 0.28 0.00 0.00 0.00 179.25 180.18 1foo h VAL 383 N 0.69 1.18 -0.26 0.00 2.07 -0.70 -0.75 116.25 118.48 1foo h VAL 383 Ca 0.18 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 1foo h VAL 383 Cb 0.02 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 29.90 1foo h VAL 383 CO -0.03 0.18 0.02 0.00 0.02 0.00 0.00 177.57 177.75 1foo n MET 385 N -4.35 1.25 -3.63 0.00 2.81 -0.15 -4.92 117.12 108.13 1foo n MET 385 Ca 0.01 -0.36 -0.22 0.00 -1.81 0.00 0.00 57.70 55.32 1foo n MET 385 Cb 0.20 -1.46 0.06 0.00 -0.71 0.00 0.00 33.22 31.31 1foo n MET 385 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1foo n ASP 386 N -0.54 -2.88 -4.96 7.83 2.03 0.22 -5.00 116.55 113.25 1foo n ASP 386 Ca 0.21 -0.70 -0.22 0.00 0.52 0.00 0.00 54.79 54.59 1foo n ASP 386 Cb 0.19 -4.54 -0.01 0.00 -0.72 0.00 0.00 41.12 36.03 1foo n ASP 386 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1foo s LEU 387 N -6.78 4.15 -0.83 -2.67 1.43 -0.63 -5.03 118.68 108.33 1foo s LEU 387 Ca 0.20 0.26 -0.25 0.00 -1.03 0.00 0.00 54.13 53.31 1foo s LEU 387 Cb -0.10 -3.09 0.04 0.00 0.03 0.00 0.00 46.19 43.08 1foo s LEU 387 CO 0.77 -0.20 1.30 -0.62 0.23 0.00 0.00 176.35 177.83 1foo s ASP 388 N -4.02 6.29 0.00 2.29 2.15 -1.26 -4.74 116.67 117.38 1foo s ASP 388 Ca 0.38 -0.87 0.11 0.00 0.43 0.00 0.00 52.55 52.59 1foo s ASP 388 Cb -0.09 -2.54 0.32 0.00 -0.30 0.00 0.00 42.92 40.30 1foo s ASP 388 CO 0.33 -1.67 1.26 0.35 -0.17 0.00 0.00 175.17 175.27 1foo n THR 389 N 6.46 0.45 1.13 1.71 -2.24 -1.26 -3.76 114.28 116.77 1foo n THR 389 Ca 0.12 -0.46 0.12 0.00 -2.27 0.00 0.00 64.05 61.57 1foo n THR 389 Cb 0.49 0.23 0.22 0.00 -2.10 0.00 0.00 70.33 69.18 1foo n THR 389 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1foo n ARG 390 N 0.50 0.79 -3.85 -0.78 1.74 -1.26 -4.90 116.66 108.91 1foo n ARG 390 Ca 0.12 -0.54 -0.12 0.00 -0.77 0.00 0.00 57.85 56.53 1foo n ARG 390 Cb 0.29 -1.49 -0.13 0.00 -1.02 0.00 0.00 32.46 30.11 1foo n ARG 390 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 1foo s THR 391 N -2.59 0.01 0.14 0.55 -1.32 -1.25 -5.05 115.64 106.13 1foo s THR 391 Ca 0.20 -0.08 -0.12 0.00 -1.21 0.00 0.00 61.69 60.48 1foo s THR 391 Cb 0.18 -0.16 -0.04 0.00 -1.51 0.00 0.00 72.50 70.97 1foo s THR 391 CO 0.58 -0.05 1.48 0.71 -2.21 0.00 0.00 174.62 175.14 1foo h THR 392 N 4.94 1.28 0.00 5.08 1.35 -1.90 -3.20 112.91 120.46 1foo h THR 392 Ca -0.25 -1.49 0.00 0.00 -0.55 0.00 0.00 66.41 64.11 1foo h THR 392 Cb 1.20 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.98 1foo h THR 392 CO 0.45 0.50 0.04 -1.54 -0.25 0.00 0.00 175.52 174.71 1foo n SER 393 N -4.11 0.00 0.09 5.36 3.41 -1.26 -0.53 113.62 116.58 1foo n SER 393 Ca -0.02 0.40 0.13 0.00 -0.26 0.00 0.00 58.87 59.12 1foo n SER 393 Cb 0.51 -0.40 0.41 0.00 -0.26 0.00 0.00 64.21 64.47 1foo n SER 393 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1foo n SER 394 N -1.39 0.71 -3.34 4.04 3.41 -1.21 -4.92 113.62 110.92 1foo n SER 394 Ca 0.00 0.52 -0.24 0.00 -0.26 0.00 0.00 58.87 58.89 1foo n SER 394 Cb 0.04 -0.66 0.05 0.00 -0.26 0.00 0.00 64.21 63.37 1foo n SER 394 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1foo n LEU 395 N -2.15 -2.87 0.04 1.04 4.77 0.31 -4.89 117.00 113.26 1foo n LEU 395 Ca 0.06 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.61 1foo n LEU 395 Cb 0.42 -2.91 0.31 0.00 -2.33 0.00 0.00 43.42 38.91 1foo n LEU 395 CO 0.31 0.41 0.89 4.11 -1.33 0.00 0.00 177.39 181.77 1foo h TRP 396 N -1.92 0.45 -0.35 -1.77 5.08 -1.83 -1.29 115.95 114.32 1foo h TRP 396 Ca -0.54 -0.05 -0.08 0.00 1.08 0.00 0.00 58.89 59.29 1foo h TRP 396 Cb 1.36 -0.13 -0.01 0.00 -3.00 0.00 0.00 29.16 27.39 1foo h TRP 396 CO 0.53 0.51 -0.09 0.87 -1.28 0.00 0.00 178.44 178.98 1foo h LYS 397 N 0.40 0.67 -0.45 0.12 1.57 -1.90 -1.99 116.57 115.00 1foo h LYS 397 Ca 0.08 -0.26 -0.01 0.00 -1.87 0.00 0.00 60.65 58.59 1foo h LYS 397 Cb 0.40 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 1foo h LYS 397 CO 0.02 0.84 0.25 -0.44 -0.57 0.00 0.00 179.45 179.56 1foo h ASP 398 N 0.46 0.55 -0.19 0.86 5.19 -1.85 -0.75 116.42 120.70 1foo h ASP 398 Ca 0.09 -0.08 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 1foo h ASP 398 Cb 0.60 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.96 1foo h ASP 398 CO 0.04 0.48 0.08 0.11 -3.12 0.00 0.00 179.24 176.82 1foo h LYS 399 N 0.59 0.29 -0.67 3.56 1.57 -1.20 -2.37 116.57 118.34 1foo h LYS 399 Ca 0.16 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.80 1foo h LYS 399 Cb 0.04 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 1foo h LYS 399 CO -0.03 0.36 0.10 0.00 -0.57 0.00 0.00 179.45 179.31 1foo h ALA 400 N 0.92 0.89 -0.83 3.86 0.00 -1.27 -2.70 119.26 120.14 1foo h ALA 400 Ca 0.06 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.72 1foo h ALA 400 Cb 0.18 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 1foo h ALA 400 CO -0.01 0.67 0.54 0.00 0.00 0.00 0.00 179.25 180.45 1foo h ALA 401 N 1.05 1.08 -0.41 0.00 0.00 -1.04 -0.75 119.26 119.18 1foo h ALA 401 Ca 0.20 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1foo h ALA 401 Cb 0.46 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1foo h ALA 401 CO 0.02 0.39 0.21 0.28 0.00 0.00 0.00 179.25 180.14 1foo h VAL 402 N 1.06 1.17 -0.57 0.00 2.07 -1.15 -1.42 116.25 117.41 1foo h VAL 402 Ca 0.32 -0.48 -0.09 0.00 0.82 0.00 0.00 66.70 67.28 1foo h VAL 402 Cb -0.04 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1foo h VAL 402 CO -0.10 0.18 0.00 -0.33 0.02 0.00 0.00 177.57 177.35 1foo h GLU 403 N 0.53 0.98 -0.66 1.57 4.39 -1.14 -0.36 114.58 119.87 1foo h GLU 403 Ca 0.14 -0.29 -0.04 0.00 0.34 0.00 0.00 59.36 59.51 1foo h GLU 403 Cb 0.10 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 1foo h GLU 403 CO -0.02 0.96 0.26 0.82 -1.16 0.00 0.00 179.01 179.87 1foo h ILE 404 N 0.90 1.24 -0.54 3.13 2.04 -0.98 0.79 117.51 124.10 1foo h ILE 404 Ca 0.16 -0.77 -0.10 0.00 1.00 0.00 0.00 64.86 65.16 1foo h ILE 404 Cb 0.52 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 1foo h ILE 404 CO 0.03 0.30 -0.06 0.78 0.00 0.00 0.00 178.15 179.20 1foo h ASN 405 N 0.94 0.96 -0.64 1.72 2.35 -0.96 -2.04 115.58 117.92 1foo h ASN 405 Ca 0.22 -0.29 -0.09 0.00 -0.55 0.00 0.00 56.30 55.59 1foo h ASN 405 Cb 0.22 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.31 1foo h ASN 405 CO -0.02 1.05 0.04 0.25 -1.65 0.00 0.00 177.43 177.11 1foo h LEU 406 N 0.88 1.06 -0.75 1.61 5.85 -0.71 -2.37 115.31 120.89 1foo h LEU 406 Ca 0.15 -0.29 0.03 0.00 0.84 0.00 0.00 57.88 58.61 1foo h LEU 406 Cb 0.60 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.30 1foo h LEU 406 CO 0.04 1.09 0.47 0.00 -0.34 0.00 0.00 178.44 179.70 1foo h ALA 407 N 1.01 0.98 -0.02 1.25 0.00 -0.51 0.35 119.26 122.33 1foo h ALA 407 Ca 0.19 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1foo h ALA 407 Cb 0.51 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1foo h ALA 407 CO 0.02 0.26 0.01 0.28 0.00 0.00 0.00 179.25 179.83 1foo h VAL 408 N 0.92 1.04 -0.41 0.00 2.07 -1.07 0.05 116.25 118.85 1foo h VAL 408 Ca 0.30 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.70 1foo h VAL 408 Cb 0.02 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 1foo h VAL 408 CO -0.11 0.03 0.25 -0.07 0.02 0.00 0.00 177.57 177.69 1foo h LEU 409 N -0.02 0.50 -0.20 2.57 3.38 -1.07 -1.96 115.31 118.50 1foo h LEU 409 Ca 0.01 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1foo h LEU 409 Cb 0.04 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1foo h LEU 409 CO -0.00 0.41 0.13 -0.74 0.09 0.00 0.00 178.44 178.32 1foo h HIS 410 N 0.54 0.25 -0.43 1.13 2.76 -0.76 -1.64 115.15 117.00 1foo h HIS 410 Ca 0.15 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.28 1foo h HIS 410 Cb 0.00 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 28.86 1foo h HIS 410 CO -0.03 0.16 0.11 0.77 -1.30 0.00 0.00 177.93 177.64 1foo h SER 411 N 0.26 0.65 -0.51 3.26 0.02 -0.88 0.39 113.55 116.74 1foo h SER 411 Ca 0.07 -0.23 -0.05 0.00 -0.84 0.00 0.00 61.79 60.75 1foo h SER 411 Cb -0.02 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.32 1foo h SER 411 CO -0.02 0.71 0.14 -0.26 -1.14 0.00 0.00 176.83 176.27 1foo h PHE 412 N 0.56 0.84 -0.31 3.45 0.04 -1.32 0.25 116.94 120.45 1foo h PHE 412 Ca 0.13 -0.09 -0.00 0.00 2.80 0.00 0.00 57.97 60.81 1foo h PHE 412 Cb 0.31 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 38.21 1foo h PHE 412 CO 0.02 0.74 0.19 1.96 -0.60 0.00 0.00 178.31 180.61 1foo h GLN 413 N 0.70 0.42 -0.29 1.51 4.20 -1.16 0.62 115.11 121.12 1foo h GLN 413 Ca 0.16 -0.04 0.04 0.00 0.06 0.00 0.00 58.65 58.88 1foo h GLN 413 Cb 0.30 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 27.95 1foo h GLN 413 CO -0.00 0.33 0.04 1.25 -0.67 0.00 0.00 178.83 179.78 1foo h LEU 414 N 0.40 -0.02 0.00 1.46 6.46 -0.62 -0.36 115.31 122.64 1foo h LEU 414 Ca 0.11 0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.92 1foo h LEU 414 Cb 0.01 0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.02 1foo h LEU 414 CO -0.02 0.03 0.00 0.00 -0.62 0.00 0.00 178.44 177.83 1foo n ALA 415 N -2.37 2.44 -3.64 1.25 0.00 0.05 -4.89 120.51 113.35 1foo n ALA 415 Ca -0.00 -0.14 -0.22 0.00 0.00 0.00 0.00 53.44 53.07 1foo n ALA 415 Cb 0.13 -1.37 0.06 0.00 0.00 0.00 0.00 19.45 18.27 1foo n ALA 415 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1foo n LYS 416 N -0.94 -6.11 -4.79 0.00 5.02 -0.14 -4.98 118.16 106.21 1foo n LYS 416 Ca 0.17 0.72 -0.33 0.00 -2.02 0.00 0.00 58.31 56.86 1foo n LYS 416 Cb 0.08 -5.57 -0.14 0.00 -0.02 0.00 0.00 35.03 29.37 1foo n LYS 416 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1foo s VAL 417 N -3.45 3.00 0.22 -0.18 1.01 0.05 -4.39 120.40 116.66 1foo s VAL 417 Ca 0.23 -0.68 -0.32 0.00 0.00 0.00 0.00 61.98 61.22 1foo s VAL 417 Cb -0.11 -2.26 -0.13 0.00 0.00 0.00 0.00 36.38 33.88 1foo s VAL 417 CO 0.78 0.53 1.51 0.41 0.00 0.00 0.00 175.10 178.32 1foo n THR 418 N 3.53 0.59 -3.49 3.92 -1.04 0.19 -4.36 114.28 113.62 1foo n THR 418 Ca -0.18 -0.15 -0.15 0.00 -2.04 0.00 0.00 64.05 61.53 1foo n THR 418 Cb 0.53 -1.58 -0.05 0.00 -1.82 0.00 0.00 70.33 67.41 1foo n THR 418 CO 0.00 0.00 0.00 -0.51 -0.64 0.00 0.00 175.07 173.92 1foo s ILE 419 N 0.34 0.00 -0.06 12.58 2.07 -1.26 -4.41 121.20 130.46 1foo s ILE 419 Ca 0.72 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.97 1foo s ILE 419 Cb -0.63 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 40.98 1foo s ILE 419 CO 0.45 0.00 -0.08 0.54 -1.91 0.00 0.00 174.94 173.94 1foo s VAL 420 N -2.00 0.82 0.73 4.00 0.11 -0.60 -4.99 120.40 118.47 1foo s VAL 420 Ca -0.06 -0.28 -0.11 0.00 -2.93 0.00 0.00 61.98 58.60 1foo s VAL 420 Cb -0.00 -0.79 0.03 0.00 -1.53 0.00 0.00 36.38 34.08 1foo s VAL 420 CO 0.02 0.29 1.07 1.51 -3.33 0.00 0.00 175.10 174.66 1foo s ASP 421 N 0.89 5.06 0.55 3.54 -4.77 -1.26 -0.69 116.67 119.99 1foo s ASP 421 Ca -0.11 1.61 0.27 0.00 -3.30 0.00 0.00 52.55 51.02 1foo s ASP 421 Cb -0.15 -2.43 1.61 0.00 -1.09 0.00 0.00 42.92 40.86 1foo s ASP 421 CO 0.01 -1.65 2.17 1.12 0.70 0.00 0.00 175.17 177.52 1foo h HIS 422 N -0.86 0.00 0.16 2.11 2.07 -1.96 -0.82 115.15 115.84 1foo h HIS 422 Ca -0.44 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.07 1foo h HIS 422 Cb 1.22 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.20 1foo h HIS 422 CO 0.59 0.05 -0.08 0.45 -3.07 0.00 0.00 177.93 175.88 1foo h HIS 423 N 0.00 -0.20 -0.79 6.12 3.86 -1.97 -2.36 115.15 119.81 1foo h HIS 423 Ca -0.00 -0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.25 1foo h HIS 423 Cb 0.14 0.06 -0.05 0.00 1.06 0.00 0.00 27.41 28.62 1foo h HIS 423 CO 0.00 0.25 0.50 0.00 0.86 0.00 0.00 177.93 179.53 1foo h ALA 424 N -0.18 1.05 -0.22 2.45 0.00 -1.89 -1.55 119.26 118.91 1foo h ALA 424 Ca -0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1foo h ALA 424 Cb 0.53 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1foo h ALA 424 CO 0.04 0.28 0.11 0.00 0.00 0.00 0.00 179.25 179.68 1foo h ALA 425 N 1.35 0.29 -0.23 0.00 0.00 -1.21 -1.37 119.26 118.08 1foo h ALA 425 Ca 0.33 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 55.04 1foo h ALA 425 Cb 0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1foo h ALA 425 CO -0.13 -0.16 -0.37 1.79 0.00 0.00 0.00 179.25 180.37 1foo h THR 426 N 0.24 1.30 -0.55 0.00 1.35 -1.18 -0.26 112.91 113.80 1foo h THR 426 Ca 0.08 -1.50 -0.02 0.00 -0.55 0.00 0.00 66.41 64.41 1foo h THR 426 Cb 0.10 1.53 -0.02 0.00 -1.73 0.00 0.00 68.15 68.02 1foo h THR 426 CO -0.01 0.47 0.25 0.58 -0.25 0.00 0.00 175.52 176.56 1foo h VAL 427 N 0.42 1.21 -0.27 6.82 2.07 -1.16 -1.30 116.25 124.04 1foo h VAL 427 Ca 0.04 -0.62 -0.06 0.00 0.82 0.00 0.00 66.70 66.88 1foo h VAL 427 Cb 0.84 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1foo h VAL 427 CO 0.07 0.24 -0.09 0.77 0.02 0.00 0.00 177.57 178.58 1foo h SER 428 N 0.74 0.42 0.41 0.57 4.64 -0.82 -2.01 113.55 117.51 1foo h SER 428 Ca 0.19 -0.10 -0.10 0.00 -0.47 0.00 0.00 61.79 61.31 1foo h SER 428 Cb 0.15 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 1foo h SER 428 CO -0.02 0.56 -0.46 0.15 -0.87 0.00 0.00 176.83 176.18 1foo h PHE 429 N 0.41 0.08 -0.56 4.77 3.57 -0.46 -1.10 116.94 123.65 1foo h PHE 429 Ca 0.08 -0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.47 1foo h PHE 429 Cb 0.42 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.12 1foo h PHE 429 CO 0.01 0.52 -0.03 0.52 -2.23 0.00 0.00 178.31 177.10 1foo h MET 430 N 0.05 0.99 -0.57 1.11 2.86 -0.53 0.19 114.93 119.03 1foo h MET 430 Ca 0.00 -0.31 -0.04 0.00 -2.06 0.00 0.00 59.70 57.28 1foo h MET 430 Cb 0.84 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.39 1foo h MET 430 CO 0.06 0.99 0.18 -0.22 1.06 0.00 0.00 176.91 178.98 1foo h LYS 431 N 0.90 0.88 -0.55 1.72 1.63 -1.05 -2.11 116.57 117.98 1foo h LYS 431 Ca 0.16 -0.18 0.02 0.00 -0.85 0.00 0.00 60.65 59.79 1foo h LYS 431 Cb 0.56 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 32.03 1foo h LYS 431 CO 0.03 0.79 0.35 1.25 -3.45 0.00 0.00 179.45 178.42 1foo h HIS 432 N 0.79 0.66 -0.80 1.91 2.76 -0.66 -0.34 115.15 119.48 1foo h HIS 432 Ca 0.18 0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.39 1foo h HIS 432 Cb 0.27 -0.22 -0.04 0.00 1.55 0.00 0.00 27.41 28.97 1foo h HIS 432 CO 0.02 0.40 0.53 -0.07 -1.30 0.00 0.00 177.93 177.50 1foo h LEU 433 N 0.71 0.87 -0.31 0.26 3.38 -0.61 0.53 115.31 120.14 1foo h LEU 433 Ca 0.21 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 58.01 1foo h LEU 433 Cb -0.03 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.50 1foo h LEU 433 CO -0.07 0.62 -0.43 -0.78 0.09 0.00 0.00 178.44 177.86 1foo h ASP 434 N 1.02 0.92 -0.12 -0.43 1.82 -0.72 -0.24 116.42 118.67 1foo h ASP 434 Ca 0.31 -0.50 0.00 0.00 -0.39 0.00 0.00 57.03 56.44 1foo h ASP 434 Cb -0.03 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 39.71 1foo h ASP 434 CO -0.08 1.24 0.08 0.78 -1.61 0.00 0.00 179.24 179.65 1foo h ASN 435 N 0.63 0.15 0.26 2.28 2.35 -0.49 -2.82 115.58 117.94 1foo h ASN 435 Ca 0.03 -0.03 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 1foo h ASN 435 Cb 1.03 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 39.35 1foo h ASN 435 CO 0.10 0.13 -0.28 -0.33 -1.65 0.00 0.00 177.43 175.40 1foo h GLU 436 N 0.15 0.05 -0.57 0.81 4.39 -0.84 0.23 114.58 118.79 1foo h GLU 436 Ca 0.05 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 1foo h GLU 436 Cb 0.01 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 1foo h GLU 436 CO -0.01 0.33 0.28 0.37 -1.16 0.00 0.00 179.01 178.82 1foo h GLN 437 N 0.04 0.82 -0.16 2.33 5.75 -0.80 0.19 115.11 123.28 1foo h GLN 437 Ca 0.00 -0.12 -0.19 0.00 -0.15 0.00 0.00 58.65 58.20 1foo h GLN 437 Cb 0.53 -0.15 0.01 0.00 1.07 0.00 0.00 27.48 28.94 1foo h GLN 437 CO 0.04 0.66 -0.63 0.87 -2.65 0.00 0.00 178.83 177.12 1foo h LYS 438 N 0.77 0.71 -0.04 1.69 1.57 -1.25 -1.23 116.57 118.80 1foo h LYS 438 Ca 0.20 -0.55 -0.24 0.00 -1.87 0.00 0.00 60.65 58.18 1foo h LYS 438 Cb 0.11 0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.54 1foo h LYS 438 CO -0.03 1.17 -0.94 0.00 -0.57 0.00 0.00 179.45 179.08 1foo h ALA 439 N 0.55 0.25 0.00 3.86 0.00 -0.78 -3.40 119.26 119.73 1foo h ALA 439 Ca -0.03 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1foo h ALA 439 Cb 1.26 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1foo h ALA 439 CO 0.13 0.71 0.00 0.54 0.00 0.00 0.00 179.25 180.64 1foo n ARG 440 N -3.85 -0.24 -0.88 0.00 1.74 0.63 -5.01 116.66 109.04 1foo n ARG 440 Ca -0.09 -0.33 0.00 0.00 -0.77 0.00 0.00 57.85 56.66 1foo n ARG 440 Cb 0.83 -0.74 0.00 0.00 -1.02 0.00 0.00 32.46 31.53 1foo n ARG 440 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1foo n GLY 441 N -0.03 0.52 0.00 -0.13 0.00 -0.46 -4.02 105.19 101.07 1foo n GLY 441 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1foo n GLY 441 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1foo n GLY 442 N -2.88 -2.22 3.56 -0.02 0.00 -1.15 -1.55 105.19 100.94 1foo n GLY 442 Ca 0.00 -1.32 -0.01 0.00 0.00 0.00 0.00 46.02 44.69 1foo n GLY 442 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1foo s PRO 444 N 2.87 4.24 -0.04 0.00 0.04 -1.26 -4.59 135.00 136.27 1foo s PRO 444 Ca -0.03 2.05 -0.03 0.00 0.04 0.00 0.00 61.00 63.03 1foo s PRO 444 Cb -0.12 -3.66 0.01 0.00 0.04 0.00 0.00 34.50 30.77 1foo s PRO 444 CO -0.19 -0.66 0.09 0.00 0.04 0.00 0.00 177.00 176.28 1foo s ALA 445 N 2.81 -0.20 -0.61 8.56 0.00 -0.61 -4.05 121.76 127.67 1foo s ALA 445 Ca 0.67 0.30 -0.17 0.00 0.00 0.00 0.00 51.96 52.76 1foo s ALA 445 Cb -0.33 -0.19 0.14 0.00 0.00 0.00 0.00 23.12 22.74 1foo s ALA 445 CO 0.27 -0.06 0.61 0.34 0.00 0.00 0.00 175.76 176.92 1foo s ASP 446 N 0.25 6.28 0.19 0.00 -1.08 0.52 -3.70 116.67 119.13 1foo s ASP 446 Ca -0.02 -1.83 -0.20 0.00 -0.52 0.00 0.00 52.55 49.99 1foo s ASP 446 Cb -0.03 -2.24 0.14 0.00 -1.46 0.00 0.00 42.92 39.34 1foo s ASP 446 CO -0.01 -0.90 1.59 -0.25 0.52 0.00 0.00 175.17 176.12 1foo h TRP 447 N 8.81 -0.89 -0.23 -5.34 7.01 -1.90 0.07 115.95 123.48 1foo h TRP 447 Ca -0.23 0.07 0.07 0.00 2.11 0.00 0.00 58.89 60.91 1foo h TRP 447 Cb 1.09 0.48 -0.01 0.00 -2.10 0.00 0.00 29.16 28.62 1foo h TRP 447 CO 0.81 -0.38 0.22 0.00 -2.79 0.00 0.00 178.44 176.31 1foo h ALA 448 N 1.08 1.95 0.00 2.65 0.00 -1.93 -1.44 119.26 121.57 1foo h ALA 448 Ca 0.25 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.00 1foo h ALA 448 Cb 0.55 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1foo h ALA 448 CO -0.70 -0.34 -1.78 0.91 0.00 0.00 0.00 179.25 177.33 1foo n TRP 449 N -3.97 0.46 0.07 0.00 7.02 -0.15 -4.40 117.44 116.47 1foo n TRP 449 Ca 0.03 0.15 -0.21 0.00 -1.02 0.00 0.00 57.50 56.45 1foo n TRP 449 Cb 0.36 -0.89 -0.14 0.00 -2.42 0.00 0.00 31.31 28.23 1foo n TRP 449 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 1foo h ILE 450 N 0.00 1.40 -3.00 -0.99 1.08 -0.43 -3.45 117.51 112.13 1foo h ILE 450 Ca -0.20 -2.46 -0.53 0.00 -0.39 0.00 0.00 64.86 61.28 1foo h ILE 450 Cb 1.53 2.94 0.03 0.00 -3.07 0.00 0.00 36.82 38.25 1foo h ILE 450 CO 0.02 0.72 0.74 -0.69 -0.69 0.00 0.00 178.15 178.26 1foo s VAL 451 N -2.74 3.22 0.64 1.67 1.01 -0.61 -4.96 120.40 118.64 1foo s VAL 451 Ca -0.12 0.88 -0.18 0.00 0.00 0.00 0.00 61.98 62.57 1foo s VAL 451 Cb 0.03 -3.56 -0.01 0.00 0.00 0.00 0.00 36.38 32.83 1foo s VAL 451 CO 0.88 0.07 1.24 -2.84 0.00 0.00 0.00 175.10 174.45 1foo s PRO 452 N 1.06 2.68 0.33 2.72 0.02 -1.26 -4.92 135.00 135.62 1foo s PRO 452 Ca 0.65 1.90 0.25 0.00 0.02 0.00 0.00 61.00 63.82 1foo s PRO 452 Cb -0.38 -1.88 1.18 0.00 0.02 0.00 0.00 34.50 33.44 1foo s PRO 452 CO 0.31 -1.46 1.74 -1.00 -0.33 0.00 0.00 177.00 176.26 1foo h PRO 453 N 0.56 0.00 -5.09 5.54 0.13 -1.93 -3.35 132.00 127.86 1foo h PRO 453 Ca -0.50 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.27 1foo h PRO 453 Cb 1.31 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.25 1foo h PRO 453 CO 0.53 0.00 -0.75 0.96 -0.23 0.00 0.00 178.00 178.51 1foo s ILE 454 N -3.49 0.99 -1.26 -3.56 -4.36 -1.26 -4.85 121.20 103.40 1foo s ILE 454 Ca 0.00 -1.48 -0.02 0.00 -0.26 0.00 0.00 60.65 58.90 1foo s ILE 454 Cb 0.08 -1.20 0.01 0.00 1.25 0.00 0.00 42.46 42.60 1foo s ILE 454 CO 0.31 -0.42 0.14 -1.20 0.24 0.00 0.00 174.94 174.01 1foo n SER 455 N 0.89 -4.45 -0.31 4.36 7.64 -1.26 -4.89 113.62 115.59 1foo n SER 455 Ca -0.18 0.02 -0.08 0.00 1.01 0.00 0.00 58.87 59.64 1foo n SER 455 Cb 0.56 -3.72 -0.07 0.00 -1.01 0.00 0.00 64.21 59.97 1foo n SER 455 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1foo n GLY 456 N -0.97 -2.47 0.00 0.23 0.00 -1.26 -0.81 105.19 99.92 1foo n GLY 456 Ca -0.14 0.98 0.13 0.00 0.00 0.00 0.00 46.02 46.99 1foo n GLY 456 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1foo n SER 457 N -4.71 0.00 -0.07 1.61 3.41 -1.26 -2.19 113.62 110.41 1foo n SER 457 Ca 0.01 -0.71 0.13 0.00 -0.26 0.00 0.00 58.87 58.05 1foo n SER 457 Cb 0.19 -0.04 0.42 0.00 -0.26 0.00 0.00 64.21 64.52 1foo n SER 457 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1foo n LEU 458 N -1.04 0.50 -4.80 1.04 4.77 0.01 -4.84 117.00 112.64 1foo n LEU 458 Ca 0.18 0.05 -0.26 0.00 -0.03 0.00 0.00 56.01 55.95 1foo n LEU 458 Cb 0.10 -0.26 -0.05 0.00 -2.33 0.00 0.00 43.42 40.88 1foo n LEU 458 CO 0.15 0.11 -0.21 0.42 -1.33 0.00 0.00 177.39 176.53 1foo s THR 459 N -2.80 4.51 0.41 -5.08 -4.23 -0.93 -5.04 115.64 102.48 1foo s THR 459 Ca 0.18 -1.10 0.15 0.00 -1.18 0.00 0.00 61.69 59.73 1foo s THR 459 Cb 0.19 -3.31 0.15 0.00 1.34 0.00 0.00 72.50 70.86 1foo s THR 459 CO 0.59 -0.13 1.93 1.55 -0.54 0.00 0.00 174.62 178.01 1foo h PRO 460 N 2.31 0.00 0.00 3.99 0.13 -1.88 -3.16 132.00 133.38 1foo h PRO 460 Ca -0.48 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 1foo h PRO 460 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1foo h PRO 460 CO 0.63 0.26 -0.24 -0.39 -0.23 0.00 0.00 178.00 178.03 1foo h VAL 461 N 0.00 1.08 -0.89 1.56 -1.51 -1.89 -2.75 116.25 111.86 1foo h VAL 461 Ca -0.00 -0.83 0.13 0.00 -1.23 0.00 0.00 66.70 64.76 1foo h VAL 461 Cb 0.47 1.46 -0.07 0.00 -2.13 0.00 0.00 31.29 31.02 1foo h VAL 461 CO 0.03 0.23 0.57 0.15 -1.23 0.00 0.00 177.57 177.33 1foo h PHE 462 N 0.00 0.87 -0.13 5.19 3.57 -1.74 -1.11 116.94 123.58 1foo h PHE 462 Ca -0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1foo h PHE 462 Cb 0.44 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.90 1foo h PHE 462 CO 0.00 0.35 0.00 0.72 -2.23 0.00 0.00 178.31 177.15 1foo n HIS 463 N -4.55 0.16 -3.65 0.41 8.25 -1.04 -4.79 115.22 110.01 1foo n HIS 463 Ca 0.16 -0.08 -0.38 0.00 -0.26 0.00 0.00 57.72 57.16 1foo n HIS 463 Cb 0.41 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.40 1foo n HIS 463 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 1foo s GLN 464 N -1.84 3.56 0.55 -0.41 2.00 -0.42 -1.27 119.66 121.83 1foo s GLN 464 Ca 0.32 -0.57 -0.19 0.00 -2.00 0.00 0.00 55.36 52.92 1foo s GLN 464 Cb 0.17 -3.56 -0.06 0.00 0.80 0.00 0.00 33.01 30.37 1foo s GLN 464 CO 0.26 -0.32 1.14 -1.21 -0.50 0.00 0.00 175.29 174.67 1foo s GLU 465 N 1.66 3.33 0.03 1.67 2.02 -0.37 -4.99 118.70 122.05 1foo s GLU 465 Ca 0.06 1.64 0.02 0.00 0.02 0.00 0.00 54.97 56.70 1foo s GLU 465 Cb -0.16 -2.01 -0.02 0.00 0.10 0.00 0.00 34.13 32.04 1foo s GLU 465 CO 0.07 -0.88 -0.06 -1.64 0.02 0.00 0.00 175.26 172.77 1foo s MET 466 N -3.27 0.46 -0.18 1.61 -1.94 -1.26 -4.72 119.30 110.00 1foo s MET 466 Ca 0.73 -0.64 -0.04 0.00 -1.71 0.00 0.00 55.69 54.03 1foo s MET 466 Cb -0.25 -0.22 -0.02 0.00 2.01 0.00 0.00 34.83 36.35 1foo s MET 466 CO 0.28 0.04 -0.04 0.08 -0.01 0.00 0.00 175.02 175.37 1foo s VAL 467 N -1.21 3.74 -0.14 -6.03 1.01 -1.26 -4.90 120.40 111.61 1foo s VAL 467 Ca -0.09 -0.40 -0.03 0.00 0.00 0.00 0.00 61.98 61.46 1foo s VAL 467 Cb -0.09 -2.66 -0.03 0.00 0.00 0.00 0.00 36.38 33.60 1foo s VAL 467 CO 0.00 0.46 -0.03 0.21 0.00 0.00 0.00 175.10 175.74 1foo s ASN 468 N 0.74 4.85 0.09 3.32 3.04 -1.24 -1.58 114.94 124.17 1foo s ASN 468 Ca -0.02 -0.09 -0.25 0.00 0.04 0.00 0.00 52.86 52.55 1foo s ASN 468 Cb -0.14 -1.70 0.08 0.00 -1.54 0.00 0.00 41.25 37.94 1foo s ASN 468 CO 0.02 0.21 0.71 -0.72 -3.04 0.00 0.00 177.10 174.28 1foo s TYR 469 N 0.13 -0.47 -0.27 0.43 -0.85 -1.26 -4.97 117.35 110.09 1foo s TYR 469 Ca -0.01 0.29 -0.13 0.00 -0.52 0.00 0.00 57.07 56.70 1foo s TYR 469 Cb -0.14 0.55 -0.04 0.00 0.38 0.00 0.00 41.96 42.71 1foo s TYR 469 CO 0.03 -0.73 0.27 0.42 -1.52 0.00 0.00 175.55 174.02 1foo s ILE 470 N -3.49 5.25 0.14 -3.49 1.01 -1.26 -4.83 121.20 114.53 1foo s ILE 470 Ca 0.02 0.36 0.09 0.00 0.00 0.00 0.00 60.65 61.12 1foo s ILE 470 Cb -0.01 -3.61 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 1foo s ILE 470 CO -0.11 0.21 -0.14 -0.76 0.00 0.00 0.00 174.94 174.14 1foo s LEU 471 N 1.86 2.84 0.06 2.97 1.43 -1.26 -4.13 118.68 122.46 1foo s LEU 471 Ca 0.11 -0.54 0.09 0.00 -1.03 0.00 0.00 54.13 52.75 1foo s LEU 471 Cb -0.16 -1.63 -0.03 0.00 0.03 0.00 0.00 46.19 44.41 1foo s LEU 471 CO 0.10 0.15 -0.23 -0.55 0.23 0.00 0.00 176.35 176.05 1foo s SER 472 N -2.38 2.82 0.70 2.29 0.15 -1.26 -4.14 113.70 111.88 1foo s SER 472 Ca 0.21 -0.59 -0.16 0.00 0.70 0.00 0.00 55.95 56.11 1foo s SER 472 Cb -0.10 -0.23 -0.05 0.00 -1.71 0.00 0.00 66.02 63.93 1foo s SER 472 CO 0.12 0.19 0.51 -2.65 1.20 0.00 0.00 173.24 172.61 1foo n PRO 473 N 1.65 0.33 -3.63 5.44 -0.02 -1.26 -5.00 135.00 132.50 1foo n PRO 473 Ca -0.17 0.15 -0.10 0.00 -2.02 0.00 0.00 63.50 61.35 1foo n PRO 473 Cb 0.53 -1.79 -0.03 0.00 -0.02 0.00 0.00 33.50 32.18 1foo n PRO 473 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1foo s ALA 474 N -1.88 -1.15 -0.12 3.55 0.00 -0.84 -4.04 121.76 117.27 1foo s ALA 474 Ca 0.66 0.02 -0.05 0.00 0.00 0.00 0.00 51.96 52.58 1foo s ALA 474 Cb -0.36 0.83 -0.04 0.00 0.00 0.00 0.00 23.12 23.55 1foo s ALA 474 CO 0.58 -0.78 0.07 -0.06 0.00 0.00 0.00 175.76 175.57 1foo s PHE 475 N -3.83 3.34 0.09 0.00 0.40 -1.26 -0.90 117.98 115.82 1foo s PHE 475 Ca 0.06 0.29 0.01 0.00 -0.60 0.00 0.00 56.93 56.68 1foo s PHE 475 Cb -0.01 -1.92 -0.04 0.00 0.51 0.00 0.00 43.02 41.56 1foo s PHE 475 CO -0.07 0.48 -0.06 1.03 0.70 0.00 0.00 175.22 177.31 1foo s ARG 476 N -0.60 0.77 0.50 0.44 0.52 0.18 -4.95 118.95 115.81 1foo s ARG 476 Ca 0.11 -1.30 -0.18 0.00 -0.52 0.00 0.00 55.73 53.84 1foo s ARG 476 Cb -0.12 -0.10 -0.08 0.00 0.52 0.00 0.00 34.95 35.17 1foo s ARG 476 CO 0.02 -0.04 0.99 0.71 0.02 0.00 0.00 175.30 177.00 1foo s TYR 477 N -3.69 3.35 0.03 -0.53 2.02 -1.26 -0.77 117.35 116.50 1foo s TYR 477 Ca 0.10 1.52 -0.00 0.00 -0.37 0.00 0.00 57.07 58.32 1foo s TYR 477 Cb 0.06 -2.84 -0.03 0.00 -0.40 0.00 0.00 41.96 38.75 1foo s TYR 477 CO -0.06 -0.39 -0.03 1.14 -1.57 0.00 0.00 175.55 174.64 1foo s GLN 478 N -3.78 0.43 0.71 -0.62 -2.07 -1.26 -1.88 119.66 111.19 1foo s GLN 478 Ca 0.61 -0.83 -0.16 0.00 -1.82 0.00 0.00 55.36 53.15 1foo s GLN 478 Cb -0.11 0.13 0.03 0.00 -1.09 0.00 0.00 33.01 31.97 1foo s GLN 478 CO 0.26 -0.07 1.25 -2.14 -1.32 0.00 0.00 175.29 173.27 1foo s PRO 479 N -2.34 2.18 0.31 9.60 0.02 -1.26 -4.94 135.00 138.55 1foo s PRO 479 Ca -0.08 1.90 -0.29 0.00 0.02 0.00 0.00 61.00 62.56 1foo s PRO 479 Cb -0.04 -1.82 -0.10 0.00 0.02 0.00 0.00 34.50 32.56 1foo s PRO 479 CO -0.04 -1.84 1.28 -0.51 -0.33 0.00 0.00 177.00 175.55 1foo s ASP 480 N -1.77 6.87 0.62 2.53 1.01 -1.26 -4.92 116.67 119.75 1foo s ASP 480 Ca 0.78 2.59 0.39 0.00 0.71 0.00 0.00 52.55 57.02 1foo s ASP 480 Cb -0.33 -2.64 2.02 0.00 1.01 0.00 0.00 42.92 42.98 1foo s ASP 480 CO 0.44 -0.47 2.24 1.55 0.21 0.00 0.00 175.17 179.14 1foo h PRO 481 N 3.73 0.00 -0.01 8.23 0.13 -1.94 -3.52 132.00 138.61 1foo h PRO 481 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1foo h PRO 481 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1foo h PRO 481 CO 0.67 0.01 0.00 -2.67 -0.23 0.00 0.00 178.00 175.79