#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x27 s LEU 65 N 0.00 3.50 0.02 1.20 2.96 -1.26 0.38 118.68 125.49 1x27 s LEU 65 Ca 0.00 -0.02 0.01 0.00 -0.22 0.00 0.00 54.13 53.90 1x27 s LEU 65 Cb 0.00 -1.86 -0.02 0.00 0.50 0.00 0.00 46.19 44.82 1x27 s LEU 65 CO 0.00 0.19 -0.04 0.68 -1.32 0.00 0.00 176.35 175.86 1x27 s VAL 66 N 0.24 0.27 -0.12 1.68 -7.23 -0.66 0.25 120.40 114.83 1x27 s VAL 66 Ca 0.00 -0.81 -0.03 0.00 -1.81 0.00 0.00 61.98 59.34 1x27 s VAL 66 Cb -0.13 -0.36 -0.03 0.00 0.56 0.00 0.00 36.38 36.42 1x27 s VAL 66 CO 0.02 -0.35 -0.01 -0.51 -0.31 0.00 0.00 175.10 173.94 1x27 s ILE 67 N -1.15 4.21 -0.33 -0.62 1.10 -0.78 -0.70 121.20 122.92 1x27 s ILE 67 Ca -0.11 -0.27 -0.29 0.00 -0.51 0.00 0.00 60.65 59.48 1x27 s ILE 67 Cb -0.08 -2.81 -0.01 0.00 0.15 0.00 0.00 42.46 39.71 1x27 s ILE 67 CO -0.00 0.55 1.54 0.00 -2.11 0.00 0.00 174.94 174.92 1x27 s ALA 68 N -0.32 3.10 0.05 1.50 0.00 0.03 -2.11 121.76 124.02 1x27 s ALA 68 Ca 0.06 0.13 0.28 0.00 0.00 0.00 0.00 51.96 52.43 1x27 s ALA 68 Cb -0.12 -3.92 1.04 0.00 0.00 0.00 0.00 23.12 20.12 1x27 s ALA 68 CO 0.02 -2.27 1.87 -0.07 0.00 0.00 0.00 175.76 175.31 1x27 h LEU 69 N 12.27 0.00 -7.93 0.00 3.38 -0.21 0.46 115.31 123.28 1x27 h LEU 69 Ca -0.30 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.59 1x27 h LEU 69 Cb 1.13 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.76 1x27 h LEU 69 CO 1.05 0.11 -0.22 -1.00 0.09 0.00 0.00 178.44 178.46 1x27 s HIS 70 N -3.60 0.22 0.52 1.13 3.76 -1.20 -4.78 115.29 111.35 1x27 s HIS 70 Ca 0.02 -0.58 -0.12 0.00 -0.15 0.00 0.00 55.06 54.22 1x27 s HIS 70 Cb 0.09 0.08 -0.06 0.00 1.11 0.00 0.00 32.58 33.80 1x27 s HIS 70 CO 0.60 -0.76 0.93 -1.12 -0.85 0.00 0.00 174.74 173.54 1x27 s SER 71 N -2.93 6.43 -0.13 1.40 0.01 -1.26 -4.12 113.70 113.10 1x27 s SER 71 Ca 0.14 1.34 -0.05 0.00 1.31 0.00 0.00 55.95 58.69 1x27 s SER 71 Cb 0.02 -2.42 0.06 0.00 0.21 0.00 0.00 66.02 63.89 1x27 s SER 71 CO -0.02 -0.64 0.27 -0.47 0.41 0.00 0.00 173.24 172.79 1x27 s TYR 72 N -2.77 -0.43 -0.18 2.43 5.04 -0.22 -4.89 117.35 116.34 1x27 s TYR 72 Ca 0.54 0.97 -0.16 0.00 -2.44 0.00 0.00 57.07 55.98 1x27 s TYR 72 Cb -0.10 -0.02 -0.04 0.00 0.35 0.00 0.00 41.96 42.15 1x27 s TYR 72 CO 0.40 -0.35 0.41 -2.00 -1.34 0.00 0.00 175.55 172.68 1x27 s GLU 73 N 2.29 4.21 0.07 4.97 -6.30 -1.26 -1.87 118.70 120.81 1x27 s GLU 73 Ca -0.00 0.25 -0.37 0.00 -2.50 0.00 0.00 54.97 52.35 1x27 s GLU 73 Cb -0.12 -3.51 -0.17 0.00 0.00 0.00 0.00 34.13 30.33 1x27 s GLU 73 CO -0.09 0.01 1.30 -2.30 0.02 0.00 0.00 175.26 174.21 1x27 n PRO 74 N 4.28 0.96 -0.06 4.30 -0.02 -1.26 -4.90 135.00 138.30 1x27 n PRO 74 Ca -0.08 0.35 -0.11 0.00 -2.02 0.00 0.00 63.50 61.63 1x27 n PRO 74 Cb 0.51 -1.97 -0.04 0.00 -0.02 0.00 0.00 33.50 31.98 1x27 n PRO 74 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1x27 n SER 75 N 2.40 1.37 -4.86 2.55 2.88 -1.26 -5.05 113.62 111.64 1x27 n SER 75 Ca 0.19 0.10 -0.21 0.00 -1.33 0.00 0.00 58.87 57.61 1x27 n SER 75 Cb 0.17 -0.30 -0.04 0.00 -0.75 0.00 0.00 64.21 63.29 1x27 n SER 75 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1x27 s HIS 76 N -2.21 2.72 0.48 0.66 3.76 -1.26 -5.06 115.29 114.38 1x27 s HIS 76 Ca -0.16 -0.47 -0.24 0.00 -0.15 0.00 0.00 55.06 54.04 1x27 s HIS 76 Cb 0.06 -2.10 -0.07 0.00 1.11 0.00 0.00 32.58 31.58 1x27 s HIS 76 CO 0.22 -0.05 1.33 -0.51 -0.85 0.00 0.00 174.74 174.87 1x27 s ASP 77 N -4.09 5.81 0.00 1.40 1.11 -1.26 -2.28 116.67 117.36 1x27 s ASP 77 Ca 0.47 2.70 0.00 0.00 0.18 0.00 0.00 52.55 55.89 1x27 s ASP 77 Cb -0.03 -2.64 0.00 0.00 1.07 0.00 0.00 42.92 41.33 1x27 s ASP 77 CO 0.27 -1.20 0.00 0.61 1.18 0.00 0.00 175.17 176.03 1x27 n GLY 78 N 0.63 0.57 3.82 0.21 0.00 -1.26 -4.99 105.19 104.18 1x27 n GLY 78 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1x27 n GLY 78 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x27 s ASP 79 N -2.42 5.34 -0.22 1.61 1.11 -0.97 -1.20 116.67 119.93 1x27 s ASP 79 Ca 0.00 1.53 0.01 0.00 0.18 0.00 0.00 52.55 54.27 1x27 s ASP 79 Cb 0.00 -2.41 0.05 0.00 1.07 0.00 0.00 42.92 41.64 1x27 s ASP 79 CO 0.00 -1.46 -0.07 -0.22 1.18 0.00 0.00 175.17 174.61 1x27 s LEU 80 N -5.54 2.41 0.52 1.23 2.96 -0.09 -4.47 118.68 115.69 1x27 s LEU 80 Ca 0.58 -1.05 -0.18 0.00 -0.22 0.00 0.00 54.13 53.25 1x27 s LEU 80 Cb -0.14 -1.17 -0.07 0.00 0.50 0.00 0.00 46.19 45.31 1x27 s LEU 80 CO 0.55 -0.21 1.02 -0.83 -1.32 0.00 0.00 176.35 175.56 1x27 s GLY 81 N 1.42 2.29 -0.13 7.98 0.00 -1.26 -4.74 107.32 112.87 1x27 s GLY 81 Ca -0.04 0.43 -0.27 0.00 0.00 0.00 0.00 44.72 44.84 1x27 s GLY 81 CO -0.07 0.74 0.66 -0.11 0.00 0.00 0.00 173.10 174.32 1x27 s PHE 82 N -2.27 -0.67 0.39 1.90 -0.12 -0.78 -4.99 117.98 111.43 1x27 s PHE 82 Ca 0.64 1.36 -0.24 0.00 -0.05 0.00 0.00 56.93 58.64 1x27 s PHE 82 Cb -0.14 0.33 -0.10 0.00 -0.63 0.00 0.00 43.02 42.48 1x27 s PHE 82 CO 0.26 -0.50 0.99 -2.00 -0.05 0.00 0.00 175.22 173.93 1x27 s GLU 83 N -0.57 4.29 0.12 1.99 2.12 -1.26 -1.05 118.70 124.33 1x27 s GLU 83 Ca -0.07 1.36 -0.32 0.00 0.36 0.00 0.00 54.97 56.30 1x27 s GLU 83 Cb -0.02 -2.52 -0.12 0.00 0.26 0.00 0.00 34.13 31.73 1x27 s GLU 83 CO 0.06 -0.00 1.78 1.17 -0.54 0.00 0.00 175.26 177.73 1x27 n LYS 84 N -0.05 2.60 -0.52 4.30 4.81 -1.26 -1.86 118.16 126.17 1x27 n LYS 84 Ca 0.05 0.94 0.00 0.00 -0.87 0.00 0.00 58.31 58.43 1x27 n LYS 84 Cb 0.51 -2.80 0.00 0.00 0.02 0.00 0.00 35.03 32.76 1x27 n LYS 84 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x27 n GLY 85 N 4.06 0.69 3.88 3.14 0.00 0.16 -4.91 105.19 112.21 1x27 n GLY 85 Ca 0.18 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 1x27 n GLY 85 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1x27 s GLU 86 N -1.05 3.77 -0.25 1.61 2.12 -0.78 -4.73 118.70 119.39 1x27 s GLU 86 Ca 0.00 0.22 -0.16 0.00 0.36 0.00 0.00 54.97 55.39 1x27 s GLU 86 Cb 0.00 -2.67 -0.04 0.00 0.26 0.00 0.00 34.13 31.69 1x27 s GLU 86 CO 0.00 0.33 0.41 -1.14 -0.54 0.00 0.00 175.26 174.32 1x27 s GLN 87 N -2.84 4.07 0.25 4.30 2.00 -1.26 -0.79 119.66 125.39 1x27 s GLN 87 Ca 0.46 0.15 0.11 0.00 -2.00 0.00 0.00 55.36 54.08 1x27 s GLN 87 Cb -0.11 -3.63 -0.05 0.00 0.80 0.00 0.00 33.01 30.02 1x27 s GLN 87 CO 0.22 -0.24 -0.20 -0.51 -0.50 0.00 0.00 175.29 174.06 1x27 s LEU 88 N 1.95 2.55 -0.22 3.68 1.02 0.12 -2.01 118.68 125.76 1x27 s LEU 88 Ca 0.17 -0.99 -0.00 0.00 0.02 0.00 0.00 54.13 53.34 1x27 s LEU 88 Cb -0.15 -1.06 0.03 0.00 0.02 0.00 0.00 46.19 45.02 1x27 s LEU 88 CO 0.09 0.03 -0.12 -0.60 0.02 0.00 0.00 176.35 175.77 1x27 s ARG 89 N -3.31 2.86 0.23 1.70 3.52 0.68 -1.66 118.95 122.98 1x27 s ARG 89 Ca 0.26 -0.94 -0.30 0.00 -0.13 0.00 0.00 55.73 54.63 1x27 s ARG 89 Cb -0.05 -2.80 -0.09 0.00 -1.56 0.00 0.00 34.95 30.45 1x27 s ARG 89 CO 0.13 -0.33 1.14 0.42 -0.81 0.00 0.00 175.30 175.85 1x27 s ILE 90 N 1.29 3.57 -0.10 4.11 -1.09 0.16 -1.17 121.20 127.97 1x27 s ILE 90 Ca 0.01 1.44 0.02 0.00 -2.23 0.00 0.00 60.65 59.89 1x27 s ILE 90 Cb -0.15 -3.92 -0.07 0.00 -1.58 0.00 0.00 42.46 36.73 1x27 s ILE 90 CO -0.08 0.29 -0.07 0.18 -1.23 0.00 0.00 174.94 174.02 1x27 n LEU 91 N 1.87 2.49 -3.87 2.97 4.77 0.45 -4.58 117.00 121.10 1x27 n LEU 91 Ca 0.02 -0.05 -0.12 0.00 -0.03 0.00 0.00 56.01 55.83 1x27 n LEU 91 Cb 0.45 -0.27 -0.13 0.00 -2.33 0.00 0.00 43.42 41.14 1x27 n LEU 91 CO 0.55 0.60 -0.29 -1.61 -1.33 0.00 0.00 177.39 175.31 1x27 s GLU 92 N -2.21 0.15 -0.74 3.23 2.02 -0.94 -4.94 118.70 115.27 1x27 s GLU 92 Ca -0.13 -0.05 0.03 0.00 0.02 0.00 0.00 54.97 54.84 1x27 s GLU 92 Cb 0.03 0.06 0.32 0.00 0.10 0.00 0.00 34.13 34.65 1x27 s GLU 92 CO 0.26 -0.02 1.17 1.04 0.02 0.00 0.00 175.26 177.73 1x27 n GLN 93 N 2.69 3.76 -0.77 1.61 6.02 -1.26 -0.74 117.38 128.69 1x27 n GLN 93 Ca -0.15 -4.76 -0.20 0.00 -0.01 0.00 0.00 57.00 51.88 1x27 n GLN 93 Cb 0.59 -2.32 -0.04 0.00 1.02 0.00 0.00 30.24 29.48 1x27 n GLN 93 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1x27 n SER 94 N 0.12 4.95 0.00 1.08 2.88 -1.20 -4.85 113.62 116.59 1x27 n SER 94 Ca 0.34 -2.30 0.00 0.00 -1.33 0.00 0.00 58.87 55.59 1x27 n SER 94 Cb 0.36 -1.10 0.00 0.00 -0.75 0.00 0.00 64.21 62.72 1x27 n SER 94 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x27 n GLY 95 N 3.46 1.16 0.08 0.46 0.00 -1.26 -3.10 105.19 105.99 1x27 n GLY 95 Ca 0.44 0.28 -0.07 0.00 0.00 0.00 0.00 46.02 46.67 1x27 n GLY 95 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1x27 h GLU 96 N 0.00 0.03 -5.11 1.61 4.81 -1.96 -3.44 114.58 110.51 1x27 h GLU 96 Ca 0.00 -0.04 -0.67 0.00 -0.13 0.00 0.00 59.36 58.52 1x27 h GLU 96 Cb 0.00 0.01 -0.31 0.00 0.63 0.00 0.00 28.75 29.08 1x27 h GLU 96 CO 0.00 0.96 -0.81 -1.58 -0.73 0.00 0.00 179.01 176.85 1x27 s TRP 97 N -2.86 2.81 0.01 0.92 0.52 -1.18 -2.32 118.94 116.84 1x27 s TRP 97 Ca 0.00 -1.21 -0.01 0.00 0.02 0.00 0.00 56.10 54.90 1x27 s TRP 97 Cb 0.10 -1.94 -0.04 0.00 -1.15 0.00 0.00 33.47 30.44 1x27 s TRP 97 CO 0.82 -0.60 0.14 -1.58 0.02 0.00 0.00 176.95 175.75 1x27 s TRP 98 N 1.10 3.42 -0.36 -1.98 0.51 -0.14 -3.23 118.94 118.26 1x27 s TRP 98 Ca 0.00 0.27 -0.23 0.00 -2.12 0.00 0.00 56.10 54.02 1x27 s TRP 98 Cb -0.14 -1.77 0.01 0.00 -0.81 0.00 0.00 33.47 30.75 1x27 s TRP 98 CO -0.05 0.60 0.75 0.21 -0.51 0.00 0.00 176.95 177.95 1x27 s LYS 99 N -1.96 3.76 0.40 4.98 2.47 0.08 0.16 119.74 129.63 1x27 s LYS 99 Ca 0.27 0.28 0.05 0.00 -1.56 0.00 0.00 55.97 55.01 1x27 s LYS 99 Cb -0.12 -3.80 -0.06 0.00 -1.46 0.00 0.00 37.83 32.39 1x27 s LYS 99 CO 0.18 -0.80 0.03 0.00 0.16 0.00 0.00 175.35 174.92 1x27 s ALA 100 N 2.99 3.07 -0.09 3.13 0.00 0.34 0.17 121.76 131.38 1x27 s ALA 100 Ca 0.30 -1.85 -0.04 0.00 0.00 0.00 0.00 51.96 50.37 1x27 s ALA 100 Cb -0.14 0.33 0.04 0.00 0.00 0.00 0.00 23.12 23.36 1x27 s ALA 100 CO 0.16 -0.17 0.21 -1.14 0.00 0.00 0.00 175.76 174.81 1x27 s GLN 101 N -3.79 0.16 0.38 0.00 0.74 -0.32 -1.43 119.66 115.40 1x27 s GLN 101 Ca 0.30 0.48 -0.25 0.00 0.05 0.00 0.00 55.36 55.94 1x27 s GLN 101 Cb 0.08 -0.15 -0.09 0.00 1.10 0.00 0.00 33.01 33.95 1x27 s GLN 101 CO 0.15 -0.17 1.05 0.45 -0.55 0.00 0.00 175.29 176.22 1x27 s SER 102 N 1.28 6.85 -0.52 6.67 0.15 -0.86 -0.23 113.70 127.04 1x27 s SER 102 Ca -0.09 2.07 0.01 0.00 0.70 0.00 0.00 55.95 58.64 1x27 s SER 102 Cb -0.11 -2.59 0.52 0.00 -1.71 0.00 0.00 66.02 62.13 1x27 s SER 102 CO -0.08 -0.43 1.94 0.18 1.20 0.00 0.00 173.24 176.06 1x27 n LEU 103 N 0.15 7.01 0.00 3.45 4.77 -0.85 -1.70 117.00 129.82 1x27 n LEU 103 Ca 0.04 -3.80 0.00 0.00 -0.03 0.00 0.00 56.01 52.22 1x27 n LEU 103 Cb 0.49 -0.90 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 1x27 n LEU 103 CO 0.46 1.22 0.00 0.41 -1.33 0.00 0.00 177.39 178.16 1x27 n THR 104 N -0.88 0.00 0.00 -5.08 -1.04 -1.26 -4.91 114.28 101.11 1x27 n THR 104 Ca 0.57 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.58 1x27 n THR 104 Cb 1.12 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.63 1x27 n THR 104 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1x27 n THR 105 N -0.13 0.00 -0.85 12.58 -2.24 -1.25 -5.00 114.28 117.39 1x27 n THR 105 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1x27 n THR 105 Cb 0.00 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 67.86 1x27 n THR 105 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1x27 n GLY 106 N 2.65 0.67 3.78 3.38 0.00 -0.69 -4.97 105.19 110.00 1x27 n GLY 106 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1x27 n GLY 106 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1x27 s GLN 107 N -0.33 4.16 0.40 1.61 2.00 -1.26 -4.73 119.66 121.50 1x27 s GLN 107 Ca 0.00 1.56 0.08 0.00 -2.00 0.00 0.00 55.36 55.00 1x27 s GLN 107 Cb 0.00 -2.58 -0.02 0.00 0.80 0.00 0.00 33.01 31.22 1x27 s GLN 107 CO 0.00 -0.16 0.39 -1.21 -0.50 0.00 0.00 175.29 173.81 1x27 s GLU 108 N -2.44 2.63 0.00 1.67 2.02 -1.26 -2.03 118.70 119.29 1x27 s GLU 108 Ca 0.57 -1.43 0.00 0.00 0.02 0.00 0.00 54.97 54.14 1x27 s GLU 108 Cb -0.23 -2.47 0.00 0.00 0.10 0.00 0.00 34.13 31.53 1x27 s GLU 108 CO 0.29 -0.13 0.00 0.41 0.02 0.00 0.00 175.26 175.85 1x27 n GLY 109 N -1.55 -2.11 3.89 -1.39 0.00 -0.51 -4.69 105.19 98.82 1x27 n GLY 109 Ca 0.03 -1.46 -0.34 0.00 0.00 0.00 0.00 46.02 44.25 1x27 n GLY 109 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1x27 s PHE 110 N -1.81 3.55 0.07 1.61 0.08 -0.34 0.13 117.98 121.26 1x27 s PHE 110 Ca 0.00 0.40 0.02 0.00 0.12 0.00 0.00 56.93 57.47 1x27 s PHE 110 Cb 0.00 -1.86 -0.03 0.00 -0.57 0.00 0.00 43.02 40.56 1x27 s PHE 110 CO 0.00 0.67 -0.08 0.96 -0.10 0.00 0.00 175.22 176.67 1x27 s ILE 111 N -1.23 0.69 -0.12 0.64 -4.36 0.12 -0.92 121.20 116.03 1x27 s ILE 111 Ca 0.24 -1.47 -0.30 0.00 -0.26 0.00 0.00 60.65 58.86 1x27 s ILE 111 Cb -0.12 -1.12 -0.02 0.00 1.25 0.00 0.00 42.46 42.44 1x27 s ILE 111 CO 0.14 -0.57 1.28 -2.16 0.24 0.00 0.00 174.94 173.88 1x27 s PRO 112 N -2.55 4.27 0.42 0.37 0.04 -1.26 -0.97 135.00 135.31 1x27 s PRO 112 Ca 0.00 1.72 0.19 0.00 0.04 0.00 0.00 61.00 62.95 1x27 s PRO 112 Cb -0.04 -3.71 1.11 0.00 0.04 0.00 0.00 34.50 31.91 1x27 s PRO 112 CO -0.01 -0.63 1.83 0.27 0.04 0.00 0.00 177.00 178.49 1x27 h PHE 113 N 8.05 0.55 0.00 0.56 -0.00 -1.78 -1.26 116.94 123.07 1x27 h PHE 113 Ca -0.30 0.02 0.00 0.00 -0.00 0.00 0.00 57.97 57.69 1x27 h PHE 113 Cb 1.13 -0.16 0.00 0.00 -0.00 0.00 0.00 35.95 36.91 1x27 h PHE 113 CO 0.78 0.11 0.00 0.27 -0.00 0.00 0.00 178.31 179.48 1x27 n ASN 114 N -4.53 0.00 -1.07 -0.68 6.94 -1.26 -2.68 115.26 111.99 1x27 n ASN 114 Ca 0.21 -1.49 0.12 0.00 -0.02 0.00 0.00 54.58 53.40 1x27 n ASN 114 Cb 0.78 0.00 0.17 0.00 -2.36 0.00 0.00 39.78 38.36 1x27 n ASN 114 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 1x27 n PHE 115 N -0.68 0.29 -4.18 -2.53 3.01 -0.47 -4.95 117.46 107.95 1x27 n PHE 115 Ca 0.08 -0.15 -0.12 0.00 1.01 0.00 0.00 57.45 58.27 1x27 n PHE 115 Cb 0.04 -0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.41 1x27 n PHE 115 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 1x27 s VAL 116 N -1.67 0.01 -0.05 -4.37 -7.23 -1.09 0.56 120.40 106.55 1x27 s VAL 116 Ca 0.34 -1.95 -0.06 0.00 -1.81 0.00 0.00 61.98 58.50 1x27 s VAL 116 Cb 0.21 -2.45 0.01 0.00 0.56 0.00 0.00 36.38 34.72 1x27 s VAL 116 CO 0.31 -0.03 0.17 0.00 -0.31 0.00 0.00 175.10 175.24 1x27 s ALA 117 N -4.14 -0.41 -0.08 1.32 0.00 -0.89 -4.85 121.76 112.70 1x27 s ALA 117 Ca 0.37 0.36 -0.39 0.00 0.00 0.00 0.00 51.96 52.30 1x27 s ALA 117 Cb 0.06 -0.20 -0.17 0.00 0.00 0.00 0.00 23.12 22.81 1x27 s ALA 117 CO 0.11 -0.11 1.44 1.63 0.00 0.00 0.00 175.76 178.83 1x27 n LYS 118 N 2.66 0.89 0.00 0.00 4.01 -1.26 -1.87 118.16 122.58 1x27 n LYS 118 Ca -0.15 0.32 0.08 0.00 -0.51 0.00 0.00 58.31 58.05 1x27 n LYS 118 Cb 0.58 -1.94 -0.07 0.00 -0.51 0.00 0.00 35.03 33.09 1x27 n LYS 118 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1x27 n ALA 119 N 3.31 3.86 -1.70 7.82 0.00 0.14 -4.81 120.51 129.13 1x27 n ALA 119 Ca 0.22 -0.47 -0.44 0.00 0.00 0.00 0.00 53.44 52.75 1x27 n ALA 119 Cb 0.14 -0.58 -0.03 0.00 0.00 0.00 0.00 19.45 18.98 1x27 n ALA 119 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1x27 n ASN 120 N -1.06 3.33 -4.22 0.00 3.02 -1.23 -4.93 115.26 110.17 1x27 n ASN 120 Ca 0.04 1.12 -0.34 0.00 -0.03 0.00 0.00 54.58 55.36 1x27 n ASN 120 Cb 0.27 -1.50 0.08 0.00 -0.61 0.00 0.00 39.78 38.03 1x27 n ASN 120 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1x27 n SER 121 N 2.70 -3.89 0.00 6.41 2.88 -1.26 -4.94 113.62 115.52 1x27 n SER 121 Ca 0.13 0.25 -0.16 0.00 -1.33 0.00 0.00 58.87 57.75 1x27 n SER 121 Cb 0.33 -0.99 -0.14 0.00 -0.75 0.00 0.00 64.21 62.66 1x27 n SER 121 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1x27 h LEU 122 N -1.31 0.25 -0.84 2.46 3.38 -1.99 -3.39 115.31 113.87 1x27 h LEU 122 Ca -0.44 -0.52 0.26 0.00 0.09 0.00 0.00 57.88 57.27 1x27 h LEU 122 Cb 1.29 -0.08 -0.16 0.00 0.09 0.00 0.00 40.66 41.81 1x27 h LEU 122 CO 0.29 1.46 0.13 1.21 0.09 0.00 0.00 178.44 181.62 1x27 n GLU 123 N -3.31 -0.06 -0.25 1.13 2.13 -1.26 0.40 120.64 119.42 1x27 n GLU 123 Ca -0.24 1.23 -0.07 0.00 0.66 0.00 0.00 57.16 58.74 1x27 n GLU 123 Cb 1.05 -2.02 0.04 0.00 0.27 0.00 0.00 31.44 30.78 1x27 n GLU 123 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 1x27 h PRO 124 N 0.00 1.11 -6.02 5.31 0.11 -1.95 -3.46 132.00 127.10 1x27 h PRO 124 Ca 0.56 -0.26 -0.83 0.00 0.11 0.00 0.00 66.00 65.58 1x27 h PRO 124 Cb 1.27 -0.15 0.03 0.00 0.11 0.00 0.00 31.00 32.26 1x27 h PRO 124 CO -0.75 0.98 0.43 0.39 -0.21 0.00 0.00 178.00 178.84 1x27 n GLU 125 N -4.26 0.09 -0.22 1.05 -0.58 0.16 -4.84 120.64 112.04 1x27 n GLU 125 Ca 0.05 0.03 0.13 0.00 -0.42 0.00 0.00 57.16 56.95 1x27 n GLU 125 Cb 0.25 -1.54 0.43 0.00 -0.57 0.00 0.00 31.44 30.01 1x27 n GLU 125 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 1x27 h PRO 126 N 4.26 0.57 -0.00 3.49 0.11 -1.88 -2.05 132.00 136.49 1x27 h PRO 126 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1x27 h PRO 126 Cb 1.39 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1x27 h PRO 126 CO 0.84 0.38 -0.37 -2.67 -0.21 0.00 0.00 178.00 175.96 1x27 n TRP 127 N -4.52 0.00 -3.35 0.65 4.27 -1.26 -4.64 117.44 108.58 1x27 n TRP 127 Ca 0.16 0.00 -0.38 0.00 -3.89 0.00 0.00 57.50 53.38 1x27 n TRP 127 Cb 0.48 -0.20 -0.06 0.00 -1.36 0.00 0.00 31.31 30.17 1x27 n TRP 127 CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 1x27 s PHE 128 N -2.77 3.72 -0.39 -2.67 5.36 -0.77 -0.09 117.98 120.36 1x27 s PHE 128 Ca 0.17 1.10 0.04 0.00 -0.96 0.00 0.00 56.93 57.28 1x27 s PHE 128 Cb 0.18 -2.45 0.16 0.00 -0.34 0.00 0.00 43.02 40.57 1x27 s PHE 128 CO 0.61 0.51 0.40 -0.06 -1.46 0.00 0.00 175.22 175.22 1x27 s PHE 129 N -0.69 -0.19 0.00 10.12 0.08 0.52 -4.89 117.98 122.93 1x27 s PHE 129 Ca 0.27 -1.06 0.00 0.00 0.12 0.00 0.00 56.93 56.26 1x27 s PHE 129 Cb -0.18 -0.42 0.00 0.00 -0.57 0.00 0.00 43.02 41.85 1x27 s PHE 129 CO 0.15 -0.98 0.37 1.17 -0.10 0.00 0.00 175.22 175.84 1x27 n LYS 130 N 3.87 0.00 -1.84 0.44 4.81 -1.26 -3.91 118.16 120.27 1x27 n LYS 130 Ca 0.15 0.16 -0.21 0.00 -0.87 0.00 0.00 58.31 57.54 1x27 n LYS 130 Cb 0.46 -0.87 -0.08 0.00 0.02 0.00 0.00 35.03 34.56 1x27 n LYS 130 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 1x27 s ASN 131 N -2.43 4.32 -0.22 3.14 0.01 -1.26 -3.29 114.94 115.21 1x27 s ASN 131 Ca 0.00 -1.09 -0.07 0.00 -0.71 0.00 0.00 52.86 50.99 1x27 s ASN 131 Cb 0.00 -2.58 0.10 0.00 0.41 0.00 0.00 41.25 39.18 1x27 s ASN 131 CO 0.00 -3.76 0.45 -0.22 -1.51 0.00 0.00 177.10 172.06 1x27 s LEU 132 N 13.57 -0.72 0.77 0.60 2.96 -1.25 -5.09 118.68 129.51 1x27 s LEU 132 Ca 0.76 1.03 -0.11 0.00 -0.22 0.00 0.00 54.13 55.59 1x27 s LEU 132 Cb -0.04 1.48 0.06 0.00 0.50 0.00 0.00 46.19 48.18 1x27 s LEU 132 CO 0.13 -0.23 1.10 -0.55 -1.32 0.00 0.00 176.35 175.47 1x27 s SER 133 N 2.65 4.45 0.12 3.68 0.15 -1.26 -4.57 113.70 118.92 1x27 s SER 133 Ca -0.01 1.89 -0.16 0.00 0.70 0.00 0.00 55.95 58.37 1x27 s SER 133 Cb -0.12 -2.53 -0.02 0.00 -1.71 0.00 0.00 66.02 61.64 1x27 s SER 133 CO -0.14 -2.07 1.63 -0.09 1.20 0.00 0.00 173.24 173.77 1x27 h ARG 134 N -1.01 0.60 0.00 5.44 2.43 -2.00 -1.54 114.38 118.30 1x27 h ARG 134 Ca -0.44 -0.13 -0.07 0.00 -0.81 0.00 0.00 59.98 58.53 1x27 h ARG 134 Cb 1.24 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.70 1x27 h ARG 134 CO 0.51 0.62 -0.31 0.87 -1.51 0.00 0.00 179.97 180.14 1x27 h LYS 135 N 0.46 0.00 -0.38 0.20 1.79 -2.00 -2.72 116.57 113.92 1x27 h LYS 135 Ca 0.12 0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.46 1x27 h LYS 135 Cb 0.28 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.91 1x27 h LYS 135 CO -0.00 0.31 -0.27 -0.44 -1.08 0.00 0.00 179.45 177.96 1x27 h ASP 136 N 0.00 0.83 -0.59 0.86 3.45 -1.80 -2.77 116.42 116.39 1x27 h ASP 136 Ca -0.00 -0.32 -0.04 0.00 0.43 0.00 0.00 57.03 57.09 1x27 h ASP 136 Cb 0.72 -0.23 -0.03 0.00 -0.56 0.00 0.00 39.33 39.23 1x27 h ASP 136 CO 0.04 1.05 0.21 0.00 -1.57 0.00 0.00 179.24 178.97 1x27 h ALA 137 N 1.00 0.77 -0.14 3.45 0.00 -0.99 -0.58 119.26 122.78 1x27 h ALA 137 Ca 0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1x27 h ALA 137 Cb 0.81 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1x27 h ALA 137 CO 0.07 0.41 -0.03 0.93 0.00 0.00 0.00 179.25 180.63 1x27 h GLU 138 N 0.83 0.20 0.01 0.00 5.08 -1.37 0.20 114.58 119.53 1x27 h GLU 138 Ca 0.19 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1x27 h GLU 138 Cb 0.24 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1x27 h GLU 138 CO -0.01 0.25 -0.00 0.00 -1.00 0.00 0.00 179.01 178.24 1x27 h ARG 139 N 0.20 -0.01 -0.87 2.33 3.08 -1.19 -1.53 114.38 116.38 1x27 h ARG 139 Ca 0.05 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.20 1x27 h ARG 139 Cb 0.19 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.16 1x27 h ARG 139 CO 0.01 0.81 0.51 0.37 -1.07 0.00 0.00 179.97 180.60 1x27 h GLN 140 N -0.92 0.82 -0.04 0.04 5.75 -0.89 0.10 115.11 119.96 1x27 h GLN 140 Ca -0.00 -0.05 -0.17 0.00 -0.15 0.00 0.00 58.65 58.28 1x27 h GLN 140 Cb 0.83 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 29.18 1x27 h GLN 140 CO 0.00 0.54 -0.73 -0.07 -2.65 0.00 0.00 178.83 175.92 1x27 h LEU 141 N 0.84 0.29 0.00 -2.39 3.38 -0.67 -3.24 115.31 113.52 1x27 h LEU 141 Ca 0.42 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1x27 h LEU 141 Cb 0.40 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1x27 h LEU 141 CO -0.26 0.92 -0.53 -0.07 0.09 0.00 0.00 178.44 178.60 1x27 h LEU 142 N 0.16 0.00-10.30 1.67 3.38 -0.56 -3.43 115.31 106.23 1x27 h LEU 142 Ca -0.02 -0.05 -0.52 0.00 0.09 0.00 0.00 57.88 57.38 1x27 h LEU 142 Cb 1.29 0.00 0.15 0.00 0.09 0.00 0.00 40.66 42.19 1x27 h LEU 142 CO 0.11 0.03 0.29 0.00 0.09 0.00 0.00 178.44 178.96 1x27 s ALA 143 N -3.25 2.03 0.59 1.53 0.00 0.30 -4.92 121.76 118.04 1x27 s ALA 143 Ca 0.04 0.37 -0.18 0.00 0.00 0.00 0.00 51.96 52.20 1x27 s ALA 143 Cb 0.10 -3.33 -0.08 0.00 0.00 0.00 0.00 23.12 19.81 1x27 s ALA 143 CO 0.72 -2.06 0.50 -2.30 0.00 0.00 0.00 175.76 172.62 1x27 n PRO 144 N -3.71 0.46 0.00 0.00 -0.02 -1.26 -2.99 135.00 127.48 1x27 n PRO 144 Ca 0.10 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1x27 n PRO 144 Cb 0.53 -1.70 0.00 0.00 -0.02 0.00 0.00 33.50 32.31 1x27 n PRO 144 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1x27 n GLY 145 N 1.80 1.71 3.63 -1.23 0.00 -1.26 -4.97 105.19 104.87 1x27 n GLY 145 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 1x27 n GLY 145 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1x27 s ASN 146 N -1.70 3.97 0.00 1.61 0.01 -1.16 -4.70 114.94 112.97 1x27 s ASN 146 Ca 0.00 -1.30 0.00 0.00 -0.71 0.00 0.00 52.86 50.85 1x27 s ASN 146 Cb 0.00 -0.41 0.00 0.00 0.41 0.00 0.00 41.25 41.25 1x27 s ASN 146 CO 0.00 -0.44 0.00 0.35 -1.51 0.00 0.00 177.10 175.50 1x27 n THR 147 N -1.00 0.00 -1.69 1.60 -2.24 -1.26 -4.98 114.28 104.70 1x27 n THR 147 Ca -0.04 0.00 -0.44 0.00 -2.27 0.00 0.00 64.05 61.30 1x27 n THR 147 Cb 0.66 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.86 1x27 n THR 147 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1x27 n HIS 148 N 0.00 2.55 -0.32 4.78 8.25 -1.26 -1.47 115.22 127.74 1x27 n HIS 148 Ca 0.00 0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1x27 n HIS 148 Cb 0.00 -2.65 0.00 0.00 1.12 0.00 0.00 29.99 28.46 1x27 n HIS 148 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1x27 n GLY 149 N 3.91 0.72 3.75 -1.41 0.00 0.14 -4.71 105.19 107.58 1x27 n GLY 149 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 1x27 n GLY 149 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x27 s SER 150 N -2.97 7.19 0.34 1.61 0.01 -0.54 -0.97 113.70 118.36 1x27 s SER 150 Ca 0.00 2.24 0.05 0.00 1.31 0.00 0.00 55.95 59.55 1x27 s SER 150 Cb 0.00 -2.62 -0.02 0.00 0.21 0.00 0.00 66.02 63.59 1x27 s SER 150 CO 0.00 -0.25 0.34 0.72 0.41 0.00 0.00 173.24 174.46 1x27 s PHE 151 N -0.60 1.61 -0.21 2.43 -0.71 -0.57 -0.20 117.98 119.73 1x27 s PHE 151 Ca 0.48 -1.59 -0.31 0.00 -1.04 0.00 0.00 56.93 54.47 1x27 s PHE 151 Cb -0.32 -0.56 0.15 0.00 -1.21 0.00 0.00 43.02 41.09 1x27 s PHE 151 CO 0.39 -0.96 1.18 -0.48 -1.34 0.00 0.00 175.22 174.01 1x27 s LEU 152 N -3.35 -0.19 -0.15 -1.99 0.05 -0.45 -0.28 118.68 112.32 1x27 s LEU 152 Ca 0.38 0.16 0.01 0.00 0.05 0.00 0.00 54.13 54.73 1x27 s LEU 152 Cb 0.01 1.47 0.01 0.00 -2.05 0.00 0.00 46.19 45.63 1x27 s LEU 152 CO 0.27 -0.21 -0.18 -0.63 -0.55 0.00 0.00 176.35 175.04 1x27 s ILE 153 N -1.44 2.36 0.54 1.48 1.01 0.87 -0.72 121.20 125.30 1x27 s ILE 153 Ca 0.05 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 59.86 1x27 s ILE 153 Cb -0.01 -1.98 0.02 0.00 0.01 0.00 0.00 42.46 40.51 1x27 s ILE 153 CO -0.04 0.53 0.25 0.00 0.00 0.00 0.00 174.94 175.68 1x27 s ARG 154 N 0.89 2.23 -0.54 2.79 1.70 -0.89 -0.36 118.95 124.79 1x27 s ARG 154 Ca -0.05 -2.19 -0.18 0.00 -0.47 0.00 0.00 55.73 52.84 1x27 s ARG 154 Cb -0.15 -1.86 0.09 0.00 -0.57 0.00 0.00 34.95 32.45 1x27 s ARG 154 CO -0.02 -0.54 0.58 -2.00 -1.08 0.00 0.00 175.30 172.24 1x27 s GLU 155 N -4.13 3.04 0.00 3.89 -6.30 -1.21 -2.19 118.70 111.80 1x27 s GLU 155 Ca 0.21 -1.29 0.00 0.00 -2.50 0.00 0.00 54.97 51.39 1x27 s GLU 155 Cb -0.01 -4.20 0.00 0.00 0.00 0.00 0.00 34.13 29.92 1x27 s GLU 155 CO 0.13 -1.31 0.00 0.45 0.02 0.00 0.00 175.26 174.55 1x27 n SER 156 N 5.85 0.00 -0.03 -1.70 2.88 -0.59 -4.84 113.62 115.19 1x27 n SER 156 Ca -0.10 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.31 1x27 n SER 156 Cb 0.43 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.81 1x27 n SER 156 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 1x27 h GLU 157 N 0.00 0.15 0.00 -1.46 4.11 -1.90 -3.36 114.58 112.12 1x27 h GLU 157 Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.36 59.37 1x27 h GLU 157 Cb 0.00 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1x27 h GLU 157 CO 0.00 0.49 0.00 -1.13 0.07 0.00 0.00 179.01 178.44 1x27 n SER 158 N -4.79 0.00 -4.71 3.06 3.41 -1.26 -4.69 113.62 104.63 1x27 n SER 158 Ca -0.07 0.72 -0.42 0.00 -0.26 0.00 0.00 58.87 58.85 1x27 n SER 158 Cb 0.24 -0.25 -0.03 0.00 -0.26 0.00 0.00 64.21 63.91 1x27 n SER 158 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1x27 s THR 159 N -1.92 4.10 -1.23 6.66 2.01 -1.26 -4.96 115.64 119.04 1x27 s THR 159 Ca 0.00 1.52 -0.13 0.00 0.31 0.00 0.00 61.69 63.39 1x27 s THR 159 Cb 0.00 -3.97 0.16 0.00 0.01 0.00 0.00 72.50 68.70 1x27 s THR 159 CO 0.00 0.12 1.55 0.00 -0.69 0.00 0.00 174.62 175.60 1x27 n ALA 160 N 3.85 4.14 0.00 7.40 0.00 -1.26 -3.72 120.51 130.91 1x27 n ALA 160 Ca 0.08 -4.23 0.00 0.00 0.00 0.00 0.00 53.44 49.29 1x27 n ALA 160 Cb 0.47 -3.08 0.00 0.00 0.00 0.00 0.00 19.45 16.83 1x27 n ALA 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x27 n GLY 161 N 3.94 0.32 2.74 0.00 0.00 -1.26 -5.15 105.19 105.79 1x27 n GLY 161 Ca 0.38 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.22 1x27 n GLY 161 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1x27 n SER 162 N 0.00 0.55 -4.09 1.61 7.64 -1.24 -4.96 113.62 113.12 1x27 n SER 162 Ca 0.00 -1.59 -0.11 0.00 1.01 0.00 0.00 58.87 58.17 1x27 n SER 162 Cb 0.00 -0.58 -0.11 0.00 -1.01 0.00 0.00 64.21 62.51 1x27 n SER 162 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1x27 s PHE 163 N -2.56 0.69 0.07 1.43 0.08 -1.26 -1.54 117.98 114.89 1x27 s PHE 163 Ca 0.50 -0.67 0.07 0.00 0.12 0.00 0.00 56.93 56.94 1x27 s PHE 163 Cb -0.02 -0.42 -0.03 0.00 -0.57 0.00 0.00 43.02 41.98 1x27 s PHE 163 CO 0.34 -0.13 -0.18 -1.12 -0.10 0.00 0.00 175.22 174.03 1x27 s SER 164 N -2.12 2.14 -0.22 1.36 0.01 -0.93 -1.83 113.70 112.11 1x27 s SER 164 Ca -0.03 -0.57 -0.08 0.00 1.31 0.00 0.00 55.95 56.58 1x27 s SER 164 Cb -0.04 -0.13 -0.04 0.00 0.21 0.00 0.00 66.02 66.02 1x27 s SER 164 CO -0.02 0.05 0.08 -0.22 0.41 0.00 0.00 173.24 173.55 1x27 s LEU 165 N -1.49 3.68 -0.16 2.44 2.96 -0.01 -2.08 118.68 124.02 1x27 s LEU 165 Ca 0.04 -0.06 -0.00 0.00 -0.22 0.00 0.00 54.13 53.89 1x27 s LEU 165 Cb -0.09 -1.97 -0.00 0.00 0.50 0.00 0.00 46.19 44.63 1x27 s LEU 165 CO 0.02 0.05 -0.14 -0.44 -1.32 0.00 0.00 176.35 174.52 1x27 s SER 166 N 1.11 3.74 -0.03 3.68 0.01 0.10 -0.56 113.70 121.76 1x27 s SER 166 Ca 0.05 -0.45 0.02 0.00 1.31 0.00 0.00 55.95 56.88 1x27 s SER 166 Cb -0.14 -1.58 0.01 0.00 0.21 0.00 0.00 66.02 64.52 1x27 s SER 166 CO 0.04 0.09 -0.06 0.54 0.41 0.00 0.00 173.24 174.26 1x27 s VAL 167 N 0.79 0.57 -0.09 3.43 0.11 0.03 -1.34 120.40 123.90 1x27 s VAL 167 Ca -0.05 -0.20 -0.20 0.00 -2.93 0.00 0.00 61.98 58.60 1x27 s VAL 167 Cb -0.15 -0.55 -0.04 0.00 -1.53 0.00 0.00 36.38 34.11 1x27 s VAL 167 CO 0.00 0.21 0.54 -0.60 -3.33 0.00 0.00 175.10 171.92 1x27 s ARG 168 N 0.51 4.36 0.06 1.54 3.52 0.72 0.00 118.95 129.66 1x27 s ARG 168 Ca -0.07 0.58 0.01 0.00 -0.13 0.00 0.00 55.73 56.13 1x27 s ARG 168 Cb -0.11 -3.43 -0.00 0.00 -1.56 0.00 0.00 34.95 29.85 1x27 s ARG 168 CO 0.00 0.16 0.05 -3.47 -0.81 0.00 0.00 175.30 171.23 1x27 n ASP 169 N 3.59 -0.10 -4.86 -2.12 2.03 0.10 0.26 116.55 115.45 1x27 n ASP 169 Ca -0.06 -1.37 -0.26 0.00 0.52 0.00 0.00 54.79 53.63 1x27 n ASP 169 Cb 0.51 0.28 -0.03 0.00 -0.72 0.00 0.00 41.12 41.17 1x27 n ASP 169 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 1x27 s PHE 170 N -2.22 1.98 0.10 -0.67 2.19 -1.26 -0.30 117.98 117.81 1x27 s PHE 170 Ca 0.07 -0.75 -0.26 0.00 0.33 0.00 0.00 56.93 56.31 1x27 s PHE 170 Cb 0.00 -1.94 0.08 0.00 -1.31 0.00 0.00 43.02 39.85 1x27 s PHE 170 CO 0.05 -0.25 0.89 0.34 1.83 0.00 0.00 175.22 178.08 1x27 s ASP 171 N -4.16 -0.28 -0.25 6.13 2.15 -1.03 -4.79 116.67 114.44 1x27 s ASP 171 Ca 0.35 -0.23 -0.01 0.00 0.43 0.00 0.00 52.55 53.09 1x27 s ASP 171 Cb -0.01 0.47 -0.17 0.00 -0.30 0.00 0.00 42.92 42.91 1x27 s ASP 171 CO 0.21 -0.83 -0.21 0.00 -0.17 0.00 0.00 175.17 174.17 1x27 n GLN 172 N -0.38 0.65 0.18 4.34 0.00 -1.26 -4.27 117.38 116.64 1x27 n GLN 172 Ca -0.08 0.18 0.13 0.00 0.00 0.00 0.00 57.00 57.22 1x27 n GLN 172 Cb 0.61 -1.53 0.68 0.00 0.00 0.00 0.00 30.24 30.00 1x27 n GLN 172 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.06 176.15 1x27 h ASN 173 N -0.13 0.00 -5.15 2.61 4.21 -2.04 -3.43 115.58 111.66 1x27 h ASN 173 Ca -0.59 0.00 -0.06 0.00 1.21 0.00 0.00 56.30 56.86 1x27 h ASN 173 Cb 1.87 0.00 -0.12 0.00 -1.12 0.00 0.00 38.32 38.94 1x27 h ASN 173 CO -0.12 0.00 -0.17 -1.58 -1.29 0.00 0.00 177.43 174.26 1x27 s GLN 174 N -5.00 1.13 0.00 0.81 0.74 -1.26 -5.17 119.66 110.90 1x27 s GLN 174 Ca -0.05 -0.92 0.00 0.00 0.05 0.00 0.00 55.36 54.44 1x27 s GLN 174 Cb 0.18 0.43 0.00 0.00 1.10 0.00 0.00 33.01 34.72 1x27 s GLN 174 CO 0.67 -0.43 0.00 0.41 -0.55 0.00 0.00 175.29 175.39 1x27 n GLY 175 N -0.22 -2.49 3.73 2.59 0.00 -1.26 -3.59 105.19 103.96 1x27 n GLY 175 Ca -0.12 -0.52 -0.35 0.00 0.00 0.00 0.00 46.02 45.04 1x27 n GLY 175 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x27 s GLU 176 N 0.00 2.37 0.07 1.61 0.41 -1.26 -2.46 118.70 119.44 1x27 s GLU 176 Ca 0.00 1.78 -0.14 0.00 -0.41 0.00 0.00 54.97 56.20 1x27 s GLU 176 Cb 0.00 -1.86 0.02 0.00 -1.78 0.00 0.00 34.13 30.51 1x27 s GLU 176 CO 0.00 -1.67 0.31 0.14 -0.49 0.00 0.00 175.26 173.55 1x27 s VAL 177 N -1.88 0.09 -0.26 2.63 -7.23 0.60 -4.91 120.40 109.44 1x27 s VAL 177 Ca 0.75 -0.75 -0.01 0.00 -1.81 0.00 0.00 61.98 60.16 1x27 s VAL 177 Cb -0.30 -1.09 0.03 0.00 0.56 0.00 0.00 36.38 35.59 1x27 s VAL 177 CO 0.42 -0.41 -0.05 -0.69 -0.31 0.00 0.00 175.10 174.06 1x27 s VAL 178 N -3.16 2.87 0.17 1.32 1.01 -1.26 0.01 120.40 121.35 1x27 s VAL 178 Ca -0.01 -1.14 -0.11 0.00 0.00 0.00 0.00 61.98 60.73 1x27 s VAL 178 Cb 0.01 -2.51 -0.07 0.00 0.00 0.00 0.00 36.38 33.81 1x27 s VAL 178 CO -0.07 0.12 0.51 -0.54 0.00 0.00 0.00 175.10 175.12 1x27 s LYS 179 N 1.30 3.85 0.05 2.72 1.02 0.10 -4.89 119.74 123.88 1x27 s LYS 179 Ca -0.02 0.31 0.09 0.00 0.02 0.00 0.00 55.97 56.38 1x27 s LYS 179 Cb -0.17 -2.82 -0.03 0.00 -0.52 0.00 0.00 37.83 34.29 1x27 s LYS 179 CO -0.04 0.42 -0.24 -1.01 -0.92 0.00 0.00 175.35 173.57 1x27 s HIS 180 N -1.61 2.39 -0.05 3.18 3.76 -1.26 -0.79 115.29 120.91 1x27 s HIS 180 Ca 0.41 -0.36 0.00 0.00 -0.15 0.00 0.00 55.06 54.96 1x27 s HIS 180 Cb -0.13 -1.40 0.02 0.00 1.11 0.00 0.00 32.58 32.18 1x27 s HIS 180 CO 0.20 0.18 -0.03 0.71 -0.85 0.00 0.00 174.74 174.95 1x27 s TYR 181 N -0.86 0.66 0.08 1.40 1.51 0.28 -4.98 117.35 115.44 1x27 s TYR 181 Ca 0.13 -0.17 -0.30 0.00 -1.01 0.00 0.00 57.07 55.72 1x27 s TYR 181 Cb -0.10 -0.65 -0.05 0.00 -0.11 0.00 0.00 41.96 41.04 1x27 s TYR 181 CO 0.03 -0.21 1.01 0.21 -1.11 0.00 0.00 175.55 175.48 1x27 s LYS 182 N 1.16 4.62 -0.51 -0.62 2.47 -1.26 -0.83 119.74 124.77 1x27 s LYS 182 Ca -0.07 1.51 -0.13 0.00 -1.56 0.00 0.00 55.97 55.71 1x27 s LYS 182 Cb -0.14 -3.38 0.12 0.00 -1.46 0.00 0.00 37.83 32.97 1x27 s LYS 182 CO -0.01 0.07 0.44 0.42 0.16 0.00 0.00 175.35 176.43 1x27 s ILE 183 N 0.35 4.85 0.89 5.43 1.01 -0.76 -4.70 121.20 128.27 1x27 s ILE 183 Ca 0.50 -1.57 -0.11 0.00 0.00 0.00 0.00 60.65 59.47 1x27 s ILE 183 Cb -0.24 -4.12 0.13 0.00 0.01 0.00 0.00 42.46 38.24 1x27 s ILE 183 CO 0.30 -0.81 1.09 -0.13 0.00 0.00 0.00 174.94 175.39 1x27 s ARG 184 N 1.52 1.29 0.41 2.79 0.52 -0.73 -4.24 118.95 120.50 1x27 s ARG 184 Ca 0.04 0.93 0.07 0.00 -0.52 0.00 0.00 55.73 56.26 1x27 s ARG 184 Cb -0.28 -1.80 -0.04 0.00 0.52 0.00 0.00 34.95 33.34 1x27 s ARG 184 CO 0.02 -2.25 0.26 -0.80 0.02 0.00 0.00 175.30 172.54 1x27 s ASN 185 N -3.31 4.69 0.06 0.23 -0.87 -1.26 -2.86 114.94 111.60 1x27 s ASN 185 Ca 0.64 -0.93 0.08 0.00 -1.57 0.00 0.00 52.86 51.08 1x27 s ASN 185 Cb -0.19 -0.53 -0.03 0.00 -0.02 0.00 0.00 41.25 40.48 1x27 s ASN 185 CO 0.57 -0.57 -0.23 -0.76 -2.57 0.00 0.00 177.10 173.54 1x27 s LEU 186 N -3.99 2.19 0.25 0.60 1.02 -0.47 -4.90 118.68 113.38 1x27 s LEU 186 Ca 0.44 -0.58 -0.04 0.00 0.02 0.00 0.00 54.13 53.97 1x27 s LEU 186 Cb 0.01 -1.09 0.49 0.00 0.02 0.00 0.00 46.19 45.61 1x27 s LEU 186 CO 0.25 0.19 1.68 0.44 0.02 0.00 0.00 176.35 178.93 1x27 h ASP 187 N 4.70 0.02 0.92 2.29 3.32 -2.01 0.34 116.42 126.00 1x27 h ASP 187 Ca -0.45 0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.75 1x27 h ASP 187 Cb 1.16 0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.91 1x27 h ASP 187 CO 0.43 -0.04 0.00 -0.55 -1.72 0.00 0.00 179.24 177.36 1x27 h ASN 188 N 0.27 0.00 0.00 6.45 7.08 -2.02 -3.45 115.58 123.91 1x27 h ASN 188 Ca 0.43 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.65 1x27 h ASN 188 Cb 0.74 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.98 1x27 h ASN 188 CO -0.52 0.00 0.00 0.61 -2.08 0.00 0.00 177.43 175.44 1x27 n GLY 189 N -0.04 1.66 2.57 9.14 0.00 0.12 -5.13 105.19 113.52 1x27 n GLY 189 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1x27 n GLY 189 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x27 n GLY 190 N -0.53 0.73 3.09 -0.02 0.00 -1.24 -4.76 105.19 102.47 1x27 n GLY 190 Ca 0.00 -2.01 -0.09 0.00 0.00 0.00 0.00 46.02 43.92 1x27 n GLY 190 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1x27 s PHE 191 N -1.95 0.59 0.01 1.61 0.08 0.32 -1.36 117.98 117.28 1x27 s PHE 191 Ca 0.44 -0.85 -0.28 0.00 0.12 0.00 0.00 56.93 56.36 1x27 s PHE 191 Cb -0.03 -0.39 0.09 0.00 -0.57 0.00 0.00 43.02 42.13 1x27 s PHE 191 CO 0.29 -0.24 0.78 1.52 -0.10 0.00 0.00 175.22 177.47 1x27 s TYR 192 N -3.04 -0.47 -0.01 0.36 -0.85 -1.14 0.03 117.35 112.24 1x27 s TYR 192 Ca 0.02 0.50 0.00 0.00 -0.52 0.00 0.00 57.07 57.07 1x27 s TYR 192 Cb 0.01 0.50 -0.01 0.00 0.38 0.00 0.00 41.96 42.85 1x27 s TYR 192 CO -0.06 -0.61 -0.00 -0.89 -1.52 0.00 0.00 175.55 172.47 1x27 n ILE 193 N 0.11 0.06 -5.21 -3.49 5.41 -1.26 -1.78 119.36 113.20 1x27 n ILE 193 Ca -0.13 -0.03 -0.32 0.00 1.00 0.00 0.00 62.75 63.27 1x27 n ILE 193 Cb 0.61 -0.75 -0.17 0.00 -0.71 0.00 0.00 39.64 38.62 1x27 n ILE 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1x27 s SER 194 N -3.62 3.15 0.00 4.38 0.15 -1.26 -4.94 113.70 111.56 1x27 s SER 194 Ca -0.01 -0.52 0.07 0.00 0.70 0.00 0.00 55.95 56.19 1x27 s SER 194 Cb 0.00 -1.17 0.43 0.00 -1.71 0.00 0.00 66.02 63.57 1x27 s SER 194 CO 0.03 0.20 0.95 -0.81 1.20 0.00 0.00 173.24 174.81 1x27 n PRO 195 N 3.25 0.20 -0.16 5.44 -0.04 -1.26 -1.94 135.00 140.50 1x27 n PRO 195 Ca -0.18 0.06 -0.11 0.00 -0.04 0.00 0.00 63.50 63.22 1x27 n PRO 195 Cb 0.53 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.48 1x27 n PRO 195 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1x27 h ARG 196 N 0.00 0.91 -4.13 0.54 2.43 -1.97 -3.44 114.38 108.72 1x27 h ARG 196 Ca 0.00 -0.36 -0.36 0.00 -0.81 0.00 0.00 59.98 58.45 1x27 h ARG 196 Cb 0.02 -0.04 -0.31 0.00 -0.42 0.00 0.00 29.97 29.21 1x27 h ARG 196 CO 0.00 1.01 -0.76 0.42 -1.51 0.00 0.00 179.97 179.13 1x27 s ILE 197 N -4.75 0.43 0.42 1.20 1.09 -0.82 -5.16 121.20 113.61 1x27 s ILE 197 Ca -0.12 -0.14 0.07 0.00 -1.10 0.00 0.00 60.65 59.36 1x27 s ILE 197 Cb 0.11 -0.42 -0.04 0.00 -1.06 0.00 0.00 42.46 41.06 1x27 s ILE 197 CO 0.85 0.16 0.24 0.42 -0.10 0.00 0.00 174.94 176.51 1x27 s THR 198 N 0.41 2.35 0.00 2.92 -4.23 -1.26 -4.39 115.64 111.44 1x27 s THR 198 Ca -0.05 -1.60 -0.08 0.00 -1.18 0.00 0.00 61.69 58.79 1x27 s THR 198 Cb -0.08 -2.94 0.00 0.00 1.34 0.00 0.00 72.50 70.81 1x27 s THR 198 CO -0.00 0.00 0.15 -0.36 -0.54 0.00 0.00 174.62 173.87 1x27 s PHE 199 N -2.58 0.03 -0.33 3.99 0.08 0.10 -4.96 117.98 114.31 1x27 s PHE 199 Ca 0.42 -0.12 0.27 0.00 0.12 0.00 0.00 56.93 57.62 1x27 s PHE 199 Cb 0.02 -0.04 0.75 0.00 -0.57 0.00 0.00 43.02 43.17 1x27 s PHE 199 CO 0.24 -0.30 1.75 -1.00 -0.10 0.00 0.00 175.22 175.80 1x27 h PRO 200 N 4.20 0.00 -2.71 0.24 0.13 -1.92 0.94 132.00 132.88 1x27 h PRO 200 Ca -0.31 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.93 1x27 h PRO 200 Cb 1.19 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.26 1x27 h PRO 200 CO 0.41 0.00 0.36 0.20 -0.23 0.00 0.00 178.00 178.73 1x27 s GLY 201 N -4.06 -0.10 0.54 1.56 0.00 -1.26 -4.56 107.32 99.44 1x27 s GLY 201 Ca 0.06 -0.17 0.30 0.00 0.00 0.00 0.00 44.72 44.91 1x27 s GLY 201 CO 0.60 0.06 2.07 1.41 0.00 0.00 0.00 173.10 177.24 1x27 h LEU 202 N 2.00 0.00 0.11 0.66 3.38 -1.95 -2.56 115.31 116.96 1x27 h LEU 202 Ca -0.23 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1x27 h LEU 202 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 1x27 h LEU 202 CO 0.26 0.09 -0.05 0.45 0.09 0.00 0.00 178.44 179.28 1x27 h HIS 203 N 0.00 -0.14 -0.84 1.13 3.86 -1.96 -0.83 115.15 116.36 1x27 h HIS 203 Ca -0.00 -0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.24 1x27 h HIS 203 Cb 0.36 0.05 -0.05 0.00 1.06 0.00 0.00 27.41 28.82 1x27 h HIS 203 CO 0.00 0.15 0.54 0.93 0.86 0.00 0.00 177.93 180.41 1x27 h GLU 204 N -0.43 1.03 -0.05 2.45 3.07 -1.93 0.19 114.58 118.90 1x27 h GLU 204 Ca -0.02 -0.06 0.01 0.00 -0.50 0.00 0.00 59.36 58.80 1x27 h GLU 204 Cb 0.35 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 28.02 1x27 h GLU 204 CO 0.03 0.68 -0.02 1.25 -1.40 0.00 0.00 179.01 179.54 1x27 h LEU 205 N 1.06 -0.07 -1.02 1.33 6.46 -1.26 0.18 115.31 121.99 1x27 h LEU 205 Ca 0.34 0.02 -0.10 0.00 -0.12 0.00 0.00 57.88 58.01 1x27 h LEU 205 Cb 0.01 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 39.97 1x27 h LEU 205 CO -0.12 -0.03 -0.44 0.58 -0.62 0.00 0.00 178.44 177.81 1x27 h VAL 206 N -0.01 1.32 -0.53 1.05 2.07 -0.70 -1.99 116.25 117.46 1x27 h VAL 206 Ca 0.03 -1.56 -0.11 0.00 0.82 0.00 0.00 66.70 65.88 1x27 h VAL 206 Cb 0.05 1.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 1x27 h VAL 206 CO -0.06 0.45 -0.09 -0.09 0.02 0.00 0.00 177.57 177.80 1x27 h ARG 207 N 0.08 1.00 0.01 1.57 2.43 -0.24 -2.84 114.38 116.39 1x27 h ARG 207 Ca 0.00 -0.36 -0.00 0.00 -0.81 0.00 0.00 59.98 58.81 1x27 h ARG 207 Cb 0.82 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1x27 h ARG 207 CO 0.06 1.04 -0.00 1.25 -1.51 0.00 0.00 179.97 180.81 1x27 h HIS 208 N 0.87 -0.01 0.00 2.20 2.76 -0.73 -3.25 115.15 116.99 1x27 h HIS 208 Ca 0.14 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.31 1x27 h HIS 208 Cb 0.65 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.62 1x27 h HIS 208 CO 0.05 0.53 0.00 0.66 -1.30 0.00 0.00 177.93 177.87 1x27 n TYR 209 N -4.83 0.00 0.55 5.26 4.01 -0.77 -1.74 117.16 119.64 1x27 n TYR 209 Ca -0.09 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.77 1x27 n TYR 209 Cb 0.28 -0.23 0.04 0.00 -0.31 0.00 0.00 39.34 39.12 1x27 n TYR 209 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1x27 n THR 210 N -1.23 0.20 0.03 -0.72 -2.24 -1.07 -1.20 114.28 108.05 1x27 n THR 210 Ca 0.09 -0.26 0.07 0.00 -2.27 0.00 0.00 64.05 61.68 1x27 n THR 210 Cb 0.12 0.15 0.15 0.00 -2.10 0.00 0.00 70.33 68.65 1x27 n THR 210 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1x27 n ASN 211 N -2.00 2.87 -3.65 3.42 5.03 -0.71 -4.64 115.26 115.58 1x27 n ASN 211 Ca 0.02 -1.87 -0.02 0.00 0.87 0.00 0.00 54.58 53.58 1x27 n ASN 211 Cb 0.44 -0.20 -0.07 0.00 -1.02 0.00 0.00 39.78 38.93 1x27 n ASN 211 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1x27 s ALA 212 N -1.06 -2.29 -0.83 5.41 0.00 -1.06 -5.03 121.76 116.91 1x27 s ALA 212 Ca 0.26 1.71 -0.04 0.00 0.00 0.00 0.00 51.96 53.89 1x27 s ALA 212 Cb 0.14 -1.82 0.15 0.00 0.00 0.00 0.00 23.12 21.60 1x27 s ALA 212 CO 0.19 -0.12 2.43 0.45 0.00 0.00 0.00 175.76 178.72 1x27 n SER 213 N 1.76 7.19 -3.96 0.00 2.88 -1.26 -4.31 113.62 115.92 1x27 n SER 213 Ca -0.11 -3.35 -0.36 0.00 -1.33 0.00 0.00 58.87 53.73 1x27 n SER 213 Cb 0.57 -1.24 -0.09 0.00 -0.75 0.00 0.00 64.21 62.71 1x27 n SER 213 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1x27 n ASP 214 N 0.77 2.03 0.00 -3.46 2.03 -1.26 -3.30 116.55 113.36 1x27 n ASP 214 Ca 0.53 -2.60 0.00 0.00 0.52 0.00 0.00 54.79 53.24 1x27 n ASP 214 Cb 0.38 -1.19 0.00 0.00 -0.72 0.00 0.00 41.12 39.59 1x27 n ASP 214 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1x27 n GLY 215 N 5.21 2.49 3.69 0.27 0.00 -1.26 -4.95 105.19 110.64 1x27 n GLY 215 Ca 0.46 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 1x27 n GLY 215 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x27 s LEU 216 N 0.00 2.14 0.27 0.99 1.43 -1.21 -4.95 118.68 117.35 1x27 s LEU 216 Ca 0.00 1.55 0.06 0.00 -1.03 0.00 0.00 54.13 54.71 1x27 s LEU 216 Cb 0.00 -3.91 0.37 0.00 0.03 0.00 0.00 46.19 42.68 1x27 s LEU 216 CO 0.00 -2.86 1.64 0.00 0.23 0.00 0.00 176.35 175.35 1x27 s THR 218 N -3.93 -0.00 0.50 0.00 2.01 -1.26 -5.10 115.64 107.85 1x27 s THR 218 Ca -0.04 0.00 -0.21 0.00 0.31 0.00 0.00 61.69 61.75 1x27 s THR 218 Cb 0.13 -0.82 -0.09 0.00 0.01 0.00 0.00 72.50 71.73 1x27 s THR 218 CO 0.78 0.00 0.82 -1.14 -0.69 0.00 0.00 174.62 174.39 1x27 n ARG 219 N 2.91 0.93 -2.60 4.92 0.63 -1.26 -4.82 116.66 117.37 1x27 n ARG 219 Ca -0.14 0.35 -0.42 0.00 -0.92 0.00 0.00 57.85 56.71 1x27 n ARG 219 Cb 0.56 -1.91 -0.02 0.00 0.45 0.00 0.00 32.46 31.54 1x27 n ARG 219 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1x27 s LEU 220 N -0.23 3.74 0.06 6.15 1.43 -0.34 -4.49 118.68 125.00 1x27 s LEU 220 Ca 0.67 -1.90 -0.32 0.00 -1.03 0.00 0.00 54.13 51.55 1x27 s LEU 220 Cb -0.51 -2.56 -0.17 0.00 0.03 0.00 0.00 46.19 42.99 1x27 s LEU 220 CO 0.54 -1.34 1.49 0.28 0.23 0.00 0.00 176.35 177.56 1x27 h SER 221 N 8.84 -1.13 -4.75 2.29 0.02 -1.34 -3.40 113.55 114.08 1x27 h SER 221 Ca 0.30 0.07 -0.09 0.00 -0.84 0.00 0.00 61.79 61.22 1x27 h SER 221 Cb 0.95 0.34 -0.20 0.00 0.14 0.00 0.00 62.40 63.63 1x27 h SER 221 CO 1.42 -0.65 -0.08 0.00 -1.14 0.00 0.00 176.83 176.38 1x27 s ARG 222 N -5.55 0.79 0.44 3.45 1.70 -0.96 -4.99 118.95 113.83 1x27 s ARG 222 Ca -0.16 0.17 -0.25 0.00 -0.47 0.00 0.00 55.73 55.01 1x27 s ARG 222 Cb 0.03 0.37 -0.09 0.00 -0.57 0.00 0.00 34.95 34.68 1x27 s ARG 222 CO 0.53 -0.21 1.34 -2.30 -1.08 0.00 0.00 175.30 173.57 1x27 n PRO 223 N 1.49 2.04 -1.56 3.89 -0.02 -1.26 -1.51 135.00 138.07 1x27 n PRO 223 Ca -0.19 0.73 -0.42 0.00 -2.02 0.00 0.00 63.50 61.60 1x27 n PRO 223 Cb 0.56 -2.49 0.01 0.00 -0.02 0.00 0.00 33.50 31.56 1x27 n PRO 223 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1x27 s GLN 225 N -1.82 2.97 0.00 0.00 -1.52 -1.26 -4.95 119.66 113.07 1x27 s GLN 225 Ca 0.63 -0.90 0.00 0.00 -1.95 0.00 0.00 55.36 53.14 1x27 s GLN 225 Cb -0.60 -3.02 0.00 0.00 -0.22 0.00 0.00 33.01 29.17 1x27 s GLN 225 CO 0.57 -0.36 0.38 0.25 -0.25 0.00 0.00 175.29 175.89