#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 4.46 0.40 -4.53 2.96 -1.26 0.11 118.68 120.82 1x27 s LEU 65 Ca 0.00 -0.25 0.08 0.00 -0.22 0.00 0.00 54.13 53.74 1x27 s LEU 65 Cb 0.00 -2.35 -0.03 0.00 0.50 0.00 0.00 46.19 44.31 1x27 s LEU 65 CO 0.00 -0.36 0.30 0.68 -1.32 0.00 0.00 176.35 175.65 1x27 s VAL 66 N 2.03 2.65 -0.01 1.68 -7.23 0.64 -0.41 120.40 119.74 1x27 s VAL 66 Ca 0.12 -1.47 0.03 0.00 -1.81 0.00 0.00 61.98 58.85 1x27 s VAL 66 Cb -0.17 -3.01 -0.01 0.00 0.56 0.00 0.00 36.38 33.76 1x27 s VAL 66 CO 0.12 -0.03 -0.10 -0.51 -0.31 0.00 0.00 175.10 174.27 1x27 s ILE 67 N -2.49 0.84 -0.09 -0.62 2.07 0.07 -2.03 121.20 118.94 1x27 s ILE 67 Ca 0.45 -0.44 -0.30 0.00 -1.41 0.00 0.00 60.65 58.95 1x27 s ILE 67 Cb -0.01 -0.71 -0.01 0.00 0.13 0.00 0.00 42.46 41.85 1x27 s ILE 67 CO 0.26 0.24 1.01 0.00 -1.91 0.00 0.00 174.94 174.54 1x27 s ALA 68 N -0.14 3.38 -0.29 1.50 0.00 -0.75 -0.76 121.76 124.70 1x27 s ALA 68 Ca 0.02 0.40 0.21 0.00 0.00 0.00 0.00 51.96 52.59 1x27 s ALA 68 Cb -0.05 -3.43 0.12 0.00 0.00 0.00 0.00 23.12 19.76 1x27 s ALA 68 CO -0.00 -0.57 1.28 -0.07 0.00 0.00 0.00 175.76 176.40 1x27 h LEU 69 N 7.89 0.00 -8.45 0.00 3.38 -1.01 0.96 115.31 118.09 1x27 h LEU 69 Ca -0.32 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.48 1x27 h LEU 69 Cb 1.15 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.78 1x27 h LEU 69 CO 0.85 0.13 -0.44 -1.00 0.09 0.00 0.00 178.44 178.06 1x27 s HIS 70 N -3.21 0.85 0.23 1.13 3.76 -1.23 -4.77 115.29 112.05 1x27 s HIS 70 Ca 0.03 -1.13 -0.05 0.00 -0.15 0.00 0.00 55.06 53.76 1x27 s HIS 70 Cb 0.08 -0.29 -0.05 0.00 1.11 0.00 0.00 32.58 33.43 1x27 s HIS 70 CO 0.74 -0.76 0.49 -1.12 -0.85 0.00 0.00 174.74 173.24 1x27 s SER 71 N -3.10 6.48 -0.06 1.40 0.01 -1.26 -3.84 113.70 113.32 1x27 s SER 71 Ca 0.32 0.67 0.00 0.00 1.31 0.00 0.00 55.95 58.25 1x27 s SER 71 Cb 0.04 -2.12 0.02 0.00 0.21 0.00 0.00 66.02 64.17 1x27 s SER 71 CO 0.10 -0.10 -0.05 -0.47 0.41 0.00 0.00 173.24 173.13 1x27 s TYR 72 N -1.91 0.93 -0.21 2.43 5.04 0.29 -4.92 117.35 119.00 1x27 s TYR 72 Ca 0.43 -0.32 -0.12 0.00 -2.44 0.00 0.00 57.07 54.62 1x27 s TYR 72 Cb -0.11 -0.83 -0.05 0.00 0.35 0.00 0.00 41.96 41.32 1x27 s TYR 72 CO 0.27 -0.28 0.21 -2.00 -1.34 0.00 0.00 175.55 172.41 1x27 s GLU 73 N 1.22 4.16 0.14 4.97 2.12 -1.26 -1.78 118.70 128.27 1x27 s GLU 73 Ca -0.06 -0.12 -0.34 0.00 0.36 0.00 0.00 54.97 54.81 1x27 s GLU 73 Cb -0.14 -3.48 -0.15 0.00 0.26 0.00 0.00 34.13 30.62 1x27 s GLU 73 CO -0.02 0.16 1.37 -2.30 -0.54 0.00 0.00 175.26 173.94 1x27 n PRO 74 N 3.91 1.53 0.05 4.30 -0.02 -1.26 -4.89 135.00 138.63 1x27 n PRO 74 Ca -0.14 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 1x27 n PRO 74 Cb 0.52 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 1x27 n PRO 74 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1x27 n SER 75 N 2.60 0.99 -4.73 2.55 3.41 -1.26 -5.02 113.62 112.17 1x27 n SER 75 Ca 0.16 0.16 -0.41 0.00 -0.26 0.00 0.00 58.87 58.52 1x27 n SER 75 Cb 0.24 -0.28 -0.04 0.00 -0.26 0.00 0.00 64.21 63.87 1x27 n SER 75 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1x27 s HIS 76 N -1.96 3.72 -0.25 7.33 3.76 -1.26 -4.95 115.29 121.69 1x27 s HIS 76 Ca 0.00 1.63 -0.38 0.00 -0.15 0.00 0.00 55.06 56.16 1x27 s HIS 76 Cb 0.00 -2.98 -0.14 0.00 1.11 0.00 0.00 32.58 30.57 1x27 s HIS 76 CO 0.00 0.15 1.88 -3.47 -0.85 0.00 0.00 174.74 172.45 1x27 n ASP 77 N 3.21 2.61 0.00 1.40 -0.08 -1.26 -0.49 116.55 121.94 1x27 n ASP 77 Ca 0.02 0.91 0.00 0.00 -1.51 0.00 0.00 54.79 54.20 1x27 n ASP 77 Cb 0.50 -1.22 0.00 0.00 2.34 0.00 0.00 41.12 42.74 1x27 n ASP 77 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1x27 n GLY 78 N 4.79 1.82 3.75 0.27 0.00 -1.26 -5.10 105.19 109.46 1x27 n GLY 78 Ca 0.29 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.96 4.76 -0.31 1.61 1.01 0.36 -2.34 116.67 119.79 1x27 s ASP 79 Ca 0.00 2.20 -0.04 0.00 0.71 0.00 0.00 52.55 55.42 1x27 s ASP 79 Cb 0.00 -2.57 0.04 0.00 1.01 0.00 0.00 42.92 41.40 1x27 s ASP 79 CO 0.00 -1.87 0.04 -0.22 0.21 0.00 0.00 175.17 173.33 1x27 s LEU 80 N -4.85 4.04 0.64 1.23 2.96 -0.11 -4.60 118.68 118.00 1x27 s LEU 80 Ca 0.71 -1.18 -0.12 0.00 -0.22 0.00 0.00 54.13 53.32 1x27 s LEU 80 Cb -0.25 -1.78 -0.02 0.00 0.50 0.00 0.00 46.19 44.64 1x27 s LEU 80 CO 0.41 -0.28 1.05 -0.83 -1.32 0.00 0.00 176.35 175.38 1x27 s GLY 81 N 1.33 1.80 -0.02 7.98 0.00 -1.26 -4.68 107.32 112.46 1x27 s GLY 81 Ca -0.03 0.12 -0.29 0.00 0.00 0.00 0.00 44.72 44.52 1x27 s GLY 81 CO 0.01 0.42 0.76 -0.11 0.00 0.00 0.00 173.10 174.18 1x27 s PHE 82 N -2.91 -0.52 0.31 1.90 -0.12 -0.73 -4.96 117.98 110.94 1x27 s PHE 82 Ca 0.59 0.71 0.04 0.00 -0.05 0.00 0.00 56.93 58.21 1x27 s PHE 82 Cb -0.13 0.47 -0.02 0.00 -0.63 0.00 0.00 43.02 42.70 1x27 s PHE 82 CO 0.49 -0.59 0.46 -1.21 -0.05 0.00 0.00 175.22 174.32 1x27 s GLU 83 N -2.02 3.35 0.46 1.99 2.02 -1.26 0.11 118.70 123.34 1x27 s GLU 83 Ca -0.04 -0.67 -0.23 0.00 0.02 0.00 0.00 54.97 54.05 1x27 s GLU 83 Cb -0.00 -2.78 -0.09 0.00 0.10 0.00 0.00 34.13 31.36 1x27 s GLU 83 CO 0.00 0.21 1.10 1.17 0.02 0.00 0.00 175.26 177.76 1x27 n LYS 84 N -1.63 1.47 -0.16 1.61 4.81 -1.25 -1.54 118.16 121.47 1x27 n LYS 84 Ca -0.05 0.53 0.00 0.00 -0.87 0.00 0.00 58.31 57.92 1x27 n LYS 84 Cb 0.57 -2.20 0.00 0.00 0.02 0.00 0.00 35.03 33.42 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 1.06 1.30 3.76 3.14 0.00 0.33 -4.94 105.19 109.84 1x27 n GLY 85 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.11 3.39 0.08 1.61 2.12 -0.59 -4.54 118.70 120.67 1x27 s GLU 86 Ca 0.00 2.25 -0.20 0.00 0.36 0.00 0.00 54.97 57.38 1x27 s GLU 86 Cb 0.00 -2.41 -0.07 0.00 0.26 0.00 0.00 34.13 31.91 1x27 s GLU 86 CO 0.00 -0.99 0.58 -0.65 -0.54 0.00 0.00 175.26 173.66 1x27 s GLN 87 N -2.72 4.22 -0.00 4.30 -1.52 -1.26 -1.81 119.66 120.86 1x27 s GLN 87 Ca 0.67 0.76 -0.04 0.00 -1.95 0.00 0.00 55.36 54.80 1x27 s GLN 87 Cb -0.40 -3.23 -0.00 0.00 -0.22 0.00 0.00 33.01 29.15 1x27 s GLN 87 CO 0.49 0.63 0.06 -0.51 -0.25 0.00 0.00 175.29 175.72 1x27 s LEU 88 N -1.13 1.83 -0.14 2.90 1.43 -0.86 -2.49 118.68 120.21 1x27 s LEU 88 Ca 0.30 -0.20 -0.03 0.00 -1.03 0.00 0.00 54.13 53.17 1x27 s LEU 88 Cb -0.20 0.37 -0.03 0.00 0.03 0.00 0.00 46.19 46.37 1x27 s LEU 88 CO 0.19 -0.25 -0.06 0.00 0.23 0.00 0.00 176.35 176.47 1x27 s ARG 89 N -1.01 3.56 -0.04 1.70 1.70 -0.22 -0.26 118.95 124.38 1x27 s ARG 89 Ca -0.11 -0.55 -0.23 0.00 -0.47 0.00 0.00 55.73 54.37 1x27 s ARG 89 Cb -0.06 -2.84 -0.04 0.00 -0.57 0.00 0.00 34.95 31.43 1x27 s ARG 89 CO 0.00 0.27 0.69 0.42 -1.08 0.00 0.00 175.30 175.60 1x27 s ILE 90 N 0.28 4.97 -0.20 4.99 -1.09 0.12 -0.17 121.20 130.08 1x27 s ILE 90 Ca -0.04 1.43 0.07 0.00 -2.23 0.00 0.00 60.65 59.87 1x27 s ILE 90 Cb -0.14 -4.03 -0.17 0.00 -1.58 0.00 0.00 42.46 36.54 1x27 s ILE 90 CO 0.03 0.30 -0.10 0.18 -1.23 0.00 0.00 174.94 174.12 1x27 n LEU 91 N 3.42 1.90 -3.84 2.97 4.77 0.31 -4.93 117.00 121.61 1x27 n LEU 91 Ca -0.03 -0.08 -0.12 0.00 -0.03 0.00 0.00 56.01 55.76 1x27 n LEU 91 Cb 0.51 -0.34 -0.11 0.00 -2.33 0.00 0.00 43.42 41.15 1x27 n LEU 91 CO 0.46 0.71 -0.18 -1.61 -1.33 0.00 0.00 177.39 175.44 1x27 s GLU 92 N -2.43 0.31 -0.81 3.23 2.02 -0.89 -4.96 118.70 115.17 1x27 s GLU 92 Ca -0.22 -0.05 0.02 0.00 0.02 0.00 0.00 54.97 54.74 1x27 s GLU 92 Cb 0.07 0.14 0.29 0.00 0.10 0.00 0.00 34.13 34.72 1x27 s GLU 92 CO 0.58 -0.06 1.12 1.04 0.02 0.00 0.00 175.26 177.96 1x27 n GLN 93 N 2.34 3.54 -0.83 1.61 6.02 -1.26 -1.16 117.38 127.64 1x27 n GLN 93 Ca -0.17 -4.67 -0.25 0.00 -0.01 0.00 0.00 57.00 51.90 1x27 n GLN 93 Cb 0.57 -2.36 -0.02 0.00 1.02 0.00 0.00 30.24 29.46 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 0.74 5.18 0.00 1.08 2.88 -0.78 -4.84 113.62 117.88 1x27 n SER 94 Ca 0.31 -2.37 0.00 0.00 -1.33 0.00 0.00 58.87 55.48 1x27 n SER 94 Cb 0.37 -1.15 0.00 0.00 -0.75 0.00 0.00 64.21 62.68 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 3.79 0.62 0.18 0.46 0.00 -1.26 -2.67 105.19 106.31 1x27 n GLY 95 Ca 0.48 0.53 -0.11 0.00 0.00 0.00 0.00 46.02 46.92 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 0.46 -6.28 1.61 4.81 -1.97 -3.45 114.58 109.77 1x27 h GLU 96 Ca 0.00 -0.39 -0.69 0.00 -0.13 0.00 0.00 59.36 58.15 1x27 h GLU 96 Cb 0.00 0.09 -0.21 0.00 0.63 0.00 0.00 28.75 29.25 1x27 h GLU 96 CO 0.00 1.03 -0.74 -1.58 -0.73 0.00 0.00 179.01 176.99 1x27 s TRP 97 N -3.58 2.79 -0.07 0.92 0.52 -1.09 -2.39 118.94 116.03 1x27 s TRP 97 Ca -0.06 -0.09 0.05 0.00 0.02 0.00 0.00 56.10 56.01 1x27 s TRP 97 Cb 0.10 -1.65 -0.01 0.00 -1.15 0.00 0.00 33.47 30.76 1x27 s TRP 97 CO 0.85 0.26 -0.21 -1.58 0.02 0.00 0.00 176.95 176.28 1x27 s TRP 98 N -0.79 2.55 0.06 -1.98 0.51 0.21 -1.87 118.94 117.62 1x27 s TRP 98 Ca 0.12 -0.66 -0.30 0.00 -2.12 0.00 0.00 56.10 53.14 1x27 s TRP 98 Cb -0.11 -1.65 -0.05 0.00 -0.81 0.00 0.00 33.47 30.85 1x27 s TRP 98 CO 0.02 -0.17 1.14 0.21 -0.51 0.00 0.00 176.95 177.64 1x27 s LYS 99 N -0.12 4.47 0.29 4.98 2.47 -0.31 -0.77 119.74 130.75 1x27 s LYS 99 Ca -0.04 1.69 -0.03 0.00 -1.56 0.00 0.00 55.97 56.03 1x27 s LYS 99 Cb -0.14 -3.36 -0.01 0.00 -1.46 0.00 0.00 37.83 32.86 1x27 s LYS 99 CO 0.04 -0.18 0.38 0.00 0.16 0.00 0.00 175.35 175.75 1x27 s ALA 100 N 0.92 0.76 -0.03 3.13 0.00 0.32 -0.53 121.76 126.33 1x27 s ALA 100 Ca 0.56 -1.48 0.01 0.00 0.00 0.00 0.00 51.96 51.05 1x27 s ALA 100 Cb -0.28 1.22 0.02 0.00 0.00 0.00 0.00 23.12 24.08 1x27 s ALA 100 CO 0.29 -0.75 -0.03 -1.14 0.00 0.00 0.00 175.76 174.14 1x27 s GLN 101 N -3.52 0.53 0.01 0.00 0.74 0.75 -0.71 119.66 117.46 1x27 s GLN 101 Ca 0.32 -0.04 -0.30 0.00 0.05 0.00 0.00 55.36 55.38 1x27 s GLN 101 Cb 0.01 -0.60 -0.05 0.00 1.10 0.00 0.00 33.01 33.47 1x27 s GLN 101 CO 0.17 -0.07 1.24 0.45 -0.55 0.00 0.00 175.29 176.53 1x27 s SER 102 N 0.76 7.03 -0.22 6.67 0.15 -0.56 -1.05 113.70 126.48 1x27 s SER 102 Ca -0.09 1.97 0.03 0.00 0.70 0.00 0.00 55.95 58.55 1x27 s SER 102 Cb -0.12 -2.57 0.35 0.00 -1.71 0.00 0.00 66.02 61.97 1x27 s SER 102 CO -0.01 -0.55 1.44 0.18 1.20 0.00 0.00 173.24 175.50 1x27 n LEU 103 N 4.61 4.78 0.00 3.45 4.77 -1.04 -0.56 117.00 133.02 1x27 n LEU 103 Ca 0.10 -2.50 0.00 0.00 -0.03 0.00 0.00 56.01 53.58 1x27 n LEU 103 Cb 0.46 -0.67 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 1x27 n LEU 103 CO 0.56 0.75 -0.13 0.41 -1.33 0.00 0.00 177.39 177.65 1x27 n THR 104 N -0.28 0.00 -0.17 -5.08 -1.04 -1.26 -4.87 114.28 101.57 1x27 n THR 104 Ca 0.29 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.30 1x27 n THR 104 Cb 1.07 -0.15 0.00 0.00 -1.82 0.00 0.00 70.33 69.43 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 -0.75 0.00 0.00 12.58 -2.24 -1.23 -5.01 114.28 117.63 1x27 n THR 105 Ca 0.00 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1x27 n THR 105 Cb 0.09 1.17 0.00 0.00 -2.10 0.00 0.00 70.33 69.50 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 0.28 1.50 3.77 3.38 0.00 0.28 -4.95 105.19 109.45 1x27 n GLY 106 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1x27 n GLY 106 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1x27 s GLN 107 N 0.00 4.46 0.26 1.61 -0.21 -1.26 -4.59 119.66 119.93 1x27 s GLN 107 Ca 0.00 1.66 0.10 0.00 0.02 0.00 0.00 55.36 57.14 1x27 s GLN 107 Cb 0.00 -2.93 -0.05 0.00 1.00 0.00 0.00 33.01 31.03 1x27 s GLN 107 CO 0.00 0.09 -0.17 -1.83 -2.12 0.00 0.00 175.29 171.26 1x27 s GLU 108 N -1.86 1.58 0.00 2.91 -1.05 -1.26 -1.50 118.70 117.52 1x27 s GLU 108 Ca 0.50 -1.73 0.00 0.00 -0.15 0.00 0.00 54.97 53.59 1x27 s GLU 108 Cb -0.27 -1.53 0.00 0.00 -0.44 0.00 0.00 34.13 31.88 1x27 s GLU 108 CO 0.35 0.26 0.00 0.41 0.95 0.00 0.00 175.26 177.22 1x27 n GLY 109 N -0.56 -0.55 3.85 -3.83 0.00 0.11 -4.78 105.19 99.43 1x27 n GLY 109 Ca -0.06 -0.66 -0.37 0.00 0.00 0.00 0.00 46.02 44.93 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 -3.00 3.62 0.08 1.61 0.08 -0.99 0.12 117.98 119.50 1x27 s PHE 110 Ca 0.00 0.66 0.05 0.00 0.12 0.00 0.00 56.93 57.76 1x27 s PHE 110 Cb 0.00 -2.08 -0.03 0.00 -0.57 0.00 0.00 43.02 40.34 1x27 s PHE 110 CO 0.00 0.66 -0.13 0.96 -0.10 0.00 0.00 175.22 176.61 1x27 s ILE 111 N -0.89 1.07 0.02 0.64 -4.36 0.05 -0.93 121.20 116.80 1x27 s ILE 111 Ca 0.17 -1.43 -0.30 0.00 -0.26 0.00 0.00 60.65 58.83 1x27 s ILE 111 Cb -0.13 -1.17 -0.04 0.00 1.25 0.00 0.00 42.46 42.37 1x27 s ILE 111 CO 0.06 -0.34 1.08 -2.16 0.24 0.00 0.00 174.94 173.83 1x27 s PRO 112 N -2.10 4.49 0.48 0.37 0.04 -1.26 -0.62 135.00 136.39 1x27 s PRO 112 Ca 0.01 1.58 0.22 0.00 0.04 0.00 0.00 61.00 62.85 1x27 s PRO 112 Cb -0.08 -3.42 1.21 0.00 0.04 0.00 0.00 34.50 32.26 1x27 s PRO 112 CO 0.02 -0.17 2.00 0.27 0.04 0.00 0.00 177.00 179.16 1x27 h PHE 113 N 6.85 0.00 -0.01 0.56 -0.00 -1.81 -2.72 116.94 119.81 1x27 h PHE 113 Ca -0.40 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.57 1x27 h PHE 113 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.16 1x27 h PHE 113 CO 0.68 0.18 0.00 0.27 -0.00 0.00 0.00 178.31 179.44 1x27 n ASN 114 N -3.81 0.07 -0.95 -0.68 6.94 -1.26 -2.92 115.26 112.63 1x27 n ASN 114 Ca -0.02 -1.70 0.12 0.00 -0.02 0.00 0.00 54.58 52.96 1x27 n ASN 114 Cb 0.28 -0.01 0.11 0.00 -2.36 0.00 0.00 39.78 37.80 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 -0.61 0.06 -4.12 -2.53 3.01 -1.03 -4.95 117.46 107.28 1x27 n PHE 115 Ca 0.08 -0.03 -0.09 0.00 1.01 0.00 0.00 57.45 58.41 1x27 n PHE 115 Cb 0.04 -0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.42 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 -1.87 0.12 -0.00 -4.37 -7.23 -1.15 -0.31 120.40 105.59 1x27 s VAL 116 Ca 0.28 -1.85 -0.01 0.00 -1.81 0.00 0.00 61.98 58.59 1x27 s VAL 116 Cb 0.20 -1.94 -0.00 0.00 0.56 0.00 0.00 36.38 35.20 1x27 s VAL 116 CO 0.29 -0.54 0.02 0.00 -0.31 0.00 0.00 175.10 174.56 1x27 s ALA 117 N -4.02 -0.04 0.04 1.32 0.00 0.06 -4.90 121.76 114.22 1x27 s ALA 117 Ca 0.21 -0.07 -0.34 0.00 0.00 0.00 0.00 51.96 51.75 1x27 s ALA 117 Cb 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 23.12 23.07 1x27 s ALA 117 CO -0.00 -0.05 1.73 1.63 0.00 0.00 0.00 175.76 179.06 1x27 n LYS 118 N 2.68 2.17 -0.10 0.00 5.02 -1.26 -0.75 118.16 125.91 1x27 n LYS 118 Ca -0.15 0.79 0.06 0.00 -2.02 0.00 0.00 58.31 56.99 1x27 n LYS 118 Cb 0.59 -2.60 0.11 0.00 -0.02 0.00 0.00 35.03 33.11 1x27 n LYS 118 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1x27 n ALA 119 N 5.03 2.31 -0.70 7.82 0.00 0.45 -4.84 120.51 130.58 1x27 n ALA 119 Ca 0.20 -0.90 -0.29 0.00 0.00 0.00 0.00 53.44 52.45 1x27 n ALA 119 Cb 0.29 -0.42 0.23 0.00 0.00 0.00 0.00 19.45 19.54 1x27 n ALA 119 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1x27 s ASN 120 N -0.98 1.53 0.73 0.00 -0.87 -1.18 -4.97 114.94 109.19 1x27 s ASN 120 Ca 0.19 1.51 -0.13 0.00 -1.57 0.00 0.00 52.86 52.86 1x27 s ASN 120 Cb 0.11 -2.24 0.04 0.00 -0.02 0.00 0.00 41.25 39.14 1x27 s ASN 120 CO 0.15 -3.86 1.12 -0.55 -2.57 0.00 0.00 177.10 171.40 1x27 s SER 121 N -2.74 4.57 -0.10 -1.22 0.15 -1.26 -5.00 113.70 108.09 1x27 s SER 121 Ca 0.67 2.03 -0.23 0.00 0.70 0.00 0.00 55.95 59.12 1x27 s SER 121 Cb -0.23 -2.55 -0.28 0.00 -1.71 0.00 0.00 66.02 61.25 1x27 s SER 121 CO 0.62 -1.99 0.74 -0.07 1.20 0.00 0.00 173.24 173.74 1x27 h LEU 122 N -0.53 0.25 -0.88 3.45 3.38 -1.99 -3.38 115.31 115.61 1x27 h LEU 122 Ca -0.46 -0.91 0.24 0.00 0.09 0.00 0.00 57.88 56.84 1x27 h LEU 122 Cb 1.25 -0.08 -0.15 0.00 0.09 0.00 0.00 40.66 41.77 1x27 h LEU 122 CO 0.51 1.30 0.20 -0.33 0.09 0.00 0.00 178.44 180.22 1x27 h GLU 123 N -0.63 0.17 -0.07 1.13 3.07 -1.95 0.32 114.58 116.62 1x27 h GLU 123 Ca -0.14 -0.01 0.02 0.00 -0.50 0.00 0.00 59.36 58.73 1x27 h GLU 123 Cb 1.41 -0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 29.28 1x27 h GLU 123 CO 0.05 0.11 0.21 -1.35 -1.40 0.00 0.00 179.01 176.64 1x27 h PRO 124 N 0.17 0.00 -6.81 2.33 0.11 -1.90 -3.43 132.00 122.48 1x27 h PRO 124 Ca 0.55 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 66.13 1x27 h PRO 124 Cb 1.12 0.00 0.07 0.00 0.11 0.00 0.00 31.00 32.30 1x27 h PRO 124 CO -0.68 0.00 0.80 -1.21 -0.21 0.00 0.00 178.00 176.70 1x27 s GLU 125 N -4.29 4.19 0.65 1.05 0.41 0.11 -4.89 118.70 115.94 1x27 s GLU 125 Ca -0.04 2.44 0.43 0.00 -0.41 0.00 0.00 54.97 57.39 1x27 s GLU 125 Cb 0.12 -3.05 2.27 0.00 -1.78 0.00 0.00 34.13 31.69 1x27 s GLU 125 CO 0.40 -0.50 2.32 -1.35 -0.49 0.00 0.00 175.26 175.64 1x27 h PRO 126 N 4.54 0.00 -0.01 0.39 0.11 -1.87 -2.91 132.00 132.25 1x27 h PRO 126 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1x27 h PRO 126 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1x27 h PRO 126 CO 0.75 0.00 -0.11 -2.67 -0.21 0.00 0.00 178.00 175.77 1x27 n TRP 127 N -3.09 0.00 -3.24 0.65 4.27 -1.26 -4.69 117.44 110.08 1x27 n TRP 127 Ca -0.02 0.00 -0.46 0.00 -3.89 0.00 0.00 57.50 53.13 1x27 n TRP 127 Cb 0.11 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 30.01 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 -1.13 3.22 -0.81 -2.67 5.36 -1.10 -1.51 117.98 119.35 1x27 s PHE 128 Ca 0.10 -1.27 -0.05 0.00 -0.96 0.00 0.00 56.93 54.75 1x27 s PHE 128 Cb 0.08 -3.88 0.20 0.00 -0.34 0.00 0.00 43.02 39.09 1x27 s PHE 128 CO 0.19 -1.11 0.69 -0.06 -1.46 0.00 0.00 175.22 173.47 1x27 s PHE 129 N 1.80 3.72 0.00 10.12 0.08 -0.96 -4.68 117.98 128.07 1x27 s PHE 129 Ca 0.08 -2.67 0.00 0.00 0.12 0.00 0.00 56.93 54.46 1x27 s PHE 129 Cb -0.26 -3.41 0.00 0.00 -0.57 0.00 0.00 43.02 38.79 1x27 s PHE 129 CO 0.02 -0.85 0.68 1.17 -0.10 0.00 0.00 175.22 176.15 1x27 n LYS 130 N 3.12 0.00 -2.38 0.44 4.81 -1.26 -3.47 118.16 119.42 1x27 n LYS 130 Ca 0.15 0.68 -0.41 0.00 -0.87 0.00 0.00 58.31 57.86 1x27 n LYS 130 Cb 0.40 -1.18 -0.01 0.00 0.02 0.00 0.00 35.03 34.26 1x27 n LYS 130 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1x27 n ASN 131 N -1.73 4.56 -3.80 3.14 3.02 -1.26 -2.31 115.26 116.88 1x27 n ASN 131 Ca 0.00 -2.88 -0.16 0.00 -0.03 0.00 0.00 54.58 51.51 1x27 n ASN 131 Cb 0.00 -1.72 -0.16 0.00 -0.61 0.00 0.00 39.78 37.29 1x27 n ASN 131 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1x27 s LEU 132 N 4.57 1.20 0.33 3.41 2.96 -1.23 -5.08 118.68 124.84 1x27 s LEU 132 Ca 0.55 0.01 -0.19 0.00 -0.22 0.00 0.00 54.13 54.27 1x27 s LEU 132 Cb 0.05 -0.13 -0.09 0.00 0.50 0.00 0.00 46.19 46.51 1x27 s LEU 132 CO 0.06 -0.10 0.81 -0.94 -1.32 0.00 0.00 176.35 174.86 1x27 s SER 133 N 0.95 6.94 0.33 3.68 1.04 -1.26 -4.62 113.70 120.75 1x27 s SER 133 Ca -0.09 1.48 0.12 0.00 0.48 0.00 0.00 55.95 57.94 1x27 s SER 133 Cb -0.12 -2.45 1.00 0.00 0.10 0.00 0.00 66.02 64.55 1x27 s SER 133 CO -0.02 -0.18 1.66 -0.09 0.98 0.00 0.00 173.24 175.59 1x27 h ARG 134 N 2.52 0.31 0.02 4.02 2.43 -2.00 0.17 114.38 121.85 1x27 h ARG 134 Ca -0.48 -0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 58.55 1x27 h ARG 134 Cb 1.18 -0.07 0.01 0.00 -0.42 0.00 0.00 29.97 30.67 1x27 h ARG 134 CO 0.64 0.20 -0.49 1.57 -1.51 0.00 0.00 179.97 180.39 1x27 h LYS 135 N 0.32 0.29 -0.23 0.20 -0.00 -2.00 -3.15 116.57 112.00 1x27 h LYS 135 Ca 0.69 -0.34 0.02 0.00 -0.00 0.00 0.00 60.65 61.01 1x27 h LYS 135 Cb 1.53 0.11 -0.01 0.00 -0.00 0.00 0.00 32.23 33.85 1x27 h LYS 135 CO -0.61 1.06 0.15 -0.44 -0.00 0.00 0.00 179.45 179.62 1x27 h ASP 136 N -0.33 0.21 -0.26 7.07 5.19 -1.39 -1.02 116.42 125.88 1x27 h ASP 136 Ca -0.07 -0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 56.30 1x27 h ASP 136 Cb 1.25 -0.05 -0.01 0.00 0.18 0.00 0.00 39.33 40.70 1x27 h ASP 136 CO 0.10 0.15 0.01 0.00 -3.12 0.00 0.00 179.24 176.37 1x27 h ALA 137 N 1.87 0.35 -0.51 3.45 0.00 -0.82 0.26 119.26 123.85 1x27 h ALA 137 Ca 0.09 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.80 1x27 h ALA 137 Cb 0.07 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1x27 h ALA 137 CO -0.02 0.07 0.34 0.93 0.00 0.00 0.00 179.25 180.57 1x27 h GLU 138 N 0.24 0.61 -0.28 0.00 5.08 -1.18 0.25 114.58 119.30 1x27 h GLU 138 Ca 0.07 -0.04 -0.19 0.00 -1.00 0.00 0.00 59.36 58.21 1x27 h GLU 138 Cb 0.40 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1x27 h GLU 138 CO 0.01 0.41 -0.56 0.00 -1.00 0.00 0.00 179.01 177.87 1x27 h ARG 139 N 0.63 0.88 -0.16 2.33 -0.00 -0.75 -2.44 114.38 114.87 1x27 h ARG 139 Ca 0.20 -0.57 -0.22 0.00 -0.50 0.00 0.00 59.98 58.88 1x27 h ARG 139 Cb 0.01 0.07 0.01 0.00 0.00 0.00 0.00 29.97 30.06 1x27 h ARG 139 CO -0.05 1.20 -0.77 1.96 0.00 0.00 0.00 179.97 182.31 1x27 h GLN 140 N 0.66 0.80 -0.55 0.04 1.08 -0.31 -2.79 115.11 114.05 1x27 h GLN 140 Ca 0.01 -0.65 -0.08 0.00 -1.45 0.00 0.00 58.65 56.47 1x27 h GLN 140 Cb 1.17 0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 28.72 1x27 h GLN 140 CO 0.13 1.26 0.02 -0.07 -0.95 0.00 0.00 178.83 179.21 1x27 h LEU 141 N 0.55 0.93 0.00 1.46 3.38 -0.57 -2.64 115.31 118.41 1x27 h LEU 141 Ca -0.05 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1x27 h LEU 141 Cb 1.40 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1x27 h LEU 141 CO 0.16 1.00 0.00 0.18 0.09 0.00 0.00 178.44 179.87 1x27 n LEU 142 N -4.28 0.00 -4.72 1.67 4.77 -0.92 -4.67 117.00 108.85 1x27 n LEU 142 Ca 0.02 0.44 -0.31 0.00 -0.03 0.00 0.00 56.01 56.13 1x27 n LEU 142 Cb 0.32 -0.44 0.13 0.00 -2.33 0.00 0.00 43.42 41.09 1x27 n LEU 142 CO 0.43 -0.01 0.70 0.00 -1.33 0.00 0.00 177.39 177.18 1x27 s ALA 143 N -2.89 1.88 0.48 -1.18 0.00 -1.00 -4.97 121.76 114.08 1x27 s ALA 143 Ca 0.17 0.47 -0.22 0.00 0.00 0.00 0.00 51.96 52.39 1x27 s ALA 143 Cb 0.19 -3.37 -0.07 0.00 0.00 0.00 0.00 23.12 19.86 1x27 s ALA 143 CO 0.50 -2.24 1.12 -1.25 0.00 0.00 0.00 175.76 173.89 1x27 s PRO 144 N -4.69 3.70 0.00 0.00 0.04 -1.26 -3.67 135.00 129.12 1x27 s PRO 144 Ca 0.65 1.62 0.00 0.00 0.04 0.00 0.00 61.00 63.31 1x27 s PRO 144 Cb -0.21 -2.26 0.00 0.00 0.04 0.00 0.00 34.50 32.08 1x27 s PRO 144 CO 0.56 -0.56 0.00 0.41 0.04 0.00 0.00 177.00 177.44 1x27 n GLY 145 N 0.24 0.67 3.21 0.56 0.00 -1.26 -5.01 105.19 103.60 1x27 n GLY 145 Ca 0.09 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.30 1.30 0.00 1.61 0.02 -1.24 -4.68 114.94 109.65 1x27 s ASN 146 Ca 0.00 -1.07 0.00 0.00 -1.02 0.00 0.00 52.86 50.77 1x27 s ASN 146 Cb 0.00 0.08 0.00 0.00 0.02 0.00 0.00 41.25 41.35 1x27 s ASN 146 CO 0.00 -0.48 0.00 0.35 0.02 0.00 0.00 177.10 176.99 1x27 n THR 147 N -0.15 0.00 -1.68 1.60 -2.24 -1.26 -4.97 114.28 105.58 1x27 n THR 147 Ca -0.10 0.00 -0.46 0.00 -2.27 0.00 0.00 64.05 61.22 1x27 n THR 147 Cb 0.62 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.80 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 2.37 0.00 4.78 8.25 -1.26 -0.29 115.22 129.08 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 -2.64 0.00 0.00 1.12 0.00 0.00 29.99 28.47 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 4.03 1.37 3.77 -1.41 0.00 0.13 -4.84 105.19 108.25 1x27 n GLY 149 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.76 6.54 0.37 1.61 0.01 0.61 -0.62 113.70 120.46 1x27 s SER 150 Ca 0.00 2.22 -0.15 0.00 1.31 0.00 0.00 55.95 59.32 1x27 s SER 150 Cb 0.00 -2.60 0.05 0.00 0.21 0.00 0.00 66.02 63.68 1x27 s SER 150 CO 0.00 -0.65 0.77 0.72 0.41 0.00 0.00 173.24 174.49 1x27 s PHE 151 N -1.53 0.14 0.03 2.43 -0.71 -0.67 -1.03 117.98 116.65 1x27 s PHE 151 Ca 0.59 -0.78 -0.28 0.00 -1.04 0.00 0.00 56.93 55.42 1x27 s PHE 151 Cb -0.27 0.78 0.09 0.00 -1.21 0.00 0.00 43.02 42.42 1x27 s PHE 151 CO 0.33 -1.52 0.93 -0.48 -1.34 0.00 0.00 175.22 173.14 1x27 s LEU 152 N -3.07 -0.30 -0.04 -1.99 0.05 0.23 -0.03 118.68 113.53 1x27 s LEU 152 Ca 0.16 -0.12 0.05 0.00 0.05 0.00 0.00 54.13 54.27 1x27 s LEU 152 Cb -0.05 2.02 -0.01 0.00 -2.05 0.00 0.00 46.19 46.11 1x27 s LEU 152 CO 0.11 -0.68 -0.20 -0.63 -0.55 0.00 0.00 176.35 174.40 1x27 s ILE 153 N -3.13 1.66 0.18 1.48 1.01 -0.57 -0.73 121.20 121.11 1x27 s ILE 153 Ca 0.07 -0.86 0.06 0.00 0.00 0.00 0.00 60.65 59.93 1x27 s ILE 153 Cb -0.01 -1.42 -0.05 0.00 0.01 0.00 0.00 42.46 41.00 1x27 s ILE 153 CO -0.06 0.47 -0.13 0.00 0.00 0.00 0.00 174.94 175.23 1x27 s ARG 154 N -0.10 1.21 0.04 2.79 1.70 -0.59 -2.25 118.95 121.75 1x27 s ARG 154 Ca -0.02 -1.51 -0.30 0.00 -0.47 0.00 0.00 55.73 53.42 1x27 s ARG 154 Cb -0.12 -0.92 -0.08 0.00 -0.57 0.00 0.00 34.95 33.26 1x27 s ARG 154 CO 0.02 0.14 1.70 -2.00 -1.08 0.00 0.00 175.30 174.09 1x27 s GLU 155 N -3.61 4.18 0.61 3.89 2.56 -0.98 -0.98 118.70 124.37 1x27 s GLU 155 Ca 0.19 2.35 -0.19 0.00 0.00 0.00 0.00 54.97 57.32 1x27 s GLU 155 Cb 0.00 -3.76 -0.03 0.00 2.00 0.00 0.00 34.13 32.34 1x27 s GLU 155 CO 0.04 -0.79 1.22 0.45 -0.56 0.00 0.00 175.26 175.62 1x27 n SER 156 N 6.21 1.86 -0.17 -1.70 2.88 0.27 -4.79 113.62 118.18 1x27 n SER 156 Ca 0.17 0.86 0.09 0.00 -1.33 0.00 0.00 58.87 58.66 1x27 n SER 156 Cb 0.41 -1.51 0.13 0.00 -0.75 0.00 0.00 64.21 62.49 1x27 n SER 156 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1x27 n GLU 157 N -1.42 1.17 0.00 -1.46 0.28 -1.26 -4.53 120.64 113.43 1x27 n GLU 157 Ca 0.14 -2.49 0.00 0.00 -0.16 0.00 0.00 57.16 54.65 1x27 n GLU 157 Cb 0.47 -1.40 0.00 0.00 1.43 0.00 0.00 31.44 31.94 1x27 n GLU 157 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1x27 n SER 158 N -1.26 0.43 -3.35 -1.84 2.88 -1.26 -5.02 113.62 104.20 1x27 n SER 158 Ca 0.15 -1.00 0.02 0.00 -1.33 0.00 0.00 58.87 56.70 1x27 n SER 158 Cb 0.65 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.09 1x27 n SER 158 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1x27 s THR 159 N -0.00 -0.69 0.90 2.46 2.01 -1.26 -5.14 115.64 113.92 1x27 s THR 159 Ca 0.00 0.00 -0.12 0.00 0.31 0.00 0.00 61.69 61.88 1x27 s THR 159 Cb 0.00 -1.00 0.08 0.00 0.01 0.00 0.00 72.50 71.59 1x27 s THR 159 CO 0.00 0.00 0.81 0.00 -0.69 0.00 0.00 174.62 174.74 1x27 n ALA 160 N 5.28 -1.48 -2.56 7.40 0.00 -1.26 -2.44 120.51 125.44 1x27 n ALA 160 Ca -0.08 -0.52 -0.11 0.00 0.00 0.00 0.00 53.44 52.73 1x27 n ALA 160 Cb 0.52 -2.02 -0.00 0.00 0.00 0.00 0.00 19.45 17.94 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 0.92 -0.50 3.48 0.00 0.00 -1.26 -4.92 105.19 102.90 1x27 n GLY 161 Ca 0.10 0.01 -0.23 0.00 0.00 0.00 0.00 46.02 45.90 1x27 n GLY 161 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x27 s SER 162 N -2.11 2.82 0.09 1.61 0.01 -1.02 -4.90 113.70 110.20 1x27 s SER 162 Ca 0.05 -1.31 0.03 0.00 1.31 0.00 0.00 55.95 56.03 1x27 s SER 162 Cb -0.03 -0.18 -0.03 0.00 0.21 0.00 0.00 66.02 65.99 1x27 s SER 162 CO 0.06 -0.48 -0.09 -0.36 0.41 0.00 0.00 173.24 172.78 1x27 s PHE 163 N -3.07 0.96 0.09 2.43 0.08 -1.25 0.94 117.98 118.16 1x27 s PHE 163 Ca 0.34 -0.67 0.07 0.00 0.12 0.00 0.00 56.93 56.79 1x27 s PHE 163 Cb 0.07 -0.54 -0.03 0.00 -0.57 0.00 0.00 43.02 41.95 1x27 s PHE 163 CO 0.15 -0.04 -0.18 -1.12 -0.10 0.00 0.00 175.22 173.92 1x27 s SER 164 N -2.37 2.22 -0.23 1.36 0.01 -0.15 -0.97 113.70 113.56 1x27 s SER 164 Ca 0.03 -0.66 -0.04 0.00 1.31 0.00 0.00 55.95 56.59 1x27 s SER 164 Cb -0.03 -0.11 -0.00 0.00 0.21 0.00 0.00 66.02 66.09 1x27 s SER 164 CO -0.01 0.01 -0.02 -0.22 0.41 0.00 0.00 173.24 173.41 1x27 s LEU 165 N -1.85 3.09 -0.08 2.44 2.96 0.12 -1.53 118.68 123.83 1x27 s LEU 165 Ca 0.03 -0.46 0.03 0.00 -0.22 0.00 0.00 54.13 53.51 1x27 s LEU 165 Cb -0.10 -1.76 -0.02 0.00 0.50 0.00 0.00 46.19 44.81 1x27 s LEU 165 CO 0.04 -0.05 -0.17 -0.44 -1.32 0.00 0.00 176.35 174.41 1x27 s SER 166 N 1.48 3.78 -0.03 3.68 0.01 0.09 0.53 113.70 123.23 1x27 s SER 166 Ca 0.05 -0.32 -0.07 0.00 1.31 0.00 0.00 55.95 56.92 1x27 s SER 166 Cb -0.15 -1.10 0.01 0.00 0.21 0.00 0.00 66.02 64.99 1x27 s SER 166 CO -0.02 0.26 0.17 0.54 0.41 0.00 0.00 173.24 174.59 1x27 s VAL 167 N -0.22 0.04 -0.20 3.43 0.11 -0.47 -0.60 120.40 122.49 1x27 s VAL 167 Ca 0.00 -0.37 -0.15 0.00 -2.93 0.00 0.00 61.98 58.54 1x27 s VAL 167 Cb -0.13 -0.36 -0.04 0.00 -1.53 0.00 0.00 36.38 34.31 1x27 s VAL 167 CO 0.03 -0.20 0.34 -0.60 -3.33 0.00 0.00 175.10 171.34 1x27 s ARG 168 N -0.71 4.17 0.37 1.54 3.52 -0.20 -0.22 118.95 127.41 1x27 s ARG 168 Ca -0.08 0.10 0.05 0.00 -0.13 0.00 0.00 55.73 55.67 1x27 s ARG 168 Cb -0.05 -3.52 -0.06 0.00 -1.56 0.00 0.00 34.95 29.76 1x27 s ARG 168 CO 0.01 0.02 0.04 0.34 -0.81 0.00 0.00 175.30 174.90 1x27 s ASP 169 N 0.96 2.98 -0.16 -2.12 2.15 -0.63 0.17 116.67 120.02 1x27 s ASP 169 Ca 0.17 -1.41 -0.02 0.00 0.43 0.00 0.00 52.55 51.72 1x27 s ASP 169 Cb -0.14 -0.12 -0.02 0.00 -0.30 0.00 0.00 42.92 42.34 1x27 s ASP 169 CO 0.07 -0.59 -0.08 0.12 -0.17 0.00 0.00 175.17 174.51 1x27 s PHE 170 N -3.08 2.90 -0.08 -5.34 2.19 -1.26 -1.74 117.98 111.57 1x27 s PHE 170 Ca 0.34 -0.64 -0.03 0.00 0.33 0.00 0.00 56.93 56.93 1x27 s PHE 170 Cb 0.08 -1.94 -0.04 0.00 -1.31 0.00 0.00 43.02 39.82 1x27 s PHE 170 CO 0.16 -0.26 0.04 0.34 1.83 0.00 0.00 175.22 177.33 1x27 s ASP 171 N 0.65 5.54 -0.03 6.13 2.15 0.77 -4.97 116.67 126.91 1x27 s ASP 171 Ca -0.05 0.21 0.02 0.00 0.43 0.00 0.00 52.55 53.16 1x27 s ASP 171 Cb -0.15 -1.62 0.10 0.00 -0.30 0.00 0.00 42.92 40.95 1x27 s ASP 171 CO 0.02 0.37 0.65 0.00 -0.17 0.00 0.00 175.17 176.04 1x27 n GLN 172 N 1.93 1.46 0.11 4.34 1.13 -1.26 -2.57 117.38 122.51 1x27 n GLN 172 Ca -0.18 -0.37 0.00 0.00 -1.94 0.00 0.00 57.00 54.51 1x27 n GLN 172 Cb 0.54 -1.59 0.00 0.00 0.11 0.00 0.00 30.24 29.30 1x27 n GLN 172 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1x27 n ASN 173 N 0.08 -0.13 0.15 1.08 5.15 -1.26 -4.91 115.26 115.41 1x27 n ASN 173 Ca 0.03 0.36 0.05 0.00 -0.60 0.00 0.00 54.58 54.43 1x27 n ASN 173 Cb 0.36 0.31 0.05 0.00 -0.53 0.00 0.00 39.78 39.98 1x27 n ASN 173 CO 0.00 0.00 0.00 -0.61 1.40 0.00 0.00 177.26 178.05 1x27 h GLN 174 N 0.00 0.00 0.00 1.20 5.75 -2.00 -3.50 115.11 116.56 1x27 h GLN 174 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1x27 h GLN 174 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 1x27 h GLN 174 CO 0.00 0.34 0.00 0.41 -2.65 0.00 0.00 178.83 176.93 1x27 n GLY 175 N 1.20 1.00 3.66 2.39 0.00 -1.06 -4.88 105.19 107.49 1x27 n GLY 175 Ca 0.02 -1.44 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 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 4.15 0.29 1.61 8.01 -1.26 -0.16 118.70 131.34 1x27 s GLU 176 Ca 0.00 2.06 0.05 0.00 0.01 0.00 0.00 54.97 57.09 1x27 s GLU 176 Cb 0.00 -3.96 -0.06 0.00 -4.31 0.00 0.00 34.13 25.80 1x27 s GLU 176 CO 0.00 -0.86 -0.00 0.08 0.01 0.00 0.00 175.26 174.48 1x27 s VAL 177 N 4.06 1.37 -0.08 2.63 1.01 -0.71 -4.94 120.40 123.74 1x27 s VAL 177 Ca 0.70 -2.05 0.00 0.00 0.00 0.00 0.00 61.98 60.63 1x27 s VAL 177 Cb -0.31 -2.58 0.02 0.00 0.00 0.00 0.00 36.38 33.51 1x27 s VAL 177 CO 0.27 -0.18 -0.07 -0.69 0.00 0.00 0.00 175.10 174.43 1x27 s VAL 178 N -3.18 0.87 0.13 2.92 1.01 -1.26 -1.60 120.40 119.29 1x27 s VAL 178 Ca 0.32 -0.25 0.04 0.00 0.00 0.00 0.00 61.98 62.09 1x27 s VAL 178 Cb 0.06 -0.88 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 1x27 s VAL 178 CO 0.13 0.32 0.14 -0.54 0.00 0.00 0.00 175.10 175.15 1x27 s LYS 179 N 1.32 2.98 -0.08 2.72 1.02 0.69 -4.94 119.74 123.46 1x27 s LYS 179 Ca -0.03 -0.77 0.03 0.00 0.02 0.00 0.00 55.97 55.22 1x27 s LYS 179 Cb -0.14 -2.72 0.01 0.00 -0.52 0.00 0.00 37.83 34.46 1x27 s LYS 179 CO -0.03 0.52 -0.16 -1.01 -0.92 0.00 0.00 175.35 173.75 1x27 s HIS 180 N -1.64 1.77 -0.09 3.18 3.76 -1.26 -1.37 115.29 119.65 1x27 s HIS 180 Ca 0.31 -0.68 0.04 0.00 -0.15 0.00 0.00 55.06 54.58 1x27 s HIS 180 Cb -0.11 -1.25 -0.01 0.00 1.11 0.00 0.00 32.58 32.32 1x27 s HIS 180 CO 0.24 -0.32 -0.23 0.71 -0.85 0.00 0.00 174.74 174.29 1x27 s TYR 181 N 0.58 2.56 -0.11 1.40 1.51 0.19 -4.93 117.35 118.54 1x27 s TYR 181 Ca -0.16 -0.86 -0.30 0.00 -1.01 0.00 0.00 57.07 54.75 1x27 s TYR 181 Cb -0.16 -1.69 -0.01 0.00 -0.11 0.00 0.00 41.96 39.98 1x27 s TYR 181 CO 0.05 -0.31 1.08 0.21 -1.11 0.00 0.00 175.55 175.48 1x27 s LYS 182 N 0.14 4.37 -0.69 -0.62 2.36 -1.26 0.12 119.74 124.17 1x27 s LYS 182 Ca -0.12 1.49 -0.18 0.00 -2.55 0.00 0.00 55.97 54.61 1x27 s LYS 182 Cb -0.16 -3.57 0.13 0.00 -1.05 0.00 0.00 37.83 33.17 1x27 s LYS 182 CO 0.07 -0.42 0.78 0.42 1.55 0.00 0.00 175.35 177.75 1x27 s ILE 183 N 2.32 4.94 0.37 5.43 1.01 -0.14 -4.61 121.20 130.52 1x27 s ILE 183 Ca 0.50 -1.35 -0.27 0.00 0.00 0.00 0.00 60.65 59.54 1x27 s ILE 183 Cb -0.20 -4.53 -0.09 0.00 0.01 0.00 0.00 42.46 37.65 1x27 s ILE 183 CO 0.17 -1.17 1.24 -0.13 0.00 0.00 0.00 174.94 175.05 1x27 s ARG 184 N 2.25 4.18 0.19 2.79 0.52 0.15 -3.94 118.95 125.09 1x27 s ARG 184 Ca 0.16 2.03 -0.13 0.00 -0.52 0.00 0.00 55.73 57.27 1x27 s ARG 184 Cb -0.19 -2.87 -0.07 0.00 0.52 0.00 0.00 34.95 32.34 1x27 s ARG 184 CO 0.01 -0.27 0.56 -0.80 0.02 0.00 0.00 175.30 174.82 1x27 s ASN 185 N -0.81 6.75 0.38 0.23 0.01 -1.26 -0.97 114.94 119.26 1x27 s ASN 185 Ca 0.53 1.03 0.07 0.00 -0.71 0.00 0.00 52.86 53.78 1x27 s ASN 185 Cb -0.35 -2.27 -0.00 0.00 0.41 0.00 0.00 41.25 39.03 1x27 s ASN 185 CO 0.46 0.02 0.50 -0.22 -1.51 0.00 0.00 177.10 176.35 1x27 s LEU 186 N -2.33 3.77 0.26 0.60 2.96 0.25 -4.90 118.68 119.28 1x27 s LEU 186 Ca 0.42 -0.35 -0.09 0.00 -0.22 0.00 0.00 54.13 53.90 1x27 s LEU 186 Cb -0.13 -2.63 0.42 0.00 0.50 0.00 0.00 46.19 44.34 1x27 s LEU 186 CO 0.20 -0.59 1.59 -0.78 -1.32 0.00 0.00 176.35 175.45 1x27 h ASP 187 N 0.81 -0.72 -2.24 3.68 1.82 -1.99 -3.11 116.42 114.68 1x27 h ASP 187 Ca -0.43 0.25 -0.59 0.00 -0.39 0.00 0.00 57.03 55.88 1x27 h ASP 187 Cb 1.27 0.51 -0.42 0.00 0.68 0.00 0.00 39.33 41.37 1x27 h ASP 187 CO 0.50 -0.28 -0.66 0.59 -1.61 0.00 0.00 179.24 177.78 1x27 n ASN 188 N -5.53 3.99 0.00 2.28 3.02 -1.26 -4.88 115.26 112.89 1x27 n ASN 188 Ca 0.14 -3.55 0.00 0.00 -0.03 0.00 0.00 54.58 51.13 1x27 n ASN 188 Cb 0.47 -0.60 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 1x27 n ASN 188 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1x27 n GLY 189 N 0.19 0.75 3.93 7.41 0.00 -1.17 -5.03 105.19 111.26 1x27 n GLY 189 Ca 0.30 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.03 1x27 n GLY 189 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1x27 s GLY 190 N -2.00 1.73 0.05 -0.02 0.00 -1.25 -4.69 107.32 101.13 1x27 s GLY 190 Ca 0.00 -1.09 -0.02 0.00 0.00 0.00 0.00 44.72 43.61 1x27 s GLY 190 CO 0.00 -0.43 0.01 -1.36 0.00 0.00 0.00 173.10 171.32 1x27 s PHE 191 N -3.72 0.39 -0.23 1.90 0.08 0.50 0.85 117.98 117.76 1x27 s PHE 191 Ca 0.70 -0.84 -0.29 0.00 0.12 0.00 0.00 56.93 56.61 1x27 s PHE 191 Cb -0.06 -0.29 0.16 0.00 -0.57 0.00 0.00 43.02 42.26 1x27 s PHE 191 CO 0.51 -0.35 1.19 1.52 -0.10 0.00 0.00 175.22 177.98 1x27 s TYR 192 N -3.24 -0.21 -0.13 0.36 -0.85 -0.15 -0.45 117.35 112.68 1x27 s TYR 192 Ca 0.01 0.38 0.10 0.00 -0.52 0.00 0.00 57.07 57.04 1x27 s TYR 192 Cb 0.03 0.47 -0.15 0.00 0.38 0.00 0.00 41.96 42.68 1x27 s TYR 192 CO -0.08 -0.18 0.03 -0.89 -1.52 0.00 0.00 175.55 172.91 1x27 n ILE 193 N 0.78 0.88 -4.54 -3.49 5.41 -1.26 -0.67 119.36 116.47 1x27 n ILE 193 Ca -0.06 -0.53 -0.26 0.00 1.00 0.00 0.00 62.75 62.90 1x27 n ILE 193 Cb 0.58 -0.70 -0.17 0.00 -0.71 0.00 0.00 39.64 38.65 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 -4.67 2.06 0.66 4.38 0.15 -1.26 -4.90 113.70 110.12 1x27 s SER 194 Ca -0.08 -0.35 0.39 0.00 0.70 0.00 0.00 55.95 56.61 1x27 s SER 194 Cb 0.04 -0.93 2.12 0.00 -1.71 0.00 0.00 66.02 65.54 1x27 s SER 194 CO 0.51 0.03 2.20 1.55 1.20 0.00 0.00 173.24 178.72 1x27 h PRO 195 N 7.16 0.00 -0.34 5.44 0.13 -2.00 -0.96 132.00 141.43 1x27 h PRO 195 Ca -0.30 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.87 1x27 h PRO 195 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 1x27 h PRO 195 CO 0.47 0.00 0.23 0.00 -0.23 0.00 0.00 178.00 178.47 1x27 h ARG 196 N 0.00 0.32 -4.13 0.86 3.08 -2.01 -3.40 114.38 109.09 1x27 h ARG 196 Ca 0.00 -0.02 -0.41 0.00 0.07 0.00 0.00 59.98 59.62 1x27 h ARG 196 Cb 0.23 -0.07 -0.33 0.00 0.08 0.00 0.00 29.97 29.88 1x27 h ARG 196 CO 0.00 0.21 -0.77 0.42 -1.07 0.00 0.00 179.97 178.76 1x27 s ILE 197 N -5.32 0.58 0.22 2.04 1.09 -0.36 -5.14 121.20 114.31 1x27 s ILE 197 Ca -0.07 -0.17 0.11 0.00 -1.10 0.00 0.00 60.65 59.41 1x27 s ILE 197 Cb 0.18 -0.58 -0.05 0.00 -1.06 0.00 0.00 42.46 40.95 1x27 s ILE 197 CO 0.72 0.22 -0.20 0.42 -0.10 0.00 0.00 174.94 176.00 1x27 s THR 198 N 0.74 2.23 0.11 2.92 -4.23 -1.26 -4.38 115.64 111.76 1x27 s THR 198 Ca -0.10 -2.18 0.02 0.00 -1.18 0.00 0.00 61.69 58.25 1x27 s THR 198 Cb -0.13 -2.13 -0.04 0.00 1.34 0.00 0.00 72.50 71.54 1x27 s THR 198 CO 0.00 -0.33 -0.07 -0.36 -0.54 0.00 0.00 174.62 173.33 1x27 s PHE 199 N -2.23 0.99 -0.07 3.99 0.08 0.40 -4.98 117.98 116.16 1x27 s PHE 199 Ca 0.24 -0.88 0.13 0.00 0.12 0.00 0.00 56.93 56.54 1x27 s PHE 199 Cb -0.05 -0.55 -0.08 0.00 -0.57 0.00 0.00 43.02 41.76 1x27 s PHE 199 CO 0.11 -0.10 1.18 -1.00 -0.10 0.00 0.00 175.22 175.32 1x27 h PRO 200 N 2.91 0.00 -3.46 0.24 0.13 -1.90 0.14 132.00 130.07 1x27 h PRO 200 Ca -0.36 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.72 1x27 h PRO 200 Cb 1.17 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.18 1x27 h PRO 200 CO 0.64 0.57 -0.10 0.20 -0.23 0.00 0.00 178.00 179.09 1x27 s GLY 201 N -4.66 -0.11 0.46 1.56 0.00 -1.26 -4.47 107.32 98.83 1x27 s GLY 201 Ca 0.01 -0.24 0.15 0.00 0.00 0.00 0.00 44.72 44.64 1x27 s GLY 201 CO 0.79 -0.40 2.01 1.41 0.00 0.00 0.00 173.10 176.91 1x27 h LEU 202 N 2.37 0.28 0.48 0.66 3.38 -1.94 -1.72 115.31 118.82 1x27 h LEU 202 Ca -0.32 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 1x27 h LEU 202 Cb 1.25 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 1x27 h LEU 202 CO 0.45 0.18 -0.37 0.45 0.09 0.00 0.00 178.44 179.24 1x27 h HIS 203 N 0.32 -1.00 -0.89 1.13 3.86 -1.96 -1.36 115.15 115.25 1x27 h HIS 203 Ca 0.23 -0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.49 1x27 h HIS 203 Cb 0.49 0.37 -0.06 0.00 1.06 0.00 0.00 27.41 29.27 1x27 h HIS 203 CO -0.00 -0.54 0.58 0.93 0.86 0.00 0.00 177.93 179.76 1x27 h GLU 204 N -0.84 0.99 0.08 2.45 3.07 -1.79 -1.47 114.58 117.07 1x27 h GLU 204 Ca -0.05 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.75 1x27 h GLU 204 Cb 0.72 -0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 28.40 1x27 h GLU 204 CO 0.00 0.66 -0.07 1.25 -1.40 0.00 0.00 179.01 179.45 1x27 h LEU 205 N 1.02 -0.18 -0.34 1.33 6.46 -0.90 -1.10 115.31 121.60 1x27 h LEU 205 Ca 0.37 0.02 0.01 0.00 -0.12 0.00 0.00 57.88 58.17 1x27 h LEU 205 Cb 0.16 0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 40.13 1x27 h LEU 205 CO -0.13 -0.11 0.20 0.58 -0.62 0.00 0.00 178.44 178.35 1x27 h VAL 206 N -0.16 1.03 -0.76 1.05 2.07 -0.82 -2.10 116.25 116.56 1x27 h VAL 206 Ca 0.00 -0.14 0.12 0.00 0.82 0.00 0.00 66.70 67.51 1x27 h VAL 206 Cb 0.15 0.60 -0.08 0.00 -1.52 0.00 0.00 31.29 30.44 1x27 h VAL 206 CO -0.01 0.07 0.36 -0.09 0.02 0.00 0.00 177.57 177.92 1x27 h ARG 207 N 0.40 0.55 0.70 1.57 2.43 -1.02 -0.49 114.38 118.52 1x27 h ARG 207 Ca 0.13 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 1x27 h ARG 207 Cb 0.00 -0.12 0.01 0.00 -0.42 0.00 0.00 29.97 29.44 1x27 h ARG 207 CO -0.06 0.36 -0.34 1.25 -1.51 0.00 0.00 179.97 179.67 1x27 h HIS 208 N 0.57 -0.87 0.00 2.20 2.76 -0.56 -2.95 115.15 116.30 1x27 h HIS 208 Ca 0.40 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.55 1x27 h HIS 208 Cb 0.52 0.29 0.00 0.00 1.55 0.00 0.00 27.41 29.77 1x27 h HIS 208 CO -0.12 -0.53 0.00 0.66 -1.30 0.00 0.00 177.93 176.64 1x27 n TYR 209 N -5.48 0.00 -0.04 5.26 4.01 -0.86 -2.02 117.16 118.03 1x27 n TYR 209 Ca -0.14 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.49 1x27 n TYR 209 Cb 0.38 -0.14 -0.14 0.00 -0.31 0.00 0.00 39.34 39.13 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 -1.14 1.60 0.67 -0.72 -2.24 -0.25 -1.69 114.28 110.51 1x27 n THR 210 Ca 0.11 -0.77 0.09 0.00 -2.27 0.00 0.00 64.05 61.21 1x27 n THR 210 Cb 0.10 -1.08 0.25 0.00 -2.10 0.00 0.00 70.33 67.49 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 -3.08 2.39 0.00 3.42 4.13 -0.94 -4.57 115.26 116.60 1x27 n ASN 211 Ca -0.24 -1.93 0.00 0.00 1.68 0.00 0.00 54.58 54.09 1x27 n ASN 211 Cb 1.07 -0.25 0.00 0.00 -1.54 0.00 0.00 39.78 39.05 1x27 n ASN 211 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1x27 n ALA 212 N 0.80 0.00 -1.64 5.41 0.00 -0.86 -5.03 120.51 119.19 1x27 n ALA 212 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.27 1x27 n ALA 212 Cb 0.40 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.81 1x27 n ALA 212 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1x27 n SER 213 N 0.00 7.45 -4.47 0.00 3.41 -1.26 -3.94 113.62 114.81 1x27 n SER 213 Ca 0.00 -2.99 -0.33 0.00 -0.26 0.00 0.00 58.87 55.29 1x27 n SER 213 Cb 0.00 -1.37 -0.05 0.00 -0.26 0.00 0.00 64.21 62.54 1x27 n SER 213 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1x27 n ASP 214 N 1.88 3.37 0.00 4.04 2.03 -1.26 -3.32 116.55 123.30 1x27 n ASP 214 Ca 0.59 -2.74 0.00 0.00 0.52 0.00 0.00 54.79 53.17 1x27 n ASP 214 Cb 0.40 -1.68 0.00 0.00 -0.72 0.00 0.00 41.12 39.12 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 5.55 3.38 3.73 0.27 0.00 -1.26 -5.06 105.19 111.80 1x27 n GLY 215 Ca 0.46 -1.08 -0.41 0.00 0.00 0.00 0.00 46.02 44.99 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 4.43 0.00 0.99 1.43 -1.21 -4.88 118.68 119.44 1x27 s LEU 216 Ca 0.00 1.54 0.00 0.00 -1.03 0.00 0.00 54.13 54.64 1x27 s LEU 216 Cb 0.00 -3.36 0.00 0.00 0.03 0.00 0.00 46.19 42.86 1x27 s LEU 216 CO 0.00 -0.08 0.40 0.00 0.23 0.00 0.00 176.35 176.90 1x27 s THR 218 N -0.73 -0.01 0.06 0.00 2.01 -1.26 -5.02 115.64 110.70 1x27 s THR 218 Ca 0.00 0.02 -0.15 0.00 0.31 0.00 0.00 61.69 61.87 1x27 s THR 218 Cb 0.00 -0.82 -0.06 0.00 0.01 0.00 0.00 72.50 71.63 1x27 s THR 218 CO 0.00 0.01 0.48 -0.60 -0.69 0.00 0.00 174.62 173.82 1x27 s ARG 219 N 0.90 3.98 -0.84 4.92 3.52 -1.26 -4.78 118.95 125.39 1x27 s ARG 219 Ca -0.05 0.48 -0.25 0.00 -0.13 0.00 0.00 55.73 55.79 1x27 s ARG 219 Cb -0.05 -3.13 0.01 0.00 -1.56 0.00 0.00 34.95 30.22 1x27 s ARG 219 CO -0.08 0.61 1.58 -0.51 -0.81 0.00 0.00 175.30 176.09 1x27 s LEU 220 N -1.40 3.29 -0.06 -0.88 1.43 -0.68 -4.37 118.68 116.02 1x27 s LEU 220 Ca 0.29 -0.66 -0.00 0.00 -1.03 0.00 0.00 54.13 52.73 1x27 s LEU 220 Cb -0.17 -2.56 -0.00 0.00 0.03 0.00 0.00 46.19 43.49 1x27 s LEU 220 CO 0.17 -2.02 0.01 0.28 0.23 0.00 0.00 176.35 175.02 1x27 h SER 221 N 11.15 -0.01 -4.29 2.29 0.02 -1.17 -3.38 113.55 118.16 1x27 h SER 221 Ca -0.05 0.00 -0.38 0.00 -0.84 0.00 0.00 61.79 60.52 1x27 h SER 221 Cb 1.05 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 63.34 1x27 h SER 221 CO 1.30 0.27 -0.77 -0.13 -1.14 0.00 0.00 176.83 176.36 1x27 s ARG 222 N -1.35 0.74 0.55 3.45 0.52 -1.13 -4.99 118.95 116.73 1x27 s ARG 222 Ca -0.00 -0.58 -0.18 0.00 -0.52 0.00 0.00 55.73 54.45 1x27 s ARG 222 Cb 0.00 -0.68 -0.06 0.00 0.52 0.00 0.00 34.95 34.73 1x27 s ARG 222 CO 0.00 0.17 1.08 -1.25 0.02 0.00 0.00 175.30 175.32 1x27 s PRO 223 N -0.87 3.45 0.07 3.54 0.04 -1.26 -1.66 135.00 138.29 1x27 s PRO 223 Ca -0.00 1.39 -0.37 0.00 0.04 0.00 0.00 61.00 62.06 1x27 s PRO 223 Cb -0.06 -2.04 -0.16 0.00 0.04 0.00 0.00 34.50 32.27 1x27 s PRO 223 CO 0.00 -0.73 1.38 0.00 0.04 0.00 0.00 177.00 177.69 1x27 s GLN 225 N 0.72 2.92 0.00 0.00 -1.52 -1.26 -4.94 119.66 115.57 1x27 s GLN 225 Ca 0.85 -1.01 0.10 0.00 -1.95 0.00 0.00 55.36 53.35 1x27 s GLN 225 Cb -0.94 -3.68 0.61 0.00 -0.22 0.00 0.00 33.01 28.77 1x27 s GLN 225 CO 0.47 -0.64 1.05 0.25 -0.25 0.00 0.00 175.29 176.18