#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 3.66 0.06 3.41 1.02 -1.26 -2.02 118.68 123.55 1x27 s LEU 65 Ca 0.00 -0.02 -0.05 0.00 0.02 0.00 0.00 54.13 54.07 1x27 s LEU 65 Cb 0.00 -2.25 -0.02 0.00 0.02 0.00 0.00 46.19 43.94 1x27 s LEU 65 CO 0.00 0.22 0.09 0.68 0.02 0.00 0.00 176.35 177.36 1x27 s VAL 66 N -1.26 0.16 0.12 -1.59 -7.23 -0.66 0.02 120.40 109.97 1x27 s VAL 66 Ca 0.25 -1.35 0.10 0.00 -1.81 0.00 0.00 61.98 59.17 1x27 s VAL 66 Cb -0.12 -1.26 -0.04 0.00 0.56 0.00 0.00 36.38 35.53 1x27 s VAL 66 CO 0.17 -0.74 -0.25 -0.63 -0.31 0.00 0.00 175.10 173.33 1x27 s ILE 67 N -3.49 2.40 -0.07 -0.62 1.01 -0.33 -0.40 121.20 119.70 1x27 s ILE 67 Ca 0.02 -1.65 -0.27 0.00 0.00 0.00 0.00 60.65 58.76 1x27 s ILE 67 Cb 0.04 -2.06 -0.03 0.00 0.01 0.00 0.00 42.46 40.42 1x27 s ILE 67 CO -0.09 0.12 0.85 0.00 0.00 0.00 0.00 174.94 175.82 1x27 s ALA 68 N -1.05 3.32 -0.13 9.38 0.00 0.73 -1.93 121.76 132.07 1x27 s ALA 68 Ca 0.15 0.27 0.16 0.00 0.00 0.00 0.00 51.96 52.54 1x27 s ALA 68 Cb -0.10 -3.18 -0.07 0.00 0.00 0.00 0.00 23.12 19.77 1x27 s ALA 68 CO 0.07 -0.30 1.02 -0.07 0.00 0.00 0.00 175.76 176.48 1x27 h LEU 69 N 7.19 0.00 0.00 0.00 3.38 -0.58 0.17 115.31 125.47 1x27 h LEU 69 Ca -0.38 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.13 1x27 h LEU 69 Cb 1.19 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.81 1x27 h LEU 69 CO 0.78 0.54 -0.44 1.41 0.09 0.00 0.00 178.44 180.81 1x27 n HIS 70 N -2.99 -0.88 -3.94 1.13 8.25 -1.23 -4.80 115.22 110.76 1x27 n HIS 70 Ca -0.06 -2.81 -0.34 0.00 -0.26 0.00 0.00 57.72 54.25 1x27 n HIS 70 Cb 0.80 0.33 -0.05 0.00 1.12 0.00 0.00 29.99 32.18 1x27 n HIS 70 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1x27 s SER 71 N -3.36 6.25 -0.09 0.41 0.01 -1.26 -3.16 113.70 112.49 1x27 s SER 71 Ca 0.40 0.33 0.02 0.00 1.31 0.00 0.00 55.95 58.00 1x27 s SER 71 Cb 0.02 -1.94 0.01 0.00 0.21 0.00 0.00 66.02 64.32 1x27 s SER 71 CO 0.28 0.28 -0.16 -0.47 0.41 0.00 0.00 173.24 173.59 1x27 s TYR 72 N -1.26 1.91 -0.16 2.43 5.04 -0.51 -4.91 117.35 119.89 1x27 s TYR 72 Ca 0.25 -0.83 -0.07 0.00 -2.44 0.00 0.00 57.07 53.98 1x27 s TYR 72 Cb -0.12 -1.37 -0.04 0.00 0.35 0.00 0.00 41.96 40.78 1x27 s TYR 72 CO 0.16 -0.41 0.08 -1.21 -1.34 0.00 0.00 175.55 172.82 1x27 s GLU 73 N 0.81 3.73 0.34 4.97 2.02 -1.26 -1.71 118.70 127.61 1x27 s GLU 73 Ca -0.11 -0.30 -0.29 0.00 0.02 0.00 0.00 54.97 54.30 1x27 s GLU 73 Cb -0.16 -3.16 -0.11 0.00 0.10 0.00 0.00 34.13 30.80 1x27 s GLU 73 CO 0.01 0.45 1.54 -2.14 0.02 0.00 0.00 175.26 175.15 1x27 s PRO 74 N -0.12 4.10 0.00 0.39 0.02 -1.26 -4.90 135.00 133.23 1x27 s PRO 74 Ca 0.08 2.60 0.00 0.00 0.02 0.00 0.00 61.00 63.69 1x27 s PRO 74 Cb -0.12 -2.98 0.00 0.00 0.02 0.00 0.00 34.50 31.42 1x27 s PRO 74 CO 0.01 -0.59 0.00 0.43 -0.33 0.00 0.00 177.00 176.51 1x27 n SER 75 N 1.17 0.19 -4.51 2.53 7.64 -1.26 -5.08 113.62 114.30 1x27 n SER 75 Ca 0.04 -0.03 -0.24 0.00 1.01 0.00 0.00 58.87 59.65 1x27 n SER 75 Cb 0.38 0.10 -0.10 0.00 -1.01 0.00 0.00 64.21 63.59 1x27 n SER 75 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1x27 s HIS 76 N -0.14 2.37 0.75 1.43 3.76 -1.26 -5.11 115.29 117.10 1x27 s HIS 76 Ca 0.00 -0.34 -0.11 0.00 -0.15 0.00 0.00 55.06 54.46 1x27 s HIS 76 Cb 0.00 -1.09 0.04 0.00 1.11 0.00 0.00 32.58 32.64 1x27 s HIS 76 CO 0.00 0.68 1.08 -0.51 -0.85 0.00 0.00 174.74 175.14 1x27 s ASP 77 N -3.55 4.77 -0.85 1.40 1.01 -1.26 -2.87 116.67 115.32 1x27 s ASP 77 Ca 0.31 1.65 0.00 0.00 0.71 0.00 0.00 52.55 55.21 1x27 s ASP 77 Cb -0.04 -2.42 0.00 0.00 1.01 0.00 0.00 42.92 41.47 1x27 s ASP 77 CO 0.16 -1.84 0.00 0.61 0.21 0.00 0.00 175.17 174.31 1x27 n GLY 78 N -1.63 0.76 3.77 0.21 0.00 -1.26 -4.89 105.19 102.15 1x27 n GLY 78 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.18 7.07 -0.26 1.61 1.11 -1.14 0.56 116.67 123.44 1x27 s ASP 79 Ca 0.00 1.27 -0.10 0.00 0.18 0.00 0.00 52.55 53.90 1x27 s ASP 79 Cb 0.00 -2.40 -0.04 0.00 1.07 0.00 0.00 42.92 41.55 1x27 s ASP 79 CO 0.00 0.12 0.15 -0.22 1.18 0.00 0.00 175.17 176.39 1x27 s LEU 80 N -0.37 3.84 0.37 1.23 2.96 -0.75 -4.64 118.68 121.32 1x27 s LEU 80 Ca 0.33 -0.06 -0.09 0.00 -0.22 0.00 0.00 54.13 54.09 1x27 s LEU 80 Cb -0.19 -2.05 -0.06 0.00 0.50 0.00 0.00 46.19 44.39 1x27 s LEU 80 CO 0.19 -0.03 0.71 -0.83 -1.32 0.00 0.00 176.35 175.08 1x27 s GLY 81 N 1.59 1.93 0.30 7.98 0.00 -1.26 -4.67 107.32 113.19 1x27 s GLY 81 Ca 0.07 -0.29 -0.17 0.00 0.00 0.00 0.00 44.72 44.32 1x27 s GLY 81 CO 0.08 -0.13 0.66 -0.11 0.00 0.00 0.00 173.10 173.60 1x27 s PHE 82 N -2.28 0.08 0.14 1.90 -0.12 -0.69 -4.98 117.98 112.03 1x27 s PHE 82 Ca 0.49 -0.55 0.09 0.00 -0.05 0.00 0.00 56.93 56.91 1x27 s PHE 82 Cb -0.10 0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 42.81 1x27 s PHE 82 CO 0.31 -1.24 -0.14 -2.00 -0.05 0.00 0.00 175.22 172.09 1x27 s GLU 83 N -3.56 1.91 0.17 1.99 2.56 -1.26 -1.42 118.70 119.09 1x27 s GLU 83 Ca 0.16 -1.22 -0.33 0.00 0.00 0.00 0.00 54.97 53.58 1x27 s GLU 83 Cb -0.04 -2.13 -0.15 0.00 2.00 0.00 0.00 34.13 33.80 1x27 s GLU 83 CO 0.09 0.46 1.21 1.17 -0.56 0.00 0.00 175.26 177.64 1x27 n LYS 84 N 0.46 1.28 -0.16 4.30 4.81 -1.19 -0.69 118.16 126.97 1x27 n LYS 84 Ca -0.13 0.46 0.00 0.00 -0.87 0.00 0.00 58.31 57.76 1x27 n LYS 84 Cb 0.54 -1.99 0.00 0.00 0.02 0.00 0.00 35.03 33.60 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 2.10 1.72 3.76 3.14 0.00 0.60 -4.95 105.19 111.56 1x27 n GLY 85 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.33 4.66 0.09 1.61 2.12 0.14 -4.55 118.70 122.43 1x27 s GLU 86 Ca 0.00 1.73 -0.15 0.00 0.36 0.00 0.00 54.97 56.91 1x27 s GLU 86 Cb 0.00 -3.17 -0.06 0.00 0.26 0.00 0.00 34.13 31.15 1x27 s GLU 86 CO 0.00 0.26 0.50 -0.65 -0.54 0.00 0.00 175.26 174.82 1x27 s GLN 87 N -1.45 3.98 0.12 4.30 -0.21 -1.26 -0.19 119.66 124.94 1x27 s GLN 87 Ca 0.44 0.47 0.03 0.00 0.02 0.00 0.00 55.36 56.33 1x27 s GLN 87 Cb -0.30 -3.07 -0.04 0.00 1.00 0.00 0.00 33.01 30.59 1x27 s GLN 87 CO 0.39 0.57 -0.09 -0.51 -2.12 0.00 0.00 175.29 173.53 1x27 s LEU 88 N -1.58 2.50 -0.20 2.90 1.43 0.46 -2.92 118.68 121.28 1x27 s LEU 88 Ca 0.32 -0.98 -0.03 0.00 -1.03 0.00 0.00 54.13 52.41 1x27 s LEU 88 Cb -0.16 -0.23 -0.01 0.00 0.03 0.00 0.00 46.19 45.81 1x27 s LEU 88 CO 0.18 -0.37 -0.05 -0.60 0.23 0.00 0.00 176.35 175.73 1x27 s ARG 89 N -3.63 3.43 -0.23 1.70 3.52 0.20 -1.66 118.95 122.28 1x27 s ARG 89 Ca 0.13 -0.62 -0.26 0.00 -0.13 0.00 0.00 55.73 54.85 1x27 s ARG 89 Cb 0.03 -2.94 -0.00 0.00 -1.56 0.00 0.00 34.95 30.48 1x27 s ARG 89 CO -0.02 -0.06 0.90 0.42 -0.81 0.00 0.00 175.30 175.73 1x27 s ILE 90 N 1.13 4.79 -0.23 4.11 -1.09 -0.86 0.51 121.20 129.56 1x27 s ILE 90 Ca 0.02 1.72 -0.17 0.00 -2.23 0.00 0.00 60.65 59.99 1x27 s ILE 90 Cb -0.15 -4.18 -0.13 0.00 -1.58 0.00 0.00 42.46 36.42 1x27 s ILE 90 CO -0.01 -0.09 -0.13 0.18 -1.23 0.00 0.00 174.94 173.66 1x27 n LEU 91 N 5.98 1.91 -4.43 2.97 4.77 0.74 -4.68 117.00 124.25 1x27 n LEU 91 Ca 0.07 0.40 -0.21 0.00 -0.03 0.00 0.00 56.01 56.24 1x27 n LEU 91 Cb 0.47 -0.87 -0.10 0.00 -2.33 0.00 0.00 43.42 40.59 1x27 n LEU 91 CO 0.49 0.28 -0.40 -1.61 -1.33 0.00 0.00 177.39 174.82 1x27 s GLU 92 N -2.47 1.55 -0.47 3.23 2.02 -0.99 -4.99 118.70 116.58 1x27 s GLU 92 Ca -0.32 -1.76 0.03 0.00 0.02 0.00 0.00 54.97 52.94 1x27 s GLU 92 Cb 0.09 -1.27 0.16 0.00 0.10 0.00 0.00 34.13 33.21 1x27 s GLU 92 CO 0.49 0.11 0.33 -0.65 0.02 0.00 0.00 175.26 175.57 1x27 s GLN 93 N -3.67 1.28 -1.27 1.61 -0.21 -1.26 -2.73 119.66 113.41 1x27 s GLN 93 Ca 0.28 -2.25 -0.07 0.00 0.02 0.00 0.00 55.36 53.34 1x27 s GLN 93 Cb 0.02 -2.04 0.17 0.00 1.00 0.00 0.00 33.01 32.16 1x27 s GLN 93 CO 0.12 -1.29 1.99 0.45 -2.12 0.00 0.00 175.29 174.43 1x27 n SER 94 N 2.98 6.17 0.00 5.90 2.88 -0.52 -4.95 113.62 126.08 1x27 n SER 94 Ca 0.20 -3.17 0.00 0.00 -1.33 0.00 0.00 58.87 54.57 1x27 n SER 94 Cb 0.41 -1.41 0.00 0.00 -0.75 0.00 0.00 64.21 62.45 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 2.23 0.72 0.20 0.46 0.00 -1.26 -1.85 105.19 105.70 1x27 n GLY 95 Ca 0.45 0.61 -0.13 0.00 0.00 0.00 0.00 46.02 46.96 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 0.59 -5.67 1.61 4.81 -1.96 -3.44 114.58 110.52 1x27 h GLU 96 Ca 0.00 -0.46 -0.66 0.00 -0.13 0.00 0.00 59.36 58.11 1x27 h GLU 96 Cb 0.00 0.09 -0.19 0.00 0.63 0.00 0.00 28.75 29.28 1x27 h GLU 96 CO 0.00 1.08 -0.66 -1.58 -0.73 0.00 0.00 179.01 177.12 1x27 s TRP 97 N -3.76 3.05 -0.08 0.92 0.52 -0.77 -2.18 118.94 116.64 1x27 s TRP 97 Ca -0.08 -0.08 0.05 0.00 0.02 0.00 0.00 56.10 56.00 1x27 s TRP 97 Cb 0.10 -1.86 -0.00 0.00 -1.15 0.00 0.00 33.47 30.55 1x27 s TRP 97 CO 0.87 0.19 -0.23 -1.58 0.02 0.00 0.00 176.95 176.21 1x27 s TRP 98 N -0.23 2.40 -0.23 -1.98 0.51 0.22 -1.44 118.94 118.19 1x27 s TRP 98 Ca 0.04 -0.88 -0.29 0.00 -2.12 0.00 0.00 56.10 52.85 1x27 s TRP 98 Cb -0.13 -1.60 -0.01 0.00 -0.81 0.00 0.00 33.47 30.92 1x27 s TRP 98 CO 0.02 -0.33 1.33 0.21 -0.51 0.00 0.00 176.95 177.67 1x27 s LYS 99 N 0.18 4.03 0.33 4.98 2.47 -1.10 -0.35 119.74 130.28 1x27 s LYS 99 Ca -0.13 1.47 0.07 0.00 -1.56 0.00 0.00 55.97 55.82 1x27 s LYS 99 Cb -0.16 -3.85 -0.06 0.00 -1.46 0.00 0.00 37.83 32.29 1x27 s LYS 99 CO 0.07 -0.97 -0.03 0.00 0.16 0.00 0.00 175.35 174.57 1x27 s ALA 100 N 4.11 2.67 -0.07 3.13 0.00 0.76 -0.18 121.76 132.18 1x27 s ALA 100 Ca 0.58 -2.06 0.01 0.00 0.00 0.00 0.00 51.96 50.48 1x27 s ALA 100 Cb -0.20 0.20 0.02 0.00 0.00 0.00 0.00 23.12 23.15 1x27 s ALA 100 CO 0.21 -0.08 -0.07 -1.14 0.00 0.00 0.00 175.76 174.67 1x27 s GLN 101 N -3.72 1.26 0.43 0.00 0.74 0.18 -1.86 119.66 116.69 1x27 s GLN 101 Ca 0.33 -0.21 -0.25 0.00 0.05 0.00 0.00 55.36 55.28 1x27 s GLN 101 Cb 0.05 -1.24 -0.08 0.00 1.10 0.00 0.00 33.01 32.84 1x27 s GLN 101 CO 0.15 -0.13 1.21 0.45 -0.55 0.00 0.00 175.29 176.41 1x27 s SER 102 N 1.21 6.31 -0.00 6.67 0.15 -0.13 0.62 113.70 128.53 1x27 s SER 102 Ca -0.05 2.42 0.22 0.00 0.70 0.00 0.00 55.95 59.24 1x27 s SER 102 Cb -0.14 -2.62 -0.28 0.00 -1.71 0.00 0.00 66.02 61.27 1x27 s SER 102 CO -0.02 -0.83 0.55 0.18 1.20 0.00 0.00 173.24 174.32 1x27 n LEU 103 N -0.12 0.14 -0.06 3.45 4.77 -1.15 -2.22 117.00 121.80 1x27 n LEU 103 Ca 0.05 0.05 -0.06 0.00 -0.03 0.00 0.00 56.01 56.02 1x27 n LEU 103 Cb 0.46 0.02 -0.05 0.00 -2.33 0.00 0.00 43.42 41.52 1x27 n LEU 103 CO 0.51 0.00 0.05 0.74 -1.33 0.00 0.00 177.39 177.36 1x27 h THR 104 N 0.00 0.62 0.07 -5.08 2.02 -1.92 -3.42 112.91 105.21 1x27 h THR 104 Ca -0.03 -1.50 -0.34 0.00 0.77 0.00 0.00 66.41 65.31 1x27 h THR 104 Cb 1.07 1.21 -0.03 0.00 -1.74 0.00 0.00 68.15 68.67 1x27 h THR 104 CO 0.00 0.21 -1.89 0.35 0.37 0.00 0.00 175.52 174.57 1x27 n THR 105 N -4.69 1.68 0.00 3.16 -2.24 -1.26 -4.99 114.28 105.94 1x27 n THR 105 Ca -0.06 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 1x27 n THR 105 Cb 0.22 -1.79 0.00 0.00 -2.10 0.00 0.00 70.33 66.66 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 1.83 0.50 3.80 3.38 0.00 -0.94 -5.01 105.19 108.76 1x27 n GLY 106 Ca -0.35 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.98 2.87 0.01 1.61 -1.52 -1.26 -4.64 119.66 115.75 1x27 s GLN 107 Ca 0.00 1.08 0.03 0.00 -1.95 0.00 0.00 55.36 54.52 1x27 s GLN 107 Cb 0.00 -1.98 -0.01 0.00 -0.22 0.00 0.00 33.01 30.80 1x27 s GLN 107 CO 0.00 -1.16 -0.10 -1.21 -0.25 0.00 0.00 175.29 172.57 1x27 s GLU 108 N -4.74 0.72 0.00 2.91 2.02 -1.26 -0.96 118.70 117.39 1x27 s GLU 108 Ca 0.60 -0.47 0.00 0.00 0.02 0.00 0.00 54.97 55.13 1x27 s GLU 108 Cb -0.16 -0.68 0.00 0.00 0.10 0.00 0.00 34.13 33.39 1x27 s GLU 108 CO 0.50 0.18 0.00 0.41 0.02 0.00 0.00 175.26 176.37 1x27 n GLY 109 N 2.47 -1.22 3.73 -1.39 0.00 -0.78 -4.72 105.19 103.28 1x27 n GLY 109 Ca -0.16 -0.86 -0.38 0.00 0.00 0.00 0.00 46.02 44.63 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 -2.77 3.52 0.23 1.61 0.08 0.19 -0.17 117.98 120.67 1x27 s PHE 110 Ca 0.00 0.84 0.11 0.00 0.12 0.00 0.00 56.93 58.00 1x27 s PHE 110 Cb 0.00 -2.49 -0.05 0.00 -0.57 0.00 0.00 43.02 39.91 1x27 s PHE 110 CO 0.00 0.21 -0.21 0.96 -0.10 0.00 0.00 175.22 176.08 1x27 s ILE 111 N 0.48 2.30 -0.33 0.64 -4.36 0.53 -1.81 121.20 118.65 1x27 s ILE 111 Ca 0.24 -2.20 -0.26 0.00 -0.26 0.00 0.00 60.65 58.17 1x27 s ILE 111 Cb -0.15 -2.16 0.01 0.00 1.25 0.00 0.00 42.46 41.41 1x27 s ILE 111 CO 0.09 -0.30 0.94 -2.16 0.24 0.00 0.00 174.94 173.75 1x27 s PRO 112 N -3.12 3.96 0.55 0.37 0.04 -1.26 -0.61 135.00 134.93 1x27 s PRO 112 Ca 0.24 0.76 0.33 0.00 0.04 0.00 0.00 61.00 62.38 1x27 s PRO 112 Cb -0.06 -3.75 1.50 0.00 0.04 0.00 0.00 34.50 32.23 1x27 s PRO 112 CO 0.11 -0.84 1.84 0.27 0.04 0.00 0.00 177.00 178.42 1x27 h PHE 113 N 8.21 0.00 -0.06 0.56 -0.00 -1.77 -1.12 116.94 122.77 1x27 h PHE 113 Ca -0.23 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.74 1x27 h PHE 113 Cb 1.08 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.03 1x27 h PHE 113 CO 0.81 0.00 0.00 0.27 -0.00 0.00 0.00 178.31 179.39 1x27 n ASN 114 N -4.14 0.79 -0.38 -0.68 6.94 -1.26 -3.06 115.26 113.47 1x27 n ASN 114 Ca 0.20 -1.46 0.13 0.00 -0.02 0.00 0.00 54.58 53.43 1x27 n ASN 114 Cb 1.07 -0.03 0.29 0.00 -2.36 0.00 0.00 39.78 38.75 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 -0.30 0.00 -4.33 -2.53 3.01 -0.42 -4.93 117.46 107.95 1x27 n PHE 115 Ca 0.17 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.46 1x27 n PHE 115 Cb 0.20 -0.07 -0.10 0.00 -0.01 0.00 0.00 39.48 39.50 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 -2.40 0.75 -0.00 -4.37 -7.23 -1.17 0.22 120.40 106.20 1x27 s VAL 116 Ca 0.25 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.33 1x27 s VAL 116 Cb 0.19 -2.57 0.01 0.00 0.56 0.00 0.00 36.38 34.57 1x27 s VAL 116 CO 0.49 -0.10 0.17 0.00 -0.31 0.00 0.00 175.10 175.36 1x27 s ALA 117 N -3.62 -0.42 -0.03 1.32 0.00 -0.81 -4.90 121.76 113.31 1x27 s ALA 117 Ca 0.35 -0.04 -0.36 0.00 0.00 0.00 0.00 51.96 51.91 1x27 s ALA 117 Cb 0.07 0.10 -0.14 0.00 0.00 0.00 0.00 23.12 23.15 1x27 s ALA 117 CO 0.12 -0.22 1.67 1.63 0.00 0.00 0.00 175.76 178.97 1x27 n LYS 118 N 1.43 1.77 0.00 0.00 4.01 -1.26 -1.19 118.16 122.91 1x27 n LYS 118 Ca -0.22 0.64 0.11 0.00 -0.51 0.00 0.00 58.31 58.33 1x27 n LYS 118 Cb 0.56 -2.40 0.09 0.00 -0.51 0.00 0.00 35.03 32.77 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 4.78 2.53 -1.00 7.82 0.00 0.10 -4.79 120.51 129.95 1x27 n ALA 119 Ca 0.21 -0.68 -0.30 0.00 0.00 0.00 0.00 53.44 52.67 1x27 n ALA 119 Cb 0.24 -0.76 0.14 0.00 0.00 0.00 0.00 19.45 19.07 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 -1.91 3.36 0.54 0.00 0.01 -1.23 -4.90 114.94 110.81 1x27 s ASN 120 Ca 0.26 1.80 -0.17 0.00 -0.71 0.00 0.00 52.86 54.04 1x27 s ASN 120 Cb 0.19 -2.41 -0.06 0.00 0.41 0.00 0.00 41.25 39.37 1x27 s ASN 120 CO 0.30 -2.76 1.02 -0.94 -1.51 0.00 0.00 177.10 173.21 1x27 s SER 121 N -3.10 6.23 0.13 -1.22 1.04 -1.26 -4.98 113.70 110.53 1x27 s SER 121 Ca 0.64 1.75 -0.01 0.00 0.48 0.00 0.00 55.95 58.81 1x27 s SER 121 Cb -0.20 -2.53 -0.13 0.00 0.10 0.00 0.00 66.02 63.26 1x27 s SER 121 CO 0.58 -0.86 1.28 -0.07 0.98 0.00 0.00 173.24 175.15 1x27 h LEU 122 N 0.89 0.36 -0.97 2.42 3.38 -1.99 -3.38 115.31 116.02 1x27 h LEU 122 Ca -0.47 -0.32 0.10 0.00 0.09 0.00 0.00 57.88 57.27 1x27 h LEU 122 Cb 1.21 -0.11 -0.12 0.00 0.09 0.00 0.00 40.66 41.72 1x27 h LEU 122 CO 0.59 1.17 -0.54 -0.62 0.09 0.00 0.00 178.44 179.13 1x27 n GLU 123 N -3.62 -0.40 -0.24 1.13 -0.58 -1.26 -1.30 120.64 114.37 1x27 n GLU 123 Ca -0.06 1.47 0.08 0.00 -0.42 0.00 0.00 57.16 58.23 1x27 n GLU 123 Cb 0.89 -2.16 0.33 0.00 -0.57 0.00 0.00 31.44 29.93 1x27 n GLU 123 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 1x27 h PRO 124 N 0.00 0.78 -6.07 3.49 0.11 -1.94 -3.45 132.00 124.91 1x27 h PRO 124 Ca 0.18 -0.05 -0.73 0.00 0.11 0.00 0.00 66.00 65.52 1x27 h PRO 124 Cb 0.43 -0.18 0.07 0.00 0.11 0.00 0.00 31.00 31.43 1x27 h PRO 124 CO -0.92 0.52 -0.01 0.39 -0.21 0.00 0.00 178.00 177.76 1x27 n GLU 125 N -4.51 0.27 0.31 1.05 -0.58 -0.42 -4.82 120.64 111.95 1x27 n GLU 125 Ca 0.13 0.10 0.20 0.00 -0.42 0.00 0.00 57.16 57.18 1x27 n GLU 125 Cb 0.30 -1.49 1.00 0.00 -0.57 0.00 0.00 31.44 30.67 1x27 n GLU 125 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 1x27 h PRO 126 N 2.72 0.00 -0.01 3.49 0.13 -1.88 -2.74 132.00 133.70 1x27 h PRO 126 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1x27 h PRO 126 Cb 1.41 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.54 1x27 h PRO 126 CO 0.65 0.01 -0.43 -2.67 -0.23 0.00 0.00 178.00 175.33 1x27 n TRP 127 N -3.12 0.00 -3.71 1.56 4.27 -1.26 -4.60 117.44 110.58 1x27 n TRP 127 Ca -0.02 0.00 -0.33 0.00 -3.89 0.00 0.00 57.50 53.26 1x27 n TRP 127 Cb 0.17 0.00 -0.05 0.00 -1.36 0.00 0.00 31.31 30.07 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 -2.21 3.55 -0.30 -2.67 5.36 -1.04 -0.31 117.98 120.36 1x27 s PHE 128 Ca 0.15 0.59 0.04 0.00 -0.96 0.00 0.00 56.93 56.75 1x27 s PHE 128 Cb 0.15 -2.01 0.17 0.00 -0.34 0.00 0.00 43.02 40.99 1x27 s PHE 128 CO 0.50 0.54 0.47 -0.06 -1.46 0.00 0.00 175.22 175.21 1x27 s PHE 129 N -1.44 -1.26 0.00 10.12 0.08 -0.50 -4.87 117.98 120.12 1x27 s PHE 129 Ca 0.33 0.48 0.00 0.00 0.12 0.00 0.00 56.93 57.86 1x27 s PHE 129 Cb -0.13 -0.01 0.00 0.00 -0.57 0.00 0.00 43.02 42.31 1x27 s PHE 129 CO 0.20 -1.03 0.00 1.63 -0.10 0.00 0.00 175.22 175.92 1x27 n LYS 130 N 5.27 0.00 -1.28 0.44 5.02 -1.26 -3.80 118.16 122.56 1x27 n LYS 130 Ca 0.03 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.92 1x27 n LYS 130 Cb 0.51 -0.44 -0.07 0.00 -0.02 0.00 0.00 35.03 35.01 1x27 n LYS 130 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1x27 n ASN 131 N 0.00 2.43 -3.74 4.39 3.02 -1.26 -3.83 115.26 116.27 1x27 n ASN 131 Ca 0.00 -2.66 -0.28 0.00 -0.03 0.00 0.00 54.58 51.61 1x27 n ASN 131 Cb 0.00 -1.19 -0.16 0.00 -0.61 0.00 0.00 39.78 37.82 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 3.52 1.25 0.78 3.41 2.96 -1.25 -5.11 118.68 124.24 1x27 s LEU 132 Ca 0.62 -0.86 -0.11 0.00 -0.22 0.00 0.00 54.13 53.56 1x27 s LEU 132 Cb 0.11 -0.62 0.06 0.00 0.50 0.00 0.00 46.19 46.24 1x27 s LEU 132 CO 0.15 -0.31 1.09 -0.94 -1.32 0.00 0.00 176.35 175.03 1x27 s SER 133 N 1.84 4.43 0.24 3.68 1.04 -1.26 -4.56 113.70 119.10 1x27 s SER 133 Ca -0.01 1.81 -0.05 0.00 0.48 0.00 0.00 55.95 58.18 1x27 s SER 133 Cb -0.17 -2.50 0.37 0.00 0.10 0.00 0.00 66.02 63.82 1x27 s SER 133 CO -0.09 -2.08 1.81 -0.09 0.98 0.00 0.00 173.24 173.77 1x27 h ARG 134 N -1.16 0.74 -0.34 4.02 2.43 -1.99 0.16 114.38 118.23 1x27 h ARG 134 Ca -0.44 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 58.61 1x27 h ARG 134 Cb 1.23 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.61 1x27 h ARG 134 CO 0.51 0.49 -0.07 -0.22 -1.51 0.00 0.00 179.97 179.18 1x27 h LYS 135 N 0.76 0.66 -0.99 0.20 3.64 -1.99 -1.61 116.57 117.24 1x27 h LYS 135 Ca 0.38 -0.24 0.03 0.00 -1.27 0.00 0.00 60.65 59.55 1x27 h LYS 135 Cb 0.34 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.06 1x27 h LYS 135 CO -0.24 0.81 0.65 -0.44 -2.27 0.00 0.00 179.45 177.96 1x27 h ASP 136 N 0.45 1.09 -0.35 4.20 3.32 -1.69 0.32 116.42 123.76 1x27 h ASP 136 Ca 0.09 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 1x27 h ASP 136 Cb 0.56 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 1x27 h ASP 136 CO 0.03 0.76 0.18 0.00 -1.72 0.00 0.00 179.24 178.49 1x27 h ALA 137 N 1.39 0.45 -0.36 3.45 0.00 -0.52 0.52 119.26 124.19 1x27 h ALA 137 Ca 0.39 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 1x27 h ALA 137 Cb -0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1x27 h ALA 137 CO -0.11 0.01 0.07 0.93 0.00 0.00 0.00 179.25 180.15 1x27 h GLU 138 N 0.44 0.59 -0.34 0.00 5.08 -0.52 0.28 114.58 120.11 1x27 h GLU 138 Ca 0.12 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 1x27 h GLU 138 Cb 0.10 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1x27 h GLU 138 CO -0.02 0.65 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.54 1x27 h ARG 139 N 0.44 0.53 -0.03 2.33 9.65 -0.21 -1.68 114.38 125.40 1x27 h ARG 139 Ca 0.11 -0.12 -0.03 0.00 -1.10 0.00 0.00 59.98 58.84 1x27 h ARG 139 Cb 0.33 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.84 1x27 h ARG 139 CO 0.00 0.56 -0.10 0.37 2.80 0.00 0.00 179.97 183.61 1x27 h GLN 140 N 0.50 0.12 0.00 0.20 5.75 0.52 -2.90 115.11 119.30 1x27 h GLN 140 Ca 0.11 -0.09 -0.04 0.00 -0.15 0.00 0.00 58.65 58.48 1x27 h GLN 140 Cb 0.35 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.91 1x27 h GLN 140 CO 0.01 0.72 -0.19 -0.07 -2.65 0.00 0.00 178.83 176.65 1x27 h LEU 141 N -0.45 0.00 0.00 -2.39 3.38 -0.32 -2.14 115.31 113.40 1x27 h LEU 141 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1x27 h LEU 141 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1x27 h LEU 141 CO 0.02 0.19 -0.30 0.18 0.09 0.00 0.00 178.44 178.62 1x27 n LEU 142 N -3.83 0.31 -4.77 1.67 4.77 -0.64 -4.71 117.00 109.80 1x27 n LEU 142 Ca -0.02 0.21 -0.38 0.00 -0.03 0.00 0.00 56.01 55.78 1x27 n LEU 142 Cb 0.29 -0.35 -0.01 0.00 -2.33 0.00 0.00 43.42 41.02 1x27 n LEU 142 CO 0.33 0.07 0.89 0.00 -1.33 0.00 0.00 177.39 177.35 1x27 s ALA 143 N -3.00 3.14 0.52 -1.18 0.00 -0.81 -4.96 121.76 115.47 1x27 s ALA 143 Ca 0.12 1.07 -0.20 0.00 0.00 0.00 0.00 51.96 52.95 1x27 s ALA 143 Cb 0.18 -3.43 -0.09 0.00 0.00 0.00 0.00 23.12 19.78 1x27 s ALA 143 CO 0.63 -0.69 0.67 -0.35 0.00 0.00 0.00 175.76 176.02 1x27 n PRO 144 N -0.06 0.72 -0.18 0.00 -0.04 -1.26 -3.23 135.00 130.94 1x27 n PRO 144 Ca 0.05 0.27 0.00 0.00 -0.04 0.00 0.00 63.50 63.78 1x27 n PRO 144 Cb 0.46 -1.79 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 1x27 n PRO 144 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1x27 n GLY 145 N 1.61 0.79 3.26 0.55 0.00 -1.26 -4.98 105.19 105.15 1x27 n GLY 145 Ca 0.12 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.38 1.72 0.00 1.61 0.01 -1.20 -4.73 114.94 109.98 1x27 s ASN 146 Ca 0.00 -1.06 0.00 0.00 -0.71 0.00 0.00 52.86 51.09 1x27 s ASN 146 Cb 0.00 0.01 0.00 0.00 0.41 0.00 0.00 41.25 41.67 1x27 s ASN 146 CO 0.00 -0.39 0.00 0.35 -1.51 0.00 0.00 177.10 175.55 1x27 n THR 147 N -0.23 0.00 -2.18 1.60 -2.24 -1.26 -4.99 114.28 104.97 1x27 n THR 147 Ca -0.09 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.26 1x27 n THR 147 Cb 0.61 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.82 1x27 n THR 147 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1x27 s HIS 148 N -0.45 2.32 0.00 4.78 3.76 -1.26 -2.03 115.29 122.41 1x27 s HIS 148 Ca 0.00 0.56 0.00 0.00 -0.15 0.00 0.00 55.06 55.47 1x27 s HIS 148 Cb 0.00 -3.79 0.00 0.00 1.11 0.00 0.00 32.58 29.90 1x27 s HIS 148 CO 0.00 -2.88 0.00 0.41 -0.85 0.00 0.00 174.74 171.42 1x27 n GLY 149 N 4.05 1.27 3.77 -2.22 0.00 0.64 -4.80 105.19 107.90 1x27 n GLY 149 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.81 6.68 0.34 1.61 0.01 -0.86 -2.17 113.70 117.49 1x27 s SER 150 Ca 0.00 2.74 -0.07 0.00 1.31 0.00 0.00 55.95 59.93 1x27 s SER 150 Cb 0.00 -2.65 0.03 0.00 0.21 0.00 0.00 66.02 63.61 1x27 s SER 150 CO 0.00 -0.63 0.56 2.22 0.41 0.00 0.00 173.24 175.81 1x27 n PHE 151 N 1.09 -1.75 -3.59 2.43 -1.74 -0.97 0.11 117.46 113.03 1x27 n PHE 151 Ca 0.02 -1.94 -0.04 0.00 -0.56 0.00 0.00 57.45 54.92 1x27 n PHE 151 Cb 0.41 0.65 -0.02 0.00 1.52 0.00 0.00 39.48 42.04 1x27 n PHE 151 CO 0.00 0.00 0.00 -0.48 -0.56 0.00 0.00 176.76 175.72 1x27 s LEU 152 N 0.00 -0.14 -0.12 5.98 0.05 0.11 0.08 118.68 124.63 1x27 s LEU 152 Ca 0.21 0.01 0.02 0.00 0.05 0.00 0.00 54.13 54.42 1x27 s LEU 152 Cb -0.02 1.39 -0.01 0.00 -2.05 0.00 0.00 46.19 45.50 1x27 s LEU 152 CO 0.15 -0.23 -0.18 -0.63 -0.55 0.00 0.00 176.35 174.91 1x27 s ILE 153 N -2.37 2.54 0.43 1.48 1.01 0.58 -0.85 121.20 124.02 1x27 s ILE 153 Ca 0.09 -0.84 0.03 0.00 0.00 0.00 0.00 60.65 59.93 1x27 s ILE 153 Cb -0.01 -2.03 -0.03 0.00 0.01 0.00 0.00 42.46 40.41 1x27 s ILE 153 CO -0.05 0.54 0.08 0.00 0.00 0.00 0.00 174.94 175.51 1x27 s ARG 154 N 0.45 1.99 0.30 2.79 1.70 -0.86 -1.41 118.95 123.92 1x27 s ARG 154 Ca -0.13 -2.23 -0.26 0.00 -0.47 0.00 0.00 55.73 52.64 1x27 s ARG 154 Cb -0.17 -0.95 -0.10 0.00 -0.57 0.00 0.00 34.95 33.17 1x27 s ARG 154 CO 0.06 -0.41 0.93 -1.21 -1.08 0.00 0.00 175.30 173.60 1x27 s GLU 155 N -3.77 4.62 0.25 3.89 2.02 -1.25 -1.32 118.70 123.13 1x27 s GLU 155 Ca 0.20 1.34 -0.30 0.00 0.02 0.00 0.00 54.97 56.23 1x27 s GLU 155 Cb 0.03 -2.89 -0.09 0.00 0.10 0.00 0.00 34.13 31.28 1x27 s GLU 155 CO 0.11 0.33 1.13 0.45 0.02 0.00 0.00 175.26 177.30 1x27 s SER 156 N -1.54 7.21 0.02 -0.19 0.15 -0.62 -4.69 113.70 114.04 1x27 s SER 156 Ca 0.48 2.26 -0.00 0.00 0.70 0.00 0.00 55.95 59.39 1x27 s SER 156 Cb -0.20 -2.62 -0.26 0.00 -1.71 0.00 0.00 66.02 61.23 1x27 s SER 156 CO 0.25 -0.22 0.93 -0.33 1.20 0.00 0.00 173.24 175.07 1x27 h GLU 157 N 4.27 0.19 -0.00 5.44 5.08 -1.95 -3.34 114.58 124.27 1x27 h GLU 157 Ca -0.46 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 57.58 1x27 h GLU 157 Cb 1.21 0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.58 1x27 h GLU 157 CO 0.69 1.05 -0.26 0.43 -1.00 0.00 0.00 179.01 179.91 1x27 n SER 158 N -3.41 0.34 -3.43 1.42 7.64 -1.26 -4.73 113.62 110.19 1x27 n SER 158 Ca -0.13 -0.05 -0.16 0.00 1.01 0.00 0.00 58.87 59.54 1x27 n SER 158 Cb 1.03 -0.06 -0.11 0.00 -1.01 0.00 0.00 64.21 64.06 1x27 n SER 158 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1x27 s THR 159 N -2.92 -0.41 -0.12 0.44 2.01 -1.25 -5.11 115.64 108.28 1x27 s THR 159 Ca 0.15 -0.24 -0.29 0.00 0.31 0.00 0.00 61.69 61.62 1x27 s THR 159 Cb 0.18 -0.81 -0.04 0.00 0.01 0.00 0.00 72.50 71.84 1x27 s THR 159 CO 0.61 -0.28 1.55 0.00 -0.69 0.00 0.00 174.62 175.80 1x27 s ALA 160 N 2.38 3.55 0.00 7.40 0.00 -1.26 -1.96 121.76 131.87 1x27 s ALA 160 Ca 0.09 0.71 0.00 0.00 0.00 0.00 0.00 51.96 52.76 1x27 s ALA 160 Cb -0.15 -3.74 0.00 0.00 0.00 0.00 0.00 23.12 19.23 1x27 s ALA 160 CO -0.20 -1.46 0.00 0.41 0.00 0.00 0.00 175.76 174.51 1x27 n GLY 161 N 4.11 0.77 3.67 0.00 0.00 -1.26 -5.09 105.19 107.39 1x27 n GLY 161 Ca 0.17 0.00 -0.28 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 -2.05 4.02 0.35 1.61 0.01 -0.83 -4.98 113.70 111.83 1x27 s SER 162 Ca 0.00 -1.37 0.06 0.00 1.31 0.00 0.00 55.95 55.94 1x27 s SER 162 Cb 0.00 -0.24 -0.07 0.00 0.21 0.00 0.00 66.02 65.92 1x27 s SER 162 CO 0.00 -0.54 0.02 -0.36 0.41 0.00 0.00 173.24 172.76 1x27 s PHE 163 N -2.72 2.16 0.02 2.43 0.08 -1.25 -1.59 117.98 117.10 1x27 s PHE 163 Ca 0.31 -0.80 0.00 0.00 0.12 0.00 0.00 56.93 56.56 1x27 s PHE 163 Cb 0.07 -1.42 -0.02 0.00 -0.57 0.00 0.00 43.02 41.09 1x27 s PHE 163 CO 0.16 0.22 -0.03 -1.12 -0.10 0.00 0.00 175.22 174.35 1x27 s SER 164 N -3.56 0.30 -0.21 1.36 0.01 -0.43 -2.27 113.70 108.90 1x27 s SER 164 Ca 0.35 -0.37 -0.07 0.00 1.31 0.00 0.00 55.95 57.17 1x27 s SER 164 Cb 0.08 0.06 -0.03 0.00 0.21 0.00 0.00 66.02 66.34 1x27 s SER 164 CO 0.16 -0.20 0.05 -0.22 0.41 0.00 0.00 173.24 173.44 1x27 s LEU 165 N -1.08 3.53 -0.11 2.44 2.96 0.54 -2.03 118.68 124.94 1x27 s LEU 165 Ca -0.10 -0.09 0.02 0.00 -0.22 0.00 0.00 54.13 53.73 1x27 s LEU 165 Cb -0.07 -1.91 -0.01 0.00 0.50 0.00 0.00 46.19 44.70 1x27 s LEU 165 CO -0.01 0.08 -0.18 -0.44 -1.32 0.00 0.00 176.35 174.48 1x27 s SER 166 N 0.94 3.62 -0.04 3.68 0.01 -0.03 -0.11 113.70 121.77 1x27 s SER 166 Ca 0.03 -0.41 -0.02 0.00 1.31 0.00 0.00 55.95 56.86 1x27 s SER 166 Cb -0.14 -1.39 0.02 0.00 0.21 0.00 0.00 66.02 64.72 1x27 s SER 166 CO 0.02 0.19 0.09 0.54 0.41 0.00 0.00 173.24 174.49 1x27 s VAL 167 N 0.19 -0.02 -0.06 3.43 0.11 -0.67 0.06 120.40 123.44 1x27 s VAL 167 Ca -0.11 0.09 -0.29 0.00 -2.93 0.00 0.00 61.98 58.74 1x27 s VAL 167 Cb -0.16 -0.14 -0.02 0.00 -1.53 0.00 0.00 36.38 34.53 1x27 s VAL 167 CO 0.06 0.04 0.94 -0.60 -3.33 0.00 0.00 175.10 172.21 1x27 s ARG 168 N 0.53 4.48 0.37 1.54 3.52 0.29 -1.33 118.95 128.34 1x27 s ARG 168 Ca -0.04 1.31 0.03 0.00 -0.13 0.00 0.00 55.73 56.91 1x27 s ARG 168 Cb -0.06 -3.50 -0.04 0.00 -1.56 0.00 0.00 34.95 29.79 1x27 s ARG 168 CO -0.02 -0.15 0.09 0.34 -0.81 0.00 0.00 175.30 174.75 1x27 s ASP 169 N 1.03 2.55 -0.09 -2.12 2.15 0.01 -0.26 116.67 119.94 1x27 s ASP 169 Ca 0.48 -1.52 0.02 0.00 0.43 0.00 0.00 52.55 51.95 1x27 s ASP 169 Cb -0.19 0.22 0.02 0.00 -0.30 0.00 0.00 42.92 42.66 1x27 s ASP 169 CO 0.22 -0.77 -0.13 0.12 -0.17 0.00 0.00 175.17 174.44 1x27 s PHE 170 N -3.27 1.66 0.38 -5.34 2.19 -1.26 -0.57 117.98 111.77 1x27 s PHE 170 Ca 0.30 -0.72 0.08 0.00 0.33 0.00 0.00 56.93 56.92 1x27 s PHE 170 Cb 0.06 -1.23 -0.02 0.00 -1.31 0.00 0.00 43.02 40.51 1x27 s PHE 170 CO 0.14 -0.39 0.35 0.34 1.83 0.00 0.00 175.22 177.50 1x27 s ASP 171 N 0.94 5.22 0.05 6.13 2.15 0.27 -4.96 116.67 126.46 1x27 s ASP 171 Ca -0.09 -0.60 0.14 0.00 0.43 0.00 0.00 52.55 52.43 1x27 s ASP 171 Cb -0.15 -0.77 -0.16 0.00 -0.30 0.00 0.00 42.92 41.54 1x27 s ASP 171 CO 0.00 -0.52 0.89 1.56 -0.17 0.00 0.00 175.17 176.93 1x27 h GLN 172 N 1.10 0.00 0.00 4.34 1.08 -2.01 -2.60 115.11 117.02 1x27 h GLN 172 Ca -0.43 0.00 -0.31 0.00 -1.45 0.00 0.00 58.65 56.46 1x27 h GLN 172 Cb 1.26 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 28.64 1x27 h GLN 172 CO 0.57 0.48 -2.00 0.09 -0.95 0.00 0.00 178.83 177.02 1x27 n ASN 173 N -3.04 0.45 -0.16 1.46 5.03 -1.26 -4.51 115.26 113.23 1x27 n ASN 173 Ca -0.10 0.21 0.03 0.00 0.87 0.00 0.00 54.58 55.59 1x27 n ASN 173 Cb 0.92 0.50 0.04 0.00 -1.02 0.00 0.00 39.78 40.23 1x27 n ASN 173 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1x27 n GLN 174 N -2.87 1.03 0.00 3.52 10.64 -1.26 -5.10 117.38 123.34 1x27 n GLN 174 Ca -0.23 -1.46 0.00 0.00 -1.83 0.00 0.00 57.00 53.48 1x27 n GLN 174 Cb 1.07 -0.90 0.00 0.00 -0.86 0.00 0.00 30.24 29.55 1x27 n GLN 174 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1x27 n GLY 175 N -0.52 3.09 3.68 2.61 0.00 -0.98 -4.55 105.19 108.51 1x27 n GLY 175 Ca 0.05 0.19 -0.47 0.00 0.00 0.00 0.00 46.02 45.78 1x27 n GLY 175 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1x27 n GLU 176 N 14.00 2.29 -4.25 1.61 4.71 -1.26 0.94 120.64 138.68 1x27 n GLU 176 Ca 0.00 0.84 -0.14 0.00 -0.01 0.00 0.00 57.16 57.85 1x27 n GLU 176 Cb 0.00 -2.70 -0.10 0.00 -1.01 0.00 0.00 31.44 27.63 1x27 n GLU 176 CO 0.00 0.00 0.00 0.14 0.09 0.00 0.00 177.13 177.36 1x27 s VAL 177 N 4.01 0.63 -0.22 2.62 -7.23 0.27 -4.90 120.40 115.57 1x27 s VAL 177 Ca 0.92 -1.98 -0.01 0.00 -1.81 0.00 0.00 61.98 59.10 1x27 s VAL 177 Cb -0.65 -2.19 0.06 0.00 0.56 0.00 0.00 36.38 34.17 1x27 s VAL 177 CO 0.50 -0.41 0.00 -0.69 -0.31 0.00 0.00 175.10 174.19 1x27 s VAL 178 N -3.69 1.00 0.31 1.32 1.01 -1.26 -0.81 120.40 118.27 1x27 s VAL 178 Ca 0.26 -0.91 -0.14 0.00 0.00 0.00 0.00 61.98 61.19 1x27 s VAL 178 Cb 0.06 -1.41 -0.09 0.00 0.00 0.00 0.00 36.38 34.94 1x27 s VAL 178 CO 0.05 -0.19 0.71 -0.54 0.00 0.00 0.00 175.10 175.13 1x27 s LYS 179 N 1.63 3.97 -0.11 2.72 1.02 -0.44 -4.91 119.74 123.62 1x27 s LYS 179 Ca -0.02 0.61 0.00 0.00 0.02 0.00 0.00 55.97 56.57 1x27 s LYS 179 Cb -0.18 -2.46 0.02 0.00 -0.52 0.00 0.00 37.83 34.69 1x27 s LYS 179 CO -0.08 0.17 -0.10 -1.01 -0.92 0.00 0.00 175.35 173.42 1x27 s HIS 180 N -1.97 1.60 -0.09 3.18 3.76 -1.26 -1.68 115.29 118.83 1x27 s HIS 180 Ca 0.53 -0.78 0.03 0.00 -0.15 0.00 0.00 55.06 54.69 1x27 s HIS 180 Cb -0.10 -1.27 -0.01 0.00 1.11 0.00 0.00 32.58 32.31 1x27 s HIS 180 CO 0.18 -0.50 -0.19 0.71 -0.85 0.00 0.00 174.74 174.10 1x27 s TYR 181 N 1.47 2.64 0.14 1.40 1.51 0.84 -4.97 117.35 120.38 1x27 s TYR 181 Ca 0.01 -0.64 -0.30 0.00 -1.01 0.00 0.00 57.07 55.13 1x27 s TYR 181 Cb -0.13 -1.71 -0.07 0.00 -0.11 0.00 0.00 41.96 39.94 1x27 s TYR 181 CO -0.06 -0.17 1.03 0.21 -1.11 0.00 0.00 175.55 175.45 1x27 s LYS 182 N -0.01 4.64 -0.39 -0.62 2.36 -1.26 -0.34 119.74 124.12 1x27 s LYS 182 Ca -0.06 1.58 -0.10 0.00 -2.55 0.00 0.00 55.97 54.84 1x27 s LYS 182 Cb -0.15 -3.33 0.05 0.00 -1.05 0.00 0.00 37.83 33.35 1x27 s LYS 182 CO 0.05 0.14 0.22 0.42 1.55 0.00 0.00 175.35 177.73 1x27 s ILE 183 N -0.06 4.41 0.61 5.43 1.01 -0.96 -4.65 121.20 126.99 1x27 s ILE 183 Ca 0.48 -1.08 -0.12 0.00 0.00 0.00 0.00 60.65 59.93 1x27 s ILE 183 Cb -0.26 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.61 1x27 s ILE 183 CO 0.32 -0.34 1.02 -0.13 0.00 0.00 0.00 174.94 175.81 1x27 s ARG 184 N 1.50 3.62 0.28 2.79 0.52 -0.01 -3.91 118.95 123.73 1x27 s ARG 184 Ca 0.02 0.80 0.06 0.00 -0.52 0.00 0.00 55.73 56.09 1x27 s ARG 184 Cb -0.21 -2.08 -0.02 0.00 0.52 0.00 0.00 34.95 33.15 1x27 s ARG 184 CO 0.05 -0.55 0.37 -0.80 0.02 0.00 0.00 175.30 174.39 1x27 s ASN 185 N -3.96 6.06 0.30 0.23 0.01 -1.26 -1.75 114.94 114.56 1x27 s ASN 185 Ca 0.56 -0.08 0.11 0.00 -0.71 0.00 0.00 52.86 52.74 1x27 s ASN 185 Cb -0.11 -1.56 -0.05 0.00 0.41 0.00 0.00 41.25 39.93 1x27 s ASN 185 CO 0.50 -0.19 -0.15 -0.22 -1.51 0.00 0.00 177.10 175.53 1x27 s LEU 186 N -4.02 2.70 0.00 0.60 2.96 -0.13 -4.86 118.68 115.93 1x27 s LEU 186 Ca 0.38 -1.03 0.00 0.00 -0.22 0.00 0.00 54.13 53.25 1x27 s LEU 186 Cb -0.09 -1.14 0.00 0.00 0.50 0.00 0.00 46.19 45.46 1x27 s LEU 186 CO 0.29 -0.04 0.25 0.47 -1.32 0.00 0.00 176.35 176.00 1x27 n ASP 187 N -0.70 0.00 -2.28 3.68 8.00 -1.26 -2.82 116.55 121.17 1x27 n ASP 187 Ca -0.05 0.25 -0.15 0.00 0.71 0.00 0.00 54.79 55.55 1x27 n ASP 187 Cb 0.61 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.58 1x27 n ASP 187 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1x27 n ASN 188 N -0.37 5.10 0.00 -2.24 5.15 -1.26 -4.84 115.26 116.79 1x27 n ASN 188 Ca 0.00 -2.38 0.00 0.00 -0.60 0.00 0.00 54.58 51.60 1x27 n ASN 188 Cb 0.00 -1.27 0.00 0.00 -0.53 0.00 0.00 39.78 37.98 1x27 n ASN 188 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1x27 n GLY 189 N 2.75 -1.95 0.00 8.20 0.00 -1.13 -5.11 105.19 107.96 1x27 n GLY 189 Ca 0.43 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.24 3.16 3.28 -0.02 0.00 -1.25 -4.34 105.19 103.78 1x27 n GLY 190 Ca 0.00 -1.98 -0.10 0.00 0.00 0.00 0.00 46.02 43.95 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 -2.98 0.56 -0.22 1.61 0.08 -0.29 -0.95 117.98 115.79 1x27 s PHE 191 Ca 0.00 -0.92 -0.29 0.00 0.12 0.00 0.00 56.93 55.84 1x27 s PHE 191 Cb 0.00 -0.19 0.15 0.00 -0.57 0.00 0.00 43.02 42.41 1x27 s PHE 191 CO 0.00 -0.66 1.15 1.52 -0.10 0.00 0.00 175.22 177.13 1x27 s TYR 192 N -4.00 -0.23 -0.17 0.36 -0.85 -0.72 -1.25 117.35 110.48 1x27 s TYR 192 Ca 0.20 0.42 0.07 0.00 -0.52 0.00 0.00 57.07 57.23 1x27 s TYR 192 Cb 0.05 0.47 -0.15 0.00 0.38 0.00 0.00 41.96 42.70 1x27 s TYR 192 CO 0.01 -0.21 -0.08 -0.89 -1.52 0.00 0.00 175.55 172.87 1x27 n ILE 193 N 0.73 1.08 -4.60 -3.49 5.41 -1.26 -0.83 119.36 116.39 1x27 n ILE 193 Ca -0.06 -0.52 -0.25 0.00 1.00 0.00 0.00 62.75 62.92 1x27 n ILE 193 Cb 0.58 -0.93 -0.17 0.00 -0.71 0.00 0.00 39.64 38.41 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 -5.44 1.81 0.00 4.38 0.15 -1.26 -4.91 113.70 108.43 1x27 s SER 194 Ca -0.18 -0.31 0.02 0.00 0.70 0.00 0.00 55.95 56.18 1x27 s SER 194 Cb 0.06 -0.84 0.12 0.00 -1.71 0.00 0.00 66.02 63.64 1x27 s SER 194 CO 0.52 0.04 0.44 -0.81 1.20 0.00 0.00 173.24 174.63 1x27 n PRO 195 N 3.81 0.11 0.08 5.44 -0.04 -1.26 -1.11 135.00 142.02 1x27 n PRO 195 Ca -0.23 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.22 1x27 n PRO 195 Cb 0.52 -1.29 -0.05 0.00 -0.04 0.00 0.00 33.50 32.63 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 0.00 -3.68 0.54 2.43 -2.00 -3.45 114.38 108.23 1x27 h ARG 196 Ca 0.00 0.00 -0.35 0.00 -0.81 0.00 0.00 59.98 58.82 1x27 h ARG 196 Cb 0.00 0.00 -0.34 0.00 -0.42 0.00 0.00 29.97 29.21 1x27 h ARG 196 CO 0.00 0.58 -0.75 0.42 -1.51 0.00 0.00 179.97 178.71 1x27 s ILE 197 N -2.85 0.15 0.38 1.20 1.09 -0.27 -5.15 121.20 115.75 1x27 s ILE 197 Ca 0.01 0.12 0.08 0.00 -1.10 0.00 0.00 60.65 59.75 1x27 s ILE 197 Cb 0.08 -0.26 -0.04 0.00 -1.06 0.00 0.00 42.46 41.19 1x27 s ILE 197 CO 0.79 0.15 0.25 0.42 -0.10 0.00 0.00 174.94 176.44 1x27 s THR 198 N 1.13 2.82 -0.06 2.92 -4.23 -1.26 -4.50 115.64 112.47 1x27 s THR 198 Ca -0.08 -1.53 -0.07 0.00 -1.18 0.00 0.00 61.69 58.82 1x27 s THR 198 Cb -0.13 -3.02 0.02 0.00 1.34 0.00 0.00 72.50 70.70 1x27 s THR 198 CO -0.02 -0.08 0.19 -0.36 -0.54 0.00 0.00 174.62 173.80 1x27 s PHE 199 N -2.46 -0.17 0.40 3.99 0.08 -0.38 -5.00 117.98 114.44 1x27 s PHE 199 Ca 0.42 0.40 0.21 0.00 0.12 0.00 0.00 56.93 58.09 1x27 s PHE 199 Cb -0.02 0.05 1.18 0.00 -0.57 0.00 0.00 43.02 43.66 1x27 s PHE 199 CO 0.25 -0.14 1.99 -1.00 -0.10 0.00 0.00 175.22 176.22 1x27 h PRO 200 N 5.54 0.00 -2.66 0.24 0.13 -1.94 -0.76 132.00 132.55 1x27 h PRO 200 Ca -0.26 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.98 1x27 h PRO 200 Cb 1.20 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.27 1x27 h PRO 200 CO 0.39 0.19 0.39 0.20 -0.23 0.00 0.00 178.00 178.94 1x27 s GLY 201 N -4.22 -0.06 0.49 1.56 0.00 -1.26 -3.89 107.32 99.93 1x27 s GLY 201 Ca -0.03 -0.19 0.17 0.00 0.00 0.00 0.00 44.72 44.67 1x27 s GLY 201 CO 0.64 0.22 2.08 1.41 0.00 0.00 0.00 173.10 177.45 1x27 h LEU 202 N 2.00 0.00 0.46 0.66 3.38 -1.97 -2.14 115.31 117.70 1x27 h LEU 202 Ca -0.24 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 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 0.28 0.10 -0.22 0.45 0.09 0.00 0.00 178.44 179.14 1x27 h HIS 203 N 0.00 -0.57 -0.83 1.13 3.86 -1.96 -0.95 115.15 115.84 1x27 h HIS 203 Ca -0.00 -0.01 0.06 0.00 -1.16 0.00 0.00 60.37 59.25 1x27 h HIS 203 Cb 0.18 0.19 -0.05 0.00 1.06 0.00 0.00 27.41 28.78 1x27 h HIS 203 CO 0.00 -0.31 0.54 0.93 0.86 0.00 0.00 177.93 179.96 1x27 h GLU 204 N -0.71 0.92 -0.02 2.45 3.07 -1.91 -0.70 114.58 117.67 1x27 h GLU 204 Ca -0.06 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.74 1x27 h GLU 204 Cb 0.52 -0.21 -0.00 0.00 -0.84 0.00 0.00 28.75 28.22 1x27 h GLU 204 CO 0.10 0.61 0.01 1.25 -1.40 0.00 0.00 179.01 179.59 1x27 h LEU 205 N 0.95 0.03 -0.70 1.33 6.46 -1.08 -1.48 115.31 120.81 1x27 h LEU 205 Ca 0.35 -0.06 -0.07 0.00 -0.12 0.00 0.00 57.88 57.98 1x27 h LEU 205 Cb 0.17 -0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.06 1x27 h LEU 205 CO -0.12 0.08 0.16 0.58 -0.62 0.00 0.00 178.44 178.52 1x27 h VAL 206 N -0.02 1.26 -0.50 1.05 2.07 -0.68 -1.44 116.25 117.99 1x27 h VAL 206 Ca 0.01 -0.99 0.04 0.00 0.82 0.00 0.00 66.70 66.58 1x27 h VAL 206 Cb 0.05 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.33 1x27 h VAL 206 CO -0.00 0.38 0.25 -0.09 0.02 0.00 0.00 177.57 178.13 1x27 h ARG 207 N 1.07 0.47 0.13 1.57 2.43 -0.99 -1.57 114.38 117.50 1x27 h ARG 207 Ca 0.22 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.35 1x27 h ARG 207 Cb 0.39 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1x27 h ARG 207 CO 0.00 0.31 -0.06 1.25 -1.51 0.00 0.00 179.97 179.96 1x27 h HIS 208 N 0.49 -0.17 0.00 2.20 2.76 -0.96 -2.93 115.15 116.54 1x27 h HIS 208 Ca 0.22 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.38 1x27 h HIS 208 Cb 0.13 0.06 0.00 0.00 1.55 0.00 0.00 27.41 29.14 1x27 h HIS 208 CO -0.10 0.06 0.00 0.66 -1.30 0.00 0.00 177.93 177.24 1x27 n TYR 209 N -5.08 0.00 -0.07 5.26 4.01 -0.57 -1.60 117.16 119.11 1x27 n TYR 209 Ca -0.09 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.60 1x27 n TYR 209 Cb 0.17 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.04 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 -0.83 1.13 1.10 -0.72 -2.24 -0.61 -1.22 114.28 110.89 1x27 n THR 210 Ca 0.12 -0.77 0.12 0.00 -2.27 0.00 0.00 64.05 61.24 1x27 n THR 210 Cb 0.05 -0.44 0.15 0.00 -2.10 0.00 0.00 70.33 67.99 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 -2.69 1.99 -3.56 3.42 4.13 -1.02 -4.60 115.26 112.92 1x27 n ASN 211 Ca -0.24 -1.50 0.00 0.00 1.68 0.00 0.00 54.58 54.52 1x27 n ASN 211 Cb 1.01 0.26 -0.06 0.00 -1.54 0.00 0.00 39.78 39.46 1x27 n ASN 211 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1x27 s ALA 212 N -2.33 -2.58 -0.80 5.41 0.00 -0.63 -5.09 121.76 115.74 1x27 s ALA 212 Ca 0.24 2.06 -0.05 0.00 0.00 0.00 0.00 51.96 54.21 1x27 s ALA 212 Cb 0.19 -1.91 0.20 0.00 0.00 0.00 0.00 23.12 21.60 1x27 s ALA 212 CO 0.48 -0.49 0.68 -1.54 0.00 0.00 0.00 175.76 174.89 1x27 s SER 213 N 1.47 5.98 -1.19 0.00 1.04 -1.26 -3.82 113.70 115.92 1x27 s SER 213 Ca -0.07 -3.16 -0.12 0.00 0.48 0.00 0.00 55.95 53.08 1x27 s SER 213 Cb -0.03 -1.98 0.20 0.00 0.10 0.00 0.00 66.02 64.31 1x27 s SER 213 CO -0.14 -0.35 1.35 -0.90 0.98 0.00 0.00 173.24 174.19 1x27 n ASP 214 N 3.15 5.32 0.00 7.02 5.68 -1.26 -4.21 116.55 132.25 1x27 n ASP 214 Ca 0.15 -3.00 0.00 0.00 -0.50 0.00 0.00 54.79 51.44 1x27 n ASP 214 Cb 0.40 -1.51 0.00 0.00 -1.14 0.00 0.00 41.12 38.87 1x27 n ASP 214 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1x27 n GLY 215 N 3.62 3.88 3.76 6.12 0.00 -1.26 -5.01 105.19 116.29 1x27 n GLY 215 Ca 0.33 -0.95 -0.36 0.00 0.00 0.00 0.00 46.02 45.04 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 3.81 0.00 0.99 1.43 -1.26 -4.87 118.68 118.79 1x27 s LEU 216 Ca 0.00 2.37 0.05 0.00 -1.03 0.00 0.00 54.13 55.52 1x27 s LEU 216 Cb 0.00 -4.44 0.29 0.00 0.03 0.00 0.00 46.19 42.07 1x27 s LEU 216 CO 0.00 -1.31 1.05 0.00 0.23 0.00 0.00 176.35 176.32 1x27 s THR 218 N -2.00 0.00 0.19 0.00 -4.23 -1.26 -4.99 115.64 103.35 1x27 s THR 218 Ca 0.07 0.00 -0.28 0.00 -1.18 0.00 0.00 61.69 60.30 1x27 s THR 218 Cb 0.03 -1.00 -0.08 0.00 1.34 0.00 0.00 72.50 72.79 1x27 s THR 218 CO 0.06 0.00 0.89 -0.13 -0.54 0.00 0.00 174.62 174.89 1x27 s ARG 219 N -1.67 4.74 -1.00 3.99 0.52 -1.26 -4.82 118.95 119.45 1x27 s ARG 219 Ca 0.04 1.37 -0.24 0.00 -0.52 0.00 0.00 55.73 56.37 1x27 s ARG 219 Cb -0.01 -3.29 -0.09 0.00 0.52 0.00 0.00 34.95 32.08 1x27 s ARG 219 CO -0.03 0.48 2.02 -0.51 0.02 0.00 0.00 175.30 177.28 1x27 s LEU 220 N -0.96 3.01 0.18 2.53 1.43 -0.36 -4.60 118.68 119.92 1x27 s LEU 220 Ca 0.40 -0.95 -0.03 0.00 -1.03 0.00 0.00 54.13 52.52 1x27 s LEU 220 Cb -0.25 -2.57 0.08 0.00 0.03 0.00 0.00 46.19 43.49 1x27 s LEU 220 CO 0.30 -3.19 1.47 0.77 0.23 0.00 0.00 176.35 175.93 1x27 h SER 221 N 10.97 0.59 -3.02 2.29 4.64 -1.74 -3.40 113.55 123.89 1x27 h SER 221 Ca 0.12 -0.34 0.04 0.00 -0.47 0.00 0.00 61.79 61.14 1x27 h SER 221 Cb 0.98 -0.17 -0.23 0.00 -0.31 0.00 0.00 62.40 62.67 1x27 h SER 221 CO 1.17 1.06 0.18 0.00 -0.87 0.00 0.00 176.83 178.37 1x27 s ARG 222 N -3.87 0.62 0.57 4.77 1.70 -1.14 -4.99 118.95 116.59 1x27 s ARG 222 Ca -0.07 0.98 -0.20 0.00 -0.47 0.00 0.00 55.73 55.97 1x27 s ARG 222 Cb 0.11 0.17 -0.04 0.00 -0.57 0.00 0.00 34.95 34.62 1x27 s ARG 222 CO 0.84 -0.12 1.30 -1.25 -1.08 0.00 0.00 175.30 174.99 1x27 s PRO 223 N 1.26 3.04 0.40 3.89 0.04 -1.26 -2.30 135.00 140.06 1x27 s PRO 223 Ca -0.07 2.07 -0.23 0.00 0.04 0.00 0.00 61.00 62.81 1x27 s PRO 223 Cb -0.05 -2.12 -0.13 0.00 0.04 0.00 0.00 34.50 32.25 1x27 s PRO 223 CO -0.15 -1.22 0.62 0.00 0.04 0.00 0.00 177.00 176.29 1x27 s GLN 225 N -1.60 2.55 0.00 0.00 2.00 -1.26 -4.95 119.66 116.40 1x27 s GLN 225 Ca 0.63 -0.69 0.27 0.00 -2.00 0.00 0.00 55.36 53.56 1x27 s GLN 225 Cb -0.62 -2.39 0.75 0.00 0.80 0.00 0.00 33.01 31.54 1x27 s GLN 225 CO 0.58 0.60 1.57 0.25 -0.50 0.00 0.00 175.29 177.79