#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ghu s SER 59 N 0.00 0.96 -0.12 1.61 0.01 -1.26 -5.06 113.70 109.84 1ghu s SER 59 Ca 0.00 0.05 -0.14 0.00 1.31 0.00 0.00 55.95 57.17 1ghu s SER 59 Cb 0.00 0.55 -0.12 0.00 0.21 0.00 0.00 66.02 66.66 1ghu s SER 59 CO 0.00 -0.30 0.33 4.11 0.41 0.00 0.00 173.24 177.79 1ghu h TRP 60 N 8.29 0.00 -3.18 2.43 5.08 -2.00 -3.42 115.95 123.16 1ghu h TRP 60 Ca -0.17 0.00 -0.60 0.00 1.08 0.00 0.00 58.89 59.21 1ghu h TRP 60 Cb 1.14 0.00 -0.08 0.00 -3.00 0.00 0.00 29.16 27.22 1ghu h TRP 60 CO 0.20 0.49 -0.25 0.12 -1.28 0.00 0.00 178.44 177.72 1ghu s PHE 61 N -1.90 3.56 0.00 0.12 5.36 -1.26 -2.44 117.98 121.42 1ghu s PHE 61 Ca -0.10 0.78 0.00 0.00 -0.96 0.00 0.00 56.93 56.65 1ghu s PHE 61 Cb -0.01 -2.35 0.00 0.00 -0.34 0.00 0.00 43.02 40.32 1ghu s PHE 61 CO 0.33 0.37 0.00 1.19 -1.46 0.00 0.00 175.22 175.65 1ghu n PHE 62 N 2.99 0.00 -2.41 10.12 3.01 -1.19 -4.94 117.46 125.05 1ghu n PHE 62 Ca -0.12 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.34 1ghu n PHE 62 Cb 0.52 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 39.96 1ghu n PHE 62 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ghu n GLY 63 N 2.25 1.89 3.39 1.37 0.00 -1.26 -5.08 105.19 107.75 1ghu n GLY 63 Ca 0.00 -0.65 -0.45 0.00 0.00 0.00 0.00 46.02 44.92 1ghu n GLY 63 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ghu s LYS 64 N 1.09 3.50 0.11 1.61 2.20 -1.26 -1.91 119.74 125.08 1ghu s LYS 64 Ca 0.00 -1.94 0.09 0.00 -0.36 0.00 0.00 55.97 53.76 1ghu s LYS 64 Cb 0.00 -4.62 -0.04 0.00 -1.51 0.00 0.00 37.83 31.67 1ghu s LYS 64 CO 0.00 -1.55 -0.23 0.96 -0.36 0.00 0.00 175.35 174.17 1ghu s ILE 65 N 1.76 1.86 1.19 5.43 -0.00 -1.26 -4.94 121.20 125.23 1ghu s ILE 65 Ca 0.23 -1.58 -0.19 0.00 -0.00 0.00 0.00 60.65 59.11 1ghu s ILE 65 Cb -0.10 -1.67 0.28 0.00 -0.00 0.00 0.00 42.46 40.97 1ghu s ILE 65 CO -0.06 -0.00 1.11 -2.16 -0.00 0.00 0.00 174.94 173.82 1ghu s PRO 66 N -1.91 -1.16 0.20 0.37 0.04 -1.26 -4.64 135.00 126.65 1ghu s PRO 66 Ca 0.08 -0.05 -0.11 0.00 0.04 0.00 0.00 61.00 60.97 1ghu s PRO 66 Cb -0.10 -1.60 0.13 0.00 0.04 0.00 0.00 34.50 32.97 1ghu s PRO 66 CO 0.05 -3.67 1.83 -0.09 0.04 0.00 0.00 177.00 175.16 1ghu h ARG 67 N -2.55 0.98 -0.45 4.56 2.43 -1.98 -2.28 114.38 115.08 1ghu h ARG 67 Ca -0.45 -0.10 -0.09 0.00 -0.81 0.00 0.00 59.98 58.53 1ghu h ARG 67 Cb 1.29 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.63 1ghu h ARG 67 CO 0.35 0.70 -0.09 0.00 -1.51 0.00 0.00 179.97 179.42 1ghu h ALA 68 N 1.22 0.61 -0.46 2.80 0.00 -2.00 -2.38 119.26 119.05 1ghu h ALA 68 Ca 0.25 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1ghu h ALA 68 Cb -0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1ghu h ALA 68 CO -0.05 0.49 0.02 -0.22 0.00 0.00 0.00 179.25 179.49 1ghu h LYS 69 N 0.69 0.74 -0.75 0.00 3.64 -1.93 -2.16 116.57 116.80 1ghu h LYS 69 Ca 0.12 -0.18 -0.05 0.00 -1.27 0.00 0.00 60.65 59.26 1ghu h LYS 69 Cb 0.63 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.32 1ghu h LYS 69 CO 0.04 0.74 0.27 0.00 -2.27 0.00 0.00 179.45 178.23 1ghu h ALA 70 N 1.32 0.98 -0.60 5.00 0.00 -1.41 -2.52 119.26 122.03 1ghu h ALA 70 Ca 0.14 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1ghu h ALA 70 Cb 0.41 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1ghu h ALA 70 CO 0.01 0.63 0.07 0.93 0.00 0.00 0.00 179.25 180.89 1ghu h GLU 71 N 1.10 1.02 -0.16 0.00 5.08 -1.41 -2.56 114.58 117.65 1ghu h GLU 71 Ca 0.25 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1ghu h GLU 71 Cb 0.26 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1ghu h GLU 71 CO -0.01 0.97 0.11 1.49 -1.00 0.00 0.00 179.01 180.57 1ghu h GLU 72 N 0.92 0.22 -0.16 2.33 4.81 -1.39 -2.11 114.58 119.21 1ghu h GLU 72 Ca 0.18 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.37 1ghu h GLU 72 Cb 0.47 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1ghu h GLU 72 CO 0.02 0.15 -0.01 0.52 -0.73 0.00 0.00 179.01 178.95 1ghu h MET 73 N 0.22 0.29 0.00 1.92 2.86 -1.53 -3.32 114.93 115.36 1ghu h MET 73 Ca 0.06 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1ghu h MET 73 Cb -0.02 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.62 1ghu h MET 73 CO -0.01 0.53 0.00 1.25 1.06 0.00 0.00 176.91 179.74 1ghu h LEU 74 N 0.01 0.00 -1.80 1.22 5.85 -1.54 -3.24 115.31 115.82 1ghu h LEU 74 Ca 0.04 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1ghu h LEU 74 Cb 0.41 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 1ghu h LEU 74 CO 0.01 0.00 0.04 0.77 -0.34 0.00 0.00 178.44 178.93 1ghu h SER 75 N 0.00 0.15 -0.97 1.25 4.64 -1.48 -2.80 113.55 114.34 1ghu h SER 75 Ca 0.00 -0.01 0.01 0.00 -0.47 0.00 0.00 61.79 61.32 1ghu h SER 75 Cb 0.73 -0.04 -0.05 0.00 -0.31 0.00 0.00 62.40 62.73 1ghu h SER 75 CO 0.00 0.15 0.64 0.11 -0.87 0.00 0.00 176.83 176.86 1ghu h LYS 76 N 0.17 1.27 -6.20 4.77 1.79 -1.71 -3.41 116.57 113.25 1ghu h LYS 76 Ca 0.05 -0.08 -0.57 0.00 -2.18 0.00 0.00 60.65 57.87 1ghu h LYS 76 Cb 0.05 -0.29 -0.01 0.00 -1.58 0.00 0.00 32.23 30.40 1ghu h LYS 76 CO -0.00 0.84 1.29 -0.65 -1.08 0.00 0.00 179.45 179.85 1ghu s GLN 77 N -6.08 3.52 0.24 3.15 1.11 -1.06 -4.93 119.66 115.61 1ghu s GLN 77 Ca -0.13 1.84 0.26 0.00 0.01 0.00 0.00 55.36 57.34 1ghu s GLN 77 Cb 0.18 -4.20 0.74 0.00 -1.01 0.00 0.00 33.01 28.73 1ghu s GLN 77 CO 0.81 -1.64 1.75 0.07 0.01 0.00 0.00 175.29 176.29 1ghu h ARG 78 N 12.59 0.00 -6.45 2.91 0.11 -1.84 -3.49 114.38 118.21 1ghu h ARG 78 Ca -0.38 0.00 -0.54 0.00 0.10 0.00 0.00 59.98 59.16 1ghu h ARG 78 Cb 1.19 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.24 1ghu h ARG 78 CO 0.99 0.00 -0.06 -1.01 0.10 0.00 0.00 179.97 179.99 1ghu s HIS 79 N -3.12 3.49 -0.18 4.08 3.76 -1.26 -5.01 115.29 117.05 1ghu s HIS 79 Ca 0.10 1.02 -0.29 0.00 -0.15 0.00 0.00 55.06 55.74 1ghu s HIS 79 Cb 0.11 -2.36 -0.00 0.00 1.11 0.00 0.00 32.58 31.44 1ghu s HIS 79 CO 0.61 0.30 1.13 -0.51 -0.85 0.00 0.00 174.74 175.42 1ghu s ASP 80 N -2.08 7.05 0.00 1.40 1.11 -1.26 -2.99 116.67 119.91 1ghu s ASP 80 Ca 0.45 1.54 0.00 0.00 0.18 0.00 0.00 52.55 54.71 1ghu s ASP 80 Cb -0.13 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.32 1ghu s ASP 80 CO 0.20 -0.68 0.00 0.61 1.18 0.00 0.00 175.17 176.48 1ghu n GLY 81 N 3.41 3.43 3.63 0.21 0.00 -0.26 -4.69 105.19 110.92 1ghu n GLY 81 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 1ghu n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ghu s ALA 82 N -3.00 3.22 0.17 4.61 0.00 -1.16 -1.43 121.76 124.16 1ghu s ALA 82 Ca 0.00 0.94 0.08 0.00 0.00 0.00 0.00 51.96 52.98 1ghu s ALA 82 Cb 0.00 -3.93 -0.04 0.00 0.00 0.00 0.00 23.12 19.15 1ghu s ALA 82 CO 0.00 -2.08 -0.16 -0.59 0.00 0.00 0.00 175.76 172.93 1ghu s PHE 83 N 5.97 1.69 -0.07 0.00 -0.12 -1.18 -2.17 117.98 122.10 1ghu s PHE 83 Ca 0.89 -0.52 0.00 0.00 -0.05 0.00 0.00 56.93 57.25 1ghu s PHE 83 Cb -0.35 -0.83 0.02 0.00 -0.63 0.00 0.00 43.02 41.23 1ghu s PHE 83 CO 0.36 0.29 -0.06 -0.48 -0.05 0.00 0.00 175.22 175.29 1ghu s LEU 84 N -2.81 1.22 -0.25 -1.99 0.05 -0.60 -4.62 118.68 109.67 1ghu s LEU 84 Ca 0.16 -0.19 -0.23 0.00 0.05 0.00 0.00 54.13 53.92 1ghu s LEU 84 Cb -0.04 -0.61 -0.01 0.00 -2.05 0.00 0.00 46.19 43.47 1ghu s LEU 84 CO 0.06 -0.08 0.74 -0.63 -0.55 0.00 0.00 176.35 175.89 1ghu s ILE 85 N 1.25 4.90 0.19 1.48 1.01 -1.02 -2.14 121.20 126.86 1ghu s ILE 85 Ca -0.05 1.38 -0.09 0.00 0.00 0.00 0.00 60.65 61.89 1ghu s ILE 85 Cb -0.14 -4.04 -0.07 0.00 0.01 0.00 0.00 42.46 38.23 1ghu s ILE 85 CO -0.02 -0.03 0.50 0.00 0.00 0.00 0.00 174.94 175.39 1ghu s ARG 86 N 2.70 3.78 -0.22 2.79 1.70 -0.68 -3.16 118.95 125.85 1ghu s ARG 86 Ca 0.31 0.22 -0.20 0.00 -0.47 0.00 0.00 55.73 55.59 1ghu s ARG 86 Cb -0.15 -2.76 -0.02 0.00 -0.57 0.00 0.00 34.95 31.45 1ghu s ARG 86 CO 0.08 0.39 0.60 -2.00 -1.08 0.00 0.00 175.30 173.29 1ghu s GLU 87 N -2.59 4.16 -0.21 3.89 -6.30 -0.80 -1.36 118.70 115.49 1ghu s GLU 87 Ca 0.43 0.53 -0.29 0.00 -2.50 0.00 0.00 54.97 53.15 1ghu s GLU 87 Cb -0.12 -3.61 -0.04 0.00 0.00 0.00 0.00 34.13 30.36 1ghu s GLU 87 CO 0.21 -0.29 1.86 -1.12 0.02 0.00 0.00 175.26 175.94 1ghu s SER 88 N 1.32 6.04 -0.85 -1.70 0.01 -0.66 -4.14 113.70 113.71 1ghu s SER 88 Ca 0.26 1.76 -0.19 0.00 1.31 0.00 0.00 55.95 59.10 1ghu s SER 88 Cb -0.16 -2.52 0.13 0.00 0.21 0.00 0.00 66.02 63.68 1ghu s SER 88 CO 0.09 -1.52 1.04 -1.83 0.41 0.00 0.00 173.24 171.43 1ghu s GLU 89 N 5.31 3.48 0.00 12.44 -1.05 -1.26 -2.83 118.70 134.78 1ghu s GLU 89 Ca 0.83 -1.64 0.00 0.00 -0.15 0.00 0.00 54.97 54.01 1ghu s GLU 89 Cb -0.29 -4.72 0.00 0.00 -0.44 0.00 0.00 34.13 28.68 1ghu s GLU 89 CO 0.34 -1.72 0.00 -1.13 0.95 0.00 0.00 175.26 173.70 1ghu n SER 90 N 6.49 0.00 -3.72 0.83 3.41 -1.26 -5.04 113.62 114.32 1ghu n SER 90 Ca 0.16 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.47 1ghu n SER 90 Cb 0.48 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.28 1ghu n SER 90 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ghu s ALA 91 N 0.00 1.59 0.27 7.33 0.00 -1.13 -5.14 121.76 124.68 1ghu s ALA 91 Ca 0.00 -1.78 -0.30 0.00 0.00 0.00 0.00 51.96 49.87 1ghu s ALA 91 Cb 0.00 -1.65 -0.11 0.00 0.00 0.00 0.00 23.12 21.36 1ghu s ALA 91 CO 0.00 -1.72 1.55 -2.14 0.00 0.00 0.00 175.76 173.45 1ghu s PRO 92 N 1.46 4.17 0.00 0.00 0.02 -1.26 -2.45 135.00 136.94 1ghu s PRO 92 Ca 0.11 2.49 0.00 0.00 0.02 0.00 0.00 61.00 63.62 1ghu s PRO 92 Cb -0.18 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.28 1ghu s PRO 92 CO -0.22 -0.57 0.00 0.41 -0.33 0.00 0.00 177.00 176.29 1ghu n GLY 93 N 2.32 2.66 3.73 0.52 0.00 -1.26 -5.05 105.19 108.12 1ghu n GLY 93 Ca 0.08 -0.08 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1ghu n GLY 93 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ghu s ASP 94 N 0.45 7.49 0.45 1.61 1.01 -1.02 -5.00 116.67 121.64 1ghu s ASP 94 Ca 0.00 1.77 0.07 0.00 0.71 0.00 0.00 52.55 55.11 1ghu s ASP 94 Cb 0.00 -2.58 -0.01 0.00 1.01 0.00 0.00 42.92 41.34 1ghu s ASP 94 CO 0.00 -0.02 0.35 -0.36 0.21 0.00 0.00 175.17 175.36 1ghu s PHE 95 N -0.20 2.43 -0.11 4.23 0.08 -1.13 -1.65 117.98 121.63 1ghu s PHE 95 Ca 0.45 -0.59 -0.05 0.00 0.12 0.00 0.00 56.93 56.86 1ghu s PHE 95 Cb -0.23 -2.08 0.05 0.00 -0.57 0.00 0.00 43.02 40.19 1ghu s PHE 95 CO 0.29 -0.16 0.24 -1.12 -0.10 0.00 0.00 175.22 174.37 1ghu s SER 96 N -4.13 0.16 -0.37 1.36 0.01 -0.47 -1.61 113.70 108.65 1ghu s SER 96 Ca 0.44 0.53 -0.29 0.00 1.31 0.00 0.00 55.95 57.94 1ghu s SER 96 Cb -0.02 0.53 0.02 0.00 0.21 0.00 0.00 66.02 66.76 1ghu s SER 96 CO 0.26 -0.21 1.09 -0.22 0.41 0.00 0.00 173.24 174.57 1ghu s LEU 97 N 1.94 3.84 -0.43 2.44 2.96 -0.57 -1.69 118.68 127.17 1ghu s LEU 97 Ca -0.03 0.86 -0.16 0.00 -0.22 0.00 0.00 54.13 54.58 1ghu s LEU 97 Cb -0.11 -3.54 0.03 0.00 0.50 0.00 0.00 46.19 43.07 1ghu s LEU 97 CO -0.08 -1.00 0.38 -0.44 -1.32 0.00 0.00 176.35 173.89 1ghu s SER 98 N 1.91 6.15 -0.14 3.68 0.01 -0.91 -1.39 113.70 123.01 1ghu s SER 98 Ca 0.46 -0.91 -0.00 0.00 1.31 0.00 0.00 55.95 56.81 1ghu s SER 98 Cb -0.11 -2.19 0.03 0.00 0.21 0.00 0.00 66.02 63.96 1ghu s SER 98 CO 0.20 -0.55 -0.09 0.54 0.41 0.00 0.00 173.24 173.75 1ghu s VAL 99 N 1.87 1.24 -0.77 3.43 0.11 -0.85 -1.56 120.40 123.87 1ghu s VAL 99 Ca 0.08 -0.50 -0.23 0.00 -2.93 0.00 0.00 61.98 58.39 1ghu s VAL 99 Cb -0.19 -1.26 0.07 0.00 -1.53 0.00 0.00 36.38 33.46 1ghu s VAL 99 CO 0.11 0.33 1.13 -0.75 -3.33 0.00 0.00 175.10 172.59 1ghu s LYS 100 N 1.61 3.27 -0.13 1.54 2.36 -0.92 -1.49 119.74 125.98 1ghu s LYS 100 Ca 0.04 -0.87 0.02 0.00 -2.55 0.00 0.00 55.97 52.61 1ghu s LYS 100 Cb -0.13 -4.48 0.01 0.00 -1.05 0.00 0.00 37.83 32.18 1ghu s LYS 100 CO -0.09 -1.95 -0.19 0.12 1.55 0.00 0.00 175.35 174.79 1ghu s PHE 101 N 4.39 2.41 0.00 4.03 2.19 -0.95 -1.10 117.98 128.95 1ghu s PHE 101 Ca 0.30 -1.20 0.00 0.00 0.33 0.00 0.00 56.93 56.37 1ghu s PHE 101 Cb -0.10 -1.67 0.00 0.00 -1.31 0.00 0.00 43.02 39.94 1ghu s PHE 101 CO 0.06 -0.57 0.00 0.41 1.83 0.00 0.00 175.22 176.95 1ghu n GLY 102 N 4.14 1.68 2.40 13.12 0.00 -1.26 -3.59 105.19 121.68 1ghu n GLY 102 Ca -0.20 -0.37 -0.17 0.00 0.00 0.00 0.00 46.02 45.29 1ghu n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ghu n ASN 103 N 8.96 1.52 -3.63 1.61 3.02 -1.26 -4.79 115.26 120.68 1ghu n ASN 103 Ca 0.00 -3.03 -0.11 0.00 -0.03 0.00 0.00 54.58 51.41 1ghu n ASN 103 Cb 0.00 -0.58 -0.07 0.00 -0.61 0.00 0.00 39.78 38.52 1ghu n ASN 103 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1ghu s ASP 104 N -2.76 -0.85 -0.53 6.41 1.01 -1.24 -5.12 116.67 113.59 1ghu s ASP 104 Ca 0.38 1.48 -0.23 0.00 0.71 0.00 0.00 52.55 54.89 1ghu s ASP 104 Cb 0.37 1.43 0.04 0.00 1.01 0.00 0.00 42.92 45.78 1ghu s ASP 104 CO -0.06 -0.24 0.85 -0.69 0.21 0.00 0.00 175.17 175.24 1ghu s VAL 105 N 1.00 4.53 -0.29 -1.27 1.01 -1.26 -2.24 120.40 121.87 1ghu s VAL 105 Ca -0.05 0.09 -0.10 0.00 0.00 0.00 0.00 61.98 61.92 1ghu s VAL 105 Cb -0.05 -4.47 -0.03 0.00 0.00 0.00 0.00 36.38 31.84 1ghu s VAL 105 CO -0.09 -1.02 0.16 -1.10 0.00 0.00 0.00 175.10 173.05 1ghu s GLN 106 N 3.58 3.62 -0.36 2.72 -0.21 -0.55 -4.86 119.66 123.59 1ghu s GLN 106 Ca 0.26 -0.53 -0.16 0.00 0.02 0.00 0.00 55.36 54.95 1ghu s GLN 106 Cb -0.14 -3.59 -0.00 0.00 1.00 0.00 0.00 33.01 30.28 1ghu s GLN 106 CO 0.17 -0.30 0.38 -1.01 -2.12 0.00 0.00 175.29 172.42 1ghu s HIS 107 N 1.68 3.20 -0.22 0.91 3.76 -1.26 -2.00 115.29 121.36 1ghu s HIS 107 Ca 0.06 -0.11 -0.02 0.00 -0.15 0.00 0.00 55.06 54.84 1ghu s HIS 107 Cb -0.16 -2.73 0.01 0.00 1.11 0.00 0.00 32.58 30.81 1ghu s HIS 107 CO 0.08 -0.50 -0.09 -0.06 -0.85 0.00 0.00 174.74 173.32 1ghu s PHE 108 N 2.05 2.94 -0.10 1.40 0.08 -0.48 -4.99 117.98 118.87 1ghu s PHE 108 Ca 0.12 -1.33 -0.29 0.00 0.12 0.00 0.00 56.93 55.55 1ghu s PHE 108 Cb -0.17 -2.04 -0.01 0.00 -0.57 0.00 0.00 43.02 40.23 1ghu s PHE 108 CO 0.12 -0.68 0.98 0.21 -0.10 0.00 0.00 175.22 175.75 1ghu s LYS 109 N 1.38 4.42 -0.59 0.44 2.36 -1.26 -1.52 119.74 124.97 1ghu s LYS 109 Ca 0.04 1.34 -0.23 0.00 -2.55 0.00 0.00 55.97 54.57 1ghu s LYS 109 Cb -0.15 -3.54 0.06 0.00 -1.05 0.00 0.00 37.83 33.16 1ghu s LYS 109 CO -0.06 -0.28 0.89 0.08 1.55 0.00 0.00 175.35 177.53 1ghu s VAL 110 N 1.90 4.45 0.04 4.02 1.01 -0.63 -4.43 120.40 126.76 1ghu s VAL 110 Ca 0.47 -0.14 0.01 0.00 0.00 0.00 0.00 61.98 62.32 1ghu s VAL 110 Cb -0.18 -4.56 -0.04 0.00 0.00 0.00 0.00 36.38 31.60 1ghu s VAL 110 CO 0.18 -1.20 0.10 -1.48 0.00 0.00 0.00 175.10 172.70 1ghu s LEU 111 N 3.75 3.93 0.32 3.92 2.34 -0.97 -2.85 118.68 129.12 1ghu s LEU 111 Ca 0.24 0.11 0.02 0.00 0.06 0.00 0.00 54.13 54.56 1ghu s LEU 111 Cb -0.16 -2.45 -0.03 0.00 -0.56 0.00 0.00 46.19 43.00 1ghu s LEU 111 CO 0.14 0.22 0.50 -0.13 -1.06 0.00 0.00 176.35 176.02 1ghu s ARG 112 N -2.09 3.39 -0.44 1.48 0.52 -1.26 -1.73 118.95 118.82 1ghu s ARG 112 Ca 0.27 -0.54 0.02 0.00 -0.52 0.00 0.00 55.73 54.96 1ghu s ARG 112 Cb -0.12 -2.73 0.15 0.00 0.52 0.00 0.00 34.95 32.76 1ghu s ARG 112 CO 0.19 0.18 0.28 0.16 0.02 0.00 0.00 175.30 176.13 1ghu s ASP 113 N -4.05 3.13 -0.03 0.23 -4.77 -1.07 -4.95 116.67 105.16 1ghu s ASP 113 Ca 0.39 -2.73 -0.02 0.00 -3.30 0.00 0.00 52.55 46.90 1ghu s ASP 113 Cb -0.09 -0.81 0.01 0.00 -1.09 0.00 0.00 42.92 40.93 1ghu s ASP 113 CO 0.34 -0.24 0.04 0.61 0.70 0.00 0.00 175.17 176.61 1ghu n GLY 114 N 3.37 -3.30 5.12 2.12 0.00 -1.26 -4.33 105.19 106.91 1ghu n GLY 114 Ca 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1ghu n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ghu n ALA 115 N 0.26 0.00 -2.70 4.61 0.00 -1.26 -4.26 120.51 117.17 1ghu n ALA 115 Ca -0.06 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.32 1ghu n ALA 115 Cb 0.10 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.62 1ghu n ALA 115 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ghu n GLY 116 N 0.00 -1.00 3.19 0.00 0.00 -1.26 -5.09 105.19 101.03 1ghu n GLY 116 Ca 0.00 0.65 -0.40 0.00 0.00 0.00 0.00 46.02 46.27 1ghu n GLY 116 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ghu s LYS 117 N 0.28 2.75 -0.07 1.61 3.01 -1.26 -4.44 119.74 121.62 1ghu s LYS 117 Ca 0.27 -2.21 -0.30 0.00 -1.01 0.00 0.00 55.97 52.71 1ghu s LYS 117 Cb 0.23 -3.96 -0.02 0.00 -1.01 0.00 0.00 37.83 33.08 1ghu s LYS 117 CO -0.14 -1.20 1.02 0.71 0.51 0.00 0.00 175.35 176.24 1ghu s TYR 118 N 0.55 3.52 -0.14 3.18 2.02 -0.11 -2.61 117.35 123.76 1ghu s TYR 118 Ca 0.13 1.58 -0.05 0.00 -0.37 0.00 0.00 57.07 58.36 1ghu s TYR 118 Cb -0.20 -3.20 0.07 0.00 -0.40 0.00 0.00 41.96 38.23 1ghu s TYR 118 CO -0.04 -0.29 0.29 -0.59 -1.57 0.00 0.00 175.55 173.35 1ghu s PHE 119 N 1.74 -0.49 -0.21 2.71 -0.71 -0.71 -1.42 117.98 118.89 1ghu s PHE 119 Ca 0.50 1.06 -0.02 0.00 -1.04 0.00 0.00 56.93 57.44 1ghu s PHE 119 Cb -0.20 0.04 -0.12 0.00 -1.21 0.00 0.00 43.02 41.53 1ghu s PHE 119 CO 0.21 -0.37 -0.21 1.47 -1.34 0.00 0.00 175.22 174.99 1ghu n LEU 120 N 5.22 2.60 0.00 -1.99 -0.00 -1.26 -2.30 117.00 119.28 1ghu n LEU 120 Ca -0.09 -0.01 0.00 0.00 -0.00 0.00 0.00 56.01 55.91 1ghu n LEU 120 Cb 0.50 -0.69 0.00 0.00 -0.00 0.00 0.00 43.42 43.23 1ghu n LEU 120 CO 0.03 0.74 0.00 1.87 -0.00 0.00 0.00 177.39 180.03 1ghu n TRP 121 N -3.32 0.00 0.05 1.47 -0.00 -1.26 -4.93 117.44 109.45 1ghu n TRP 121 Ca -0.38 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.12 1ghu n TRP 121 Cb 0.86 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 32.17 1ghu n TRP 121 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 1ghu n VAL 122 N -0.48 0.02 -2.73 5.87 0.31 -1.26 -5.00 118.33 115.06 1ghu n VAL 122 Ca 0.00 0.01 -0.41 0.00 -0.01 0.00 0.00 64.34 63.93 1ghu n VAL 122 Cb 0.00 -0.22 -0.05 0.00 -0.91 0.00 0.00 33.84 32.66 1ghu n VAL 122 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1ghu s VAL 123 N -1.35 4.24 0.49 2.52 0.11 -1.26 -5.04 120.40 120.11 1ghu s VAL 123 Ca 0.00 2.06 -0.03 0.00 -2.93 0.00 0.00 61.98 61.07 1ghu s VAL 123 Cb 0.00 -4.31 -0.02 0.00 -1.53 0.00 0.00 36.38 30.52 1ghu s VAL 123 CO 0.00 0.41 0.76 -1.59 -3.33 0.00 0.00 175.10 171.35 1ghu s LYS 124 N -0.65 3.25 -0.11 1.54 -2.85 -1.26 -4.74 119.74 114.91 1ghu s LYS 124 Ca 0.44 -0.09 -0.04 0.00 -1.00 0.00 0.00 55.97 55.28 1ghu s LYS 124 Cb -0.25 -2.43 0.06 0.00 -2.06 0.00 0.00 37.83 33.15 1ghu s LYS 124 CO 0.31 -0.31 0.23 -0.06 0.10 0.00 0.00 175.35 175.63 1ghu s PHE 125 N -2.71 -0.35 0.18 1.78 0.08 -0.51 -4.95 117.98 111.50 1ghu s PHE 125 Ca 0.48 0.86 -0.13 0.00 0.12 0.00 0.00 56.93 58.26 1ghu s PHE 125 Cb -0.10 -0.10 0.08 0.00 -0.57 0.00 0.00 43.02 42.32 1ghu s PHE 125 CO 0.42 -0.33 1.80 -0.91 -0.10 0.00 0.00 175.22 176.11 1ghu h ASN 126 N 8.29 0.70 -2.92 1.36 2.35 -1.86 -0.27 115.58 123.23 1ghu h ASN 126 Ca -0.14 -0.07 -0.63 0.00 -0.55 0.00 0.00 56.30 54.91 1ghu h ASN 126 Cb 1.12 -0.18 -0.07 0.00 0.05 0.00 0.00 38.32 39.24 1ghu h ASN 126 CO 0.14 0.57 -0.34 -0.44 -1.65 0.00 0.00 177.43 175.71 1ghu s SER 127 N -5.83 6.57 0.36 5.81 0.01 -1.26 -4.73 113.70 114.63 1ghu s SER 127 Ca -0.13 0.68 0.09 0.00 1.31 0.00 0.00 55.95 57.90 1ghu s SER 127 Cb 0.13 -2.17 0.69 0.00 0.21 0.00 0.00 66.02 64.88 1ghu s SER 127 CO 0.76 0.32 1.85 0.25 0.41 0.00 0.00 173.24 176.83 1ghu h LEU 128 N 5.17 0.21 -0.87 2.44 5.85 -1.95 -2.83 115.31 123.33 1ghu h LEU 128 Ca -0.51 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.17 1ghu h LEU 128 Cb 1.21 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 42.14 1ghu h LEU 128 CO 0.63 0.45 0.57 -1.13 -0.34 0.00 0.00 178.44 178.62 1ghu h ASN 129 N 0.20 0.98 -0.49 1.25 -0.73 -1.99 -2.70 115.58 112.11 1ghu h ASN 129 Ca 0.03 -0.02 -0.08 0.00 1.87 0.00 0.00 56.30 58.10 1ghu h ASN 129 Cb 0.52 -0.24 -0.02 0.00 0.27 0.00 0.00 38.32 38.84 1ghu h ASN 129 CO 0.04 0.70 -0.00 -0.33 -0.37 0.00 0.00 177.43 177.47 1ghu h GLU 130 N 1.16 0.92 0.16 6.67 4.39 -1.96 -2.81 114.58 123.11 1ghu h GLU 130 Ca 0.32 -0.27 0.01 0.00 0.34 0.00 0.00 59.36 59.76 1ghu h GLU 130 Cb -0.10 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.43 1ghu h GLU 130 CO -0.08 0.91 -0.20 1.25 -1.16 0.00 0.00 179.01 179.73 1ghu h LEU 131 N 0.85 -0.54 0.04 1.33 6.46 -1.42 -2.65 115.31 119.37 1ghu h LEU 131 Ca 0.16 0.06 -0.00 0.00 -0.12 0.00 0.00 57.88 57.97 1ghu h LEU 131 Cb 0.50 0.20 0.00 0.00 -0.73 0.00 0.00 40.66 40.63 1ghu h LEU 131 CO 0.02 -0.29 -0.02 1.62 -0.62 0.00 0.00 178.44 179.15 1ghu h VAL 132 N -0.41 1.12 -0.63 1.05 3.04 -1.55 -2.66 116.25 116.22 1ghu h VAL 132 Ca 0.01 -0.52 -0.01 0.00 -1.01 0.00 0.00 66.70 65.16 1ghu h VAL 132 Cb 0.40 1.47 -0.03 0.00 -2.01 0.00 0.00 31.29 31.13 1ghu h VAL 132 CO -0.07 0.13 0.34 -0.78 -1.01 0.00 0.00 177.57 176.18 1ghu h ASP 133 N -0.28 0.77 0.32 3.17 3.58 -1.62 -1.56 116.42 120.80 1ghu h ASP 133 Ca -0.01 -0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.37 1ghu h ASP 133 Cb 0.26 -0.20 -0.00 0.00 1.72 0.00 0.00 39.33 41.11 1ghu h ASP 133 CO 0.01 0.63 -0.17 0.22 -2.88 0.00 0.00 179.24 177.05 1ghu h TYR 134 N 0.88 -0.44 0.00 0.28 3.20 -1.51 -3.24 116.97 116.13 1ghu h TYR 134 Ca 0.22 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.09 1ghu h TYR 134 Cb 0.03 0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.46 1ghu h TYR 134 CO 0.01 -0.27 0.00 0.72 -1.64 0.00 0.00 178.16 176.97 1ghu n HIS 135 N -5.30 0.00 0.06 -3.82 8.25 -1.00 -2.43 115.22 110.98 1ghu n HIS 135 Ca -0.10 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.46 1ghu n HIS 135 Cb 0.21 -0.45 0.56 0.00 1.12 0.00 0.00 29.99 31.42 1ghu n HIS 135 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ghu h ARG 136 N 0.00 0.24 0.01 -0.41 3.08 -1.31 -3.15 114.38 112.84 1ghu h ARG 136 Ca 0.00 -0.01 -0.41 0.00 0.07 0.00 0.00 59.98 59.63 1ghu h ARG 136 Cb 0.26 -0.05 -0.07 0.00 0.08 0.00 0.00 29.97 30.19 1ghu h ARG 136 CO 0.00 0.16 -2.45 0.43 -1.07 0.00 0.00 179.97 177.04 1ghu n SER 137 N -4.48 1.98 -4.89 7.04 7.64 -1.19 -3.93 113.62 115.80 1ghu n SER 137 Ca 0.04 0.01 -0.29 0.00 1.01 0.00 0.00 58.87 59.64 1ghu n SER 137 Cb 0.24 -0.55 -0.03 0.00 -1.01 0.00 0.00 64.21 62.86 1ghu n SER 137 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1ghu s THR 138 N -2.52 4.87 -0.02 0.44 2.01 -1.02 -4.94 115.64 114.47 1ghu s THR 138 Ca -0.35 0.40 -0.30 0.00 0.31 0.00 0.00 61.69 61.75 1ghu s THR 138 Cb 0.10 -3.76 -0.03 0.00 0.01 0.00 0.00 72.50 68.83 1ghu s THR 138 CO 0.58 -0.53 1.00 -0.55 -0.69 0.00 0.00 174.62 174.44 1ghu s SER 139 N -3.33 7.33 0.19 3.53 0.15 -1.26 -4.48 113.70 115.83 1ghu s SER 139 Ca 0.49 1.66 -0.04 0.00 0.70 0.00 0.00 55.95 58.76 1ghu s SER 139 Cb -0.10 -2.57 0.12 0.00 -1.71 0.00 0.00 66.02 61.76 1ghu s SER 139 CO 0.33 -0.31 1.53 -0.37 1.20 0.00 0.00 173.24 175.62 1ghu h VAL 140 N 4.84 1.30 -3.35 4.45 -1.51 -1.83 -3.45 116.25 116.70 1ghu h VAL 140 Ca -0.39 -1.67 -0.55 0.00 -1.23 0.00 0.00 66.70 62.85 1ghu h VAL 140 Cb 1.21 1.62 -0.04 0.00 -2.13 0.00 0.00 31.29 31.95 1ghu h VAL 140 CO 0.77 0.53 0.05 -0.55 -1.23 0.00 0.00 177.57 177.14 1ghu s SER 141 N -6.88 7.19 -0.04 4.19 0.15 -1.26 -4.29 113.70 112.75 1ghu s SER 141 Ca -0.08 1.41 -0.25 0.00 0.70 0.00 0.00 55.95 57.73 1ghu s SER 141 Cb 0.12 -2.41 -0.21 0.00 -1.71 0.00 0.00 66.02 61.80 1ghu s SER 141 CO 0.84 0.25 1.13 -0.09 1.20 0.00 0.00 173.24 176.56 1ghu h ARG 142 N 4.43 0.09 0.30 5.44 2.43 -1.95 -3.38 114.38 121.74 1ghu h ARG 142 Ca -0.49 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 58.60 1ghu h ARG 142 Cb 1.21 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 1ghu h ARG 142 CO 0.64 0.73 -0.14 -0.97 -1.51 0.00 0.00 179.97 178.72 1ghu h ASN 143 N -0.52 -0.34 -4.19 -3.80 -1.24 -2.00 -3.47 115.58 100.02 1ghu h ASN 143 Ca -0.01 -0.12 -0.47 0.00 0.71 0.00 0.00 56.30 56.41 1ghu h ASN 143 Cb 0.74 0.09 0.02 0.00 0.73 0.00 0.00 38.32 39.90 1ghu h ASN 143 CO 0.02 0.13 0.38 -1.10 -1.29 0.00 0.00 177.43 175.57 1ghu s GLN 144 N -3.32 3.94 -0.53 6.67 -0.21 -1.26 -5.05 119.66 119.91 1ghu s GLN 144 Ca -0.09 0.96 -0.19 0.00 0.02 0.00 0.00 55.36 56.06 1ghu s GLN 144 Cb 0.01 -2.13 0.07 0.00 1.00 0.00 0.00 33.01 31.95 1ghu s GLN 144 CO 0.32 -0.28 0.66 -1.14 -2.12 0.00 0.00 175.29 172.73 1ghu s GLN 145 N -4.06 3.11 -0.31 2.91 0.74 -1.26 -4.29 119.66 116.49 1ghu s GLN 145 Ca 0.59 -0.99 0.02 0.00 0.05 0.00 0.00 55.36 55.04 1ghu s GLN 145 Cb -0.10 -4.14 0.09 0.00 1.10 0.00 0.00 33.01 29.96 1ghu s GLN 145 CO 0.31 -1.32 0.03 0.42 -0.55 0.00 0.00 175.29 174.19 1ghu s ILE 146 N 2.69 1.85 -0.16 -2.34 -1.09 -1.26 -5.06 121.20 115.83 1ghu s ILE 146 Ca 0.14 -1.92 -0.08 0.00 -2.23 0.00 0.00 60.65 56.57 1ghu s ILE 146 Cb -0.20 -2.30 -0.04 0.00 -1.58 0.00 0.00 42.46 38.33 1ghu s ILE 146 CO 0.11 -0.50 0.11 -0.36 -1.23 0.00 0.00 174.94 173.07 1ghu s PHE 147 N 1.15 3.41 -0.23 3.97 0.08 -1.26 -2.95 117.98 122.14 1ghu s PHE 147 Ca 0.07 0.32 -0.21 0.00 0.12 0.00 0.00 56.93 57.23 1ghu s PHE 147 Cb -0.19 -2.05 -0.02 0.00 -0.57 0.00 0.00 43.02 40.19 1ghu s PHE 147 CO -0.11 0.40 0.64 -0.51 -0.10 0.00 0.00 175.22 175.53 1ghu s LEU 148 N -0.12 4.10 0.39 -0.37 1.02 -1.19 -4.11 118.68 118.39 1ghu s LEU 148 Ca 0.09 0.77 0.08 0.00 0.02 0.00 0.00 54.13 55.09 1ghu s LEU 148 Cb -0.12 -2.88 -0.07 0.00 0.02 0.00 0.00 46.19 43.14 1ghu s LEU 148 CO 0.00 -0.33 -0.00 -0.13 0.02 0.00 0.00 176.35 175.91 1ghu s ARG 149 N 2.27 1.95 0.51 1.70 3.00 -0.51 -4.48 118.95 123.39 1ghu s ARG 149 Ca 0.27 -2.02 -0.09 0.00 0.00 0.00 0.00 55.73 53.89 1ghu s ARG 149 Cb -0.16 -1.70 -0.05 0.00 0.00 0.00 0.00 34.95 33.04 1ghu s ARG 149 CO 0.09 0.00 0.88 0.34 0.00 0.00 0.00 175.30 176.62 1ghu s ASP 150 N -3.70 6.35 0.87 0.23 2.15 -1.26 -3.09 116.67 118.23 1ghu s ASP 150 Ca 0.35 1.20 -0.11 0.00 0.43 0.00 0.00 52.55 54.42 1ghu s ASP 150 Cb 0.07 -2.36 0.12 0.00 -0.30 0.00 0.00 42.92 40.44 1ghu s ASP 150 CO 0.18 -0.63 1.10 0.27 -0.17 0.00 0.00 175.17 175.92 1ghu s ILE 151 N -2.78 2.73 -2.44 4.11 -5.25 -1.26 -4.55 121.20 111.77 1ghu s ILE 151 Ca 0.52 0.24 0.29 0.00 -0.99 0.00 0.00 60.65 60.70 1ghu s ILE 151 Cb -0.10 -2.58 0.60 0.00 2.95 0.00 0.00 42.46 43.32 1ghu s ILE 151 CO 0.43 -0.31 1.81 1.21 -1.79 0.00 0.00 174.94 176.29