#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 6.80 0.00 1.61 1.04 -1.26 -4.80 113.70 117.09 1ghu s SER 59 Ca 0.00 0.99 0.00 0.00 0.48 0.00 0.00 55.95 57.42 1ghu s SER 59 Cb 0.00 -2.42 0.00 0.00 0.10 0.00 0.00 66.02 63.70 1ghu s SER 59 CO 0.00 -0.48 0.00 -2.67 0.98 0.00 0.00 173.24 171.07 1ghu n TRP 60 N 5.91 -0.90 -2.90 5.02 2.14 -1.26 -3.57 117.44 121.87 1ghu n TRP 60 Ca 0.04 0.00 -0.39 0.00 2.07 0.00 0.00 57.50 59.23 1ghu n TRP 60 Cb 0.48 0.22 -0.06 0.00 -0.81 0.00 0.00 31.31 31.14 1ghu n TRP 60 CO 0.00 0.00 0.00 0.12 2.07 0.00 0.00 177.69 179.88 1ghu s PHE 61 N -1.44 3.87 0.00 -2.67 5.36 -1.26 -2.43 117.98 119.42 1ghu s PHE 61 Ca 0.00 1.71 0.00 0.00 -0.96 0.00 0.00 56.93 57.68 1ghu s PHE 61 Cb 0.00 -2.83 0.00 0.00 -0.34 0.00 0.00 43.02 39.85 1ghu s PHE 61 CO 0.00 0.44 0.00 1.19 -1.46 0.00 0.00 175.22 175.39 1ghu n PHE 62 N 1.33 0.00 0.00 10.12 3.01 -1.02 -4.96 117.46 125.93 1ghu n PHE 62 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.43 1ghu n PHE 62 Cb 0.49 0.00 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 3.48 0.50 2.78 1.37 0.00 -1.26 -4.97 105.19 107.09 1ghu n GLY 63 Ca 0.00 -0.77 -0.01 0.00 0.00 0.00 0.00 46.02 45.24 1ghu n GLY 63 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ghu n LYS 64 N 0.47 -1.19 -4.34 1.61 5.02 -1.18 -4.80 118.16 113.75 1ghu n LYS 64 Ca 0.00 1.39 -0.26 0.00 -2.02 0.00 0.00 58.31 57.42 1ghu n LYS 64 Cb 0.00 -5.05 -0.13 0.00 -0.02 0.00 0.00 35.03 29.84 1ghu n LYS 64 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1ghu s ILE 65 N -2.93 1.97 0.82 -0.18 -4.36 -1.26 -4.99 121.20 110.27 1ghu s ILE 65 Ca 0.02 -1.68 -0.11 0.00 -0.26 0.00 0.00 60.65 58.62 1ghu s ILE 65 Cb -0.01 -1.78 0.09 0.00 1.25 0.00 0.00 42.46 42.01 1ghu s ILE 65 CO 0.63 -0.02 1.09 -2.16 0.24 0.00 0.00 174.94 174.72 1ghu s PRO 66 N -2.06 1.86 0.19 0.37 0.04 -1.26 -4.90 135.00 129.23 1ghu s PRO 66 Ca 0.11 0.79 -0.10 0.00 0.04 0.00 0.00 61.00 61.83 1ghu s PRO 66 Cb -0.10 -1.88 0.11 0.00 0.04 0.00 0.00 34.50 32.67 1ghu s PRO 66 CO 0.05 -1.82 1.75 -0.09 0.04 0.00 0.00 177.00 176.94 1ghu h ARG 67 N -1.24 1.00 -0.27 4.56 2.43 -2.01 -2.71 114.38 116.14 1ghu h ARG 67 Ca -0.47 -0.17 -0.02 0.00 -0.81 0.00 0.00 59.98 58.50 1ghu h ARG 67 Cb 1.27 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.64 1ghu h ARG 67 CO 0.56 0.82 0.07 0.00 -1.51 0.00 0.00 179.97 179.92 1ghu h ALA 68 N 1.12 0.35 -0.43 2.80 0.00 -1.99 -2.07 119.26 119.04 1ghu h ALA 68 Ca 0.22 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1ghu h ALA 68 Cb 0.19 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1ghu h ALA 68 CO -0.02 0.00 0.10 0.87 0.00 0.00 0.00 179.25 180.20 1ghu h LYS 69 N 0.27 0.64 -0.44 0.00 1.57 -1.97 -1.95 116.57 114.69 1ghu h LYS 69 Ca 0.09 -0.12 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1ghu h LYS 69 Cb 0.27 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 1ghu h LYS 69 CO -0.00 0.59 0.20 0.00 -0.57 0.00 0.00 179.45 179.67 1ghu h ALA 70 N 1.48 0.57 -0.82 3.86 0.00 -1.43 -2.66 119.26 120.26 1ghu h ALA 70 Ca 0.14 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1ghu h ALA 70 Cb 0.25 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1ghu h ALA 70 CO -0.00 0.15 0.43 0.93 0.00 0.00 0.00 179.25 180.76 1ghu h GLU 71 N 0.57 1.16 0.03 0.00 5.08 -1.33 -2.84 114.58 117.26 1ghu h GLU 71 Ca 0.15 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ghu h GLU 71 Cb 0.15 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1ghu h GLU 71 CO -0.02 0.87 -0.02 0.93 -1.00 0.00 0.00 179.01 179.78 1ghu h GLU 72 N 1.15 -0.04 -0.50 2.33 5.08 -1.35 -2.17 114.58 119.08 1ghu h GLU 72 Ca 0.29 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.63 1ghu h GLU 72 Cb 0.07 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 1ghu h GLU 72 CO -0.04 0.04 0.22 0.52 -1.00 0.00 0.00 179.01 178.75 1ghu h MET 73 N -0.12 0.73 -0.51 2.33 2.86 -1.54 -2.85 114.93 115.83 1ghu h MET 73 Ca -0.00 -0.12 -0.06 0.00 -2.06 0.00 0.00 59.70 57.45 1ghu h MET 73 Cb 0.11 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 1ghu h MET 73 CO 0.01 0.64 0.08 -0.07 1.06 0.00 0.00 176.91 178.63 1ghu h LEU 74 N 0.66 0.81 -1.34 1.22 4.07 -1.58 -3.08 115.31 116.07 1ghu h LEU 74 Ca 0.17 -0.26 0.12 0.00 0.08 0.00 0.00 57.88 57.99 1ghu h LEU 74 Cb 0.16 -0.22 -0.06 0.00 1.08 0.00 0.00 40.66 41.63 1ghu h LEU 74 CO -0.02 0.87 0.55 0.28 -1.08 0.00 0.00 178.44 179.03 1ghu h SER 75 N 0.72 0.63 -0.36 -0.43 0.02 -1.40 -2.41 113.55 110.32 1ghu h SER 75 Ca 0.15 0.03 -0.04 0.00 -0.84 0.00 0.00 61.79 61.09 1ghu h SER 75 Cb 0.40 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 1ghu h SER 75 CO 0.01 0.35 0.09 0.11 -1.14 0.00 0.00 176.83 176.25 1ghu h LYS 76 N 0.69 0.66 -6.52 3.45 1.57 -1.44 -3.44 116.57 111.53 1ghu h LYS 76 Ca 0.41 -0.12 -0.53 0.00 -1.87 0.00 0.00 60.65 58.54 1ghu h LYS 76 Cb 0.62 -0.11 0.03 0.00 0.08 0.00 0.00 32.23 32.85 1ghu h LYS 76 CO -0.17 0.61 1.00 -0.65 -0.57 0.00 0.00 179.45 179.67 1ghu s GLN 77 N -5.15 4.18 0.38 3.15 1.11 -0.91 -4.96 119.66 117.47 1ghu s GLN 77 Ca -0.09 2.43 0.28 0.00 0.01 0.00 0.00 55.36 57.99 1ghu s GLN 77 Cb 0.16 -3.43 1.25 0.00 -1.01 0.00 0.00 33.01 29.97 1ghu s GLN 77 CO 0.78 -0.73 1.83 0.07 0.01 0.00 0.00 175.29 177.25 1ghu h ARG 78 N 7.84 0.00 -6.29 2.91 0.11 -1.85 -3.47 114.38 113.63 1ghu h ARG 78 Ca -0.43 0.00 -0.56 0.00 0.10 0.00 0.00 59.98 59.08 1ghu h ARG 78 Cb 1.21 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 32.25 1ghu h ARG 78 CO 0.93 0.00 -0.05 -1.01 0.10 0.00 0.00 179.97 179.94 1ghu s HIS 79 N -3.52 3.71 -0.01 4.08 3.76 -1.26 -5.07 115.29 116.98 1ghu s HIS 79 Ca 0.01 1.19 -0.30 0.00 -0.15 0.00 0.00 55.06 55.81 1ghu s HIS 79 Cb 0.09 -2.45 -0.04 0.00 1.11 0.00 0.00 32.58 31.29 1ghu s HIS 79 CO 0.40 0.51 1.16 0.34 -0.85 0.00 0.00 174.74 176.30 1ghu s ASP 80 N -1.39 7.11 0.00 1.40 2.15 -1.26 -3.19 116.67 121.49 1ghu s ASP 80 Ca 0.33 1.84 0.00 0.00 0.43 0.00 0.00 52.55 55.15 1ghu s ASP 80 Cb -0.17 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 39.88 1ghu s ASP 80 CO 0.19 -0.50 0.00 0.61 -0.17 0.00 0.00 175.17 175.30 1ghu n GLY 81 N 3.24 0.74 3.63 2.66 0.00 -0.71 -4.52 105.19 110.23 1ghu n GLY 81 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.43 3.27 0.18 4.61 0.00 -1.16 -1.52 121.76 124.71 1ghu s ALA 82 Ca 0.00 0.45 0.07 0.00 0.00 0.00 0.00 51.96 52.48 1ghu s ALA 82 Cb 0.00 -3.85 -0.04 0.00 0.00 0.00 0.00 23.12 19.23 1ghu s ALA 82 CO 0.00 -1.94 -0.14 -0.59 0.00 0.00 0.00 175.76 173.08 1ghu s PHE 83 N 5.16 1.60 0.10 0.00 -0.12 -1.17 -1.27 117.98 122.28 1ghu s PHE 83 Ca 0.71 -0.59 0.02 0.00 -0.05 0.00 0.00 56.93 57.02 1ghu s PHE 83 Cb -0.24 -0.77 -0.04 0.00 -0.63 0.00 0.00 43.02 41.33 1ghu s PHE 83 CO 0.29 0.28 -0.08 -0.48 -0.05 0.00 0.00 175.22 175.18 1ghu s LEU 84 N -3.07 2.47 -0.27 -1.99 0.05 -0.63 -4.18 118.68 111.06 1ghu s LEU 84 Ca 0.18 -0.93 -0.02 0.00 0.05 0.00 0.00 54.13 53.42 1ghu s LEU 84 Cb -0.01 -0.14 0.03 0.00 -2.05 0.00 0.00 46.19 44.01 1ghu s LEU 84 CO 0.05 -0.39 -0.03 -0.63 -0.55 0.00 0.00 176.35 174.80 1ghu s ILE 85 N -3.17 3.02 -0.10 1.48 1.09 -1.02 -1.52 121.20 120.98 1ghu s ILE 85 Ca 0.09 -1.09 -0.06 0.00 -1.10 0.00 0.00 60.65 58.49 1ghu s ILE 85 Cb 0.02 -2.59 -0.04 0.00 -1.06 0.00 0.00 42.46 38.79 1ghu s ILE 85 CO -0.03 0.10 0.12 0.00 -0.10 0.00 0.00 174.94 175.03 1ghu s ARG 86 N 1.32 3.35 0.21 2.79 1.70 -0.83 -2.45 118.95 125.04 1ghu s ARG 86 Ca -0.01 -0.20 -0.30 0.00 -0.47 0.00 0.00 55.73 54.75 1ghu s ARG 86 Cb -0.18 -3.11 -0.08 0.00 -0.57 0.00 0.00 34.95 31.02 1ghu s ARG 86 CO -0.03 0.75 0.96 -2.00 -1.08 0.00 0.00 175.30 173.91 1ghu s GLU 87 N -1.10 4.80 0.10 3.89 2.12 -1.26 -1.31 118.70 125.94 1ghu s GLU 87 Ca 0.16 1.50 -0.31 0.00 0.36 0.00 0.00 54.97 56.68 1ghu s GLU 87 Cb -0.12 -3.30 -0.08 0.00 0.26 0.00 0.00 34.13 30.89 1ghu s GLU 87 CO 0.05 0.41 1.51 -1.12 -0.54 0.00 0.00 175.26 175.57 1ghu s SER 88 N -0.81 6.70 0.03 -1.70 0.01 -0.63 -3.10 113.70 114.20 1ghu s SER 88 Ca 0.43 2.43 -0.25 0.00 1.31 0.00 0.00 55.95 59.87 1ghu s SER 88 Cb -0.26 -2.58 -0.18 0.00 0.21 0.00 0.00 66.02 63.22 1ghu s SER 88 CO 0.32 -0.77 1.47 -0.33 0.41 0.00 0.00 173.24 174.34 1ghu h GLU 89 N 7.29 -0.09 -0.72 12.44 3.07 -1.91 -3.17 114.58 131.50 1ghu h GLU 89 Ca -0.42 0.01 -0.06 0.00 -0.50 0.00 0.00 59.36 58.39 1ghu h GLU 89 Cb 1.20 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 29.10 1ghu h GLU 89 CO 0.90 0.16 0.20 1.03 -1.40 0.00 0.00 179.01 179.91 1ghu h SER 90 N -0.34 1.06 -3.78 1.42 0.87 -1.99 -3.41 113.55 107.39 1ghu h SER 90 Ca -0.01 -0.22 -0.70 0.00 -1.23 0.00 0.00 61.79 59.63 1ghu h SER 90 Cb 0.30 -0.28 -0.34 0.00 -0.44 0.00 0.00 62.40 61.64 1ghu h SER 90 CO 0.02 1.00 -0.43 0.00 -0.53 0.00 0.00 176.83 176.89 1ghu s ALA 91 N -5.37 3.41 0.08 6.23 0.00 -1.20 -5.10 121.76 119.82 1ghu s ALA 91 Ca -0.12 -2.90 -0.31 0.00 0.00 0.00 0.00 51.96 48.63 1ghu s ALA 91 Cb 0.15 -2.60 -0.07 0.00 0.00 0.00 0.00 23.12 20.59 1ghu s ALA 91 CO 0.84 -1.97 1.35 -1.25 0.00 0.00 0.00 175.76 174.74 1ghu s PRO 92 N 0.57 4.34 0.00 0.00 0.04 -1.24 -2.76 135.00 135.94 1ghu s PRO 92 Ca 0.12 1.99 0.00 0.00 0.04 0.00 0.00 61.00 63.16 1ghu s PRO 92 Cb -0.22 -3.32 0.00 0.00 0.04 0.00 0.00 34.50 31.00 1ghu s PRO 92 CO -0.04 -0.42 0.00 0.41 0.04 0.00 0.00 177.00 176.99 1ghu n GLY 93 N 3.46 2.56 3.73 0.56 0.00 -1.26 -5.07 105.19 109.16 1ghu n GLY 93 Ca 0.11 -0.54 -0.40 0.00 0.00 0.00 0.00 46.02 45.19 1ghu n GLY 93 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ghu s ASP 94 N 0.08 7.20 0.39 1.61 2.15 -1.11 -4.55 116.67 122.44 1ghu s ASP 94 Ca 0.00 1.44 0.08 0.00 0.43 0.00 0.00 52.55 54.50 1ghu s ASP 94 Cb 0.00 -2.48 -0.06 0.00 -0.30 0.00 0.00 42.92 40.08 1ghu s ASP 94 CO 0.00 -0.10 0.09 -0.36 -0.17 0.00 0.00 175.17 174.62 1ghu s PHE 95 N 0.50 2.57 -0.18 -5.34 0.08 -0.63 -1.60 117.98 113.38 1ghu s PHE 95 Ca 0.42 -0.55 -0.04 0.00 0.12 0.00 0.00 56.93 56.89 1ghu s PHE 95 Cb -0.20 -1.75 0.09 0.00 -0.57 0.00 0.00 43.02 40.58 1ghu s PHE 95 CO 0.23 0.34 0.23 -1.12 -0.10 0.00 0.00 175.22 174.80 1ghu s SER 96 N -3.80 1.08 -0.57 1.36 0.01 -0.43 -1.58 113.70 109.77 1ghu s SER 96 Ca 0.38 -0.00 -0.23 0.00 1.31 0.00 0.00 55.95 57.41 1ghu s SER 96 Cb 0.04 0.46 0.05 0.00 0.21 0.00 0.00 66.02 66.78 1ghu s SER 96 CO 0.21 -0.30 0.88 -0.22 0.41 0.00 0.00 173.24 174.21 1ghu s LEU 97 N 2.35 4.37 -0.26 2.44 2.96 -0.27 -1.97 118.68 128.30 1ghu s LEU 97 Ca 0.06 -0.63 -0.27 0.00 -0.22 0.00 0.00 54.13 53.07 1ghu s LEU 97 Cb -0.15 -2.65 0.00 0.00 0.50 0.00 0.00 46.19 43.90 1ghu s LEU 97 CO -0.11 -1.20 0.94 -0.44 -1.32 0.00 0.00 176.35 174.22 1ghu s SER 98 N 3.01 6.93 -0.10 3.68 0.01 -0.57 -1.42 113.70 125.23 1ghu s SER 98 Ca 0.25 1.12 0.00 0.00 1.31 0.00 0.00 55.95 58.64 1ghu s SER 98 Cb -0.15 -2.49 0.02 0.00 0.21 0.00 0.00 66.02 63.61 1ghu s SER 98 CO 0.15 -0.64 -0.09 -0.69 0.41 0.00 0.00 173.24 172.39 1ghu s VAL 99 N 3.11 1.05 0.20 3.43 1.01 -0.69 -1.61 120.40 126.90 1ghu s VAL 99 Ca 0.40 -0.34 -0.30 0.00 0.00 0.00 0.00 61.98 61.74 1ghu s VAL 99 Cb -0.15 -1.04 -0.08 0.00 0.00 0.00 0.00 36.38 35.12 1ghu s VAL 99 CO 0.09 0.36 0.93 -0.75 0.00 0.00 0.00 175.10 175.73 1ghu s LYS 100 N 1.41 4.79 -0.26 2.72 2.20 -0.40 -1.62 119.74 128.59 1ghu s LYS 100 Ca -0.00 1.45 -0.01 0.00 -0.36 0.00 0.00 55.97 57.04 1ghu s LYS 100 Cb -0.13 -3.30 0.14 0.00 -1.51 0.00 0.00 37.83 33.02 1ghu s LYS 100 CO -0.05 0.45 0.36 0.12 -0.36 0.00 0.00 175.35 175.87 1ghu s PHE 101 N -0.88 -0.77 0.00 4.03 5.36 -0.86 -1.73 117.98 123.13 1ghu s PHE 101 Ca 0.42 0.49 0.00 0.00 -0.96 0.00 0.00 56.93 56.88 1ghu s PHE 101 Cb -0.25 -0.13 0.00 0.00 -0.34 0.00 0.00 43.02 42.30 1ghu s PHE 101 CO 0.31 -0.81 0.00 0.41 -1.46 0.00 0.00 175.22 173.67 1ghu n GLY 102 N 5.35 1.65 2.36 13.12 0.00 -1.26 -3.76 105.19 122.64 1ghu n GLY 102 Ca -0.02 -0.35 -0.22 0.00 0.00 0.00 0.00 46.02 45.43 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 7.33 1.70 -3.64 1.61 4.13 -1.26 -4.98 115.26 120.15 1ghu n ASN 103 Ca 0.00 -3.11 -0.05 0.00 1.68 0.00 0.00 54.58 53.10 1ghu n ASN 103 Cb 0.00 -0.62 -0.06 0.00 -1.54 0.00 0.00 39.78 37.56 1ghu n ASN 103 CO 0.00 0.00 0.00 1.51 0.28 0.00 0.00 177.26 179.05 1ghu s ASP 104 N -2.31 -0.96 -0.43 6.41 1.47 -1.25 -5.13 116.67 114.47 1ghu s ASP 104 Ca 0.40 1.47 -0.12 0.00 1.18 0.00 0.00 52.55 55.49 1ghu s ASP 104 Cb 0.27 1.58 0.06 0.00 -0.34 0.00 0.00 42.92 44.49 1ghu s ASP 104 CO -0.09 -0.23 0.30 -0.69 0.68 0.00 0.00 175.17 175.14 1ghu s VAL 105 N 1.91 4.70 -0.15 2.11 1.01 -1.26 -2.04 120.40 126.67 1ghu s VAL 105 Ca -0.09 -1.13 -0.05 0.00 0.00 0.00 0.00 61.98 60.71 1ghu s VAL 105 Cb -0.06 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 1ghu s VAL 105 CO -0.19 -0.46 -0.00 0.00 0.00 0.00 0.00 175.10 174.44 1ghu s GLN 106 N 1.54 3.68 -0.41 2.72 -2.07 -0.64 -4.86 119.66 119.61 1ghu s GLN 106 Ca 0.03 -0.45 -0.12 0.00 -1.82 0.00 0.00 55.36 53.00 1ghu s GLN 106 Cb -0.22 -2.99 0.05 0.00 -1.09 0.00 0.00 33.01 28.76 1ghu s GLN 106 CO 0.05 0.31 0.28 -1.01 -1.32 0.00 0.00 175.29 173.60 1ghu s HIS 107 N 0.19 3.27 -0.09 9.60 3.76 -1.26 -1.71 115.29 129.05 1ghu s HIS 107 Ca 0.00 -1.04 -0.18 0.00 -0.15 0.00 0.00 55.06 53.69 1ghu s HIS 107 Cb -0.13 -2.75 -0.04 0.00 1.11 0.00 0.00 32.58 30.76 1ghu s HIS 107 CO 0.02 -0.72 0.50 -0.06 -0.85 0.00 0.00 174.74 173.62 1ghu s PHE 108 N 1.56 3.56 -0.30 1.40 0.08 -0.51 -4.94 117.98 118.82 1ghu s PHE 108 Ca 0.03 0.96 -0.29 0.00 0.12 0.00 0.00 56.93 57.75 1ghu s PHE 108 Cb -0.21 -2.55 0.01 0.00 -0.57 0.00 0.00 43.02 39.70 1ghu s PHE 108 CO 0.06 0.23 1.05 0.15 -0.10 0.00 0.00 175.22 176.61 1ghu s LYS 109 N 0.37 4.09 -0.64 0.44 1.02 -1.26 -1.11 119.74 122.65 1ghu s LYS 109 Ca 0.27 1.09 -0.19 0.00 0.02 0.00 0.00 55.97 57.16 1ghu s LYS 109 Cb -0.16 -3.72 0.11 0.00 -0.52 0.00 0.00 37.83 33.55 1ghu s LYS 109 CO 0.12 -0.84 0.76 0.08 -0.92 0.00 0.00 175.35 174.55 1ghu s VAL 110 N 3.52 4.86 -0.06 3.17 1.01 -0.62 -4.47 120.40 127.81 1ghu s VAL 110 Ca 0.44 -1.15 -0.10 0.00 0.00 0.00 0.00 61.98 61.18 1ghu s VAL 110 Cb -0.13 -4.52 -0.05 0.00 0.00 0.00 0.00 36.38 31.68 1ghu s VAL 110 CO 0.13 -1.17 0.26 -1.48 0.00 0.00 0.00 175.10 172.84 1ghu s LEU 111 N 2.53 4.42 -0.17 3.92 2.34 -0.93 -1.61 118.68 129.18 1ghu s LEU 111 Ca 0.14 0.68 -0.09 0.00 0.06 0.00 0.00 54.13 54.92 1ghu s LEU 111 Cb -0.21 -2.31 -0.05 0.00 -0.56 0.00 0.00 46.19 43.06 1ghu s LEU 111 CO 0.04 0.37 0.13 -0.13 -1.06 0.00 0.00 176.35 175.70 1ghu s ARG 112 N -1.09 3.94 -0.03 1.48 0.52 -1.26 -2.36 118.95 120.14 1ghu s ARG 112 Ca 0.19 -0.19 -0.00 0.00 -0.52 0.00 0.00 55.73 55.21 1ghu s ARG 112 Cb -0.14 -3.34 -0.00 0.00 0.52 0.00 0.00 34.95 31.99 1ghu s ARG 112 CO 0.08 0.46 -0.00 0.38 0.02 0.00 0.00 175.30 176.25 1ghu h ASP 113 N 6.10 0.00 0.00 0.23 2.03 -1.90 -3.49 116.42 119.39 1ghu h ASP 113 Ca -0.46 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.84 1ghu h ASP 113 Cb 1.18 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.68 1ghu h ASP 113 CO 0.70 0.17 0.00 0.61 -1.03 0.00 0.00 179.24 179.69 1ghu n GLY 114 N 1.92 0.57 0.00 7.15 0.00 -1.26 -5.02 105.19 108.55 1ghu n GLY 114 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -3.00 0.00 -3.57 4.61 0.00 -1.26 -4.76 120.51 112.53 1ghu n ALA 115 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.07 1ghu n ALA 115 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 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 2.66 4.23 2.57 0.00 0.00 -1.26 -4.97 105.19 108.41 1ghu n GLY 116 Ca 0.00 -2.61 -0.27 0.00 0.00 0.00 0.00 46.02 43.14 1ghu n GLY 116 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ghu n LYS 117 N 2.18 1.01 -2.67 1.61 4.76 -1.26 -4.38 118.16 119.40 1ghu n LYS 117 Ca 0.23 -3.77 -0.43 0.00 -2.87 0.00 0.00 58.31 51.47 1ghu n LYS 117 Cb 0.37 -1.90 -0.02 0.00 -1.84 0.00 0.00 35.03 31.63 1ghu n LYS 117 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1ghu s TYR 118 N -0.79 3.31 -0.04 2.13 1.51 -0.62 -2.69 117.35 120.16 1ghu s TYR 118 Ca 0.31 1.40 -0.01 0.00 -1.01 0.00 0.00 57.07 57.75 1ghu s TYR 118 Cb 0.03 -3.32 0.03 0.00 -0.11 0.00 0.00 41.96 38.59 1ghu s TYR 118 CO -0.17 -0.52 0.05 -0.59 -1.11 0.00 0.00 175.55 173.21 1ghu s PHE 119 N 3.25 0.10 -0.09 2.71 -0.71 -1.00 -1.50 117.98 120.74 1ghu s PHE 119 Ca 0.44 0.19 0.02 0.00 -1.04 0.00 0.00 56.93 56.54 1ghu s PHE 119 Cb -0.15 -0.43 -0.07 0.00 -1.21 0.00 0.00 43.02 41.16 1ghu s PHE 119 CO 0.08 -0.17 -0.06 1.47 -1.34 0.00 0.00 175.22 175.20 1ghu n LEU 120 N 4.95 2.34 0.00 -1.99 -0.00 -1.26 -2.20 117.00 118.84 1ghu n LEU 120 Ca -0.11 -0.04 0.00 0.00 -0.00 0.00 0.00 56.01 55.86 1ghu n LEU 120 Cb 0.50 -0.22 0.00 0.00 -0.00 0.00 0.00 43.42 43.70 1ghu n LEU 120 CO 0.11 0.56 0.00 1.87 -0.00 0.00 0.00 177.39 179.93 1ghu n TRP 121 N -2.67 0.00 0.13 1.47 -0.00 -1.26 -4.96 117.44 110.15 1ghu n TRP 121 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.34 1ghu n TRP 121 Cb 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 32.00 1ghu n TRP 121 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 177.69 179.02 1ghu n VAL 122 N -0.27 0.01 -2.75 5.87 0.24 -1.26 -5.12 118.33 115.04 1ghu n VAL 122 Ca 0.00 0.00 -0.39 0.00 -2.04 0.00 0.00 64.34 61.91 1ghu n VAL 122 Cb 0.00 -0.46 -0.06 0.00 -1.47 0.00 0.00 33.84 31.85 1ghu n VAL 122 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1ghu s VAL 123 N -1.90 4.09 0.52 3.34 0.11 -1.26 -5.00 120.40 120.31 1ghu s VAL 123 Ca 0.00 2.04 -0.12 0.00 -2.93 0.00 0.00 61.98 60.97 1ghu s VAL 123 Cb 0.00 -4.27 -0.06 0.00 -1.53 0.00 0.00 36.38 30.52 1ghu s VAL 123 CO 0.00 0.44 0.94 -1.59 -3.33 0.00 0.00 175.10 171.56 1ghu s LYS 124 N -1.33 3.76 -0.04 1.54 0.00 -1.26 -4.74 119.74 117.66 1ghu s LYS 124 Ca 0.43 0.71 -0.02 0.00 0.00 0.00 0.00 55.97 57.09 1ghu s LYS 124 Cb -0.25 -2.19 0.03 0.00 0.00 0.00 0.00 37.83 35.42 1ghu s LYS 124 CO 0.31 -0.32 0.05 -0.06 0.00 0.00 0.00 175.35 175.33 1ghu s PHE 125 N -2.77 0.13 0.24 1.78 0.08 -0.56 -4.94 117.98 111.94 1ghu s PHE 125 Ca 0.55 0.20 -0.06 0.00 0.12 0.00 0.00 56.93 57.74 1ghu s PHE 125 Cb -0.10 -0.51 0.23 0.00 -0.57 0.00 0.00 43.02 42.07 1ghu s PHE 125 CO 0.40 -0.20 1.87 -0.91 -0.10 0.00 0.00 175.22 176.28 1ghu h ASN 126 N 8.36 1.13 -2.76 1.36 2.35 -1.86 -1.66 115.58 122.50 1ghu h ASN 126 Ca -0.15 -0.08 -0.52 0.00 -0.55 0.00 0.00 56.30 55.00 1ghu h ASN 126 Cb 1.12 -0.29 -0.14 0.00 0.05 0.00 0.00 38.32 39.06 1ghu h ASN 126 CO 0.18 0.89 -0.74 -0.44 -1.65 0.00 0.00 177.43 175.67 1ghu s SER 127 N -6.22 3.01 -1.08 5.81 0.01 -1.26 -4.54 113.70 109.44 1ghu s SER 127 Ca -0.13 -1.04 -0.19 0.00 1.31 0.00 0.00 55.95 55.90 1ghu s SER 127 Cb 0.17 -0.21 0.10 0.00 0.21 0.00 0.00 66.02 66.29 1ghu s SER 127 CO 0.83 -0.10 1.41 -0.76 0.41 0.00 0.00 173.24 175.03 1ghu s LEU 128 N -3.41 4.28 0.00 2.44 1.43 -1.26 -2.69 118.68 119.47 1ghu s LEU 128 Ca 0.26 -2.07 0.00 0.00 -1.03 0.00 0.00 54.13 51.29 1ghu s LEU 128 Cb -0.02 -2.49 0.00 0.00 0.03 0.00 0.00 46.19 43.71 1ghu s LEU 128 CO 0.11 -1.19 0.00 -3.20 0.23 0.00 0.00 176.35 172.30 1ghu n ASN 129 N 7.58 0.00 -0.19 2.29 2.85 -1.26 -4.94 115.26 121.59 1ghu n ASN 129 Ca 0.34 0.00 -0.05 0.00 -0.11 0.00 0.00 54.58 54.76 1ghu n ASN 129 Cb 0.48 0.00 0.04 0.00 1.24 0.00 0.00 39.78 41.55 1ghu n ASN 129 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 1ghu h GLU 130 N 0.00 0.64 -0.11 1.20 5.08 -1.93 -1.88 114.58 117.58 1ghu h GLU 130 Ca 0.00 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1ghu h GLU 130 Cb 0.00 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.08 1ghu h GLU 130 CO 0.00 0.42 -0.05 1.25 -1.00 0.00 0.00 179.01 179.63 1ghu h LEU 131 N 0.66 -0.17 -0.06 1.33 6.46 -1.83 -2.71 115.31 119.00 1ghu h LEU 131 Ca 0.22 0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 58.01 1ghu h LEU 131 Cb 0.02 0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 40.04 1ghu h LEU 131 CO -0.09 -0.07 0.00 -0.37 -0.62 0.00 0.00 178.44 177.29 1ghu h VAL 132 N -0.04 1.24 -0.26 1.05 -1.51 -1.84 -2.93 116.25 111.96 1ghu h VAL 132 Ca 0.06 -0.75 -0.11 0.00 -1.23 0.00 0.00 66.70 64.68 1ghu h VAL 132 Cb 0.13 1.64 -0.01 0.00 -2.13 0.00 0.00 31.29 30.91 1ghu h VAL 132 CO -0.13 0.20 -0.29 -0.78 -1.23 0.00 0.00 177.57 175.34 1ghu h ASP 133 N -0.18 0.54 0.50 4.19 3.58 -1.44 -1.16 116.42 122.44 1ghu h ASP 133 Ca 0.02 -0.20 -0.02 0.00 0.42 0.00 0.00 57.03 57.24 1ghu h ASP 133 Cb 0.32 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.23 1ghu h ASP 133 CO 0.00 0.81 -0.24 0.22 -2.88 0.00 0.00 179.24 177.15 1ghu h TYR 134 N 0.46 -0.62 0.00 0.28 3.20 -1.56 -3.21 116.97 115.52 1ghu h TYR 134 Ca 0.06 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1ghu h TYR 134 Cb 0.73 0.21 0.00 0.00 1.54 0.00 0.00 36.73 39.21 1ghu h TYR 134 CO 0.03 -0.36 0.00 0.72 -1.64 0.00 0.00 178.16 176.91 1ghu n HIS 135 N -5.36 0.00 0.21 -3.82 8.25 -1.11 -2.24 115.22 111.16 1ghu n HIS 135 Ca -0.12 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.48 1ghu n HIS 135 Cb 0.29 -0.44 0.75 0.00 1.12 0.00 0.00 29.99 31.70 1ghu n HIS 135 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1ghu h ARG 136 N 0.00 0.00 0.00 -0.41 2.43 -1.21 -3.06 114.38 112.14 1ghu h ARG 136 Ca 0.00 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 1ghu h ARG 136 Cb 0.19 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 1ghu h ARG 136 CO 0.00 0.00 -1.41 0.43 -1.51 0.00 0.00 179.97 177.48 1ghu n SER 137 N -4.21 3.53 -4.88 -3.80 7.64 -1.18 -4.49 113.62 106.22 1ghu n SER 137 Ca 0.00 -0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.57 1ghu n SER 137 Cb 0.23 0.58 -0.04 0.00 -1.01 0.00 0.00 64.21 63.97 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 -2.14 4.93 0.01 0.44 2.01 -0.95 -5.04 115.64 114.90 1ghu s THR 138 Ca -0.04 0.38 -0.28 0.00 0.31 0.00 0.00 61.69 62.06 1ghu s THR 138 Cb 0.02 -3.67 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 1ghu s THR 138 CO 0.24 -0.23 0.89 -0.55 -0.69 0.00 0.00 174.62 174.27 1ghu s SER 139 N -2.75 7.29 0.10 3.53 0.15 -1.26 -4.38 113.70 116.37 1ghu s SER 139 Ca 0.47 1.55 -0.17 0.00 0.70 0.00 0.00 55.95 58.50 1ghu s SER 139 Cb -0.11 -2.53 -0.06 0.00 -1.71 0.00 0.00 66.02 61.62 1ghu s SER 139 CO 0.25 -0.16 1.54 -0.37 1.20 0.00 0.00 173.24 175.70 1ghu h VAL 140 N 4.58 1.26 0.05 4.45 -1.51 -1.84 -3.34 116.25 119.90 1ghu h VAL 140 Ca -0.42 -0.94 -0.23 0.00 -1.23 0.00 0.00 66.70 63.88 1ghu h VAL 140 Cb 1.21 1.27 -0.01 0.00 -2.13 0.00 0.00 31.29 31.63 1ghu h VAL 140 CO 0.74 0.30 -1.09 -1.28 -1.23 0.00 0.00 177.57 175.02 1ghu h SER 141 N 0.33 0.19 0.00 4.19 0.87 -1.85 -3.42 113.55 113.86 1ghu h SER 141 Ca 0.09 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 1ghu h SER 141 Cb 0.44 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.33 1ghu h SER 141 CO 0.02 1.14 0.00 -1.14 -0.53 0.00 0.00 176.83 176.32 1ghu n ARG 142 N -3.45 0.00 0.12 2.24 0.63 -1.26 -4.59 116.66 110.35 1ghu n ARG 142 Ca -0.04 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 56.77 1ghu n ARG 142 Cb 0.96 0.00 -0.08 0.00 0.45 0.00 0.00 32.46 33.80 1ghu n ARG 142 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 1ghu h ASN 143 N 0.00 -0.29 -3.77 6.15 4.21 -1.95 -3.44 115.58 116.49 1ghu h ASN 143 Ca 0.00 -0.24 -0.49 0.00 1.21 0.00 0.00 56.30 56.78 1ghu h ASN 143 Cb 0.00 0.07 -0.02 0.00 -1.12 0.00 0.00 38.32 37.25 1ghu h ASN 143 CO 0.00 0.16 0.35 -1.10 -1.29 0.00 0.00 177.43 175.55 1ghu s GLN 144 N -4.10 4.82 -0.47 0.81 -0.21 -1.26 -5.04 119.66 114.21 1ghu s GLN 144 Ca -0.13 1.48 -0.24 0.00 0.02 0.00 0.00 55.36 56.49 1ghu s GLN 144 Cb 0.01 -3.22 0.03 0.00 1.00 0.00 0.00 33.01 30.83 1ghu s GLN 144 CO 0.51 0.49 0.84 -1.14 -2.12 0.00 0.00 175.29 173.86 1ghu s GLN 145 N -1.28 3.42 -0.08 2.91 -0.44 -1.26 -4.29 119.66 118.64 1ghu s GLN 145 Ca 0.42 -0.07 -0.01 0.00 -2.50 0.00 0.00 55.36 53.21 1ghu s GLN 145 Cb -0.25 -3.95 0.03 0.00 -1.64 0.00 0.00 33.01 27.19 1ghu s GLN 145 CO 0.31 -1.19 -0.03 0.42 0.50 0.00 0.00 175.29 175.30 1ghu s ILE 146 N 3.48 0.62 0.03 -2.34 1.09 -1.26 -5.08 121.20 117.74 1ghu s ILE 146 Ca 0.32 -0.06 0.06 0.00 -1.10 0.00 0.00 60.65 59.87 1ghu s ILE 146 Cb -0.12 -0.71 -0.03 0.00 -1.06 0.00 0.00 42.46 40.54 1ghu s ILE 146 CO 0.23 0.29 -0.16 -0.36 -0.10 0.00 0.00 174.94 174.84 1ghu s PHE 147 N 1.69 2.62 -0.23 3.97 0.08 -1.26 -3.16 117.98 121.69 1ghu s PHE 147 Ca 0.02 -0.22 -0.20 0.00 0.12 0.00 0.00 56.93 56.66 1ghu s PHE 147 Cb -0.13 -1.50 -0.02 0.00 -0.57 0.00 0.00 43.02 40.80 1ghu s PHE 147 CO -0.05 0.27 0.59 -0.51 -0.10 0.00 0.00 175.22 175.42 1ghu s LEU 148 N -1.40 4.10 -0.01 -0.37 1.02 -1.16 -4.17 118.68 116.69 1ghu s LEU 148 Ca 0.15 0.72 0.08 0.00 0.02 0.00 0.00 54.13 55.10 1ghu s LEU 148 Cb -0.11 -2.81 -0.02 0.00 0.02 0.00 0.00 46.19 43.27 1ghu s LEU 148 CO 0.05 -0.29 -0.25 -0.13 0.02 0.00 0.00 176.35 175.75 1ghu s ARG 149 N 2.11 2.10 0.47 1.70 3.00 -0.58 -4.42 118.95 123.34 1ghu s ARG 149 Ca 0.26 -0.93 -0.22 0.00 0.00 0.00 0.00 55.73 54.83 1ghu s ARG 149 Cb -0.16 -2.06 -0.07 0.00 0.00 0.00 0.00 34.95 32.67 1ghu s ARG 149 CO 0.09 0.56 1.14 0.16 0.00 0.00 0.00 175.30 177.26 1ghu s ASP 150 N -0.69 6.14 0.67 0.23 1.47 -1.26 -3.03 116.67 120.20 1ghu s ASP 150 Ca 0.10 2.24 -0.15 0.00 1.18 0.00 0.00 52.55 55.92 1ghu s ASP 150 Cb -0.10 -2.60 0.01 0.00 -0.34 0.00 0.00 42.92 39.89 1ghu s ASP 150 CO -0.01 -0.94 1.14 0.27 0.68 0.00 0.00 175.17 176.32 1ghu s ILE 151 N -1.62 2.95 -2.32 2.11 -4.36 -1.23 -4.83 121.20 111.90 1ghu s ILE 151 Ca 0.65 0.46 0.29 0.00 -0.26 0.00 0.00 60.65 61.79 1ghu s ILE 151 Cb -0.27 -3.00 0.68 0.00 1.25 0.00 0.00 42.46 41.12 1ghu s ILE 151 CO 0.32 -0.25 1.92 1.21 0.24 0.00 0.00 174.94 178.37