#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 7.20 0.00 1.61 1.04 -1.26 -4.86 113.70 117.43 1ghu s SER 59 Ca 0.00 1.55 0.00 0.00 0.48 0.00 0.00 55.95 57.98 1ghu s SER 59 Cb 0.00 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.57 1ghu s SER 59 CO 0.00 -0.50 0.00 -2.67 0.98 0.00 0.00 173.24 171.05 1ghu n TRP 60 N 5.21 -0.37 -2.82 5.02 2.14 -1.26 -4.37 117.44 120.99 1ghu n TRP 60 Ca 0.09 0.00 -0.41 0.00 2.07 0.00 0.00 57.50 59.26 1ghu n TRP 60 Cb 0.48 0.16 -0.05 0.00 -0.81 0.00 0.00 31.31 31.09 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 -1.31 3.77 0.00 -2.67 5.36 -1.26 -2.46 117.98 119.41 1ghu s PHE 61 Ca 0.00 1.67 0.00 0.00 -0.96 0.00 0.00 56.93 57.64 1ghu s PHE 61 Cb 0.00 -2.97 0.00 0.00 -0.34 0.00 0.00 43.02 39.71 1ghu s PHE 61 CO 0.00 0.22 0.00 1.19 -1.46 0.00 0.00 175.22 175.17 1ghu n PHE 62 N 2.86 0.00 0.00 10.12 3.01 -1.07 -4.97 117.46 127.42 1ghu n PHE 62 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.47 1ghu n PHE 62 Cb 0.50 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.97 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 3.18 -1.15 3.98 1.37 0.00 -1.26 -5.02 105.19 106.29 1ghu n GLY 63 Ca 0.00 0.54 -0.42 0.00 0.00 0.00 0.00 46.02 46.14 1ghu n GLY 63 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ghu n LYS 64 N 0.00 -0.59 -2.80 1.61 2.85 -1.26 -4.87 118.16 113.09 1ghu n LYS 64 Ca 0.00 0.18 -0.30 0.00 -1.05 0.00 0.00 58.31 57.14 1ghu n LYS 64 Cb 0.00 -3.03 -0.03 0.00 -0.65 0.00 0.00 35.03 31.32 1ghu n LYS 64 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 177.40 178.31 1ghu s ILE 65 N -3.55 4.77 0.94 0.58 -4.36 -1.26 -4.92 121.20 113.40 1ghu s ILE 65 Ca 0.46 0.64 -0.12 0.00 -0.26 0.00 0.00 60.65 61.37 1ghu s ILE 65 Cb -0.23 -3.74 0.15 0.00 1.25 0.00 0.00 42.46 39.90 1ghu s ILE 65 CO 0.94 -0.56 1.10 -2.16 0.24 0.00 0.00 174.94 174.51 1ghu s PRO 66 N -3.92 0.90 0.20 0.37 0.04 -1.26 -4.87 135.00 126.45 1ghu s PRO 66 Ca 0.52 0.57 -0.09 0.00 0.04 0.00 0.00 61.00 62.04 1ghu s PRO 66 Cb -0.10 -1.79 0.13 0.00 0.04 0.00 0.00 34.50 32.78 1ghu s PRO 66 CO 0.32 -2.42 1.75 -0.09 0.04 0.00 0.00 177.00 176.60 1ghu h ARG 67 N -1.67 1.12 -0.59 4.56 2.43 -1.99 -2.14 114.38 116.09 1ghu h ARG 67 Ca -0.52 -0.22 -0.05 0.00 -0.81 0.00 0.00 59.98 58.37 1ghu h ARG 67 Cb 1.31 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.67 1ghu h ARG 67 CO 0.58 0.94 0.16 0.00 -1.51 0.00 0.00 179.97 180.13 1ghu h ALA 68 N 1.13 0.78 -0.28 2.80 0.00 -1.99 -2.00 119.26 119.70 1ghu h ALA 68 Ca 0.24 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1ghu h ALA 68 Cb 0.26 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1ghu h ALA 68 CO -0.01 0.47 -0.21 -0.22 0.00 0.00 0.00 179.25 179.28 1ghu h LYS 69 N 0.85 0.52 -0.33 0.00 1.63 -1.94 -1.70 116.57 115.60 1ghu h LYS 69 Ca 0.19 -0.18 -0.03 0.00 -0.85 0.00 0.00 60.65 59.77 1ghu h LYS 69 Cb 0.33 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 31.91 1ghu h LYS 69 CO -0.00 0.70 0.09 0.00 -3.45 0.00 0.00 179.45 176.79 1ghu h ALA 70 N 1.31 0.43 -0.25 5.00 0.00 -1.34 -2.97 119.26 121.44 1ghu h ALA 70 Ca 0.07 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1ghu h ALA 70 Cb 0.62 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1ghu h ALA 70 CO 0.04 0.08 -0.16 0.93 0.00 0.00 0.00 179.25 180.14 1ghu h GLU 71 N 0.37 0.42 -0.17 0.00 5.08 -1.41 -2.82 114.58 116.06 1ghu h GLU 71 Ca 0.10 -0.13 0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1ghu h GLU 71 Cb 0.28 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1ghu h GLU 71 CO -0.00 0.58 0.01 1.49 -1.00 0.00 0.00 179.01 180.09 1ghu h GLU 72 N 0.39 0.07 -0.19 2.33 4.81 -1.31 -2.15 114.58 118.52 1ghu h GLU 72 Ca 0.07 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1ghu h GLU 72 Cb 0.51 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 1ghu h GLU 72 CO 0.03 0.04 0.11 1.98 -0.73 0.00 0.00 179.01 180.45 1ghu h MET 73 N 0.07 0.27 0.09 1.92 4.05 -1.56 -3.31 114.93 116.45 1ghu h MET 73 Ca 0.08 -0.03 -0.31 0.00 -0.28 0.00 0.00 59.70 59.16 1ghu h MET 73 Cb 0.09 -0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 30.82 1ghu h MET 73 CO -0.12 0.25 -1.66 -0.07 0.23 0.00 0.00 176.91 175.53 1ghu h LEU 74 N 0.22 0.28 -1.64 3.39 3.38 -1.52 -3.32 115.31 116.10 1ghu h LEU 74 Ca 0.07 -0.80 -0.02 0.00 0.09 0.00 0.00 57.88 57.23 1ghu h LEU 74 Cb 0.05 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1ghu h LEU 74 CO -0.01 1.70 0.04 0.28 0.09 0.00 0.00 178.44 180.54 1ghu h SER 75 N -0.33 0.24 -0.67 -0.43 0.02 -1.61 -3.10 113.55 107.66 1ghu h SER 75 Ca -0.38 -0.02 0.01 0.00 -0.84 0.00 0.00 61.79 60.56 1ghu h SER 75 Cb 1.76 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 64.20 1ghu h SER 75 CO -0.01 0.25 0.44 0.50 -1.14 0.00 0.00 176.83 176.87 1ghu h LYS 76 N 0.27 0.86 -6.62 3.45 3.64 -1.73 -3.44 116.57 113.00 1ghu h LYS 76 Ca 0.07 -0.05 -0.52 0.00 -1.27 0.00 0.00 60.65 58.88 1ghu h LYS 76 Cb 0.12 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1ghu h LYS 76 CO -0.00 0.57 0.48 1.14 -2.27 0.00 0.00 179.45 179.37 1ghu s GLN 77 N -6.14 4.57 0.20 1.90 -2.07 -1.17 -4.98 119.66 111.97 1ghu s GLN 77 Ca -0.13 1.71 0.13 0.00 -1.82 0.00 0.00 55.36 55.25 1ghu s GLN 77 Cb 0.14 -3.29 0.70 0.00 -1.09 0.00 0.00 33.01 29.47 1ghu s GLN 77 CO 0.77 0.03 1.38 2.89 -1.32 0.00 0.00 175.29 179.03 1ghu n ARG 78 N 2.63 0.08 -3.15 9.60 1.85 -1.26 -4.86 116.66 121.54 1ghu n ARG 78 Ca 0.04 0.57 -0.39 0.00 -1.00 0.00 0.00 57.85 57.06 1ghu n ARG 78 Cb 0.46 -1.81 -0.05 0.00 -1.05 0.00 0.00 32.46 30.01 1ghu n ARG 78 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 1ghu s HIS 79 N -3.31 3.49 0.07 2.89 3.76 -1.26 -4.98 115.29 115.95 1ghu s HIS 79 Ca -0.01 1.03 -0.31 0.00 -0.15 0.00 0.00 55.06 55.62 1ghu s HIS 79 Cb 0.04 -2.72 -0.06 0.00 1.11 0.00 0.00 32.58 30.94 1ghu s HIS 79 CO 0.12 0.03 1.23 -0.51 -0.85 0.00 0.00 174.74 174.75 1ghu s ASP 80 N 0.87 7.04 0.00 1.40 1.11 -1.26 -3.15 116.67 122.68 1ghu s ASP 80 Ca 0.31 2.07 0.00 0.00 0.18 0.00 0.00 52.55 55.11 1ghu s ASP 80 Cb -0.16 -2.58 0.00 0.00 1.07 0.00 0.00 42.92 41.25 1ghu s ASP 80 CO 0.13 -0.50 0.00 0.61 1.18 0.00 0.00 175.17 176.60 1ghu n GLY 81 N 3.23 0.51 3.63 0.21 0.00 -0.36 -4.51 105.19 107.90 1ghu n GLY 81 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.21 3.19 0.18 4.61 0.00 -1.16 -1.37 121.76 125.00 1ghu s ALA 82 Ca 0.00 0.66 0.09 0.00 0.00 0.00 0.00 51.96 52.71 1ghu s ALA 82 Cb 0.00 -3.91 -0.04 0.00 0.00 0.00 0.00 23.12 19.17 1ghu s ALA 82 CO 0.00 -2.10 -0.19 -0.59 0.00 0.00 0.00 175.76 172.89 1ghu s PHE 83 N 5.80 1.90 -0.04 0.00 -0.12 -1.18 -1.48 117.98 122.85 1ghu s PHE 83 Ca 0.81 -0.46 -0.03 0.00 -0.05 0.00 0.00 56.93 57.19 1ghu s PHE 83 Cb -0.29 -0.93 0.01 0.00 -0.63 0.00 0.00 43.02 41.18 1ghu s PHE 83 CO 0.33 0.38 0.10 -0.48 -0.05 0.00 0.00 175.22 175.50 1ghu s LEU 84 N -2.81 1.59 -0.28 -1.99 0.05 -0.93 -4.60 118.68 109.71 1ghu s LEU 84 Ca 0.18 0.20 -0.18 0.00 0.05 0.00 0.00 54.13 54.38 1ghu s LEU 84 Cb -0.05 0.34 -0.02 0.00 -2.05 0.00 0.00 46.19 44.40 1ghu s LEU 84 CO 0.08 -0.04 0.51 -0.63 -0.55 0.00 0.00 176.35 175.71 1ghu s ILE 85 N 0.10 5.06 -0.12 1.48 1.09 -1.03 -1.48 121.20 126.30 1ghu s ILE 85 Ca -0.00 0.73 -0.02 0.00 -1.10 0.00 0.00 60.65 60.26 1ghu s ILE 85 Cb -0.01 -3.85 -0.03 0.00 -1.06 0.00 0.00 42.46 37.51 1ghu s ILE 85 CO -0.00 0.02 -0.03 0.00 -0.10 0.00 0.00 174.94 174.83 1ghu s ARG 86 N 2.32 3.31 0.24 2.79 1.70 -0.75 -2.58 118.95 125.98 1ghu s ARG 86 Ca 0.20 -0.49 -0.30 0.00 -0.47 0.00 0.00 55.73 54.68 1ghu s ARG 86 Cb -0.16 -2.83 -0.09 0.00 -0.57 0.00 0.00 34.95 31.31 1ghu s ARG 86 CO 0.10 0.46 0.96 -2.00 -1.08 0.00 0.00 175.30 173.73 1ghu s GLU 87 N -0.22 4.83 -0.04 3.89 2.12 -1.26 -1.60 118.70 126.42 1ghu s GLU 87 Ca 0.04 1.52 -0.30 0.00 0.36 0.00 0.00 54.97 56.59 1ghu s GLU 87 Cb -0.13 -3.28 -0.04 0.00 0.26 0.00 0.00 34.13 30.94 1ghu s GLU 87 CO 0.02 0.48 1.35 -1.12 -0.54 0.00 0.00 175.26 175.45 1ghu s SER 88 N -1.09 6.90 -0.07 -1.70 0.01 -0.71 -4.20 113.70 112.85 1ghu s SER 88 Ca 0.42 1.99 -0.26 0.00 1.31 0.00 0.00 55.95 59.41 1ghu s SER 88 Cb -0.26 -2.56 -0.23 0.00 0.21 0.00 0.00 66.02 63.18 1ghu s SER 88 CO 0.33 -0.71 1.02 -0.08 0.41 0.00 0.00 173.24 174.21 1ghu h GLU 89 N 7.91 0.06 -0.66 12.44 4.81 -1.96 -3.31 114.58 133.88 1ghu h GLU 89 Ca -0.36 -0.06 0.08 0.00 -0.13 0.00 0.00 59.36 58.89 1ghu h GLU 89 Cb 1.16 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.52 1ghu h GLU 89 CO 0.91 0.81 0.44 1.03 -0.73 0.00 0.00 179.01 181.47 1ghu h SER 90 N -0.66 0.52 -3.99 1.04 0.87 -1.98 -3.31 113.55 106.04 1ghu h SER 90 Ca -0.01 0.01 -0.70 0.00 -1.23 0.00 0.00 61.79 59.85 1ghu h SER 90 Cb 0.84 -0.10 -0.34 0.00 -0.44 0.00 0.00 62.40 62.35 1ghu h SER 90 CO 0.02 0.33 -0.36 0.00 -0.53 0.00 0.00 176.83 176.28 1ghu s ALA 91 N -5.54 3.55 0.15 6.23 0.00 -1.25 -5.11 121.76 119.79 1ghu s ALA 91 Ca -0.09 -3.13 -0.30 0.00 0.00 0.00 0.00 51.96 48.44 1ghu s ALA 91 Cb 0.19 -2.69 -0.08 0.00 0.00 0.00 0.00 23.12 20.55 1ghu s ALA 91 CO 0.76 -2.06 1.24 -1.25 0.00 0.00 0.00 175.76 174.45 1ghu s PRO 92 N 0.18 4.44 0.00 0.00 0.04 -1.24 -2.55 135.00 135.86 1ghu s PRO 92 Ca 0.15 1.90 0.00 0.00 0.04 0.00 0.00 61.00 63.10 1ghu s PRO 92 Cb -0.20 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.08 1ghu s PRO 92 CO -0.04 -0.20 0.00 0.41 0.04 0.00 0.00 177.00 177.21 1ghu n GLY 93 N 2.64 2.72 3.74 0.56 0.00 -1.26 -5.05 105.19 108.53 1ghu n GLY 93 Ca 0.07 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 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 0.31 7.48 0.45 1.61 1.11 -1.06 -4.99 116.67 121.59 1ghu s ASP 94 Ca 0.00 1.91 0.07 0.00 0.18 0.00 0.00 52.55 54.71 1ghu s ASP 94 Cb 0.00 -2.60 -0.00 0.00 1.07 0.00 0.00 42.92 41.39 1ghu s ASP 94 CO 0.00 -0.05 0.42 -0.36 1.18 0.00 0.00 175.17 176.36 1ghu s PHE 95 N -0.35 2.41 -0.14 4.23 0.08 -1.05 -1.73 117.98 121.43 1ghu s PHE 95 Ca 0.46 -0.57 -0.04 0.00 0.12 0.00 0.00 56.93 56.90 1ghu s PHE 95 Cb -0.25 -2.14 0.07 0.00 -0.57 0.00 0.00 43.02 40.13 1ghu s PHE 95 CO 0.32 -0.28 0.22 -1.12 -0.10 0.00 0.00 175.22 174.25 1ghu s SER 96 N -4.21 0.84 -0.17 1.36 0.01 -0.63 -1.44 113.70 109.47 1ghu s SER 96 Ca 0.47 0.22 -0.29 0.00 1.31 0.00 0.00 55.95 57.66 1ghu s SER 96 Cb -0.03 0.46 -0.00 0.00 0.21 0.00 0.00 66.02 66.65 1ghu s SER 96 CO 0.28 -0.27 1.03 -0.22 0.41 0.00 0.00 173.24 174.47 1ghu s LEU 97 N 2.35 4.17 -0.60 2.44 2.96 -0.54 -1.81 118.68 127.65 1ghu s LEU 97 Ca 0.04 1.46 -0.06 0.00 -0.22 0.00 0.00 54.13 55.35 1ghu s LEU 97 Cb -0.13 -3.55 0.16 0.00 0.50 0.00 0.00 46.19 43.17 1ghu s LEU 97 CO -0.09 -0.57 0.45 -0.44 -1.32 0.00 0.00 176.35 174.38 1ghu s SER 98 N 1.17 5.57 -0.25 3.68 0.01 -0.55 -1.52 113.70 121.80 1ghu s SER 98 Ca 0.46 -2.56 -0.06 0.00 1.31 0.00 0.00 55.95 55.10 1ghu s SER 98 Cb -0.17 -1.94 -0.01 0.00 0.21 0.00 0.00 66.02 64.11 1ghu s SER 98 CO 0.12 -0.48 0.04 0.54 0.41 0.00 0.00 173.24 173.87 1ghu s VAL 99 N 0.37 3.93 0.40 3.43 0.11 -0.69 -2.18 120.40 125.77 1ghu s VAL 99 Ca 0.14 -0.41 -0.24 0.00 -2.93 0.00 0.00 61.98 58.54 1ghu s VAL 99 Cb -0.20 -2.88 -0.09 0.00 -1.53 0.00 0.00 36.38 31.68 1ghu s VAL 99 CO -0.04 0.29 1.02 -0.75 -3.33 0.00 0.00 175.10 172.29 1ghu s LYS 100 N 1.54 4.22 -0.27 1.54 2.36 -0.55 -1.18 119.74 127.39 1ghu s LYS 100 Ca 0.05 1.41 -0.01 0.00 -2.55 0.00 0.00 55.97 54.88 1ghu s LYS 100 Cb -0.15 -2.50 0.16 0.00 -1.05 0.00 0.00 37.83 34.29 1ghu s LYS 100 CO 0.01 -0.08 0.47 0.12 1.55 0.00 0.00 175.35 177.43 1ghu s PHE 101 N -1.75 -1.20 0.00 4.03 2.19 -1.05 -1.22 117.98 118.98 1ghu s PHE 101 Ca 0.58 1.06 0.00 0.00 0.33 0.00 0.00 56.93 58.90 1ghu s PHE 101 Cb -0.19 0.20 0.00 0.00 -1.31 0.00 0.00 43.02 41.72 1ghu s PHE 101 CO 0.24 -0.85 0.00 0.41 1.83 0.00 0.00 175.22 176.85 1ghu n GLY 102 N 5.39 2.12 0.99 13.12 0.00 -1.26 -4.04 105.19 121.50 1ghu n GLY 102 Ca -0.01 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.68 1ghu n GLY 102 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ghu n ASN 103 N 4.27 0.29 -4.88 1.61 2.85 -1.26 -4.93 115.26 113.21 1ghu n ASN 103 Ca 0.00 0.00 -0.33 0.00 -0.11 0.00 0.00 54.58 54.14 1ghu n ASN 103 Cb 0.00 0.00 -0.05 0.00 1.24 0.00 0.00 39.78 40.97 1ghu n ASN 103 CO 0.00 0.00 0.00 -1.81 -2.11 0.00 0.00 177.26 173.34 1ghu s ASP 104 N -4.14 6.61 -0.27 1.20 1.01 -1.26 -4.61 116.67 115.21 1ghu s ASP 104 Ca 0.00 0.81 -0.12 0.00 0.71 0.00 0.00 52.55 53.95 1ghu s ASP 104 Cb 0.00 -2.18 -0.05 0.00 1.01 0.00 0.00 42.92 41.70 1ghu s ASP 104 CO 0.00 0.04 0.23 -0.69 0.21 0.00 0.00 175.17 174.96 1ghu s VAL 105 N -1.63 5.29 -0.23 -1.27 1.01 -1.26 -2.52 120.40 119.79 1ghu s VAL 105 Ca 0.41 0.26 -0.12 0.00 0.00 0.00 0.00 61.98 62.53 1ghu s VAL 105 Cb -0.13 -3.56 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 1ghu s VAL 105 CO 0.21 0.25 0.23 -1.10 0.00 0.00 0.00 175.10 174.69 1ghu s GLN 106 N 1.69 4.10 -0.31 2.72 1.11 -0.33 -4.91 119.66 123.74 1ghu s GLN 106 Ca 0.09 -0.13 -0.08 0.00 0.01 0.00 0.00 55.36 55.26 1ghu s GLN 106 Cb -0.16 -3.54 0.01 0.00 -1.01 0.00 0.00 33.01 28.31 1ghu s GLN 106 CO 0.10 0.03 0.10 -1.01 0.01 0.00 0.00 175.29 174.52 1ghu s HIS 107 N 1.15 3.17 -0.12 0.91 3.76 -1.26 -1.71 115.29 121.19 1ghu s HIS 107 Ca 0.11 -0.94 0.02 0.00 -0.15 0.00 0.00 55.06 54.10 1ghu s HIS 107 Cb -0.14 -2.29 0.01 0.00 1.11 0.00 0.00 32.58 31.28 1ghu s HIS 107 CO 0.06 -0.57 -0.19 -0.06 -0.85 0.00 0.00 174.74 173.12 1ghu s PHE 108 N 1.52 2.32 -0.15 1.40 0.08 -0.58 -5.03 117.98 117.55 1ghu s PHE 108 Ca 0.03 -1.11 -0.28 0.00 0.12 0.00 0.00 56.93 55.68 1ghu s PHE 108 Cb -0.17 -1.61 -0.01 0.00 -0.57 0.00 0.00 43.02 40.66 1ghu s PHE 108 CO 0.03 -0.53 0.96 0.21 -0.10 0.00 0.00 175.22 175.80 1ghu s LYS 109 N 0.84 4.36 -0.61 0.44 2.20 -1.26 -1.46 119.74 124.25 1ghu s LYS 109 Ca -0.08 1.28 -0.28 0.00 -0.36 0.00 0.00 55.97 56.54 1ghu s LYS 109 Cb -0.15 -3.57 0.03 0.00 -1.51 0.00 0.00 37.83 32.63 1ghu s LYS 109 CO -0.01 -0.38 1.18 0.08 -0.36 0.00 0.00 175.35 175.87 1ghu s VAL 110 N 2.27 4.00 0.06 4.02 1.01 -0.52 -4.59 120.40 126.65 1ghu s VAL 110 Ca 0.45 0.74 -0.16 0.00 0.00 0.00 0.00 61.98 63.01 1ghu s VAL 110 Cb -0.17 -4.75 -0.06 0.00 0.00 0.00 0.00 36.38 31.40 1ghu s VAL 110 CO 0.14 -1.42 0.50 -0.76 0.00 0.00 0.00 175.10 173.56 1ghu s LEU 111 N 5.01 4.47 0.03 3.92 1.43 -0.42 -2.53 118.68 130.59 1ghu s LEU 111 Ca 0.40 1.10 0.03 0.00 -1.03 0.00 0.00 54.13 54.63 1ghu s LEU 111 Cb -0.08 -2.85 -0.04 0.00 0.03 0.00 0.00 46.19 43.25 1ghu s LEU 111 CO 0.23 0.26 -0.00 -0.13 0.23 0.00 0.00 176.35 176.93 1ghu s ARG 112 N -1.29 2.70 -0.01 1.70 0.52 -1.26 -1.69 118.95 119.61 1ghu s ARG 112 Ca 0.29 -0.69 -0.20 0.00 -0.52 0.00 0.00 55.73 54.61 1ghu s ARG 112 Cb -0.17 -2.62 -0.32 0.00 0.52 0.00 0.00 34.95 32.36 1ghu s ARG 112 CO 0.17 0.60 0.95 0.38 0.02 0.00 0.00 175.30 177.42 1ghu h ASP 113 N 4.06 0.62 0.00 0.23 2.03 -1.95 -3.49 116.42 117.91 1ghu h ASP 113 Ca -0.48 -0.92 0.00 0.00 -0.73 0.00 0.00 57.03 54.89 1ghu h ASP 113 Cb 1.17 -0.20 0.00 0.00 -0.83 0.00 0.00 39.33 39.47 1ghu h ASP 113 CO 0.58 1.49 0.00 0.61 -1.03 0.00 0.00 179.24 180.89 1ghu n GLY 114 N 1.63 -2.54 0.14 7.15 0.00 -1.26 -5.04 105.19 105.26 1ghu n GLY 114 Ca -0.15 0.81 -0.05 0.00 0.00 0.00 0.00 46.02 46.64 1ghu n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ghu h ALA 115 N 0.00 -0.46 0.00 4.61 0.00 -2.05 -3.48 119.26 117.88 1ghu h ALA 115 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ghu h ALA 115 Cb 0.00 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1ghu h ALA 115 CO 0.00 -0.44 0.00 0.41 0.00 0.00 0.00 179.25 179.22 1ghu n GLY 116 N 0.63 -2.02 2.89 0.00 0.00 -1.26 -5.13 105.19 100.30 1ghu n GLY 116 Ca -0.04 0.96 -0.29 0.00 0.00 0.00 0.00 46.02 46.65 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 0.00 1.40 -0.09 1.61 -0.14 -1.26 -4.72 119.74 116.53 1ghu s LYS 117 Ca 0.00 -0.75 -0.18 0.00 -1.36 0.00 0.00 55.97 53.68 1ghu s LYS 117 Cb 0.00 -2.34 -0.04 0.00 -1.68 0.00 0.00 37.83 33.77 1ghu s LYS 117 CO 0.00 -0.56 0.48 0.71 -0.76 0.00 0.00 175.35 175.22 1ghu s TYR 118 N 1.55 3.56 -0.06 3.18 2.02 -0.53 -3.16 117.35 123.91 1ghu s TYR 118 Ca -0.03 0.93 -0.05 0.00 -0.37 0.00 0.00 57.07 57.56 1ghu s TYR 118 Cb -0.17 -2.52 0.02 0.00 -0.40 0.00 0.00 41.96 38.88 1ghu s TYR 118 CO -0.07 0.24 0.15 -0.59 -1.57 0.00 0.00 175.55 173.72 1ghu s PHE 119 N 0.33 -0.17 0.00 2.71 -0.71 -0.68 -1.36 117.98 118.10 1ghu s PHE 119 Ca 0.26 0.43 0.00 0.00 -1.04 0.00 0.00 56.93 56.58 1ghu s PHE 119 Cb -0.16 0.02 0.00 0.00 -1.21 0.00 0.00 43.02 41.68 1ghu s PHE 119 CO 0.11 -0.11 0.00 1.47 -1.34 0.00 0.00 175.22 175.36 1ghu n LEU 120 N 3.33 0.79 0.00 -1.99 -0.00 -1.26 -1.30 117.00 116.57 1ghu n LEU 120 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.85 1ghu n LEU 120 Cb 0.57 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.99 1ghu n LEU 120 CO 0.20 0.03 0.00 1.87 -0.00 0.00 0.00 177.39 179.50 1ghu n TRP 121 N -2.14 0.00 0.12 1.47 -0.00 -1.26 -4.97 117.44 110.66 1ghu n TRP 121 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 1ghu n TRP 121 Cb 0.19 -0.10 0.00 0.00 -0.00 0.00 0.00 31.31 31.40 1ghu n TRP 121 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 177.69 179.24 1ghu n VAL 122 N -1.16 0.00 -2.65 5.87 3.14 -1.26 -5.07 118.33 117.19 1ghu n VAL 122 Ca 0.00 0.00 -0.43 0.00 -2.96 0.00 0.00 64.34 60.95 1ghu n VAL 122 Cb 0.00 -0.27 -0.02 0.00 -1.06 0.00 0.00 33.84 32.49 1ghu n VAL 122 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1ghu s VAL 123 N -2.00 4.69 0.36 1.55 0.11 -1.26 -5.03 120.40 118.83 1ghu s VAL 123 Ca 0.00 2.00 -0.24 0.00 -2.93 0.00 0.00 61.98 60.81 1ghu s VAL 123 Cb 0.00 -4.29 -0.10 0.00 -1.53 0.00 0.00 36.38 30.46 1ghu s VAL 123 CO 0.00 -0.08 0.95 -0.75 -3.33 0.00 0.00 175.10 171.89 1ghu s LYS 124 N 2.61 4.45 0.25 1.54 2.20 -1.26 -4.78 119.74 124.74 1ghu s LYS 124 Ca 0.47 1.26 0.11 0.00 -0.36 0.00 0.00 55.97 57.45 1ghu s LYS 124 Cb -0.17 -2.57 -0.05 0.00 -1.51 0.00 0.00 37.83 33.53 1ghu s LYS 124 CO 0.13 0.16 -0.17 -0.06 -0.36 0.00 0.00 175.35 175.04 1ghu s PHE 125 N -1.82 2.38 -0.08 4.03 0.08 -0.47 -5.00 117.98 117.10 1ghu s PHE 125 Ca 0.55 -0.31 -0.11 0.00 0.12 0.00 0.00 56.93 57.18 1ghu s PHE 125 Cb -0.15 -1.07 -0.08 0.00 -0.57 0.00 0.00 43.02 41.15 1ghu s PHE 125 CO 0.20 0.65 0.39 -0.97 -0.10 0.00 0.00 175.22 175.38 1ghu h ASN 126 N 2.45 -0.13 -2.03 1.36 -0.73 -1.87 -1.40 115.58 113.22 1ghu h ASN 126 Ca -0.42 -0.19 -0.53 0.00 1.87 0.00 0.00 56.30 57.03 1ghu h ASN 126 Cb 1.24 0.03 -0.06 0.00 0.27 0.00 0.00 38.32 39.80 1ghu h ASN 126 CO 0.57 0.42 -0.54 -0.94 -0.37 0.00 0.00 177.43 176.58 1ghu s SER 127 N -5.49 5.01 0.33 1.15 1.04 -1.26 -4.26 113.70 110.22 1ghu s SER 127 Ca -0.06 -0.54 0.05 0.00 0.48 0.00 0.00 55.95 55.87 1ghu s SER 127 Cb -0.00 -0.99 0.59 0.00 0.10 0.00 0.00 66.02 65.72 1ghu s SER 127 CO 0.23 -0.17 1.84 0.25 0.98 0.00 0.00 173.24 176.36 1ghu h LEU 128 N 1.54 0.43 -0.53 2.42 5.85 -1.95 -2.70 115.31 120.37 1ghu h LEU 128 Ca -0.45 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.12 1ghu h LEU 128 Cb 1.25 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.14 1ghu h LEU 128 CO 0.61 0.57 0.14 0.78 -0.34 0.00 0.00 178.44 180.20 1ghu h ASN 129 N 0.42 0.79 -0.88 1.25 2.35 -2.01 -3.15 115.58 114.35 1ghu h ASN 129 Ca 0.08 -0.23 0.03 0.00 -0.55 0.00 0.00 56.30 55.64 1ghu h ASN 129 Cb 0.43 -0.21 -0.05 0.00 0.05 0.00 0.00 38.32 38.54 1ghu h ASN 129 CO 0.02 0.81 0.57 -0.33 -1.65 0.00 0.00 177.43 176.86 1ghu h GLU 130 N 0.74 1.08 -0.30 0.81 5.08 -1.96 -2.80 114.58 117.23 1ghu h GLU 130 Ca 0.17 -0.07 0.06 0.00 -1.00 0.00 0.00 59.36 58.52 1ghu h GLU 130 Cb 0.32 -0.24 -0.06 0.00 0.50 0.00 0.00 28.75 29.27 1ghu h GLU 130 CO 0.00 0.72 -0.09 1.25 -1.00 0.00 0.00 179.01 179.89 1ghu h LEU 131 N 1.12 -0.32 -0.22 1.33 6.46 -1.48 -2.64 115.31 119.55 1ghu h LEU 131 Ca 0.35 0.10 -0.06 0.00 -0.12 0.00 0.00 57.88 58.15 1ghu h LEU 131 Cb -0.01 0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 40.12 1ghu h LEU 131 CO -0.11 -0.12 -0.08 -0.37 -0.62 0.00 0.00 178.44 177.14 1ghu h VAL 132 N -0.02 1.29 0.00 1.05 -1.51 -1.56 -3.15 116.25 112.35 1ghu h VAL 132 Ca 0.15 -1.11 -0.05 0.00 -1.23 0.00 0.00 66.70 64.45 1ghu h VAL 132 Cb 0.25 1.56 -0.01 0.00 -2.13 0.00 0.00 31.29 30.96 1ghu h VAL 132 CO -0.32 0.34 -0.25 -2.24 -1.23 0.00 0.00 177.57 173.87 1ghu h ASP 133 N 0.16 0.00 0.28 4.19 3.04 -1.50 -1.47 116.42 121.12 1ghu h ASP 133 Ca 0.05 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 53.83 1ghu h ASP 133 Cb 0.55 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.85 1ghu h ASP 133 CO 0.03 0.25 -0.13 0.22 -2.04 0.00 0.00 179.24 177.56 1ghu h TYR 134 N 0.00 -0.35 0.00 4.15 3.20 -1.56 -3.30 116.97 119.11 1ghu h TYR 134 Ca -0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1ghu h TYR 134 Cb 0.46 0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.84 1ghu h TYR 134 CO 0.00 -0.01 0.00 0.72 -1.64 0.00 0.00 178.16 177.23 1ghu n HIS 135 N -5.11 0.00 0.08 -3.82 8.25 -1.15 -2.30 115.22 111.17 1ghu n HIS 135 Ca -0.09 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.48 1ghu n HIS 135 Cb 0.26 -0.46 0.59 0.00 1.12 0.00 0.00 29.99 31.49 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 0.17 0.00 -0.41 2.43 -1.35 -2.90 114.38 112.32 1ghu h ARG 136 Ca 0.00 -0.01 -0.23 0.00 -0.81 0.00 0.00 59.98 58.93 1ghu h ARG 136 Cb 0.17 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.64 1ghu h ARG 136 CO 0.00 0.11 -1.88 0.43 -1.51 0.00 0.00 179.97 177.13 1ghu n SER 137 N -4.47 2.31 -4.91 -3.80 7.64 -1.15 -4.21 113.62 105.03 1ghu n SER 137 Ca 0.04 -0.04 -0.28 0.00 1.01 0.00 0.00 58.87 59.60 1ghu n SER 137 Cb 0.28 0.32 -0.02 0.00 -1.01 0.00 0.00 64.21 63.78 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 -2.31 4.98 -0.13 0.44 2.01 -0.97 -5.03 115.64 114.62 1ghu s THR 138 Ca -0.13 0.09 -0.29 0.00 0.31 0.00 0.00 61.69 61.67 1ghu s THR 138 Cb 0.05 -3.78 -0.02 0.00 0.01 0.00 0.00 72.50 68.76 1ghu s THR 138 CO 0.44 -0.49 1.26 -0.55 -0.69 0.00 0.00 174.62 174.59 1ghu s SER 139 N -3.48 6.96 0.18 3.53 0.15 -1.26 -4.45 113.70 115.33 1ghu s SER 139 Ca 0.45 1.75 -0.01 0.00 0.70 0.00 0.00 55.95 58.84 1ghu s SER 139 Cb -0.10 -2.54 0.08 0.00 -1.71 0.00 0.00 66.02 61.75 1ghu s SER 139 CO 0.34 -0.72 1.45 1.62 1.20 0.00 0.00 173.24 177.13 1ghu h VAL 140 N 5.36 1.38 -3.67 4.45 3.04 -1.76 -3.46 116.25 121.59 1ghu h VAL 140 Ca -0.29 -2.10 -0.50 0.00 -1.01 0.00 0.00 66.70 62.80 1ghu h VAL 140 Cb 1.12 2.08 -0.03 0.00 -2.01 0.00 0.00 31.29 32.45 1ghu h VAL 140 CO 0.95 0.63 0.12 -0.55 -1.01 0.00 0.00 177.57 177.71 1ghu s SER 141 N -6.96 6.93 -0.01 3.17 0.15 -1.26 -4.64 113.70 111.09 1ghu s SER 141 Ca -0.06 1.38 -0.14 0.00 0.70 0.00 0.00 55.95 57.84 1ghu s SER 141 Cb 0.11 -2.41 -0.08 0.00 -1.71 0.00 0.00 66.02 61.93 1ghu s SER 141 CO 0.83 -0.10 0.77 -0.09 1.20 0.00 0.00 173.24 175.86 1ghu h ARG 142 N 2.81 -0.49 0.10 5.44 2.43 -1.98 -3.40 114.38 119.29 1ghu h ARG 142 Ca -0.48 0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 58.72 1ghu h ARG 142 Cb 1.18 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.85 1ghu h ARG 142 CO 0.65 -0.33 -0.05 -0.97 -1.51 0.00 0.00 179.97 177.76 1ghu h ASN 143 N -0.80 -0.12 -4.40 -3.80 -1.24 -2.01 -3.47 115.58 99.75 1ghu h ASN 143 Ca -0.05 -0.45 -0.50 0.00 0.71 0.00 0.00 56.30 56.00 1ghu h ASN 143 Cb 0.39 0.03 0.07 0.00 0.73 0.00 0.00 38.32 39.54 1ghu h ASN 143 CO 0.09 0.46 0.42 -1.10 -1.29 0.00 0.00 177.43 176.00 1ghu s GLN 144 N -3.60 3.31 -0.62 6.67 -0.21 -1.26 -5.05 119.66 118.89 1ghu s GLN 144 Ca -0.14 0.65 -0.10 0.00 0.02 0.00 0.00 55.36 55.80 1ghu s GLN 144 Cb 0.01 -2.06 0.16 0.00 1.00 0.00 0.00 33.01 32.12 1ghu s GLN 144 CO 0.56 -0.76 0.51 -0.65 -2.12 0.00 0.00 175.29 172.83 1ghu s GLN 145 N -5.24 2.89 -0.22 2.91 -1.52 -1.26 -4.34 119.66 112.88 1ghu s GLN 145 Ca 0.56 -2.17 -0.03 0.00 -1.95 0.00 0.00 55.36 51.78 1ghu s GLN 145 Cb -0.11 -4.06 0.00 0.00 -0.22 0.00 0.00 33.01 28.62 1ghu s GLN 145 CO 0.53 -1.23 -0.07 0.42 -0.25 0.00 0.00 175.29 174.69 1ghu s ILE 146 N 0.65 3.04 -0.12 1.08 -1.09 -1.26 -5.05 121.20 118.46 1ghu s ILE 146 Ca 0.12 -0.67 0.03 0.00 -2.23 0.00 0.00 60.65 57.90 1ghu s ILE 146 Cb -0.20 -2.40 0.01 0.00 -1.58 0.00 0.00 42.46 38.29 1ghu s ILE 146 CO -0.04 0.40 -0.21 -0.36 -1.23 0.00 0.00 174.94 173.51 1ghu s PHE 147 N 1.42 2.47 -0.12 3.97 0.08 -1.26 -2.48 117.98 122.06 1ghu s PHE 147 Ca 0.05 -1.16 -0.30 0.00 0.12 0.00 0.00 56.93 55.65 1ghu s PHE 147 Cb -0.14 -1.69 -0.01 0.00 -0.57 0.00 0.00 43.02 40.60 1ghu s PHE 147 CO -0.05 -0.52 1.08 -0.51 -0.10 0.00 0.00 175.22 175.12 1ghu s LEU 148 N 0.69 4.23 0.08 -0.37 1.02 -1.10 -3.95 118.68 119.28 1ghu s LEU 148 Ca -0.11 1.59 0.10 0.00 0.02 0.00 0.00 54.13 55.73 1ghu s LEU 148 Cb -0.16 -3.55 -0.03 0.00 0.02 0.00 0.00 46.19 42.46 1ghu s LEU 148 CO 0.02 -0.54 -0.27 -0.13 0.02 0.00 0.00 176.35 175.45 1ghu s ARG 149 N 2.34 1.62 0.60 1.70 3.00 -0.47 -4.48 118.95 123.25 1ghu s ARG 149 Ca 0.50 -1.22 -0.15 0.00 0.00 0.00 0.00 55.73 54.86 1ghu s ARG 149 Cb -0.20 -1.94 -0.04 0.00 0.00 0.00 0.00 34.95 32.77 1ghu s ARG 149 CO 0.17 0.48 1.05 0.34 0.00 0.00 0.00 175.30 177.34 1ghu s ASP 150 N -1.61 5.87 0.75 0.23 2.15 -1.26 -3.09 116.67 119.71 1ghu s ASP 150 Ca 0.13 1.74 -0.13 0.00 0.43 0.00 0.00 52.55 54.71 1ghu s ASP 150 Cb -0.10 -2.52 0.05 0.00 -0.30 0.00 0.00 42.92 40.05 1ghu s ASP 150 CO 0.04 -1.11 1.14 0.27 -0.17 0.00 0.00 175.17 175.34 1ghu s ILE 151 N -2.59 2.79 -2.03 4.11 -4.36 -1.26 -4.84 121.20 113.03 1ghu s ILE 151 Ca 0.62 0.33 0.32 0.00 -0.26 0.00 0.00 60.65 61.66 1ghu s ILE 151 Cb -0.15 -2.78 0.89 0.00 1.25 0.00 0.00 42.46 41.68 1ghu s ILE 151 CO 0.39 -0.26 2.20 1.21 0.24 0.00 0.00 174.94 178.72