#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 6.39 0.00 1.61 0.15 -1.26 -4.60 113.70 115.98 1ghu s SER 59 Ca 0.00 -1.53 0.00 0.00 0.70 0.00 0.00 55.95 55.12 1ghu s SER 59 Cb 0.00 -2.40 0.00 0.00 -1.71 0.00 0.00 66.02 61.91 1ghu s SER 59 CO 0.00 -1.24 0.00 -2.67 1.20 0.00 0.00 173.24 170.53 1ghu n TRP 60 N 7.04 -0.41 -2.79 3.44 2.14 -1.26 -4.77 117.44 120.84 1ghu n TRP 60 Ca 0.09 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.24 1ghu n TRP 60 Cb 0.47 0.34 -0.03 0.00 -0.81 0.00 0.00 31.31 31.28 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 -1.69 3.47 -0.56 -2.67 5.36 -1.26 -1.72 117.98 118.92 1ghu s PHE 61 Ca 0.00 1.44 0.06 0.00 -0.96 0.00 0.00 56.93 57.46 1ghu s PHE 61 Cb 0.00 -3.10 0.21 0.00 -0.34 0.00 0.00 43.02 39.79 1ghu s PHE 61 CO 0.00 -0.22 0.54 1.19 -1.46 0.00 0.00 175.22 175.26 1ghu n PHE 62 N 5.08 1.69 0.00 10.12 3.72 -1.19 -5.00 117.46 131.88 1ghu n PHE 62 Ca 0.07 -3.89 0.00 0.00 -0.05 0.00 0.00 57.45 53.57 1ghu n PHE 62 Cb 0.49 -0.35 0.00 0.00 -0.94 0.00 0.00 39.48 38.67 1ghu n PHE 62 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ghu n GLY 63 N 1.72 2.69 2.77 1.37 0.00 -1.26 -4.13 105.19 108.36 1ghu n GLY 63 Ca 0.25 0.30 -0.18 0.00 0.00 0.00 0.00 46.02 46.40 1ghu n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ghu s LYS 64 N 0.00 0.17 0.14 1.61 -2.85 -1.26 -3.99 119.74 113.57 1ghu s LYS 64 Ca 0.00 0.26 0.10 0.00 -1.00 0.00 0.00 55.97 55.32 1ghu s LYS 64 Cb 0.00 -1.08 -0.04 0.00 -2.06 0.00 0.00 37.83 34.65 1ghu s LYS 64 CO 0.00 -0.61 -0.22 0.96 0.10 0.00 0.00 175.35 175.58 1ghu s ILE 65 N 2.32 1.98 1.08 3.79 -4.36 -1.23 -4.93 121.20 119.85 1ghu s ILE 65 Ca 0.06 -1.78 -0.12 0.00 -0.26 0.00 0.00 60.65 58.54 1ghu s ILE 65 Cb -0.15 -1.84 0.21 0.00 1.25 0.00 0.00 42.46 41.93 1ghu s ILE 65 CO -0.11 -0.11 0.93 -2.65 0.24 0.00 0.00 174.94 173.24 1ghu n PRO 66 N 0.68 -1.62 -0.28 0.37 -0.02 -1.26 -4.62 135.00 128.25 1ghu n PRO 66 Ca -0.16 -0.43 -0.06 0.00 -2.02 0.00 0.00 63.50 60.83 1ghu n PRO 66 Cb 0.55 -2.18 0.06 0.00 -0.02 0.00 0.00 33.50 31.91 1ghu n PRO 66 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1ghu h ARG 67 N -2.32 1.13 -0.75 -0.52 2.43 -1.99 -2.22 114.38 110.14 1ghu h ARG 67 Ca -0.54 -0.19 -0.03 0.00 -0.81 0.00 0.00 59.98 58.41 1ghu h ARG 67 Cb 1.31 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 30.64 1ghu h ARG 67 CO 0.45 0.91 0.35 0.00 -1.51 0.00 0.00 179.97 180.16 1ghu h ALA 68 N 1.17 0.97 -0.54 2.80 0.00 -1.99 -2.03 119.26 119.64 1ghu h ALA 68 Ca 0.26 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1ghu h ALA 68 Cb 0.18 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1ghu h ALA 68 CO -0.03 0.55 0.06 -0.22 0.00 0.00 0.00 179.25 179.61 1ghu h LYS 69 N 1.06 0.87 -0.53 0.00 1.63 -1.92 -2.05 116.57 115.64 1ghu h LYS 69 Ca 0.26 -0.22 -0.08 0.00 -0.85 0.00 0.00 60.65 59.76 1ghu h LYS 69 Cb 0.14 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.64 1ghu h LYS 69 CO -0.03 0.83 0.03 0.00 -3.45 0.00 0.00 179.45 176.83 1ghu h ALA 70 N 1.24 0.71 -0.63 5.00 0.00 -1.35 -2.68 119.26 121.55 1ghu h ALA 70 Ca 0.17 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1ghu h ALA 70 Cb 0.41 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1ghu h ALA 70 CO 0.01 0.50 0.12 0.93 0.00 0.00 0.00 179.25 180.81 1ghu h GLU 71 N 0.79 1.01 0.28 0.00 5.08 -1.40 -2.75 114.58 117.59 1ghu h GLU 71 Ca 0.15 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1ghu h GLU 71 Cb 0.49 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1ghu h GLU 71 CO 0.02 0.92 -0.13 1.49 -1.00 0.00 0.00 179.01 180.30 1ghu h GLU 72 N 0.95 -0.36 -0.56 2.33 4.81 -1.38 -1.94 114.58 118.43 1ghu h GLU 72 Ca 0.20 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.45 1ghu h GLU 72 Cb 0.39 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.82 1ghu h GLU 72 CO 0.01 -0.22 0.33 1.98 -0.73 0.00 0.00 179.01 180.37 1ghu h MET 73 N -0.41 0.76 0.00 1.92 4.05 -1.56 -3.09 114.93 116.61 1ghu h MET 73 Ca -0.04 -0.08 -0.01 0.00 -0.28 0.00 0.00 59.70 59.30 1ghu h MET 73 Cb 0.31 -0.16 -0.00 0.00 -0.80 0.00 0.00 31.60 30.95 1ghu h MET 73 CO 0.06 0.56 -0.05 -0.07 0.23 0.00 0.00 176.91 177.65 1ghu h LEU 74 N 0.75 0.00 -1.23 3.39 3.38 -1.57 -3.21 115.31 116.82 1ghu h LEU 74 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1ghu h LEU 74 Cb 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1ghu h LEU 74 CO -0.04 0.05 0.49 -1.28 0.09 0.00 0.00 178.44 177.75 1ghu h SER 75 N 0.00 0.88 -0.74 -0.43 0.87 -1.26 -2.69 113.55 110.18 1ghu h SER 75 Ca -0.00 -0.03 0.02 0.00 -1.23 0.00 0.00 61.79 60.55 1ghu h SER 75 Cb 0.67 -0.22 -0.04 0.00 -0.44 0.00 0.00 62.40 62.37 1ghu h SER 75 CO 0.01 0.65 0.49 0.11 -0.53 0.00 0.00 176.83 177.56 1ghu h LYS 76 N 1.03 0.93 -6.28 2.24 1.57 -1.62 -3.41 116.57 111.03 1ghu h LYS 76 Ca 0.28 -0.06 -0.57 0.00 -1.87 0.00 0.00 60.65 58.43 1ghu h LYS 76 Cb -0.10 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 31.98 1ghu h LYS 76 CO -0.06 0.61 1.15 -0.65 -0.57 0.00 0.00 179.45 179.94 1ghu s GLN 77 N -5.81 3.74 0.17 3.15 1.11 -1.01 -4.94 119.66 116.06 1ghu s GLN 77 Ca -0.11 1.66 0.25 0.00 0.01 0.00 0.00 55.36 57.17 1ghu s GLN 77 Cb 0.18 -4.06 0.91 0.00 -1.01 0.00 0.00 33.01 29.03 1ghu s GLN 77 CO 0.78 -1.36 1.76 2.89 0.01 0.00 0.00 175.29 179.36 1ghu n ARG 78 N 7.76 0.17 -3.32 2.91 1.85 -1.26 -4.97 116.66 119.81 1ghu n ARG 78 Ca 0.19 0.24 -0.36 0.00 -1.00 0.00 0.00 57.85 56.92 1ghu n ARG 78 Cb 0.45 -1.74 -0.06 0.00 -1.05 0.00 0.00 32.46 30.06 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 -3.13 3.65 0.10 2.89 3.76 -1.26 -4.98 115.29 116.32 1ghu s HIS 79 Ca 0.09 1.13 -0.31 0.00 -0.15 0.00 0.00 55.06 55.83 1ghu s HIS 79 Cb 0.12 -2.42 -0.07 0.00 1.11 0.00 0.00 32.58 31.33 1ghu s HIS 79 CO 0.50 0.46 1.28 0.34 -0.85 0.00 0.00 174.74 176.46 1ghu s ASP 80 N -1.58 6.97 0.00 1.40 -1.08 -1.26 -3.35 116.67 117.77 1ghu s ASP 80 Ca 0.36 2.18 0.00 0.00 -0.52 0.00 0.00 52.55 54.57 1ghu s ASP 80 Cb -0.16 -2.59 0.00 0.00 -1.46 0.00 0.00 42.92 38.71 1ghu s ASP 80 CO 0.19 -0.53 0.00 0.61 0.52 0.00 0.00 175.17 175.96 1ghu n GLY 81 N 3.15 3.01 3.66 2.66 0.00 -0.41 -4.86 105.19 112.39 1ghu n GLY 81 Ca 0.09 0.00 -0.42 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 -2.06 3.56 0.16 4.61 0.00 -1.21 -1.67 121.76 125.14 1ghu s ALA 82 Ca 0.00 1.01 0.06 0.00 0.00 0.00 0.00 51.96 53.03 1ghu s ALA 82 Cb 0.00 -3.79 -0.04 0.00 0.00 0.00 0.00 23.12 19.29 1ghu s ALA 82 CO 0.00 -1.52 -0.14 -0.59 0.00 0.00 0.00 175.76 173.51 1ghu s PHE 83 N 4.35 1.51 -0.00 0.00 -0.71 -1.14 -1.45 117.98 120.53 1ghu s PHE 83 Ca 0.78 -0.60 0.01 0.00 -1.04 0.00 0.00 56.93 56.08 1ghu s PHE 83 Cb -0.35 -0.75 0.00 0.00 -1.21 0.00 0.00 43.02 40.71 1ghu s PHE 83 CO 0.33 0.22 -0.02 -0.48 -1.34 0.00 0.00 175.22 173.92 1ghu s LEU 84 N -2.90 1.95 -0.31 -1.99 0.05 -0.64 -4.66 118.68 110.18 1ghu s LEU 84 Ca 0.15 -0.04 -0.13 0.00 0.05 0.00 0.00 54.13 54.16 1ghu s LEU 84 Cb -0.02 -0.14 -0.03 0.00 -2.05 0.00 0.00 46.19 43.95 1ghu s LEU 84 CO 0.04 0.02 0.29 -0.63 -0.55 0.00 0.00 176.35 175.52 1ghu s ILE 85 N 0.01 5.23 0.08 1.48 1.01 -0.70 -1.64 121.20 126.68 1ghu s ILE 85 Ca 0.00 0.16 -0.03 0.00 0.00 0.00 0.00 60.65 60.79 1ghu s ILE 85 Cb -0.02 -3.69 -0.05 0.00 0.01 0.00 0.00 42.46 38.72 1ghu s ILE 85 CO -0.00 0.09 0.28 0.00 0.00 0.00 0.00 174.94 175.30 1ghu s ARG 86 N 1.90 3.53 -0.08 2.79 1.70 -0.93 -3.15 118.95 124.71 1ghu s ARG 86 Ca 0.10 -0.25 -0.12 0.00 -0.47 0.00 0.00 55.73 54.99 1ghu s ARG 86 Cb -0.16 -2.97 -0.05 0.00 -0.57 0.00 0.00 34.95 31.20 1ghu s ARG 86 CO 0.11 0.56 0.29 -2.00 -1.08 0.00 0.00 175.30 173.18 1ghu s GLU 87 N -2.46 3.82 0.29 3.89 2.12 -1.26 -1.31 118.70 123.80 1ghu s GLU 87 Ca 0.36 0.15 -0.29 0.00 0.36 0.00 0.00 54.97 55.55 1ghu s GLU 87 Cb -0.13 -3.25 -0.10 0.00 0.26 0.00 0.00 34.13 30.91 1ghu s GLU 87 CO 0.25 0.63 1.24 -1.12 -0.54 0.00 0.00 175.26 175.71 1ghu s SER 88 N -0.73 6.96 -0.03 -1.70 0.01 -0.70 -3.50 113.70 114.01 1ghu s SER 88 Ca 0.19 2.49 -0.23 0.00 1.31 0.00 0.00 55.95 59.71 1ghu s SER 88 Cb -0.14 -2.63 -0.17 0.00 0.21 0.00 0.00 66.02 63.29 1ghu s SER 88 CO 0.08 -0.40 1.04 -0.33 0.41 0.00 0.00 173.24 174.04 1ghu h GLU 89 N 3.90 -0.23 -0.60 12.44 4.39 -1.91 -3.16 114.58 129.42 1ghu h GLU 89 Ca -0.47 0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.20 1ghu h GLU 89 Cb 1.22 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.89 1ghu h GLU 89 CO 0.68 0.18 0.21 1.03 -1.16 0.00 0.00 179.01 179.96 1ghu h SER 90 N -0.77 0.82 -4.10 1.42 0.87 -2.00 -3.38 113.55 106.40 1ghu h SER 90 Ca -0.02 -0.12 -0.64 0.00 -1.23 0.00 0.00 61.79 59.77 1ghu h SER 90 Cb 0.52 -0.21 -0.41 0.00 -0.44 0.00 0.00 62.40 61.86 1ghu h SER 90 CO 0.04 0.75 -0.66 0.00 -0.53 0.00 0.00 176.83 176.43 1ghu s ALA 91 N -5.36 3.07 0.23 6.23 0.00 -1.25 -5.12 121.76 119.57 1ghu s ALA 91 Ca -0.10 -2.99 -0.31 0.00 0.00 0.00 0.00 51.96 48.56 1ghu s ALA 91 Cb 0.16 -2.08 -0.11 0.00 0.00 0.00 0.00 23.12 21.09 1ghu s ALA 91 CO 0.80 -1.93 1.58 -2.14 0.00 0.00 0.00 175.76 174.07 1ghu s PRO 92 N 0.11 4.18 0.00 0.00 0.02 -1.19 -2.65 135.00 135.47 1ghu s PRO 92 Ca 0.15 2.46 0.00 0.00 0.02 0.00 0.00 61.00 63.64 1ghu s PRO 92 Cb -0.24 -3.09 0.00 0.00 0.02 0.00 0.00 34.50 31.19 1ghu s PRO 92 CO -0.03 -0.61 0.00 0.41 -0.33 0.00 0.00 177.00 176.45 1ghu n GLY 93 N 3.02 2.63 3.59 0.52 0.00 -1.26 -5.05 105.19 108.64 1ghu n GLY 93 Ca 0.11 -0.35 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 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 0.31 6.54 0.33 1.61 2.15 -1.09 -4.80 116.67 121.72 1ghu s ASP 94 Ca 0.00 0.35 -0.01 0.00 0.43 0.00 0.00 52.55 53.32 1ghu s ASP 94 Cb 0.00 -2.55 -0.04 0.00 -0.30 0.00 0.00 42.92 40.03 1ghu s ASP 94 CO 0.00 -1.36 0.55 -0.36 -0.17 0.00 0.00 175.17 173.83 1ghu s PHE 95 N 4.73 3.50 -0.10 -5.34 0.40 -1.18 -1.72 117.98 118.27 1ghu s PHE 95 Ca 0.47 0.42 -0.03 0.00 -0.60 0.00 0.00 56.93 57.18 1ghu s PHE 95 Cb -0.08 -1.94 0.04 0.00 0.51 0.00 0.00 43.02 41.56 1ghu s PHE 95 CO 0.30 0.13 0.07 -1.12 0.70 0.00 0.00 175.22 175.30 1ghu s SER 96 N -3.82 1.70 -0.54 1.36 0.01 -0.42 -1.41 113.70 110.57 1ghu s SER 96 Ca 0.41 -0.24 -0.28 0.00 1.31 0.00 0.00 55.95 57.15 1ghu s SER 96 Cb -0.10 -0.20 0.03 0.00 0.21 0.00 0.00 66.02 65.96 1ghu s SER 96 CO 0.35 -0.29 1.13 -0.22 0.41 0.00 0.00 173.24 174.61 1ghu s LEU 97 N 2.15 3.62 -0.50 2.44 2.96 -0.64 -2.19 118.68 126.51 1ghu s LEU 97 Ca 0.04 0.14 -0.18 0.00 -0.22 0.00 0.00 54.13 53.90 1ghu s LEU 97 Cb -0.14 -3.22 0.06 0.00 0.50 0.00 0.00 46.19 43.39 1ghu s LEU 97 CO -0.06 -1.36 0.57 -0.44 -1.32 0.00 0.00 176.35 173.74 1ghu s SER 98 N 2.77 6.21 -0.16 3.68 0.01 -0.65 -1.64 113.70 123.91 1ghu s SER 98 Ca 0.42 -0.99 0.01 0.00 1.31 0.00 0.00 55.95 56.69 1ghu s SER 98 Cb -0.08 -2.27 0.01 0.00 0.21 0.00 0.00 66.02 63.89 1ghu s SER 98 CO 0.26 -0.83 -0.17 -0.69 0.41 0.00 0.00 173.24 172.22 1ghu s VAL 99 N 2.41 2.46 -0.95 3.43 1.01 -0.85 -1.62 120.40 126.28 1ghu s VAL 99 Ca 0.13 -0.83 -0.19 0.00 0.00 0.00 0.00 61.98 61.09 1ghu s VAL 99 Cb -0.20 -2.03 0.13 0.00 0.00 0.00 0.00 36.38 34.27 1ghu s VAL 99 CO 0.11 0.52 1.16 -0.75 0.00 0.00 0.00 175.10 176.13 1ghu s LYS 100 N 0.98 3.63 -0.39 2.72 2.36 -0.53 -1.30 119.74 127.21 1ghu s LYS 100 Ca -0.02 -1.80 -0.10 0.00 -2.55 0.00 0.00 55.97 51.50 1ghu s LYS 100 Cb -0.15 -4.94 0.05 0.00 -1.05 0.00 0.00 37.83 31.74 1ghu s LYS 100 CO -0.04 -1.79 0.22 0.12 1.55 0.00 0.00 175.35 175.42 1ghu s PHE 101 N 2.68 3.27 0.00 4.03 5.36 -0.88 -1.29 117.98 131.15 1ghu s PHE 101 Ca 0.34 -1.19 0.00 0.00 -0.96 0.00 0.00 56.93 55.12 1ghu s PHE 101 Cb -0.04 -2.61 0.00 0.00 -0.34 0.00 0.00 43.02 40.02 1ghu s PHE 101 CO -0.09 -0.73 0.00 0.41 -1.46 0.00 0.00 175.22 173.35 1ghu n GLY 102 N 4.96 1.69 2.72 13.12 0.00 -1.26 -3.52 105.19 122.90 1ghu n GLY 102 Ca -0.11 -0.33 -0.05 0.00 0.00 0.00 0.00 46.02 45.53 1ghu n GLY 102 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ghu n ASN 103 N 4.62 1.78 -3.70 1.61 0.23 -1.26 -4.71 115.26 113.82 1ghu n ASN 103 Ca 0.00 -2.41 -0.11 0.00 -0.53 0.00 0.00 54.58 51.52 1ghu n ASN 103 Cb 0.00 -0.49 -0.10 0.00 -2.08 0.00 0.00 39.78 37.11 1ghu n ASN 103 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 1ghu s ASP 104 N -3.53 -0.54 -0.43 0.53 1.01 -1.23 -5.13 116.67 107.35 1ghu s ASP 104 Ca 0.29 0.96 -0.18 0.00 0.71 0.00 0.00 52.55 54.33 1ghu s ASP 104 Cb 0.38 0.90 0.02 0.00 1.01 0.00 0.00 42.92 45.24 1ghu s ASP 104 CO -0.01 -0.18 0.50 -0.69 0.21 0.00 0.00 175.17 175.00 1ghu s VAL 105 N 0.89 5.00 -0.29 -1.27 1.01 -1.26 -2.08 120.40 122.40 1ghu s VAL 105 Ca -0.05 -0.22 -0.06 0.00 0.00 0.00 0.00 61.98 61.64 1ghu s VAL 105 Cb -0.06 -4.10 0.01 0.00 0.00 0.00 0.00 36.38 32.24 1ghu s VAL 105 CO -0.07 -0.49 0.06 -1.10 0.00 0.00 0.00 175.10 173.50 1ghu s GLN 106 N 2.35 3.06 -0.27 2.72 -0.21 -0.42 -4.87 119.66 122.01 1ghu s GLN 106 Ca 0.15 -0.87 -0.16 0.00 0.02 0.00 0.00 55.36 54.50 1ghu s GLN 106 Cb -0.16 -3.33 -0.03 0.00 1.00 0.00 0.00 33.01 30.49 1ghu s GLN 106 CO 0.15 -0.44 0.44 -1.01 -2.12 0.00 0.00 175.29 172.31 1ghu s HIS 107 N 1.48 3.25 -0.20 0.91 3.76 -1.26 -2.01 115.29 121.22 1ghu s HIS 107 Ca 0.02 0.49 -0.00 0.00 -0.15 0.00 0.00 55.06 55.42 1ghu s HIS 107 Cb -0.17 -2.66 0.02 0.00 1.11 0.00 0.00 32.58 30.88 1ghu s HIS 107 CO 0.02 -0.27 -0.16 -0.06 -0.85 0.00 0.00 174.74 173.42 1ghu s PHE 108 N 2.19 2.85 -0.47 1.40 0.08 -0.65 -4.95 117.98 118.44 1ghu s PHE 108 Ca 0.18 -1.52 -0.28 0.00 0.12 0.00 0.00 56.93 55.42 1ghu s PHE 108 Cb -0.16 -1.97 0.01 0.00 -0.57 0.00 0.00 43.02 40.34 1ghu s PHE 108 CO 0.10 -0.75 1.41 -1.59 -0.10 0.00 0.00 175.22 174.29 1ghu s LYS 109 N 1.32 3.47 -0.30 0.44 -2.85 -1.26 -1.62 119.74 118.95 1ghu s LYS 109 Ca 0.04 0.76 -0.26 0.00 -1.00 0.00 0.00 55.97 55.52 1ghu s LYS 109 Cb -0.14 -4.06 0.01 0.00 -2.06 0.00 0.00 37.83 31.58 1ghu s LYS 109 CO -0.10 -1.70 0.89 0.08 0.10 0.00 0.00 175.35 174.62 1ghu s VAL 110 N 5.67 4.71 -0.13 1.79 1.01 -0.50 -4.84 120.40 128.10 1ghu s VAL 110 Ca 0.58 1.46 -0.07 0.00 0.00 0.00 0.00 61.98 63.95 1ghu s VAL 110 Cb -0.12 -4.23 -0.04 0.00 0.00 0.00 0.00 36.38 31.98 1ghu s VAL 110 CO 0.30 -0.28 0.12 -0.76 0.00 0.00 0.00 175.10 174.48 1ghu s LEU 111 N 3.15 4.26 -0.18 3.92 1.43 -0.91 -3.08 118.68 127.27 1ghu s LEU 111 Ca 0.37 0.38 -0.04 0.00 -1.03 0.00 0.00 54.13 53.82 1ghu s LEU 111 Cb -0.14 -2.05 -0.02 0.00 0.03 0.00 0.00 46.19 44.01 1ghu s LEU 111 CO 0.12 0.36 -0.03 -0.13 0.23 0.00 0.00 176.35 176.90 1ghu s ARG 112 N -0.71 3.58 -0.11 1.70 0.52 -1.26 -1.29 118.95 121.37 1ghu s ARG 112 Ca 0.13 -0.55 -0.09 0.00 -0.52 0.00 0.00 55.73 54.70 1ghu s ARG 112 Cb -0.12 -2.97 -0.08 0.00 0.52 0.00 0.00 34.95 32.30 1ghu s ARG 112 CO 0.03 0.08 0.24 0.38 0.02 0.00 0.00 175.30 176.05 1ghu h ASP 113 N 7.22 -0.00 0.00 0.23 3.04 -1.97 -3.50 116.42 121.45 1ghu h ASP 113 Ca -0.34 -0.30 0.00 0.00 -3.24 0.00 0.00 57.03 53.15 1ghu h ASP 113 Cb 1.18 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.47 1ghu h ASP 113 CO 0.61 0.65 0.00 0.61 -2.04 0.00 0.00 179.24 179.07 1ghu n GLY 114 N 1.71 1.29 5.61 7.15 0.00 -1.26 -5.06 105.19 114.64 1ghu n GLY 114 Ca -0.03 0.14 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 -0.03 0.00 -2.72 4.61 0.00 -1.26 -4.18 120.51 116.93 1ghu n ALA 115 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 1ghu n ALA 115 Cb 0.00 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.50 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 -0.71 3.38 0.00 0.00 -1.26 -5.17 105.19 101.42 1ghu n GLY 116 Ca 0.00 0.54 -0.19 0.00 0.00 0.00 0.00 46.02 46.36 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 0.61 1.42 -0.14 1.61 3.01 -1.26 -4.45 119.74 120.53 1ghu s LYS 117 Ca 0.29 -1.67 -0.04 0.00 -1.01 0.00 0.00 55.97 53.54 1ghu s LYS 117 Cb 0.17 -1.11 0.07 0.00 -1.01 0.00 0.00 37.83 35.96 1ghu s LYS 117 CO -0.16 0.11 0.18 0.71 0.51 0.00 0.00 175.35 176.71 1ghu s TYR 118 N -3.01 -0.20 -0.12 3.18 2.02 -0.48 -4.22 117.35 114.52 1ghu s TYR 118 Ca 0.26 0.38 0.01 0.00 -0.37 0.00 0.00 57.07 57.35 1ghu s TYR 118 Cb 0.01 -0.33 0.02 0.00 -0.40 0.00 0.00 41.96 41.26 1ghu s TYR 118 CO 0.09 -0.44 -0.15 -0.59 -1.57 0.00 0.00 175.55 172.90 1ghu s PHE 119 N 2.30 2.05 -0.05 2.71 -0.71 -0.41 -1.56 117.98 122.31 1ghu s PHE 119 Ca 0.04 -1.04 -0.08 0.00 -1.04 0.00 0.00 56.93 54.81 1ghu s PHE 119 Cb -0.14 -1.49 -0.03 0.00 -1.21 0.00 0.00 43.02 40.15 1ghu s PHE 119 CO -0.09 -0.55 -0.17 -0.11 -1.34 0.00 0.00 175.22 172.96 1ghu n LEU 120 N 4.44 1.45 -0.06 -1.99 -0.00 -1.26 -2.14 117.00 117.43 1ghu n LEU 120 Ca -0.18 0.22 -0.06 0.00 -0.00 0.00 0.00 56.01 55.99 1ghu n LEU 120 Cb 0.51 -0.52 -0.02 0.00 -0.00 0.00 0.00 43.42 43.39 1ghu n LEU 120 CO 0.23 -0.43 -0.45 1.87 -0.00 0.00 0.00 177.39 178.62 1ghu n TRP 121 N -3.92 0.09 0.06 1.96 -0.00 -1.26 -4.97 117.44 109.41 1ghu n TRP 121 Ca -0.09 0.04 0.00 0.00 -0.00 0.00 0.00 57.50 57.45 1ghu n TRP 121 Cb 0.30 -0.39 0.00 0.00 -0.00 0.00 0.00 31.31 31.23 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 -3.88 0.41 -4.46 5.87 0.24 -1.26 -5.15 118.33 110.10 1ghu n VAL 122 Ca -0.09 0.14 -0.24 0.00 -2.04 0.00 0.00 64.34 62.10 1ghu n VAL 122 Cb 0.34 -1.05 -0.10 0.00 -1.47 0.00 0.00 33.84 31.57 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 -2.00 2.55 0.49 3.34 0.11 -1.26 -5.10 120.40 118.54 1ghu s VAL 123 Ca 0.00 -2.28 -0.18 0.00 -2.93 0.00 0.00 61.98 56.59 1ghu s VAL 123 Cb 0.00 -2.46 -0.09 0.00 -1.53 0.00 0.00 36.38 32.30 1ghu s VAL 123 CO 0.00 -0.35 0.98 -1.59 -3.33 0.00 0.00 175.10 170.82 1ghu s LYS 124 N -3.56 3.99 -0.08 1.54 0.00 -1.26 -4.46 119.74 115.91 1ghu s LYS 124 Ca 0.31 1.03 -0.03 0.00 0.00 0.00 0.00 55.97 57.28 1ghu s LYS 124 Cb -0.03 -2.14 0.04 0.00 0.00 0.00 0.00 37.83 35.70 1ghu s LYS 124 CO 0.16 -0.24 0.14 -0.06 0.00 0.00 0.00 175.35 175.36 1ghu s PHE 125 N -2.47 -0.14 0.06 1.78 0.08 -0.60 -4.91 117.98 111.78 1ghu s PHE 125 Ca 0.60 0.55 -0.37 0.00 0.12 0.00 0.00 56.93 57.83 1ghu s PHE 125 Cb -0.10 -0.28 -0.20 0.00 -0.57 0.00 0.00 43.02 41.86 1ghu s PHE 125 CO 0.26 -0.25 1.57 -0.91 -0.10 0.00 0.00 175.22 175.79 1ghu h ASN 126 N 8.30 -1.16 -3.40 1.36 2.35 -1.88 -1.26 115.58 119.89 1ghu h ASN 126 Ca -0.15 0.05 -0.50 0.00 -0.55 0.00 0.00 56.30 55.14 1ghu h ASN 126 Cb 1.12 0.31 0.00 0.00 0.05 0.00 0.00 38.32 39.80 1ghu h ASN 126 CO 0.16 -0.79 -0.02 -0.94 -1.65 0.00 0.00 177.43 174.19 1ghu s SER 127 N -4.06 6.45 0.39 5.81 1.04 -1.26 -4.32 113.70 117.74 1ghu s SER 127 Ca -0.20 0.88 0.08 0.00 0.48 0.00 0.00 55.95 57.19 1ghu s SER 127 Cb 0.02 -2.22 0.78 0.00 0.10 0.00 0.00 66.02 64.71 1ghu s SER 127 CO 0.60 -0.32 1.95 0.25 0.98 0.00 0.00 173.24 176.70 1ghu h LEU 128 N 1.32 0.33 -1.08 2.42 5.85 -1.96 -2.85 115.31 119.34 1ghu h LEU 128 Ca -0.47 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.15 1ghu h LEU 128 Cb 1.19 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 1ghu h LEU 128 CO 0.64 0.40 0.15 -1.13 -0.34 0.00 0.00 178.44 178.17 1ghu h ASN 129 N 0.36 0.75 -0.54 1.25 -0.73 -1.98 -2.16 115.58 112.52 1ghu h ASN 129 Ca 0.08 -0.12 -0.06 0.00 1.87 0.00 0.00 56.30 58.07 1ghu h ASN 129 Cb 0.24 -0.20 -0.02 0.00 0.27 0.00 0.00 38.32 38.62 1ghu h ASN 129 CO 0.01 0.72 0.09 -0.33 -0.37 0.00 0.00 177.43 177.55 1ghu h GLU 130 N 0.79 0.89 -0.41 6.67 3.07 -1.91 -1.25 114.58 122.43 1ghu h GLU 130 Ca 0.18 -0.24 0.04 0.00 -0.50 0.00 0.00 59.36 58.84 1ghu h GLU 130 Cb 0.25 -0.11 -0.04 0.00 -0.84 0.00 0.00 28.75 28.02 1ghu h GLU 130 CO -0.01 0.86 0.18 1.25 -1.40 0.00 0.00 179.01 179.90 1ghu h LEU 131 N 0.78 0.23 0.76 1.33 5.85 -1.46 -2.77 115.31 120.03 1ghu h LEU 131 Ca 0.16 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 1ghu h LEU 131 Cb 0.40 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.43 1ghu h LEU 131 CO 0.01 0.17 -0.41 0.58 -0.34 0.00 0.00 178.44 178.45 1ghu h VAL 132 N 0.37 0.17 -0.20 1.05 2.07 -1.39 -3.24 116.25 115.08 1ghu h VAL 132 Ca 0.18 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.70 1ghu h VAL 132 Cb 0.13 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 1ghu h VAL 132 CO -0.16 0.00 0.10 -0.78 0.02 0.00 0.00 177.57 176.75 1ghu h ASP 133 N -1.08 0.24 0.77 0.57 3.58 -1.26 -1.23 116.42 118.02 1ghu h ASP 133 Ca -0.10 -0.01 -0.04 0.00 0.42 0.00 0.00 57.03 57.30 1ghu h ASP 133 Cb 0.84 -0.06 0.01 0.00 1.72 0.00 0.00 39.33 41.84 1ghu h ASP 133 CO 0.14 0.21 -0.37 0.22 -2.88 0.00 0.00 179.24 176.56 1ghu h TYR 134 N 0.28 -0.96 0.00 0.28 3.20 -1.59 -3.27 116.97 114.91 1ghu h TYR 134 Ca 0.07 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1ghu h TYR 134 Cb 0.04 0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.62 1ghu h TYR 134 CO 0.00 -0.59 0.00 0.72 -1.64 0.00 0.00 178.16 176.65 1ghu n HIS 135 N -5.52 0.00 0.09 -3.82 8.25 -1.11 -2.39 115.22 110.72 1ghu n HIS 135 Ca -0.14 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.41 1ghu n HIS 135 Cb 0.42 -0.45 0.57 0.00 1.12 0.00 0.00 29.99 31.65 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 0.21 0.00 -0.41 2.43 -1.28 -3.00 114.38 112.34 1ghu h ARG 136 Ca 0.00 -0.01 -0.30 0.00 -0.81 0.00 0.00 59.98 58.85 1ghu h ARG 136 Cb 0.29 -0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.73 1ghu h ARG 136 CO 0.00 0.14 -2.14 0.43 -1.51 0.00 0.00 179.97 176.89 1ghu n SER 137 N -4.49 1.88 -4.87 -3.80 7.64 -1.21 -4.38 113.62 104.38 1ghu n SER 137 Ca 0.03 -0.07 -0.31 0.00 1.01 0.00 0.00 58.87 59.52 1ghu n SER 137 Cb 0.21 0.14 -0.05 0.00 -1.01 0.00 0.00 64.21 63.50 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 -2.40 4.90 -0.05 0.44 2.01 -1.01 -5.03 115.64 114.51 1ghu s THR 138 Ca -0.20 0.49 -0.30 0.00 0.31 0.00 0.00 61.69 61.99 1ghu s THR 138 Cb 0.06 -3.64 -0.04 0.00 0.01 0.00 0.00 72.50 68.89 1ghu s THR 138 CO 0.55 -0.14 1.35 -0.55 -0.69 0.00 0.00 174.62 175.13 1ghu s SER 139 N -2.49 6.90 0.37 3.53 0.15 -1.26 -4.45 113.70 116.44 1ghu s SER 139 Ca 0.48 1.97 0.16 0.00 0.70 0.00 0.00 55.95 59.26 1ghu s SER 139 Cb -0.11 -2.55 0.70 0.00 -1.71 0.00 0.00 66.02 62.35 1ghu s SER 139 CO 0.22 -0.71 1.77 1.62 1.20 0.00 0.00 173.24 177.34 1ghu h VAL 140 N 5.11 1.07 -3.79 4.45 3.04 -1.72 -3.44 116.25 120.95 1ghu h VAL 140 Ca -0.35 -1.48 -0.36 0.00 -1.01 0.00 0.00 66.70 63.50 1ghu h VAL 140 Cb 1.16 1.85 -0.30 0.00 -2.01 0.00 0.00 31.29 31.99 1ghu h VAL 140 CO 0.91 0.39 -0.76 -0.44 -1.01 0.00 0.00 177.57 176.66 1ghu s SER 141 N -6.62 0.74 -0.91 3.17 0.01 -1.26 -4.83 113.70 104.00 1ghu s SER 141 Ca -0.01 -0.11 -0.25 0.00 1.31 0.00 0.00 55.95 56.89 1ghu s SER 141 Cb 0.12 -0.18 0.04 0.00 0.21 0.00 0.00 66.02 66.22 1ghu s SER 141 CO 0.70 0.03 1.38 -0.13 0.41 0.00 0.00 173.24 175.63 1ghu s ARG 142 N 0.18 3.43 0.15 12.44 1.81 -1.26 -4.19 118.95 131.51 1ghu s ARG 142 Ca -0.02 -0.78 0.00 0.00 -1.72 0.00 0.00 55.73 53.21 1ghu s ARG 142 Cb -0.06 -4.89 0.00 0.00 -0.45 0.00 0.00 34.95 29.55 1ghu s ARG 142 CO -0.00 -2.18 0.00 0.27 -0.68 0.00 0.00 175.30 172.71 1ghu n ASN 143 N 9.05 -1.34 0.00 0.23 6.94 -1.26 -5.15 115.26 123.74 1ghu n ASN 143 Ca 0.21 0.35 0.00 0.00 -0.02 0.00 0.00 54.58 55.12 1ghu n ASN 143 Cb 0.50 1.50 0.00 0.00 -2.36 0.00 0.00 39.78 39.42 1ghu n ASN 143 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ghu n GLN 144 N -2.69 2.71 -3.61 -3.83 6.02 -1.26 -5.10 117.38 109.62 1ghu n GLN 144 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.72 1ghu n GLN 144 Cb 0.00 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.16 1ghu n GLN 144 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ghu n GLN 145 N 0.00 1.30 -2.88 -1.09 -0.00 -1.26 -4.97 117.38 108.48 1ghu n GLN 145 Ca 0.00 -3.98 -0.43 0.00 -0.00 0.00 0.00 57.00 52.59 1ghu n GLN 145 Cb 0.00 -1.99 -0.05 0.00 -0.00 0.00 0.00 30.24 28.20 1ghu n GLN 145 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1ghu s ILE 146 N -1.09 4.50 -0.06 -0.39 1.09 -1.26 -4.96 121.20 119.03 1ghu s ILE 146 Ca 0.30 0.47 0.03 0.00 -1.10 0.00 0.00 60.65 60.35 1ghu s ILE 146 Cb 0.03 -4.43 -0.02 0.00 -1.06 0.00 0.00 42.46 36.97 1ghu s ILE 146 CO -0.15 -0.90 -0.15 -0.36 -0.10 0.00 0.00 174.94 173.28 1ghu s PHE 147 N 3.66 2.68 -0.50 3.97 0.08 -1.26 -2.23 117.98 124.37 1ghu s PHE 147 Ca 0.32 -0.26 -0.25 0.00 0.12 0.00 0.00 56.93 56.86 1ghu s PHE 147 Cb -0.12 -1.65 0.03 0.00 -0.57 0.00 0.00 43.02 40.72 1ghu s PHE 147 CO 0.23 0.10 0.95 -0.51 -0.10 0.00 0.00 175.22 175.89 1ghu s LEU 148 N -0.55 4.01 0.35 -0.37 1.02 -1.13 -4.35 118.68 117.65 1ghu s LEU 148 Ca 0.08 -0.07 0.06 0.00 0.02 0.00 0.00 54.13 54.22 1ghu s LEU 148 Cb -0.11 -3.05 -0.07 0.00 0.02 0.00 0.00 46.19 42.98 1ghu s LEU 148 CO 0.01 -1.15 -0.01 -0.13 0.02 0.00 0.00 176.35 175.10 1ghu s ARG 149 N 3.91 1.77 0.56 1.70 0.52 -0.67 -4.45 118.95 122.29 1ghu s ARG 149 Ca 0.35 -1.96 -0.11 0.00 -0.52 0.00 0.00 55.73 53.49 1ghu s ARG 149 Cb -0.11 -1.34 -0.05 0.00 0.52 0.00 0.00 34.95 33.97 1ghu s ARG 149 CO 0.23 -0.04 0.96 0.16 0.02 0.00 0.00 175.30 176.64 1ghu s ASP 150 N -3.58 6.32 0.63 0.23 1.47 -1.26 -2.90 116.67 117.58 1ghu s ASP 150 Ca 0.34 1.33 -0.10 0.00 1.18 0.00 0.00 52.55 55.30 1ghu s ASP 150 Cb 0.07 -2.42 -0.02 0.00 -0.34 0.00 0.00 42.92 40.21 1ghu s ASP 150 CO 0.16 -0.74 1.02 0.27 0.68 0.00 0.00 175.17 176.56 1ghu s ILE 151 N -2.95 4.20 -2.52 2.11 -4.36 -1.26 -4.49 121.20 111.92 1ghu s ILE 151 Ca 0.54 0.59 0.28 0.00 -0.26 0.00 0.00 60.65 61.80 1ghu s ILE 151 Cb -0.11 -3.69 0.54 0.00 1.25 0.00 0.00 42.46 40.45 1ghu s ILE 151 CO 0.47 -0.87 1.73 1.21 0.24 0.00 0.00 174.94 177.72