#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jh7 n GLU 2 N 0.00 0.18 -3.12 2.12 2.13 -1.26 -4.91 120.64 115.78 1jh7 n GLU 2 Ca 0.00 0.08 -0.42 0.00 0.66 0.00 0.00 57.16 57.48 1jh7 n GLU 2 Cb 0.00 -0.81 -0.07 0.00 0.27 0.00 0.00 31.44 30.84 1jh7 n GLU 2 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 1jh7 s GLU 3 N -2.22 3.66 0.00 5.31 2.56 -1.26 -4.96 118.70 121.80 1jh7 s GLU 3 Ca -0.11 0.03 0.08 0.00 0.00 0.00 0.00 54.97 54.96 1jh7 s GLU 3 Cb 0.03 -3.81 0.22 0.00 2.00 0.00 0.00 34.13 32.57 1jh7 s GLU 3 CO 0.15 -0.74 1.18 1.33 -0.56 0.00 0.00 175.26 176.62 1jh7 n VAL 4 N 5.59 0.99 -4.01 3.70 0.24 -1.26 -4.96 118.33 118.63 1jh7 n VAL 4 Ca -0.01 -1.00 -0.35 0.00 -2.04 0.00 0.00 64.34 60.94 1jh7 n VAL 4 Cb 0.49 0.50 -0.14 0.00 -1.47 0.00 0.00 33.84 33.22 1jh7 n VAL 4 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1jh7 s LYS 5 N -1.00 3.31 -0.09 7.34 2.20 -1.26 -5.10 119.74 125.15 1jh7 s LYS 5 Ca 0.17 -0.66 0.02 0.00 -0.36 0.00 0.00 55.97 55.14 1jh7 s LYS 5 Cb 0.09 -2.91 -0.02 0.00 -1.51 0.00 0.00 37.83 33.48 1jh7 s LYS 5 CO 0.12 -0.17 -0.16 0.15 -0.36 0.00 0.00 175.35 174.93 1jh7 s LYS 6 N 1.36 2.92 0.10 4.03 1.02 -1.26 -3.61 119.74 124.30 1jh7 s LYS 6 Ca 0.04 -0.73 0.02 0.00 0.02 0.00 0.00 55.97 55.32 1jh7 s LYS 6 Cb -0.14 -2.45 -0.04 0.00 -0.52 0.00 0.00 37.83 34.68 1jh7 s LYS 6 CO -0.04 0.39 -0.08 -0.51 -0.92 0.00 0.00 175.35 174.19 1jh7 s ASP 7 N -0.12 1.24 -0.25 2.83 1.11 -1.04 -4.83 116.67 115.62 1jh7 s ASP 7 Ca -0.02 -0.95 -0.19 0.00 0.18 0.00 0.00 52.55 51.57 1jh7 s ASP 7 Cb -0.14 0.07 -0.02 0.00 1.07 0.00 0.00 42.92 43.89 1jh7 s ASP 7 CO 0.04 -0.40 0.57 -0.69 1.18 0.00 0.00 175.17 175.86 1jh7 s VAL 8 N -3.28 5.04 0.11 -1.27 1.01 -1.26 -2.63 120.40 118.12 1jh7 s VAL 8 Ca 0.10 1.01 0.08 0.00 0.00 0.00 0.00 61.98 63.16 1jh7 s VAL 8 Cb 0.03 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 1jh7 s VAL 8 CO -0.03 0.08 -0.12 -0.31 0.00 0.00 0.00 175.10 174.72 1jh7 s TYR 9 N 2.26 2.69 -0.02 5.22 1.51 -1.26 -1.46 117.35 126.28 1jh7 s TYR 9 Ca 0.24 -0.19 0.05 0.00 -1.01 0.00 0.00 57.07 56.16 1jh7 s TYR 9 Cb -0.16 -1.40 -0.01 0.00 -0.11 0.00 0.00 41.96 40.28 1jh7 s TYR 9 CO 0.09 0.42 -0.17 -1.54 -1.11 0.00 0.00 175.55 173.24 1jh7 s SER 10 N -2.23 1.99 -0.16 2.29 1.04 0.40 0.67 113.70 117.69 1jh7 s SER 10 Ca 0.21 -0.31 -0.13 0.00 0.48 0.00 0.00 55.95 56.19 1jh7 s SER 10 Cb -0.11 -0.29 -0.05 0.00 0.10 0.00 0.00 66.02 65.68 1jh7 s SER 10 CO 0.13 0.19 0.28 -0.69 0.98 0.00 0.00 173.24 174.13 1jh7 s VAL 11 N -0.30 5.31 -0.14 5.02 1.01 -0.58 -1.26 120.40 129.46 1jh7 s VAL 11 Ca 0.04 0.52 0.00 0.00 0.00 0.00 0.00 61.98 62.55 1jh7 s VAL 11 Cb -0.07 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.68 1jh7 s VAL 11 CO -0.00 0.40 -0.14 0.26 0.00 0.00 0.00 175.10 175.61 1jh7 s TRP 12 N 0.42 2.79 -0.40 5.22 0.52 0.69 -2.97 118.94 125.21 1jh7 s TRP 12 Ca 0.16 -0.81 -0.21 0.00 0.02 0.00 0.00 56.10 55.26 1jh7 s TRP 12 Cb -0.13 -1.86 0.01 0.00 -1.15 0.00 0.00 33.47 30.35 1jh7 s TRP 12 CO 0.04 -0.32 0.69 0.00 0.02 0.00 0.00 176.95 177.37 1jh7 s ALA 13 N 0.53 3.39 0.63 0.98 0.00 0.14 -0.50 121.76 126.93 1jh7 s ALA 13 Ca -0.09 -0.95 -0.11 0.00 0.00 0.00 0.00 51.96 50.81 1jh7 s ALA 13 Cb -0.16 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.64 1jh7 s ALA 13 CO 0.04 -1.60 1.03 -0.51 0.00 0.00 0.00 175.76 174.72 1jh7 s LEU 14 N 2.91 3.18 0.00 0.00 1.43 0.28 -1.95 118.68 124.53 1jh7 s LEU 14 Ca 0.26 1.32 0.00 0.00 -1.03 0.00 0.00 54.13 54.68 1jh7 s LEU 14 Cb -0.14 -4.31 0.00 0.00 0.03 0.00 0.00 46.19 41.78 1jh7 s LEU 14 CO 0.18 -0.96 0.00 -2.65 0.23 0.00 0.00 176.35 173.15 1jh7 n PRO 15 N -2.78 2.45 -4.15 1.29 -0.02 -1.26 -3.18 135.00 127.35 1jh7 n PRO 15 Ca 0.06 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.23 1jh7 n PRO 15 Cb 0.55 0.00 -0.08 0.00 -0.02 0.00 0.00 33.50 33.95 1jh7 n PRO 15 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1jh7 s ASP 16 N -1.00 5.05 0.00 2.55 1.01 -1.23 -3.63 116.67 119.42 1jh7 s ASP 16 Ca 0.00 -0.15 0.00 0.00 0.71 0.00 0.00 52.55 53.11 1jh7 s ASP 16 Cb 0.00 -1.22 0.00 0.00 1.01 0.00 0.00 42.92 42.71 1jh7 s ASP 16 CO 0.00 0.19 0.40 -1.84 0.21 0.00 0.00 175.17 174.13 1jh7 n GLU 17 N 0.68 0.53 0.00 8.23 0.00 -1.26 -0.51 120.64 128.32 1jh7 n GLU 17 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.05 1jh7 n GLU 17 Cb 0.52 -1.25 0.00 0.00 0.00 0.00 0.00 31.44 30.71 1jh7 n GLU 17 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1jh7 n GLU 18 N 0.48 3.74 -0.07 3.44 -0.58 -1.26 -4.89 120.64 121.51 1jh7 n GLU 18 Ca 0.00 0.00 -0.05 0.00 -0.42 0.00 0.00 57.16 56.69 1jh7 n GLU 18 Cb 0.20 -0.31 -0.02 0.00 -0.57 0.00 0.00 31.44 30.74 1jh7 n GLU 18 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1jh7 n SER 19 N 0.00 1.55 -0.16 1.62 7.64 0.34 -4.48 113.62 120.12 1jh7 n SER 19 Ca 0.00 0.43 -0.00 0.00 1.01 0.00 0.00 58.87 60.31 1jh7 n SER 19 Cb 0.00 -0.76 0.02 0.00 -1.01 0.00 0.00 64.21 62.46 1jh7 n SER 19 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1jh7 n GLU 20 N -4.17 -0.10 0.09 1.43 2.13 -0.19 0.54 120.64 120.37 1jh7 n GLU 20 Ca -0.09 0.66 -0.05 0.00 0.66 0.00 0.00 57.16 58.35 1jh7 n GLU 20 Cb 0.32 -0.98 0.12 0.00 0.27 0.00 0.00 31.44 31.16 1jh7 n GLU 20 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 1jh7 h PRO 21 N 0.00 0.23 -0.44 5.31 0.13 -1.83 2.64 132.00 138.03 1jh7 h PRO 21 Ca 0.15 -0.16 0.04 0.00 -0.87 0.00 0.00 66.00 65.16 1jh7 h PRO 21 Cb 0.26 0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.39 1jh7 h PRO 21 CO -0.43 0.77 0.30 -0.09 -0.23 0.00 0.00 178.00 178.32 1jh7 h ARG 22 N 0.17 0.44 0.00 0.86 2.43 -0.13 0.68 114.38 118.82 1jh7 h ARG 22 Ca -0.01 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1jh7 h ARG 22 Cb 1.13 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.58 1jh7 h ARG 22 CO 0.09 0.29 -0.00 0.74 -1.51 0.00 0.00 179.97 179.59 1jh7 h PHE 23 N 0.45 0.00 -1.17 2.20 0.05 -0.34 -3.29 116.94 114.85 1jh7 h PHE 23 Ca 0.18 0.00 0.41 0.00 3.82 0.00 0.00 57.97 62.38 1jh7 h PHE 23 Cb 0.16 0.00 -0.12 0.00 2.00 0.00 0.00 35.95 37.99 1jh7 h PHE 23 CO -0.00 0.00 0.74 1.63 -0.18 0.00 0.00 178.31 180.50 1jh7 n LYS 24 N -3.05 -0.03 -0.09 1.51 5.02 0.88 0.24 118.16 122.65 1jh7 n LYS 24 Ca -0.00 1.08 -0.14 0.00 -2.02 0.00 0.00 58.31 57.23 1jh7 n LYS 24 Cb 0.00 -2.12 -0.05 0.00 -0.02 0.00 0.00 35.03 32.85 1jh7 n LYS 24 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 1jh7 h LYS 25 N 0.00 0.71 -0.47 1.97 2.10 -1.01 0.20 116.57 120.08 1jh7 h LYS 25 Ca 0.75 -0.40 -0.07 0.00 -2.00 0.00 0.00 60.65 58.94 1jh7 h LYS 25 Cb 2.41 0.03 -0.02 0.00 -0.90 0.00 0.00 32.23 33.74 1jh7 h LYS 25 CO -0.41 1.02 0.01 1.25 -2.00 0.00 0.00 179.45 179.32 1jh7 h LEU 26 N 0.44 0.72 0.26 7.07 5.85 0.31 -1.17 115.31 128.80 1jh7 h LEU 26 Ca 0.04 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 1jh7 h LEU 26 Cb 0.91 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.76 1jh7 h LEU 26 CO 0.08 0.78 -0.12 0.24 -0.34 0.00 0.00 178.44 179.08 1jh7 h MET 27 N 0.71 -0.34 -0.01 1.25 2.86 -0.78 0.17 114.93 118.80 1jh7 h MET 27 Ca 0.14 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 1jh7 h MET 27 Cb 0.42 0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.15 1jh7 h MET 27 CO 0.02 -0.02 0.02 1.49 1.06 0.00 0.00 176.91 179.48 1jh7 h GLU 28 N -0.97 0.00 0.00 1.72 4.22 -0.64 -1.50 114.58 117.41 1jh7 h GLU 28 Ca -0.04 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.40 1jh7 h GLU 28 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1jh7 h GLU 28 CO 0.06 0.00 -0.13 0.00 -2.18 0.00 0.00 179.01 176.76 1jh7 h ALA 29 N 1.97 0.00 -1.04 2.92 0.00 -1.16 -3.35 119.26 118.60 1jh7 h ALA 29 Ca 0.00 -0.16 0.28 0.00 0.00 0.00 0.00 54.91 55.03 1jh7 h ALA 29 Cb 0.04 0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.89 1jh7 h ALA 29 CO -0.00 0.13 0.70 -0.07 0.00 0.00 0.00 179.25 180.01 1jh7 h LEU 30 N -0.74 0.28 -0.12 0.00 3.38 -0.55 -0.84 115.31 116.72 1jh7 h LEU 30 Ca 0.00 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1jh7 h LEU 30 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1jh7 h LEU 30 CO 0.00 0.06 0.00 -2.11 0.09 0.00 0.00 178.44 176.48 1jh7 n ARG 31 N -4.46 0.58 -0.07 1.13 1.85 -0.57 -2.92 116.66 112.19 1jh7 n ARG 31 Ca 0.24 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.94 1jh7 n ARG 31 Cb 0.95 -1.03 -0.05 0.00 -1.05 0.00 0.00 32.46 31.28 1jh7 n ARG 31 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 1jh7 n SER 32 N -0.42 1.36 0.00 2.89 3.41 -0.32 -4.32 113.62 116.22 1jh7 n SER 32 Ca 0.00 0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.84 1jh7 n SER 32 Cb 0.02 -0.54 0.00 0.00 -0.26 0.00 0.00 64.21 63.43 1jh7 n SER 32 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1jh7 n GLU 33 N -3.89 0.00 -2.57 4.33 2.13 -1.23 -4.62 120.64 114.80 1jh7 n GLU 33 Ca -0.27 0.49 -0.23 0.00 0.66 0.00 0.00 57.16 57.82 1jh7 n GLU 33 Cb 0.62 -1.47 0.07 0.00 0.27 0.00 0.00 31.44 30.93 1jh7 n GLU 33 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 1jh7 s PHE 34 N -2.88 2.35 0.00 4.31 0.40 -1.15 -5.10 117.98 115.92 1jh7 s PHE 34 Ca 0.00 -0.07 0.00 0.00 -0.60 0.00 0.00 56.93 56.26 1jh7 s PHE 34 Cb 0.00 -2.90 0.00 0.00 0.51 0.00 0.00 43.02 40.63 1jh7 s PHE 34 CO 0.00 -1.27 0.00 0.25 0.70 0.00 0.00 175.22 174.90 1jh7 n THR 35 N -2.61 0.00 0.00 0.64 -2.24 -1.26 -4.04 114.28 104.77 1jh7 n THR 35 Ca 0.11 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 1jh7 n THR 35 Cb 0.60 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 1jh7 n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jh7 n GLY 36 N 0.00 0.59 3.48 3.38 0.00 -1.26 -4.49 105.19 106.89 1jh7 n GLY 36 Ca 0.00 -2.17 -0.43 0.00 0.00 0.00 0.00 46.02 43.42 1jh7 n GLY 36 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1jh7 s PRO 37 N -0.65 3.21 -0.25 1.61 0.04 -1.26 -5.02 135.00 132.69 1jh7 s PRO 37 Ca 0.00 -0.59 -0.29 0.00 0.04 0.00 0.00 61.00 60.16 1jh7 s PRO 37 Cb 0.00 -4.12 -0.03 0.00 0.04 0.00 0.00 34.50 30.38 1jh7 s PRO 37 CO 0.00 -1.55 1.87 0.50 0.04 0.00 0.00 177.00 177.86 1jh7 s ARG 38 N 3.71 3.46 0.00 4.56 3.52 -1.26 -4.78 118.95 128.16 1jh7 s ARG 38 Ca 0.24 1.72 0.00 0.00 -0.13 0.00 0.00 55.73 57.57 1jh7 s ARG 38 Cb -0.15 -4.20 0.00 0.00 -1.56 0.00 0.00 34.95 29.04 1jh7 s ARG 38 CO 0.15 -1.70 0.00 1.97 -0.81 0.00 0.00 175.30 174.90 1jh7 n PHE 39 N 9.94 -0.49 -3.55 5.12 -1.74 -1.26 -5.13 117.46 120.35 1jh7 n PHE 39 Ca 0.23 0.00 -0.37 0.00 -0.56 0.00 0.00 57.45 56.75 1jh7 n PHE 39 Cb 0.45 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.39 1jh7 n PHE 39 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1jh7 s VAL 40 N 0.81 5.20 -0.04 1.97 -7.23 -1.26 -5.03 120.40 114.83 1jh7 s VAL 40 Ca 0.00 0.66 -0.33 0.00 -1.81 0.00 0.00 61.98 60.50 1jh7 s VAL 40 Cb 0.00 -3.65 -0.11 0.00 0.56 0.00 0.00 36.38 33.18 1jh7 s VAL 40 CO 0.00 0.50 1.90 -2.65 -0.31 0.00 0.00 175.10 174.54 1jh7 n PRO 41 N 2.55 2.39 -3.52 4.82 -0.02 -1.26 -4.93 135.00 135.03 1jh7 n PRO 41 Ca -0.14 0.87 -0.15 0.00 -2.02 0.00 0.00 63.50 62.07 1jh7 n PRO 41 Cb 0.53 -2.75 -0.05 0.00 -0.02 0.00 0.00 33.50 31.21 1jh7 n PRO 41 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1jh7 s HIS 42 N 4.03 -0.55 -0.14 6.00 -3.43 -1.26 -4.36 115.29 115.58 1jh7 s HIS 42 Ca 0.91 0.70 0.02 0.00 -0.80 0.00 0.00 55.06 55.89 1jh7 s HIS 42 Cb -0.62 0.42 0.00 0.00 -1.43 0.00 0.00 32.58 30.96 1jh7 s HIS 42 CO 0.48 -0.68 -0.19 0.08 -2.00 0.00 0.00 174.74 172.43 1jh7 s VAL 43 N -2.23 2.32 -0.35 -5.38 1.01 -0.82 -4.13 120.40 110.82 1jh7 s VAL 43 Ca -0.06 -0.89 -0.14 0.00 0.00 0.00 0.00 61.98 60.89 1jh7 s VAL 43 Cb -0.01 -1.95 -0.01 0.00 0.00 0.00 0.00 36.38 34.41 1jh7 s VAL 43 CO 0.00 0.54 0.29 -0.89 0.00 0.00 0.00 175.10 175.04 1jh7 s THR 44 N 0.77 5.24 -0.14 3.92 2.01 -1.26 0.26 115.64 126.43 1jh7 s THR 44 Ca -0.07 -0.17 0.19 0.00 0.31 0.00 0.00 61.69 61.94 1jh7 s THR 44 Cb -0.16 -3.77 -0.14 0.00 0.01 0.00 0.00 72.50 68.44 1jh7 s THR 44 CO -0.00 -0.07 0.76 1.33 -0.69 0.00 0.00 174.62 175.96 1jh7 n VAL 45 N 5.16 0.89 -3.72 3.82 0.24 -1.16 -4.95 118.33 118.62 1jh7 n VAL 45 Ca -0.11 -0.64 -0.11 0.00 -2.04 0.00 0.00 64.34 61.44 1jh7 n VAL 45 Cb 0.49 -0.51 -0.06 0.00 -1.47 0.00 0.00 33.84 32.30 1jh7 n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1jh7 s ALA 46 N -3.09 -0.72 -0.06 2.33 0.00 -1.23 -3.08 121.76 115.91 1jh7 s ALA 46 Ca -0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 51.96 51.79 1jh7 s ALA 46 Cb 0.09 0.51 0.03 0.00 0.00 0.00 0.00 23.12 23.75 1jh7 s ALA 46 CO 0.82 -0.53 0.03 0.54 0.00 0.00 0.00 175.76 176.62 1jh7 s VAL 47 N -3.34 0.12 0.00 0.00 0.11 -1.26 -1.53 120.40 114.50 1jh7 s VAL 47 Ca 0.00 0.26 0.00 0.00 -2.93 0.00 0.00 61.98 59.31 1jh7 s VAL 47 Cb 0.02 -0.35 0.00 0.00 -1.53 0.00 0.00 36.38 34.52 1jh7 s VAL 47 CO -0.08 0.20 0.00 -1.54 -3.33 0.00 0.00 175.10 170.34 1jh7 n SER 48 N 5.23 0.00 -0.79 3.54 3.41 0.21 -4.31 113.62 120.91 1jh7 n SER 48 Ca -0.05 -0.66 0.00 0.00 -0.26 0.00 0.00 58.87 57.90 1jh7 n SER 48 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 1jh7 n SER 48 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jh7 n ALA 49 N -3.00 0.00 -2.28 7.33 0.00 -1.26 -4.64 120.51 116.66 1jh7 n ALA 49 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 1jh7 n ALA 49 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1jh7 n ALA 49 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1jh7 s TYR 50 N 0.36 1.98 -0.16 0.00 1.51 -1.26 -4.25 117.35 115.53 1jh7 s TYR 50 Ca 0.00 0.32 -0.03 0.00 -1.01 0.00 0.00 57.07 56.35 1jh7 s TYR 50 Cb 0.00 -4.34 -0.02 0.00 -0.11 0.00 0.00 41.96 37.49 1jh7 s TYR 50 CO 0.00 -2.13 -0.05 -0.51 -1.11 0.00 0.00 175.55 171.74 1jh7 s LEU 51 N 7.59 3.11 0.00 -1.29 1.43 -1.08 -4.79 118.68 123.65 1jh7 s LEU 51 Ca 0.54 -0.20 -0.01 0.00 -1.03 0.00 0.00 54.13 53.42 1jh7 s LEU 51 Cb -0.09 -1.75 0.02 0.00 0.03 0.00 0.00 46.19 44.40 1jh7 s LEU 51 CO 0.14 0.14 0.06 0.35 0.23 0.00 0.00 176.35 177.27 1jh7 n THR 52 N 3.71 0.00 0.15 5.49 -2.24 -1.26 -2.49 114.28 117.65 1jh7 n THR 52 Ca -0.18 -0.01 -0.06 0.00 -2.27 0.00 0.00 64.05 61.54 1jh7 n THR 52 Cb 0.52 -0.32 -0.03 0.00 -2.10 0.00 0.00 70.33 68.40 1jh7 n THR 52 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jh7 h ALA 53 N -2.09 -0.97 0.16 6.98 0.00 -1.93 -3.11 119.26 118.29 1jh7 h ALA 53 Ca -0.03 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1jh7 h ALA 53 Cb 0.08 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1jh7 h ALA 53 CO 0.02 -0.94 -0.28 -0.44 0.00 0.00 0.00 179.25 177.60 1jh7 h ASP 54 N -0.44 -0.81 0.00 0.00 3.45 -1.95 -2.16 116.42 114.51 1jh7 h ASP 54 Ca -0.04 0.08 0.00 0.00 0.43 0.00 0.00 57.03 57.50 1jh7 h ASP 54 Cb 0.30 0.29 0.00 0.00 -0.56 0.00 0.00 39.33 39.36 1jh7 h ASP 54 CO 0.07 -0.33 0.58 -0.62 -1.57 0.00 0.00 179.24 177.37 1jh7 n GLU 55 N -4.05 0.02 -0.10 3.56 1.02 -1.26 -0.01 120.64 119.82 1jh7 n GLU 55 Ca -0.05 0.34 -0.18 0.00 -0.02 0.00 0.00 57.16 57.25 1jh7 n GLU 55 Cb 0.24 -2.14 -0.08 0.00 -0.02 0.00 0.00 31.44 29.43 1jh7 n GLU 55 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1jh7 n ALA 56 N -1.23 0.75 0.46 0.62 0.00 -0.82 -3.62 120.51 116.67 1jh7 n ALA 56 Ca -0.00 -0.55 -0.20 0.00 0.00 0.00 0.00 53.44 52.69 1jh7 n ALA 56 Cb 0.58 -0.31 -0.10 0.00 0.00 0.00 0.00 19.45 19.62 1jh7 n ALA 56 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1jh7 h LYS 57 N -1.00 -1.12 -1.11 0.00 2.10 -0.34 0.45 116.57 115.55 1jh7 h LYS 57 Ca -0.29 0.08 0.37 0.00 -2.00 0.00 0.00 60.65 58.80 1jh7 h LYS 57 Cb 1.13 0.25 -0.14 0.00 -0.90 0.00 0.00 32.23 32.57 1jh7 h LYS 57 CO -0.17 -0.75 0.67 0.87 -2.00 0.00 0.00 179.45 178.07 1jh7 h LYS 58 N -1.16 0.20 -0.09 0.07 1.57 -1.38 3.14 116.57 118.92 1jh7 h LYS 58 Ca -0.12 -0.01 -0.15 0.00 -1.87 0.00 0.00 60.65 58.51 1jh7 h LYS 58 Cb 0.89 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 33.17 1jh7 h LYS 58 CO 0.18 0.13 -0.51 0.52 -0.57 0.00 0.00 179.45 179.21 1jh7 h MET 59 N 0.21 0.51 -0.18 3.15 2.86 -1.21 0.18 114.93 120.44 1jh7 h MET 59 Ca 0.76 -0.42 -0.12 0.00 -2.06 0.00 0.00 59.70 57.86 1jh7 h MET 59 Cb 2.03 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 33.78 1jh7 h MET 59 CO -0.53 1.06 -0.41 0.35 1.06 0.00 0.00 176.91 178.43 1jh7 h PHE 60 N 0.09 0.50 -0.36 -0.22 -0.00 0.37 -0.89 116.94 116.45 1jh7 h PHE 60 Ca -0.04 -0.14 0.08 0.00 -0.00 0.00 0.00 57.97 57.87 1jh7 h PHE 60 Cb 1.16 -0.11 -0.08 0.00 -0.00 0.00 0.00 35.95 36.93 1jh7 h PHE 60 CO 0.12 0.77 -0.18 1.49 -0.00 0.00 0.00 178.31 180.51 1jh7 h GLU 61 N 0.35 -0.12 -0.13 1.11 4.81 0.57 0.85 114.58 122.01 1jh7 h GLU 61 Ca 0.03 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.23 1jh7 h GLU 61 Cb 0.88 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.28 1jh7 h GLU 61 CO 0.07 -0.08 -0.06 0.77 -0.73 0.00 0.00 179.01 178.98 1jh7 h SER 62 N -0.13 0.29 0.14 1.04 0.02 -0.54 -2.86 113.55 111.50 1jh7 h SER 62 Ca 0.18 -0.41 0.02 0.00 -0.84 0.00 0.00 61.79 60.74 1jh7 h SER 62 Cb 0.40 -0.08 -0.05 0.00 0.14 0.00 0.00 62.40 62.82 1jh7 h SER 62 CO -0.43 0.63 -0.47 0.00 -1.14 0.00 0.00 176.83 175.41 1jh7 h ALA 63 N 0.66 -0.87 -1.03 3.77 0.00 -0.63 -1.32 119.26 119.84 1jh7 h ALA 63 Ca 0.03 -0.09 0.27 0.00 0.00 0.00 0.00 54.91 55.11 1jh7 h ALA 63 Cb 0.52 0.79 -0.08 0.00 0.00 0.00 0.00 17.79 19.02 1jh7 h ALA 63 CO 0.02 -1.06 0.68 0.00 0.00 0.00 0.00 179.25 178.90 1jh7 n ASP 65 N -4.52 7.27 0.00 0.00 10.43 -0.50 -4.65 116.55 124.58 1jh7 n ASP 65 Ca 0.24 -2.49 0.00 0.00 2.57 0.00 0.00 54.79 55.11 1jh7 n ASP 65 Cb 0.91 -1.42 0.00 0.00 1.84 0.00 0.00 41.12 42.45 1jh7 n ASP 65 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1jh7 n GLY 66 N 3.40 -0.62 2.87 0.44 0.00 -0.25 -4.94 105.19 106.09 1jh7 n GLY 66 Ca 0.65 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.69 1jh7 n GLY 66 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jh7 n LEU 67 N 0.00 0.00 -4.29 0.99 7.99 -1.22 -4.69 117.00 115.78 1jh7 n LEU 67 Ca 0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 56.01 55.62 1jh7 n LEU 67 Cb 0.00 0.00 0.02 0.00 -0.11 0.00 0.00 43.42 43.33 1jh7 n LEU 67 CO 0.00 0.00 -0.49 2.29 -1.51 0.00 0.00 177.39 177.68 1jh7 n LYS 68 N -0.66 0.13 -1.19 3.23 2.85 -1.26 -4.85 118.16 116.42 1jh7 n LYS 68 Ca 0.00 0.06 -0.34 0.00 -1.05 0.00 0.00 58.31 56.98 1jh7 n LYS 68 Cb 0.00 -1.23 0.12 0.00 -0.65 0.00 0.00 35.03 33.27 1jh7 n LYS 68 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1jh7 s ALA 69 N -1.93 1.91 0.00 0.58 0.00 -1.25 -4.99 121.76 116.08 1jh7 s ALA 69 Ca 0.59 0.84 0.00 0.00 0.00 0.00 0.00 51.96 53.39 1jh7 s ALA 69 Cb -0.44 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.19 1jh7 s ALA 69 CO 0.64 -2.19 0.00 2.48 0.00 0.00 0.00 175.76 176.69 1jh7 n TYR 70 N -3.17 -0.59 -4.07 0.00 4.11 -1.26 -4.90 117.16 107.29 1jh7 n TYR 70 Ca 0.13 0.00 -0.11 0.00 -0.00 0.00 0.00 57.90 57.92 1jh7 n TYR 70 Cb 0.50 0.00 -0.11 0.00 -0.00 0.00 0.00 39.34 39.74 1jh7 n TYR 70 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.86 177.81 1jh7 s THR 71 N -2.70 0.45 0.16 -3.48 -4.23 -1.26 -1.13 115.64 103.46 1jh7 s THR 71 Ca 0.00 -1.27 0.10 0.00 -1.18 0.00 0.00 61.69 59.34 1jh7 s THR 71 Cb 0.00 -0.82 -0.04 0.00 1.34 0.00 0.00 72.50 72.98 1jh7 s THR 71 CO 0.00 -0.56 -0.22 0.00 -0.54 0.00 0.00 174.62 173.31 1jh7 s ALA 72 N -2.05 2.20 -0.11 3.99 0.00 0.78 -4.67 121.76 121.90 1jh7 s ALA 72 Ca -0.06 -1.50 0.02 0.00 0.00 0.00 0.00 51.96 50.43 1jh7 s ALA 72 Cb -0.06 -0.27 0.01 0.00 0.00 0.00 0.00 23.12 22.81 1jh7 s ALA 72 CO -0.02 0.36 -0.17 0.99 0.00 0.00 0.00 175.76 176.93 1jh7 s THR 73 N -1.64 1.62 -0.84 0.00 2.01 -1.25 0.13 115.64 115.66 1jh7 s THR 73 Ca 0.16 -0.72 -0.25 0.00 0.31 0.00 0.00 61.69 61.19 1jh7 s THR 73 Cb -0.08 -1.46 -0.00 0.00 0.01 0.00 0.00 72.50 70.97 1jh7 s THR 73 CO 0.07 0.46 1.67 -0.69 -0.69 0.00 0.00 174.62 175.44 1jh7 s VAL 74 N 0.91 3.61 0.42 3.82 1.01 1.97 -2.11 120.40 130.03 1jh7 s VAL 74 Ca -0.08 -0.22 0.14 0.00 0.00 0.00 0.00 61.98 61.82 1jh7 s VAL 74 Cb -0.15 -4.45 0.34 0.00 0.00 0.00 0.00 36.38 32.11 1jh7 s VAL 74 CO -0.01 -1.38 1.95 -0.78 0.00 0.00 0.00 175.10 174.87 1jh7 h ASP 75 N 11.42 0.42 0.00 3.32 1.82 -1.66 -2.75 116.42 128.99 1jh7 h ASP 75 Ca -0.02 0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1jh7 h ASP 75 Cb 1.05 -0.07 0.00 0.00 0.68 0.00 0.00 39.33 40.99 1jh7 h ASP 75 CO 1.29 0.24 0.00 -1.14 -1.61 0.00 0.00 179.24 178.02 1jh7 n ARG 76 N -4.48 0.00 -3.60 0.28 3.00 -1.04 -4.74 116.66 106.09 1jh7 n ARG 76 Ca 0.12 0.00 -0.37 0.00 -0.00 0.00 0.00 57.85 57.60 1jh7 n ARG 76 Cb 0.43 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 32.83 1jh7 n ARG 76 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1jh7 s VAL 77 N -2.00 5.20 0.21 5.15 1.01 -1.26 -1.11 120.40 127.60 1jh7 s VAL 77 Ca 0.00 0.63 -0.09 0.00 0.00 0.00 0.00 61.98 62.53 1jh7 s VAL 77 Cb 0.00 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.74 1jh7 s VAL 77 CO 0.00 0.55 0.33 -0.55 0.00 0.00 0.00 175.10 175.43 1jh7 s SER 78 N -0.76 0.01 0.06 3.32 0.15 -1.02 -4.90 113.70 110.56 1jh7 s SER 78 Ca 0.20 -1.04 0.09 0.00 0.70 0.00 0.00 55.95 55.91 1jh7 s SER 78 Cb -0.15 0.49 -0.03 0.00 -1.71 0.00 0.00 66.02 64.62 1jh7 s SER 78 CO 0.09 -0.99 -0.25 0.42 1.20 0.00 0.00 173.24 173.71 1jh7 s THR 79 N -4.04 2.03 0.00 6.45 -4.23 -1.26 -2.35 115.64 112.24 1jh7 s THR 79 Ca 0.25 -1.40 0.00 0.00 -1.18 0.00 0.00 61.69 59.36 1jh7 s THR 79 Cb 0.02 -1.75 0.00 0.00 1.34 0.00 0.00 72.50 72.11 1jh7 s THR 79 CO 0.07 0.28 0.00 0.61 -0.54 0.00 0.00 174.62 175.04 1jh7 n GLY 80 N 1.65 3.38 0.18 3.99 0.00 0.13 -4.98 105.19 109.54 1jh7 n GLY 80 Ca -0.17 -2.10 0.06 0.00 0.00 0.00 0.00 46.02 43.81 1jh7 n GLY 80 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1jh7 n THR 81 N -0.33 1.56 -3.56 2.61 5.66 -1.14 -4.74 114.28 114.35 1jh7 n THR 81 Ca 0.00 -1.70 -0.12 0.00 -3.05 0.00 0.00 64.05 59.18 1jh7 n THR 81 Cb 0.00 0.07 -0.04 0.00 -1.55 0.00 0.00 70.33 68.80 1jh7 n THR 81 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 1jh7 s PHE 82 N -2.09 -0.36 0.25 1.09 -0.71 -1.25 -5.03 117.98 109.87 1jh7 s PHE 82 Ca 0.22 0.22 0.22 0.00 -1.04 0.00 0.00 56.93 56.54 1jh7 s PHE 82 Cb 0.18 0.36 0.78 0.00 -1.21 0.00 0.00 43.02 43.13 1jh7 s PHE 82 CO 0.04 -0.71 0.73 0.34 -1.34 0.00 0.00 175.22 174.27 1jh7 n PHE 83 N 0.01 0.07 -0.01 3.49 -0.00 -1.26 0.30 117.46 120.06 1jh7 n PHE 83 Ca -0.17 0.07 0.00 0.00 -0.00 0.00 0.00 57.45 57.35 1jh7 n PHE 83 Cb 0.63 -0.33 -0.12 0.00 -0.00 0.00 0.00 39.48 39.65 1jh7 n PHE 83 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 1jh7 n PHE 84 N -3.04 0.49 -2.95 -5.13 3.01 -1.26 -3.03 117.46 105.55 1jh7 n PHE 84 Ca 0.20 0.16 -0.36 0.00 1.01 0.00 0.00 57.45 58.46 1jh7 n PHE 84 Cb 0.90 -0.92 -0.01 0.00 -0.01 0.00 0.00 39.48 39.43 1jh7 n PHE 84 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1jh7 n GLN 85 N -2.70 4.21 0.00 -1.08 6.02 0.15 -4.83 117.38 119.16 1jh7 n GLN 85 Ca -0.14 -4.68 0.00 0.00 -0.01 0.00 0.00 57.00 52.17 1jh7 n GLN 85 Cb 0.85 -2.40 0.00 0.00 1.02 0.00 0.00 30.24 29.71 1jh7 n GLN 85 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1jh7 s VAL 87 N 0.09 3.43 0.01 0.00 1.01 -1.16 -1.44 120.40 122.34 1jh7 s VAL 87 Ca 0.00 -0.55 -0.20 0.00 0.00 0.00 0.00 61.98 61.23 1jh7 s VAL 87 Cb 0.00 -2.43 0.04 0.00 0.00 0.00 0.00 36.38 33.99 1jh7 s VAL 87 CO 0.00 0.55 0.44 0.72 0.00 0.00 0.00 175.10 176.81 1jh7 s PHE 88 N -0.17 -0.32 -0.89 5.22 -0.71 -0.99 0.69 117.98 120.80 1jh7 s PHE 88 Ca 0.01 0.40 -0.23 0.00 -1.04 0.00 0.00 56.93 56.07 1jh7 s PHE 88 Cb -0.13 0.23 0.06 0.00 -1.21 0.00 0.00 43.02 41.97 1jh7 s PHE 88 CO 0.03 -0.54 1.29 -0.51 -1.34 0.00 0.00 175.22 174.15 1jh7 s LEU 89 N -1.69 3.80 0.10 -1.99 1.43 -0.05 -2.43 118.68 117.84 1jh7 s LEU 89 Ca -0.08 -1.25 -0.31 0.00 -1.03 0.00 0.00 54.13 51.46 1jh7 s LEU 89 Cb -0.02 -2.52 -0.09 0.00 0.03 0.00 0.00 46.19 43.59 1jh7 s LEU 89 CO 0.01 -1.51 1.73 -0.22 0.23 0.00 0.00 176.35 176.60 1jh7 s LEU 90 N 4.65 4.38 0.27 1.79 2.96 -0.27 -1.95 118.68 130.52 1jh7 s LEU 90 Ca 0.38 2.61 0.06 0.00 -0.22 0.00 0.00 54.13 56.96 1jh7 s LEU 90 Cb -0.05 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 43.05 1jh7 s LEU 90 CO -0.01 -0.94 0.37 -0.76 -1.32 0.00 0.00 176.35 173.68 1jh7 s LEU 91 N 2.63 4.13 -0.14 -0.68 1.43 -0.26 -1.92 118.68 123.87 1jh7 s LEU 91 Ca 0.77 -0.07 -0.19 0.00 -1.03 0.00 0.00 54.13 53.61 1jh7 s LEU 91 Cb -0.43 -2.73 -0.04 0.00 0.03 0.00 0.00 46.19 43.02 1jh7 s LEU 91 CO 0.34 -0.18 0.53 -1.10 0.23 0.00 0.00 176.35 176.17 1jh7 s GLN 92 N -4.02 4.31 0.00 1.70 -0.21 -0.90 -4.69 119.66 115.86 1jh7 s GLN 92 Ca 0.37 0.51 -0.00 0.00 0.02 0.00 0.00 55.36 56.26 1jh7 s GLN 92 Cb -0.09 -3.48 -0.01 0.00 1.00 0.00 0.00 33.01 30.44 1jh7 s GLN 92 CO 0.29 0.05 0.39 0.25 -2.12 0.00 0.00 175.29 174.14 1jh7 n THR 93 N 3.97 0.28 -0.62 -0.19 -2.24 -1.26 -4.72 114.28 109.49 1jh7 n THR 93 Ca -0.05 -0.09 -0.30 0.00 -2.27 0.00 0.00 64.05 61.34 1jh7 n THR 93 Cb 0.51 -1.17 0.21 0.00 -2.10 0.00 0.00 70.33 67.78 1jh7 n THR 93 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1jh7 s THR 94 N 1.96 2.05 0.00 4.28 -4.23 -1.26 -4.78 115.64 113.67 1jh7 s THR 94 Ca 0.02 0.02 0.00 0.00 -1.18 0.00 0.00 61.69 60.55 1jh7 s THR 94 Cb 0.01 -2.05 0.00 0.00 1.34 0.00 0.00 72.50 71.80 1jh7 s THR 94 CO 0.00 -0.02 0.05 -2.65 -0.54 0.00 0.00 174.62 171.46 1jh7 n PRO 95 N -4.56 0.00 -0.18 3.99 -0.02 -1.26 -3.20 135.00 129.76 1jh7 n PRO 95 Ca 0.08 0.03 0.15 0.00 -2.02 0.00 0.00 63.50 61.73 1jh7 n PRO 95 Cb 0.53 -0.55 0.24 0.00 -0.02 0.00 0.00 33.50 33.70 1jh7 n PRO 95 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1jh7 n GLU 96 N -0.08 -0.01 -0.07 -0.52 0.28 -1.26 -1.65 120.64 117.34 1jh7 n GLU 96 Ca 0.00 0.41 -0.07 0.00 -0.16 0.00 0.00 57.16 57.34 1jh7 n GLU 96 Cb 0.00 -0.84 -0.05 0.00 1.43 0.00 0.00 31.44 31.98 1jh7 n GLU 96 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 177.13 176.73 1jh7 h VAL 97 N 0.00 0.62 0.00 3.84 3.04 -1.83 -3.23 116.25 118.69 1jh7 h VAL 97 Ca 0.30 -1.52 0.00 0.00 -1.01 0.00 0.00 66.70 64.47 1jh7 h VAL 97 Cb 1.05 1.23 0.00 0.00 -2.01 0.00 0.00 31.29 31.56 1jh7 h VAL 97 CO -0.11 0.21 0.19 0.23 -1.01 0.00 0.00 177.57 177.07 1jh7 n MET 98 N -4.67 0.10 0.00 4.17 2.81 -0.66 0.16 117.12 119.04 1jh7 n MET 98 Ca -0.08 0.57 0.12 0.00 -1.81 0.00 0.00 57.70 56.51 1jh7 n MET 98 Cb 0.26 -2.01 0.19 0.00 -0.71 0.00 0.00 33.22 30.95 1jh7 n MET 98 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1jh7 n GLU 99 N -2.06 0.41 0.04 0.03 -0.58 -1.12 -2.94 120.64 114.42 1jh7 n GLU 99 Ca -0.01 -0.28 0.14 0.00 -0.42 0.00 0.00 57.16 56.59 1jh7 n GLU 99 Cb 0.21 -1.49 0.52 0.00 -0.57 0.00 0.00 31.44 30.11 1jh7 n GLU 99 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1jh7 n ALA 100 N -1.05 2.39 0.07 0.62 0.00 0.43 -2.23 120.51 120.73 1jh7 n ALA 100 Ca 0.08 -0.09 -0.16 0.00 0.00 0.00 0.00 53.44 53.26 1jh7 n ALA 100 Cb 0.35 -1.45 -0.14 0.00 0.00 0.00 0.00 19.45 18.22 1jh7 n ALA 100 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1jh7 h GLY 101 N 4.83 0.29 0.72 0.00 0.00 -1.46 -2.96 103.07 104.48 1jh7 h GLY 101 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 47.33 46.60 1jh7 h GLY 101 CO 0.00 0.64 0.00 -2.21 0.00 0.00 0.00 176.54 174.98 1jh7 n GLU 102 N -3.47 0.00 0.07 4.80 2.13 -0.95 0.46 120.64 123.69 1jh7 n GLU 102 Ca -0.14 0.01 -0.22 0.00 0.66 0.00 0.00 57.16 57.47 1jh7 n GLU 102 Cb 1.04 -1.50 -0.12 0.00 0.27 0.00 0.00 31.44 31.12 1jh7 n GLU 102 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1jh7 h HIS 103 N 0.00 0.98 0.00 4.31 2.76 -1.66 0.79 115.15 122.33 1jh7 h HIS 103 Ca 0.00 -0.60 -0.00 0.00 -2.20 0.00 0.00 60.37 57.57 1jh7 h HIS 103 Cb 0.01 -0.09 -0.00 0.00 1.55 0.00 0.00 27.41 28.88 1jh7 h HIS 103 CO 0.00 1.44 -0.01 0.00 -1.30 0.00 0.00 177.93 178.06 1jh7 n LYS 105 N -3.44 2.15 -1.45 0.00 2.85 -1.18 -4.02 118.16 113.06 1jh7 n LYS 105 Ca -0.03 -0.01 -0.48 0.00 -1.05 0.00 0.00 58.31 56.74 1jh7 n LYS 105 Cb 0.11 -1.18 -0.08 0.00 -0.65 0.00 0.00 35.03 33.22 1jh7 n LYS 105 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1jh7 n ASN 106 N -1.40 1.71 0.00 -5.58 5.03 0.27 -4.39 115.26 110.91 1jh7 n ASN 106 Ca 0.02 0.25 0.00 0.00 0.87 0.00 0.00 54.58 55.73 1jh7 n ASN 106 Cb 0.24 -1.22 0.00 0.00 -1.02 0.00 0.00 39.78 37.78 1jh7 n ASN 106 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.26 177.00 1jh7 n HIS 107 N 10.69 0.00 1.36 3.10 -0.00 -1.26 -4.46 115.22 124.64 1jh7 n HIS 107 Ca 0.46 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 58.31 1jh7 n HIS 107 Cb 0.22 0.04 0.45 0.00 -0.00 0.00 0.00 29.99 30.70 1jh7 n HIS 107 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1jh7 n PHE 108 N 7.17 0.09 -3.90 1.57 0.99 -1.26 -4.85 117.46 117.27 1jh7 n PHE 108 Ca 0.00 -0.05 -0.24 0.00 -0.00 0.00 0.00 57.45 57.16 1jh7 n PHE 108 Cb 0.00 0.00 -0.17 0.00 -1.00 0.00 0.00 39.48 38.31 1jh7 n PHE 108 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.76 177.97 1jh7 s ASN 109 N -1.82 1.80 0.00 4.37 3.04 -1.26 -5.05 114.94 116.02 1jh7 s ASN 109 Ca 0.36 -0.19 0.00 0.00 0.04 0.00 0.00 52.86 53.06 1jh7 s ASN 109 Cb 0.20 -0.63 0.00 0.00 -1.54 0.00 0.00 41.25 39.27 1jh7 s ASN 109 CO 0.31 -0.14 0.00 0.00 -3.04 0.00 0.00 177.10 174.23 1jh7 n SER 111 N 0.00 -0.92 0.00 0.00 7.64 -1.26 -4.47 113.62 114.61 1jh7 n SER 111 Ca 0.00 -3.17 0.00 0.00 1.01 0.00 0.00 58.87 56.71 1jh7 n SER 111 Cb 0.00 0.76 0.00 0.00 -1.01 0.00 0.00 64.21 63.96 1jh7 n SER 111 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1jh7 n THR 112 N 0.11 0.00 -3.94 0.44 -1.04 -1.26 -4.46 114.28 104.14 1jh7 n THR 112 Ca 0.10 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.80 1jh7 n THR 112 Cb 0.73 0.00 -0.15 0.00 -1.82 0.00 0.00 70.33 69.09 1jh7 n THR 112 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1jh7 s THR 113 N 0.00 1.79 -0.07 12.58 -4.23 -1.26 -5.03 115.64 119.42 1jh7 s THR 113 Ca 0.00 -1.82 -0.12 0.00 -1.18 0.00 0.00 61.69 58.57 1jh7 s THR 113 Cb 0.00 -2.22 0.03 0.00 1.34 0.00 0.00 72.50 71.64 1jh7 s THR 113 CO 0.00 -0.45 0.30 0.42 -0.54 0.00 0.00 174.62 174.35 1jh7 s THR 114 N 1.19 0.03 -0.84 3.99 -4.23 -1.26 -5.10 115.64 109.41 1jh7 s THR 114 Ca 0.05 -0.23 -0.25 0.00 -1.18 0.00 0.00 61.69 60.08 1jh7 s THR 114 Cb -0.19 -0.51 0.04 0.00 1.34 0.00 0.00 72.50 73.18 1jh7 s THR 114 CO -0.11 -0.13 1.36 -2.16 -0.54 0.00 0.00 174.62 173.04 1jh7 s PRO 115 N -0.52 3.32 -0.30 3.99 0.04 -1.26 -4.94 135.00 135.33 1jh7 s PRO 115 Ca -0.06 -0.55 -0.42 0.00 0.04 0.00 0.00 61.00 60.01 1jh7 s PRO 115 Cb -0.04 -4.63 -0.18 0.00 0.04 0.00 0.00 34.50 29.70 1jh7 s PRO 115 CO 0.02 -2.20 1.60 0.98 0.04 0.00 0.00 177.00 177.44 1jh7 n TYR 116 N 9.31 1.78 -4.02 0.56 9.36 -1.26 -4.94 117.16 127.96 1jh7 n TYR 116 Ca 0.15 0.80 -0.31 0.00 3.32 0.00 0.00 57.90 61.86 1jh7 n TYR 116 Cb 0.50 -2.34 -0.15 0.00 -0.63 0.00 0.00 39.34 36.72 1jh7 n TYR 116 CO 0.00 0.00 0.00 1.41 0.22 0.00 0.00 176.86 178.49 1jh7 s MET 117 N 2.76 1.50 0.01 2.98 -2.45 -1.26 -5.10 119.30 117.74 1jh7 s MET 117 Ca 0.99 -1.91 -0.30 0.00 -1.25 0.00 0.00 55.69 53.22 1jh7 s MET 117 Cb -1.23 -3.21 -0.06 0.00 1.25 0.00 0.00 34.83 31.58 1jh7 s MET 117 CO 0.69 -0.95 1.48 -1.25 1.05 0.00 0.00 175.02 176.04 1jh7 s PRO 118 N 0.85 4.25 0.05 4.11 0.04 -1.26 -5.00 135.00 138.05 1jh7 s PRO 118 Ca 0.11 2.07 -0.26 0.00 0.04 0.00 0.00 61.00 62.96 1jh7 s PRO 118 Cb -0.19 -3.61 0.07 0.00 0.04 0.00 0.00 34.50 30.81 1jh7 s PRO 118 CO -0.08 -0.64 0.61 -3.38 0.04 0.00 0.00 177.00 173.56 1jh7 s HIS 119 N 2.58 -0.55 -0.60 0.56 -3.43 -1.26 -1.10 115.29 111.49 1jh7 s HIS 119 Ca 0.67 0.66 -0.04 0.00 -0.80 0.00 0.00 55.06 55.55 1jh7 s HIS 119 Cb -0.33 0.45 0.15 0.00 -1.43 0.00 0.00 32.58 31.42 1jh7 s HIS 119 CO 0.28 -0.71 0.42 -1.17 -2.00 0.00 0.00 174.74 171.56 1jh7 s LEU 120 N -1.98 5.40 0.28 5.38 0.20 -0.82 -4.43 118.68 122.72 1jh7 s LEU 120 Ca -0.05 -2.64 -0.30 0.00 0.69 0.00 0.00 54.13 51.83 1jh7 s LEU 120 Cb -0.01 -1.89 -0.13 0.00 -0.43 0.00 0.00 46.19 43.73 1jh7 s LEU 120 CO -0.02 -0.44 1.32 -1.20 -0.29 0.00 0.00 176.35 175.72 1jh7 n SER 121 N 3.81 2.58 -0.13 3.68 7.64 -1.26 -0.87 113.62 129.07 1jh7 n SER 121 Ca 0.05 1.17 -0.28 0.00 1.01 0.00 0.00 58.87 60.83 1jh7 n SER 121 Cb 0.39 -1.43 -0.10 0.00 -1.01 0.00 0.00 64.21 62.06 1jh7 n SER 121 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1jh7 n LEU 122 N 1.54 2.02 -3.99 -3.43 4.32 0.22 -4.82 117.00 112.86 1jh7 n LEU 122 Ca 0.09 0.32 -0.09 0.00 -0.02 0.00 0.00 56.01 56.31 1jh7 n LEU 122 Cb 0.33 -0.85 -0.10 0.00 -1.62 0.00 0.00 43.42 41.18 1jh7 n LEU 122 CO 0.62 0.56 -0.28 -0.22 -1.22 0.00 0.00 177.39 176.84 1jh7 s LEU 123 N -7.50 2.09 -0.14 2.23 2.96 -0.71 -4.82 118.68 112.79 1jh7 s LEU 123 Ca -0.37 -0.68 0.01 0.00 -0.22 0.00 0.00 54.13 52.87 1jh7 s LEU 123 Cb 0.13 0.39 0.02 0.00 0.50 0.00 0.00 46.19 47.23 1jh7 s LEU 123 CO 0.52 -0.50 -0.16 -0.31 -1.32 0.00 0.00 176.35 174.57 1jh7 s TYR 124 N -2.84 2.26 -0.30 5.38 4.12 -1.26 -2.99 117.35 121.71 1jh7 s TYR 124 Ca -0.03 -1.20 -0.18 0.00 0.02 0.00 0.00 57.07 55.68 1jh7 s TYR 124 Cb 0.00 -1.62 0.18 0.00 -1.52 0.00 0.00 41.96 39.01 1jh7 s TYR 124 CO -0.06 -0.62 1.21 0.00 0.02 0.00 0.00 175.55 176.10 1jh7 s ALA 125 N 1.22 -3.50 -0.83 3.71 0.00 -1.17 -4.23 121.76 116.97 1jh7 s ALA 125 Ca -0.00 1.57 -0.25 0.00 0.00 0.00 0.00 51.96 53.27 1jh7 s ALA 125 Cb -0.14 -2.43 -0.08 0.00 0.00 0.00 0.00 23.12 20.47 1jh7 s ALA 125 CO -0.07 -1.24 2.12 -1.21 0.00 0.00 0.00 175.76 175.36 1jh7 s GLU 126 N 2.55 2.20 0.40 0.00 2.02 -1.26 -4.77 118.70 119.84 1jh7 s GLU 126 Ca -0.04 0.10 0.08 0.00 0.02 0.00 0.00 54.97 55.13 1jh7 s GLU 126 Cb -0.05 -4.90 -0.00 0.00 0.10 0.00 0.00 34.13 29.27 1jh7 s GLU 126 CO -0.12 -3.71 0.49 -0.51 0.02 0.00 0.00 175.26 171.42 1jh7 s LEU 127 N 11.77 3.66 -0.13 1.80 1.43 -1.26 -5.07 118.68 130.88 1jh7 s LEU 127 Ca 0.79 -0.45 -0.17 0.00 -1.03 0.00 0.00 54.13 53.27 1jh7 s LEU 127 Cb -0.10 -2.52 -0.04 0.00 0.03 0.00 0.00 46.19 43.57 1jh7 s LEU 127 CO 0.05 -0.65 0.43 0.42 0.23 0.00 0.00 176.35 176.84 1jh7 s THR 128 N -2.34 5.22 0.11 5.49 -4.23 -1.26 -4.90 115.64 113.73 1jh7 s THR 128 Ca 0.51 0.86 0.01 0.00 -1.18 0.00 0.00 61.69 61.88 1jh7 s THR 128 Cb -0.08 -3.77 0.15 0.00 1.34 0.00 0.00 72.50 70.14 1jh7 s THR 128 CO 0.31 0.34 0.57 -0.62 -0.54 0.00 0.00 174.62 174.67 1jh7 n GLU 129 N 3.67 -0.03 -0.24 3.99 -0.58 -1.26 0.13 120.64 126.33 1jh7 n GLU 129 Ca -0.08 0.54 -0.06 0.00 -0.42 0.00 0.00 57.16 57.14 1jh7 n GLU 129 Cb 0.52 -0.86 0.04 0.00 -0.57 0.00 0.00 31.44 30.57 1jh7 n GLU 129 CO 0.00 0.00 0.00 1.05 -0.48 0.00 0.00 177.13 177.70 1jh7 h GLU 130 N 0.00 0.96 0.00 3.49 4.11 -1.99 0.31 114.58 121.45 1jh7 h GLU 130 Ca 0.22 -0.13 -0.06 0.00 0.07 0.00 0.00 59.36 59.45 1jh7 h GLU 130 Cb 0.45 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 1jh7 h GLU 130 CO -0.34 0.75 -0.31 0.93 0.07 0.00 0.00 179.01 180.11 1jh7 h GLU 131 N 0.93 0.00 0.25 1.06 5.08 0.72 -2.64 114.58 119.99 1jh7 h GLU 131 Ca 0.23 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.58 1jh7 h GLU 131 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1jh7 h GLU 131 CO -0.03 0.31 -0.12 0.87 -1.00 0.00 0.00 179.01 179.03 1jh7 h LYS 132 N 0.00 -0.33 -0.66 2.33 1.57 -0.24 0.36 116.57 119.60 1jh7 h LYS 132 Ca -0.00 0.02 0.13 0.00 -1.87 0.00 0.00 60.65 58.93 1jh7 h LYS 132 Cb 1.04 0.07 -0.13 0.00 0.08 0.00 0.00 32.23 33.30 1jh7 h LYS 132 CO 0.04 -0.03 -0.19 0.87 -0.57 0.00 0.00 179.45 179.57 1jh7 h LYS 133 N -0.63 -0.02 0.58 3.15 1.79 -0.32 -1.43 116.57 119.68 1jh7 h LYS 133 Ca -0.03 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.41 1jh7 h LYS 133 Cb 0.45 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.11 1jh7 h LYS 133 CO 0.06 -0.02 -0.28 -0.97 -1.08 0.00 0.00 179.45 177.16 1jh7 h ASN 134 N -0.03 -0.67 -0.93 0.86 -0.00 -1.24 3.08 115.58 116.65 1jh7 h ASN 134 Ca 0.31 0.02 0.27 0.00 -0.00 0.00 0.00 56.30 56.90 1jh7 h ASN 134 Cb 0.50 0.18 -0.16 0.00 -0.00 0.00 0.00 38.32 38.84 1jh7 h ASN 134 CO -0.69 -0.48 0.18 0.00 -0.00 0.00 0.00 177.43 176.44 1jh7 h ALA 135 N -0.35 1.31 0.21 1.57 0.00 0.68 6.01 119.26 128.69 1jh7 h ALA 135 Ca -0.08 0.28 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1jh7 h ALA 135 Cb 0.60 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1jh7 h ALA 135 CO 0.13 -0.56 -0.10 0.37 0.00 0.00 0.00 179.25 179.08 1jh7 h GLN 136 N 0.10 -0.27 -0.19 0.00 4.15 -0.96 0.26 115.11 118.19 1jh7 h GLN 136 Ca 0.60 0.02 0.02 0.00 0.77 0.00 0.00 58.65 60.06 1jh7 h GLN 136 Cb 1.27 0.06 -0.03 0.00 0.21 0.00 0.00 27.48 29.00 1jh7 h GLN 136 CO -0.78 0.03 -0.15 1.49 -1.93 0.00 0.00 178.83 177.49 1jh7 h GLU 137 N -0.99 -0.05 -0.60 1.69 4.22 0.88 0.25 114.58 119.98 1jh7 h GLU 137 Ca -0.03 0.00 0.13 0.00 0.08 0.00 0.00 59.36 59.55 1jh7 h GLU 137 Cb 0.43 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 1jh7 h GLU 137 CO 0.05 -0.03 0.41 -0.22 -2.18 0.00 0.00 179.01 177.04 1jh7 h LYS 138 N -0.05 0.24 -0.89 1.92 1.63 1.21 -2.31 116.57 118.32 1jh7 h LYS 138 Ca 0.03 -0.01 0.12 0.00 -0.85 0.00 0.00 60.65 59.93 1jh7 h LYS 138 Cb 0.13 -0.05 -0.07 0.00 -0.60 0.00 0.00 32.23 31.64 1jh7 h LYS 138 CO -0.21 0.16 0.57 0.00 -3.45 0.00 0.00 179.45 176.52 1jh7 h ALA 139 N 1.70 1.72 0.00 5.00 0.00 0.17 -2.04 119.26 125.81 1jh7 h ALA 139 Ca 0.29 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1jh7 h ALA 139 Cb 0.79 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1jh7 h ALA 139 CO -0.06 0.07 0.00 0.66 0.00 0.00 0.00 179.25 179.92 1jh7 n TYR 140 N -4.55 0.00 0.11 0.00 4.01 -0.87 -2.11 117.16 113.75 1jh7 n TYR 140 Ca 0.16 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.93 1jh7 n TYR 140 Cb 0.38 -0.07 0.04 0.00 -0.31 0.00 0.00 39.34 39.38 1jh7 n TYR 140 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 1jh7 n THR 141 N 0.04 0.35 -0.01 -0.72 -1.04 -0.77 -4.44 114.28 107.69 1jh7 n THR 141 Ca 0.00 -0.67 -0.00 0.00 -2.04 0.00 0.00 64.05 61.33 1jh7 n THR 141 Cb 0.18 0.90 -0.02 0.00 -1.82 0.00 0.00 70.33 69.56 1jh7 n THR 141 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1jh7 n LEU 142 N 0.18 0.00 -3.65 -4.42 7.99 -0.90 -4.99 117.00 111.21 1jh7 n LEU 142 Ca 0.04 0.00 -0.15 0.00 -0.01 0.00 0.00 56.01 55.89 1jh7 n LEU 142 Cb 0.20 0.04 -0.14 0.00 -0.11 0.00 0.00 43.42 43.41 1jh7 n LEU 142 CO 0.03 0.04 -0.17 -1.81 -1.51 0.00 0.00 177.39 173.98 1jh7 s ASP 143 N -2.92 0.53 -0.07 -1.43 -0.00 -1.19 -5.00 116.67 106.57 1jh7 s ASP 143 Ca -0.01 0.47 0.15 0.00 -0.00 0.00 0.00 52.55 53.16 1jh7 s ASP 143 Cb 0.01 0.57 -0.23 0.00 -0.00 0.00 0.00 42.92 43.28 1jh7 s ASP 143 CO 0.11 -0.25 0.23 -1.54 -0.00 0.00 0.00 175.17 173.73 1jh7 n SER 144 N 5.34 1.26 0.10 0.27 3.41 -1.26 -4.17 113.62 118.58 1jh7 n SER 144 Ca -0.06 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.68 1jh7 n SER 144 Cb 0.50 1.39 0.34 0.00 -0.26 0.00 0.00 64.21 66.18 1jh7 n SER 144 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1jh7 h SER 145 N 0.00 0.00 -0.90 4.04 0.02 -1.97 -3.35 113.55 111.40 1jh7 h SER 145 Ca -0.17 -0.05 0.17 0.00 -0.84 0.00 0.00 61.79 60.91 1jh7 h SER 145 Cb 1.23 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.60 1jh7 h SER 145 CO 0.01 0.02 -0.24 -0.11 -1.14 0.00 0.00 176.83 175.37 1jh7 n LEU 146 N -2.28 -0.36 -4.78 5.07 7.94 -1.26 -3.64 117.00 117.69 1jh7 n LEU 146 Ca 0.05 1.55 -0.35 0.00 -1.11 0.00 0.00 56.01 56.14 1jh7 n LEU 146 Cb 0.44 -0.45 -0.02 0.00 0.53 0.00 0.00 43.42 43.92 1jh7 n LEU 146 CO 0.32 -1.47 0.76 -1.81 -1.11 0.00 0.00 177.39 174.08 1jh7 s ASP 147 N -5.25 6.16 0.00 1.96 -0.00 -1.26 -2.54 116.67 115.74 1jh7 s ASP 147 Ca -0.13 2.10 0.00 0.00 -0.00 0.00 0.00 52.55 54.52 1jh7 s ASP 147 Cb 0.23 -2.58 0.00 0.00 -0.00 0.00 0.00 42.92 40.57 1jh7 s ASP 147 CO 0.69 -0.92 0.00 0.61 -0.00 0.00 0.00 175.17 175.56 1jh7 n GLY 148 N 0.10 2.78 3.63 0.21 0.00 -1.04 -4.96 105.19 105.92 1jh7 n GLY 148 Ca 0.09 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.59 1jh7 n GLY 148 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1jh7 n LEU 149 N 0.00 2.08 -4.37 0.99 7.94 -1.05 -4.50 117.00 118.09 1jh7 n LEU 149 Ca 0.00 1.10 -0.30 0.00 -1.11 0.00 0.00 56.01 55.70 1jh7 n LEU 149 Cb 0.00 -1.23 -0.14 0.00 0.53 0.00 0.00 43.42 42.58 1jh7 n LEU 149 CO 0.00 -0.78 -0.56 -0.44 -1.11 0.00 0.00 177.39 174.50 1jh7 s SER 150 N 1.18 3.30 0.16 1.96 0.01 -1.25 0.52 113.70 119.58 1jh7 s SER 150 Ca 0.86 -0.58 -0.14 0.00 1.31 0.00 0.00 55.95 57.40 1jh7 s SER 150 Cb -0.91 -0.34 0.02 0.00 0.21 0.00 0.00 66.02 64.99 1jh7 s SER 150 CO 0.48 0.25 0.40 0.72 0.41 0.00 0.00 173.24 175.50 1jh7 s PHE 151 N -0.86 0.03 -0.10 2.43 -0.12 0.34 -4.92 117.98 114.78 1jh7 s PHE 151 Ca 0.13 -0.38 -0.05 0.00 -0.05 0.00 0.00 56.93 56.58 1jh7 s PHE 151 Cb -0.10 0.20 -0.04 0.00 -0.63 0.00 0.00 43.02 42.45 1jh7 s PHE 151 CO 0.03 -0.78 0.08 1.03 -0.05 0.00 0.00 175.22 175.52 1jh7 s ARG 152 N -3.88 3.22 -1.11 1.99 0.52 -1.26 -0.16 118.95 118.27 1jh7 s ARG 152 Ca 0.10 -0.26 -0.07 0.00 -0.52 0.00 0.00 55.73 54.97 1jh7 s ARG 152 Cb 0.01 -3.00 0.29 0.00 0.52 0.00 0.00 34.95 32.77 1jh7 s ARG 152 CO -0.05 0.74 1.27 1.28 0.02 0.00 0.00 175.30 178.56 1jh7 n LEU 153 N 2.05 5.85 0.21 2.53 7.99 -0.28 -3.47 117.00 131.88 1jh7 n LEU 153 Ca -0.19 -5.08 0.18 0.00 -0.01 0.00 0.00 56.01 50.91 1jh7 n LEU 153 Cb 0.54 -1.41 0.80 0.00 -0.11 0.00 0.00 43.42 43.24 1jh7 n LEU 153 CO 0.30 1.45 1.15 0.78 -1.51 0.00 0.00 177.39 179.56 1jh7 h ASN 154 N 6.23 0.00 -0.96 -1.43 4.21 -1.61 -3.37 115.58 118.65 1jh7 h ASN 154 Ca 0.19 0.00 0.03 0.00 1.21 0.00 0.00 56.30 57.73 1jh7 h ASN 154 Cb 0.78 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.97 1jh7 h ASN 154 CO 1.14 0.00 0.11 -2.11 -1.29 0.00 0.00 177.43 175.28 1jh7 n ARG 155 N -3.37 0.12 -4.47 0.81 1.85 -1.25 -1.00 116.66 109.36 1jh7 n ARG 155 Ca 0.03 -0.28 -0.23 0.00 -1.00 0.00 0.00 57.85 56.37 1jh7 n ARG 155 Cb 0.47 0.38 -0.10 0.00 -1.05 0.00 0.00 32.46 32.16 1jh7 n ARG 155 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1jh7 s LEU 156 N 0.00 2.15 -0.24 2.89 1.43 -0.18 0.98 118.68 125.70 1jh7 s LEU 156 Ca 0.04 -1.44 -0.13 0.00 -1.03 0.00 0.00 54.13 51.57 1jh7 s LEU 156 Cb -0.01 -0.34 0.08 0.00 0.03 0.00 0.00 46.19 45.95 1jh7 s LEU 156 CO 0.01 -0.67 0.59 0.00 0.23 0.00 0.00 176.35 176.51 1jh7 s ALA 157 N -3.27 -1.61 -0.25 4.21 0.00 0.34 -2.11 121.76 119.06 1jh7 s ALA 157 Ca 0.33 2.12 -0.15 0.00 0.00 0.00 0.00 51.96 54.27 1jh7 s ALA 157 Cb 0.07 -1.29 -0.04 0.00 0.00 0.00 0.00 23.12 21.86 1jh7 s ALA 157 CO 0.15 -0.39 0.36 -1.17 0.00 0.00 0.00 175.76 174.71 1jh7 s LEU 158 N 1.67 4.07 -0.03 0.00 2.96 0.43 -0.22 118.68 127.56 1jh7 s LEU 158 Ca -0.09 0.32 0.05 0.00 -0.22 0.00 0.00 54.13 54.19 1jh7 s LEU 158 Cb -0.07 -2.42 -0.01 0.00 0.50 0.00 0.00 46.19 44.20 1jh7 s LEU 158 CO -0.17 -0.14 -0.17 0.00 -1.32 0.00 0.00 176.35 174.54 1jh7 s LYS 160 N -0.16 3.74 -0.03 0.00 2.20 -0.18 -0.45 119.74 124.85 1jh7 s LYS 160 Ca 0.01 1.08 0.01 0.00 -0.36 0.00 0.00 55.97 56.71 1jh7 s LYS 160 Cb -0.09 -3.96 0.02 0.00 -1.51 0.00 0.00 37.83 32.29 1jh7 s LYS 160 CO 0.01 -1.35 -0.03 -0.08 -0.36 0.00 0.00 175.35 173.53 1jh7 s THR 161 N 4.91 0.41 -0.91 3.43 -1.32 -0.54 -1.40 115.64 120.23 1jh7 s THR 161 Ca 0.59 -0.09 -0.06 0.00 -1.21 0.00 0.00 61.69 60.92 1jh7 s THR 161 Cb -0.15 -0.43 0.23 0.00 -1.51 0.00 0.00 72.50 70.64 1jh7 s THR 161 CO 0.28 0.18 0.83 -0.62 -2.21 0.00 0.00 174.62 173.08 1jh7 s ASP 162 N 0.69 6.41 0.13 8.08 3.68 -1.26 -4.56 116.67 129.83 1jh7 s ASP 162 Ca -0.08 -3.41 0.00 0.00 2.13 0.00 0.00 52.55 51.18 1jh7 s ASP 162 Cb -0.11 -2.04 0.00 0.00 -1.45 0.00 0.00 42.92 39.32 1jh7 s ASP 162 CO -0.00 -0.30 0.42 0.35 0.13 0.00 0.00 175.17 175.77 1jh7 n THR 163 N 2.85 0.00 0.22 1.71 -2.24 -1.26 0.12 114.28 115.68 1jh7 n THR 163 Ca 0.19 0.42 0.03 0.00 -2.27 0.00 0.00 64.05 62.42 1jh7 n THR 163 Cb 0.39 -1.07 0.01 0.00 -2.10 0.00 0.00 70.33 67.57 1jh7 n THR 163 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1jh7 n GLU 164 N -0.99 0.56 -2.36 -0.78 1.02 -1.26 -4.87 120.64 111.96 1jh7 n GLU 164 Ca 0.00 -0.70 -0.37 0.00 -0.02 0.00 0.00 57.16 56.08 1jh7 n GLU 164 Cb 0.42 -1.05 -0.03 0.00 -0.02 0.00 0.00 31.44 30.77 1jh7 n GLU 164 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1jh7 n ASP 165 N 0.09 4.15 0.14 1.62 2.03 0.33 -4.75 116.55 120.15 1jh7 n ASP 165 Ca 0.03 -2.83 0.19 0.00 0.52 0.00 0.00 54.79 52.70 1jh7 n ASP 165 Cb 0.12 -1.75 0.75 0.00 -0.72 0.00 0.00 41.12 39.52 1jh7 n ASP 165 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1jh7 h LYS 166 N 8.47 0.00 0.00 -0.67 1.57 -1.89 1.62 116.57 125.67 1jh7 h LYS 166 Ca 0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 1jh7 h LYS 166 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.21 1jh7 h LYS 166 CO 1.36 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 180.49 1jh7 n THR 167 N -3.52 0.07 -0.47 -0.16 -2.24 -1.26 -4.82 114.28 101.88 1jh7 n THR 167 Ca 0.06 0.02 -0.01 0.00 -2.27 0.00 0.00 64.05 61.84 1jh7 n THR 167 Cb 0.59 -0.54 -0.00 0.00 -2.10 0.00 0.00 70.33 68.28 1jh7 n THR 167 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1jh7 n LEU 168 N -1.36 0.20 0.22 3.22 4.77 0.55 -4.73 117.00 119.88 1jh7 n LEU 168 Ca 0.11 0.03 0.08 0.00 -0.03 0.00 0.00 56.01 56.20 1jh7 n LEU 168 Cb 0.26 -1.19 0.50 0.00 -2.33 0.00 0.00 43.42 40.66 1jh7 n LEU 168 CO 0.23 -0.34 0.81 1.05 -1.33 0.00 0.00 177.39 177.82 1jh7 h GLU 169 N 0.00 0.00 0.00 3.23 4.11 -1.90 -2.57 114.58 117.45 1jh7 h GLU 169 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.41 1jh7 h GLU 169 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1jh7 h GLU 169 CO 0.03 0.26 -0.24 0.25 0.07 0.00 0.00 179.01 179.38 1jh7 n THR 170 N -3.70 0.13 -2.57 -1.06 -2.24 -1.26 -4.74 114.28 98.84 1jh7 n THR 170 Ca -0.01 -0.08 -0.42 0.00 -2.27 0.00 0.00 64.05 61.27 1jh7 n THR 170 Cb 0.37 -0.23 -0.03 0.00 -2.10 0.00 0.00 70.33 68.35 1jh7 n THR 170 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1jh7 s TRP 171 N -3.04 3.48 -0.08 4.78 0.52 -0.97 -4.42 118.94 119.20 1jh7 s TRP 171 Ca 0.12 1.46 -0.11 0.00 0.02 0.00 0.00 56.10 57.59 1jh7 s TRP 171 Cb 0.17 -3.28 0.03 0.00 -1.15 0.00 0.00 33.47 29.23 1jh7 s TRP 171 CO 0.62 -0.70 0.29 -1.21 0.02 0.00 0.00 176.95 175.97 1jh7 s GLU 172 N 1.41 0.43 -0.18 4.98 2.02 -0.49 -5.00 118.70 121.86 1jh7 s GLU 172 Ca 0.54 0.24 -0.25 0.00 0.02 0.00 0.00 54.97 55.52 1jh7 s GLU 172 Cb -0.24 0.20 -0.01 0.00 0.10 0.00 0.00 34.13 34.18 1jh7 s GLU 172 CO 0.26 -0.08 0.82 0.99 0.02 0.00 0.00 175.26 177.28 1jh7 s THR 173 N -0.26 4.88 -0.17 3.63 2.01 -1.26 -1.01 115.64 123.46 1jh7 s THR 173 Ca -0.04 1.61 0.12 0.00 0.31 0.00 0.00 61.69 63.69 1jh7 s THR 173 Cb -0.03 -4.13 -0.23 0.00 0.01 0.00 0.00 72.50 68.12 1jh7 s THR 173 CO 0.01 0.01 0.17 0.52 -0.69 0.00 0.00 174.62 174.64 1jh7 n VAL 174 N 4.81 1.49 -3.53 3.82 0.31 0.94 -4.95 118.33 121.23 1jh7 n VAL 174 Ca 0.04 -0.77 -0.08 0.00 -0.01 0.00 0.00 64.34 63.52 1jh7 n VAL 174 Cb 0.49 -0.89 -0.03 0.00 -0.91 0.00 0.00 33.84 32.50 1jh7 n VAL 174 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1jh7 s ALA 175 N -2.53 -1.88 0.04 3.52 0.00 -0.90 -4.97 121.76 115.05 1jh7 s ALA 175 Ca -0.15 1.21 -0.05 0.00 0.00 0.00 0.00 51.96 52.97 1jh7 s ALA 175 Cb 0.07 0.11 -0.02 0.00 0.00 0.00 0.00 23.12 23.29 1jh7 s ALA 175 CO 0.78 -0.59 0.08 0.54 0.00 0.00 0.00 175.76 176.56 1jh7 s VAL 176 N -2.60 0.14 -0.01 0.00 0.11 -1.26 0.16 120.40 116.95 1jh7 s VAL 176 Ca 0.04 -1.19 -0.07 0.00 -2.93 0.00 0.00 61.98 57.83 1jh7 s VAL 176 Cb -0.01 -0.98 0.00 0.00 -1.53 0.00 0.00 36.38 33.86 1jh7 s VAL 176 CO -0.06 -0.66 0.14 0.00 -3.33 0.00 0.00 175.10 171.19 1jh7 s ASN 178 N -1.13 6.56 -0.37 0.00 0.01 -1.26 -1.01 114.94 117.74 1jh7 s ASN 178 Ca -0.12 0.67 0.01 0.00 -0.71 0.00 0.00 52.86 52.71 1jh7 s ASN 178 Cb -0.07 -2.14 0.12 0.00 0.41 0.00 0.00 41.25 39.57 1jh7 s ASN 178 CO 0.01 0.36 0.16 -0.76 -1.51 0.00 0.00 177.10 175.36 1jh7 s LEU 179 N -1.14 2.69 -0.69 0.60 1.02 -0.17 -4.96 118.68 116.04 1jh7 s LEU 179 Ca 0.20 -2.15 0.04 0.00 0.02 0.00 0.00 54.13 52.24 1jh7 s LEU 179 Cb -0.14 -1.02 0.31 0.00 0.02 0.00 0.00 46.19 45.37 1jh7 s LEU 179 CO 0.09 -0.34 1.07 0.59 0.02 0.00 0.00 176.35 177.78 1jh7 n ASN 180 N 4.18 4.88 -4.62 2.29 4.13 -1.26 -3.75 115.26 121.11 1jh7 n ASN 180 Ca 0.04 -3.62 -0.30 0.00 1.68 0.00 0.00 54.58 52.37 1jh7 n ASN 180 Cb 0.38 -0.72 0.19 0.00 -1.54 0.00 0.00 39.78 38.10 1jh7 n ASN 180 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1jh7 s PRO 181 N -3.34 0.41 0.00 3.52 0.04 -1.26 -4.86 135.00 129.50 1jh7 s PRO 181 Ca 0.44 1.32 0.00 0.00 0.04 0.00 0.00 61.00 62.80 1jh7 s PRO 181 Cb 0.22 -1.67 0.00 0.00 0.04 0.00 0.00 34.50 33.09 1jh7 s PRO 181 CO -0.09 -2.97 0.00 0.41 0.04 0.00 0.00 177.00 174.38 1jh7 n GLY 182 N 0.37 0.01 7.00 0.56 0.00 -1.26 -4.86 105.19 107.01 1jh7 n GLY 182 Ca 0.09 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1jh7 n GLY 182 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1jh7 n SER 183 N -0.35 -2.72 0.00 1.61 7.64 -1.26 -4.87 113.62 113.66 1jh7 n SER 183 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1jh7 n SER 183 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1jh7 n SER 183 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1jh7 n HIS 184 N 0.00 0.00 0.51 1.43 1.44 -1.26 -5.30 115.22 112.04 1jh7 n HIS 184 Ca 0.00 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.77 1jh7 n HIS 184 Cb 0.00 0.00 0.05 0.00 0.12 0.00 0.00 29.99 30.16 1jh7 n HIS 184 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25