#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hm0 s ALA 14 N 0.00 1.83 0.38 5.20 0.00 -1.26 -4.95 121.76 122.95 3hm0 s ALA 14 Ca 0.00 -0.53 -0.27 0.00 0.00 0.00 0.00 51.96 51.16 3hm0 s ALA 14 Cb 0.00 -3.03 -0.09 0.00 0.00 0.00 0.00 23.12 20.00 3hm0 s ALA 14 CO 0.00 -2.25 1.29 -0.06 0.00 0.00 0.00 175.76 174.75 3hm0 s PHE 15 N -3.30 2.92 0.03 0.00 0.08 -1.26 -4.77 117.98 111.69 3hm0 s PHE 15 Ca 0.64 1.42 -0.14 0.00 0.12 0.00 0.00 56.93 58.97 3hm0 s PHE 15 Cb -0.15 -3.65 -0.06 0.00 -0.57 0.00 0.00 43.02 38.59 3hm0 s PHE 15 CO 0.53 -1.95 0.43 -1.01 -0.10 0.00 0.00 175.22 173.12 3hm0 s HIS 16 N -1.23 3.70 -0.00 0.36 3.76 0.20 -4.87 115.29 117.20 3hm0 s HIS 16 Ca 0.54 0.99 0.00 0.00 -0.15 0.00 0.00 55.06 56.44 3hm0 s HIS 16 Cb -0.38 -2.29 -0.04 0.00 1.11 0.00 0.00 32.58 30.98 3hm0 s HIS 16 CO 0.50 0.60 0.05 -0.51 -0.85 0.00 0.00 174.74 174.52 3hm0 s ASP 17 N -1.25 5.44 -0.23 1.40 1.11 -1.26 -1.03 116.67 120.85 3hm0 s ASP 17 Ca 0.27 0.08 -0.20 0.00 0.18 0.00 0.00 52.55 52.88 3hm0 s ASP 17 Cb -0.16 -1.50 0.06 0.00 1.07 0.00 0.00 42.92 42.38 3hm0 s ASP 17 CO 0.15 0.28 0.60 0.12 1.18 0.00 0.00 175.17 177.50 3hm0 s PHE 18 N -1.15 -0.71 -0.05 4.23 5.36 -0.34 -4.97 117.98 120.36 3hm0 s PHE 18 Ca 0.21 1.67 0.01 0.00 -0.96 0.00 0.00 56.93 57.85 3hm0 s PHE 18 Cb -0.12 0.28 -0.03 0.00 -0.34 0.00 0.00 43.02 42.81 3hm0 s PHE 18 CO 0.12 -0.35 -0.04 -0.65 -1.46 0.00 0.00 175.22 172.85 3hm0 s GLN 19 N 0.54 2.78 -0.03 10.12 -0.21 -1.26 0.65 119.66 132.26 3hm0 s GLN 19 Ca -0.02 -0.55 -0.02 0.00 0.02 0.00 0.00 55.36 54.79 3hm0 s GLN 19 Cb -0.05 -2.64 0.02 0.00 1.00 0.00 0.00 33.01 31.34 3hm0 s GLN 19 CO -0.02 0.66 0.07 0.00 -2.12 0.00 0.00 175.29 173.88 3hm0 s ALA 20 N -0.91 -0.14 0.15 6.09 0.00 -0.65 -4.98 121.76 121.31 3hm0 s ALA 20 Ca 0.15 0.29 -0.15 0.00 0.00 0.00 0.00 51.96 52.24 3hm0 s ALA 20 Cb -0.11 -0.19 -0.07 0.00 0.00 0.00 0.00 23.12 22.75 3hm0 s ALA 20 CO 0.04 -0.06 0.56 0.50 0.00 0.00 0.00 175.76 176.80 3hm0 s ARG 21 N 0.38 4.01 -0.10 0.00 6.06 -1.26 0.09 118.95 128.13 3hm0 s ARG 21 Ca -0.03 0.53 -0.23 0.00 -2.50 0.00 0.00 55.73 53.50 3hm0 s ARG 21 Cb -0.04 -2.95 -0.03 0.00 0.06 0.00 0.00 34.95 31.99 3hm0 s ARG 21 CO -0.01 0.48 0.71 0.08 -2.50 0.00 0.00 175.30 174.06 3hm0 s VAL 22 N -1.45 5.02 0.44 7.11 1.01 -0.39 -4.94 120.40 127.20 3hm0 s VAL 22 Ca 0.38 1.44 0.02 0.00 0.00 0.00 0.00 61.98 63.82 3hm0 s VAL 22 Cb -0.15 -4.04 0.02 0.00 0.00 0.00 0.00 36.38 32.20 3hm0 s VAL 22 CO 0.19 0.20 0.19 -1.22 0.00 0.00 0.00 175.10 174.46 3hm0 n TYR 23 N 4.15 0.05 -0.31 5.22 4.01 -1.26 -1.09 117.16 127.92 3hm0 n TYR 23 Ca -0.00 -2.02 -0.04 0.00 -0.16 0.00 0.00 57.90 55.67 3hm0 n TYR 23 Cb 0.51 -0.33 0.09 0.00 -0.31 0.00 0.00 39.34 39.30 3hm0 n TYR 23 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3hm0 h VAL 24 N 0.90 1.26 -0.12 -0.72 2.07 -1.97 -1.94 116.25 115.73 3hm0 h VAL 24 Ca -0.32 -0.69 0.03 0.00 0.82 0.00 0.00 66.70 66.54 3hm0 h VAL 24 Cb 1.07 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.96 3hm0 h VAL 24 CO 0.52 0.30 0.18 0.00 0.02 0.00 0.00 177.57 178.59 3hm0 h ALA 25 N 1.26 1.58 -0.00 1.67 0.00 -2.02 -1.94 119.26 119.80 3hm0 h ALA 25 Ca 0.30 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 3hm0 h ALA 25 Cb 0.08 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3hm0 h ALA 25 CO -0.04 -0.24 -0.17 -0.25 0.00 0.00 0.00 179.25 178.55 3hm0 n ASP 26 N -3.53 0.56 -4.83 0.00 8.00 -0.73 -4.96 116.55 111.07 3hm0 n ASP 26 Ca 0.00 -0.55 -0.21 0.00 0.71 0.00 0.00 54.79 54.74 3hm0 n ASP 26 Cb 0.28 -0.03 -0.04 0.00 -0.02 0.00 0.00 41.12 41.31 3hm0 n ASP 26 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3hm0 s THR 27 N -2.56 3.65 0.44 -3.53 -4.23 -0.73 -0.77 115.64 107.91 3hm0 s THR 27 Ca 0.25 -1.42 0.01 0.00 -1.18 0.00 0.00 61.69 59.36 3hm0 s THR 27 Cb 0.20 -3.20 -0.00 0.00 1.34 0.00 0.00 72.50 70.83 3hm0 s THR 27 CO 0.51 -0.21 0.03 -0.90 -0.54 0.00 0.00 174.62 173.51 3hm0 n ASP 28 N -1.31 2.80 0.30 3.99 5.68 -0.05 -4.55 116.55 123.41 3hm0 n ASP 28 Ca -0.03 -3.00 0.16 0.00 -0.50 0.00 0.00 54.79 51.42 3hm0 n ASP 28 Cb 0.60 0.46 0.94 0.00 -1.14 0.00 0.00 41.12 41.98 3hm0 n ASP 28 CO 0.00 0.00 0.00 2.19 -1.33 0.00 0.00 177.20 178.06 3hm0 h PHE 29 N 1.32 0.00 -0.05 2.11 -0.00 -2.01 -1.75 116.94 116.57 3hm0 h PHE 29 Ca -0.36 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.61 3hm0 h PHE 29 Cb 1.14 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.09 3hm0 h PHE 29 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 178.31 177.18 3hm0 n SER 30 N -3.79 0.39 0.00 -0.68 3.41 -1.26 -4.90 113.62 106.79 3hm0 n SER 30 Ca -0.03 -1.65 0.00 0.00 -0.26 0.00 0.00 58.87 56.93 3hm0 n SER 30 Cb 0.08 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 3hm0 n SER 30 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hm0 n GLY 31 N 0.79 3.39 3.97 5.00 0.00 -0.66 -5.04 105.19 112.65 3hm0 n GLY 31 Ca 0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.90 3hm0 n GLY 31 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hm0 s VAL 32 N -2.62 1.87 0.22 1.61 -7.23 -1.26 -4.62 120.40 108.37 3hm0 s VAL 32 Ca 0.00 -1.25 -0.30 0.00 -1.81 0.00 0.00 61.98 58.62 3hm0 s VAL 32 Cb 0.00 -2.12 -0.09 0.00 0.56 0.00 0.00 36.38 34.73 3hm0 s VAL 32 CO 0.00 0.00 1.32 -0.69 -0.31 0.00 0.00 175.10 175.42 3hm0 s VAL 33 N -2.73 3.11 0.35 1.32 1.01 -0.94 -0.87 120.40 121.65 3hm0 s VAL 33 Ca 0.47 0.94 -0.29 0.00 0.00 0.00 0.00 61.98 63.11 3hm0 s VAL 33 Cb -0.04 -3.60 -0.11 0.00 0.00 0.00 0.00 36.38 32.63 3hm0 s VAL 33 CO 0.30 0.15 1.42 -0.47 0.00 0.00 0.00 175.10 176.50 3hm0 s TYR 34 N -0.05 2.79 0.32 5.22 5.04 0.05 -4.75 117.35 125.98 3hm0 s TYR 34 Ca 0.56 1.23 0.00 0.00 -2.44 0.00 0.00 57.07 56.42 3hm0 s TYR 34 Cb -0.37 -3.89 0.52 0.00 0.35 0.00 0.00 41.96 38.57 3hm0 s TYR 34 CO 0.40 -2.60 1.94 1.12 -1.34 0.00 0.00 175.55 175.07 3hm0 h HIS 35 N 3.37 0.86 -0.00 4.97 2.07 -1.93 -0.90 115.15 123.60 3hm0 h HIS 35 Ca -0.50 -0.01 -0.05 0.00 -2.85 0.00 0.00 60.37 56.96 3hm0 h HIS 35 Cb 1.23 -0.28 -0.01 0.00 2.57 0.00 0.00 27.41 30.93 3hm0 h HIS 35 CO 0.55 0.61 -0.24 0.00 -3.07 0.00 0.00 177.93 175.78 3hm0 h ALA 36 N 1.49 1.60 0.00 6.11 0.00 -1.97 -3.02 119.26 123.47 3hm0 h ALA 36 Ca 0.23 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 3hm0 h ALA 36 Cb 0.03 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3hm0 h ALA 36 CO -0.04 0.30 -0.23 0.00 0.00 0.00 0.00 179.25 179.29 3hm0 h ARG 37 N 0.01 0.00 -0.43 0.00 2.47 -1.49 -1.55 114.38 113.39 3hm0 h ARG 37 Ca -0.00 0.00 0.11 0.00 -1.26 0.00 0.00 59.98 58.83 3hm0 h ARG 37 Cb 0.42 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.72 3hm0 h ARG 37 CO 0.03 0.23 0.30 1.88 0.56 0.00 0.00 179.97 182.97 3hm0 h TYR 38 N 0.00 0.08 0.00 3.04 0.05 -1.60 0.06 116.97 118.59 3hm0 h TYR 38 Ca -0.00 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.73 3hm0 h TYR 38 Cb 0.40 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 38.11 3hm0 h TYR 38 CO 0.00 0.03 -0.23 -0.07 -1.05 0.00 0.00 178.16 176.85 3hm0 h LEU 39 N 0.07 0.00 -0.63 3.88 4.07 -1.46 -0.81 115.31 120.43 3hm0 h LEU 39 Ca 0.20 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 58.03 3hm0 h LEU 39 Cb 0.72 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.45 3hm0 h LEU 39 CO -0.02 0.23 -0.31 -0.33 -1.08 0.00 0.00 178.44 176.94 3hm0 h GLU 40 N 0.00 0.75 -0.17 1.13 5.08 -1.09 -1.27 114.58 119.01 3hm0 h GLU 40 Ca -0.00 -0.34 -0.09 0.00 -1.00 0.00 0.00 59.36 57.93 3hm0 h GLU 40 Cb 0.41 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 3hm0 h GLU 40 CO 0.03 0.96 -0.24 0.74 -1.00 0.00 0.00 179.01 179.49 3hm0 h PHE 41 N 0.64 0.57 -0.77 4.33 0.04 -1.20 -1.84 116.94 118.70 3hm0 h PHE 41 Ca 0.07 -0.19 0.00 0.00 2.80 0.00 0.00 57.97 60.65 3hm0 h PHE 41 Cb 0.83 -0.11 -0.04 0.00 2.20 0.00 0.00 35.95 38.83 3hm0 h PHE 41 CO 0.04 0.88 0.49 0.74 -0.60 0.00 0.00 178.31 179.86 3hm0 h PHE 42 N 0.10 0.99 -0.57 -0.55 0.04 -1.09 -1.60 116.94 114.27 3hm0 h PHE 42 Ca 0.02 0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.74 3hm0 h PHE 42 Cb 0.81 -0.33 -0.03 0.00 2.20 0.00 0.00 35.95 38.61 3hm0 h PHE 42 CO 0.09 0.64 0.12 1.49 -0.60 0.00 0.00 178.31 180.05 3hm0 h GLU 43 N 1.05 0.89 -0.36 1.51 4.81 -1.06 -1.15 114.58 120.28 3hm0 h GLU 43 Ca 0.28 -0.20 0.03 0.00 -0.13 0.00 0.00 59.36 59.34 3hm0 h GLU 43 Cb -0.08 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.14 3hm0 h GLU 43 CO -0.06 0.82 0.18 0.00 -0.73 0.00 0.00 179.01 179.22 3hm0 h ARG 44 N 0.85 0.36 -0.51 1.92 3.08 -0.45 -1.47 114.38 118.16 3hm0 h ARG 44 Ca 0.18 -0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.30 3hm0 h ARG 44 Cb 0.34 -0.08 -0.07 0.00 0.08 0.00 0.00 29.97 30.24 3hm0 h ARG 44 CO 0.00 0.24 0.10 0.78 -1.07 0.00 0.00 179.97 180.02 3hm0 h GLY 45 N 0.37 0.62 1.25 0.04 0.00 -1.03 -0.30 103.07 104.02 3hm0 h GLY 45 Ca 0.15 -0.02 -0.00 0.00 0.00 0.00 0.00 47.33 47.46 3hm0 h GLY 45 CO -0.10 -0.08 0.46 3.21 0.00 0.00 0.00 176.54 180.03 3hm0 h ARG 46 N 0.23 1.00 0.03 4.80 3.08 -0.91 0.24 114.38 122.85 3hm0 h ARG 46 Ca 0.26 -0.08 -0.27 0.00 0.07 0.00 0.00 59.98 59.96 3hm0 h ARG 46 Cb 0.35 -0.22 0.02 0.00 0.08 0.00 0.00 29.97 30.21 3hm0 h ARG 46 CO -0.34 0.69 -1.08 0.77 -1.07 0.00 0.00 179.97 178.94 3hm0 h SER 47 N 1.02 0.85 0.01 7.04 0.02 -0.79 -1.74 113.55 119.96 3hm0 h SER 47 Ca 0.27 -0.71 -0.15 0.00 -0.84 0.00 0.00 61.79 60.36 3hm0 h SER 47 Cb -0.06 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.21 3hm0 h SER 47 CO -0.05 1.51 -0.49 -0.33 -1.14 0.00 0.00 176.83 176.33 3hm0 h GLU 48 N 0.35 0.55 -0.06 3.45 4.39 -0.95 0.52 114.58 122.82 3hm0 h GLU 48 Ca -0.14 -0.32 0.04 0.00 0.34 0.00 0.00 59.36 59.28 3hm0 h GLU 48 Cb 1.74 0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 30.35 3hm0 h GLU 48 CO 0.21 0.91 -0.41 0.35 -1.16 0.00 0.00 179.01 178.91 3hm0 h PHE 49 N 0.44 -1.16 -0.38 4.33 3.57 -0.47 0.31 116.94 123.58 3hm0 h PHE 49 Ca 0.02 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.62 3hm0 h PHE 49 Cb 1.01 0.52 -0.05 0.00 2.79 0.00 0.00 35.95 40.22 3hm0 h PHE 49 CO 0.04 -0.48 0.09 -0.07 -2.23 0.00 0.00 178.31 175.66 3hm0 h LEU 50 N -0.53 0.03 -0.33 0.59 4.07 -1.08 -2.23 115.31 115.84 3hm0 h LEU 50 Ca 0.06 0.06 0.07 0.00 0.08 0.00 0.00 57.88 58.15 3hm0 h LEU 50 Cb 0.63 0.07 -0.08 0.00 1.08 0.00 0.00 40.66 42.36 3hm0 h LEU 50 CO -0.35 0.06 -0.27 -0.09 -1.08 0.00 0.00 178.44 176.71 3hm0 h ARG 51 N 0.22 -0.23 0.00 1.13 2.43 -0.68 -1.47 114.38 115.78 3hm0 h ARG 51 Ca 0.18 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 3hm0 h ARG 51 Cb 0.20 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 3hm0 h ARG 51 CO -0.23 -0.15 0.22 -0.44 -1.51 0.00 0.00 179.97 177.87 3hm0 h ASP 52 N -0.23 0.00 -0.01 -3.80 3.32 -0.32 0.23 116.42 115.60 3hm0 h ASP 52 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 3hm0 h ASP 52 Cb 0.49 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 3hm0 h ASP 52 CO -0.46 0.00 -0.07 0.35 -1.72 0.00 0.00 179.24 177.34 3hm0 n THR 53 N -2.24 0.00 -1.39 0.35 -2.24 -0.60 -5.00 114.28 103.16 3hm0 n THR 53 Ca -0.01 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 3hm0 n THR 53 Cb 0.25 1.23 0.00 0.00 -2.10 0.00 0.00 70.33 69.72 3hm0 n THR 53 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hm0 n GLY 54 N 0.80 0.99 4.01 3.38 0.00 0.79 -5.10 105.19 110.06 3hm0 n GLY 54 Ca 0.07 -0.46 -0.19 0.00 0.00 0.00 0.00 46.02 45.44 3hm0 n GLY 54 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hm0 s PHE 55 N -2.36 2.52 0.00 1.61 0.40 -0.90 -5.03 117.98 114.23 3hm0 s PHE 55 Ca 0.00 -0.38 0.00 0.00 -0.60 0.00 0.00 56.93 55.95 3hm0 s PHE 55 Cb 0.00 -2.45 0.00 0.00 0.51 0.00 0.00 43.02 41.08 3hm0 s PHE 55 CO 0.00 -0.69 0.00 -0.85 0.70 0.00 0.00 175.22 174.38 3hm0 n GLU 67 N -2.06 0.00 -2.16 0.44 0.28 -1.26 -4.45 120.64 111.44 3hm0 n GLU 67 Ca 0.10 0.00 -0.36 0.00 -0.16 0.00 0.00 57.16 56.74 3hm0 n GLU 67 Cb 0.60 0.00 0.01 0.00 1.43 0.00 0.00 31.44 33.48 3hm0 n GLU 67 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 3hm0 s LYS 68 N 0.00 3.32 0.00 3.44 1.02 -1.26 -4.94 119.74 121.32 3hm0 s LYS 68 Ca 0.00 1.75 0.08 0.00 0.02 0.00 0.00 55.97 57.82 3hm0 s LYS 68 Cb 0.00 -2.09 -0.02 0.00 -0.52 0.00 0.00 37.83 35.20 3hm0 s LYS 68 CO 0.00 -0.91 -0.23 -0.51 -0.92 0.00 0.00 175.35 172.77 3hm0 s LEU 69 N -3.69 2.25 0.01 3.17 1.43 -1.26 -3.19 118.68 117.41 3hm0 s LEU 69 Ca 0.72 -0.46 0.03 0.00 -1.03 0.00 0.00 54.13 53.38 3hm0 s LEU 69 Cb -0.28 -1.38 -0.01 0.00 0.03 0.00 0.00 46.19 44.55 3hm0 s LEU 69 CO 0.32 0.30 -0.08 -0.36 0.23 0.00 0.00 176.35 176.75 3hm0 s PHE 70 N -0.73 0.72 0.41 0.29 0.08 -0.64 -4.99 117.98 113.13 3hm0 s PHE 70 Ca 0.11 -0.24 -0.24 0.00 0.12 0.00 0.00 56.93 56.68 3hm0 s PHE 70 Cb -0.10 -0.45 -0.09 0.00 -0.57 0.00 0.00 43.02 41.82 3hm0 s PHE 70 CO 0.01 -0.02 1.09 -0.06 -0.10 0.00 0.00 175.22 176.14 3hm0 s PHE 71 N -0.56 3.16 -0.00 0.36 0.08 -1.26 -2.13 117.98 117.63 3hm0 s PHE 71 Ca -0.01 1.61 0.03 0.00 0.12 0.00 0.00 56.93 58.69 3hm0 s PHE 71 Cb -0.05 -3.22 -0.01 0.00 -0.57 0.00 0.00 43.02 39.17 3hm0 s PHE 71 CO 0.00 -0.91 -0.11 0.08 -0.10 0.00 0.00 175.22 174.18 3hm0 s VAL 72 N -1.59 0.86 -0.14 -0.44 1.01 0.11 -4.94 120.40 115.27 3hm0 s VAL 72 Ca 0.59 -0.50 -0.28 0.00 0.00 0.00 0.00 61.98 61.78 3hm0 s VAL 72 Cb -0.25 -0.73 -0.01 0.00 0.00 0.00 0.00 36.38 35.39 3hm0 s VAL 72 CO 0.31 0.22 0.97 -0.69 0.00 0.00 0.00 175.10 175.91 3hm0 s VAL 73 N -0.30 4.79 -0.17 2.92 1.01 -1.26 -0.97 120.40 126.42 3hm0 s VAL 73 Ca 0.04 1.94 -0.10 0.00 0.00 0.00 0.00 61.98 63.87 3hm0 s VAL 73 Cb -0.04 -4.27 -0.23 0.00 0.00 0.00 0.00 36.38 31.84 3hm0 s VAL 73 CO -0.00 -0.02 0.21 0.54 0.00 0.00 0.00 175.10 175.83 3hm0 n ARG 74 N 5.25 0.69 -3.75 2.72 5.12 0.03 -4.94 116.66 121.78 3hm0 n ARG 74 Ca 0.08 0.32 -0.13 0.00 -1.93 0.00 0.00 57.85 56.20 3hm0 n ARG 74 Cb 0.48 -1.68 -0.10 0.00 -1.16 0.00 0.00 32.46 30.00 3hm0 n ARG 74 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 3hm0 s HIS 75 N -2.50 -0.38 -0.07 -1.55 2.46 -1.21 -5.02 115.29 107.02 3hm0 s HIS 75 Ca -0.26 0.92 -0.03 0.00 0.47 0.00 0.00 55.06 56.15 3hm0 s HIS 75 Cb 0.07 0.13 0.04 0.00 -0.13 0.00 0.00 32.58 32.69 3hm0 s HIS 75 CO 0.69 -0.20 0.15 1.41 -2.47 0.00 0.00 174.74 174.32 3hm0 s MET 76 N 0.11 0.08 -0.17 2.88 1.75 -1.26 -1.44 119.30 121.25 3hm0 s MET 76 Ca -0.01 0.39 -0.01 0.00 -1.25 0.00 0.00 55.69 54.82 3hm0 s MET 76 Cb -0.03 -0.19 -0.00 0.00 2.84 0.00 0.00 34.83 37.45 3hm0 s MET 76 CO 0.01 -0.18 -0.12 -2.00 -0.65 0.00 0.00 175.02 172.07 3hm0 s GLU 77 N 1.31 3.28 -0.01 4.11 2.12 -0.61 -5.01 118.70 123.89 3hm0 s GLU 77 Ca -0.08 -0.71 0.07 0.00 0.36 0.00 0.00 54.97 54.61 3hm0 s GLU 77 Cb -0.12 -2.72 -0.02 0.00 0.26 0.00 0.00 34.13 31.54 3hm0 s GLU 77 CO -0.06 -0.01 -0.21 0.42 -0.54 0.00 0.00 175.26 174.87 3hm0 s ILE 78 N 0.90 1.64 -0.23 -3.70 1.09 -1.26 -1.39 121.20 118.26 3hm0 s ILE 78 Ca -0.03 -0.93 -0.00 0.00 -1.10 0.00 0.00 60.65 58.59 3hm0 s ILE 78 Cb -0.15 -1.37 0.03 0.00 -1.06 0.00 0.00 42.46 39.91 3hm0 s ILE 78 CO -0.01 0.42 -0.12 0.21 -0.10 0.00 0.00 174.94 175.35 3hm0 s ASN 79 N -0.59 3.94 -0.56 3.58 2.47 0.32 -4.99 114.94 119.11 3hm0 s ASN 79 Ca 0.08 -0.86 -0.17 0.00 0.42 0.00 0.00 52.86 52.33 3hm0 s ASN 79 Cb -0.08 -1.59 0.12 0.00 -1.45 0.00 0.00 41.25 38.25 3hm0 s ASN 79 CO -0.00 -0.09 0.58 -0.36 -3.72 0.00 0.00 177.10 173.51 3hm0 s PHE 80 N 1.28 3.16 -0.20 0.43 0.08 -1.26 -1.53 117.98 119.94 3hm0 s PHE 80 Ca 0.00 -1.18 -0.17 0.00 0.12 0.00 0.00 56.93 55.70 3hm0 s PHE 80 Cb -0.16 -3.88 -0.07 0.00 -0.57 0.00 0.00 43.02 38.34 3hm0 s PHE 80 CO -0.07 -1.12 -0.35 0.45 -0.10 0.00 0.00 175.22 174.03 3hm0 n SER 81 N 5.63 1.94 -4.20 1.36 2.88 -0.38 -5.00 113.62 115.86 3hm0 n SER 81 Ca -0.12 0.34 -0.24 0.00 -1.33 0.00 0.00 58.87 57.52 3hm0 n SER 81 Cb 0.41 -0.76 -0.14 0.00 -0.75 0.00 0.00 64.21 62.97 3hm0 n SER 81 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 3hm0 s ARG 82 N -2.81 1.30 0.34 -1.46 0.52 -0.70 -5.05 118.95 111.09 3hm0 s ARG 82 Ca -0.31 -0.79 -0.27 0.00 -0.52 0.00 0.00 55.73 53.84 3hm0 s ARG 82 Cb 0.06 -1.33 -0.09 0.00 0.52 0.00 0.00 34.95 34.11 3hm0 s ARG 82 CO 0.44 0.35 1.09 -1.25 0.02 0.00 0.00 175.30 175.95 3hm0 s PRO 83 N -0.91 4.37 0.34 3.54 0.04 -1.26 -4.52 135.00 136.59 3hm0 s PRO 83 Ca 0.06 1.69 -0.18 0.00 0.04 0.00 0.00 61.00 62.60 3hm0 s PRO 83 Cb -0.08 -2.86 -0.10 0.00 0.04 0.00 0.00 34.50 31.51 3hm0 s PRO 83 CO 0.01 -0.00 0.82 0.00 0.04 0.00 0.00 177.00 177.86 3hm0 s ALA 84 N -1.40 3.24 0.38 8.56 0.00 -1.26 -5.02 121.76 126.27 3hm0 s ALA 84 Ca 0.52 0.21 0.08 0.00 0.00 0.00 0.00 51.96 52.77 3hm0 s ALA 84 Cb -0.28 -2.93 -0.07 0.00 0.00 0.00 0.00 23.12 19.85 3hm0 s ALA 84 CO 0.35 0.26 0.00 -0.65 0.00 0.00 0.00 175.76 175.72 3hm0 s GLN 85 N -2.79 1.97 0.24 0.00 -1.52 -1.26 -2.21 119.66 114.09 3hm0 s GLN 85 Ca 0.54 -1.97 -0.30 0.00 -1.95 0.00 0.00 55.36 51.68 3hm0 s GLN 85 Cb -0.12 -1.75 -0.10 0.00 -0.22 0.00 0.00 33.01 30.83 3hm0 s GLN 85 CO 0.17 0.02 1.40 -1.50 -0.25 0.00 0.00 175.29 175.13 3hm0 s ILE 86 N -2.64 2.80 0.00 1.08 2.07 -1.26 -2.50 121.20 120.74 3hm0 s ILE 86 Ca 0.35 0.68 0.00 0.00 -1.41 0.00 0.00 60.65 60.27 3hm0 s ILE 86 Cb 0.06 -3.43 0.00 0.00 0.13 0.00 0.00 42.46 39.21 3hm0 s ILE 86 CO 0.18 0.11 0.00 0.47 -1.91 0.00 0.00 174.94 173.79 3hm0 n ASP 87 N 2.28 0.00 -4.73 4.50 8.00 -0.25 -4.99 116.55 121.36 3hm0 n ASP 87 Ca 0.06 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.14 3hm0 n ASP 87 Cb 0.41 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.49 3hm0 n ASP 87 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3hm0 n ASN 88 N 0.00 3.64 -4.50 -2.24 5.03 -1.04 -4.69 115.26 111.46 3hm0 n ASN 88 Ca 0.00 1.14 -0.43 0.00 0.87 0.00 0.00 54.58 56.16 3hm0 n ASN 88 Cb 0.00 -1.56 -0.04 0.00 -1.02 0.00 0.00 39.78 37.16 3hm0 n ASN 88 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 3hm0 s LEU 89 N -0.26 4.17 0.38 3.41 2.96 -1.26 -1.27 118.68 126.82 3hm0 s LEU 89 Ca 0.66 -0.57 -0.20 0.00 -0.22 0.00 0.00 54.13 53.80 3hm0 s LEU 89 Cb -0.53 -2.68 -0.10 0.00 0.50 0.00 0.00 46.19 43.38 3hm0 s LEU 89 CO 0.48 -1.31 0.88 -0.76 -1.32 0.00 0.00 176.35 174.31 3hm0 s LEU 90 N 4.02 4.03 -0.16 -0.68 1.43 0.11 -4.40 118.68 123.03 3hm0 s LEU 90 Ca 0.27 1.57 -0.02 0.00 -1.03 0.00 0.00 54.13 54.93 3hm0 s LEU 90 Cb -0.14 -4.32 -0.02 0.00 0.03 0.00 0.00 46.19 41.75 3hm0 s LEU 90 CO 0.16 -0.27 -0.08 -0.89 0.23 0.00 0.00 176.35 175.50 3hm0 s THR 91 N -2.04 3.40 -0.24 5.49 2.01 0.16 -1.64 115.64 122.78 3hm0 s THR 91 Ca 0.58 -0.52 -0.05 0.00 0.31 0.00 0.00 61.69 62.01 3hm0 s THR 91 Cb -0.11 -2.49 -0.01 0.00 0.01 0.00 0.00 72.50 69.91 3hm0 s THR 91 CO 0.16 0.49 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.94 3hm0 s ILE 92 N 0.68 3.61 -0.22 1.82 1.01 0.21 -0.41 121.20 127.89 3hm0 s ILE 92 Ca -0.04 -0.47 -0.05 0.00 0.00 0.00 0.00 60.65 60.09 3hm0 s ILE 92 Cb -0.15 -2.69 -0.01 0.00 0.01 0.00 0.00 42.46 39.62 3hm0 s ILE 92 CO 0.02 0.36 -0.02 -0.54 0.00 0.00 0.00 174.94 174.76 3hm0 s LYS 93 N 1.50 3.45 -0.04 2.79 -0.14 0.46 -1.20 119.74 126.57 3hm0 s LYS 93 Ca 0.05 -0.59 0.03 0.00 -1.36 0.00 0.00 55.97 54.10 3hm0 s LYS 93 Cb -0.15 -3.07 0.01 0.00 -1.68 0.00 0.00 37.83 32.93 3hm0 s LYS 93 CO -0.01 -0.18 -0.10 0.99 -0.76 0.00 0.00 175.35 175.29 3hm0 s THR 94 N 1.46 0.92 0.03 2.17 2.01 -0.19 -1.31 115.64 120.73 3hm0 s THR 94 Ca 0.05 -0.41 -0.15 0.00 0.31 0.00 0.00 61.69 61.50 3hm0 s THR 94 Cb -0.14 -0.82 0.02 0.00 0.01 0.00 0.00 72.50 71.57 3hm0 s THR 94 CO -0.01 0.29 0.32 0.00 -0.69 0.00 0.00 174.62 174.52 3hm0 s ARG 95 N 0.31 0.79 -0.31 4.92 1.70 -1.09 0.58 118.95 125.85 3hm0 s ARG 95 Ca -0.06 -0.41 -0.29 0.00 -0.47 0.00 0.00 55.73 54.51 3hm0 s ARG 95 Cb -0.11 0.35 0.02 0.00 -0.57 0.00 0.00 34.95 34.63 3hm0 s ARG 95 CO 0.01 -0.25 1.06 0.42 -1.08 0.00 0.00 175.30 175.46 3hm0 s ILE 96 N -2.24 4.54 -0.03 4.99 1.01 -1.26 -1.48 121.20 126.72 3hm0 s ILE 96 Ca -0.07 1.73 0.10 0.00 0.00 0.00 0.00 60.65 62.41 3hm0 s ILE 96 Cb -0.02 -4.40 -0.23 0.00 0.01 0.00 0.00 42.46 37.82 3hm0 s ILE 96 CO -0.01 -0.45 0.71 0.77 0.00 0.00 0.00 174.94 175.96 3hm0 h SER 97 N 8.05 0.04 -3.49 3.58 4.64 -0.79 -3.48 113.55 122.11 3hm0 h SER 97 Ca -0.21 -0.09 -0.07 0.00 -0.47 0.00 0.00 61.79 60.96 3hm0 h SER 97 Cb 1.06 -0.01 -0.23 0.00 -0.31 0.00 0.00 62.40 62.90 3hm0 h SER 97 CO 1.02 1.08 -0.11 -0.60 -0.87 0.00 0.00 176.83 177.35 3hm0 s ARG 98 N -2.61 0.59 0.00 4.77 3.52 -1.20 -5.00 118.95 119.02 3hm0 s ARG 98 Ca -0.05 0.89 -0.03 0.00 -0.13 0.00 0.00 55.73 56.41 3hm0 s ARG 98 Cb 0.08 0.17 -0.04 0.00 -1.56 0.00 0.00 34.95 33.60 3hm0 s ARG 98 CO 0.82 -0.12 0.20 -1.17 -0.81 0.00 0.00 175.30 174.22 3hm0 s LEU 99 N 0.97 4.37 -0.33 -0.88 2.96 -1.26 -0.99 118.68 123.51 3hm0 s LEU 99 Ca -0.05 0.36 0.15 0.00 -0.22 0.00 0.00 54.13 54.37 3hm0 s LEU 99 Cb -0.05 -2.67 0.44 0.00 0.50 0.00 0.00 46.19 44.40 3hm0 s LEU 99 CO -0.09 0.25 1.36 0.00 -1.32 0.00 0.00 176.35 176.55 3hm0 n GLN 100 N 0.87 1.41 0.00 1.98 6.02 -0.60 -5.01 117.38 122.05 3hm0 n GLN 100 Ca -0.10 -2.06 0.00 0.00 -0.01 0.00 0.00 57.00 54.83 3hm0 n GLN 100 Cb 0.52 -0.30 0.00 0.00 1.02 0.00 0.00 30.24 31.48 3hm0 n GLN 100 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3hm0 n GLY 101 N -1.03 0.42 0.04 1.08 0.00 -1.26 -3.30 105.19 101.14 3hm0 n GLY 101 Ca -0.07 -0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.06 3hm0 n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hm0 n ALA 102 N 0.00 2.79 -2.81 4.61 0.00 -1.26 -3.68 120.51 120.16 3hm0 n ALA 102 Ca 0.00 -0.43 -0.13 0.00 0.00 0.00 0.00 53.44 52.89 3hm0 n ALA 102 Cb 0.00 -0.87 -0.06 0.00 0.00 0.00 0.00 19.45 18.52 3hm0 n ALA 102 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3hm0 s ARG 103 N -3.44 1.66 0.11 0.00 3.03 -1.21 -4.12 118.95 114.98 3hm0 s ARG 103 Ca -0.05 -1.60 -0.03 0.00 2.03 0.00 0.00 55.73 56.09 3hm0 s ARG 103 Cb 0.13 0.41 -0.03 0.00 -1.03 0.00 0.00 34.95 34.42 3hm0 s ARG 103 CO 0.87 -0.66 0.07 -0.59 -1.13 0.00 0.00 175.30 173.86 3hm0 s PHE 104 N -3.58 0.67 -0.03 5.89 -0.71 -0.41 -1.56 117.98 118.25 3hm0 s PHE 104 Ca 0.30 -1.09 0.06 0.00 -1.04 0.00 0.00 56.93 55.16 3hm0 s PHE 104 Cb 0.01 -0.38 -0.01 0.00 -1.21 0.00 0.00 43.02 41.44 3hm0 s PHE 104 CO 0.16 -0.51 -0.20 -0.06 -1.34 0.00 0.00 175.22 173.26 3hm0 s PHE 105 N -3.99 1.91 -0.06 3.49 0.40 -0.17 -0.19 117.98 119.38 3hm0 s PHE 105 Ca 0.18 -0.48 0.04 0.00 -0.60 0.00 0.00 56.93 56.08 3hm0 s PHE 105 Cb 0.07 -1.26 -0.00 0.00 0.51 0.00 0.00 43.02 42.34 3hm0 s PHE 105 CO -0.02 -0.12 -0.19 -1.64 0.70 0.00 0.00 175.22 173.95 3hm0 s MET 106 N -0.22 2.12 -0.11 0.44 -1.94 0.50 -0.04 119.30 120.04 3hm0 s MET 106 Ca 0.01 -0.69 -0.05 0.00 -1.71 0.00 0.00 55.69 53.25 3hm0 s MET 106 Cb -0.10 -1.78 -0.04 0.00 2.01 0.00 0.00 34.83 34.92 3hm0 s MET 106 CO 0.01 0.25 0.09 -1.83 -0.01 0.00 0.00 175.02 173.53 3hm0 s GLU 107 N 0.09 3.32 0.05 2.03 -1.05 -0.55 -0.82 118.70 121.76 3hm0 s GLU 107 Ca -0.07 -0.24 0.03 0.00 -0.15 0.00 0.00 54.97 54.54 3hm0 s GLU 107 Cb -0.13 -3.05 -0.03 0.00 -0.44 0.00 0.00 34.13 30.48 3hm0 s GLU 107 CO 0.04 0.71 -0.09 -0.65 0.95 0.00 0.00 175.26 176.22 3hm0 s GLN 108 N -0.87 0.60 0.02 -4.83 -0.21 0.14 -2.69 119.66 111.82 3hm0 s GLN 108 Ca 0.14 -0.83 0.01 0.00 0.02 0.00 0.00 55.36 54.70 3hm0 s GLN 108 Cb -0.12 -0.39 -0.02 0.00 1.00 0.00 0.00 33.01 33.49 3hm0 s GLN 108 CO 0.03 0.07 -0.04 0.71 -2.12 0.00 0.00 175.29 173.94 3hm0 s TYR 109 N -1.49 0.35 -0.14 0.91 2.02 -0.42 -0.16 117.35 118.42 3hm0 s TYR 109 Ca -0.07 -0.39 0.02 0.00 -0.37 0.00 0.00 57.07 56.25 3hm0 s TYR 109 Cb -0.09 -0.23 0.02 0.00 -0.40 0.00 0.00 41.96 41.25 3hm0 s TYR 109 CO 0.00 -0.11 -0.18 0.42 -1.57 0.00 0.00 175.55 174.11 3hm0 s ILE 110 N -1.06 1.80 0.09 2.71 1.01 0.59 -0.40 121.20 125.94 3hm0 s ILE 110 Ca -0.10 -0.80 0.09 0.00 0.00 0.00 0.00 60.65 59.84 3hm0 s ILE 110 Cb -0.08 -1.63 -0.03 0.00 0.01 0.00 0.00 42.46 40.73 3hm0 s ILE 110 CO -0.00 0.50 -0.24 -0.76 0.00 0.00 0.00 174.94 174.43 3hm0 s LEU 111 N 1.10 2.25 -0.50 2.97 1.02 0.45 -0.67 118.68 125.29 3hm0 s LEU 111 Ca -0.02 -0.65 -0.12 0.00 0.02 0.00 0.00 54.13 53.35 3hm0 s LEU 111 Cb -0.14 -1.12 0.12 0.00 0.02 0.00 0.00 46.19 45.07 3hm0 s LEU 111 CO -0.06 0.17 0.41 -2.28 0.02 0.00 0.00 176.35 174.62 3hm0 s HIS 112 N -0.97 3.34 0.00 0.29 2.46 -0.51 0.37 115.29 120.27 3hm0 s HIS 112 Ca 0.11 -1.56 0.00 0.00 0.47 0.00 0.00 55.06 54.07 3hm0 s HIS 112 Cb -0.10 -3.60 0.00 0.00 -0.13 0.00 0.00 32.58 28.76 3hm0 s HIS 112 CO 0.04 -0.99 0.00 0.41 -2.47 0.00 0.00 174.74 171.73 3hm0 n GLY 113 N 5.07 1.27 0.04 1.59 0.00 -1.26 -2.25 105.19 109.66 3hm0 n GLY 113 Ca -0.11 0.42 0.03 0.00 0.00 0.00 0.00 46.02 46.36 3hm0 n GLY 113 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hm0 n GLU 114 N 0.00 0.67 -2.11 1.61 1.02 -1.26 -4.95 120.64 115.62 3hm0 n GLU 114 Ca 0.00 -0.13 -0.42 0.00 -0.02 0.00 0.00 57.16 56.60 3hm0 n GLU 114 Cb 0.00 -1.52 -0.03 0.00 -0.02 0.00 0.00 31.44 29.87 3hm0 n GLU 114 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3hm0 s SER 115 N -4.88 6.77 -0.19 1.62 0.15 -0.95 -5.02 113.70 111.19 3hm0 s SER 115 Ca -0.09 2.50 -0.18 0.00 0.70 0.00 0.00 55.95 58.88 3hm0 s SER 115 Cb 0.11 -2.61 -0.03 0.00 -1.71 0.00 0.00 66.02 61.78 3hm0 s SER 115 CO 0.88 -0.64 0.51 -0.32 1.20 0.00 0.00 173.24 174.87 3hm0 s MET 116 N 0.16 4.20 -0.20 5.44 1.75 -1.26 -1.42 119.30 127.97 3hm0 s MET 116 Ca 0.60 0.40 -0.11 0.00 -1.25 0.00 0.00 55.69 55.34 3hm0 s MET 116 Cb -0.39 -3.55 -0.08 0.00 2.84 0.00 0.00 34.83 33.65 3hm0 s MET 116 CO 0.38 -0.11 -0.27 1.28 -0.65 0.00 0.00 175.02 175.64 3hm0 n LEU 117 N 4.66 1.53 -3.72 4.11 4.77 0.15 -3.93 117.00 124.58 3hm0 n LEU 117 Ca -0.05 0.26 -0.12 0.00 -0.03 0.00 0.00 56.01 56.07 3hm0 n LEU 117 Cb 0.51 -0.63 -0.10 0.00 -2.33 0.00 0.00 43.42 40.87 3hm0 n LEU 117 CO 0.42 0.30 0.07 -0.69 -1.33 0.00 0.00 177.39 176.16 3hm0 s VAL 118 N -2.44 -0.01 0.05 4.08 1.01 -1.07 -1.25 120.40 120.78 3hm0 s VAL 118 Ca -0.28 0.04 0.09 0.00 0.00 0.00 0.00 61.98 61.82 3hm0 s VAL 118 Cb 0.10 -0.59 -0.03 0.00 0.00 0.00 0.00 36.38 35.86 3hm0 s VAL 118 CO 0.36 0.02 -0.24 0.42 0.00 0.00 0.00 175.10 175.66 3hm0 s THR 119 N 0.72 1.95 0.00 3.92 -4.23 -0.58 -0.30 115.64 117.12 3hm0 s THR 119 Ca -0.04 -1.34 -0.01 0.00 -1.18 0.00 0.00 61.69 59.12 3hm0 s THR 119 Cb -0.05 -1.69 -0.01 0.00 1.34 0.00 0.00 72.50 72.09 3hm0 s THR 119 CO -0.05 0.28 0.02 0.00 -0.54 0.00 0.00 174.62 174.33 3hm0 s ALA 120 N -0.82 -0.02 -0.18 3.99 0.00 0.77 -0.52 121.76 124.98 3hm0 s ALA 120 Ca 0.10 -0.25 -0.03 0.00 0.00 0.00 0.00 51.96 51.78 3hm0 s ALA 120 Cb -0.10 0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.07 3hm0 s ALA 120 CO 0.02 -0.11 -0.06 0.15 0.00 0.00 0.00 175.76 175.76 3hm0 s LYS 121 N -0.83 3.44 -0.03 0.00 1.02 -0.49 0.27 119.74 123.12 3hm0 s LYS 121 Ca -0.09 -0.62 0.04 0.00 0.02 0.00 0.00 55.97 55.32 3hm0 s LYS 121 Cb -0.06 -2.90 -0.00 0.00 -0.52 0.00 0.00 37.83 34.35 3hm0 s LYS 121 CO -0.00 -0.01 -0.15 0.54 -0.92 0.00 0.00 175.35 174.81 3hm0 s VAL 122 N 0.97 1.28 -0.19 3.17 0.11 -0.01 -1.58 120.40 124.17 3hm0 s VAL 122 Ca -0.00 -0.65 -0.08 0.00 -2.93 0.00 0.00 61.98 58.32 3hm0 s VAL 122 Cb -0.15 -1.10 -0.04 0.00 -1.53 0.00 0.00 36.38 33.56 3hm0 s VAL 122 CO 0.00 0.37 0.08 -0.70 -3.33 0.00 0.00 175.10 171.52 3hm0 s GLU 123 N -0.01 4.03 -0.11 1.54 2.12 -0.52 -0.37 118.70 125.38 3hm0 s GLU 123 Ca -0.02 -0.31 0.01 0.00 0.36 0.00 0.00 54.97 55.00 3hm0 s GLU 123 Cb -0.10 -3.26 0.02 0.00 0.26 0.00 0.00 34.13 31.05 3hm0 s GLU 123 CO 0.01 0.28 -0.11 0.42 -0.54 0.00 0.00 175.26 175.32 3hm0 s ILE 124 N 0.37 1.26 0.42 -3.70 -1.09 0.73 -0.79 121.20 118.39 3hm0 s ILE 124 Ca 0.04 -0.47 0.08 0.00 -2.23 0.00 0.00 60.65 58.07 3hm0 s ILE 124 Cb -0.12 -1.20 -0.02 0.00 -1.58 0.00 0.00 42.46 39.54 3hm0 s ILE 124 CO -0.00 0.40 0.37 0.00 -1.23 0.00 0.00 174.94 174.47 3hm0 s ALA 125 N 1.32 4.04 -0.11 9.38 0.00 -0.15 -1.29 121.76 134.96 3hm0 s ALA 125 Ca -0.01 -1.90 0.03 0.00 0.00 0.00 0.00 51.96 50.09 3hm0 s ALA 125 Cb -0.14 -0.96 -0.00 0.00 0.00 0.00 0.00 23.12 22.02 3hm0 s ALA 125 CO -0.05 -0.23 -0.22 -1.17 0.00 0.00 0.00 175.76 174.09 3hm0 s LEU 126 N -4.12 2.17 0.28 0.00 2.96 -1.26 -0.71 118.68 118.00 3hm0 s LEU 126 Ca 0.47 -0.54 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 3hm0 s LEU 126 Cb -0.03 -1.44 -0.06 0.00 0.50 0.00 0.00 46.19 45.17 3hm0 s LEU 126 CO 0.27 0.15 0.08 0.27 -1.32 0.00 0.00 176.35 175.80 3hm0 s ILE 127 N 0.40 0.81 0.49 6.68 -4.36 -0.90 -1.05 121.20 123.25 3hm0 s ILE 127 Ca -0.17 -2.00 0.05 0.00 -0.26 0.00 0.00 60.65 58.27 3hm0 s ILE 127 Cb -0.17 -2.67 0.05 0.00 1.25 0.00 0.00 42.46 40.92 3hm0 s ILE 127 CO 0.07 -0.02 0.44 -0.46 0.24 0.00 0.00 174.94 175.21 3hm0 n ASN 128 N -0.54 2.36 -0.22 4.36 0.23 -0.87 -1.61 115.26 118.98 3hm0 n ASN 128 Ca -0.01 -2.57 0.26 0.00 -0.53 0.00 0.00 54.58 51.72 3hm0 n ASN 128 Cb 0.66 -0.12 0.64 0.00 -2.08 0.00 0.00 39.78 38.89 3hm0 n ASN 128 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 3hm0 h GLU 129 N 0.00 0.15 0.11 -3.83 4.11 -1.90 -1.90 114.58 111.33 3hm0 h GLU 129 Ca -0.29 -0.01 -0.27 0.00 0.07 0.00 0.00 59.36 58.87 3hm0 h GLU 129 Cb 1.10 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.32 3hm0 h GLU 129 CO 0.44 0.10 -1.20 1.05 0.07 0.00 0.00 179.01 179.47 3hm0 h GLU 130 N 0.16 0.27 0.00 1.06 4.11 -1.96 -3.48 114.58 114.74 3hm0 h GLU 130 Ca 0.46 -0.45 0.00 0.00 0.07 0.00 0.00 59.36 59.44 3hm0 h GLU 130 Cb 1.55 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.97 3hm0 h GLU 130 CO -0.08 1.20 0.00 0.41 0.07 0.00 0.00 179.01 180.61 3hm0 n GLY 131 N 1.46 0.55 3.79 1.06 0.00 -0.71 -5.13 105.19 106.21 3hm0 n GLY 131 Ca -0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 3hm0 n GLY 131 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hm0 s LYS 132 N 0.00 4.32 0.97 1.61 -2.85 -1.26 -4.85 119.74 117.67 3hm0 s LYS 132 Ca 0.00 0.84 -0.11 0.00 -1.00 0.00 0.00 55.97 55.69 3hm0 s LYS 132 Cb 0.00 -3.27 0.17 0.00 -2.06 0.00 0.00 37.83 32.67 3hm0 s LYS 132 CO 0.00 0.54 1.09 -2.14 0.10 0.00 0.00 175.35 174.94 3hm0 s PRO 133 N -0.84 0.64 0.00 1.78 0.02 -1.26 -2.04 135.00 133.30 3hm0 s PRO 133 Ca 0.31 1.05 0.00 0.00 0.02 0.00 0.00 61.00 62.38 3hm0 s PRO 133 Cb -0.20 -1.72 0.00 0.00 0.02 0.00 0.00 34.50 32.60 3hm0 s PRO 133 CO 0.20 -2.73 0.00 0.54 -0.33 0.00 0.00 177.00 174.68 3hm0 n ARG 134 N -4.25 0.00 -4.18 5.54 5.12 -0.22 -4.82 116.66 113.86 3hm0 n ARG 134 Ca 0.07 0.00 -0.23 0.00 -1.93 0.00 0.00 57.85 55.76 3hm0 n ARG 134 Cb 0.54 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.77 3hm0 n ARG 134 CO 0.00 0.00 0.00 -0.98 -1.93 0.00 0.00 177.63 174.72 3hm0 s ARG 135 N -0.16 2.40 0.00 5.56 1.70 -1.26 -4.74 118.95 122.44 3hm0 s ARG 135 Ca 0.00 -1.44 0.00 0.00 -0.47 0.00 0.00 55.73 53.82 3hm0 s ARG 135 Cb 0.00 -2.21 0.00 0.00 -0.57 0.00 0.00 34.95 32.17 3hm0 s ARG 135 CO 0.00 0.24 0.00 1.28 -1.08 0.00 0.00 175.30 175.74 3hm0 n LEU 136 N -1.05 0.00 0.00 -1.89 4.77 -1.24 -5.00 117.00 112.58 3hm0 n LEU 136 Ca -0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 3hm0 n LEU 136 Cb 0.60 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.70 3hm0 n LEU 136 CO 0.42 -0.41 0.26 -2.65 -1.33 0.00 0.00 177.39 173.68