#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e7n s SER 2 N 0.00 4.76 -1.73 1.61 0.15 -1.26 -4.58 113.70 112.65 2e7n s SER 2 Ca 0.00 -0.09 -0.17 0.00 0.70 0.00 0.00 55.95 56.39 2e7n s SER 2 Cb 0.00 -1.60 0.16 0.00 -1.71 0.00 0.00 66.02 62.87 2e7n s SER 2 CO 0.00 0.24 0.62 -0.24 1.20 0.00 0.00 173.24 175.05 2e7n n SER 3 N 3.09 -2.15 0.00 5.45 2.88 -1.26 -4.79 113.62 116.84 2e7n n SER 3 Ca -0.18 -1.12 0.00 0.00 -1.33 0.00 0.00 58.87 56.25 2e7n n SER 3 Cb 0.53 -2.29 0.00 0.00 -0.75 0.00 0.00 64.21 61.70 2e7n n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2e7n n GLY 4 N -1.45 2.99 3.53 0.46 0.00 -1.26 -5.07 105.19 104.38 2e7n n GLY 4 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2e7n n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2e7n s SER 5 N 0.00 6.42 -0.28 1.61 0.01 -1.26 -4.58 113.70 115.62 2e7n s SER 5 Ca 0.00 -1.29 -0.35 0.00 1.31 0.00 0.00 55.95 55.61 2e7n s SER 5 Cb 0.00 -2.52 -0.12 0.00 0.21 0.00 0.00 66.02 63.59 2e7n s SER 5 CO 0.00 -1.49 2.06 -1.54 0.41 0.00 0.00 173.24 172.68 2e7n n SER 6 N 8.45 2.52 -3.58 2.44 3.41 -1.26 -4.86 113.62 120.74 2e7n n SER 6 Ca 0.21 0.62 -0.25 0.00 -0.26 0.00 0.00 58.87 59.19 2e7n n SER 6 Cb 0.50 -1.28 0.23 0.00 -0.26 0.00 0.00 64.21 63.39 2e7n n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2e7n n GLY 7 N 5.69 -3.07 0.00 5.00 0.00 -1.26 -5.04 105.19 106.51 2e7n n GLY 7 Ca 0.34 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 45.13 2e7n n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2e7n n GLY 8 N 2.04 1.73 2.57 -0.02 0.00 -1.26 -4.98 105.19 105.27 2e7n n GLY 8 Ca 0.08 0.33 -0.20 0.00 0.00 0.00 0.00 46.02 46.23 2e7n n GLY 8 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2e7n n LYS 9 N 0.00 -2.63 -3.94 1.61 4.01 -1.26 -4.99 118.16 110.96 2e7n n LYS 9 Ca 0.00 0.91 -0.10 0.00 -0.51 0.00 0.00 58.31 58.60 2e7n n LYS 9 Cb 0.00 -5.53 -0.12 0.00 -0.51 0.00 0.00 35.03 28.87 2e7n n LYS 9 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2e7n s LEU 10 N -5.80 2.09 0.62 -0.35 1.43 -1.26 -5.03 118.68 110.38 2e7n s LEU 10 Ca 0.10 -0.31 -0.18 0.00 -1.03 0.00 0.00 54.13 52.71 2e7n s LEU 10 Cb -0.04 0.14 -0.04 0.00 0.03 0.00 0.00 46.19 46.28 2e7n s LEU 10 CO 0.13 -0.22 0.98 -0.24 0.23 0.00 0.00 176.35 177.23 2e7n n SER 11 N 2.02 0.80 -0.51 2.29 2.88 -1.26 -4.50 113.62 115.34 2e7n n SER 11 Ca -0.20 0.79 0.42 0.00 -1.33 0.00 0.00 58.87 58.54 2e7n n SER 11 Cb 0.56 -1.40 0.72 0.00 -0.75 0.00 0.00 64.21 63.34 2e7n n SER 11 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 2e7n h GLU 12 N 0.39 0.05 0.00 -1.46 4.11 -2.00 -0.70 114.58 114.97 2e7n h GLU 12 Ca -0.49 -0.00 -0.20 0.00 0.07 0.00 0.00 59.36 58.74 2e7n h GLU 12 Cb 1.36 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.57 2e7n h GLU 12 CO 0.50 0.03 -1.28 0.72 0.07 0.00 0.00 179.01 179.06 2e7n n HIS 13 N -4.39 0.79 -0.40 2.06 8.25 -1.26 -4.42 115.22 115.85 2e7n n HIS 13 Ca 0.38 0.34 -0.07 0.00 -0.26 0.00 0.00 57.72 58.11 2e7n n HIS 13 Cb 1.59 -0.98 -0.04 0.00 1.12 0.00 0.00 29.99 31.68 2e7n n HIS 13 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2e7n n LEU 14 N -4.45 -0.88 -0.31 2.41 4.77 -0.39 0.66 117.00 118.82 2e7n n LEU 14 Ca -0.29 1.73 0.22 0.00 -0.03 0.00 0.00 56.01 57.64 2e7n n LEU 14 Cb 0.61 -0.29 0.42 0.00 -2.33 0.00 0.00 43.42 41.82 2e7n n LEU 14 CO 0.15 -1.47 0.87 -2.11 -1.33 0.00 0.00 177.39 173.50 2e7n n ARG 15 N -5.31 -0.06 0.01 3.23 1.85 -0.50 0.11 116.66 115.98 2e7n n ARG 15 Ca 0.05 1.34 -0.18 0.00 -1.00 0.00 0.00 57.85 58.06 2e7n n ARG 15 Cb 0.31 -2.26 -0.10 0.00 -1.05 0.00 0.00 32.46 29.36 2e7n n ARG 15 CO 0.00 0.00 0.00 -0.92 -0.01 0.00 0.00 177.63 176.70 2e7n h TYR 16 N 0.00 0.83 -0.05 2.89 5.03 0.02 -3.31 116.97 122.37 2e7n h TYR 16 Ca 0.68 -0.42 0.02 0.00 2.58 0.00 0.00 58.73 61.59 2e7n h TYR 16 Cb 1.64 -0.11 -0.03 0.00 1.55 0.00 0.00 36.73 39.79 2e7n h TYR 16 CO -0.23 1.24 -0.10 0.00 -1.32 0.00 0.00 178.16 177.74 2e7n n ASP 18 N -5.24 0.03 -0.05 0.00 -0.08 0.47 0.16 116.55 111.85 2e7n n ASP 18 Ca -0.05 0.87 -0.13 0.00 -1.51 0.00 0.00 54.79 53.97 2e7n n ASP 18 Cb 0.16 -0.43 -0.12 0.00 2.34 0.00 0.00 41.12 43.07 2e7n n ASP 18 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 2e7n h SER 19 N 0.00 -0.01 -1.79 1.67 4.64 -1.49 -3.15 113.55 113.42 2e7n h SER 19 Ca 0.76 -0.79 0.54 0.00 -0.47 0.00 0.00 61.79 61.83 2e7n h SER 19 Cb 2.95 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 64.94 2e7n h SER 19 CO -0.08 0.80 1.25 0.40 -0.87 0.00 0.00 176.83 178.34 2e7n h ILE 20 N -0.84 0.01 0.11 0.95 2.04 0.15 0.89 117.51 120.83 2e7n h ILE 20 Ca -0.00 -0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.71 2e7n h ILE 20 Cb 0.80 0.01 0.02 0.00 -0.74 0.00 0.00 36.82 36.90 2e7n h ILE 20 CO 0.00 0.00 -0.67 0.25 0.00 0.00 0.00 178.15 177.73 2e7n h LEU 21 N 0.00 0.37 -2.23 1.44 5.85 -1.57 -3.05 115.31 116.12 2e7n h LEU 21 Ca 0.92 -0.96 0.04 0.00 0.84 0.00 0.00 57.88 58.72 2e7n h LEU 21 Cb 3.48 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 44.38 2e7n h LEU 21 CO -0.15 1.32 0.13 0.08 -0.34 0.00 0.00 178.44 179.47 2e7n h ARG 22 N -0.50 0.00 0.02 1.25 -0.00 0.78 -2.13 114.38 113.80 2e7n h ARG 22 Ca -0.12 0.00 -0.06 0.00 -0.00 0.00 0.00 59.98 59.80 2e7n h ARG 22 Cb 1.52 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 31.49 2e7n h ARG 22 CO 0.12 0.00 -0.23 1.49 -0.00 0.00 0.00 179.97 181.35 2e7n h GLU 23 N 0.00 0.13 0.00 0.08 4.81 -1.18 -3.21 114.58 115.20 2e7n h GLU 23 Ca 0.06 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 2e7n h GLU 23 Cb 0.31 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.74 2e7n h GLU 23 CO -0.00 0.96 0.00 0.52 -0.73 0.00 0.00 179.01 179.76 2e7n h MET 24 N -0.64 0.00 -1.04 1.92 2.86 -1.29 -1.34 114.93 115.40 2e7n h MET 24 Ca -0.03 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 57.07 2e7n h MET 24 Cb 1.06 0.00 -0.27 0.00 0.06 0.00 0.00 31.60 32.45 2e7n h MET 24 CO 0.04 0.00 0.68 1.28 1.06 0.00 0.00 176.91 179.98 2e7n n LEU 25 N -2.60 6.86 -4.83 1.22 4.77 -0.92 -4.62 117.00 116.89 2e7n n LEU 25 Ca -0.02 -3.71 -0.33 0.00 -0.03 0.00 0.00 56.01 51.92 2e7n n LEU 25 Cb 0.05 -0.89 -0.06 0.00 -2.33 0.00 0.00 43.42 40.19 2e7n n LEU 25 CO 0.14 1.18 -0.21 -0.55 -1.33 0.00 0.00 177.39 176.62 2e7n s SER 26 N -1.24 5.97 0.54 -1.43 0.15 -0.51 -4.97 113.70 112.22 2e7n s SER 26 Ca 0.54 0.23 0.29 0.00 0.70 0.00 0.00 55.95 57.72 2e7n s SER 26 Cb 0.44 -1.79 1.60 0.00 -1.71 0.00 0.00 66.02 64.57 2e7n s SER 26 CO 0.05 0.27 1.88 0.11 1.20 0.00 0.00 173.24 176.76 2e7n h LYS 27 N 4.00 0.00 0.07 5.44 6.56 -1.92 0.10 116.57 130.82 2e7n h LYS 27 Ca -0.49 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.10 2e7n h LYS 27 Cb 1.19 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.85 2e7n h LYS 27 CO 0.65 0.00 -0.03 -0.22 -2.06 0.00 0.00 179.45 177.79 2e7n h LYS 28 N 0.00 -0.09 0.00 3.15 1.63 -1.93 -3.26 116.57 116.08 2e7n h LYS 28 Ca 0.00 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 2e7n h LYS 28 Cb 0.36 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.01 2e7n h LYS 28 CO 0.00 0.47 -0.06 0.72 -3.45 0.00 0.00 179.45 177.13 2e7n n HIS 29 N -4.84 0.47 -0.31 1.91 8.25 -0.63 -3.78 115.22 116.30 2e7n n HIS 29 Ca -0.08 0.14 0.09 0.00 -0.26 0.00 0.00 57.72 57.61 2e7n n HIS 29 Cb 0.30 -0.71 0.26 0.00 1.12 0.00 0.00 29.99 30.96 2e7n n HIS 29 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2e7n h ALA 30 N 2.75 1.37 -0.98 -1.41 0.00 -0.88 1.44 119.26 121.56 2e7n h ALA 30 Ca 0.00 0.10 0.33 0.00 0.00 0.00 0.00 54.91 55.34 2e7n h ALA 30 Cb 0.63 0.02 -0.17 0.00 0.00 0.00 0.00 17.79 18.26 2e7n h ALA 30 CO 0.00 -0.15 0.37 0.00 0.00 0.00 0.00 179.25 179.48 2e7n h ALA 31 N 1.61 1.73 0.00 0.00 0.00 -1.72 0.75 119.26 121.62 2e7n h ALA 31 Ca 0.50 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.67 2e7n h ALA 31 Cb 0.79 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2e7n h ALA 31 CO -0.41 -0.70 0.00 2.48 0.00 0.00 0.00 179.25 180.63 2e7n n TYR 32 N -5.26 0.00 0.21 0.00 4.11 -0.30 -4.57 117.16 111.35 2e7n n TYR 32 Ca 0.30 -0.36 0.03 0.00 -0.00 0.00 0.00 57.90 57.86 2e7n n TYR 32 Cb 0.99 -0.04 0.02 0.00 -0.00 0.00 0.00 39.34 40.31 2e7n n TYR 32 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2e7n n ALA 33 N -0.36 2.50 0.10 -3.48 0.00 0.48 -3.82 120.51 115.93 2e7n n ALA 33 Ca 0.00 -0.50 -0.05 0.00 0.00 0.00 0.00 53.44 52.89 2e7n n ALA 33 Cb 0.19 -0.17 0.04 0.00 0.00 0.00 0.00 19.45 19.51 2e7n n ALA 33 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 2e7n h TRP 34 N 0.91 0.08 0.00 0.00 5.08 0.20 -3.16 115.95 119.06 2e7n h TRP 34 Ca 0.00 -0.04 0.00 0.00 1.08 0.00 0.00 58.89 59.93 2e7n h TRP 34 Cb 0.20 -0.01 0.00 0.00 -3.00 0.00 0.00 29.16 26.35 2e7n h TRP 34 CO 0.00 0.83 0.57 -1.35 -1.28 0.00 0.00 178.44 177.21 2e7n h PRO 35 N 0.03 0.00 -0.58 0.12 0.11 -1.81 0.68 132.00 130.56 2e7n h PRO 35 Ca -0.02 0.00 -0.43 0.00 0.11 0.00 0.00 66.00 65.67 2e7n h PRO 35 Cb 1.40 0.00 -0.34 0.00 0.11 0.00 0.00 31.00 32.17 2e7n h PRO 35 CO 0.11 0.00 -0.76 1.19 -0.21 0.00 0.00 178.00 178.33 2e7n n PHE 36 N -2.58 2.13 -0.08 0.65 3.01 -1.19 -4.66 117.46 114.73 2e7n n PHE 36 Ca -0.01 -2.06 -0.09 0.00 1.01 0.00 0.00 57.45 56.30 2e7n n PHE 36 Cb 0.60 -0.32 -0.13 0.00 -0.01 0.00 0.00 39.48 39.62 2e7n n PHE 36 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2e7n n TYR 37 N -0.79 0.00 -4.15 1.38 4.02 0.24 -3.01 117.16 114.86 2e7n n TYR 37 Ca 0.38 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.97 2e7n n TYR 37 Cb 0.91 -0.82 -0.08 0.00 -0.02 0.00 0.00 39.34 39.32 2e7n n TYR 37 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 2e7n s LYS 38 N -2.41 2.46 0.86 -0.72 3.01 -1.26 -4.77 119.74 116.91 2e7n s LYS 38 Ca -0.10 -0.89 -0.14 0.00 -1.01 0.00 0.00 55.97 53.83 2e7n s LYS 38 Cb 0.05 -2.49 0.21 0.00 -1.01 0.00 0.00 37.83 34.60 2e7n s LYS 38 CO 0.67 0.53 0.76 -0.35 0.51 0.00 0.00 175.35 177.47 2e7n n PRO 39 N 0.54 -2.51 -3.98 -1.68 -0.04 -1.26 -5.01 135.00 121.05 2e7n n PRO 39 Ca -0.11 -1.22 -0.24 0.00 -0.04 0.00 0.00 63.50 61.89 2e7n n PRO 39 Cb 0.52 -1.15 -0.17 0.00 -0.04 0.00 0.00 33.50 32.67 2e7n n PRO 39 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2e7n s VAL 40 N -2.39 0.69 -0.38 0.52 1.01 -1.26 -5.10 120.40 113.49 2e7n s VAL 40 Ca 0.50 -0.12 0.03 0.00 0.00 0.00 0.00 61.98 62.39 2e7n s VAL 40 Cb -0.05 -0.75 0.11 0.00 0.00 0.00 0.00 36.38 35.69 2e7n s VAL 40 CO 0.38 0.29 0.11 -0.62 0.00 0.00 0.00 175.10 175.27 2e7n s ASP 41 N 1.51 4.48 0.27 3.32 -1.08 -1.26 -4.97 116.67 118.93 2e7n s ASP 41 Ca -0.01 -2.28 -0.00 0.00 -0.52 0.00 0.00 52.55 49.74 2e7n s ASP 41 Cb -0.13 -1.46 0.52 0.00 -1.46 0.00 0.00 42.92 40.39 2e7n s ASP 41 CO -0.04 -0.35 1.82 0.00 0.52 0.00 0.00 175.17 177.12 2e7n h ALA 42 N 7.40 1.43 0.71 3.66 0.00 -1.99 0.41 119.26 130.87 2e7n h ALA 42 Ca -0.06 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2e7n h ALA 42 Cb 0.99 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.61 2e7n h ALA 42 CO 0.54 0.16 -0.34 0.93 0.00 0.00 0.00 179.25 180.54 2e7n h GLU 43 N 0.91 -0.92 0.63 0.00 5.08 -1.99 -3.30 114.58 114.99 2e7n h GLU 43 Ca 0.48 0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.87 2e7n h GLU 43 Cb 0.49 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.95 2e7n h GLU 43 CO -0.27 -0.61 -0.35 0.00 -1.00 0.00 0.00 179.01 176.77 2e7n h ALA 44 N -1.53 -0.92 -2.37 3.43 0.00 -1.94 -3.43 119.26 112.50 2e7n h ALA 44 Ca -0.10 -0.19 -0.52 0.00 0.00 0.00 0.00 54.91 54.11 2e7n h ALA 44 Cb 0.73 0.40 0.14 0.00 0.00 0.00 0.00 17.79 19.06 2e7n h ALA 44 CO 0.16 -1.02 0.32 -0.51 0.00 0.00 0.00 179.25 178.20 2e7n s LEU 45 N -10.08 3.11 -0.46 0.00 1.02 0.14 -4.93 118.68 107.48 2e7n s LEU 45 Ca -0.18 1.97 0.01 0.00 0.02 0.00 0.00 54.13 55.95 2e7n s LEU 45 Cb 0.04 -4.54 0.44 0.00 0.02 0.00 0.00 46.19 42.15 2e7n s LEU 45 CO 0.62 -2.13 1.90 -0.62 0.02 0.00 0.00 176.35 176.14 2e7n n GLU 46 N -3.31 2.20 -0.45 1.70 1.02 -1.26 -4.69 120.64 115.85 2e7n n GLU 46 Ca 0.10 -2.55 -0.22 0.00 -0.02 0.00 0.00 57.16 54.47 2e7n n GLU 46 Cb 0.52 -2.00 0.20 0.00 -0.02 0.00 0.00 31.44 30.14 2e7n n GLU 46 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2e7n n LEU 47 N -0.62 -1.12 -3.71 -4.62 4.77 -1.26 -5.00 117.00 105.44 2e7n n LEU 47 Ca 0.50 -0.50 -0.30 0.00 -0.03 0.00 0.00 56.01 55.68 2e7n n LEU 47 Cb 1.00 -0.86 -0.14 0.00 -2.33 0.00 0.00 43.42 41.09 2e7n n LEU 47 CO 0.58 -3.64 -0.29 -1.00 -1.33 0.00 0.00 177.39 171.71 2e7n s HIS 48 N -2.10 1.85 -1.24 -1.77 3.76 -1.26 -4.85 115.29 109.67 2e7n s HIS 48 Ca 0.47 -2.11 -0.00 0.00 -0.15 0.00 0.00 55.06 53.26 2e7n s HIS 48 Cb -0.09 -1.79 0.00 0.00 1.11 0.00 0.00 32.58 31.81 2e7n s HIS 48 CO 0.43 -0.83 0.90 -0.25 -0.85 0.00 0.00 174.74 174.14 2e7n n ASP 49 N 4.13 -1.81 0.07 1.40 9.92 -1.26 -4.95 116.55 124.06 2e7n n ASP 49 Ca 0.04 -0.69 -0.03 0.00 -0.53 0.00 0.00 54.79 53.59 2e7n n ASP 49 Cb 0.38 -4.76 -0.01 0.00 -0.64 0.00 0.00 41.12 36.08 2e7n n ASP 49 CO 0.00 0.00 0.00 0.22 0.13 0.00 0.00 177.20 177.55 2e7n h TYR 50 N -1.90 -0.17 -0.81 1.24 3.20 -1.95 -3.00 116.97 113.57 2e7n h TYR 50 Ca -0.60 -0.00 0.20 0.00 3.14 0.00 0.00 58.73 61.47 2e7n h TYR 50 Cb 1.35 0.06 -0.13 0.00 1.54 0.00 0.00 36.73 39.54 2e7n h TYR 50 CO 0.45 -0.11 0.13 0.45 -1.64 0.00 0.00 178.16 177.44 2e7n h HIS 51 N -0.19 0.17 -0.80 -3.82 3.86 -1.93 0.52 115.15 112.95 2e7n h HIS 51 Ca -0.02 0.05 0.09 0.00 -1.16 0.00 0.00 60.37 59.33 2e7n h HIS 51 Cb 0.14 0.06 -0.11 0.00 1.06 0.00 0.00 27.41 28.56 2e7n h HIS 51 CO 0.19 -0.21 -0.54 -0.44 0.86 0.00 0.00 177.93 177.79 2e7n h ASP 52 N 0.17 -1.93 -0.02 2.45 5.19 -1.94 -1.93 116.42 118.42 2e7n h ASP 52 Ca 0.48 0.30 -0.01 0.00 -0.62 0.00 0.00 57.03 57.18 2e7n h ASP 52 Cb 0.90 0.85 -0.00 0.00 0.18 0.00 0.00 39.33 41.26 2e7n h ASP 52 CO -0.65 -0.29 -0.02 0.40 -3.12 0.00 0.00 179.24 175.56 2e7n h ILE 53 N -0.13 1.41 -3.37 0.35 2.04 -1.10 -3.39 117.51 113.31 2e7n h ILE 53 Ca 0.16 -1.23 -0.74 0.00 1.00 0.00 0.00 64.86 64.05 2e7n h ILE 53 Cb 0.50 2.20 -0.28 0.00 -0.74 0.00 0.00 36.82 38.49 2e7n h ILE 53 CO -0.83 0.32 -0.27 -0.63 0.00 0.00 0.00 178.15 176.75 2e7n s ILE 54 N -4.15 4.61 -0.04 -0.67 -1.09 0.06 -4.92 121.20 114.99 2e7n s ILE 54 Ca -0.16 -1.99 -0.25 0.00 -2.23 0.00 0.00 60.65 56.03 2e7n s ILE 54 Cb 0.02 -3.98 -0.21 0.00 -1.58 0.00 0.00 42.46 36.71 2e7n s ILE 54 CO 0.69 -0.85 1.11 0.11 -1.23 0.00 0.00 174.94 174.77 2e7n h LYS 55 N 8.26 0.13 -3.51 2.79 1.79 -1.67 -3.36 116.57 121.01 2e7n h LYS 55 Ca -0.15 -0.11 -0.73 0.00 -2.18 0.00 0.00 60.65 57.47 2e7n h LYS 55 Cb 1.06 0.02 -0.32 0.00 -1.58 0.00 0.00 32.23 31.41 2e7n h LYS 55 CO 0.86 0.78 -0.03 -3.38 -1.08 0.00 0.00 179.45 176.60 2e7n s HIS 56 N -3.52 3.82 0.72 -1.35 -3.43 -1.26 -5.03 115.29 105.24 2e7n s HIS 56 Ca -0.16 -2.72 -0.13 0.00 -0.80 0.00 0.00 55.06 51.25 2e7n s HIS 56 Cb 0.01 -3.44 0.03 0.00 -1.43 0.00 0.00 32.58 27.75 2e7n s HIS 56 CO 0.72 -0.84 1.10 -1.25 -2.00 0.00 0.00 174.74 172.47 2e7n s PRO 57 N -0.78 2.52 0.09 -0.38 0.04 -1.26 -4.98 135.00 130.26 2e7n s PRO 57 Ca 0.24 1.28 -0.12 0.00 0.04 0.00 0.00 61.00 62.44 2e7n s PRO 57 Cb -0.11 -1.92 0.02 0.00 0.04 0.00 0.00 34.50 32.52 2e7n s PRO 57 CO -0.09 -1.45 0.29 1.41 0.04 0.00 0.00 177.00 177.20 2e7n s MET 58 N -4.50 0.93 0.03 4.56 1.75 -1.26 -5.04 119.30 115.76 2e7n s MET 58 Ca 0.64 -0.78 -0.26 0.00 -1.25 0.00 0.00 55.69 54.04 2e7n s MET 58 Cb -0.19 0.39 0.06 0.00 2.84 0.00 0.00 34.83 37.94 2e7n s MET 58 CO 0.49 -0.32 0.59 -0.51 -0.65 0.00 0.00 175.02 174.61 2e7n s ASP 59 N -2.70 -0.54 0.15 1.11 1.11 -1.26 -4.85 116.67 109.68 2e7n s ASP 59 Ca 0.02 0.35 -0.26 0.00 0.18 0.00 0.00 52.55 52.85 2e7n s ASP 59 Cb 0.03 0.53 0.00 0.00 1.07 0.00 0.00 42.92 44.55 2e7n s ASP 59 CO -0.10 -0.72 1.59 -0.07 1.18 0.00 0.00 175.17 177.05 2e7n h LEU 60 N 2.75 -1.23 -1.25 1.23 3.38 -1.91 0.10 115.31 118.39 2e7n h LEU 60 Ca -0.30 0.19 0.33 0.00 0.09 0.00 0.00 57.88 58.19 2e7n h LEU 60 Cb 1.20 0.54 -0.12 0.00 0.09 0.00 0.00 40.66 42.37 2e7n h LEU 60 CO 0.40 -0.36 0.69 0.28 0.09 0.00 0.00 178.44 179.53 2e7n h SER 61 N -0.35 0.42 0.67 -0.43 0.02 -1.86 -0.96 113.55 111.06 2e7n h SER 61 Ca 0.13 0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 61.18 2e7n h SER 61 Cb 0.57 0.08 0.01 0.00 0.14 0.00 0.00 62.40 63.20 2e7n h SER 61 CO -0.49 -0.05 -0.32 0.74 -1.14 0.00 0.00 176.83 175.57 2e7n h THR 62 N 0.30 0.00 -0.77 -2.27 2.02 -1.21 -2.92 112.91 108.06 2e7n h THR 62 Ca 0.70 -0.33 0.18 0.00 0.77 0.00 0.00 66.41 67.73 2e7n h THR 62 Cb 1.84 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 68.12 2e7n h THR 62 CO -0.43 0.00 0.09 0.58 0.37 0.00 0.00 175.52 176.13 2e7n h VAL 63 N -1.23 0.38 0.05 3.16 2.07 -0.57 -2.27 116.25 117.85 2e7n h VAL 63 Ca -0.09 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.38 2e7n h VAL 63 Cb 0.69 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 2e7n h VAL 63 CO 0.15 0.03 -0.18 0.50 0.02 0.00 0.00 177.57 178.09 2e7n h LYS 64 N 0.16 -0.25 -0.97 1.57 3.64 -1.25 0.06 116.57 119.52 2e7n h LYS 64 Ca 0.44 0.02 0.25 0.00 -1.27 0.00 0.00 60.65 60.09 2e7n h LYS 64 Cb 0.79 0.06 -0.18 0.00 -0.41 0.00 0.00 32.23 32.49 2e7n h LYS 64 CO -0.62 -0.17 -0.02 0.00 -2.27 0.00 0.00 179.45 176.37 2e7n h ARG 65 N -0.26 0.01 -0.37 1.90 2.47 -1.22 0.72 114.38 117.63 2e7n h ARG 65 Ca -0.00 -0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.72 2e7n h ARG 65 Cb 0.26 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.56 2e7n h ARG 65 CO -0.09 0.01 0.24 0.87 0.56 0.00 0.00 179.97 181.56 2e7n h LYS 66 N 0.01 0.48 -0.10 0.04 1.57 -0.92 -1.30 116.57 116.35 2e7n h LYS 66 Ca 0.57 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 59.24 2e7n h LYS 66 Cb 1.11 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 2e7n h LYS 66 CO -0.92 0.32 -0.30 1.98 -0.57 0.00 0.00 179.45 179.96 2e7n h MET 67 N 0.49 0.19 -0.50 3.15 4.05 0.22 -0.47 114.93 122.05 2e7n h MET 67 Ca 0.14 -0.07 -0.11 0.00 -0.28 0.00 0.00 59.70 59.38 2e7n h MET 67 Cb -0.04 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 30.73 2e7n h MET 67 CO -0.04 0.48 -0.14 -0.44 0.23 0.00 0.00 176.91 177.00 2e7n h ASP 68 N 0.17 0.97 -0.32 1.39 5.19 0.37 -2.73 116.42 121.46 2e7n h ASP 68 Ca 0.02 -0.33 -0.02 0.00 -0.62 0.00 0.00 57.03 56.08 2e7n h ASP 68 Cb 0.62 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 39.85 2e7n h ASP 68 CO 0.04 1.10 0.03 0.61 -3.12 0.00 0.00 179.24 177.90 2e7n n GLY 69 N -0.27 2.37 2.90 2.75 0.00 -0.55 -4.87 105.19 107.52 2e7n n GLY 69 Ca 0.01 -0.49 -0.14 0.00 0.00 0.00 0.00 46.02 45.40 2e7n n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2e7n n ARG 70 N 0.27 -2.68 -0.01 1.61 5.12 -1.03 -4.78 116.66 115.16 2e7n n ARG 70 Ca 0.16 0.32 0.01 0.00 -1.93 0.00 0.00 57.85 56.40 2e7n n ARG 70 Cb 0.78 -4.91 0.32 0.00 -1.16 0.00 0.00 32.46 27.49 2e7n n ARG 70 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 2e7n h GLU 71 N -0.35 0.54 -6.35 5.56 4.39 -1.34 -3.42 114.58 113.62 2e7n h GLU 71 Ca -0.26 -0.10 -0.55 0.00 0.34 0.00 0.00 59.36 58.80 2e7n h GLU 71 Cb 1.18 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.73 2e7n h GLU 71 CO 0.33 0.52 0.78 0.71 -1.16 0.00 0.00 179.01 180.19 2e7n s TYR 72 N -5.09 2.99 0.27 4.33 2.02 -1.26 -4.91 117.35 115.70 2e7n s TYR 72 Ca -0.08 0.99 0.18 0.00 -0.37 0.00 0.00 57.07 57.79 2e7n s TYR 72 Cb 0.16 -3.56 0.80 0.00 -0.40 0.00 0.00 41.96 38.96 2e7n s TYR 72 CO 0.76 -1.97 1.81 -1.00 -1.57 0.00 0.00 175.55 173.58 2e7n h PRO 73 N 7.68 0.00 -3.00 -1.71 0.13 -1.96 -3.47 132.00 129.67 2e7n h PRO 73 Ca -0.36 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.75 2e7n h PRO 73 Cb 1.17 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.31 2e7n h PRO 73 CO 0.89 0.35 0.28 0.16 -0.23 0.00 0.00 178.00 179.45 2e7n s ASP 74 N -6.54 0.02 0.31 1.44 -4.77 -1.26 -4.91 116.67 100.96 2e7n s ASP 74 Ca -0.01 -1.18 -0.01 0.00 -3.30 0.00 0.00 52.55 48.06 2e7n s ASP 74 Cb 0.12 0.86 0.50 0.00 -1.09 0.00 0.00 42.92 43.31 2e7n s ASP 74 CO 0.68 -1.71 1.97 0.00 0.70 0.00 0.00 175.17 176.81 2e7n h ALA 75 N 2.00 1.46 -0.09 2.11 0.00 -1.92 -2.69 119.26 120.13 2e7n h ALA 75 Ca -0.33 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.57 2e7n h ALA 75 Cb 1.25 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 2e7n h ALA 75 CO 0.42 0.48 -0.15 1.96 0.00 0.00 0.00 179.25 181.96 2e7n h GLN 76 N 1.05 -0.20 -0.61 0.00 1.08 -1.99 0.02 115.11 114.46 2e7n h GLN 76 Ca 0.30 0.01 0.06 0.00 -1.45 0.00 0.00 58.65 57.57 2e7n h GLN 76 Cb -0.06 0.05 -0.05 0.00 -0.05 0.00 0.00 27.48 27.36 2e7n h GLN 76 CO -0.07 -0.14 0.32 0.78 -0.95 0.00 0.00 178.83 178.77 2e7n h GLY 77 N -0.21 0.87 0.93 3.46 0.00 -1.89 0.17 103.07 106.40 2e7n h GLY 77 Ca 0.08 -0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.16 2e7n h GLY 77 CO -0.21 0.13 -0.29 -2.75 0.00 0.00 0.00 176.54 173.42 2e7n h PHE 78 N 0.60 -0.76 -0.64 5.60 3.57 -1.22 -2.98 116.94 121.11 2e7n h PHE 78 Ca 0.27 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.82 2e7n h PHE 78 Cb 0.18 0.25 -0.06 0.00 2.79 0.00 0.00 35.95 39.11 2e7n h PHE 78 CO -0.09 -0.44 0.34 0.00 -2.23 0.00 0.00 178.31 175.89 2e7n h ALA 79 N -0.54 0.85 -0.56 2.41 0.00 -0.84 -2.88 119.26 117.69 2e7n h ALA 79 Ca -0.08 0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.91 2e7n h ALA 79 Cb 0.65 -0.10 -0.09 0.00 0.00 0.00 0.00 17.79 18.26 2e7n h ALA 79 CO 0.14 0.00 -0.55 0.00 0.00 0.00 0.00 179.25 178.83 2e7n h ALA 80 N 1.35 -0.71 -0.52 0.00 0.00 -0.57 -0.52 119.26 118.29 2e7n h ALA 80 Ca 0.29 0.03 0.10 0.00 0.00 0.00 0.00 54.91 55.33 2e7n h ALA 80 Cb 0.20 1.19 -0.11 0.00 0.00 0.00 0.00 17.79 19.08 2e7n h ALA 80 CO -0.19 -1.01 -0.26 -0.44 0.00 0.00 0.00 179.25 177.35 2e7n h ASP 81 N -0.28 -0.89 -0.68 0.00 5.19 -1.36 -0.08 116.42 118.32 2e7n h ASP 81 Ca 0.09 0.19 0.13 0.00 -0.62 0.00 0.00 57.03 56.83 2e7n h ASP 81 Cb 0.53 0.47 -0.09 0.00 0.18 0.00 0.00 39.33 40.41 2e7n h ASP 81 CO -0.68 -0.27 0.19 0.58 -3.12 0.00 0.00 179.24 175.94 2e7n h VAL 82 N -0.14 0.61 -0.62 -1.35 2.07 -1.08 -0.64 116.25 115.11 2e7n h VAL 82 Ca 0.23 -0.11 0.09 0.00 0.82 0.00 0.00 66.70 67.73 2e7n h VAL 82 Cb 0.50 0.27 -0.07 0.00 -1.52 0.00 0.00 31.29 30.48 2e7n h VAL 82 CO -0.60 0.06 0.26 0.03 0.02 0.00 0.00 177.57 177.33 2e7n h ARG 83 N 0.31 0.44 0.08 1.57 2.47 0.44 -2.37 114.38 117.32 2e7n h ARG 83 Ca 0.37 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 59.06 2e7n h ARG 83 Cb 0.57 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.78 2e7n h ARG 83 CO -0.43 0.29 -0.08 1.25 0.56 0.00 0.00 179.97 181.56 2e7n h LEU 84 N 0.46 -0.22 -0.96 3.04 5.85 -0.62 -2.43 115.31 120.43 2e7n h LEU 84 Ca 0.31 0.02 0.34 0.00 0.84 0.00 0.00 57.88 59.38 2e7n h LEU 84 Cb 0.35 0.08 -0.18 0.00 0.37 0.00 0.00 40.66 41.28 2e7n h LEU 84 CO -0.28 -0.13 0.28 0.80 -0.34 0.00 0.00 178.44 178.77 2e7n n MET 85 N -5.20 -0.07 0.10 1.25 1.56 -0.85 -1.29 117.12 112.63 2e7n n MET 85 Ca -0.07 1.38 -0.05 0.00 -0.27 0.00 0.00 57.70 58.70 2e7n n MET 85 Cb 0.12 -2.34 -0.02 0.00 2.15 0.00 0.00 33.22 33.13 2e7n n MET 85 CO 0.00 0.00 0.00 0.74 -0.73 0.00 0.00 175.97 175.98 2e7n h PHE 86 N 0.00 -0.27 -1.11 1.12 0.04 -1.39 -3.20 116.94 112.12 2e7n h PHE 86 Ca 0.70 -0.01 0.38 0.00 2.80 0.00 0.00 57.97 61.85 2e7n h PHE 86 Cb 1.70 0.09 -0.11 0.00 2.20 0.00 0.00 35.95 39.83 2e7n h PHE 86 CO -0.24 -0.17 0.71 0.43 -0.60 0.00 0.00 178.31 178.44 2e7n n SER 87 N -3.62 0.17 0.40 2.17 7.64 -0.51 0.67 113.62 120.53 2e7n n SER 87 Ca -0.04 1.11 -0.17 0.00 1.01 0.00 0.00 58.87 60.78 2e7n n SER 87 Cb 0.12 -0.55 -0.09 0.00 -1.01 0.00 0.00 64.21 62.69 2e7n n SER 87 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 2e7n h ASN 88 N 0.00 -0.86 -0.97 6.43 4.21 -1.22 -1.26 115.58 121.91 2e7n h ASN 88 Ca 0.71 0.01 0.12 0.00 1.21 0.00 0.00 56.30 58.35 2e7n h ASN 88 Cb 2.28 0.22 -0.09 0.00 -1.12 0.00 0.00 38.32 39.62 2e7n h ASN 88 CO -0.37 -0.54 0.60 0.00 -1.29 0.00 0.00 177.43 175.83 2e7n h TYR 90 N 0.94 0.00 0.00 0.00 0.05 -1.20 -2.43 116.97 114.33 2e7n h TYR 90 Ca 0.49 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.27 2e7n h TYR 90 Cb 0.51 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.25 2e7n h TYR 90 CO -0.02 0.00 -0.60 1.17 -1.05 0.00 0.00 178.16 177.66 2e7n n LYS 91 N -2.87 0.44 0.04 4.88 4.81 0.97 -4.68 118.16 121.74 2e7n n LYS 91 Ca 0.01 0.42 -0.03 0.00 -0.87 0.00 0.00 58.31 57.84 2e7n n LYS 91 Cb 0.26 -1.55 -0.02 0.00 0.02 0.00 0.00 35.03 33.75 2e7n n LYS 91 CO 0.00 0.00 0.00 -0.92 1.17 0.00 0.00 177.40 177.65 2e7n h TYR 92 N -0.93 -0.22 -3.93 5.64 3.20 -0.50 -3.42 116.97 116.82 2e7n h TYR 92 Ca 0.00 0.00 -0.53 0.00 3.14 0.00 0.00 58.73 61.34 2e7n h TYR 92 Cb 0.60 0.09 0.09 0.00 1.54 0.00 0.00 36.73 39.05 2e7n h TYR 92 CO -0.26 -0.10 0.70 -0.80 -1.64 0.00 0.00 178.16 176.06 2e7n s ASN 93 N -2.63 6.46 0.97 -2.11 0.01 -0.92 -5.00 114.94 111.72 2e7n s ASN 93 Ca -0.03 2.86 -0.12 0.00 -0.71 0.00 0.00 52.86 54.86 2e7n s ASN 93 Cb 0.01 -2.66 0.17 0.00 0.41 0.00 0.00 41.25 39.18 2e7n s ASN 93 CO 0.09 -0.77 1.09 -2.16 -1.51 0.00 0.00 177.10 173.84 2e7n s PRO 94 N -2.03 0.65 0.00 -0.60 0.04 -1.26 -4.69 135.00 127.10 2e7n s PRO 94 Ca 0.52 0.60 0.15 0.00 0.04 0.00 0.00 61.00 62.32 2e7n s PRO 94 Cb -0.43 -1.76 0.84 0.00 0.04 0.00 0.00 34.50 33.20 2e7n s PRO 94 CO 0.57 -2.60 1.38 -0.35 0.04 0.00 0.00 177.00 176.03 2e7n n PRO 95 N -4.10 0.35 -0.05 0.56 -0.04 -1.26 -1.76 135.00 128.70 2e7n n PRO 95 Ca 0.06 0.07 0.06 0.00 -0.04 0.00 0.00 63.50 63.65 2e7n n PRO 95 Cb 0.57 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.61 2e7n n PRO 95 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2e7n n ASP 96 N -1.14 2.27 -4.70 3.54 8.00 -1.26 -4.98 116.55 118.27 2e7n n ASP 96 Ca 0.09 -1.63 -0.42 0.00 0.71 0.00 0.00 54.79 53.54 2e7n n ASP 96 Cb 0.08 -0.07 -0.03 0.00 -0.02 0.00 0.00 41.12 41.09 2e7n n ASP 96 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2e7n s HIS 97 N -1.00 3.53 0.24 1.24 2.46 -0.72 -4.94 115.29 116.09 2e7n s HIS 97 Ca 0.17 1.54 -0.06 0.00 0.47 0.00 0.00 55.06 57.18 2e7n s HIS 97 Cb 0.11 -3.23 0.32 0.00 -0.13 0.00 0.00 32.58 29.64 2e7n s HIS 97 CO 0.16 -0.49 1.85 1.05 -2.47 0.00 0.00 174.74 174.84 2e7n h GLU 98 N 6.92 0.92 -1.10 2.88 4.11 -1.94 -1.17 114.58 125.21 2e7n h GLU 98 Ca -0.39 -0.06 0.31 0.00 0.07 0.00 0.00 59.36 59.30 2e7n h GLU 98 Cb 1.20 -0.21 -0.05 0.00 0.50 0.00 0.00 28.75 30.19 2e7n h GLU 98 CO 0.80 0.61 0.78 -0.24 0.07 0.00 0.00 179.01 181.02 2e7n h VAL 99 N 0.95 0.46 -0.94 -1.06 3.04 -1.95 0.32 116.25 117.06 2e7n h VAL 99 Ca 0.36 -0.03 -0.00 0.00 -1.01 0.00 0.00 66.70 66.02 2e7n h VAL 99 Cb 0.16 0.37 -0.05 0.00 -2.01 0.00 0.00 31.29 29.77 2e7n h VAL 99 CO -0.17 0.01 0.57 0.58 -1.01 0.00 0.00 177.57 177.56 2e7n h VAL 100 N 0.08 1.25 0.00 1.51 2.07 -1.53 -0.09 116.25 119.53 2e7n h VAL 100 Ca 0.54 -0.54 -0.11 0.00 0.82 0.00 0.00 66.70 67.41 2e7n h VAL 100 Cb 2.01 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 2e7n h VAL 100 CO -0.06 0.27 -0.51 0.00 0.02 0.00 0.00 177.57 177.28 2e7n h ALA 101 N 1.34 1.15 0.04 1.67 0.00 -0.48 -3.10 119.26 119.89 2e7n h ALA 101 Ca 0.34 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 2e7n h ALA 101 Cb -0.07 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2e7n h ALA 101 CO -0.06 0.64 -0.02 0.52 0.00 0.00 0.00 179.25 180.33 2e7n h MET 102 N 0.00 -0.06 -0.66 0.00 2.86 -1.14 -3.29 114.93 112.64 2e7n h MET 102 Ca -0.01 0.00 0.13 0.00 -2.06 0.00 0.00 59.70 57.77 2e7n h MET 102 Cb 0.91 0.01 -0.13 0.00 0.06 0.00 0.00 31.60 32.46 2e7n h MET 102 CO 0.07 0.58 -0.20 0.00 1.06 0.00 0.00 176.91 178.41 2e7n h ALA 103 N 0.04 0.36 -0.49 6.32 0.00 -1.07 -1.02 119.26 123.40 2e7n h ALA 103 Ca -0.01 0.25 0.09 0.00 0.00 0.00 0.00 54.91 55.24 2e7n h ALA 103 Cb 0.66 0.56 -0.10 0.00 0.00 0.00 0.00 17.79 18.91 2e7n h ALA 103 CO 0.01 -0.46 -0.35 0.00 0.00 0.00 0.00 179.25 178.45 2e7n h ARG 104 N -0.03 -0.21 -1.17 0.00 3.08 -1.64 0.22 114.38 114.63 2e7n h ARG 104 Ca 0.31 0.01 0.42 0.00 0.07 0.00 0.00 59.98 60.79 2e7n h ARG 104 Cb 0.51 0.05 -0.15 0.00 0.08 0.00 0.00 29.97 30.45 2e7n h ARG 104 CO -0.69 -0.14 0.70 0.87 -1.07 0.00 0.00 179.97 179.64 2e7n h LYS 105 N -0.22 0.08 0.09 0.04 1.57 -1.25 0.17 116.57 117.05 2e7n h LYS 105 Ca 0.19 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2e7n h LYS 105 Cb 0.55 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.84 2e7n h LYS 105 CO -0.61 0.05 -0.04 1.25 -0.57 0.00 0.00 179.45 179.53 2e7n h LEU 106 N 0.08 -0.10 -0.64 2.94 5.85 -0.57 -3.26 115.31 119.61 2e7n h LEU 106 Ca 0.83 -0.46 0.13 0.00 0.84 0.00 0.00 57.88 59.22 2e7n h LEU 106 Cb 2.36 0.03 -0.11 0.00 0.37 0.00 0.00 40.66 43.31 2e7n h LEU 106 CO -0.58 0.55 0.01 -0.61 -0.34 0.00 0.00 178.44 177.47 2e7n h GLN 107 N -0.91 0.12 -0.99 1.25 4.15 0.18 0.22 115.11 119.12 2e7n h GLN 107 Ca -0.01 -0.01 0.20 0.00 0.77 0.00 0.00 58.65 59.61 2e7n h GLN 107 Cb 0.56 -0.03 -0.10 0.00 0.21 0.00 0.00 27.48 28.12 2e7n h GLN 107 CO 0.02 0.08 0.62 0.22 -1.93 0.00 0.00 178.83 177.84 2e7n h ASP 108 N 0.12 0.68 0.27 -0.69 3.58 -0.92 0.44 116.42 119.90 2e7n h ASP 108 Ca 0.34 0.09 -0.26 0.00 0.42 0.00 0.00 57.03 57.62 2e7n h ASP 108 Cb 0.55 -0.03 0.01 0.00 1.72 0.00 0.00 39.33 41.59 2e7n h ASP 108 CO -0.55 0.23 -1.08 0.58 -2.88 0.00 0.00 179.24 175.54 2e7n h VAL 109 N 0.65 1.36 0.00 2.25 2.07 -0.71 -3.02 116.25 118.86 2e7n h VAL 109 Ca 0.57 -2.50 -0.02 0.00 0.82 0.00 0.00 66.70 65.56 2e7n h VAL 109 Cb 1.03 2.56 -0.00 0.00 -1.52 0.00 0.00 31.29 33.36 2e7n h VAL 109 CO -0.35 0.75 -0.11 0.15 0.02 0.00 0.00 177.57 178.04 2e7n h PHE 110 N 0.25 0.00 0.07 1.57 3.57 1.00 -2.34 116.94 121.06 2e7n h PHE 110 Ca -0.12 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.37 2e7n h PHE 110 Cb 1.74 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.48 2e7n h PHE 110 CO 0.08 0.11 -0.03 0.93 -2.23 0.00 0.00 178.31 177.16 2e7n h GLU 111 N 0.00 -0.09 -0.62 1.11 4.39 -1.01 -3.12 114.58 115.24 2e7n h GLU 111 Ca -0.00 0.01 0.13 0.00 0.34 0.00 0.00 59.36 59.83 2e7n h GLU 111 Cb 0.33 0.02 -0.11 0.00 -0.10 0.00 0.00 28.75 28.89 2e7n h GLU 111 CO 0.01 -0.06 -0.09 0.00 -1.16 0.00 0.00 179.01 177.72 2e7n h MET 112 N -0.90 0.04 -0.03 2.33 -0.00 -1.52 -1.34 114.93 113.51 2e7n h MET 112 Ca -0.01 -0.00 0.03 0.00 -0.00 0.00 0.00 59.70 59.72 2e7n h MET 112 Cb 0.07 -0.01 -0.06 0.00 -0.00 0.00 0.00 31.60 31.61 2e7n h MET 112 CO 0.02 0.03 -0.38 0.00 -0.00 0.00 0.00 176.91 176.58 2e7n h ARG 113 N 0.05 -0.50 -0.73 -0.10 2.47 -1.57 0.20 114.38 114.20 2e7n h ARG 113 Ca 0.31 0.03 0.17 0.00 -1.26 0.00 0.00 59.98 59.23 2e7n h ARG 113 Cb 0.49 0.11 -0.04 0.00 -1.65 0.00 0.00 29.97 28.88 2e7n h ARG 113 CO -0.59 -0.33 0.50 0.35 0.56 0.00 0.00 179.97 180.46 2e7n h PHE 114 N -0.52 0.31 0.01 3.04 3.57 -1.25 -1.71 116.94 120.39 2e7n h PHE 114 Ca 0.06 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.57 2e7n h PHE 114 Cb 0.61 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.26 2e7n h PHE 114 CO -0.41 0.11 -0.01 0.00 -2.23 0.00 0.00 178.31 175.78 2e7n h ALA 115 N 1.66 -0.01 -0.98 2.41 0.00 0.02 -3.22 119.26 119.13 2e7n h ALA 115 Ca 0.36 -0.31 0.21 0.00 0.00 0.00 0.00 54.91 55.16 2e7n h ALA 115 Cb 1.02 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.73 2e7n h ALA 115 CO -0.08 -0.19 0.62 0.87 0.00 0.00 0.00 179.25 180.46 2e7n h LYS 116 N -0.64 0.60 0.00 0.00 6.56 0.18 -3.51 116.57 119.75 2e7n h LYS 116 Ca -0.00 -0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.55 2e7n h LYS 116 Cb 0.62 -0.13 0.00 0.00 -0.57 0.00 0.00 32.23 32.15 2e7n h LYS 116 CO 0.00 0.39 0.00 -0.12 -2.06 0.00 0.00 179.45 177.67