#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e7n n SER 2 N 0.00 3.60 -4.59 1.61 2.88 -1.26 -4.88 113.62 110.97 2e7n n SER 2 Ca 0.00 0.99 -0.43 0.00 -1.33 0.00 0.00 58.87 58.11 2e7n n SER 2 Cb 0.00 -1.44 -0.02 0.00 -0.75 0.00 0.00 64.21 61.99 2e7n n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2e7n s SER 3 N 3.12 6.10 -0.30 -3.46 1.04 -1.26 -4.95 113.70 113.98 2e7n s SER 3 Ca 0.87 0.89 -0.02 0.00 0.48 0.00 0.00 55.95 58.17 2e7n s SER 3 Cb -0.61 -2.54 0.10 0.00 0.10 0.00 0.00 66.02 63.08 2e7n s SER 3 CO 0.44 -1.61 0.12 -0.83 0.98 0.00 0.00 173.24 172.33 2e7n s GLY 4 N 4.96 0.77 0.06 7.32 0.00 -1.26 -5.11 107.32 114.05 2e7n s GLY 4 Ca 0.67 -1.37 -0.30 0.00 0.00 0.00 0.00 44.72 43.71 2e7n s GLY 4 CO 0.31 1.86 1.79 -0.56 0.00 0.00 0.00 173.10 176.51 2e7n s SER 5 N 1.86 6.52 -0.16 1.64 0.01 -1.26 -4.98 113.70 117.32 2e7n s SER 5 Ca 0.10 2.58 -0.12 0.00 1.31 0.00 0.00 55.95 59.82 2e7n s SER 5 Cb -0.17 -2.55 0.05 0.00 0.21 0.00 0.00 66.02 63.56 2e7n s SER 5 CO -0.31 -0.97 0.42 -0.94 0.41 0.00 0.00 173.24 171.84 2e7n s SER 6 N 3.22 -0.48 0.00 2.44 1.04 -1.26 -4.84 113.70 113.81 2e7n s SER 6 Ca 0.80 0.87 0.00 0.00 0.48 0.00 0.00 55.95 58.10 2e7n s SER 6 Cb -0.41 0.81 0.00 0.00 0.10 0.00 0.00 66.02 66.52 2e7n s SER 6 CO 0.36 -0.17 0.00 0.61 0.98 0.00 0.00 173.24 175.01 2e7n n GLY 7 N 3.62 1.31 1.53 7.32 0.00 -1.26 -5.07 105.19 112.65 2e7n n GLY 7 Ca -0.19 -0.63 0.10 0.00 0.00 0.00 0.00 46.02 45.30 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 -0.24 -3.72 0.43 -0.02 0.00 -1.26 -3.27 105.19 97.11 2e7n n GLY 8 Ca 0.00 -0.95 0.17 0.00 0.00 0.00 0.00 46.02 45.23 2e7n n GLY 8 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2e7n h LYS 9 N -0.78 0.00 -2.91 1.61 -0.00 -2.01 -3.35 116.57 109.14 2e7n h LYS 9 Ca -0.12 0.00 -0.19 0.00 -0.00 0.00 0.00 60.65 60.34 2e7n h LYS 9 Cb 1.24 0.00 -0.30 0.00 -0.00 0.00 0.00 32.23 33.17 2e7n h LYS 9 CO 0.05 0.00 -0.47 -0.51 -0.00 0.00 0.00 179.45 178.51 2e7n s LEU 10 N -6.03 0.09 0.41 7.07 1.43 -1.25 -4.94 118.68 115.46 2e7n s LEU 10 Ca -0.02 0.61 -0.26 0.00 -1.03 0.00 0.00 54.13 53.43 2e7n s LEU 10 Cb 0.09 0.82 -0.09 0.00 0.03 0.00 0.00 46.19 47.04 2e7n s LEU 10 CO 0.30 -0.19 1.37 -0.55 0.23 0.00 0.00 176.35 177.51 2e7n s SER 11 N 1.68 6.19 0.34 2.29 0.15 -1.20 -4.52 113.70 118.63 2e7n s SER 11 Ca -0.06 2.80 0.26 0.00 0.70 0.00 0.00 55.95 59.65 2e7n s SER 11 Cb -0.11 -2.65 1.13 0.00 -1.71 0.00 0.00 66.02 62.69 2e7n s SER 11 CO -0.09 -0.95 1.16 -1.84 1.20 0.00 0.00 173.24 172.72 2e7n n GLU 12 N 0.10 -0.02 -0.07 5.44 0.00 -1.26 0.86 120.64 125.68 2e7n n GLU 12 Ca 0.04 0.92 -0.22 0.00 0.00 0.00 0.00 57.16 57.89 2e7n n GLU 12 Cb 0.42 -1.84 -0.12 0.00 0.00 0.00 0.00 31.44 29.90 2e7n n GLU 12 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2e7n n HIS 13 N -4.09 1.00 -0.23 -1.84 8.25 -1.26 -4.27 115.22 112.78 2e7n n HIS 13 Ca 0.30 0.35 0.04 0.00 -0.26 0.00 0.00 57.72 58.15 2e7n n HIS 13 Cb 1.21 -1.11 0.15 0.00 1.12 0.00 0.00 29.99 31.36 2e7n n HIS 13 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2e7n h LEU 14 N -0.65 0.02 -2.14 2.41 5.85 0.15 0.53 115.31 121.47 2e7n h LEU 14 Ca -0.40 0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.49 2e7n h LEU 14 Cb 1.56 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.77 2e7n h LEU 14 CO -0.13 -0.01 0.30 0.08 -0.34 0.00 0.00 178.44 178.34 2e7n h ARG 15 N 0.27 0.00 0.05 1.25 0.11 -0.87 -1.38 114.38 113.81 2e7n h ARG 15 Ca 0.38 0.00 -0.29 0.00 0.10 0.00 0.00 59.98 60.17 2e7n h ARG 15 Cb 0.61 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.66 2e7n h ARG 15 CO -0.47 0.00 -1.56 0.98 0.10 0.00 0.00 179.97 179.02 2e7n n TYR 16 N -3.28 1.12 0.01 4.08 4.19 0.17 -4.12 117.16 119.33 2e7n n TYR 16 Ca 0.01 0.37 0.17 0.00 3.31 0.00 0.00 57.90 61.76 2e7n n TYR 16 Cb 0.40 -1.13 0.64 0.00 0.49 0.00 0.00 39.34 39.74 2e7n n TYR 16 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2e7n h ASP 18 N 0.09 0.48 -0.12 0.00 3.58 -1.47 -0.51 116.42 118.47 2e7n h ASP 18 Ca 0.23 0.14 -0.04 0.00 0.42 0.00 0.00 57.03 57.78 2e7n h ASP 18 Cb 0.80 0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.93 2e7n h ASP 18 CO -0.02 0.05 -0.09 0.77 -2.88 0.00 0.00 179.24 177.07 2e7n h SER 19 N 0.48 0.29 -1.49 2.28 4.64 -1.50 -3.01 113.55 115.23 2e7n h SER 19 Ca 0.59 -0.45 0.43 0.00 -0.47 0.00 0.00 61.79 61.89 2e7n h SER 19 Cb 1.12 -0.08 -0.06 0.00 -0.31 0.00 0.00 62.40 63.07 2e7n h SER 19 CO -0.50 0.68 1.29 0.40 -0.87 0.00 0.00 176.83 177.83 2e7n h ILE 20 N -0.10 0.03 0.00 0.95 2.04 -1.13 0.62 117.51 119.93 2e7n h ILE 20 Ca 0.02 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.88 2e7n h ILE 20 Cb 0.58 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.70 2e7n h ILE 20 CO 0.02 0.00 -0.00 0.25 0.00 0.00 0.00 178.15 178.42 2e7n h LEU 21 N 0.00 -0.00 -2.21 1.44 5.85 -1.43 -2.89 115.31 116.06 2e7n h LEU 21 Ca 0.71 -0.89 0.05 0.00 0.84 0.00 0.00 57.88 58.59 2e7n h LEU 21 Cb 3.29 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 44.31 2e7n h LEU 21 CO -0.01 0.93 0.25 0.08 -0.34 0.00 0.00 178.44 179.35 2e7n h ARG 22 N -0.97 0.00 0.00 1.25 0.11 0.18 -1.87 114.38 113.08 2e7n h ARG 22 Ca -0.00 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.08 2e7n h ARG 22 Cb 0.89 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.97 2e7n h ARG 22 CO 0.00 0.00 -0.00 1.49 0.10 0.00 0.00 179.97 181.56 2e7n h GLU 23 N 0.00 -0.00 -0.08 0.08 4.57 -1.33 -3.29 114.58 114.52 2e7n h GLU 23 Ca 0.09 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.29 2e7n h GLU 23 Cb 0.58 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.16 2e7n h GLU 23 CO -0.00 0.89 0.16 0.52 -1.18 0.00 0.00 179.01 179.40 2e7n h MET 24 N -0.99 0.00 -1.24 1.92 2.86 -1.14 -0.94 114.93 115.41 2e7n h MET 24 Ca -0.00 0.00 -0.37 0.00 -2.06 0.00 0.00 59.70 57.27 2e7n h MET 24 Cb 0.89 0.00 -0.18 0.00 0.06 0.00 0.00 31.60 32.38 2e7n h MET 24 CO 0.00 0.00 0.47 1.28 1.06 0.00 0.00 176.91 179.72 2e7n n LEU 25 N -3.44 6.12 -4.89 1.22 4.77 -0.79 -4.62 117.00 115.37 2e7n n LEU 25 Ca -0.01 -3.21 -0.32 0.00 -0.03 0.00 0.00 56.01 52.45 2e7n n LEU 25 Cb 0.25 -0.90 -0.05 0.00 -2.33 0.00 0.00 43.42 40.39 2e7n n LEU 25 CO 0.23 1.09 -0.17 -0.55 -1.33 0.00 0.00 177.39 176.66 2e7n s SER 26 N -0.32 6.24 0.22 -1.43 0.15 -0.36 -4.98 113.70 113.22 2e7n s SER 26 Ca 0.37 0.26 -0.09 0.00 0.70 0.00 0.00 55.95 57.19 2e7n s SER 26 Cb 0.30 -1.90 0.33 0.00 -1.71 0.00 0.00 66.02 63.03 2e7n s SER 26 CO 0.02 0.20 1.70 0.50 1.20 0.00 0.00 173.24 176.87 2e7n h LYS 27 N 3.37 0.26 -0.18 5.44 1.63 -1.91 0.39 116.57 125.57 2e7n h LYS 27 Ca -0.46 -0.02 0.04 0.00 -0.85 0.00 0.00 60.65 59.36 2e7n h LYS 27 Cb 1.17 -0.06 -0.07 0.00 -0.60 0.00 0.00 32.23 32.67 2e7n h LYS 27 CO 0.72 0.17 -0.45 -0.22 -3.45 0.00 0.00 179.45 176.22 2e7n h LYS 28 N 0.27 -0.47 0.00 1.90 3.64 -1.95 0.11 116.57 120.08 2e7n h LYS 28 Ca 0.34 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.75 2e7n h LYS 28 Cb 0.51 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 2e7n h LYS 28 CO -0.42 -0.31 0.00 0.45 -2.27 0.00 0.00 179.45 176.90 2e7n h HIS 29 N -0.49 0.00 0.00 1.91 3.86 -1.71 -3.04 115.15 115.68 2e7n h HIS 29 Ca 0.08 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 2e7n h HIS 29 Cb 0.63 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.10 2e7n h HIS 29 CO -0.54 0.00 0.19 0.00 0.86 0.00 0.00 177.93 178.45 2e7n n ALA 30 N -1.94 0.76 -0.01 2.45 0.00 0.13 -0.37 120.51 121.53 2e7n n ALA 30 Ca 0.02 0.13 -0.13 0.00 0.00 0.00 0.00 53.44 53.46 2e7n n ALA 30 Cb 0.31 -0.94 -0.01 0.00 0.00 0.00 0.00 19.45 18.81 2e7n n ALA 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2e7n h ALA 31 N 1.46 0.51 0.00 0.00 0.00 -1.57 -3.09 119.26 116.57 2e7n h ALA 31 Ca 0.00 -0.56 -0.02 0.00 0.00 0.00 0.00 54.91 54.33 2e7n h ALA 31 Cb 0.39 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2e7n h ALA 31 CO 0.00 0.70 -0.32 2.48 0.00 0.00 0.00 179.25 182.11 2e7n n TYR 32 N -3.93 0.00 -0.74 0.00 0.18 0.25 -4.63 117.16 108.28 2e7n n TYR 32 Ca -0.05 -0.96 0.00 0.00 1.88 0.00 0.00 57.90 58.78 2e7n n TYR 32 Cb 0.68 -0.17 0.00 0.00 -0.38 0.00 0.00 39.34 39.47 2e7n n TYR 32 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2e7n n ALA 33 N -0.95 1.01 0.05 -3.48 0.00 0.50 -3.91 120.51 113.73 2e7n n ALA 33 Ca 0.14 -0.42 -0.07 0.00 0.00 0.00 0.00 53.44 53.09 2e7n n ALA 33 Cb 0.71 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 20.05 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 0.00 0.00 0.00 0.00 5.08 -1.74 -3.27 115.95 116.01 2e7n h TRP 34 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2e7n h TRP 34 Cb 0.66 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.82 2e7n h TRP 34 CO 0.00 0.97 0.57 -1.35 -1.28 0.00 0.00 178.44 177.35 2e7n h PRO 35 N 0.00 0.00 0.00 0.12 0.11 -1.87 0.56 132.00 130.92 2e7n h PRO 35 Ca -0.06 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.80 2e7n h PRO 35 Cb 1.79 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.85 2e7n h PRO 35 CO 0.12 0.00 -2.10 1.19 -0.21 0.00 0.00 178.00 177.00 2e7n n PHE 36 N -2.58 0.00 0.00 0.65 3.01 -1.23 -4.68 117.46 112.62 2e7n n PHE 36 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 2e7n n PHE 36 Cb 0.60 -0.76 0.00 0.00 -0.01 0.00 0.00 39.48 39.30 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 -2.54 0.00 -2.18 1.38 4.02 0.20 -4.32 117.16 113.71 2e7n n TYR 37 Ca -0.24 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.26 2e7n n TYR 37 Cb 0.96 -0.42 -0.02 0.00 -0.02 0.00 0.00 39.34 39.84 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 -2.85 4.18 0.70 -0.72 1.02 -1.24 -4.66 119.74 116.16 2e7n s LYS 38 Ca 0.00 2.05 -0.13 0.00 0.02 0.00 0.00 55.97 57.91 2e7n s LYS 38 Cb 0.00 -2.88 0.02 0.00 -0.52 0.00 0.00 37.83 34.45 2e7n s LYS 38 CO 0.00 -0.28 1.10 -1.25 -0.92 0.00 0.00 175.35 174.01 2e7n s PRO 39 N -2.04 2.62 -0.19 -1.68 0.04 -1.26 -5.02 135.00 127.48 2e7n s PRO 39 Ca 0.53 1.32 -0.16 0.00 0.04 0.00 0.00 61.00 62.73 2e7n s PRO 39 Cb -0.36 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.21 2e7n s PRO 39 CO 0.47 -1.38 0.39 0.54 0.04 0.00 0.00 177.00 177.05 2e7n s VAL 40 N -2.53 5.22 -0.24 -0.36 0.11 -1.26 -5.05 120.40 116.29 2e7n s VAL 40 Ca 0.65 0.70 -0.01 0.00 -2.93 0.00 0.00 61.98 60.38 2e7n s VAL 40 Cb -0.19 -3.72 0.07 0.00 -1.53 0.00 0.00 36.38 31.01 2e7n s VAL 40 CO 0.46 0.28 0.03 -0.62 -3.33 0.00 0.00 175.10 171.92 2e7n s ASP 41 N 0.93 3.50 0.31 3.54 -1.08 -1.26 -5.00 116.67 117.61 2e7n s ASP 41 Ca 0.19 -1.17 -0.01 0.00 -0.52 0.00 0.00 52.55 51.04 2e7n s ASP 41 Cb -0.14 -0.83 0.48 0.00 -1.46 0.00 0.00 42.92 40.96 2e7n s ASP 41 CO 0.07 -0.32 1.98 0.00 0.52 0.00 0.00 175.17 177.42 2e7n h ALA 42 N 8.12 1.44 0.24 3.66 0.00 -1.90 -1.19 119.26 129.62 2e7n h ALA 42 Ca -0.16 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 2e7n h ALA 42 Cb 1.08 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2e7n h ALA 42 CO 0.40 0.52 -0.12 0.93 0.00 0.00 0.00 179.25 180.98 2e7n h GLU 43 N 1.06 -0.32 -0.43 0.00 5.08 -1.94 -3.32 114.58 114.72 2e7n h GLU 43 Ca 0.29 0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.72 2e7n h GLU 43 Cb -0.12 0.07 -0.08 0.00 0.50 0.00 0.00 28.75 29.12 2e7n h GLU 43 CO -0.06 -0.21 -0.55 0.00 -1.00 0.00 0.00 179.01 177.19 2e7n h ALA 44 N -1.41 -0.77 -2.33 3.43 0.00 -1.98 -3.41 119.26 112.78 2e7n h ALA 44 Ca -0.03 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.37 2e7n h ALA 44 Cb 0.25 1.13 0.08 0.00 0.00 0.00 0.00 17.79 19.26 2e7n h ALA 44 CO 0.05 -1.04 0.37 -0.51 0.00 0.00 0.00 179.25 178.13 2e7n s LEU 45 N -10.26 3.26 -1.29 0.00 1.43 -0.45 -4.94 118.68 106.43 2e7n s LEU 45 Ca -0.14 1.66 -0.17 0.00 -1.03 0.00 0.00 54.13 54.45 2e7n s LEU 45 Cb 0.08 -4.50 0.09 0.00 0.03 0.00 0.00 46.19 41.89 2e7n s LEU 45 CO 0.60 -1.30 1.70 -0.62 0.23 0.00 0.00 176.35 176.97 2e7n n GLU 46 N -2.74 3.22 -3.76 1.70 1.02 -1.26 -4.74 120.64 114.08 2e7n n GLU 46 Ca 0.08 -3.37 -0.29 0.00 -0.02 0.00 0.00 57.16 53.56 2e7n n GLU 46 Cb 0.53 -3.39 -0.16 0.00 -0.02 0.00 0.00 31.44 28.40 2e7n n GLU 46 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2e7n s LEU 47 N 3.57 1.96 0.26 -4.62 1.43 -1.25 -5.00 118.68 115.03 2e7n s LEU 47 Ca 0.51 -1.33 0.12 0.00 -1.03 0.00 0.00 54.13 52.40 2e7n s LEU 47 Cb 0.03 -0.82 0.87 0.00 0.03 0.00 0.00 46.19 46.30 2e7n s LEU 47 CO 0.06 -0.36 1.15 1.41 0.23 0.00 0.00 176.35 178.83 2e7n n HIS 48 N 4.89 0.75 -3.64 0.29 8.25 -1.26 -4.36 115.22 120.13 2e7n n HIS 48 Ca -0.05 0.86 -0.03 0.00 -0.26 0.00 0.00 57.72 58.23 2e7n n HIS 48 Cb 0.44 -1.22 -0.07 0.00 1.12 0.00 0.00 29.99 30.26 2e7n n HIS 48 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2e7n s ASP 49 N -4.74 -0.56 -0.15 0.41 1.01 -1.26 -5.08 116.67 106.30 2e7n s ASP 49 Ca -0.07 0.91 -0.10 0.00 0.71 0.00 0.00 52.55 54.00 2e7n s ASP 49 Cb 0.24 1.21 -0.07 0.00 1.01 0.00 0.00 42.92 45.31 2e7n s ASP 49 CO 0.57 -0.14 -0.23 0.00 0.21 0.00 0.00 175.17 175.57 2e7n n TYR 50 N 3.69 0.00 -0.04 4.23 9.36 -1.26 -4.64 117.16 128.49 2e7n n TYR 50 Ca -0.18 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 60.95 2e7n n TYR 50 Cb 0.58 -0.55 -0.03 0.00 -0.63 0.00 0.00 39.34 38.71 2e7n n TYR 50 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2e7n h HIS 51 N -0.65 0.05 -1.39 2.98 3.86 -1.98 -0.81 115.15 117.21 2e7n h HIS 51 Ca -0.32 0.01 0.46 0.00 -1.16 0.00 0.00 60.37 59.36 2e7n h HIS 51 Cb 1.18 0.01 -0.12 0.00 1.06 0.00 0.00 27.41 29.53 2e7n h HIS 51 CO -0.13 0.01 0.91 -0.25 0.86 0.00 0.00 177.93 179.34 2e7n n ASP 52 N -5.10 0.17 -0.10 2.45 8.00 -1.26 -0.40 116.55 120.31 2e7n n ASP 52 Ca -0.03 1.24 -0.23 0.00 0.71 0.00 0.00 54.79 56.48 2e7n n ASP 52 Cb 0.09 -0.61 -0.12 0.00 -0.02 0.00 0.00 41.12 40.47 2e7n n ASP 52 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2e7n n ILE 53 N -4.46 1.56 -3.39 0.53 5.41 -0.76 -4.86 119.36 113.38 2e7n n ILE 53 Ca 0.39 -0.16 -0.39 0.00 1.00 0.00 0.00 62.75 63.59 2e7n n ILE 53 Cb 1.54 -1.97 -0.09 0.00 -0.71 0.00 0.00 39.64 38.41 2e7n n ILE 53 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2e7n s ILE 54 N -2.41 5.18 -0.12 1.39 -1.09 0.47 -4.94 121.20 119.67 2e7n s ILE 54 Ca -0.30 0.60 -0.12 0.00 -2.23 0.00 0.00 60.65 58.60 2e7n s ILE 54 Cb 0.08 -3.70 -0.11 0.00 -1.58 0.00 0.00 42.46 37.15 2e7n s ILE 54 CO 0.59 0.19 0.28 0.11 -1.23 0.00 0.00 174.94 174.88 2e7n h LYS 55 N 7.94 0.00 -3.37 2.79 1.79 -1.89 -3.39 116.57 120.43 2e7n h LYS 55 Ca -0.33 0.00 -0.69 0.00 -2.18 0.00 0.00 60.65 57.45 2e7n h LYS 55 Cb 1.16 0.00 -0.36 0.00 -1.58 0.00 0.00 32.23 31.45 2e7n h LYS 55 CO 0.67 0.42 -0.27 -3.38 -1.08 0.00 0.00 179.45 175.80 2e7n s HIS 56 N -1.88 3.65 0.15 -1.35 -3.43 -1.26 -5.07 115.29 106.09 2e7n s HIS 56 Ca -0.09 -2.97 -0.31 0.00 -0.80 0.00 0.00 55.06 50.89 2e7n s HIS 56 Cb -0.01 -3.14 -0.08 0.00 -1.43 0.00 0.00 32.58 27.92 2e7n s HIS 56 CO 0.30 -0.75 1.34 -1.25 -2.00 0.00 0.00 174.74 172.38 2e7n s PRO 57 N -0.88 4.36 0.18 -0.38 0.04 -1.26 -4.90 135.00 132.16 2e7n s PRO 57 Ca 0.23 2.04 0.02 0.00 0.04 0.00 0.00 61.00 63.33 2e7n s PRO 57 Cb -0.12 -3.23 -0.05 0.00 0.04 0.00 0.00 34.50 31.14 2e7n s PRO 57 CO -0.09 -0.34 -0.01 1.41 0.04 0.00 0.00 177.00 178.00 2e7n s MET 58 N 0.58 1.14 0.30 4.56 1.75 -1.26 -5.07 119.30 121.30 2e7n s MET 58 Ca 0.61 -1.55 -0.19 0.00 -1.25 0.00 0.00 55.69 53.31 2e7n s MET 58 Cb -0.36 -0.37 0.03 0.00 2.84 0.00 0.00 34.83 36.97 2e7n s MET 58 CO 0.33 -0.10 0.72 0.16 -0.65 0.00 0.00 175.02 175.48 2e7n s ASP 59 N -3.20 -0.18 0.27 1.11 1.47 -1.26 -4.79 116.67 110.10 2e7n s ASP 59 Ca 0.24 -0.76 0.02 0.00 1.18 0.00 0.00 52.55 53.23 2e7n s ASP 59 Cb 0.06 0.75 0.38 0.00 -0.34 0.00 0.00 42.92 43.76 2e7n s ASP 59 CO 0.04 -1.41 1.70 -0.07 0.68 0.00 0.00 175.17 176.11 2e7n h LEU 60 N 2.02 0.50 -1.77 2.11 3.38 -1.89 -2.74 115.31 116.92 2e7n h LEU 60 Ca -0.22 -0.18 0.18 0.00 0.09 0.00 0.00 57.88 57.74 2e7n h LEU 60 Cb 1.25 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.82 2e7n h LEU 60 CO 0.28 0.76 0.50 0.77 0.09 0.00 0.00 178.44 180.84 2e7n h SER 61 N 0.43 0.20 0.00 -0.43 4.64 -1.83 -2.55 113.55 114.01 2e7n h SER 61 Ca 0.06 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2e7n h SER 61 Cb 0.71 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 2e7n h SER 61 CO 0.05 0.10 -0.09 0.74 -0.87 0.00 0.00 176.83 176.76 2e7n h THR 62 N 0.21 0.00 -1.45 2.95 2.02 -1.91 -2.94 112.91 111.80 2e7n h THR 62 Ca 0.35 -0.84 0.44 0.00 0.77 0.00 0.00 66.41 67.14 2e7n h THR 62 Cb 1.08 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.41 2e7n h THR 62 CO -0.07 0.00 1.01 0.52 0.37 0.00 0.00 175.52 177.35 2e7n n VAL 63 N -4.31 -0.06 0.02 3.16 0.31 -1.10 0.21 118.33 116.56 2e7n n VAL 63 Ca -0.01 1.28 -0.21 0.00 -0.01 0.00 0.00 64.34 65.39 2e7n n VAL 63 Cb 0.05 -2.12 -0.14 0.00 -0.91 0.00 0.00 33.84 30.71 2e7n n VAL 63 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2e7n h LYS 64 N 0.00 0.26 -0.29 5.55 3.64 -1.58 -2.75 116.57 121.40 2e7n h LYS 64 Ca 0.74 -0.45 -0.01 0.00 -1.27 0.00 0.00 60.65 59.66 2e7n h LYS 64 Cb 2.81 0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 34.79 2e7n h LYS 64 CO -0.13 1.22 0.14 0.07 -2.27 0.00 0.00 179.45 178.48 2e7n h ARG 65 N -0.34 0.40 0.07 1.90 0.11 0.27 0.31 114.38 117.11 2e7n h ARG 65 Ca -0.24 -0.04 -0.00 0.00 0.10 0.00 0.00 59.98 59.79 2e7n h ARG 65 Cb 1.71 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 32.71 2e7n h ARG 65 CO 0.09 0.32 -0.04 0.87 0.10 0.00 0.00 179.97 181.31 2e7n h LYS 66 N 0.40 -0.09 -0.95 0.08 1.57 -0.88 -3.06 116.57 113.64 2e7n h LYS 66 Ca 0.10 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.90 2e7n h LYS 66 Cb 0.05 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.33 2e7n h LYS 66 CO -0.01 0.39 0.63 1.98 -0.57 0.00 0.00 179.45 181.86 2e7n h MET 67 N -0.94 1.24 -0.58 3.15 4.05 -1.38 0.21 114.93 120.68 2e7n h MET 67 Ca -0.01 -0.07 0.04 0.00 -0.28 0.00 0.00 59.70 59.38 2e7n h MET 67 Cb 0.53 -0.28 -0.05 0.00 -0.80 0.00 0.00 31.60 31.00 2e7n h MET 67 CO 0.02 0.82 0.32 -0.44 0.23 0.00 0.00 176.91 177.86 2e7n h ASP 68 N 1.28 0.49 -0.42 1.39 5.19 -0.48 -1.34 116.42 122.52 2e7n h ASP 68 Ca 0.35 0.02 -0.15 0.00 -0.62 0.00 0.00 57.03 56.63 2e7n h ASP 68 Cb -0.12 -0.08 -0.09 0.00 0.18 0.00 0.00 39.33 39.22 2e7n h ASP 68 CO -0.08 0.33 0.19 0.61 -3.12 0.00 0.00 179.24 177.17 2e7n n GLY 69 N -1.26 2.85 4.17 2.75 0.00 -0.92 -4.88 105.19 107.90 2e7n n GLY 69 Ca 0.06 -0.53 -0.31 0.00 0.00 0.00 0.00 46.02 45.25 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 -0.06 -2.36 0.05 1.61 5.12 -0.51 -4.85 116.66 115.67 2e7n n ARG 70 Ca 0.24 0.28 -0.16 0.00 -1.93 0.00 0.00 57.85 56.28 2e7n n ARG 70 Cb 0.95 -4.39 -0.14 0.00 -1.16 0.00 0.00 32.46 27.72 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 -1.67 0.22 -6.60 5.56 5.08 -0.80 -3.46 114.58 112.92 2e7n h GLU 71 Ca -0.63 -0.38 -0.52 0.00 -1.00 0.00 0.00 59.36 56.83 2e7n h GLU 71 Cb 1.39 0.14 0.04 0.00 0.50 0.00 0.00 28.75 30.82 2e7n h GLU 71 CO 0.71 1.07 0.93 0.71 -1.00 0.00 0.00 179.01 181.42 2e7n s TYR 72 N -2.61 2.94 0.10 4.33 2.02 -1.26 -4.92 117.35 117.95 2e7n s TYR 72 Ca -0.09 0.52 -0.15 0.00 -0.37 0.00 0.00 57.07 56.97 2e7n s TYR 72 Cb 0.07 -3.99 -0.09 0.00 -0.40 0.00 0.00 41.96 37.56 2e7n s TYR 72 CO 0.84 -3.70 1.42 -1.00 -1.57 0.00 0.00 175.55 171.54 2e7n h PRO 73 N 6.99 0.68 -2.85 -1.71 0.13 -1.94 -3.49 132.00 129.82 2e7n h PRO 73 Ca -0.43 -0.36 0.04 0.00 -0.87 0.00 0.00 66.00 64.38 2e7n h PRO 73 Cb 1.20 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2e7n h PRO 73 CO 0.93 0.97 0.39 0.16 -0.23 0.00 0.00 178.00 180.21 2e7n s ASP 74 N -6.52 0.02 0.42 1.44 1.47 -1.26 -4.72 116.67 107.52 2e7n s ASP 74 Ca -0.12 -1.02 0.22 0.00 1.18 0.00 0.00 52.55 52.81 2e7n s ASP 74 Cb 0.08 0.74 1.21 0.00 -0.34 0.00 0.00 42.92 44.61 2e7n s ASP 74 CO 0.82 -1.47 1.74 0.00 0.68 0.00 0.00 175.17 176.94 2e7n h ALA 75 N 2.00 2.41 0.17 2.11 0.00 -1.89 0.40 119.26 124.47 2e7n h ALA 75 Ca -0.31 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2e7n h ALA 75 Cb 1.24 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2e7n h ALA 75 CO 0.40 -0.86 -0.08 1.96 0.00 0.00 0.00 179.25 180.67 2e7n h GLN 76 N 0.29 -0.22 -0.64 0.00 1.08 -1.95 -1.34 115.11 112.32 2e7n h GLN 76 Ca 0.64 0.02 0.07 0.00 -1.45 0.00 0.00 58.65 57.93 2e7n h GLN 76 Cb 1.80 0.05 -0.06 0.00 -0.05 0.00 0.00 27.48 29.22 2e7n h GLN 76 CO -0.30 -0.13 0.32 0.78 -0.95 0.00 0.00 178.83 178.55 2e7n h GLY 77 N -0.25 0.94 0.95 3.46 0.00 -1.31 0.19 103.07 107.04 2e7n h GLY 77 Ca -0.02 -0.21 -0.02 0.00 0.00 0.00 0.00 47.33 47.08 2e7n h GLY 77 CO 0.04 0.08 -0.20 -2.75 0.00 0.00 0.00 176.54 173.71 2e7n h PHE 78 N 0.57 -0.53 0.06 5.60 3.57 -1.29 -3.04 116.94 121.88 2e7n h PHE 78 Ca 0.31 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.80 2e7n h PHE 78 Cb 0.28 0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 2e7n h PHE 78 CO -0.11 -0.30 -0.11 0.00 -2.23 0.00 0.00 178.31 175.57 2e7n h ALA 79 N -0.08 -0.17 -0.90 2.41 0.00 -0.97 -2.59 119.26 116.95 2e7n h ALA 79 Ca -0.06 -0.01 0.16 0.00 0.00 0.00 0.00 54.91 55.00 2e7n h ALA 79 Cb 0.47 0.17 -0.16 0.00 0.00 0.00 0.00 17.79 18.27 2e7n h ALA 79 CO 0.10 -0.62 -0.28 0.00 0.00 0.00 0.00 179.25 178.45 2e7n n ALA 80 N -2.33 0.08 0.44 0.00 0.00 0.64 -0.96 120.51 118.37 2e7n n ALA 80 Ca -0.06 0.95 -0.18 0.00 0.00 0.00 0.00 53.44 54.15 2e7n n ALA 80 Cb 0.15 -0.51 -0.08 0.00 0.00 0.00 0.00 19.45 19.00 2e7n n ALA 80 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2e7n h ASP 81 N 0.00 -0.96 -0.91 0.00 5.19 -1.39 -1.48 116.42 116.88 2e7n h ASP 81 Ca 0.38 0.03 0.08 0.00 -0.62 0.00 0.00 57.03 56.90 2e7n h ASP 81 Cb 0.61 0.25 -0.11 0.00 0.18 0.00 0.00 39.33 40.26 2e7n h ASP 81 CO -0.92 -0.60 -0.54 0.52 -3.12 0.00 0.00 179.24 174.58 2e7n n VAL 82 N -5.53 -0.62 -0.32 -1.35 0.31 -0.13 0.44 118.33 111.13 2e7n n VAL 82 Ca -0.14 2.26 0.01 0.00 -0.01 0.00 0.00 64.34 66.46 2e7n n VAL 82 Cb 0.45 -2.80 0.15 0.00 -0.91 0.00 0.00 33.84 30.72 2e7n n VAL 82 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 2e7n h ARG 83 N 0.00 1.00 0.11 5.55 3.08 -1.18 -2.62 114.38 120.31 2e7n h ARG 83 Ca 0.15 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.15 2e7n h ARG 83 Cb 0.37 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 2e7n h ARG 83 CO -0.85 0.66 -0.19 1.25 -1.07 0.00 0.00 179.97 179.77 2e7n h LEU 84 N 1.03 -0.53 -0.77 3.04 7.12 0.11 -1.71 115.31 123.60 2e7n h LEU 84 Ca 0.39 0.06 0.14 0.00 0.13 0.00 0.00 57.88 58.60 2e7n h LEU 84 Cb 0.16 0.20 -0.14 0.00 -0.53 0.00 0.00 40.66 40.35 2e7n h LEU 84 CO -0.17 -0.27 -0.27 -0.03 -0.13 0.00 0.00 178.44 177.57 2e7n h MET 85 N -0.37 -0.05 0.56 1.25 4.05 -0.29 -1.08 114.93 119.00 2e7n h MET 85 Ca 0.03 0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 59.42 2e7n h MET 85 Cb 0.39 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.20 2e7n h MET 85 CO -0.10 -0.03 -0.28 0.74 0.23 0.00 0.00 176.91 177.46 2e7n h PHE 86 N -0.05 -0.74 -0.82 1.39 0.04 -1.39 -2.65 116.94 112.72 2e7n h PHE 86 Ca 0.33 -0.02 0.33 0.00 2.80 0.00 0.00 57.97 61.42 2e7n h PHE 86 Cb 0.58 0.25 -0.15 0.00 2.20 0.00 0.00 35.95 38.83 2e7n h PHE 86 CO -0.67 -0.45 0.37 0.43 -0.60 0.00 0.00 178.31 177.39 2e7n n SER 87 N -5.43 0.23 -0.04 2.17 7.64 -0.44 0.17 113.62 117.91 2e7n n SER 87 Ca -0.12 1.37 -0.12 0.00 1.01 0.00 0.00 58.87 61.00 2e7n n SER 87 Cb 0.32 -0.64 -0.07 0.00 -1.01 0.00 0.00 64.21 62.81 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 0.25 -0.43 6.43 2.35 -1.11 -1.56 115.58 121.51 2e7n h ASN 88 Ca 0.67 -0.39 0.05 0.00 -0.55 0.00 0.00 56.30 56.08 2e7n h ASN 88 Cb 1.71 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 39.99 2e7n h ASN 88 CO -0.65 0.59 0.29 0.00 -1.65 0.00 0.00 177.43 176.00 2e7n n TYR 90 N -4.48 0.00 -0.06 0.00 4.01 -0.20 -3.83 117.16 112.61 2e7n n TYR 90 Ca 0.05 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.73 2e7n n TYR 90 Cb 0.24 -0.19 -0.02 0.00 -0.31 0.00 0.00 39.34 39.05 2e7n n TYR 90 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 2e7n n LYS 91 N -0.98 0.36 -0.08 -0.72 0.00 0.49 -4.73 118.16 112.49 2e7n n LYS 91 Ca 0.11 0.14 -0.05 0.00 0.00 0.00 0.00 58.31 58.52 2e7n n LYS 91 Cb 0.32 -1.12 -0.04 0.00 0.00 0.00 0.00 35.03 34.20 2e7n n LYS 91 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.40 176.48 2e7n h TYR 92 N -0.67 -0.65 -4.07 5.64 3.20 -0.63 -3.41 116.97 116.38 2e7n h TYR 92 Ca 0.00 0.04 -0.48 0.00 3.14 0.00 0.00 58.73 61.43 2e7n h TYR 92 Cb 0.67 0.31 0.01 0.00 1.54 0.00 0.00 36.73 39.27 2e7n h TYR 92 CO -0.29 -0.17 0.31 0.54 -1.64 0.00 0.00 178.16 176.91 2e7n s ASN 93 N -3.67 6.62 0.95 -2.11 2.20 -1.25 -5.06 114.94 112.62 2e7n s ASN 93 Ca -0.05 1.48 -0.12 0.00 -0.94 0.00 0.00 52.86 53.23 2e7n s ASN 93 Cb 0.03 -2.47 0.16 0.00 -2.00 0.00 0.00 41.25 36.97 2e7n s ASN 93 CO 0.23 -0.53 1.09 -2.16 -2.94 0.00 0.00 177.10 172.79 2e7n s PRO 94 N -3.95 0.85 0.00 3.55 0.04 -1.26 -4.71 135.00 129.52 2e7n s PRO 94 Ca 0.57 0.68 0.15 0.00 0.04 0.00 0.00 61.00 62.44 2e7n s PRO 94 Cb -0.10 -1.77 0.75 0.00 0.04 0.00 0.00 34.50 33.42 2e7n s PRO 94 CO 0.30 -2.48 1.40 -0.35 0.04 0.00 0.00 177.00 175.91 2e7n n PRO 95 N -4.03 0.23 -0.05 0.56 -0.04 -1.26 -2.35 135.00 128.06 2e7n n PRO 95 Ca 0.06 0.14 -0.09 0.00 -0.04 0.00 0.00 63.50 63.57 2e7n n PRO 95 Cb 0.56 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.37 2e7n n PRO 95 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2e7n n ASP 96 N -1.27 0.58 -4.65 3.54 -0.08 -1.26 -4.94 116.55 108.48 2e7n n ASP 96 Ca 0.07 0.26 -0.57 0.00 -1.51 0.00 0.00 54.79 53.05 2e7n n ASP 96 Cb 0.11 0.30 -0.07 0.00 2.34 0.00 0.00 41.12 43.80 2e7n n ASP 96 CO 0.00 0.00 0.00 1.57 0.12 0.00 0.00 177.20 178.89 2e7n n HIS 97 N -2.95 1.67 -0.28 -0.67 -0.00 -0.99 -4.83 115.22 107.18 2e7n n HIS 97 Ca -0.23 0.69 0.03 0.00 0.46 0.00 0.00 57.72 58.67 2e7n n HIS 97 Cb 1.09 -2.35 0.17 0.00 -0.12 0.00 0.00 29.99 28.78 2e7n n HIS 97 CO 0.00 0.00 0.00 1.05 0.46 0.00 0.00 176.34 177.85 2e7n h GLU 98 N 5.55 0.67 -0.82 1.57 4.11 -1.92 0.29 114.58 124.03 2e7n h GLU 98 Ca -0.47 -0.04 0.24 0.00 0.07 0.00 0.00 59.36 59.16 2e7n h GLU 98 Cb 1.34 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 30.41 2e7n h GLU 98 CO 0.86 0.44 0.66 -0.24 0.07 0.00 0.00 179.01 180.80 2e7n h VAL 99 N 0.69 0.44 -0.73 -1.06 3.04 -1.96 0.15 116.25 116.82 2e7n h VAL 99 Ca 0.40 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 66.08 2e7n h VAL 99 Cb 0.43 0.52 -0.04 0.00 -2.01 0.00 0.00 31.29 30.19 2e7n h VAL 99 CO -0.28 0.00 0.42 0.58 -1.01 0.00 0.00 177.57 177.28 2e7n h VAL 100 N 0.00 1.22 -0.22 1.51 2.07 -1.25 -1.07 116.25 118.50 2e7n h VAL 100 Ca 0.39 -0.51 -0.08 0.00 0.82 0.00 0.00 66.70 67.32 2e7n h VAL 100 Cb 1.71 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 2e7n h VAL 100 CO -0.00 0.23 -0.21 0.00 0.02 0.00 0.00 177.57 177.61 2e7n h ALA 101 N 1.22 1.23 -0.13 1.67 0.00 -0.80 -2.97 119.26 119.48 2e7n h ALA 101 Ca 0.26 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 2e7n h ALA 101 Cb -0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 2e7n h ALA 101 CO -0.05 0.50 -0.14 0.52 0.00 0.00 0.00 179.25 180.08 2e7n h MET 102 N 0.36 0.33 -0.84 0.00 2.86 -1.30 -3.07 114.93 113.27 2e7n h MET 102 Ca 0.06 -0.18 0.16 0.00 -2.06 0.00 0.00 59.70 57.68 2e7n h MET 102 Cb 0.57 0.01 -0.06 0.00 0.06 0.00 0.00 31.60 32.18 2e7n h MET 102 CO 0.04 0.73 0.55 0.00 1.06 0.00 0.00 176.91 179.29 2e7n h ALA 103 N 0.59 2.06 0.57 6.32 0.00 -1.11 -2.35 119.26 125.34 2e7n h ALA 103 Ca 0.02 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2e7n h ALA 103 Cb 0.68 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.40 2e7n h ALA 103 CO 0.03 -0.30 -0.27 0.00 0.00 0.00 0.00 179.25 178.71 2e7n h ARG 104 N 0.49 -0.74 -0.78 0.00 3.08 -1.45 -2.88 114.38 112.11 2e7n h ARG 104 Ca 0.42 0.05 0.18 0.00 0.07 0.00 0.00 59.98 60.70 2e7n h ARG 104 Cb 0.90 0.17 -0.15 0.00 0.08 0.00 0.00 29.97 30.97 2e7n h ARG 104 CO -0.16 -0.43 -0.10 1.63 -1.07 0.00 0.00 179.97 179.84 2e7n n LYS 105 N -5.34 -0.07 0.28 0.04 5.02 -0.89 0.41 118.16 117.61 2e7n n LYS 105 Ca -0.12 1.20 -0.16 0.00 -2.02 0.00 0.00 58.31 57.21 2e7n n LYS 105 Cb 0.34 -1.84 -0.08 0.00 -0.02 0.00 0.00 35.03 33.42 2e7n n LYS 105 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2e7n h LEU 106 N 0.00 -0.57 -0.99 -0.35 5.85 -1.51 -2.86 115.31 114.87 2e7n h LEU 106 Ca 0.42 -0.02 0.20 0.00 0.84 0.00 0.00 57.88 59.32 2e7n h LEU 106 Cb 0.75 0.15 -0.11 0.00 0.37 0.00 0.00 40.66 41.82 2e7n h LEU 106 CO -0.77 -0.35 0.59 -0.61 -0.34 0.00 0.00 178.44 176.96 2e7n h GLN 107 N -0.77 0.70 -0.79 1.25 -0.00 0.18 0.50 115.11 116.17 2e7n h GLN 107 Ca -0.07 -0.04 0.14 0.00 -0.00 0.00 0.00 58.65 58.67 2e7n h GLN 107 Cb 0.56 -0.16 -0.09 0.00 0.00 0.00 0.00 27.48 27.79 2e7n h GLN 107 CO 0.11 0.46 0.38 -0.44 0.00 0.00 0.00 178.83 179.34 2e7n h ASP 108 N 0.72 0.44 0.20 -0.69 3.32 -0.60 0.11 116.42 119.92 2e7n h ASP 108 Ca 0.58 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.72 2e7n h ASP 108 Cb 0.94 0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.53 2e7n h ASP 108 CO -0.40 0.19 -0.10 0.58 -1.72 0.00 0.00 179.24 177.79 2e7n h VAL 109 N 0.56 0.76 -1.00 -1.35 2.07 -0.85 -3.20 116.25 113.24 2e7n h VAL 109 Ca 0.43 -0.99 0.23 0.00 0.82 0.00 0.00 66.70 67.19 2e7n h VAL 109 Cb 0.59 1.24 -0.09 0.00 -1.52 0.00 0.00 31.29 31.51 2e7n h VAL 109 CO -0.36 0.18 0.63 0.15 0.02 0.00 0.00 177.57 178.20 2e7n h PHE 110 N -0.86 0.77 0.48 1.57 3.04 -1.02 -0.71 116.94 120.20 2e7n h PHE 110 Ca -0.03 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 2e7n h PHE 110 Cb 0.51 -0.23 -0.02 0.00 2.56 0.00 0.00 35.95 38.78 2e7n h PHE 110 CO 0.07 0.12 -0.43 0.93 -2.02 0.00 0.00 178.31 176.98 2e7n h GLU 111 N 0.50 -0.87 -0.66 1.11 4.39 -0.80 -0.44 114.58 117.81 2e7n h GLU 111 Ca 0.57 0.06 -0.01 0.00 0.34 0.00 0.00 59.36 60.32 2e7n h GLU 111 Cb 1.27 0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 30.08 2e7n h GLU 111 CO -0.31 -0.58 0.38 0.00 -1.16 0.00 0.00 179.01 177.34 2e7n h MET 112 N -0.90 0.90 -0.84 2.33 -0.00 -1.30 -2.10 114.93 113.00 2e7n h MET 112 Ca -0.05 -0.08 0.00 0.00 -0.00 0.00 0.00 59.70 59.57 2e7n h MET 112 Cb 0.78 -0.19 -0.04 0.00 -0.00 0.00 0.00 31.60 32.15 2e7n h MET 112 CO -0.03 0.64 0.54 0.00 -0.00 0.00 0.00 176.91 178.06 2e7n h ARG 113 N 0.91 1.12 0.42 -0.10 2.47 -0.73 0.22 114.38 118.70 2e7n h ARG 113 Ca 0.24 -0.08 -0.02 0.00 -1.26 0.00 0.00 59.98 58.86 2e7n h ARG 113 Cb -0.01 -0.25 0.00 0.00 -1.65 0.00 0.00 29.97 28.06 2e7n h ARG 113 CO -0.04 0.76 -0.20 0.35 0.56 0.00 0.00 179.97 181.40 2e7n h PHE 114 N 1.15 -0.53 -0.28 3.04 3.57 -0.41 -3.15 116.94 120.34 2e7n h PHE 114 Ca 0.31 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.79 2e7n h PHE 114 Cb -0.10 0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 2e7n h PHE 114 CO 0.00 -0.21 0.18 0.00 -2.23 0.00 0.00 178.31 176.05 2e7n h ALA 115 N -0.42 0.36 -0.99 2.41 0.00 -1.35 -2.64 119.26 116.63 2e7n h ALA 115 Ca -0.06 -0.03 0.35 0.00 0.00 0.00 0.00 54.91 55.17 2e7n h ALA 115 Cb 0.55 -0.11 -0.17 0.00 0.00 0.00 0.00 17.79 18.06 2e7n h ALA 115 CO 0.10 -0.16 0.39 0.87 0.00 0.00 0.00 179.25 180.45 2e7n h LYS 116 N 0.37 0.06 0.00 0.00 1.79 -0.60 -3.52 116.57 114.68 2e7n h LYS 116 Ca 0.10 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.57 2e7n h LYS 116 Cb -0.01 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.62 2e7n h LYS 116 CO -0.02 0.04 0.00 -0.12 -1.08 0.00 0.00 179.45 178.27