#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e5l s LYS 3 N 0.00 4.20 0.37 -0.52 1.02 -1.26 -4.93 119.74 118.63 2e5l s LYS 3 Ca 0.00 2.35 -0.28 0.00 0.02 0.00 0.00 55.97 58.06 2e5l s LYS 3 Cb 0.00 -3.42 -0.11 0.00 -0.52 0.00 0.00 37.83 33.78 2e5l s LYS 3 CO 0.00 -0.68 1.49 1.17 -0.92 0.00 0.00 175.35 176.41 2e5l n LYS 4 N 4.95 2.67 -4.71 1.68 3.00 -1.26 -4.77 118.16 119.72 2e5l n LYS 4 Ca 0.15 0.94 -0.25 0.00 -0.00 0.00 0.00 58.31 59.15 2e5l n LYS 4 Cb 0.40 -2.67 -0.16 0.00 0.00 0.00 0.00 35.03 32.59 2e5l n LYS 4 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2e5l s VAL 5 N -1.07 1.29 0.33 3.15 1.01 -1.26 -1.98 120.40 121.87 2e5l s VAL 5 Ca 0.54 -0.60 0.06 0.00 0.00 0.00 0.00 61.98 61.98 2e5l s VAL 5 Cb -0.48 -1.14 -0.07 0.00 0.00 0.00 0.00 36.38 34.70 2e5l s VAL 5 CO 0.63 0.38 -0.01 -0.76 0.00 0.00 0.00 175.10 175.35 2e5l s LEU 6 N 0.35 2.50 -0.02 3.92 1.43 0.89 -4.87 118.68 122.88 2e5l s LEU 6 Ca -0.10 -1.30 0.03 0.00 -1.03 0.00 0.00 54.13 51.74 2e5l s LEU 6 Cb -0.14 -0.65 -0.00 0.00 0.03 0.00 0.00 46.19 45.44 2e5l s LEU 6 CO 0.03 -0.44 -0.11 -0.89 0.23 0.00 0.00 176.35 175.17 2e5l s THR 7 N -3.00 0.90 0.00 5.49 2.01 -1.26 0.87 115.64 120.64 2e5l s THR 7 Ca 0.33 -0.45 0.00 0.00 0.31 0.00 0.00 61.69 61.89 2e5l s THR 7 Cb 0.07 -0.77 0.00 0.00 0.01 0.00 0.00 72.50 71.80 2e5l s THR 7 CO 0.15 0.27 0.00 0.61 -0.69 0.00 0.00 174.62 174.96 2e5l n GLY 8 N 3.09 1.20 3.31 4.40 0.00 -0.08 -4.36 105.19 112.74 2e5l n GLY 8 Ca -0.16 -0.88 -0.31 0.00 0.00 0.00 0.00 46.02 44.66 2e5l n GLY 8 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2e5l s VAL 9 N -2.47 2.16 -0.20 1.61 1.01 -0.07 -0.24 120.40 122.20 2e5l s VAL 9 Ca 0.00 -1.05 -0.29 0.00 0.00 0.00 0.00 61.98 60.64 2e5l s VAL 9 Cb 0.00 -1.77 -0.02 0.00 0.00 0.00 0.00 36.38 34.59 2e5l s VAL 9 CO 0.00 0.58 1.49 -0.69 0.00 0.00 0.00 175.10 176.47 2e5l s VAL 10 N -0.40 3.88 -0.19 2.92 1.01 -0.85 0.61 120.40 127.39 2e5l s VAL 10 Ca 0.03 1.03 0.10 0.00 0.00 0.00 0.00 61.98 63.14 2e5l s VAL 10 Cb -0.12 -3.81 -0.13 0.00 0.00 0.00 0.00 36.38 32.32 2e5l s VAL 10 CO 0.01 -0.26 0.29 1.33 0.00 0.00 0.00 175.10 176.48 2e5l n VAL 11 N 6.00 0.00 -5.01 2.92 0.24 0.75 -1.81 118.33 121.42 2e5l n VAL 11 Ca 0.17 -0.24 -0.29 0.00 -2.04 0.00 0.00 64.34 61.93 2e5l n VAL 11 Cb 0.45 0.57 -0.17 0.00 -1.47 0.00 0.00 33.84 33.22 2e5l n VAL 11 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2e5l s SER 12 N -2.63 2.59 -0.37 -1.34 0.15 -1.22 -4.96 113.70 105.92 2e5l s SER 12 Ca -0.01 -0.45 0.13 0.00 0.70 0.00 0.00 55.95 56.33 2e5l s SER 12 Cb 0.07 -0.97 0.37 0.00 -1.71 0.00 0.00 66.02 63.78 2e5l s SER 12 CO 0.40 0.15 0.77 -0.67 1.20 0.00 0.00 173.24 175.10 2e5l n ASP 13 N 3.36 1.05 0.00 5.45 4.64 -1.26 -3.14 116.55 126.65 2e5l n ASP 13 Ca -0.19 -2.98 0.00 0.00 -1.38 0.00 0.00 54.79 50.24 2e5l n ASP 13 Cb 0.53 -0.60 0.00 0.00 -1.04 0.00 0.00 41.12 40.00 2e5l n ASP 13 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 2e5l n LYS 14 N 0.20 2.72 -3.32 -0.67 5.02 -1.26 -5.07 118.16 115.78 2e5l n LYS 14 Ca 0.23 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.24 2e5l n LYS 14 Cb 0.68 -0.77 -0.03 0.00 -0.02 0.00 0.00 35.03 34.89 2e5l n LYS 14 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2e5l s MET 15 N -1.48 3.61 -0.26 1.97 -1.94 -1.26 -5.06 119.30 114.88 2e5l s MET 15 Ca 0.00 -0.04 -0.29 0.00 -1.71 0.00 0.00 55.69 53.65 2e5l s MET 15 Cb 0.00 -2.64 0.01 0.00 2.01 0.00 0.00 34.83 34.21 2e5l s MET 15 CO 0.00 0.19 1.11 -0.65 -0.01 0.00 0.00 175.02 175.66 2e5l s GLN 16 N -3.69 4.15 0.00 2.03 -0.21 -1.26 -3.88 119.66 116.80 2e5l s GLN 16 Ca 0.43 1.28 0.00 0.00 0.02 0.00 0.00 55.36 57.10 2e5l s GLN 16 Cb -0.11 -3.72 0.00 0.00 1.00 0.00 0.00 33.01 30.19 2e5l s GLN 16 CO 0.31 -0.79 0.00 1.63 -2.12 0.00 0.00 175.29 174.33 2e5l n LYS 17 N 6.66 0.00 -4.85 2.91 5.02 -1.26 -4.91 118.16 121.73 2e5l n LYS 17 Ca 0.13 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 56.09 2e5l n LYS 17 Cb 0.46 -3.79 -0.13 0.00 -0.02 0.00 0.00 35.03 31.55 2e5l n LYS 17 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2e5l s THR 18 N -0.86 3.11 -0.05 -0.18 2.01 -1.25 -0.14 115.64 118.29 2e5l s THR 18 Ca 0.00 -0.69 0.03 0.00 0.31 0.00 0.00 61.69 61.34 2e5l s THR 18 Cb 0.00 -2.24 0.00 0.00 0.01 0.00 0.00 72.50 70.27 2e5l s THR 18 CO 0.00 0.58 -0.13 0.68 -0.69 0.00 0.00 174.62 175.05 2e5l s VAL 19 N -0.52 1.17 -0.12 3.82 -7.23 -1.23 -4.34 120.40 111.95 2e5l s VAL 19 Ca 0.07 -0.55 -0.28 0.00 -1.81 0.00 0.00 61.98 59.41 2e5l s VAL 19 Cb -0.12 -1.04 -0.01 0.00 0.56 0.00 0.00 36.38 35.77 2e5l s VAL 19 CO 0.02 0.35 0.96 -0.89 -0.31 0.00 0.00 175.10 175.23 2e5l s THR 20 N 0.30 4.81 -0.16 5.32 2.01 -1.19 -0.63 115.64 126.11 2e5l s THR 20 Ca -0.08 1.94 -0.01 0.00 0.31 0.00 0.00 61.69 63.85 2e5l s THR 20 Cb -0.12 -4.27 -0.01 0.00 0.01 0.00 0.00 72.50 68.11 2e5l s THR 20 CO 0.02 0.02 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.17 2e5l s VAL 21 N 1.99 3.04 -0.27 3.82 1.01 -0.01 -0.18 120.40 129.80 2e5l s VAL 21 Ca 0.46 -0.64 -0.26 0.00 0.00 0.00 0.00 61.98 61.53 2e5l s VAL 21 Cb -0.18 -2.31 0.00 0.00 0.00 0.00 0.00 36.38 33.89 2e5l s VAL 21 CO 0.17 0.49 0.93 -0.22 0.00 0.00 0.00 175.10 176.47 2e5l s LEU 22 N 0.82 4.06 -0.29 3.92 2.96 0.20 -1.43 118.68 128.93 2e5l s LEU 22 Ca -0.04 1.06 0.02 0.00 -0.22 0.00 0.00 54.13 54.96 2e5l s LEU 22 Cb -0.15 -3.33 0.07 0.00 0.50 0.00 0.00 46.19 43.28 2e5l s LEU 22 CO 0.01 -0.65 -0.05 -0.69 -1.32 0.00 0.00 176.35 173.65 2e5l s VAL 23 N 3.12 2.34 0.20 1.68 1.01 0.11 -0.89 120.40 127.97 2e5l s VAL 23 Ca 0.39 -1.77 -0.28 0.00 0.00 0.00 0.00 61.98 60.31 2e5l s VAL 23 Cb -0.14 -2.46 -0.08 0.00 0.00 0.00 0.00 36.38 33.69 2e5l s VAL 23 CO 0.09 -0.19 0.87 -0.70 0.00 0.00 0.00 175.10 175.18 2e5l s GLU 24 N 1.08 4.73 -0.01 2.72 2.12 -1.26 -1.25 118.70 126.83 2e5l s GLU 24 Ca -0.04 1.35 0.02 0.00 0.36 0.00 0.00 54.97 56.66 2e5l s GLU 24 Cb -0.20 -3.28 0.00 0.00 0.26 0.00 0.00 34.13 30.92 2e5l s GLU 24 CO -0.05 0.53 -0.06 0.50 -0.54 0.00 0.00 175.26 175.64 2e5l s ARG 25 N -1.12 0.62 0.10 4.30 3.52 -0.73 -4.96 118.95 120.69 2e5l s ARG 25 Ca 0.39 -0.21 0.09 0.00 -0.13 0.00 0.00 55.73 55.87 2e5l s ARG 25 Cb -0.25 -0.61 -0.04 0.00 -1.56 0.00 0.00 34.95 32.49 2e5l s ARG 25 CO 0.29 0.09 -0.20 -0.65 -0.81 0.00 0.00 175.30 174.02 2e5l s GLN 26 N 0.11 1.77 -0.28 5.12 -0.21 -1.26 -1.51 119.66 123.39 2e5l s GLN 26 Ca -0.01 -1.17 -0.29 0.00 0.02 0.00 0.00 55.36 53.91 2e5l s GLN 26 Cb -0.06 -2.08 0.19 0.00 1.00 0.00 0.00 33.01 32.06 2e5l s GLN 26 CO -0.00 0.49 1.35 -0.59 -2.12 0.00 0.00 175.29 174.42 2e5l s PHE 27 N -1.07 -0.05 0.11 0.91 -0.12 -0.37 -5.01 117.98 112.38 2e5l s PHE 27 Ca 0.16 0.10 -0.31 0.00 -0.05 0.00 0.00 56.93 56.83 2e5l s PHE 27 Cb -0.10 0.49 -0.09 0.00 -0.63 0.00 0.00 43.02 42.69 2e5l s PHE 27 CO 0.08 -0.05 1.52 -1.25 -0.05 0.00 0.00 175.22 175.48 2e5l s PRO 28 N -0.89 4.25 0.12 1.99 0.04 -1.26 -1.81 135.00 137.44 2e5l s PRO 28 Ca 0.08 2.24 -0.31 0.00 0.04 0.00 0.00 61.00 63.05 2e5l s PRO 28 Cb -0.01 -3.33 -0.11 0.00 0.04 0.00 0.00 34.50 31.09 2e5l s PRO 28 CO -0.08 -0.59 1.84 1.58 0.04 0.00 0.00 177.00 179.78 2e5l n HIS 29 N 4.51 2.63 0.00 0.56 -0.00 0.18 -4.88 115.22 118.22 2e5l n HIS 29 Ca 0.14 -0.14 0.00 0.00 0.46 0.00 0.00 57.72 58.17 2e5l n HIS 29 Cb 0.40 -2.73 0.00 0.00 -0.12 0.00 0.00 29.99 27.55 2e5l n HIS 29 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 2e5l n PRO 30 N 5.60 0.00 0.00 1.57 -0.04 -1.26 -0.74 135.00 140.13 2e5l n PRO 30 Ca 0.18 0.11 0.00 0.00 -0.04 0.00 0.00 63.50 63.75 2e5l n PRO 30 Cb 0.37 -1.69 0.00 0.00 -0.04 0.00 0.00 33.50 32.14 2e5l n PRO 30 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2e5l n LEU 31 N -0.99 0.00 -0.61 1.53 7.94 -1.26 -4.88 117.00 118.73 2e5l n LEU 31 Ca 0.00 0.00 0.13 0.00 -1.11 0.00 0.00 56.01 55.03 2e5l n LEU 31 Cb 0.19 0.00 0.41 0.00 0.53 0.00 0.00 43.42 44.55 2e5l n LEU 31 CO 0.00 0.00 0.81 -1.22 -1.11 0.00 0.00 177.39 175.87 2e5l n TYR 32 N -1.25 0.02 0.00 1.96 0.53 -1.18 -4.97 117.16 112.27 2e5l n TYR 32 Ca 0.00 -0.01 0.00 0.00 -1.02 0.00 0.00 57.90 56.87 2e5l n TYR 32 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.31 2e5l n TYR 32 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2e5l n GLY 33 N 1.22 0.00 3.82 2.72 0.00 0.08 -4.86 105.19 108.17 2e5l n GLY 33 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 2e5l n GLY 33 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2e5l s LYS 34 N 0.00 3.01 -0.37 1.61 0.00 -1.26 -4.24 119.74 118.49 2e5l s LYS 34 Ca 0.00 0.94 -0.28 0.00 0.00 0.00 0.00 55.97 56.63 2e5l s LYS 34 Cb 0.00 -2.00 0.02 0.00 0.00 0.00 0.00 37.83 35.85 2e5l s LYS 34 CO 0.00 -1.04 1.04 0.08 0.00 0.00 0.00 175.35 175.43 2e5l s VAL 35 N -3.05 4.47 0.13 1.79 1.01 -1.26 -0.64 120.40 122.85 2e5l s VAL 35 Ca 0.58 1.46 -0.04 0.00 0.00 0.00 0.00 61.98 63.98 2e5l s VAL 35 Cb -0.14 -4.43 -0.05 0.00 0.00 0.00 0.00 36.38 31.76 2e5l s VAL 35 CO 0.55 -0.61 0.34 0.27 0.00 0.00 0.00 175.10 175.65 2e5l s ILE 36 N 3.76 5.22 -0.26 2.22 -4.36 -0.75 -4.89 121.20 122.14 2e5l s ILE 36 Ca 0.44 -0.08 0.03 0.00 -0.26 0.00 0.00 60.65 60.77 2e5l s ILE 36 Cb -0.11 -3.63 0.06 0.00 1.25 0.00 0.00 42.46 40.03 2e5l s ILE 36 CO 0.20 0.05 -0.09 -0.75 0.24 0.00 0.00 174.94 174.59 2e5l s LYS 37 N -2.66 2.04 0.27 0.37 2.20 -1.26 -1.24 119.74 119.46 2e5l s LYS 37 Ca 0.40 -1.30 0.03 0.00 -0.36 0.00 0.00 55.97 54.74 2e5l s LYS 37 Cb -0.12 -2.84 0.03 0.00 -1.51 0.00 0.00 37.83 33.39 2e5l s LYS 37 CO 0.26 -0.60 0.24 -2.13 -0.36 0.00 0.00 175.35 172.76 2e5l n ARG 38 N 4.48 1.03 -3.76 4.03 3.00 -0.57 -4.97 116.66 119.89 2e5l n ARG 38 Ca -0.12 -1.64 -0.03 0.00 -0.00 0.00 0.00 57.85 56.06 2e5l n ARG 38 Cb 0.42 0.11 -0.01 0.00 0.00 0.00 0.00 32.46 32.99 2e5l n ARG 38 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 2e5l s SER 39 N -2.62 -0.13 -0.06 6.15 1.04 -1.26 -1.77 113.70 115.06 2e5l s SER 39 Ca 0.18 -0.41 -0.29 0.00 0.48 0.00 0.00 55.95 55.91 2e5l s SER 39 Cb -0.01 0.44 0.07 0.00 0.10 0.00 0.00 66.02 66.61 2e5l s SER 39 CO 0.12 -0.83 0.66 -0.75 0.98 0.00 0.00 173.24 173.41 2e5l s LYS 40 N -2.97 1.02 -0.23 4.02 2.20 -0.38 -4.98 119.74 118.42 2e5l s LYS 40 Ca 0.14 0.27 -0.11 0.00 -0.36 0.00 0.00 55.97 55.91 2e5l s LYS 40 Cb -0.01 0.48 -0.05 0.00 -1.51 0.00 0.00 37.83 36.74 2e5l s LYS 40 CO 0.02 -0.31 0.17 0.15 -0.36 0.00 0.00 175.35 175.02 2e5l s LYS 41 N -1.11 4.10 -0.08 4.03 1.02 -1.25 0.04 119.74 126.49 2e5l s LYS 41 Ca -0.11 -0.23 0.03 0.00 0.02 0.00 0.00 55.97 55.68 2e5l s LYS 41 Cb -0.01 -3.52 -0.02 0.00 -0.52 0.00 0.00 37.83 33.76 2e5l s LYS 41 CO 0.09 0.09 -0.16 0.71 -0.92 0.00 0.00 175.35 175.17 2e5l s TYR 42 N 0.96 2.69 -0.34 3.18 1.51 -0.51 -4.88 117.35 119.96 2e5l s TYR 42 Ca 0.08 -0.40 -0.23 0.00 -1.01 0.00 0.00 57.07 55.51 2e5l s TYR 42 Cb -0.13 -1.69 0.00 0.00 -0.11 0.00 0.00 41.96 40.03 2e5l s TYR 42 CO 0.04 -0.01 0.76 -0.51 -1.11 0.00 0.00 175.55 174.72 2e5l s LEU 43 N -0.29 4.13 0.00 -1.29 1.43 -1.26 -0.83 118.68 120.56 2e5l s LEU 43 Ca 0.02 0.44 -0.00 0.00 -1.03 0.00 0.00 54.13 53.56 2e5l s LEU 43 Cb -0.13 -3.01 0.00 0.00 0.03 0.00 0.00 46.19 43.09 2e5l s LEU 43 CO 0.03 -0.66 0.02 0.00 0.23 0.00 0.00 176.35 175.96 2e5l n ALA 44 N 6.28 -0.01 -3.46 4.21 0.00 0.20 -4.07 120.51 123.66 2e5l n ALA 44 Ca 0.03 -0.03 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 2e5l n ALA 44 Cb 0.48 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.82 2e5l n ALA 44 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2e5l s HIS 45 N -0.52 -0.30 -0.42 0.00 2.46 -0.95 -3.58 115.29 111.98 2e5l s HIS 45 Ca 0.01 -0.01 -0.12 0.00 0.47 0.00 0.00 55.06 55.41 2e5l s HIS 45 Cb -0.00 -0.44 0.05 0.00 -0.13 0.00 0.00 32.58 32.06 2e5l s HIS 45 CO 0.01 -0.74 0.29 0.34 -2.47 0.00 0.00 174.74 172.16 2e5l s ASP 46 N 2.32 5.89 -0.02 9.88 3.68 0.80 -3.64 116.67 135.58 2e5l s ASP 46 Ca 0.08 -1.19 -0.24 0.00 2.13 0.00 0.00 52.55 53.33 2e5l s ASP 46 Cb -0.15 -2.08 -0.18 0.00 -1.45 0.00 0.00 42.92 39.06 2e5l s ASP 46 CO -0.22 -0.50 1.15 -0.65 0.13 0.00 0.00 175.17 175.08 2e5l h PRO 47 N 8.55 -0.18 -0.57 4.34 0.11 -2.00 -3.30 132.00 138.95 2e5l h PRO 47 Ca -0.26 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2e5l h PRO 47 Cb 1.10 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2e5l h PRO 47 CO 0.76 0.24 0.00 0.39 -0.21 0.00 0.00 178.00 179.17 2e5l n GLU 48 N -4.96 1.99 -2.34 1.05 1.02 -1.26 -4.91 120.64 111.23 2e5l n GLU 48 Ca -0.09 -1.00 -0.13 0.00 -0.02 0.00 0.00 57.16 55.92 2e5l n GLU 48 Cb 0.26 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.17 2e5l n GLU 48 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2e5l n GLU 49 N 0.23 -2.09 -0.03 3.49 1.02 -1.24 -4.91 120.64 117.11 2e5l n GLU 49 Ca 0.09 0.65 -0.14 0.00 -0.02 0.00 0.00 57.16 57.74 2e5l n GLU 49 Cb 0.41 -5.22 -0.10 0.00 -0.02 0.00 0.00 31.44 26.50 2e5l n GLU 49 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2e5l h LYS 50 N 0.00 0.09 -6.38 3.49 3.64 -1.90 -3.45 116.57 112.06 2e5l h LYS 50 Ca -0.31 -0.07 -0.54 0.00 -1.27 0.00 0.00 60.65 58.46 2e5l h LYS 50 Cb 1.19 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.03 2e5l h LYS 50 CO 0.37 0.73 0.84 0.71 -2.27 0.00 0.00 179.45 179.83 2e5l s TYR 51 N -3.59 2.83 0.47 1.91 1.51 -1.26 -5.03 117.35 114.19 2e5l s TYR 51 Ca -0.16 0.79 0.06 0.00 -1.01 0.00 0.00 57.07 56.75 2e5l s TYR 51 Cb 0.01 -3.68 -0.01 0.00 -0.11 0.00 0.00 41.96 38.17 2e5l s TYR 51 CO 0.71 -2.54 0.26 0.15 -1.11 0.00 0.00 175.55 173.02 2e5l s LYS 52 N 2.39 2.27 0.34 -0.62 1.02 -1.26 -5.05 119.74 118.83 2e5l s LYS 52 Ca 0.64 -1.93 -0.29 0.00 0.02 0.00 0.00 55.97 54.41 2e5l s LYS 52 Cb -0.32 -2.02 -0.11 0.00 -0.52 0.00 0.00 37.83 34.86 2e5l s LYS 52 CO 0.27 -0.33 1.51 -0.11 -0.92 0.00 0.00 175.35 175.76 2e5l n LEU 53 N -1.47 4.50 -0.19 3.17 7.94 -1.26 -2.65 117.00 127.04 2e5l n LEU 53 Ca -0.03 1.20 -0.02 0.00 -1.11 0.00 0.00 56.01 56.05 2e5l n LEU 53 Cb 0.64 -1.60 -0.01 0.00 0.53 0.00 0.00 43.42 42.99 2e5l n LEU 53 CO 0.42 0.09 -0.02 0.61 -1.11 0.00 0.00 177.39 177.38 2e5l n GLY 54 N 1.09 0.47 3.62 -3.96 0.00 -0.75 -4.86 105.19 100.80 2e5l n GLY 54 Ca 0.04 -0.93 -0.34 0.00 0.00 0.00 0.00 46.02 44.79 2e5l n GLY 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2e5l s ASP 55 N -2.96 4.99 -0.23 1.61 1.01 -1.09 -1.79 116.67 118.22 2e5l s ASP 55 Ca 0.00 0.05 -0.17 0.00 0.71 0.00 0.00 52.55 53.14 2e5l s ASP 55 Cb 0.00 -1.43 -0.03 0.00 1.01 0.00 0.00 42.92 42.46 2e5l s ASP 55 CO 0.00 0.34 0.45 -0.69 0.21 0.00 0.00 175.17 175.47 2e5l s VAL 56 N -0.64 5.14 0.27 -1.27 1.01 -0.60 -2.01 120.40 122.30 2e5l s VAL 56 Ca 0.10 0.77 0.08 0.00 0.00 0.00 0.00 61.98 62.93 2e5l s VAL 56 Cb -0.12 -3.77 -0.06 0.00 0.00 0.00 0.00 36.38 32.44 2e5l s VAL 56 CO 0.02 0.17 -0.10 0.68 0.00 0.00 0.00 175.10 175.87 2e5l s VAL 57 N 1.80 1.86 -0.11 2.92 -7.23 0.66 0.16 120.40 120.45 2e5l s VAL 57 Ca 0.20 -2.19 -0.05 0.00 -1.81 0.00 0.00 61.98 58.12 2e5l s VAL 57 Cb -0.15 -2.36 -0.04 0.00 0.56 0.00 0.00 36.38 34.38 2e5l s VAL 57 CO 0.09 -0.37 0.09 -1.61 -0.31 0.00 0.00 175.10 172.99 2e5l s GLU 58 N -3.66 3.34 0.08 4.82 2.02 -1.11 -0.90 118.70 123.29 2e5l s GLU 58 Ca 0.28 -0.24 0.05 0.00 0.02 0.00 0.00 54.97 55.08 2e5l s GLU 58 Cb 0.01 -3.06 -0.04 0.00 0.10 0.00 0.00 34.13 31.14 2e5l s GLU 58 CO 0.12 0.71 -0.02 0.42 0.02 0.00 0.00 175.26 176.51 2e5l s ILE 59 N -0.85 3.91 -0.03 -1.63 -1.09 0.25 -0.45 121.20 121.31 2e5l s ILE 59 Ca 0.13 -0.98 -0.00 0.00 -2.23 0.00 0.00 60.65 57.57 2e5l s ILE 59 Cb -0.12 -2.84 0.03 0.00 -1.58 0.00 0.00 42.46 37.95 2e5l s ILE 59 CO 0.03 0.16 0.03 -0.51 -1.23 0.00 0.00 174.94 173.42 2e5l s ILE 60 N -1.26 -0.01 -0.01 2.92 -1.16 -0.37 -0.08 121.20 121.24 2e5l s ILE 60 Ca 0.24 0.22 -0.36 0.00 -0.51 0.00 0.00 60.65 60.25 2e5l s ILE 60 Cb -0.12 -0.14 -0.14 0.00 0.61 0.00 0.00 42.46 42.67 2e5l s ILE 60 CO 0.16 0.12 1.64 1.21 -2.81 0.00 0.00 174.94 175.26 2e5l n GLU 61 N 4.39 1.72 -4.12 3.50 2.13 -0.84 -1.49 120.64 125.93 2e5l n GLU 61 Ca -0.23 0.63 -0.21 0.00 0.66 0.00 0.00 57.16 58.00 2e5l n GLU 61 Cb 0.50 -2.37 -0.07 0.00 0.27 0.00 0.00 31.44 29.77 2e5l n GLU 61 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2e5l n SER 62 N 4.47 0.73 -4.74 4.31 7.64 0.93 -4.82 113.62 122.14 2e5l n SER 62 Ca 0.21 -2.96 -0.42 0.00 1.01 0.00 0.00 58.87 56.71 2e5l n SER 62 Cb 0.24 1.08 -0.02 0.00 -1.01 0.00 0.00 64.21 64.49 2e5l n SER 62 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2e5l s ARG 63 N -3.35 4.23 0.29 1.43 3.52 -1.26 -4.63 118.95 119.18 2e5l s ARG 63 Ca 0.23 2.36 -0.26 0.00 -0.13 0.00 0.00 55.73 57.92 2e5l s ARG 63 Cb 0.01 -3.10 -0.15 0.00 -1.56 0.00 0.00 34.95 30.15 2e5l s ARG 63 CO 0.16 -0.49 0.64 -2.30 -0.81 0.00 0.00 175.30 172.50 2e5l n PRO 64 N 2.62 0.52 0.01 5.12 -0.02 -1.26 -4.78 135.00 137.22 2e5l n PRO 64 Ca 0.08 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 2e5l n PRO 64 Cb 0.39 -1.36 0.00 0.00 -0.02 0.00 0.00 33.50 32.52 2e5l n PRO 64 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2e5l n ILE 65 N -0.19 0.17 -4.29 4.25 5.41 -0.92 -5.01 119.36 118.78 2e5l n ILE 65 Ca 0.14 0.06 -0.16 0.00 1.00 0.00 0.00 62.75 63.78 2e5l n ILE 65 Cb 0.31 -1.29 -0.10 0.00 -0.71 0.00 0.00 39.64 37.86 2e5l n ILE 65 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 2e5l s SER 66 N -5.14 1.07 -0.25 4.38 1.04 -1.23 -5.04 113.70 108.53 2e5l s SER 66 Ca 0.00 -1.47 -0.28 0.00 0.48 0.00 0.00 55.95 54.68 2e5l s SER 66 Cb 0.00 0.33 -0.05 0.00 0.10 0.00 0.00 66.02 66.40 2e5l s SER 66 CO 0.00 -0.84 2.25 1.17 0.98 0.00 0.00 173.24 176.80 2e5l n LYS 67 N -0.47 1.87 -1.77 4.02 4.81 -1.26 -2.79 118.16 122.57 2e5l n LYS 67 Ca 0.01 0.48 -0.01 0.00 -0.87 0.00 0.00 58.31 57.92 2e5l n LYS 67 Cb 0.65 -3.26 0.00 0.00 0.02 0.00 0.00 35.03 32.44 2e5l n LYS 67 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 2e5l n ARG 68 N 8.80 -0.39 0.00 1.64 0.63 -1.26 -5.02 116.66 121.06 2e5l n ARG 68 Ca 0.31 0.77 0.00 0.00 -0.92 0.00 0.00 57.85 58.01 2e5l n ARG 68 Cb 0.46 -2.31 0.00 0.00 0.45 0.00 0.00 32.46 31.06 2e5l n ARG 68 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 2e5l n LYS 69 N -0.67 0.00 -0.95 -0.14 4.81 -1.12 -4.76 118.16 115.33 2e5l n LYS 69 Ca 0.02 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.43 2e5l n LYS 69 Cb 0.21 0.00 0.31 0.00 0.02 0.00 0.00 35.03 35.57 2e5l n LYS 69 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2e5l n ARG 70 N 0.00 3.70 -3.91 1.64 3.00 -1.26 -2.15 116.66 117.68 2e5l n ARG 70 Ca 0.00 -3.09 -0.12 0.00 -0.01 0.00 0.00 57.85 54.63 2e5l n ARG 70 Cb 0.00 -2.17 -0.14 0.00 0.00 0.00 0.00 32.46 30.15 2e5l n ARG 70 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2e5l s PHE 71 N -2.97 0.08 0.18 -1.55 0.08 -1.26 -0.05 117.98 112.50 2e5l s PHE 71 Ca 0.53 -0.07 0.06 0.00 0.12 0.00 0.00 56.93 57.57 2e5l s PHE 71 Cb 0.43 -0.05 -0.04 0.00 -0.57 0.00 0.00 43.02 42.79 2e5l s PHE 71 CO 0.13 -0.02 0.13 1.03 -0.10 0.00 0.00 175.22 176.39 2e5l s ARG 72 N -0.19 2.86 -0.00 0.44 0.52 -0.56 -2.25 118.95 119.77 2e5l s ARG 72 Ca -0.02 -0.93 -0.28 0.00 -0.52 0.00 0.00 55.73 53.98 2e5l s ARG 72 Cb -0.01 -2.60 -0.04 0.00 0.52 0.00 0.00 34.95 32.82 2e5l s ARG 72 CO -0.00 0.46 0.88 0.08 0.02 0.00 0.00 175.30 176.75 2e5l s VAL 73 N -1.83 4.86 0.00 3.52 1.01 -1.24 -1.23 120.40 125.49 2e5l s VAL 73 Ca 0.31 1.86 0.00 0.00 0.00 0.00 0.00 61.98 64.15 2e5l s VAL 73 Cb -0.10 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.06 2e5l s VAL 73 CO 0.23 0.22 0.00 -0.11 0.00 0.00 0.00 175.10 175.44 2e5l n LEU 74 N 3.63 0.57 0.00 3.92 0.00 0.41 -4.92 117.00 120.61 2e5l n LEU 74 Ca 0.03 0.28 -0.12 0.00 0.00 0.00 0.00 56.01 56.20 2e5l n LEU 74 Cb 0.51 -0.37 -0.04 0.00 0.00 0.00 0.00 43.42 43.51 2e5l n LEU 74 CO 0.50 -0.37 -0.01 -2.11 0.00 0.00 0.00 177.39 175.40 2e5l n ARG 75 N -1.77 0.34 -4.05 1.96 1.85 -1.26 -4.99 116.66 108.74 2e5l n ARG 75 Ca 0.00 -2.19 -0.34 0.00 -1.00 0.00 0.00 57.85 54.33 2e5l n ARG 75 Cb 0.00 1.88 -0.07 0.00 -1.05 0.00 0.00 32.46 33.22 2e5l n ARG 75 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 2e5l s LEU 76 N 0.00 4.05 -0.19 2.89 0.20 -1.26 -2.74 118.68 121.63 2e5l s LEU 76 Ca 0.25 0.24 -0.12 0.00 0.69 0.00 0.00 54.13 55.19 2e5l s LEU 76 Cb 0.01 -2.29 -0.08 0.00 -0.43 0.00 0.00 46.19 43.40 2e5l s LEU 76 CO 0.18 0.30 -0.28 0.52 -0.29 0.00 0.00 176.35 176.78 2e5l n VAL 77 N 1.31 1.26 -3.50 1.68 0.31 0.42 -4.95 118.33 114.85 2e5l n VAL 77 Ca -0.14 -0.15 -0.06 0.00 -0.01 0.00 0.00 64.34 63.98 2e5l n VAL 77 Cb 0.53 -1.91 -0.07 0.00 -0.91 0.00 0.00 33.84 31.48 2e5l n VAL 77 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2e5l s GLU 78 N -2.49 0.39 0.52 5.55 -1.05 -1.17 -4.98 118.70 115.47 2e5l s GLU 78 Ca -0.28 0.94 -0.12 0.00 -0.15 0.00 0.00 54.97 55.36 2e5l s GLU 78 Cb 0.09 0.19 -0.06 0.00 -0.44 0.00 0.00 34.13 33.92 2e5l s GLU 78 CO 0.37 -0.40 0.92 -1.54 0.95 0.00 0.00 175.26 175.55 2e5l s SER 79 N 2.66 6.42 -0.13 0.83 1.04 -1.26 -1.56 113.70 121.70 2e5l s SER 79 Ca 0.05 1.32 -0.01 0.00 0.48 0.00 0.00 55.95 57.79 2e5l s SER 79 Cb -0.13 -2.41 -0.01 0.00 0.10 0.00 0.00 66.02 63.57 2e5l s SER 79 CO -0.15 -0.63 0.12 0.61 0.98 0.00 0.00 173.24 174.16 2e5l n GLY 80 N -1.99 0.61 2.58 7.32 0.00 -1.23 -4.97 105.19 107.52 2e5l n GLY 80 Ca 0.04 -0.17 -0.13 0.00 0.00 0.00 0.00 46.02 45.77 2e5l n GLY 80 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2e5l n ARG 81 N -1.70 0.60 -0.19 1.61 1.85 -0.74 -4.97 116.66 113.11 2e5l n ARG 81 Ca -0.01 -2.36 -0.04 0.00 -1.00 0.00 0.00 57.85 54.44 2e5l n ARG 81 Cb 0.51 -1.45 0.14 0.00 -1.05 0.00 0.00 32.46 30.62 2e5l n ARG 81 CO 0.00 0.00 0.00 0.52 -0.01 0.00 0.00 177.63 178.14 2e5l h MET 82 N 4.56 0.97 -0.95 2.89 2.86 -1.92 -3.09 114.93 120.26 2e5l h MET 82 Ca 0.03 -0.19 0.33 0.00 -2.06 0.00 0.00 59.70 57.81 2e5l h MET 82 Cb 1.00 -0.15 -0.10 0.00 0.06 0.00 0.00 31.60 32.42 2e5l h MET 82 CO 0.27 0.83 0.61 -0.40 1.06 0.00 0.00 176.91 179.28 2e5l n ASP 83 N -4.27 0.15 -0.04 1.22 5.75 -1.26 0.18 116.55 118.28 2e5l n ASP 83 Ca 0.05 0.98 -0.14 0.00 -0.01 0.00 0.00 54.79 55.67 2e5l n ASP 83 Cb 0.22 -0.48 -0.11 0.00 -1.03 0.00 0.00 41.12 39.71 2e5l n ASP 83 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 2e5l h LEU 84 N 0.00 0.09 -0.79 -2.12 3.38 -1.96 -3.24 115.31 110.66 2e5l h LEU 84 Ca 0.61 -0.72 0.09 0.00 0.09 0.00 0.00 57.88 57.96 2e5l h LEU 84 Cb 1.96 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 42.61 2e5l h LEU 84 CO -0.34 0.79 0.44 0.58 0.09 0.00 0.00 178.44 180.00 2e5l h VAL 85 N -0.61 0.89 -0.50 1.22 2.07 0.17 -1.44 116.25 118.05 2e5l h VAL 85 Ca -0.01 -0.25 0.10 0.00 0.82 0.00 0.00 66.70 67.36 2e5l h VAL 85 Cb 0.80 0.09 -0.10 0.00 -1.52 0.00 0.00 31.29 30.56 2e5l h VAL 85 CO 0.02 0.13 -0.12 -0.33 0.02 0.00 0.00 177.57 177.29 2e5l h GLU 86 N 0.74 0.00 -0.52 1.57 4.39 -1.30 0.13 114.58 119.58 2e5l h GLU 86 Ca 0.38 -0.00 0.10 0.00 0.34 0.00 0.00 59.36 60.18 2e5l h GLU 86 Cb 0.36 -0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 28.93 2e5l h GLU 86 CO -0.25 0.00 0.07 0.87 -1.16 0.00 0.00 179.01 178.54 2e5l h LYS 87 N 0.00 0.18 -0.38 2.33 1.57 -1.29 0.37 116.57 119.36 2e5l h LYS 87 Ca 0.24 -0.01 0.03 0.00 -1.87 0.00 0.00 60.65 59.04 2e5l h LYS 87 Cb 0.37 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 2e5l h LYS 87 CO -0.51 0.12 0.17 -0.92 -0.57 0.00 0.00 179.45 177.74 2e5l h TYR 88 N 0.19 0.32 0.04 -1.35 3.20 -0.76 -2.53 116.97 116.08 2e5l h TYR 88 Ca 0.26 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.15 2e5l h TYR 88 Cb 0.38 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.56 2e5l h TYR 88 CO -0.26 0.16 -0.02 -0.07 -1.64 0.00 0.00 178.16 176.32 2e5l h LEU 89 N 0.36 -0.05 -0.49 2.82 3.38 0.17 -2.43 115.31 119.06 2e5l h LEU 89 Ca 0.16 -0.11 0.04 0.00 0.09 0.00 0.00 57.88 58.06 2e5l h LEU 89 Cb 0.09 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 2e5l h LEU 89 CO -0.13 0.08 0.26 0.40 0.09 0.00 0.00 178.44 179.14 2e5l h ILE 90 N -0.17 0.99 -0.87 1.22 2.04 -0.27 -0.72 117.51 119.72 2e5l h ILE 90 Ca -0.01 -0.18 0.13 0.00 1.00 0.00 0.00 64.86 65.81 2e5l h ILE 90 Cb 0.15 0.43 -0.07 0.00 -0.74 0.00 0.00 36.82 36.59 2e5l h ILE 90 CO 0.01 0.09 0.56 -0.09 0.00 0.00 0.00 178.15 178.73 2e5l h ARG 91 N 0.51 0.70 0.09 2.37 2.43 -1.31 0.46 114.38 119.63 2e5l h ARG 91 Ca 0.21 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2e5l h ARG 91 Cb 0.09 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 2e5l h ARG 91 CO -0.13 0.46 -0.04 -0.09 -1.51 0.00 0.00 179.97 178.66 2e5l h ARG 92 N 0.72 -0.11 -0.52 0.20 2.43 -0.72 -2.80 114.38 113.58 2e5l h ARG 92 Ca 0.43 0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.70 2e5l h ARG 92 Cb 0.63 0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 30.13 2e5l h ARG 92 CO -0.19 0.14 0.10 0.37 -1.51 0.00 0.00 179.97 178.88 2e5l h GLN 93 N -0.35 0.23 -0.11 0.20 4.15 0.38 0.15 115.11 119.76 2e5l h GLN 93 Ca -0.01 -0.01 0.03 0.00 0.77 0.00 0.00 58.65 59.43 2e5l h GLN 93 Cb 0.30 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 27.93 2e5l h GLN 93 CO 0.02 0.15 0.10 -0.91 -1.93 0.00 0.00 178.83 176.26 2e5l h ASN 94 N 0.24 0.00 0.55 -0.69 4.21 -0.93 0.16 115.58 119.11 2e5l h ASN 94 Ca 0.27 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.76 2e5l h ASN 94 Cb 0.37 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.57 2e5l h ASN 94 CO -0.35 0.00 -0.07 1.88 -1.29 0.00 0.00 177.43 177.60 2e5l h TYR 95 N 0.00 0.00 0.00 1.19 -1.99 -0.42 -2.16 116.97 113.59 2e5l h TYR 95 Ca 0.05 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.74 2e5l h TYR 95 Cb 0.26 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.98 2e5l h TYR 95 CO 0.00 0.07 -0.21 0.37 -0.00 0.00 0.00 178.16 178.39 2e5l h GLN 96 N 0.00 0.00 0.00 4.88 4.15 -0.68 -3.43 115.11 120.03 2e5l h GLN 96 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2e5l h GLN 96 Cb 0.37 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.06 2e5l h GLN 96 CO 0.01 0.21 0.00 -1.13 -1.93 0.00 0.00 178.83 175.99 2e5l n SER 97 N -3.86 0.00 -3.78 -0.69 3.41 -0.81 -4.73 113.62 103.16 2e5l n SER 97 Ca -0.02 -0.84 -0.27 0.00 -0.26 0.00 0.00 58.87 57.47 2e5l n SER 97 Cb 0.31 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.30 2e5l n SER 97 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2e5l n LEU 98 N 0.00 -2.92 0.00 1.04 -0.00 -1.26 -5.01 117.00 108.85 2e5l n LEU 98 Ca 0.00 -0.69 0.00 0.00 -0.00 0.00 0.00 56.01 55.32 2e5l n LEU 98 Cb 0.00 -2.75 0.00 0.00 -0.00 0.00 0.00 43.42 40.67 2e5l n LEU 98 CO 0.00 0.53 0.00 -1.54 -0.00 0.00 0.00 177.39 176.38 2e5l n SER 99 N -2.92 1.19 -1.47 1.45 3.41 -1.26 -5.08 113.62 108.95 2e5l n SER 99 Ca 0.01 -0.82 -0.12 0.00 -0.26 0.00 0.00 58.87 57.67 2e5l n SER 99 Cb 0.55 0.00 0.13 0.00 -0.26 0.00 0.00 64.21 64.63 2e5l n SER 99 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2e5l n LYS 100 N 0.00 2.49 -0.13 4.33 4.01 -1.26 -4.61 118.16 122.99 2e5l n LYS 100 Ca 0.00 -3.57 -0.26 0.00 -0.51 0.00 0.00 58.31 53.97 2e5l n LYS 100 Cb 0.00 -1.99 -0.11 0.00 -0.51 0.00 0.00 35.03 32.42 2e5l n LYS 100 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 2e5l n ARG 101 N -0.96 0.61 0.00 1.97 0.63 -1.26 -5.07 116.66 112.58 2e5l n ARG 101 Ca 0.37 0.26 0.00 0.00 -0.92 0.00 0.00 57.85 57.57 2e5l n ARG 101 Cb 0.91 -1.53 0.00 0.00 0.45 0.00 0.00 32.46 32.28 2e5l n ARG 101 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2e5l n GLY 102 N 1.55 2.29 3.85 5.14 0.00 -1.26 -5.17 105.19 111.59 2e5l n GLY 102 Ca -0.50 0.31 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 2e5l n GLY 102 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2e5l s GLY 103 N 0.00 2.29 0.00 -0.02 0.00 -1.26 -5.02 107.32 103.31 2e5l s GLY 103 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 44.72 44.26 2e5l s GLY 103 CO 0.00 -0.09 0.00 0.28 0.00 0.00 0.00 173.10 173.29 2e5l n LYS 104 N 2.08 0.00 0.00 2.90 4.76 -1.26 -5.23 118.16 121.41 2e5l n LYS 104 Ca -0.17 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.27 2e5l n LYS 104 Cb 0.54 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.73 2e5l n LYS 104 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03