#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c7y s ILE 2 N 0.00 5.22 -0.09 1.12 1.01 -1.26 -4.92 121.20 122.28 1c7y s ILE 2 Ca 0.00 0.77 0.05 0.00 0.00 0.00 0.00 60.65 61.48 1c7y s ILE 2 Cb 0.00 -3.74 -0.08 0.00 0.01 0.00 0.00 42.46 38.65 1c7y s ILE 2 CO 0.00 0.31 0.15 0.61 0.00 0.00 0.00 174.94 176.01 1c7y n GLY 3 N 3.55 0.01 3.54 6.18 0.00 -1.26 -4.22 105.19 112.99 1c7y n GLY 3 Ca -0.08 -0.14 -0.16 0.00 0.00 0.00 0.00 46.02 45.64 1c7y n GLY 3 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1c7y s ARG 4 N -2.08 0.93 -0.04 1.61 3.52 -1.26 -1.43 118.95 120.20 1c7y s ARG 4 Ca -0.01 0.29 0.03 0.00 -0.13 0.00 0.00 55.73 55.91 1c7y s ARG 4 Cb 0.04 0.44 0.00 0.00 -1.56 0.00 0.00 34.95 33.87 1c7y s ARG 4 CO 0.22 -0.28 -0.14 -0.51 -0.81 0.00 0.00 175.30 173.78 1c7y s LEU 5 N -1.05 1.84 -0.21 -0.88 1.43 -0.66 -4.91 118.68 114.24 1c7y s LEU 5 Ca -0.08 -0.30 -0.03 0.00 -1.03 0.00 0.00 54.13 52.69 1c7y s LEU 5 Cb -0.01 -0.84 0.07 0.00 0.03 0.00 0.00 46.19 45.44 1c7y s LEU 5 CO 0.07 0.11 0.06 -0.60 0.23 0.00 0.00 176.35 176.22 1c7y s ARG 6 N 0.17 0.51 0.00 1.70 3.52 -1.26 -0.78 118.95 122.81 1c7y s ARG 6 Ca -0.05 -0.42 0.00 0.00 -0.13 0.00 0.00 55.73 55.13 1c7y s ARG 6 Cb -0.11 -1.98 0.00 0.00 -1.56 0.00 0.00 34.95 31.30 1c7y s ARG 6 CO 0.02 -0.71 0.00 0.41 -0.81 0.00 0.00 175.30 174.21 1c7y n GLY 7 N 5.09 2.28 3.72 8.12 0.00 -0.51 -4.73 105.19 119.17 1c7y n GLY 7 Ca -0.08 -0.83 -0.38 0.00 0.00 0.00 0.00 46.02 44.73 1c7y n GLY 7 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c7y s ILE 8 N -2.84 5.15 -0.26 -0.61 -1.09 0.53 0.66 121.20 122.75 1c7y s ILE 8 Ca 0.00 1.06 -0.29 0.00 -2.23 0.00 0.00 60.65 59.19 1c7y s ILE 8 Cb 0.00 -3.86 -0.03 0.00 -1.58 0.00 0.00 42.46 36.99 1c7y s ILE 8 CO 0.00 0.32 1.75 -0.63 -1.23 0.00 0.00 174.94 175.15 1c7y s ILE 9 N 0.59 3.53 -0.08 2.92 -1.09 -0.30 0.93 121.20 127.70 1c7y s ILE 9 Ca 0.28 0.57 0.04 0.00 -2.23 0.00 0.00 60.65 59.31 1c7y s ILE 9 Cb -0.16 -3.61 -0.25 0.00 -1.58 0.00 0.00 42.46 36.87 1c7y s ILE 9 CO 0.12 -0.32 0.54 -0.38 -1.23 0.00 0.00 174.94 173.67 1c7y n ILE 10 N 6.91 1.69 -3.45 2.92 2.08 0.21 -0.22 119.36 129.50 1c7y n ILE 10 Ca 0.21 -0.73 -0.12 0.00 0.56 0.00 0.00 62.75 62.67 1c7y n ILE 10 Cb 0.46 -1.36 -0.03 0.00 -0.75 0.00 0.00 39.64 37.96 1c7y n ILE 10 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 1c7y s GLU 11 N -2.58 1.17 -0.13 0.38 2.12 -1.06 -4.79 118.70 113.80 1c7y s GLU 11 Ca -0.13 -0.32 -0.01 0.00 0.36 0.00 0.00 54.97 54.88 1c7y s GLU 11 Cb 0.07 0.54 0.03 0.00 0.26 0.00 0.00 34.13 35.04 1c7y s GLU 11 CO 0.80 -0.49 -0.04 0.15 -0.54 0.00 0.00 175.26 175.15 1c7y s LYS 12 N -3.20 1.16 -0.43 4.30 1.02 -1.26 -1.30 119.74 120.01 1c7y s LYS 12 Ca -0.00 -0.26 0.03 0.00 0.02 0.00 0.00 55.97 55.76 1c7y s LYS 12 Cb -0.01 -1.62 0.16 0.00 -0.52 0.00 0.00 37.83 35.84 1c7y s LYS 12 CO -0.09 -0.37 0.33 -0.65 -0.92 0.00 0.00 175.35 173.65 1c7y s GLN 13 N 1.77 1.04 0.27 1.68 -0.21 -0.06 -5.03 119.66 119.12 1c7y s GLN 13 Ca 0.03 -2.10 -0.28 0.00 0.02 0.00 0.00 55.36 53.03 1c7y s GLN 13 Cb -0.14 -1.68 -0.15 0.00 1.00 0.00 0.00 33.01 32.05 1c7y s GLN 13 CO -0.07 -1.33 0.96 -2.30 -2.12 0.00 0.00 175.29 170.43 1c7y n PRO 14 N 3.01 1.17 -0.05 2.91 -0.02 -1.26 0.52 135.00 141.28 1c7y n PRO 14 Ca 0.24 0.41 0.01 0.00 -2.02 0.00 0.00 63.50 62.14 1c7y n PRO 14 Cb 0.44 -1.74 0.04 0.00 -0.02 0.00 0.00 33.50 32.21 1c7y n PRO 14 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1c7y n PRO 15 N 0.83 1.21 -4.52 0.52 -0.02 -1.26 -5.09 135.00 126.67 1c7y n PRO 15 Ca 0.11 -0.31 -0.34 0.00 -2.02 0.00 0.00 63.50 60.94 1c7y n PRO 15 Cb 0.31 -1.10 -0.11 0.00 -0.02 0.00 0.00 33.50 32.58 1c7y n PRO 15 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 1c7y s LEU 16 N -0.95 3.32 0.20 2.45 0.05 0.18 -1.38 118.68 122.55 1c7y s LEU 16 Ca 0.06 0.03 0.06 0.00 0.05 0.00 0.00 54.13 54.33 1c7y s LEU 16 Cb 0.03 -1.75 -0.04 0.00 -2.05 0.00 0.00 46.19 42.39 1c7y s LEU 16 CO 0.04 0.36 0.14 -0.69 -0.55 0.00 0.00 176.35 175.65 1c7y s VAL 17 N -0.85 4.36 -0.33 1.48 1.01 -0.30 -0.88 120.40 124.90 1c7y s VAL 17 Ca 0.13 -1.25 0.03 0.00 0.00 0.00 0.00 61.98 60.89 1c7y s VAL 17 Cb -0.11 -3.27 0.10 0.00 0.00 0.00 0.00 36.38 33.09 1c7y s VAL 17 CO 0.02 -0.20 0.04 -0.22 0.00 0.00 0.00 175.10 174.74 1c7y s LEU 18 N -3.36 4.35 -0.22 3.92 1.98 -0.42 -0.93 118.68 124.01 1c7y s LEU 18 Ca 0.31 -2.02 -0.10 0.00 -2.89 0.00 0.00 54.13 49.44 1c7y s LEU 18 Cb -0.09 -1.54 -0.05 0.00 0.66 0.00 0.00 46.19 45.17 1c7y s LEU 18 CO 0.23 -0.36 0.13 -0.63 -1.89 0.00 0.00 176.35 173.83 1c7y s ILE 19 N 1.00 5.25 -0.22 6.68 1.01 -0.65 0.66 121.20 134.93 1c7y s ILE 19 Ca 0.09 0.14 -0.15 0.00 0.00 0.00 0.00 60.65 60.73 1c7y s ILE 19 Cb -0.19 -3.42 -0.04 0.00 0.01 0.00 0.00 42.46 38.82 1c7y s ILE 19 CO -0.09 0.39 0.35 -0.70 0.00 0.00 0.00 174.94 174.89 1c7y s GLU 20 N 0.75 4.13 -0.33 2.79 2.12 0.26 -1.30 118.70 127.12 1c7y s GLU 20 Ca 0.07 0.09 0.01 0.00 0.36 0.00 0.00 54.97 55.50 1c7y s GLU 20 Cb -0.13 -3.56 0.08 0.00 0.26 0.00 0.00 34.13 30.79 1c7y s GLU 20 CO 0.02 -0.07 0.04 0.08 -0.54 0.00 0.00 175.26 174.79 1c7y s VAL 21 N 1.41 2.65 0.00 3.70 1.01 0.06 -0.34 120.40 128.89 1c7y s VAL 21 Ca 0.16 -1.90 0.00 0.00 0.00 0.00 0.00 61.98 60.25 1c7y s VAL 21 Cb -0.15 -2.73 0.00 0.00 0.00 0.00 0.00 36.38 33.50 1c7y s VAL 21 CO 0.08 -0.38 0.00 0.61 0.00 0.00 0.00 175.10 175.41 1c7y n GLY 22 N 4.45 1.69 0.00 4.51 0.00 -1.26 -2.55 105.19 112.03 1c7y n GLY 22 Ca -0.05 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1c7y n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c7y n GLY 23 N 0.00 0.68 3.69 -0.02 0.00 -1.26 -5.00 105.19 103.28 1c7y n GLY 23 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1c7y n GLY 23 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c7y s VAL 24 N -0.81 5.17 -0.38 1.61 1.01 -1.06 -5.05 120.40 120.90 1c7y s VAL 24 Ca 0.00 0.88 -0.11 0.00 0.00 0.00 0.00 61.98 62.74 1c7y s VAL 24 Cb 0.00 -3.80 0.03 0.00 0.00 0.00 0.00 36.38 32.61 1c7y s VAL 24 CO 0.00 0.27 0.22 -0.83 0.00 0.00 0.00 175.10 174.76 1c7y s GLY 25 N 0.87 1.94 0.10 4.51 0.00 -1.26 -0.76 107.32 112.72 1c7y s GLY 25 Ca 0.23 -1.71 -0.18 0.00 0.00 0.00 0.00 44.72 43.06 1c7y s GLY 25 CO 0.09 0.85 0.57 -0.19 0.00 0.00 0.00 173.10 174.43 1c7y s TYR 26 N 1.57 3.76 -0.16 1.90 2.02 -0.42 -4.87 117.35 121.14 1c7y s TYR 26 Ca 0.02 1.24 -0.17 0.00 -0.37 0.00 0.00 57.07 57.79 1c7y s TYR 26 Cb -0.19 -2.48 -0.04 0.00 -0.40 0.00 0.00 41.96 38.85 1c7y s TYR 26 CO 0.07 0.54 0.46 -1.21 -1.57 0.00 0.00 175.55 173.84 1c7y s GLU 27 N -1.35 4.26 -0.13 -0.62 2.02 -1.26 -1.64 118.70 119.98 1c7y s GLU 27 Ca 0.32 0.36 0.02 0.00 0.02 0.00 0.00 54.97 55.69 1c7y s GLU 27 Cb -0.18 -3.49 0.01 0.00 0.10 0.00 0.00 34.13 30.57 1c7y s GLU 27 CO 0.19 0.03 -0.19 0.08 0.02 0.00 0.00 175.26 175.39 1c7y s VAL 28 N 1.06 1.82 -0.37 2.63 1.01 -0.10 -4.25 120.40 122.20 1c7y s VAL 28 Ca 0.23 -0.84 -0.23 0.00 0.00 0.00 0.00 61.98 61.15 1c7y s VAL 28 Cb -0.15 -1.63 0.01 0.00 0.00 0.00 0.00 36.38 34.61 1c7y s VAL 28 CO 0.09 0.50 0.75 -1.00 0.00 0.00 0.00 175.10 175.45 1c7y s HIS 29 N 0.91 3.11 -0.02 5.22 3.76 0.31 -1.15 115.29 127.43 1c7y s HIS 29 Ca -0.06 0.46 0.06 0.00 -0.15 0.00 0.00 55.06 55.36 1c7y s HIS 29 Cb -0.15 -3.37 -0.01 0.00 1.11 0.00 0.00 32.58 30.15 1c7y s HIS 29 CO -0.02 -0.74 -0.19 -1.64 -0.85 0.00 0.00 174.74 171.29 1c7y s MET 30 N 3.03 1.64 0.35 1.40 -1.94 -0.48 -0.94 119.30 122.36 1c7y s MET 30 Ca 0.30 -0.69 -0.28 0.00 -1.71 0.00 0.00 55.69 53.30 1c7y s MET 30 Cb -0.13 -1.55 -0.12 0.00 2.01 0.00 0.00 34.83 35.04 1c7y s MET 30 CO 0.17 0.39 1.40 -2.30 -0.01 0.00 0.00 175.02 174.67 1c7y n PRO 31 N 2.69 2.38 -0.35 2.03 -0.02 -1.26 -4.64 135.00 135.83 1c7y n PRO 31 Ca -0.16 0.83 0.15 0.00 -2.02 0.00 0.00 63.50 62.31 1c7y n PRO 31 Cb 0.53 -2.49 0.35 0.00 -0.02 0.00 0.00 33.50 31.87 1c7y n PRO 31 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 1c7y h MET 32 N 2.97 0.64 -0.24 -0.52 2.86 -1.82 0.15 114.93 118.97 1c7y h MET 32 Ca -0.48 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.10 1c7y h MET 32 Cb 1.26 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.77 1c7y h MET 32 CO 0.65 0.42 0.03 1.79 1.06 0.00 0.00 176.91 180.86 1c7y h THR 33 N 0.66 1.14 0.01 2.22 1.35 -1.75 -1.48 112.91 115.05 1c7y h THR 33 Ca 0.61 -0.50 -0.02 0.00 -0.55 0.00 0.00 66.41 65.94 1c7y h THR 33 Cb 1.05 0.93 0.00 0.00 -1.73 0.00 0.00 68.15 68.40 1c7y h THR 33 CO -0.43 0.17 -0.08 0.00 -0.25 0.00 0.00 175.52 174.93 1c7y h PHE 35 N -0.78 0.77 -0.09 0.00 3.04 -0.66 0.32 116.94 119.52 1c7y h PHE 35 Ca -0.01 0.04 0.03 0.00 3.98 0.00 0.00 57.97 62.00 1c7y h PHE 35 Cb 0.94 -0.19 -0.00 0.00 2.56 0.00 0.00 35.95 39.25 1c7y h PHE 35 CO 0.22 -0.02 0.26 1.88 -2.02 0.00 0.00 178.31 178.63 1c7y h TYR 36 N 0.45 0.00 -0.00 0.41 0.99 -1.35 -1.18 116.97 116.28 1c7y h TYR 36 Ca 0.59 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.32 1c7y h TYR 36 Cb 1.14 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.87 1c7y h TYR 36 CO -0.09 0.00 -0.68 0.39 -0.00 0.00 0.00 178.16 177.77 1c7y n GLU 37 N -3.23 0.29 -1.71 4.88 -0.58 0.11 -4.97 120.64 115.43 1c7y n GLU 37 Ca -0.00 -0.22 -0.43 0.00 -0.42 0.00 0.00 57.16 56.09 1c7y n GLU 37 Cb 0.34 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.69 1c7y n GLU 37 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1c7y n LEU 38 N -1.17 3.83 -4.55 -4.62 4.77 -0.45 -4.96 117.00 109.86 1c7y n LEU 38 Ca 0.06 1.11 -0.29 0.00 -0.03 0.00 0.00 56.01 56.86 1c7y n LEU 38 Cb 0.36 -1.53 0.22 0.00 -2.33 0.00 0.00 43.42 40.14 1c7y n LEU 38 CO 0.36 -0.02 0.57 -2.16 -1.33 0.00 0.00 177.39 174.82 1c7y s PRO 39 N 0.25 -0.29 0.88 3.23 0.04 -1.26 -4.93 135.00 132.91 1c7y s PRO 39 Ca 0.70 1.03 -0.13 0.00 0.04 0.00 0.00 61.00 62.64 1c7y s PRO 39 Cb -0.55 -1.61 0.05 0.00 0.04 0.00 0.00 34.50 32.43 1c7y s PRO 39 CO 0.42 -3.36 0.72 0.39 0.04 0.00 0.00 177.00 175.21 1c7y n GLU 40 N -4.68 -0.12 -1.17 4.56 -0.58 -1.26 -4.86 120.64 112.52 1c7y n GLU 40 Ca 0.06 0.02 -0.34 0.00 -0.42 0.00 0.00 57.16 56.48 1c7y n GLU 40 Cb 0.54 -2.06 0.12 0.00 -0.57 0.00 0.00 31.44 29.47 1c7y n GLU 40 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1c7y s ALA 41 N -2.30 1.89 0.00 0.62 0.00 -1.26 -2.19 121.76 118.52 1c7y s ALA 41 Ca 0.63 0.86 0.00 0.00 0.00 0.00 0.00 51.96 53.45 1c7y s ALA 41 Cb -0.25 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.37 1c7y s ALA 41 CO 0.61 -2.23 0.00 0.41 0.00 0.00 0.00 175.76 174.55 1c7y n GLY 42 N 0.48 2.99 3.90 0.00 0.00 0.69 -4.97 105.19 108.28 1c7y n GLY 42 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 1c7y n GLY 42 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1c7y s GLN 43 N -0.21 2.99 0.06 1.61 -1.52 -0.93 -4.72 119.66 116.95 1c7y s GLN 43 Ca 0.00 0.27 -0.18 0.00 -1.95 0.00 0.00 55.36 53.50 1c7y s GLN 43 Cb 0.00 -2.16 -0.06 0.00 -0.22 0.00 0.00 33.01 30.57 1c7y s GLN 43 CO 0.00 -0.80 0.52 -2.00 -0.25 0.00 0.00 175.29 172.77 1c7y s GLU 44 N -5.14 4.11 0.17 2.91 2.12 -1.26 -1.15 118.70 120.45 1c7y s GLU 44 Ca 0.55 0.63 0.06 0.00 0.36 0.00 0.00 54.97 56.58 1c7y s GLU 44 Cb -0.11 -3.21 -0.04 0.00 0.26 0.00 0.00 34.13 31.03 1c7y s GLU 44 CO 0.49 0.64 -0.13 0.00 -0.54 0.00 0.00 175.26 175.72 1c7y s ALA 45 N -1.13 1.72 -0.09 6.30 0.00 0.21 -4.89 121.76 123.89 1c7y s ALA 45 Ca 0.28 -1.52 -0.01 0.00 0.00 0.00 0.00 51.96 50.72 1c7y s ALA 45 Cb -0.18 -0.05 0.03 0.00 0.00 0.00 0.00 23.12 22.92 1c7y s ALA 45 CO 0.18 0.03 -0.04 0.42 0.00 0.00 0.00 175.76 176.34 1c7y s ILE 46 N -2.87 0.73 -0.06 0.00 1.01 -1.26 -1.42 121.20 117.33 1c7y s ILE 46 Ca 0.17 -0.11 -0.00 0.00 0.00 0.00 0.00 60.65 60.71 1c7y s ILE 46 Cb -0.01 -0.80 0.03 0.00 0.01 0.00 0.00 42.46 41.69 1c7y s ILE 46 CO 0.04 0.31 -0.02 0.68 0.00 0.00 0.00 174.94 175.96 1c7y s VAL 47 N 1.72 0.45 0.40 2.92 -7.23 0.04 -4.83 120.40 113.87 1c7y s VAL 47 Ca 0.03 0.02 -0.26 0.00 -1.81 0.00 0.00 61.98 59.96 1c7y s VAL 47 Cb -0.13 -0.55 -0.09 0.00 0.56 0.00 0.00 36.38 36.18 1c7y s VAL 47 CO -0.06 0.25 1.25 -0.36 -0.31 0.00 0.00 175.10 175.87 1c7y s PHE 48 N 1.55 2.92 0.07 2.82 0.08 -0.13 -1.66 117.98 123.64 1c7y s PHE 48 Ca -0.01 1.47 0.04 0.00 0.12 0.00 0.00 56.93 58.55 1c7y s PHE 48 Cb -0.13 -3.56 -0.03 0.00 -0.57 0.00 0.00 43.02 38.73 1c7y s PHE 48 CO -0.03 -1.78 -0.12 0.95 -0.10 0.00 0.00 175.22 174.14 1c7y s THR 49 N -1.31 0.94 -0.26 0.64 -4.23 -0.51 -0.49 115.64 110.43 1c7y s THR 49 Ca 0.57 -1.33 -0.02 0.00 -1.18 0.00 0.00 61.69 59.73 1c7y s THR 49 Cb -0.35 -1.03 0.03 0.00 1.34 0.00 0.00 72.50 72.48 1c7y s THR 49 CO 0.45 -0.34 -0.05 -2.28 -0.54 0.00 0.00 174.62 171.86 1c7y s HIS 50 N -1.57 3.10 -0.13 3.99 2.46 0.27 -4.46 115.29 118.94 1c7y s HIS 50 Ca -0.02 -1.61 -0.20 0.00 0.47 0.00 0.00 55.06 53.70 1c7y s HIS 50 Cb -0.08 -2.06 -0.04 0.00 -0.13 0.00 0.00 32.58 30.27 1c7y s HIS 50 CO 0.01 -0.74 0.56 0.12 -2.47 0.00 0.00 174.74 172.22 1c7y s PHE 51 N 1.31 3.48 -0.16 3.88 5.36 -1.26 -1.13 117.98 129.47 1c7y s PHE 51 Ca -0.01 0.96 -0.01 0.00 -0.96 0.00 0.00 56.93 56.91 1c7y s PHE 51 Cb -0.17 -2.67 -0.01 0.00 -0.34 0.00 0.00 43.02 39.83 1c7y s PHE 51 CO -0.04 0.05 -0.11 0.08 -1.46 0.00 0.00 175.22 173.74 1c7y s VAL 52 N 1.04 3.08 -0.22 3.12 1.01 -0.07 -4.78 120.40 123.57 1c7y s VAL 52 Ca 0.29 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.66 1c7y s VAL 52 Cb -0.16 -2.33 0.04 0.00 0.00 0.00 0.00 36.38 33.94 1c7y s VAL 52 CO 0.12 0.49 -0.14 -0.69 0.00 0.00 0.00 175.10 174.88 1c7y s VAL 53 N 0.79 2.06 0.54 2.92 1.01 -1.26 -1.36 120.40 125.10 1c7y s VAL 53 Ca -0.04 -1.31 0.08 0.00 0.00 0.00 0.00 61.98 60.70 1c7y s VAL 53 Cb -0.15 -2.06 0.05 0.00 0.00 0.00 0.00 36.38 34.23 1c7y s VAL 53 CO 0.01 0.19 0.59 -0.13 0.00 0.00 0.00 175.10 175.76 1c7y s ARG 54 N 1.21 2.32 -0.03 2.72 0.52 -0.07 -5.00 118.95 120.63 1c7y s ARG 54 Ca -0.03 -1.78 -0.02 0.00 -0.52 0.00 0.00 55.73 53.38 1c7y s ARG 54 Cb -0.17 -2.40 -0.27 0.00 0.52 0.00 0.00 34.95 32.63 1c7y s ARG 54 CO -0.08 -0.68 0.74 1.49 0.02 0.00 0.00 175.30 176.79 1c7y h GLU 55 N 0.50 0.23 -0.07 3.54 4.81 -2.05 -3.36 114.58 118.18 1c7y h GLU 55 Ca -0.34 -0.39 0.00 0.00 -0.13 0.00 0.00 59.36 58.50 1c7y h GLU 55 Cb 1.29 0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.82 1c7y h GLU 55 CO 0.49 1.07 0.00 -0.40 -0.73 0.00 0.00 179.01 179.44 1c7y n ASP 56 N -3.41 2.77 -3.59 1.04 5.75 -1.26 -5.02 116.55 112.82 1c7y n ASP 56 Ca -0.19 -1.86 -0.08 0.00 -0.01 0.00 0.00 54.79 52.65 1c7y n ASP 56 Cb 1.05 -0.03 -0.04 0.00 -1.03 0.00 0.00 41.12 41.06 1c7y n ASP 56 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1c7y s ALA 57 N -1.65 -1.98 -0.31 2.12 0.00 -1.26 -5.14 121.76 113.55 1c7y s ALA 57 Ca 0.25 1.62 -0.03 0.00 0.00 0.00 0.00 51.96 53.80 1c7y s ALA 57 Cb 0.17 -0.76 0.11 0.00 0.00 0.00 0.00 23.12 22.64 1c7y s ALA 57 CO 0.26 -0.35 0.15 1.14 0.00 0.00 0.00 175.76 176.96 1c7y s GLN 58 N -1.36 0.35 0.34 0.00 -2.07 -1.26 -0.89 119.66 114.77 1c7y s GLN 58 Ca 0.02 -0.80 0.05 0.00 -1.82 0.00 0.00 55.36 52.81 1c7y s GLN 58 Cb -0.01 -1.29 -0.01 0.00 -1.09 0.00 0.00 33.01 30.61 1c7y s GLN 58 CO -0.02 -1.07 0.49 -0.51 -1.32 0.00 0.00 175.29 172.86 1c7y s LEU 59 N 1.77 3.97 -0.17 2.60 1.02 -0.47 -4.89 118.68 122.52 1c7y s LEU 59 Ca 0.11 -0.04 -0.01 0.00 0.02 0.00 0.00 54.13 54.21 1c7y s LEU 59 Cb -0.18 -2.86 -0.01 0.00 0.02 0.00 0.00 46.19 43.16 1c7y s LEU 59 CO -0.26 -0.42 -0.11 -0.22 0.02 0.00 0.00 176.35 175.36 1c7y s LEU 60 N -4.22 2.68 -0.18 1.79 2.96 -1.26 -0.89 118.68 119.56 1c7y s LEU 60 Ca 0.44 -0.41 -0.05 0.00 -0.22 0.00 0.00 54.13 53.89 1c7y s LEU 60 Cb -0.10 -1.64 -0.03 0.00 0.50 0.00 0.00 46.19 44.93 1c7y s LEU 60 CO 0.32 0.07 -0.00 -0.31 -1.32 0.00 0.00 176.35 175.10 1c7y s TYR 61 N 0.94 3.06 0.18 5.38 1.51 -0.28 -0.53 117.35 127.62 1c7y s TYR 61 Ca -0.02 -0.32 0.11 0.00 -1.01 0.00 0.00 57.07 55.82 1c7y s TYR 61 Cb -0.15 -2.04 -0.04 0.00 -0.11 0.00 0.00 41.96 39.62 1c7y s TYR 61 CO -0.01 -0.11 -0.20 0.20 -1.11 0.00 0.00 175.55 174.32 1c7y s GLY 62 N 0.69 1.71 0.01 0.71 0.00 -0.11 0.97 107.32 111.28 1c7y s GLY 62 Ca -0.00 -1.58 -0.06 0.00 0.00 0.00 0.00 44.72 43.08 1c7y s GLY 62 CO 0.02 -1.60 0.10 -1.36 0.00 0.00 0.00 173.10 170.26 1c7y s PHE 63 N -1.63 0.09 0.16 1.90 0.08 0.36 -4.30 117.98 114.65 1c7y s PHE 63 Ca 0.21 -0.23 0.14 0.00 0.12 0.00 0.00 56.93 57.17 1c7y s PHE 63 Cb -0.08 -0.08 0.36 0.00 -0.57 0.00 0.00 43.02 42.64 1c7y s PHE 63 CO 0.11 -0.26 1.59 -0.91 -0.10 0.00 0.00 175.22 175.64 1c7y h ASN 64 N 4.36 0.00 -4.22 1.36 2.35 -1.88 -0.32 115.58 117.23 1c7y h ASN 64 Ca -0.31 0.00 -0.54 0.00 -0.55 0.00 0.00 56.30 54.90 1c7y h ASN 64 Cb 1.20 0.00 -0.22 0.00 0.05 0.00 0.00 38.32 39.35 1c7y h ASN 64 CO 0.41 0.57 -0.82 0.20 -1.65 0.00 0.00 177.43 176.13 1c7y s ASN 65 N -6.63 2.43 0.23 5.81 0.01 -1.26 -4.72 114.94 110.80 1c7y s ASN 65 Ca 0.00 -0.67 -0.08 0.00 -0.71 0.00 0.00 52.86 51.40 1c7y s ASN 65 Cb 0.11 -0.13 0.21 0.00 0.41 0.00 0.00 41.25 41.85 1c7y s ASN 65 CO 0.74 0.04 1.88 0.50 -1.51 0.00 0.00 177.10 178.75 1c7y h LYS 66 N 4.13 1.21 -0.11 -0.60 3.64 -1.98 -0.95 116.57 121.91 1c7y h LYS 66 Ca -0.45 -0.11 0.04 0.00 -1.27 0.00 0.00 60.65 58.85 1c7y h LYS 66 Cb 1.18 -0.25 -0.04 0.00 -0.41 0.00 0.00 32.23 32.70 1c7y h LYS 66 CO 0.40 0.85 -0.15 1.96 -2.27 0.00 0.00 179.45 180.24 1c7y h GLN 67 N 1.23 -0.19 -0.98 1.90 7.50 -1.96 0.16 115.11 122.77 1c7y h GLN 67 Ca 0.32 0.01 0.15 0.00 0.50 0.00 0.00 58.65 59.63 1c7y h GLN 67 Cb -0.05 0.04 -0.09 0.00 0.05 0.00 0.00 27.48 27.44 1c7y h GLN 67 CO -0.06 -0.12 0.61 0.93 -1.50 0.00 0.00 178.83 178.69 1c7y h GLU 68 N -0.19 0.82 -0.27 1.46 5.08 -1.74 0.63 114.58 120.37 1c7y h GLU 68 Ca 0.09 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.34 1c7y h GLU 68 Cb 0.32 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1c7y h GLU 68 CO -0.22 0.54 -0.04 -0.09 -1.00 0.00 0.00 179.01 178.20 1c7y h ARG 69 N 0.84 0.50 -0.20 2.33 1.12 0.11 -2.63 114.38 116.46 1c7y h ARG 69 Ca 0.51 -0.18 0.02 0.00 -1.11 0.00 0.00 59.98 59.22 1c7y h ARG 69 Cb 0.68 -0.03 -0.02 0.00 -0.01 0.00 0.00 29.97 30.59 1c7y h ARG 69 CO -0.28 0.70 0.05 1.15 -3.11 0.00 0.00 179.97 178.48 1c7y h THR 70 N 0.26 0.93 -0.25 0.20 2.02 0.97 0.12 112.91 117.16 1c7y h THR 70 Ca 0.07 -0.05 0.04 0.00 0.77 0.00 0.00 66.41 67.24 1c7y h THR 70 Cb 0.50 0.78 -0.04 0.00 -1.74 0.00 0.00 68.15 67.65 1c7y h THR 70 CO 0.02 0.03 0.03 0.25 0.37 0.00 0.00 175.52 176.22 1c7y h LEU 71 N 0.14 -0.03 -0.99 2.58 5.85 -0.99 0.05 115.31 121.92 1c7y h LEU 71 Ca 0.09 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.89 1c7y h LEU 71 Cb 0.07 0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.12 1c7y h LEU 71 CO -0.11 0.02 0.65 0.15 -0.34 0.00 0.00 178.44 178.81 1c7y h PHE 72 N 0.12 1.22 -0.31 1.25 3.04 -1.03 0.18 116.94 121.41 1c7y h PHE 72 Ca 0.12 0.03 -0.08 0.00 3.98 0.00 0.00 57.97 62.02 1c7y h PHE 72 Cb 0.13 -0.41 -0.02 0.00 2.56 0.00 0.00 35.95 38.22 1c7y h PHE 72 CO -0.17 0.72 -0.14 0.87 -2.02 0.00 0.00 178.31 177.57 1c7y h LYS 73 N 1.27 0.53 -0.20 1.11 1.57 0.07 -0.72 116.57 120.20 1c7y h LYS 73 Ca 0.39 -0.16 -0.21 0.00 -1.87 0.00 0.00 60.65 58.80 1c7y h LYS 73 Cb -0.03 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.24 1c7y h LYS 73 CO -0.12 0.66 -0.69 0.93 -0.57 0.00 0.00 179.45 179.66 1c7y h GLU 74 N 0.49 0.81 -0.59 3.15 4.39 -0.13 -3.01 114.58 119.69 1c7y h GLU 74 Ca 0.09 -0.61 0.03 0.00 0.34 0.00 0.00 59.36 59.21 1c7y h GLU 74 Cb 0.53 0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 29.25 1c7y h GLU 74 CO 0.03 1.23 0.35 -0.07 -1.16 0.00 0.00 179.01 179.39 1c7y h LEU 75 N 0.57 0.55 -1.65 1.33 3.38 -0.12 -1.62 115.31 117.75 1c7y h LEU 75 Ca -0.03 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1c7y h LEU 75 Cb 1.32 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 1c7y h LEU 75 CO 0.15 0.38 -0.20 0.16 0.09 0.00 0.00 178.44 179.02 1c7y h ILE 76 N 0.68 1.00 -0.47 1.22 3.07 -1.16 -1.84 117.51 120.02 1c7y h ILE 76 Ca 0.25 -0.71 -0.04 0.00 1.55 0.00 0.00 64.86 65.90 1c7y h ILE 76 Cb 0.07 1.40 -0.02 0.00 -0.27 0.00 0.00 36.82 38.00 1c7y h ILE 76 CO -0.12 0.19 0.12 0.11 -1.05 0.00 0.00 178.15 177.40 1c7y h LYS 77 N 0.00 0.75 -6.19 0.16 1.57 -1.16 -3.42 116.57 108.28 1c7y h LYS 77 Ca -0.00 -0.17 -0.69 0.00 -1.87 0.00 0.00 60.65 57.91 1c7y h LYS 77 Cb 0.38 -0.10 0.07 0.00 0.08 0.00 0.00 32.23 32.66 1c7y h LYS 77 CO 0.03 0.73 0.14 2.41 -0.57 0.00 0.00 179.45 182.19 1c7y n THR 78 N -4.50 0.65 -1.94 -0.16 -1.04 -0.69 -4.83 114.28 101.76 1c7y n THR 78 Ca 0.01 -0.16 -0.42 0.00 -2.04 0.00 0.00 64.05 61.44 1c7y n THR 78 Cb 0.21 -0.51 -0.03 0.00 -1.82 0.00 0.00 70.33 68.18 1c7y n THR 78 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1c7y s ASN 79 N -0.05 6.60 0.00 8.00 2.47 -1.26 -1.95 114.94 128.74 1c7y s ASN 79 Ca 0.79 2.60 0.00 0.00 0.42 0.00 0.00 52.86 56.67 1c7y s ASN 79 Cb -0.99 -2.59 0.00 0.00 -1.45 0.00 0.00 41.25 36.22 1c7y s ASN 79 CO 0.53 -0.82 0.00 0.61 -3.72 0.00 0.00 177.10 173.70 1c7y n GLY 80 N 3.75 1.82 3.62 1.21 0.00 -1.26 -4.96 105.19 109.37 1c7y n GLY 80 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 1c7y n GLY 80 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c7y s VAL 81 N -2.34 4.46 0.00 1.61 1.01 -0.82 -5.01 120.40 119.31 1c7y s VAL 81 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 61.98 61.82 1c7y s VAL 81 Cb 0.00 -2.96 -0.00 0.00 0.00 0.00 0.00 36.38 33.42 1c7y s VAL 81 CO 0.00 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.22 1c7y n GLY 82 N 3.14 4.09 0.20 4.51 0.00 -1.26 -4.57 105.19 111.29 1c7y n GLY 82 Ca -0.17 -1.88 -0.04 0.00 0.00 0.00 0.00 46.02 43.93 1c7y n GLY 82 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1c7y h PRO 83 N 0.00 -0.01 0.00 1.61 0.11 -1.96 -2.04 132.00 129.71 1c7y h PRO 83 Ca -0.00 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.12 1c7y h PRO 83 Cb 0.01 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.10 1c7y h PRO 83 CO 0.00 -0.01 -0.08 -0.22 -0.21 0.00 0.00 178.00 177.48 1c7y h LYS 84 N -0.01 -0.14 0.07 1.05 3.64 -1.98 -0.22 116.57 118.98 1c7y h LYS 84 Ca 0.22 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.62 1c7y h LYS 84 Cb 0.36 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 1c7y h LYS 84 CO -0.49 -0.09 -0.09 -0.07 -2.27 0.00 0.00 179.45 176.44 1c7y h LEU 85 N -0.14 -0.24 -1.27 5.20 3.38 -1.89 0.68 115.31 121.02 1c7y h LEU 85 Ca 0.03 0.03 0.11 0.00 0.09 0.00 0.00 57.88 58.14 1c7y h LEU 85 Cb 0.18 0.09 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 1c7y h LEU 85 CO -0.08 -0.14 0.56 0.00 0.09 0.00 0.00 178.44 178.87 1c7y h ALA 86 N 0.72 1.74 -0.05 1.53 0.00 -1.29 0.96 119.26 122.87 1c7y h ALA 86 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1c7y h ALA 86 Cb 0.20 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1c7y h ALA 86 CO -0.04 0.06 0.01 1.25 0.00 0.00 0.00 179.25 180.53 1c7y h LEU 87 N 0.77 0.09 -0.17 0.00 6.46 -0.29 0.12 115.31 122.28 1c7y h LEU 87 Ca 0.41 -0.26 0.01 0.00 -0.12 0.00 0.00 57.88 57.91 1c7y h LEU 87 Cb 0.53 -0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.42 1c7y h LEU 87 CO -0.18 0.33 0.10 0.00 -0.62 0.00 0.00 178.44 178.07 1c7y h ALA 88 N 0.76 0.21 -0.71 1.25 0.00 0.75 -2.17 119.26 119.35 1c7y h ALA 88 Ca 0.02 -0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.07 1c7y h ALA 88 Cb 0.28 -0.05 -0.11 0.00 0.00 0.00 0.00 17.79 17.91 1c7y h ALA 88 CO 0.00 -0.32 0.17 0.82 0.00 0.00 0.00 179.25 179.93 1c7y h ILE 89 N 0.21 0.54 -0.26 0.00 2.04 0.12 0.27 117.51 120.43 1c7y h ILE 89 Ca 0.07 -0.09 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 1c7y h ILE 89 Cb -0.01 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.30 1c7y h ILE 89 CO -0.03 0.05 0.03 0.18 0.00 0.00 0.00 178.15 178.38 1c7y n LEU 90 N -5.15 3.14 -0.03 1.44 4.77 0.38 -2.39 117.00 119.16 1c7y n LEU 90 Ca 0.13 -1.60 -0.04 0.00 -0.03 0.00 0.00 56.01 54.47 1c7y n LEU 90 Cb 0.43 -0.59 -0.04 0.00 -2.33 0.00 0.00 43.42 40.90 1c7y n LEU 90 CO 0.13 0.44 -0.73 -1.20 -1.33 0.00 0.00 177.39 174.70 1c7y n SER 91 N 0.22 3.44 0.07 -1.43 7.64 0.86 -2.96 113.62 121.46 1c7y n SER 91 Ca 0.13 -0.02 -0.21 0.00 1.01 0.00 0.00 58.87 59.77 1c7y n SER 91 Cb 0.68 0.25 -0.13 0.00 -1.01 0.00 0.00 64.21 64.01 1c7y n SER 91 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1c7y h GLY 92 N 0.90 0.64 -4.98 0.23 0.00 -1.27 -3.40 103.07 95.18 1c7y h GLY 92 Ca -0.17 -1.31 -0.18 0.00 0.00 0.00 0.00 47.33 45.67 1c7y h GLY 92 CO -0.01 1.15 -0.70 -3.16 0.00 0.00 0.00 176.54 173.82 1c7y s MET 93 N -2.99 0.32 0.65 4.80 0.00 -1.00 -5.08 119.30 116.00 1c7y s MET 93 Ca -0.10 -0.60 -0.11 0.00 0.00 0.00 0.00 55.69 54.88 1c7y s MET 93 Cb 0.05 0.06 -0.02 0.00 0.00 0.00 0.00 34.83 34.92 1c7y s MET 93 CO 0.91 -0.04 1.04 -1.54 0.00 0.00 0.00 175.02 175.39 1c7y s SER 94 N -1.41 5.95 0.31 -1.18 1.04 -1.26 -4.07 113.70 113.07 1c7y s SER 94 Ca -0.15 1.44 0.05 0.00 0.48 0.00 0.00 55.95 57.78 1c7y s SER 94 Cb -0.10 -2.43 0.84 0.00 0.10 0.00 0.00 66.02 64.43 1c7y s SER 94 CO -0.01 -1.06 1.60 0.00 0.98 0.00 0.00 173.24 174.76 1c7y h ALA 95 N -0.45 1.38 0.32 5.32 0.00 -1.95 0.35 119.26 124.23 1c7y h ALA 95 Ca -0.44 0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1c7y h ALA 95 Cb 1.20 0.45 0.00 0.00 0.00 0.00 0.00 17.79 19.44 1c7y h ALA 95 CO 0.61 -0.60 -0.15 1.96 0.00 0.00 0.00 179.25 181.07 1c7y h GLN 96 N 0.08 -0.41 -1.82 0.00 1.08 -1.97 -0.85 115.11 111.22 1c7y h GLN 96 Ca 0.62 0.03 0.54 0.00 -1.45 0.00 0.00 58.65 58.39 1c7y h GLN 96 Cb 1.36 0.09 -0.08 0.00 -0.05 0.00 0.00 27.48 28.80 1c7y h GLN 96 CO -0.80 -0.27 1.30 1.96 -0.95 0.00 0.00 178.83 180.07 1c7y h GLN 97 N -0.47 0.01 0.02 1.46 4.20 -1.29 0.54 115.11 119.57 1c7y h GLN 97 Ca -0.04 -0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 1c7y h GLN 97 Cb 0.33 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.11 1c7y h GLN 97 CO 0.07 0.00 -0.01 0.35 -0.67 0.00 0.00 178.83 178.57 1c7y h PHE 98 N 0.01 -0.03 -0.18 2.96 3.57 -0.21 -1.73 116.94 121.33 1c7y h PHE 98 Ca 0.89 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 62.43 1c7y h PHE 98 Cb 3.50 0.01 -0.07 0.00 2.79 0.00 0.00 35.95 42.18 1c7y h PHE 98 CO -0.00 0.71 -0.50 0.28 -2.23 0.00 0.00 178.31 176.56 1c7y h VAL 99 N -0.91 0.05 -0.72 1.41 2.07 0.14 0.28 116.25 118.57 1c7y h VAL 99 Ca -0.00 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.64 1c7y h VAL 99 Cb 0.75 0.05 -0.13 0.00 -1.52 0.00 0.00 31.29 30.43 1c7y h VAL 99 CO 0.00 0.00 -0.34 0.78 0.02 0.00 0.00 177.57 178.04 1c7y h ASN 100 N -0.53 -1.20 -0.83 0.57 -0.26 -0.70 0.11 115.58 112.75 1c7y h ASN 100 Ca 0.06 0.25 -0.00 0.00 -0.56 0.00 0.00 56.30 56.05 1c7y h ASN 100 Cb 0.66 0.62 -0.04 0.00 -1.06 0.00 0.00 38.32 38.50 1c7y h ASN 100 CO -0.45 -0.30 0.52 0.00 -1.06 0.00 0.00 177.43 176.14 1c7y h ALA 101 N 1.18 1.05 -0.10 -0.83 0.00 -0.25 0.95 119.26 121.26 1c7y h ALA 101 Ca 0.28 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.96 1c7y h ALA 101 Cb 0.57 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1c7y h ALA 101 CO -0.78 0.50 -0.59 -0.39 0.00 0.00 0.00 179.25 177.99 1c7y h VAL 102 N 1.13 1.36 -0.00 0.00 -1.51 0.16 0.33 116.25 117.71 1c7y h VAL 102 Ca 0.30 -1.92 0.00 0.00 -1.23 0.00 0.00 66.70 63.85 1c7y h VAL 102 Cb -0.07 1.94 0.00 0.00 -2.13 0.00 0.00 31.29 31.02 1c7y h VAL 102 CO -0.06 0.58 -0.18 -0.62 -1.23 0.00 0.00 177.57 176.06 1c7y n GLU 103 N -3.90 0.63 -0.00 5.19 1.02 0.18 -3.13 120.64 120.63 1c7y n GLU 103 Ca -0.03 -0.27 0.00 0.00 -0.02 0.00 0.00 57.16 56.84 1c7y n GLU 103 Cb 0.61 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.54 1c7y n GLU 103 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1c7y n ARG 104 N -0.94 2.75 -4.31 3.49 1.74 0.29 -5.01 116.66 114.68 1c7y n ARG 104 Ca 0.13 -1.45 -0.33 0.00 -0.77 0.00 0.00 57.85 55.43 1c7y n ARG 104 Cb 0.31 -1.00 -0.08 0.00 -1.02 0.00 0.00 32.46 30.66 1c7y n ARG 104 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1c7y n GLU 105 N -0.45 -1.38 -1.80 5.56 1.02 0.93 -4.82 120.64 119.70 1c7y n GLU 105 Ca 0.00 0.16 -0.41 0.00 -0.02 0.00 0.00 57.16 56.89 1c7y n GLU 105 Cb 0.24 -4.04 -0.00 0.00 -0.02 0.00 0.00 31.44 27.61 1c7y n GLU 105 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1c7y n GLU 106 N -4.44 3.26 -0.10 3.49 1.02 0.02 -4.74 120.64 119.15 1c7y n GLU 106 Ca -0.21 -2.78 -0.06 0.00 -0.02 0.00 0.00 57.16 54.10 1c7y n GLU 106 Cb 0.63 -3.09 0.02 0.00 -0.02 0.00 0.00 31.44 28.98 1c7y n GLU 106 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1c7y h VAL 107 N 3.69 0.79 -0.02 2.62 2.07 -1.88 -3.11 116.25 120.40 1c7y h VAL 107 Ca 0.59 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 68.06 1c7y h VAL 107 Cb 0.56 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1c7y h VAL 107 CO 1.79 0.03 -0.01 0.61 0.02 0.00 0.00 177.57 180.01 1c7y n GLY 108 N -1.24 -2.27 0.31 2.17 0.00 -1.26 0.21 105.19 103.11 1c7y n GLY 108 Ca 0.02 0.44 0.08 0.00 0.00 0.00 0.00 46.02 46.56 1c7y n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c7y h ALA 109 N -0.69 0.88 -0.54 4.61 0.00 -1.96 0.50 119.26 122.05 1c7y h ALA 109 Ca 0.00 0.29 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 1c7y h ALA 109 Cb 0.01 0.52 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1c7y h ALA 109 CO -0.02 -0.46 0.15 -0.07 0.00 0.00 0.00 179.25 178.85 1c7y h LEU 110 N 0.06 0.76 -0.32 0.00 3.38 -0.26 -3.12 115.31 115.81 1c7y h LEU 110 Ca 0.48 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.30 1c7y h LEU 110 Cb 0.87 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1c7y h LEU 110 CO -0.79 0.73 0.11 0.58 0.09 0.00 0.00 178.44 179.17 1c7y h VAL 111 N 0.80 1.19 0.00 1.22 2.07 0.94 -2.24 116.25 120.23 1c7y h VAL 111 Ca 0.18 -0.60 0.00 0.00 0.82 0.00 0.00 66.70 67.09 1c7y h VAL 111 Cb 0.26 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 1c7y h VAL 111 CO -0.01 0.21 0.01 2.29 0.02 0.00 0.00 177.57 180.10 1c7y n LYS 112 N -4.70 0.01 -2.16 1.57 2.85 -1.04 -4.53 118.16 110.17 1c7y n LYS 112 Ca -0.02 0.50 -0.41 0.00 -1.05 0.00 0.00 58.31 57.34 1c7y n LYS 112 Cb 0.15 -1.56 -0.03 0.00 -0.65 0.00 0.00 35.03 32.94 1c7y n LYS 112 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1c7y s LEU 113 N -3.14 4.43 -0.35 -5.58 1.43 -0.84 -4.91 118.68 109.72 1c7y s LEU 113 Ca -0.00 2.58 -0.27 0.00 -1.03 0.00 0.00 54.13 55.40 1c7y s LEU 113 Cb 0.01 -3.63 -0.05 0.00 0.03 0.00 0.00 46.19 42.54 1c7y s LEU 113 CO 0.02 -0.53 2.22 -2.16 0.23 0.00 0.00 176.35 176.14 1c7y s PRO 114 N -1.10 2.76 0.00 1.29 0.04 -1.26 -1.35 135.00 135.38 1c7y s PRO 114 Ca 0.52 1.66 0.00 0.00 0.04 0.00 0.00 61.00 63.23 1c7y s PRO 114 Cb -0.39 -4.43 0.00 0.00 0.04 0.00 0.00 34.50 29.72 1c7y s PRO 114 CO 0.47 -2.53 0.00 0.41 0.04 0.00 0.00 177.00 175.38 1c7y n GLY 115 N 5.81 0.37 2.97 0.56 0.00 -1.26 -4.99 105.19 108.65 1c7y n GLY 115 Ca 0.31 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.02 1c7y n GLY 115 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c7y s ILE 116 N -2.04 3.02 0.00 -0.61 -1.09 -0.46 -5.04 121.20 114.99 1c7y s ILE 116 Ca 0.00 -3.61 0.00 0.00 -2.23 0.00 0.00 60.65 54.81 1c7y s ILE 116 Cb 0.00 -3.01 0.00 0.00 -1.58 0.00 0.00 42.46 37.87 1c7y s ILE 116 CO 0.00 -0.90 0.00 0.61 -1.23 0.00 0.00 174.94 173.42 1c7y n GLY 117 N 2.75 -0.04 0.41 6.18 0.00 -1.26 -3.93 105.19 109.30 1c7y n GLY 117 Ca 0.11 -1.80 0.27 0.00 0.00 0.00 0.00 46.02 44.60 1c7y n GLY 117 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1c7y h LYS 118 N 0.00 0.29 0.69 1.61 3.64 -1.95 -0.68 116.57 120.17 1c7y h LYS 118 Ca 0.00 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 1c7y h LYS 118 Cb 0.00 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1c7y h LYS 118 CO 0.00 0.19 -0.33 -0.22 -2.27 0.00 0.00 179.45 176.82 1c7y h LYS 119 N 0.30 -0.89 -0.37 1.90 1.63 -2.00 0.32 116.57 117.45 1c7y h LYS 119 Ca 0.68 0.06 -0.14 0.00 -0.85 0.00 0.00 60.65 60.40 1c7y h LYS 119 Cb 1.83 0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 33.65 1c7y h LYS 119 CO -0.37 -0.59 -0.32 1.79 -3.45 0.00 0.00 179.45 176.50 1c7y h THR 120 N -0.93 1.28 -0.68 1.00 1.35 -1.90 -2.46 112.91 110.58 1c7y h THR 120 Ca -0.09 -1.47 0.09 0.00 -0.55 0.00 0.00 66.41 64.38 1c7y h THR 120 Cb 0.71 1.33 -0.11 0.00 -1.73 0.00 0.00 68.15 68.34 1c7y h THR 120 CO 0.16 0.49 -0.48 0.00 -0.25 0.00 0.00 175.52 175.43 1c7y h ALA 121 N 0.95 -0.40 -0.14 6.62 0.00 -0.94 0.23 119.26 125.58 1c7y h ALA 121 Ca 0.07 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1c7y h ALA 121 Cb 0.87 1.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.73 1c7y h ALA 121 CO 0.08 -0.87 0.09 0.93 0.00 0.00 0.00 179.25 179.47 1c7y h GLU 122 N -0.19 0.18 -0.73 0.00 5.08 -0.76 -2.74 114.58 115.42 1c7y h GLU 122 Ca 0.18 -0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.65 1c7y h GLU 122 Cb 0.54 -0.04 -0.13 0.00 0.50 0.00 0.00 28.75 29.62 1c7y h GLU 122 CO -0.76 0.13 -0.31 0.00 -1.00 0.00 0.00 179.01 177.07 1c7y h ARG 123 N 0.18 -0.09 0.00 2.33 3.08 -0.49 0.11 114.38 119.50 1c7y h ARG 123 Ca 0.05 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1c7y h ARG 123 Cb -0.01 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1c7y h ARG 123 CO -0.01 -0.06 0.00 1.28 -1.07 0.00 0.00 179.97 180.11 1c7y n LEU 124 N -5.46 0.00 -0.57 3.04 7.99 0.60 -0.17 117.00 122.42 1c7y n LEU 124 Ca 0.07 0.46 0.45 0.00 -0.01 0.00 0.00 56.01 56.99 1c7y n LEU 124 Cb 0.38 0.00 0.72 0.00 -0.11 0.00 0.00 43.42 44.41 1c7y n LEU 124 CO -0.03 0.00 1.31 2.30 -1.51 0.00 0.00 177.39 179.46 1c7y n ILE 125 N -0.75 -0.12 0.03 -0.08 -5.35 -1.00 -0.41 119.36 111.69 1c7y n ILE 125 Ca 0.00 1.58 -0.02 0.00 -0.27 0.00 0.00 62.75 64.05 1c7y n ILE 125 Cb 0.00 -2.61 -0.01 0.00 -1.74 0.00 0.00 39.64 35.28 1c7y n ILE 125 CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 1c7y h VAL 126 N 0.00 0.00 -0.06 7.28 2.07 0.10 -2.76 116.25 122.88 1c7y h VAL 126 Ca 0.88 -0.21 0.02 0.00 0.82 0.00 0.00 66.70 68.20 1c7y h VAL 126 Cb 3.20 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 32.97 1c7y h VAL 126 CO -0.22 0.00 0.09 -0.33 0.02 0.00 0.00 177.57 177.13 1c7y h GLU 127 N -0.33 0.00 0.10 1.57 3.07 0.27 -3.13 114.58 116.14 1c7y h GLU 127 Ca -0.01 0.00 -0.33 0.00 -0.50 0.00 0.00 59.36 58.52 1c7y h GLU 127 Cb 0.09 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 27.98 1c7y h GLU 127 CO 0.02 0.00 -1.72 0.52 -1.40 0.00 0.00 179.01 176.42 1c7y h MET 128 N 0.00 0.22 0.00 2.33 2.86 -0.86 -3.42 114.93 116.06 1c7y h MET 128 Ca 0.03 -0.38 0.00 0.00 -2.06 0.00 0.00 59.70 57.29 1c7y h MET 128 Cb 0.22 0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.02 1c7y h MET 128 CO -0.00 1.05 0.00 1.17 1.06 0.00 0.00 176.91 180.19 1c7y n LYS 129 N -3.40 0.00 -0.24 1.72 4.81 -1.04 -2.31 118.16 117.71 1c7y n LYS 129 Ca -0.22 0.69 -0.06 0.00 -0.87 0.00 0.00 58.31 57.86 1c7y n LYS 129 Cb 1.05 -1.32 -0.05 0.00 0.02 0.00 0.00 35.03 34.73 1c7y n LYS 129 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1c7y n ASP 130 N -2.07 -0.57 -0.07 3.14 5.68 -1.26 0.31 116.55 121.71 1c7y n ASP 130 Ca 0.00 1.01 -0.10 0.00 -0.50 0.00 0.00 54.79 55.20 1c7y n ASP 130 Cb 0.00 -0.14 -0.04 0.00 -1.14 0.00 0.00 41.12 39.80 1c7y n ASP 130 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 1c7y h ARG 131 N 0.00 -0.34 0.00 0.11 3.08 -1.78 -3.42 114.38 112.03 1c7y h ARG 131 Ca 0.10 0.02 -0.11 0.00 0.07 0.00 0.00 59.98 60.06 1c7y h ARG 131 Cb 0.25 0.08 0.07 0.00 0.08 0.00 0.00 29.97 30.44 1c7y h ARG 131 CO -0.54 -0.23 -0.06 1.19 -1.07 0.00 0.00 179.97 179.27 1c7y n PHE 132 N -5.42 -2.20 -2.14 3.04 0.99 0.15 -4.45 117.46 107.43 1c7y n PHE 132 Ca -0.01 -0.19 0.00 0.00 -0.00 0.00 0.00 57.45 57.25 1c7y n PHE 132 Cb 0.35 -0.54 0.00 0.00 -1.00 0.00 0.00 39.48 38.28 1c7y n PHE 132 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.76 177.93 1c7y n LYS 133 N -2.38 -3.04 0.00 -1.08 3.00 -1.26 -4.71 118.16 108.69 1c7y n LYS 133 Ca 0.04 2.19 0.00 0.00 -0.00 0.00 0.00 58.31 60.54 1c7y n LYS 133 Cb 0.19 -2.87 0.00 0.00 0.00 0.00 0.00 35.03 32.34 1c7y n LYS 133 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1c7y n GLY 134 N 1.89 0.62 0.13 3.14 0.00 -1.26 -4.74 105.19 104.98 1c7y n GLY 134 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 1c7y n GLY 134 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1c7y h LEU 135 N 0.00 0.00 -2.21 0.99 4.07 -1.84 -3.46 115.31 112.87 1c7y h LEU 135 Ca 0.00 0.00 -0.51 0.00 0.08 0.00 0.00 57.88 57.45 1c7y h LEU 135 Cb 0.00 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 41.69 1c7y h LEU 135 CO 0.00 0.63 -0.91 1.41 -1.08 0.00 0.00 178.44 178.49 1c7y n HIS 136 N -3.56 -1.62 0.00 1.13 8.25 -1.26 -1.75 115.22 116.40 1c7y n HIS 136 Ca -0.00 0.66 0.00 0.00 -0.26 0.00 0.00 57.72 58.11 1c7y n HIS 136 Cb 0.68 -3.55 0.00 0.00 1.12 0.00 0.00 29.99 28.23 1c7y n HIS 136 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1c7y n GLY 137 N -2.02 2.39 3.75 -1.41 0.00 -1.26 -4.97 105.19 101.67 1c7y n GLY 137 Ca -0.28 -0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 1c7y n GLY 137 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1c7y s ASP 138 N 0.04 6.42 0.02 1.61 -1.08 -0.72 -4.85 116.67 118.11 1c7y s ASP 138 Ca 0.00 0.49 0.28 0.00 -0.52 0.00 0.00 52.55 52.80 1c7y s ASP 138 Cb 0.00 -2.16 1.08 0.00 -1.46 0.00 0.00 42.92 40.38 1c7y s ASP 138 CO 0.00 0.16 1.83 -0.11 0.52 0.00 0.00 175.17 177.57 1c7y n LEU 139 N 3.27 0.16 -0.50 -1.34 7.94 -1.26 -3.65 117.00 121.62 1c7y n LEU 139 Ca -0.14 0.43 0.07 0.00 -1.11 0.00 0.00 56.01 55.27 1c7y n LEU 139 Cb 0.52 -0.44 0.17 0.00 0.53 0.00 0.00 43.42 44.21 1c7y n LEU 139 CO 0.38 0.00 0.63 0.49 -1.11 0.00 0.00 177.39 177.78 1c7y n PHE 140 N -1.58 0.47 -1.68 1.96 3.01 -1.26 -4.75 117.46 113.63 1c7y n PHE 140 Ca 0.07 -0.81 -0.34 0.00 1.01 0.00 0.00 57.45 57.38 1c7y n PHE 140 Cb 0.35 -0.19 0.06 0.00 -0.01 0.00 0.00 39.48 39.70 1c7y n PHE 140 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1c7y s THR 141 N -2.32 2.65 0.16 4.37 -4.23 -1.24 -4.87 115.64 110.16 1c7y s THR 141 Ca 0.31 0.34 -0.33 0.00 -1.18 0.00 0.00 61.69 60.83 1c7y s THR 141 Cb 0.24 -2.94 -0.17 0.00 1.34 0.00 0.00 72.50 70.98 1c7y s THR 141 CO 0.07 -0.15 0.98 -2.65 -0.54 0.00 0.00 174.62 172.33 1c7y n PRO 142 N -2.32 0.70 -3.72 3.99 -0.02 -1.26 -2.98 135.00 129.38 1c7y n PRO 142 Ca 0.13 0.25 -0.23 0.00 -2.02 0.00 0.00 63.50 61.62 1c7y n PRO 142 Cb 0.51 -1.62 0.04 0.00 -0.02 0.00 0.00 33.50 32.41 1c7y n PRO 142 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1c7y n ALA 143 N 1.03 -1.81 -0.18 3.55 0.00 -1.26 -4.91 120.51 116.94 1c7y n ALA 143 Ca 0.16 -0.04 -0.06 0.00 0.00 0.00 0.00 53.44 53.50 1c7y n ALA 143 Cb 0.22 -2.77 0.04 0.00 0.00 0.00 0.00 19.45 16.94 1c7y n ALA 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1c7y h ALA 144 N 0.90 0.68 0.00 0.00 0.00 -1.83 -2.07 119.26 116.94 1c7y h ALA 144 Ca -0.60 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.25 1c7y h ALA 144 Cb 1.36 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1c7y h ALA 144 CO 0.58 0.05 -0.22 0.38 0.00 0.00 0.00 179.25 180.04 1c7y h ASP 145 N 0.65 0.00 -0.26 0.00 2.03 -1.90 -0.71 116.42 116.22 1c7y h ASP 145 Ca 0.21 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 56.49 1c7y h ASP 145 Cb 0.00 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.49 1c7y h ASP 145 CO -0.08 0.22 0.08 -0.07 -1.03 0.00 0.00 179.24 178.36 1c7y h LEU 146 N 0.00 0.39 0.32 0.15 3.38 -1.80 1.05 115.31 118.80 1c7y h LEU 146 Ca -0.00 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 1c7y h LEU 146 Cb 0.73 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 1c7y h LEU 146 CO 0.03 0.49 -0.50 0.58 0.09 0.00 0.00 178.44 179.13 1c7y h VAL 147 N 0.26 0.00 0.09 1.22 2.07 -0.72 0.63 116.25 119.81 1c7y h VAL 147 Ca 0.09 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.60 1c7y h VAL 147 Cb 0.24 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.00 1c7y h VAL 147 CO -0.00 0.00 -0.13 -0.07 0.02 0.00 0.00 177.57 177.39 1c7y h LEU 148 N -0.86 -0.36 -1.81 2.57 3.38 -1.02 -3.29 115.31 113.92 1c7y h LEU 148 Ca -0.04 0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.07 1c7y h LEU 148 Cb 0.80 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.64 1c7y h LEU 148 CO -0.16 -0.16 0.34 0.00 0.09 0.00 0.00 178.44 178.55 1c7y h THR 149 N -0.23 0.86 0.00 0.22 1.03 0.12 -3.47 112.91 111.44 1c7y h THR 149 Ca -0.01 -0.07 0.00 0.00 -0.01 0.00 0.00 66.41 66.32 1c7y h THR 149 Cb 0.21 0.62 0.00 0.00 -1.07 0.00 0.00 68.15 67.91 1c7y h THR 149 CO -0.03 0.04 0.00 -1.54 -0.01 0.00 0.00 175.52 173.97 1c7y n SER 150 N -4.45 0.00 -4.45 0.00 3.41 0.22 -5.02 113.62 103.34 1c7y n SER 150 Ca 0.08 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.26 1c7y n SER 150 Cb 0.41 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.32 1c7y n SER 150 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1c7y s ALA 155 N -4.66 3.19 0.05 7.33 0.00 -1.26 -4.83 121.76 121.59 1c7y s ALA 155 Ca 0.00 -1.82 -0.02 0.00 0.00 0.00 0.00 51.96 50.11 1c7y s ALA 155 Cb 0.00 -3.74 0.01 0.00 0.00 0.00 0.00 23.12 19.39 1c7y s ALA 155 CO 0.00 -2.59 0.12 0.25 0.00 0.00 0.00 175.76 173.55 1c7y n THR 156 N 5.87 0.00 -1.97 0.00 -2.24 -1.26 -5.15 114.28 109.52 1c7y n THR 156 Ca -0.04 -0.13 -0.35 0.00 -2.27 0.00 0.00 64.05 61.26 1c7y n THR 156 Cb 0.45 0.13 0.03 0.00 -2.10 0.00 0.00 70.33 68.85 1c7y n THR 156 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1c7y s ASP 157 N -1.31 5.27 0.25 3.42 -1.08 -1.26 -4.87 116.67 117.09 1c7y s ASP 157 Ca 0.03 2.18 -0.03 0.00 -0.52 0.00 0.00 52.55 54.20 1c7y s ASP 157 Cb -0.01 -2.58 0.42 0.00 -1.46 0.00 0.00 42.92 39.30 1c7y s ASP 157 CO 0.01 -1.52 1.83 0.44 0.52 0.00 0.00 175.17 176.45 1c7y h ASP 158 N 0.62 0.79 0.63 -0.34 5.19 -1.98 -0.68 116.42 120.66 1c7y h ASP 158 Ca -0.49 0.04 -0.13 0.00 -0.62 0.00 0.00 57.03 55.83 1c7y h ASP 158 Cb 1.27 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 40.64 1c7y h ASP 158 CO 0.55 0.46 -0.60 0.00 -3.12 0.00 0.00 179.24 176.53 1c7y h ALA 159 N 1.46 0.99 -0.20 3.45 0.00 -1.85 -2.35 119.26 120.75 1c7y h ALA 159 Ca 0.42 -0.55 -0.17 0.00 0.00 0.00 0.00 54.91 54.61 1c7y h ALA 159 Cb 0.34 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1c7y h ALA 159 CO -0.23 0.75 -0.55 0.93 0.00 0.00 0.00 179.25 180.15 1c7y h GLU 160 N 0.00 0.62 0.77 0.00 5.08 -1.50 -2.02 114.58 117.52 1c7y h GLU 160 Ca -0.01 -0.39 -0.04 0.00 -1.00 0.00 0.00 59.36 57.93 1c7y h GLU 160 Cb 1.08 0.05 0.01 0.00 0.50 0.00 0.00 28.75 30.38 1c7y h GLU 160 CO 0.08 1.00 -0.38 1.96 -1.00 0.00 0.00 179.01 180.67 1c7y h GLN 161 N 0.47 -1.01 -0.74 2.33 4.20 -1.06 0.13 115.11 119.44 1c7y h GLN 161 Ca 0.01 0.07 0.17 0.00 0.06 0.00 0.00 58.65 58.95 1c7y h GLN 161 Cb 1.11 0.23 -0.12 0.00 0.30 0.00 0.00 27.48 29.00 1c7y h GLN 161 CO 0.11 -0.67 0.11 1.49 -0.67 0.00 0.00 178.83 179.19 1c7y h GLU 162 N -1.05 0.19 -0.41 1.46 4.81 -1.41 0.24 114.58 118.41 1c7y h GLU 162 Ca -0.10 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.05 1c7y h GLU 162 Cb 0.81 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1c7y h GLU 162 CO 0.16 0.12 0.01 0.00 -0.73 0.00 0.00 179.01 178.58 1c7y h ALA 163 N 1.65 0.55 -0.52 2.92 0.00 -1.08 -0.42 119.26 122.36 1c7y h ALA 163 Ca 0.41 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1c7y h ALA 163 Cb 0.72 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1c7y h ALA 163 CO -0.57 0.32 0.14 0.28 0.00 0.00 0.00 179.25 179.42 1c7y h VAL 164 N 0.55 1.21 0.19 0.00 2.07 0.47 -1.11 116.25 119.63 1c7y h VAL 164 Ca 0.12 -0.75 0.01 0.00 0.82 0.00 0.00 66.70 66.90 1c7y h VAL 164 Cb 0.46 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 1c7y h VAL 164 CO 0.02 0.28 -0.39 0.00 0.02 0.00 0.00 177.57 177.50 1c7y h ALA 165 N 1.40 -0.72 -0.83 1.67 0.00 0.13 -0.99 119.26 119.92 1c7y h ALA 165 Ca 0.17 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.03 1c7y h ALA 165 Cb 0.26 0.62 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 1c7y h ALA 165 CO -0.00 -0.96 0.53 0.00 0.00 0.00 0.00 179.25 178.82 1c7y h ALA 166 N -0.16 1.08 -0.35 0.00 0.00 -0.70 -1.14 119.26 117.99 1c7y h ALA 166 Ca 0.01 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1c7y h ALA 166 Cb 0.66 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1c7y h ALA 166 CO -0.18 0.37 0.03 -0.07 0.00 0.00 0.00 179.25 179.39 1c7y h LEU 167 N 1.04 0.49 -0.58 0.00 3.38 -0.99 0.11 115.31 118.77 1c7y h LEU 167 Ca 0.33 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 1c7y h LEU 167 Cb -0.01 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 1c7y h LEU 167 CO -0.11 0.55 -0.04 0.58 0.09 0.00 0.00 178.44 179.51 1c7y h VAL 168 N 0.51 0.07 -0.01 1.22 2.07 -0.15 -1.72 116.25 118.24 1c7y h VAL 168 Ca 0.11 -0.89 -0.15 0.00 0.82 0.00 0.00 66.70 66.59 1c7y h VAL 168 Cb 0.29 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 1c7y h VAL 168 CO 0.01 0.03 -0.69 0.00 0.02 0.00 0.00 177.57 176.94 1c7y h ALA 169 N 1.96 0.82 -0.00 1.67 0.00 0.31 -3.00 119.26 121.02 1c7y h ALA 169 Ca -0.00 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1c7y h ALA 169 Cb 0.83 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1c7y h ALA 169 CO 0.00 0.83 -0.02 1.28 0.00 0.00 0.00 179.25 181.34 1c7y n LEU 170 N -3.75 0.09 0.00 0.00 4.77 -0.40 -4.92 117.00 112.79 1c7y n LEU 170 Ca -0.02 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1c7y n LEU 170 Cb 0.68 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1c7y n LEU 170 CO 0.44 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1c7y n GLY 171 N 1.28 1.84 3.77 -0.72 0.00 -1.13 -5.09 105.19 105.14 1c7y n GLY 171 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 1c7y n GLY 171 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1c7y s TYR 172 N -2.08 2.96 0.48 1.61 2.02 -0.68 -4.98 117.35 116.68 1c7y s TYR 172 Ca 0.00 1.52 -0.20 0.00 -0.37 0.00 0.00 57.07 58.02 1c7y s TYR 172 Cb 0.00 -3.44 -0.08 0.00 -0.40 0.00 0.00 41.96 38.04 1c7y s TYR 172 CO 0.00 -1.52 1.04 0.15 -1.57 0.00 0.00 175.55 173.65 1c7y s LYS 173 N -2.41 3.80 0.31 -0.62 1.02 -1.26 -4.21 119.74 116.37 1c7y s LYS 173 Ca 0.59 1.38 0.07 0.00 0.02 0.00 0.00 55.97 58.03 1c7y s LYS 173 Cb -0.31 -2.11 0.77 0.00 -0.52 0.00 0.00 37.83 35.66 1c7y s LYS 173 CO 0.39 -0.44 1.78 -1.00 -0.92 0.00 0.00 175.35 175.16 1c7y h PRO 174 N 1.59 0.71 0.75 -1.68 0.13 -1.95 0.76 132.00 132.31 1c7y h PRO 174 Ca -0.49 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 64.56 1c7y h PRO 174 Cb 1.22 -0.16 -0.00 0.00 0.13 0.00 0.00 31.00 32.19 1c7y h PRO 174 CO 0.59 0.47 -0.44 1.96 -0.23 0.00 0.00 178.00 180.36 1c7y h GLN 175 N 0.73 -1.06 -0.55 0.86 4.20 -1.99 -0.09 115.11 117.20 1c7y h GLN 175 Ca 0.58 0.07 0.11 0.00 0.06 0.00 0.00 58.65 59.46 1c7y h GLN 175 Cb 0.94 0.24 -0.11 0.00 0.30 0.00 0.00 27.48 28.85 1c7y h GLN 175 CO -0.37 -0.71 -0.28 1.49 -0.67 0.00 0.00 178.83 178.29 1c7y h GLU 176 N -1.11 -0.13 -0.08 1.46 4.81 -1.59 0.66 114.58 118.60 1c7y h GLU 176 Ca -0.10 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.17 1c7y h GLU 176 Cb 0.88 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.26 1c7y h GLU 176 CO 0.11 -0.09 -0.11 0.00 -0.73 0.00 0.00 179.01 178.20 1c7y h ALA 177 N 1.14 -0.06 0.55 2.92 0.00 0.69 0.42 119.26 124.93 1c7y h ALA 177 Ca 0.24 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 1c7y h ALA 177 Cb 0.52 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1c7y h ALA 177 CO -0.64 -0.58 -0.29 0.77 0.00 0.00 0.00 179.25 178.51 1c7y h SER 178 N -0.15 -0.71 -0.90 0.00 0.02 0.67 -1.44 113.55 111.03 1c7y h SER 178 Ca 0.07 0.03 0.24 0.00 -0.84 0.00 0.00 61.79 61.29 1c7y h SER 178 Cb 0.24 0.20 -0.13 0.00 0.14 0.00 0.00 62.40 62.85 1c7y h SER 178 CO -0.17 -0.48 0.36 0.08 -1.14 0.00 0.00 176.83 175.49 1c7y h ARG 179 N -0.78 0.31 -0.66 3.45 0.11 -0.89 0.13 114.38 116.07 1c7y h ARG 179 Ca -0.08 -0.02 0.04 0.00 0.10 0.00 0.00 59.98 60.02 1c7y h ARG 179 Cb 0.61 -0.07 -0.04 0.00 1.11 0.00 0.00 29.97 31.57 1c7y h ARG 179 CO 0.11 0.21 0.40 0.52 0.10 0.00 0.00 179.97 181.30 1c7y h MET 180 N 0.32 0.74 0.55 0.08 2.86 0.28 -1.21 114.93 118.55 1c7y h MET 180 Ca 0.58 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 58.15 1c7y h MET 180 Cb 1.15 -0.17 0.01 0.00 0.06 0.00 0.00 31.60 32.65 1c7y h MET 180 CO -0.58 0.49 -0.26 0.28 1.06 0.00 0.00 176.91 177.90 1c7y h VAL 181 N 0.77 0.00 -0.95 -2.22 2.07 0.32 -3.25 116.25 112.98 1c7y h VAL 181 Ca 0.27 -0.30 0.22 0.00 0.82 0.00 0.00 66.70 67.71 1c7y h VAL 181 Cb 0.06 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 29.71 1c7y h VAL 181 CO -0.12 0.00 0.51 0.77 0.02 0.00 0.00 177.57 178.75 1c7y h SER 182 N -1.04 0.56 -1.20 0.57 4.64 -1.35 0.83 113.55 116.56 1c7y h SER 182 Ca -0.08 0.13 0.36 0.00 -0.47 0.00 0.00 61.79 61.73 1c7y h SER 182 Cb 0.57 0.05 -0.11 0.00 -0.31 0.00 0.00 62.40 62.60 1c7y h SER 182 CO 0.12 0.11 0.77 0.50 -0.87 0.00 0.00 176.83 177.46 1c7y h LYS 183 N 0.55 0.21 -0.07 4.77 3.64 -1.25 2.05 116.57 126.47 1c7y h LYS 183 Ca 0.59 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.82 1c7y h LYS 183 Cb 1.06 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.82 1c7y h LYS 183 CO -0.47 0.14 -0.56 0.82 -2.27 0.00 0.00 179.45 177.11 1c7y h ILE 184 N 0.21 1.37 -6.18 2.00 1.08 0.62 -3.49 117.51 113.14 1c7y h ILE 184 Ca 0.71 -1.88 -0.21 0.00 -0.39 0.00 0.00 64.86 63.09 1c7y h ILE 184 Cb 2.10 1.94 0.01 0.00 -3.07 0.00 0.00 36.82 37.81 1c7y h ILE 184 CO -0.35 0.55 -1.02 0.00 -0.69 0.00 0.00 178.15 176.64 1c7y n ALA 185 N -2.46 -2.46 -2.70 1.87 0.00 0.69 -4.97 120.51 110.48 1c7y n ALA 185 Ca -0.02 0.45 -0.06 0.00 0.00 0.00 0.00 53.44 53.81 1c7y n ALA 185 Cb 0.58 -2.12 0.09 0.00 0.00 0.00 0.00 19.45 18.00 1c7y n ALA 185 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1c7y n ARG 186 N 0.15 0.63 0.29 0.00 5.12 -1.26 -4.97 116.66 116.62 1c7y n ARG 186 Ca -0.02 -1.36 0.11 0.00 -1.93 0.00 0.00 57.85 54.65 1c7y n ARG 186 Cb 0.56 -0.53 0.61 0.00 -1.16 0.00 0.00 32.46 31.94 1c7y n ARG 186 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1c7y h PRO 187 N 2.45 0.00 -0.88 5.56 0.13 -1.98 -1.88 132.00 135.40 1c7y h PRO 187 Ca -0.24 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.37 1c7y h PRO 187 Cb 1.17 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.02 1c7y h PRO 187 CO 0.04 0.00 0.52 -0.25 -0.23 0.00 0.00 178.00 178.07 1c7y n ASP 188 N -2.61 4.98 -4.60 1.44 10.43 -1.26 -4.64 116.55 120.29 1c7y n ASP 188 Ca -0.01 -3.71 -0.26 0.00 2.57 0.00 0.00 54.79 53.37 1c7y n ASP 188 Cb 0.42 -0.82 -0.10 0.00 1.84 0.00 0.00 41.12 42.46 1c7y n ASP 188 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1c7y s ALA 189 N -3.49 3.12 0.42 2.24 0.00 -0.71 -5.10 121.76 118.24 1c7y s ALA 189 Ca 0.57 -2.12 -0.26 0.00 0.00 0.00 0.00 51.96 50.16 1c7y s ALA 189 Cb 0.47 -0.10 -0.09 0.00 0.00 0.00 0.00 23.12 23.41 1c7y s ALA 189 CO 0.05 0.01 1.34 0.45 0.00 0.00 0.00 175.76 177.60 1c7y s SER 190 N -3.69 6.18 0.30 0.00 0.15 -1.26 -4.74 113.70 110.63 1c7y s SER 190 Ca 0.34 2.72 0.02 0.00 0.70 0.00 0.00 55.95 59.74 1c7y s SER 190 Cb 0.04 -2.64 0.59 0.00 -1.71 0.00 0.00 66.02 62.29 1c7y s SER 190 CO 0.18 -0.95 1.86 0.77 1.20 0.00 0.00 173.24 176.30 1c7y h SER 191 N 2.56 0.88 -0.72 5.45 4.64 -1.94 0.49 113.55 124.92 1c7y h SER 191 Ca -0.50 0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 60.82 1c7y h SER 191 Cb 1.25 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 63.16 1c7y h SER 191 CO 0.62 0.50 0.33 -0.33 -0.87 0.00 0.00 176.83 177.07 1c7y h GLU 192 N 0.96 1.04 -0.88 4.77 5.08 -1.90 -1.16 114.58 122.49 1c7y h GLU 192 Ca 0.46 -0.17 0.06 0.00 -1.00 0.00 0.00 59.36 58.71 1c7y h GLU 192 Cb 0.44 -0.18 -0.06 0.00 0.50 0.00 0.00 28.75 29.45 1c7y h GLU 192 CO -0.22 0.83 0.57 1.15 -1.00 0.00 0.00 179.01 180.35 1c7y h THR 193 N 1.01 1.08 0.35 1.13 2.02 -1.29 0.12 112.91 117.33 1c7y h THR 193 Ca 0.24 -0.35 -0.02 0.00 0.77 0.00 0.00 66.41 67.06 1c7y h THR 193 Cb 0.15 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.54 1c7y h THR 193 CO -0.03 0.19 -0.17 -0.07 0.37 0.00 0.00 175.52 175.81 1c7y h LEU 194 N 1.02 -0.39 -1.39 2.58 4.07 -0.95 0.35 115.31 120.59 1c7y h LEU 194 Ca 0.37 -0.16 0.30 0.00 0.08 0.00 0.00 57.88 58.47 1c7y h LEU 194 Cb 0.15 0.10 -0.10 0.00 1.08 0.00 0.00 40.66 41.90 1c7y h LEU 194 CO -0.13 0.01 0.70 0.40 -1.08 0.00 0.00 178.44 178.34 1c7y h ILE 195 N -0.88 0.45 -0.00 1.22 2.04 -0.94 0.12 117.51 119.53 1c7y h ILE 195 Ca -0.05 -0.11 -0.07 0.00 1.00 0.00 0.00 64.86 65.63 1c7y h ILE 195 Cb 0.53 0.10 0.01 0.00 -0.74 0.00 0.00 36.82 36.71 1c7y h ILE 195 CO 0.08 0.06 -0.27 -0.09 0.00 0.00 0.00 178.15 177.93 1c7y h ARG 196 N 0.33 0.19 -0.20 2.37 2.43 -0.36 -2.36 114.38 116.77 1c7y h ARG 196 Ca 0.63 -0.20 -0.05 0.00 -0.81 0.00 0.00 59.98 59.55 1c7y h ARG 196 Cb 1.71 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 31.31 1c7y h ARG 196 CO -0.31 0.93 -0.08 0.93 -1.51 0.00 0.00 179.97 179.94 1c7y h GLU 197 N -0.48 0.41 -0.56 0.20 3.07 0.11 -2.02 114.58 115.31 1c7y h GLU 197 Ca -0.03 -0.17 0.07 0.00 -0.50 0.00 0.00 59.36 58.73 1c7y h GLU 197 Cb 1.02 -0.02 -0.10 0.00 -0.84 0.00 0.00 28.75 28.82 1c7y h GLU 197 CO 0.05 0.68 -0.49 0.00 -1.40 0.00 0.00 179.01 177.85 1c7y h ALA 198 N 0.72 -0.50 0.24 3.43 0.00 -0.95 0.47 119.26 122.66 1c7y h ALA 198 Ca 0.05 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1c7y h ALA 198 Cb 0.55 1.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.36 1c7y h ALA 198 CO 0.03 -0.92 -0.33 -0.07 0.00 0.00 0.00 179.25 177.95 1c7y h LEU 199 N -0.27 -0.93 -1.85 0.00 4.07 -1.35 0.25 115.31 115.23 1c7y h LEU 199 Ca 0.14 0.09 0.33 0.00 0.08 0.00 0.00 57.88 58.52 1c7y h LEU 199 Cb 0.56 0.33 -0.06 0.00 1.08 0.00 0.00 40.66 42.58 1c7y h LEU 199 CO -0.68 -0.45 0.80 -0.09 -1.08 0.00 0.00 178.44 176.94 1c7y h ARG 200 N -0.64 0.09 0.12 1.13 2.43 -0.31 0.33 114.38 117.53 1c7y h ARG 200 Ca 0.00 -0.01 -0.21 0.00 -0.81 0.00 0.00 59.98 58.96 1c7y h ARG 200 Cb 0.61 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 30.15 1c7y h ARG 200 CO -0.12 0.06 -0.98 0.00 -1.51 0.00 0.00 179.97 177.42 1c7y h ALA 201 N 1.47 0.01 -0.96 2.80 0.00 0.17 -3.31 119.26 119.43 1c7y h ALA 201 Ca 0.57 -0.83 0.18 0.00 0.00 0.00 0.00 54.91 54.83 1c7y h ALA 201 Cb 2.08 0.24 -0.09 0.00 0.00 0.00 0.00 17.79 20.02 1c7y h ALA 201 CO -0.08 0.51 0.61 0.00 0.00 0.00 0.00 179.25 180.29 1c7y h ALA 202 N 0.02 1.82 -0.02 0.00 0.00 0.29 -3.51 119.26 117.85 1c7y h ALA 202 Ca -0.19 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1c7y h ALA 202 Cb 1.64 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1c7y h ALA 202 CO 0.10 -0.13 0.00 1.28 0.00 0.00 0.00 179.25 180.50