#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c1u s VAL 17 N 0.00 3.84 -1.37 1.39 1.01 0.11 -4.09 120.40 121.29 1c1u s VAL 17 Ca 0.00 -0.39 -0.08 0.00 0.00 0.00 0.00 61.98 61.51 1c1u s VAL 17 Cb 0.00 -2.65 0.02 0.00 0.00 0.00 0.00 36.38 33.75 1c1u s VAL 17 CO 0.00 0.52 1.13 -0.62 0.00 0.00 0.00 175.10 176.13 1c1u n GLU 18 N 3.18 -7.40 -4.20 2.72 -0.58 -1.26 -2.25 120.64 110.84 1c1u n GLU 18 Ca -0.18 0.79 -0.28 0.00 -0.42 0.00 0.00 57.16 57.08 1c1u n GLU 18 Cb 0.53 -5.81 -0.04 0.00 -0.57 0.00 0.00 31.44 25.55 1c1u n GLU 18 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1c1u s GLY 19 N -3.46 2.57 0.36 0.62 0.00 -1.26 -4.66 107.32 101.48 1c1u s GLY 19 Ca 0.52 -1.16 0.04 0.00 0.00 0.00 0.00 44.72 44.12 1c1u s GLY 19 CO 0.75 -2.01 0.06 -1.35 0.00 0.00 0.00 173.10 170.55 1c1u s SER 20 N -4.08 2.68 0.49 1.64 1.04 0.45 -4.83 113.70 111.09 1c1u s SER 20 Ca 0.27 -1.44 -0.22 0.00 0.48 0.00 0.00 55.95 55.03 1c1u s SER 20 Cb 0.00 0.02 -0.06 0.00 0.10 0.00 0.00 66.02 66.08 1c1u s SER 20 CO 0.16 -0.66 1.24 -1.81 0.98 0.00 0.00 173.24 173.14 1c1u s ASP 21 N -3.55 5.84 0.85 7.02 1.01 -1.26 -0.56 116.67 126.02 1c1u s ASP 21 Ca 0.32 2.48 -0.12 0.00 0.71 0.00 0.00 52.55 55.94 1c1u s ASP 21 Cb 0.07 -2.61 0.14 0.00 1.01 0.00 0.00 42.92 41.53 1c1u s ASP 21 CO 0.15 -1.16 1.20 0.00 0.21 0.00 0.00 175.17 175.57 1c1u s ALA 22 N -1.46 2.65 0.28 5.23 0.00 0.58 -4.74 121.76 124.31 1c1u s ALA 22 Ca 0.66 -1.08 0.06 0.00 0.00 0.00 0.00 51.96 51.60 1c1u s ALA 22 Cb -0.33 -2.71 -0.02 0.00 0.00 0.00 0.00 23.12 20.06 1c1u s ALA 22 CO 0.40 -1.95 0.40 -1.21 0.00 0.00 0.00 175.76 173.39 1c1u s GLU 23 N -5.62 3.27 0.25 0.00 2.02 -1.26 -4.95 118.70 112.41 1c1u s GLU 23 Ca 0.68 -0.89 -0.30 0.00 0.02 0.00 0.00 54.97 54.48 1c1u s GLU 23 Cb -0.07 -2.84 -0.09 0.00 0.10 0.00 0.00 34.13 31.23 1c1u s GLU 23 CO 0.50 0.27 1.27 0.42 0.02 0.00 0.00 175.26 177.73 1c1u s ILE 24 N -2.08 3.12 -0.93 -1.63 -1.09 -1.26 -2.46 121.20 114.87 1c1u s ILE 24 Ca 0.39 1.01 0.00 0.00 -2.23 0.00 0.00 60.65 59.82 1c1u s ILE 24 Cb -0.09 -3.65 0.00 0.00 -1.58 0.00 0.00 42.46 37.14 1c1u s ILE 24 CO 0.30 0.20 0.00 0.61 -1.23 0.00 0.00 174.94 174.81 1c1u n GLY 25 N 1.66 0.99 0.19 6.18 0.00 -1.26 -4.91 105.19 108.03 1c1u n GLY 25 Ca 0.03 -0.28 -0.11 0.00 0.00 0.00 0.00 46.02 45.66 1c1u n GLY 25 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1c1u h MET 26 N 0.12 0.48 -2.12 1.61 -1.53 -1.86 -3.37 114.93 108.26 1c1u h MET 26 Ca -0.18 -0.38 -0.56 0.00 -3.44 0.00 0.00 59.70 55.14 1c1u h MET 26 Cb 0.77 0.08 -0.41 0.00 -0.55 0.00 0.00 31.60 31.49 1c1u h MET 26 CO 0.26 1.01 -0.87 0.43 0.14 0.00 0.00 176.91 177.88 1c1u n SER 27 N -3.86 2.27 0.00 1.39 7.64 -1.26 -4.94 113.62 114.85 1c1u n SER 27 Ca -0.05 -3.18 0.02 0.00 1.01 0.00 0.00 58.87 56.67 1c1u n SER 27 Cb 0.70 -0.63 0.09 0.00 -1.01 0.00 0.00 64.21 63.36 1c1u n SER 27 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1c1u n PRO 28 N 0.70 0.03 0.00 1.43 -0.04 -1.26 -0.27 135.00 135.58 1c1u n PRO 28 Ca 0.27 0.35 0.11 0.00 -0.04 0.00 0.00 63.50 64.19 1c1u n PRO 28 Cb 0.49 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.55 1c1u n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1c1u n TRP 29 N -1.40 0.00 -2.05 0.54 2.14 -1.16 -2.54 117.44 112.97 1c1u n TRP 29 Ca 0.01 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.17 1c1u n TRP 29 Cb 0.04 -0.08 -0.03 0.00 -0.81 0.00 0.00 31.31 30.43 1c1u n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1c1u s GLN 30 N -2.75 4.28 0.20 -2.67 2.00 0.63 -1.61 119.66 119.74 1c1u s GLN 30 Ca 0.15 2.25 0.11 0.00 -2.00 0.00 0.00 55.36 55.87 1c1u s GLN 30 Cb 0.18 -3.14 -0.04 0.00 0.80 0.00 0.00 33.01 30.80 1c1u s GLN 30 CO 0.68 -0.43 -0.23 0.08 -0.50 0.00 0.00 175.29 174.89 1c1u s VAL 31 N 0.32 2.30 -0.10 1.34 1.01 -0.03 -4.25 120.40 120.99 1c1u s VAL 31 Ca 0.61 -2.07 0.04 0.00 0.00 0.00 0.00 61.98 60.56 1c1u s VAL 31 Cb -0.41 -2.11 -0.00 0.00 0.00 0.00 0.00 36.38 33.86 1c1u s VAL 31 CO 0.39 -0.19 -0.24 -0.32 0.00 0.00 0.00 175.10 174.75 1c1u s MET 32 N -2.81 3.06 -0.19 2.72 1.75 -0.41 -1.86 119.30 121.54 1c1u s MET 32 Ca 0.21 -0.88 -0.14 0.00 -1.25 0.00 0.00 55.69 53.64 1c1u s MET 32 Cb -0.07 -2.31 -0.04 0.00 2.84 0.00 0.00 34.83 35.24 1c1u s MET 32 CO 0.10 0.18 0.32 -0.51 -0.65 0.00 0.00 175.02 174.45 1c1u s LEU 33 N 0.35 4.18 -0.06 4.11 1.43 -0.36 -0.91 118.68 127.42 1c1u s LEU 33 Ca -0.19 0.44 0.05 0.00 -1.03 0.00 0.00 54.13 53.40 1c1u s LEU 33 Cb -0.18 -2.39 -0.00 0.00 0.03 0.00 0.00 46.19 43.65 1c1u s LEU 33 CO 0.09 0.02 -0.21 0.12 0.23 0.00 0.00 176.35 176.59 1c1u s PHE 34 N 0.94 2.15 0.12 0.29 5.36 0.32 -0.97 117.98 126.20 1c1u s PHE 34 Ca 0.16 -0.69 -0.22 0.00 -0.96 0.00 0.00 56.93 55.22 1c1u s PHE 34 Cb -0.14 -1.43 -0.07 0.00 -0.34 0.00 0.00 43.02 41.03 1c1u s PHE 34 CO 0.06 -0.24 0.68 0.50 -1.46 0.00 0.00 175.22 174.76 1c1u s ARG 35 N 0.04 4.39 -0.04 10.12 3.52 0.19 -0.67 118.95 136.49 1c1u s ARG 35 Ca -0.07 0.96 -0.23 0.00 -0.13 0.00 0.00 55.73 56.26 1c1u s ARG 35 Cb -0.14 -3.24 -0.17 0.00 -1.56 0.00 0.00 34.95 29.84 1c1u s ARG 35 CO 0.04 0.60 0.97 0.87 -0.81 0.00 0.00 175.30 176.97 1c1u h LYS 36 N 4.40 -0.18 -3.26 5.12 1.57 -1.85 -3.14 116.57 119.23 1c1u h LYS 36 Ca -0.48 0.01 -0.31 0.00 -1.87 0.00 0.00 60.65 58.00 1c1u h LYS 36 Cb 1.21 0.04 -0.36 0.00 0.08 0.00 0.00 32.23 33.20 1c1u h LYS 36 CO 0.65 0.27 -0.67 0.45 -0.57 0.00 0.00 179.45 179.58 1c1u s SER 36 N -5.51 0.57 0.77 0.86 0.15 -1.26 -2.99 113.70 106.30 1c1u s SER 36 Ca -0.14 0.21 -0.14 0.00 0.70 0.00 0.00 55.95 56.58 1c1u s SER 36 Cb 0.01 0.08 0.06 0.00 -1.71 0.00 0.00 66.02 64.46 1c1u s SER 36 CO 0.53 -0.21 1.23 -2.16 1.20 0.00 0.00 173.24 173.83 1c1u s PRO 37 N 1.83 1.83 -0.89 5.44 0.04 -1.26 -5.03 135.00 136.96 1c1u s PRO 37 Ca -0.01 1.83 -0.25 0.00 0.04 0.00 0.00 61.00 62.62 1c1u s PRO 37 Cb -0.12 -1.79 0.04 0.00 0.04 0.00 0.00 34.50 32.67 1c1u s PRO 37 CO -0.05 -2.09 1.37 -0.65 0.04 0.00 0.00 177.00 175.63 1c1u s GLN 38 N -3.96 3.40 0.05 4.56 -0.21 -1.16 -4.55 119.66 117.79 1c1u s GLN 38 Ca 0.75 -0.71 -0.02 0.00 0.02 0.00 0.00 55.36 55.40 1c1u s GLN 38 Cb -0.31 -4.81 -0.03 0.00 1.00 0.00 0.00 33.01 28.86 1c1u s GLN 38 CO 0.48 -2.18 0.01 -1.83 -2.12 0.00 0.00 175.29 169.65 1c1u s GLU 39 N 5.33 0.61 0.19 2.91 -1.05 -1.19 -4.95 118.70 120.56 1c1u s GLU 39 Ca 0.41 -1.09 -0.30 0.00 -0.15 0.00 0.00 54.97 53.84 1c1u s GLU 39 Cb -0.04 0.22 -0.08 0.00 -0.44 0.00 0.00 34.13 33.79 1c1u s GLU 39 CO 0.02 -0.13 1.21 -1.17 0.95 0.00 0.00 175.26 176.14 1c1u s LEU 40 N -2.71 4.45 -0.09 1.83 2.96 -1.26 -0.64 118.68 123.23 1c1u s LEU 40 Ca 0.04 2.27 -0.11 0.00 -0.22 0.00 0.00 54.13 56.10 1c1u s LEU 40 Cb 0.05 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 43.09 1c1u s LEU 40 CO -0.09 -0.39 -0.22 -0.11 -1.32 0.00 0.00 176.35 174.22 1c1u n LEU 41 N 2.47 1.58 0.00 -0.68 7.94 -0.14 -4.89 117.00 123.28 1c1u n LEU 41 Ca 0.04 0.25 -0.08 0.00 -1.11 0.00 0.00 56.01 55.12 1c1u n LEU 41 Cb 0.44 -0.58 -0.00 0.00 0.53 0.00 0.00 43.42 43.81 1c1u n LEU 41 CO 0.56 -0.36 0.20 0.00 -1.11 0.00 0.00 177.39 176.68 1c1u s GLY 43 N -2.35 2.18 0.16 0.00 0.00 0.39 -1.23 107.32 106.46 1c1u s GLY 43 Ca 0.15 -1.76 -0.23 0.00 0.00 0.00 0.00 44.72 42.88 1c1u s GLY 43 CO 0.11 -1.77 1.06 0.00 0.00 0.00 0.00 173.10 172.49 1c1u s ALA 44 N -2.57 -1.69 0.06 3.20 0.00 -0.78 -3.34 121.76 116.64 1c1u s ALA 44 Ca 0.45 -0.23 0.01 0.00 0.00 0.00 0.00 51.96 52.20 1c1u s ALA 44 Cb -0.03 0.75 -0.03 0.00 0.00 0.00 0.00 23.12 23.81 1c1u s ALA 44 CO 0.27 -1.07 -0.06 -1.54 0.00 0.00 0.00 175.76 173.36 1c1u s SER 45 N -3.38 0.86 -0.26 0.00 1.04 -0.45 -0.85 113.70 110.66 1c1u s SER 45 Ca 0.21 -0.81 -0.11 0.00 0.48 0.00 0.00 55.95 55.72 1c1u s SER 45 Cb -0.02 0.09 -0.05 0.00 0.10 0.00 0.00 66.02 66.14 1c1u s SER 45 CO 0.04 -0.38 0.20 -0.22 0.98 0.00 0.00 173.24 173.86 1c1u s LEU 46 N -2.39 4.06 -0.01 2.42 1.98 -0.63 -0.80 118.68 123.31 1c1u s LEU 46 Ca 0.01 0.08 0.11 0.00 -2.89 0.00 0.00 54.13 51.45 1c1u s LEU 46 Cb -0.01 -2.15 -0.15 0.00 0.66 0.00 0.00 46.19 44.54 1c1u s LEU 46 CO -0.04 -0.02 0.38 2.30 -1.89 0.00 0.00 176.35 177.09 1c1u n ILE 47 N 4.74 0.00 -3.31 6.68 -5.35 -0.78 -2.05 119.36 119.29 1c1u n ILE 47 Ca -0.14 -0.25 -0.01 0.00 -0.27 0.00 0.00 62.75 62.08 1c1u n ILE 47 Cb 0.52 0.67 0.00 0.00 -1.74 0.00 0.00 39.64 39.08 1c1u n ILE 47 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1c1u n SER 48 N -1.54 -0.15 -0.11 7.28 3.41 -1.24 -4.64 113.62 116.62 1c1u n SER 48 Ca 0.00 -1.14 0.14 0.00 -0.26 0.00 0.00 58.87 57.61 1c1u n SER 48 Cb 0.23 0.27 0.58 0.00 -0.26 0.00 0.00 64.21 65.03 1c1u n SER 48 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1c1u n ASP 49 N -1.52 0.48 0.00 4.04 5.75 -1.26 -3.99 116.55 120.04 1c1u n ASP 49 Ca -0.00 -0.52 0.00 0.00 -0.01 0.00 0.00 54.79 54.26 1c1u n ASP 49 Cb 0.05 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.07 1c1u n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1c1u n ARG 50 N -0.99 2.26 -5.00 0.11 3.00 -1.26 -0.74 116.66 114.04 1c1u n ARG 50 Ca 0.14 -0.16 -0.27 0.00 -0.01 0.00 0.00 57.85 57.54 1c1u n ARG 50 Cb 0.29 -0.58 -0.16 0.00 0.00 0.00 0.00 32.46 32.00 1c1u n ARG 50 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 1c1u s TRP 51 N -0.37 1.89 0.04 -1.55 0.52 -1.26 -1.13 118.94 117.09 1c1u s TRP 51 Ca 0.00 -0.44 0.09 0.00 0.02 0.00 0.00 56.10 55.77 1c1u s TRP 51 Cb 0.00 -1.24 -0.03 0.00 -1.15 0.00 0.00 33.47 31.06 1c1u s TRP 51 CO 0.00 -0.09 -0.25 0.08 0.02 0.00 0.00 176.95 176.71 1c1u s VAL 52 N -0.30 2.02 -0.09 4.03 1.01 -0.44 -1.86 120.40 124.77 1c1u s VAL 52 Ca 0.03 -1.32 0.02 0.00 0.00 0.00 0.00 61.98 60.72 1c1u s VAL 52 Cb -0.10 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 1c1u s VAL 52 CO 0.01 0.35 -0.14 -0.22 0.00 0.00 0.00 175.10 175.09 1c1u s LEU 53 N -1.16 2.69 0.00 3.92 2.96 0.02 -1.18 118.68 125.93 1c1u s LEU 53 Ca 0.11 -0.27 0.00 0.00 -0.22 0.00 0.00 54.13 53.74 1c1u s LEU 53 Cb -0.10 -1.57 0.00 0.00 0.50 0.00 0.00 46.19 45.02 1c1u s LEU 53 CO 0.02 0.26 0.00 1.07 -1.32 0.00 0.00 176.35 176.38 1c1u n THR 54 N 2.89 0.00 -3.81 3.68 5.66 -0.55 -1.34 114.28 120.80 1c1u n THR 54 Ca -0.18 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.46 1c1u n THR 54 Cb 0.52 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.24 1c1u n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1c1u s ALA 55 N -1.71 3.83 0.36 1.79 0.00 -1.26 -1.80 121.76 122.98 1c1u s ALA 55 Ca 0.00 -0.60 0.05 0.00 0.00 0.00 0.00 51.96 51.41 1c1u s ALA 55 Cb 0.00 -2.05 0.70 0.00 0.00 0.00 0.00 23.12 21.77 1c1u s ALA 55 CO 0.00 0.53 1.95 0.00 0.00 0.00 0.00 175.76 178.24 1c1u h ALA 56 N 5.24 1.50 0.00 0.00 0.00 -1.72 -2.37 119.26 121.91 1c1u h ALA 56 Ca -0.52 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.26 1c1u h ALA 56 Cb 1.22 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1c1u h ALA 56 CO 0.61 0.38 0.00 -2.39 0.00 0.00 0.00 179.25 177.85 1c1u n HIS 57 N -4.36 0.00 0.13 0.00 1.44 -1.26 -1.05 115.22 110.12 1c1u n HIS 57 Ca 0.02 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.75 1c1u n HIS 57 Cb 0.17 -0.14 0.01 0.00 0.12 0.00 0.00 29.99 30.15 1c1u n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1c1u n LEU 59 N -3.22 2.20 -3.86 0.00 4.77 -0.21 -4.88 117.00 111.80 1c1u n LEU 59 Ca 0.01 -0.07 -0.28 0.00 -0.03 0.00 0.00 56.01 55.65 1c1u n LEU 59 Cb 0.76 -0.36 -0.17 0.00 -2.33 0.00 0.00 43.42 41.32 1c1u n LEU 59 CO 0.41 0.67 -0.41 -0.22 -1.33 0.00 0.00 177.39 176.51 1c1u s LEU 60 N -5.75 1.47 0.13 2.23 2.96 -0.29 -0.45 118.68 118.99 1c1u s LEU 60 Ca -0.19 -0.63 -0.17 0.00 -0.22 0.00 0.00 54.13 52.93 1c1u s LEU 60 Cb 0.05 -0.83 0.04 0.00 0.50 0.00 0.00 46.19 45.95 1c1u s LEU 60 CO 0.44 -0.20 0.43 -0.47 -1.32 0.00 0.00 176.35 175.23 1c1u s TYR 60 N 1.69 -0.22 0.00 5.38 5.04 0.82 -4.27 117.35 125.79 1c1u s TYR 60 Ca 0.01 -0.09 0.00 0.00 -2.44 0.00 0.00 57.07 54.55 1c1u s TYR 60 Cb -0.15 0.29 0.00 0.00 0.35 0.00 0.00 41.96 42.45 1c1u s TYR 60 CO -0.07 -0.73 0.00 -2.30 -1.34 0.00 0.00 175.55 171.10 1c1u n PRO 60 N -0.25 0.00 -0.23 4.97 -0.02 -1.26 -1.95 135.00 136.26 1c1u n PRO 60 Ca -0.15 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.41 1c1u n PRO 60 Cb 0.64 -0.46 0.16 0.00 -0.02 0.00 0.00 33.50 33.82 1c1u n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1c1u n TRP 60 N -0.05 0.05 -3.95 6.00 8.01 -1.26 -4.98 117.44 121.26 1c1u n TRP 60 Ca 0.00 -1.13 -0.28 0.00 -1.31 0.00 0.00 57.50 54.78 1c1u n TRP 60 Cb 0.00 -0.19 -0.00 0.00 -2.01 0.00 0.00 31.31 29.11 1c1u n TRP 60 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1c1u n ASP 60 N -1.32 -2.09 -4.47 -0.99 8.00 -1.15 -4.95 116.55 109.58 1c1u n ASP 60 Ca 0.17 -0.92 -0.36 0.00 0.71 0.00 0.00 54.79 54.39 1c1u n ASP 60 Cb 0.67 -3.37 -0.12 0.00 -0.02 0.00 0.00 41.12 38.28 1c1u n ASP 60 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1c1u s LYS 60 N -6.54 3.68 -0.45 -1.24 2.20 -0.82 -4.99 119.74 111.57 1c1u s LYS 60 Ca 0.30 -0.47 0.07 0.00 -0.36 0.00 0.00 55.97 55.51 1c1u s LYS 60 Cb -0.16 -3.25 0.18 0.00 -1.51 0.00 0.00 37.83 33.09 1c1u s LYS 60 CO 0.87 -0.08 0.63 1.21 -0.36 0.00 0.00 175.35 177.62 1c1u s ASN 60 N 1.32 -1.10 0.55 1.43 2.47 -1.18 -0.13 114.94 118.30 1c1u s ASN 60 Ca 0.05 -1.38 -0.09 0.00 0.42 0.00 0.00 52.86 51.86 1c1u s ASN 60 Cb -0.15 1.68 -0.04 0.00 -1.45 0.00 0.00 41.25 41.30 1c1u s ASN 60 CO 0.03 -0.13 0.92 -0.36 -3.72 0.00 0.00 177.10 173.84 1c1u s PHE 60 N 1.30 3.58 0.27 0.43 0.08 0.40 -5.01 117.98 119.04 1c1u s PHE 60 Ca 0.23 1.10 0.06 0.00 0.12 0.00 0.00 56.93 58.44 1c1u s PHE 60 Cb -0.03 -2.55 -0.06 0.00 -0.57 0.00 0.00 43.02 39.82 1c1u s PHE 60 CO -0.06 -0.47 -0.05 0.99 -0.10 0.00 0.00 175.22 175.52 1c1u s THR 60 N -2.92 1.55 0.17 0.64 2.01 -1.26 -4.92 115.64 110.91 1c1u s THR 60 Ca 0.52 -2.11 -0.29 0.00 0.31 0.00 0.00 61.69 60.12 1c1u s THR 60 Cb -0.11 -2.42 -0.03 0.00 0.01 0.00 0.00 72.50 69.95 1c1u s THR 60 CO 0.47 -0.31 1.54 -0.33 -0.69 0.00 0.00 174.62 175.30 1c1u h GLU 61 N 2.32 -0.02 0.00 4.92 4.39 -1.94 0.18 114.58 124.43 1c1u h GLU 61 Ca -0.40 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.31 1c1u h GLU 61 Cb 1.23 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 1c1u h GLU 61 CO 0.67 -0.01 0.20 -0.91 -1.16 0.00 0.00 179.01 177.79 1c1u h ASN 62 N -0.02 0.00 0.07 1.42 4.21 -1.97 -1.99 115.58 117.30 1c1u h ASN 62 Ca 0.18 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.69 1c1u h ASN 62 Cb 0.44 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.64 1c1u h ASN 62 CO -0.93 0.00 -0.81 0.47 -1.29 0.00 0.00 177.43 174.87 1c1u n ASP 63 N -2.16 1.14 -4.45 5.81 8.00 0.63 -4.95 116.55 120.58 1c1u n ASP 63 Ca -0.01 -1.01 -0.23 0.00 0.71 0.00 0.00 54.79 54.25 1c1u n ASP 63 Cb 0.22 0.77 -0.10 0.00 -0.02 0.00 0.00 41.12 42.00 1c1u n ASP 63 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1c1u s LEU 64 N -2.88 2.59 0.04 0.64 1.43 -0.75 -2.82 118.68 116.94 1c1u s LEU 64 Ca 0.11 -1.09 0.03 0.00 -1.03 0.00 0.00 54.13 52.15 1c1u s LEU 64 Cb 0.17 -0.91 -0.02 0.00 0.03 0.00 0.00 46.19 45.46 1c1u s LEU 64 CO 0.78 -0.12 -0.10 -0.76 0.23 0.00 0.00 176.35 176.38 1c1u s LEU 65 N -3.47 2.21 -0.12 1.79 1.43 0.15 -4.55 118.68 116.12 1c1u s LEU 65 Ca 0.29 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 1c1u s LEU 65 Cb -0.01 -0.32 -0.01 0.00 0.03 0.00 0.00 46.19 45.87 1c1u s LEU 65 CO 0.13 -0.10 -0.15 -0.69 0.23 0.00 0.00 176.35 175.77 1c1u s VAL 66 N -1.09 2.89 -0.18 -1.59 1.01 -0.81 -0.53 120.40 120.10 1c1u s VAL 66 Ca -0.05 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.21 1c1u s VAL 66 Cb -0.09 -2.19 0.01 0.00 0.00 0.00 0.00 36.38 34.11 1c1u s VAL 66 CO 0.01 0.53 -0.17 -0.13 0.00 0.00 0.00 175.10 175.34 1c1u s ARG 67 N 0.29 3.10 0.06 2.72 0.52 -0.09 -0.97 118.95 124.58 1c1u s ARG 67 Ca -0.11 -0.78 0.07 0.00 -0.52 0.00 0.00 55.73 54.38 1c1u s ARG 67 Cb -0.16 -2.64 -0.04 0.00 0.52 0.00 0.00 34.95 32.64 1c1u s ARG 67 CO 0.06 -0.15 -0.14 0.42 0.02 0.00 0.00 175.30 175.51 1c1u s ILE 68 N 1.19 3.11 0.00 1.52 1.01 0.78 -1.29 121.20 127.51 1c1u s ILE 68 Ca 0.02 -1.17 0.00 0.00 0.00 0.00 0.00 60.65 59.50 1c1u s ILE 68 Cb -0.14 -2.37 0.00 0.00 0.01 0.00 0.00 42.46 39.96 1c1u s ILE 68 CO -0.08 0.26 0.00 0.61 0.00 0.00 0.00 174.94 175.73 1c1u n GLY 69 N 1.24 0.72 3.91 6.18 0.00 -1.26 -0.28 105.19 115.70 1c1u n GLY 69 Ca -0.15 -0.14 -0.28 0.00 0.00 0.00 0.00 46.02 45.45 1c1u n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c1u s LYS 70 N -0.62 2.66 0.26 1.61 1.02 -1.26 -4.38 119.74 119.03 1c1u s LYS 70 Ca 0.00 0.08 0.00 0.00 0.02 0.00 0.00 55.97 56.07 1c1u s LYS 70 Cb 0.00 -2.15 0.00 0.00 -0.52 0.00 0.00 37.83 35.16 1c1u s LYS 70 CO 0.00 -0.99 0.00 1.58 -0.92 0.00 0.00 175.35 175.02 1c1u n HIS 71 N -2.84 -2.22 -2.35 3.18 -0.00 -1.26 -4.98 115.22 104.75 1c1u n HIS 71 Ca 0.06 0.39 -0.37 0.00 -0.00 0.00 0.00 57.72 57.81 1c1u n HIS 71 Cb 0.58 0.55 -0.02 0.00 -0.00 0.00 0.00 29.99 31.10 1c1u n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1c1u s SER 72 N -4.96 6.35 -0.11 0.26 0.15 -1.26 -1.19 113.70 112.93 1c1u s SER 72 Ca 0.00 2.22 -0.23 0.00 0.70 0.00 0.00 55.95 58.64 1c1u s SER 72 Cb 0.00 -2.60 -0.20 0.00 -1.71 0.00 0.00 66.02 61.52 1c1u s SER 72 CO 0.00 -0.79 0.72 -0.09 1.20 0.00 0.00 173.24 174.28 1c1u h ARG 73 N 2.17 -0.03 -0.01 5.44 2.43 -1.07 -3.39 114.38 119.91 1c1u h ARG 73 Ca -0.49 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1c1u h ARG 73 Cb 1.24 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1c1u h ARG 73 CO 0.61 0.66 -0.45 0.25 -1.51 0.00 0.00 179.97 179.53 1c1u n THR 74 N -4.71 0.00 -3.76 0.20 -2.24 -1.26 -4.97 114.28 97.54 1c1u n THR 74 Ca -0.08 -0.16 -0.33 0.00 -2.27 0.00 0.00 64.05 61.21 1c1u n THR 74 Cb 0.35 0.82 -0.05 0.00 -2.10 0.00 0.00 70.33 69.35 1c1u n THR 74 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1c1u s ARG 75 N -2.59 3.57 -0.72 -0.78 1.81 -1.26 -5.00 118.95 113.98 1c1u s ARG 75 Ca 0.19 -0.14 -0.23 0.00 -1.72 0.00 0.00 55.73 53.83 1c1u s ARG 75 Cb 0.18 -2.99 0.07 0.00 -0.45 0.00 0.00 34.95 31.76 1c1u s ARG 75 CO 0.60 0.58 1.05 -0.47 -0.68 0.00 0.00 175.30 176.37 1c1u s TYR 76 N -1.46 2.68 -1.20 -0.53 5.04 -1.26 -4.86 117.35 115.75 1c1u s TYR 76 Ca 0.33 -0.62 -0.20 0.00 -2.44 0.00 0.00 57.07 54.14 1c1u s TYR 76 Cb -0.13 -4.35 0.03 0.00 0.35 0.00 0.00 41.96 37.86 1c1u s TYR 76 CO 0.21 -1.69 1.73 -1.21 -1.34 0.00 0.00 175.55 173.25 1c1u s GLU 77 N 4.12 3.57 0.13 4.97 2.02 -1.26 -4.93 118.70 127.31 1c1u s GLU 77 Ca 0.26 -1.59 -0.35 0.00 0.02 0.00 0.00 54.97 53.32 1c1u s GLU 77 Cb -0.13 -5.43 -0.15 0.00 0.10 0.00 0.00 34.13 28.52 1c1u s GLU 77 CO 0.07 -2.62 1.41 -2.13 0.02 0.00 0.00 175.26 172.01 1c1u n ARG 77 N 8.50 1.54 -0.84 1.61 0.63 -1.26 -1.05 116.66 125.78 1c1u n ARG 77 Ca 0.45 0.55 0.00 0.00 -0.92 0.00 0.00 57.85 57.93 1c1u n ARG 77 Cb 0.47 -2.23 0.00 0.00 0.45 0.00 0.00 32.46 31.15 1c1u n ARG 77 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1c1u n ASN 78 N 2.77 -0.19 0.00 6.15 5.03 -1.26 -4.74 115.26 123.02 1c1u n ASN 78 Ca 0.17 0.00 -0.03 0.00 0.87 0.00 0.00 54.58 55.59 1c1u n ASN 78 Cb 0.23 -0.85 -0.01 0.00 -1.02 0.00 0.00 39.78 38.13 1c1u n ASN 78 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 1c1u n ILE 79 N -2.03 0.69 -2.39 2.41 5.41 -0.67 -5.05 119.36 117.72 1c1u n ILE 79 Ca 0.00 0.13 -0.28 0.00 1.00 0.00 0.00 62.75 63.60 1c1u n ILE 79 Cb 0.01 -1.62 0.01 0.00 -0.71 0.00 0.00 39.64 37.33 1c1u n ILE 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1c1u s GLU 80 N -2.10 3.34 -0.03 0.38 -1.05 -0.21 -4.74 118.70 114.29 1c1u s GLU 80 Ca -0.05 0.25 0.05 0.00 -0.15 0.00 0.00 54.97 55.07 1c1u s GLU 80 Cb 0.02 -2.28 -0.01 0.00 -0.44 0.00 0.00 34.13 31.42 1c1u s GLU 80 CO 0.07 -0.45 -0.16 0.15 0.95 0.00 0.00 175.26 175.82 1c1u s LYS 81 N -4.92 1.50 -0.13 -4.83 3.01 0.62 -4.91 119.74 110.08 1c1u s LYS 81 Ca 0.51 -0.58 -0.01 0.00 -1.01 0.00 0.00 55.97 54.89 1c1u s LYS 81 Cb -0.11 -1.37 -0.02 0.00 -1.01 0.00 0.00 37.83 35.32 1c1u s LYS 81 CO 0.47 0.29 -0.11 0.42 0.51 0.00 0.00 175.35 176.92 1c1u s ILE 82 N -0.16 3.21 0.25 2.17 1.01 -1.26 -0.15 121.20 126.27 1c1u s ILE 82 Ca 0.01 -0.61 0.06 0.00 0.00 0.00 0.00 60.65 60.12 1c1u s ILE 82 Cb -0.09 -2.36 -0.05 0.00 0.01 0.00 0.00 42.46 39.97 1c1u s ILE 82 CO 0.01 0.52 -0.07 -0.44 0.00 0.00 0.00 174.94 174.96 1c1u s SER 83 N 0.29 2.53 0.30 3.58 0.01 -0.15 -4.97 113.70 115.30 1c1u s SER 83 Ca -0.09 -1.15 0.08 0.00 1.31 0.00 0.00 55.95 56.11 1c1u s SER 83 Cb -0.15 -0.13 -0.04 0.00 0.21 0.00 0.00 66.02 65.91 1c1u s SER 83 CO 0.05 -0.33 0.15 -0.04 0.41 0.00 0.00 173.24 173.48 1c1u s MET 84 N -3.73 2.57 0.03 12.44 -1.94 -1.26 -1.92 119.30 125.49 1c1u s MET 84 Ca 0.27 -1.34 -0.01 0.00 -1.71 0.00 0.00 55.69 52.90 1c1u s MET 84 Cb 0.03 -2.33 -0.04 0.00 2.01 0.00 0.00 34.83 34.50 1c1u s MET 84 CO 0.10 0.24 0.20 -0.51 -0.01 0.00 0.00 175.02 175.05 1c1u s LEU 85 N -3.83 4.36 -0.22 -0.03 1.43 -1.26 -0.20 118.68 118.93 1c1u s LEU 85 Ca 0.36 0.31 -0.09 0.00 -1.03 0.00 0.00 54.13 53.67 1c1u s LEU 85 Cb -0.05 -2.83 -0.10 0.00 0.03 0.00 0.00 46.19 43.24 1c1u s LEU 85 CO 0.23 0.21 -0.27 1.21 0.23 0.00 0.00 176.35 177.96 1c1u n GLU 86 N 0.55 0.47 -3.73 1.70 2.13 0.43 -4.61 120.64 117.59 1c1u n GLU 86 Ca -0.07 0.19 -0.14 0.00 0.66 0.00 0.00 57.16 57.80 1c1u n GLU 86 Cb 0.52 -1.30 -0.08 0.00 0.27 0.00 0.00 31.44 30.85 1c1u n GLU 86 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1c1u s LYS 87 N -2.40 0.73 -0.03 5.31 2.36 -1.17 -4.99 119.74 119.55 1c1u s LYS 87 Ca -0.30 -0.16 0.07 0.00 -2.55 0.00 0.00 55.97 53.03 1c1u s LYS 87 Cb 0.11 0.33 -0.02 0.00 -1.05 0.00 0.00 37.83 37.20 1c1u s LYS 87 CO 0.40 -0.21 -0.24 0.42 1.55 0.00 0.00 175.35 177.26 1c1u s ILE 88 N -1.42 2.17 -0.09 5.43 1.01 -1.26 -0.44 121.20 126.60 1c1u s ILE 88 Ca -0.13 -1.06 0.01 0.00 0.00 0.00 0.00 60.65 59.47 1c1u s ILE 88 Cb -0.04 -1.77 0.02 0.00 0.01 0.00 0.00 42.46 40.68 1c1u s ILE 88 CO 0.04 0.58 -0.09 -0.31 0.00 0.00 0.00 174.94 175.17 1c1u s TYR 89 N -0.55 1.40 0.01 3.97 1.51 0.69 -4.99 117.35 119.39 1c1u s TYR 89 Ca 0.08 -0.61 0.02 0.00 -1.01 0.00 0.00 57.07 55.55 1c1u s TYR 89 Cb -0.11 -1.12 -0.04 0.00 -0.11 0.00 0.00 41.96 40.59 1c1u s TYR 89 CO -0.00 -0.40 -0.02 0.42 -1.11 0.00 0.00 175.55 174.44 1c1u s ILE 90 N 1.29 4.02 0.21 2.71 -1.09 -1.26 -0.60 121.20 126.48 1c1u s ILE 90 Ca -0.03 -0.69 -0.32 0.00 -2.23 0.00 0.00 60.65 57.38 1c1u s ILE 90 Cb -0.14 -2.80 -0.13 0.00 -1.58 0.00 0.00 42.46 37.82 1c1u s ILE 90 CO -0.03 0.35 1.61 1.57 -1.23 0.00 0.00 174.94 177.21 1c1u n HIS 91 N 1.33 2.52 0.05 3.97 -0.00 -1.12 -4.85 115.22 117.13 1c1u n HIS 91 Ca -0.14 0.20 0.15 0.00 -0.00 0.00 0.00 57.72 57.93 1c1u n HIS 91 Cb 0.53 -2.59 0.63 0.00 -0.00 0.00 0.00 29.99 28.55 1c1u n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1c1u h PRO 92 N 5.86 0.11 -0.69 1.57 0.13 -1.96 -2.48 132.00 134.53 1c1u h PRO 92 Ca -0.45 -0.01 -0.37 0.00 -0.87 0.00 0.00 66.00 64.31 1c1u h PRO 92 Cb 1.23 -0.02 -0.22 0.00 0.13 0.00 0.00 31.00 32.12 1c1u h PRO 92 CO 0.88 0.07 0.30 0.54 -0.23 0.00 0.00 178.00 179.56 1c1u n ARG 93 N -4.45 2.08 -1.99 0.86 1.74 -1.26 -4.97 116.66 108.67 1c1u n ARG 93 Ca 0.06 -3.12 -0.42 0.00 -0.77 0.00 0.00 57.85 53.60 1c1u n ARG 93 Cb 0.40 -2.01 -0.03 0.00 -1.02 0.00 0.00 32.46 29.80 1c1u n ARG 93 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1c1u s TYR 94 N -3.30 2.95 -0.79 -1.55 5.04 -0.94 -4.75 117.35 114.02 1c1u s TYR 94 Ca 0.51 0.63 -0.11 0.00 -2.44 0.00 0.00 57.07 55.67 1c1u s TYR 94 Cb 0.45 -3.87 0.21 0.00 0.35 0.00 0.00 41.96 39.09 1c1u s TYR 94 CO 0.05 -3.26 0.70 1.21 -1.34 0.00 0.00 175.55 172.91 1c1u s ASN 95 N 1.45 6.37 0.18 4.32 3.84 -0.22 -4.86 114.94 126.03 1c1u s ASN 95 Ca 0.69 -2.79 0.25 0.00 0.21 0.00 0.00 52.86 51.22 1c1u s ASN 95 Cb -0.41 -2.11 0.47 0.00 -0.55 0.00 0.00 41.25 38.65 1c1u s ASN 95 CO 0.31 -0.50 1.47 4.11 -2.79 0.00 0.00 177.10 179.70 1c1u h TRP 96 N 7.51 0.00 -0.02 0.43 5.08 -1.92 0.14 115.95 127.17 1c1u h TRP 96 Ca 0.08 0.00 -0.15 0.00 1.08 0.00 0.00 58.89 59.90 1c1u h TRP 96 Cb 1.01 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 27.15 1c1u h TRP 96 CO 0.94 0.00 -0.67 0.00 -1.28 0.00 0.00 178.44 177.44 1c1u h ARG 97 N 0.00 0.10 0.00 0.12 3.08 -2.00 -3.44 114.38 112.24 1c1u h ARG 97 Ca 0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1c1u h ARG 97 Cb 0.79 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.85 1c1u h ARG 97 CO 0.00 0.73 0.00 -1.91 -1.07 0.00 0.00 179.97 177.72 1c1u n GLU 97 N -3.78 0.00 -0.19 0.04 2.13 -1.25 -5.00 120.64 112.59 1c1u n GLU 97 Ca -0.02 0.00 0.07 0.00 0.66 0.00 0.00 57.16 57.87 1c1u n GLU 97 Cb 0.66 -0.03 0.10 0.00 0.27 0.00 0.00 31.44 32.44 1c1u n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1c1u n ASN 98 N -2.56 1.65 -3.67 4.31 0.23 -1.25 -4.99 115.26 108.99 1c1u n ASN 98 Ca 0.00 -2.74 -0.26 0.00 -0.53 0.00 0.00 54.58 51.05 1c1u n ASN 98 Cb 0.00 -0.35 0.06 0.00 -2.08 0.00 0.00 39.78 37.41 1c1u n ASN 98 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1c1u n LEU 99 N -1.00 -3.11 -4.74 -4.53 4.77 0.03 -4.93 117.00 103.50 1c1u n LEU 99 Ca 0.11 -0.60 -0.41 0.00 -0.03 0.00 0.00 56.01 55.08 1c1u n LEU 99 Cb 0.65 -2.88 -0.04 0.00 -2.33 0.00 0.00 43.42 38.82 1c1u n LEU 99 CO 0.01 0.58 0.84 -0.62 -1.33 0.00 0.00 177.39 176.87 1c1u s ASP 100 N -3.28 7.16 -0.82 -1.43 2.15 -1.22 -3.29 116.67 115.93 1c1u s ASP 100 Ca 0.60 2.17 -0.03 0.00 0.43 0.00 0.00 52.55 55.72 1c1u s ASP 100 Cb -0.28 -2.61 -0.03 0.00 -0.30 0.00 0.00 42.92 39.70 1c1u s ASP 100 CO 0.75 -0.31 0.70 0.54 -0.17 0.00 0.00 175.17 176.68 1c1u n ARG 101 N 2.47 -2.78 -2.79 4.34 1.74 -1.26 -1.05 116.66 117.32 1c1u n ARG 101 Ca 0.04 0.64 -0.44 0.00 -0.77 0.00 0.00 57.85 57.32 1c1u n ARG 101 Cb 0.45 -4.82 0.00 0.00 -1.02 0.00 0.00 32.46 27.07 1c1u n ARG 101 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1c1u n ASP 102 N -2.72 5.12 -3.79 0.55 2.03 -1.21 -4.38 116.55 112.17 1c1u n ASP 102 Ca -0.11 -2.97 -0.13 0.00 0.52 0.00 0.00 54.79 52.10 1c1u n ASP 102 Cb 0.60 -1.61 -0.10 0.00 -0.72 0.00 0.00 41.12 39.30 1c1u n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1c1u s ILE 103 N 2.10 0.05 -0.01 5.18 2.07 -1.26 -3.84 121.20 125.48 1c1u s ILE 103 Ca 0.45 -0.39 -0.17 0.00 -1.41 0.00 0.00 60.65 59.13 1c1u s ILE 103 Cb 0.00 -0.52 0.03 0.00 0.13 0.00 0.00 42.46 42.10 1c1u s ILE 103 CO 0.02 -0.22 0.37 0.00 -1.91 0.00 0.00 174.94 173.20 1c1u s ALA 104 N -0.94 -0.93 0.06 1.50 0.00 -0.74 -2.81 121.76 117.89 1c1u s ALA 104 Ca -0.10 0.44 0.09 0.00 0.00 0.00 0.00 51.96 52.39 1c1u s ALA 104 Cb -0.05 0.10 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 1c1u s ALA 104 CO 0.03 -0.30 -0.23 -0.51 0.00 0.00 0.00 175.76 174.74 1c1u s LEU 105 N -1.41 2.37 -0.02 0.00 1.43 0.23 -1.48 118.68 119.79 1c1u s LEU 105 Ca -0.12 -0.56 0.03 0.00 -1.03 0.00 0.00 54.13 52.46 1c1u s LEU 105 Cb -0.04 -1.37 -0.00 0.00 0.03 0.00 0.00 46.19 44.81 1c1u s LEU 105 CO 0.04 0.24 -0.12 -0.04 0.23 0.00 0.00 176.35 176.71 1c1u s MET 106 N -1.47 1.15 -0.19 1.70 -1.94 -0.32 -0.22 119.30 118.00 1c1u s MET 106 Ca 0.13 -0.41 -0.08 0.00 -1.71 0.00 0.00 55.69 53.63 1c1u s MET 106 Cb -0.10 -1.06 -0.04 0.00 2.01 0.00 0.00 34.83 35.64 1c1u s MET 106 CO 0.04 0.19 0.07 0.21 -0.01 0.00 0.00 175.02 175.52 1c1u s LYS 107 N 0.02 3.97 0.41 2.03 2.20 0.42 -1.32 119.74 127.47 1c1u s LYS 107 Ca -0.01 -0.34 -0.16 0.00 -0.36 0.00 0.00 55.97 55.10 1c1u s LYS 107 Cb -0.08 -3.24 -0.09 0.00 -1.51 0.00 0.00 37.83 32.91 1c1u s LYS 107 CO 0.01 0.24 0.85 -0.51 -0.36 0.00 0.00 175.35 175.57 1c1u s LEU 108 N 0.46 3.89 0.13 5.43 1.43 -0.28 -0.43 118.68 129.32 1c1u s LEU 108 Ca 0.04 1.41 -0.19 0.00 -1.03 0.00 0.00 54.13 54.36 1c1u s LEU 108 Cb -0.12 -4.27 -0.01 0.00 0.03 0.00 0.00 46.19 41.82 1c1u s LEU 108 CO 0.00 -0.37 1.75 0.50 0.23 0.00 0.00 176.35 178.47 1c1u h LYS 109 N 1.67 0.20 -5.17 1.70 1.63 -0.84 -3.41 116.57 112.36 1c1u h LYS 109 Ca -0.48 -0.01 -0.36 0.00 -0.85 0.00 0.00 60.65 58.95 1c1u h LYS 109 Cb 1.18 -0.05 -0.17 0.00 -0.60 0.00 0.00 32.23 32.59 1c1u h LYS 109 CO 0.63 0.13 -0.74 0.15 -3.45 0.00 0.00 179.45 176.18 1c1u s LYS 110 N -6.17 0.97 0.44 1.90 1.02 -1.26 -4.97 119.74 111.67 1c1u s LYS 110 Ca -0.13 -1.27 -0.25 0.00 0.02 0.00 0.00 55.97 54.34 1c1u s LYS 110 Cb 0.10 -0.70 -0.08 0.00 -0.52 0.00 0.00 37.83 36.63 1c1u s LYS 110 CO 0.70 0.12 1.32 -2.14 -0.92 0.00 0.00 175.35 174.42 1c1u s PRO 111 N -3.00 3.79 0.27 -1.68 0.02 -1.26 -4.85 135.00 128.30 1c1u s PRO 111 Ca 0.10 2.19 0.02 0.00 0.02 0.00 0.00 61.00 63.33 1c1u s PRO 111 Cb -0.02 -2.64 -0.03 0.00 0.02 0.00 0.00 34.50 31.82 1c1u s PRO 111 CO 0.01 -0.65 0.44 0.54 -0.33 0.00 0.00 177.00 177.01 1c1u s VAL 112 N -1.28 5.19 -0.12 3.83 0.11 0.08 -5.01 120.40 123.21 1c1u s VAL 112 Ca 0.60 -0.65 -0.05 0.00 -2.93 0.00 0.00 61.98 58.95 1c1u s VAL 112 Cb -0.39 -3.83 -0.04 0.00 -1.53 0.00 0.00 36.38 30.59 1c1u s VAL 112 CO 0.49 -0.39 0.09 0.00 -3.33 0.00 0.00 175.10 171.96 1c1u s ALA 113 N -2.09 3.63 0.74 1.54 0.00 -1.26 -4.81 121.76 119.51 1c1u s ALA 113 Ca 0.37 -0.71 -0.11 0.00 0.00 0.00 0.00 51.96 51.51 1c1u s ALA 113 Cb -0.10 -1.81 0.03 0.00 0.00 0.00 0.00 23.12 21.24 1c1u s ALA 113 CO 0.32 0.55 1.09 -0.06 0.00 0.00 0.00 175.76 177.65 1c1u s PHE 114 N -0.79 3.13 0.00 0.00 0.08 -1.26 -4.90 117.98 114.23 1c1u s PHE 114 Ca 0.13 1.14 0.00 0.00 0.12 0.00 0.00 56.93 58.32 1c1u s PHE 114 Cb -0.12 -3.05 0.00 0.00 -0.57 0.00 0.00 43.02 39.28 1c1u s PHE 114 CO 0.03 -1.39 0.00 -1.13 -0.10 0.00 0.00 175.22 172.63 1c1u n SER 115 N -3.17 0.00 0.18 1.36 3.41 -0.32 -4.91 113.62 110.17 1c1u n SER 115 Ca 0.07 -0.83 0.14 0.00 -0.26 0.00 0.00 58.87 57.99 1c1u n SER 115 Cb 0.56 0.00 0.55 0.00 -0.26 0.00 0.00 64.21 65.06 1c1u n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1c1u h ASP 116 N 0.00 0.00 0.00 4.04 3.32 -1.99 -3.07 116.42 118.72 1c1u h ASP 116 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1c1u h ASP 116 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1c1u h ASP 116 CO 0.00 0.00 -0.64 -1.22 -1.72 0.00 0.00 179.24 175.66 1c1u n TYR 117 N -2.57 0.00 -3.95 4.55 4.01 -1.26 -4.77 117.16 113.17 1c1u n TYR 117 Ca 0.02 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.47 1c1u n TYR 117 Cb 0.28 -0.02 -0.16 0.00 -0.31 0.00 0.00 39.34 39.13 1c1u n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1c1u s ILE 118 N -2.20 1.37 -0.27 -0.72 1.01 -1.16 -4.26 121.20 114.96 1c1u s ILE 118 Ca 0.04 -0.70 -0.20 0.00 0.00 0.00 0.00 60.65 59.80 1c1u s ILE 118 Cb 0.09 -1.43 0.07 0.00 0.01 0.00 0.00 42.46 41.21 1c1u s ILE 118 CO 0.51 0.25 0.69 -2.28 0.00 0.00 0.00 174.94 174.11 1c1u s HIS 119 N 1.54 -0.91 0.74 3.97 2.46 -1.05 -1.18 115.29 120.86 1c1u s HIS 119 Ca 0.02 1.99 -0.11 0.00 0.47 0.00 0.00 55.06 57.43 1c1u s HIS 119 Cb -0.15 0.44 0.03 0.00 -0.13 0.00 0.00 32.58 32.78 1c1u s HIS 119 CO -0.09 -0.45 1.08 -1.25 -2.47 0.00 0.00 174.74 171.56 1c1u s PRO 120 N 1.00 2.58 0.32 2.88 0.04 -1.26 -2.97 135.00 137.59 1c1u s PRO 120 Ca -0.05 0.80 0.07 0.00 0.04 0.00 0.00 61.00 61.86 1c1u s PRO 120 Cb -0.05 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.51 1c1u s PRO 120 CO -0.09 -1.31 0.36 0.54 0.04 0.00 0.00 177.00 176.53 1c1u s VAL 121 N -3.10 3.97 0.15 -0.36 0.11 -0.87 -4.90 120.40 115.40 1c1u s VAL 121 Ca 0.59 -1.20 -0.07 0.00 -2.93 0.00 0.00 61.98 58.37 1c1u s VAL 121 Cb -0.14 -3.35 -0.06 0.00 -1.53 0.00 0.00 36.38 31.30 1c1u s VAL 121 CO 0.55 -0.20 0.43 0.00 -3.33 0.00 0.00 175.10 172.55 1c1u s LEU 123 N -2.50 4.26 0.62 0.00 1.43 -1.26 -1.56 118.68 119.67 1c1u s LEU 123 Ca 0.41 0.38 -0.13 0.00 -1.03 0.00 0.00 54.13 53.76 1c1u s LEU 123 Cb -0.12 -2.17 -0.03 0.00 0.03 0.00 0.00 46.19 43.90 1c1u s LEU 123 CO 0.22 0.37 1.04 -2.16 0.23 0.00 0.00 176.35 176.04 1c1u s PRO 124 N -1.25 3.38 0.27 1.29 0.04 -1.26 -4.94 135.00 132.52 1c1u s PRO 124 Ca 0.18 0.94 0.09 0.00 0.04 0.00 0.00 61.00 62.25 1c1u s PRO 124 Cb -0.12 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 1c1u s PRO 124 CO 0.08 -0.75 0.01 0.16 0.04 0.00 0.00 177.00 176.54 1c1u s ASP 125 N -3.59 4.59 0.26 6.66 1.47 -1.26 -4.88 116.67 119.91 1c1u s ASP 125 Ca 0.58 -0.64 -0.07 0.00 1.18 0.00 0.00 52.55 53.60 1c1u s ASP 125 Cb -0.13 -0.86 0.42 0.00 -0.34 0.00 0.00 42.92 42.01 1c1u s ASP 125 CO 0.47 -0.01 1.43 -1.14 0.68 0.00 0.00 175.17 176.59 1c1u n ARG 126 N -0.92 -0.08 -0.15 2.11 0.63 -1.26 -1.20 116.66 115.78 1c1u n ARG 126 Ca -0.06 1.43 -0.10 0.00 -0.92 0.00 0.00 57.85 58.20 1c1u n ARG 126 Cb 0.59 -2.13 -0.00 0.00 0.45 0.00 0.00 32.46 31.37 1c1u n ARG 126 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1c1u h GLU 127 N 0.00 0.73 -1.50 -0.14 3.07 -2.04 -0.35 114.58 114.34 1c1u h GLU 127 Ca 0.44 -0.19 0.00 0.00 -0.50 0.00 0.00 59.36 59.11 1c1u h GLU 127 Cb 0.67 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.49 1c1u h GLU 127 CO -0.94 0.75 0.00 2.41 -1.40 0.00 0.00 179.01 179.83 1c1u n THR 128 N -4.48 0.23 0.00 1.13 -1.04 -0.34 -1.32 114.28 108.45 1c1u n THR 128 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1c1u n THR 128 Cb 0.24 -0.56 0.00 0.00 -1.82 0.00 0.00 70.33 68.19 1c1u n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1c1u n ALA 129 N 0.79 0.00 0.05 2.41 0.00 -0.14 -1.48 120.51 122.13 1c1u n ALA 129 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 1c1u n ALA 129 Cb 0.12 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.49 1c1u n ALA 129 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1c1u h SER 129 N 0.00 0.00 0.20 0.00 4.64 -1.47 -3.40 113.55 113.51 1c1u h SER 129 Ca 0.00 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.02 1c1u h SER 129 Cb 0.00 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.04 1c1u h SER 129 CO 0.00 0.76 -2.08 0.18 -0.87 0.00 0.00 176.83 174.81 1c1u n LEU 129 N -3.09 0.31 -3.78 5.97 4.77 -0.55 -4.62 117.00 116.01 1c1u n LEU 129 Ca -0.07 0.14 -0.42 0.00 -0.03 0.00 0.00 56.01 55.63 1c1u n LEU 129 Cb 0.89 0.33 -0.00 0.00 -2.33 0.00 0.00 43.42 42.31 1c1u n LEU 129 CO 0.44 0.39 2.64 0.18 -1.33 0.00 0.00 177.39 179.71 1c1u n LEU 130 N -2.79 6.71 -4.32 2.23 4.77 -1.26 -4.82 117.00 117.52 1c1u n LEU 130 Ca -0.24 -4.10 -0.28 0.00 -0.03 0.00 0.00 56.01 51.36 1c1u n LEU 130 Cb 1.05 -1.66 -0.14 0.00 -2.33 0.00 0.00 43.42 40.34 1c1u n LEU 130 CO 0.44 1.03 -0.55 -1.10 -1.33 0.00 0.00 177.39 175.88 1c1u s GLN 131 N 3.29 1.51 0.25 3.23 -0.21 -1.26 -4.99 119.66 121.49 1c1u s GLN 131 Ca 0.48 -1.11 -0.31 0.00 0.02 0.00 0.00 55.36 54.44 1c1u s GLN 131 Cb 0.13 -1.74 -0.12 0.00 1.00 0.00 0.00 33.01 32.29 1c1u s GLN 131 CO -0.08 0.44 1.67 0.00 -2.12 0.00 0.00 175.29 175.20 1c1u s ALA 132 N -0.89 3.86 0.00 6.09 0.00 -1.26 -1.91 121.76 127.65 1c1u s ALA 132 Ca 0.10 1.59 0.00 0.00 0.00 0.00 0.00 51.96 53.66 1c1u s ALA 132 Cb -0.10 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.34 1c1u s ALA 132 CO 0.03 -0.96 0.00 0.41 0.00 0.00 0.00 175.76 175.24 1c1u n GLY 133 N 3.19 2.97 3.78 0.00 0.00 0.01 -4.95 105.19 110.19 1c1u n GLY 133 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1c1u n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1c1u s TYR 134 N -2.75 3.54 0.01 1.61 1.51 -0.80 -4.66 117.35 115.81 1c1u s TYR 134 Ca 0.00 1.73 -0.01 0.00 -1.01 0.00 0.00 57.07 57.78 1c1u s TYR 134 Cb 0.00 -3.01 -0.04 0.00 -0.11 0.00 0.00 41.96 38.80 1c1u s TYR 134 CO 0.00 -0.11 0.12 0.15 -1.11 0.00 0.00 175.55 174.60 1c1u s LYS 135 N -2.17 3.20 0.44 -0.62 1.02 -1.26 -0.79 119.74 119.57 1c1u s LYS 135 Ca 0.52 -0.45 0.03 0.00 0.02 0.00 0.00 55.97 56.10 1c1u s LYS 135 Cb -0.20 -2.94 -0.03 0.00 -0.52 0.00 0.00 37.83 34.14 1c1u s LYS 135 CO 0.26 0.65 0.05 0.20 -0.92 0.00 0.00 175.35 175.58 1c1u s GLY 136 N -1.93 2.72 -0.02 -3.33 0.00 0.01 -4.86 107.32 99.92 1c1u s GLY 136 Ca 0.26 -1.10 0.04 0.00 0.00 0.00 0.00 44.72 43.92 1c1u s GLY 136 CO 0.17 -2.03 -0.14 -1.60 0.00 0.00 0.00 173.10 169.50 1c1u s ARG 137 N -3.80 1.25 -0.02 2.90 3.52 -0.26 -0.82 118.95 121.71 1c1u s ARG 137 Ca 0.19 -0.51 0.07 0.00 -0.13 0.00 0.00 55.73 55.34 1c1u s ARG 137 Cb 0.04 -1.18 -0.02 0.00 -1.56 0.00 0.00 34.95 32.23 1c1u s ARG 137 CO 0.10 0.28 -0.22 0.08 -0.81 0.00 0.00 175.30 174.74 1c1u s VAL 138 N -0.23 1.70 0.14 7.11 1.01 -0.75 -0.61 120.40 128.78 1c1u s VAL 138 Ca 0.03 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.13 1c1u s VAL 138 Cb -0.07 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 1c1u s VAL 138 CO -0.00 0.48 -0.10 0.42 0.00 0.00 0.00 175.10 175.90 1c1u s THR 139 N -0.51 1.13 0.00 3.92 -4.23 -1.24 -2.65 115.64 112.06 1c1u s THR 139 Ca 0.08 -1.98 0.00 0.00 -1.18 0.00 0.00 61.69 58.62 1c1u s THR 139 Cb -0.08 -1.75 0.00 0.00 1.34 0.00 0.00 72.50 72.00 1c1u s THR 139 CO -0.01 -0.70 0.00 0.61 -0.54 0.00 0.00 174.62 173.98 1c1u n GLY 140 N -0.04 1.28 0.99 3.99 0.00 -0.97 -4.62 105.19 105.82 1c1u n GLY 140 Ca -0.11 -0.93 0.02 0.00 0.00 0.00 0.00 46.02 45.00 1c1u n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1c1u n TRP 141 N -0.50 1.00 -1.62 1.61 8.01 -1.26 -1.91 117.44 122.77 1c1u n TRP 141 Ca 0.00 -1.22 -0.23 0.00 -1.31 0.00 0.00 57.50 54.75 1c1u n TRP 141 Cb 0.00 -0.40 0.16 0.00 -2.01 0.00 0.00 31.31 29.07 1c1u n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1c1u n GLY 142 N -0.84 -1.57 3.63 6.99 0.00 -1.26 -4.62 105.19 107.52 1c1u n GLY 142 Ca 0.27 -1.67 -0.36 0.00 0.00 0.00 0.00 46.02 44.26 1c1u n GLY 142 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1c1u n ASN 143 N -3.76 0.66 0.02 1.61 3.02 0.63 -3.51 115.26 113.93 1c1u n ASN 143 Ca 0.13 0.68 0.11 0.00 -0.03 0.00 0.00 54.58 55.47 1c1u n ASN 143 Cb 0.45 -1.42 -0.07 0.00 -0.61 0.00 0.00 39.78 38.13 1c1u n ASN 143 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1c1u n LEU 144 N -1.75 0.49 -3.89 3.41 4.77 -0.21 0.13 117.00 119.95 1c1u n LEU 144 Ca 0.13 -0.05 -0.09 0.00 -0.03 0.00 0.00 56.01 55.97 1c1u n LEU 144 Cb 0.49 -0.05 -0.07 0.00 -2.33 0.00 0.00 43.42 41.47 1c1u n LEU 144 CO 0.49 0.03 -0.02 -0.54 -1.33 0.00 0.00 177.39 176.02 1c1u s LYS 145 N -3.29 1.04 0.16 3.23 1.02 -1.26 -4.33 119.74 116.31 1c1u s LYS 145 Ca -0.00 -1.05 -0.13 0.00 0.02 0.00 0.00 55.97 54.81 1c1u s LYS 145 Cb 0.14 0.38 0.05 0.00 -0.52 0.00 0.00 37.83 37.87 1c1u s LYS 145 CO 0.85 -0.37 1.71 1.49 -0.92 0.00 0.00 175.35 178.10 1c1u h GLU 146 N 2.59 0.79 -0.96 1.68 4.81 -1.93 -3.48 114.58 118.08 1c1u h GLU 146 Ca -0.33 -0.15 0.01 0.00 -0.13 0.00 0.00 59.36 58.76 1c1u h GLU 146 Cb 1.22 -0.13 -0.20 0.00 0.63 0.00 0.00 28.75 30.27 1c1u h GLU 146 CO 0.51 0.70 -0.39 0.99 -0.73 0.00 0.00 179.01 180.09 1c1u s THR 147 N -5.53 -0.96 0.00 0.32 2.01 -1.26 -4.96 115.64 105.27 1c1u s THR 147 Ca -0.13 0.00 0.00 0.00 0.31 0.00 0.00 61.69 61.87 1c1u s THR 147 Cb 0.12 -0.58 0.00 0.00 0.01 0.00 0.00 72.50 72.04 1c1u s THR 147 CO 0.78 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 175.32 1c1u n GLY 155 N 5.00 0.62 3.01 4.40 0.00 -1.26 -5.15 105.19 111.81 1c1u n GLY 155 Ca 0.07 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.92 1c1u n GLY 155 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1c1u s GLN 156 N 0.00 0.61 0.56 1.61 -0.21 -1.26 -1.05 119.66 119.92 1c1u s GLN 156 Ca 0.00 -0.36 -0.04 0.00 0.02 0.00 0.00 55.36 54.98 1c1u s GLN 156 Cb 0.00 -0.56 0.01 0.00 1.00 0.00 0.00 33.01 33.46 1c1u s GLN 156 CO 0.00 0.15 0.85 -1.25 -2.12 0.00 0.00 175.29 172.91 1c1u s PRO 157 N -0.43 2.87 -0.05 2.91 0.04 -1.26 -4.94 135.00 134.14 1c1u s PRO 157 Ca 0.01 -0.20 0.20 0.00 0.04 0.00 0.00 61.00 61.06 1c1u s PRO 157 Cb -0.04 -2.35 -0.26 0.00 0.04 0.00 0.00 34.50 31.89 1c1u s PRO 157 CO -0.00 -0.64 0.46 -1.13 0.04 0.00 0.00 177.00 175.72 1c1u n SER 158 N -2.47 0.18 -4.40 6.66 3.41 -1.26 -4.70 113.62 111.04 1c1u n SER 158 Ca 0.04 0.08 -0.20 0.00 -0.26 0.00 0.00 58.87 58.52 1c1u n SER 158 Cb 0.58 1.36 -0.10 0.00 -0.26 0.00 0.00 64.21 65.78 1c1u n SER 158 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1c1u s VAL 159 N -3.14 1.88 0.38 -3.33 1.01 -1.26 -0.49 120.40 115.44 1c1u s VAL 159 Ca -0.07 -2.23 -0.28 0.00 0.00 0.00 0.00 61.98 59.40 1c1u s VAL 159 Cb 0.11 -2.21 -0.11 0.00 0.00 0.00 0.00 36.38 34.17 1c1u s VAL 159 CO 0.87 -0.47 1.49 -0.22 0.00 0.00 0.00 175.10 176.76 1c1u s LEU 160 N -3.39 4.31 0.24 3.92 2.96 -0.34 -4.84 118.68 121.54 1c1u s LEU 160 Ca 0.26 3.06 0.08 0.00 -0.22 0.00 0.00 54.13 57.31 1c1u s LEU 160 Cb -0.00 -3.68 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 1c1u s LEU 160 CO 0.10 -0.89 0.10 -1.10 -1.32 0.00 0.00 176.35 173.23 1c1u s GLN 161 N -2.12 2.63 0.01 1.98 -1.52 -0.81 -0.31 119.66 119.53 1c1u s GLN 161 Ca 0.53 -1.19 -0.05 0.00 -1.95 0.00 0.00 55.36 52.70 1c1u s GLN 161 Cb -0.47 -2.39 -0.01 0.00 -0.22 0.00 0.00 33.01 29.93 1c1u s GLN 161 CO 0.63 0.40 0.09 0.08 -0.25 0.00 0.00 175.29 176.24 1c1u s VAL 162 N -2.15 0.10 -0.11 1.09 1.01 0.28 -2.30 120.40 118.32 1c1u s VAL 162 Ca 0.32 -0.82 -0.22 0.00 0.00 0.00 0.00 61.98 61.26 1c1u s VAL 162 Cb -0.08 -0.50 0.05 0.00 0.00 0.00 0.00 36.38 35.86 1c1u s VAL 162 CO 0.22 -0.45 0.53 0.54 0.00 0.00 0.00 175.10 175.94 1c1u s VAL 163 N -1.66 0.01 -0.16 2.92 0.11 -1.09 -0.41 120.40 120.12 1c1u s VAL 163 Ca -0.13 -0.12 -0.03 0.00 -2.93 0.00 0.00 61.98 58.77 1c1u s VAL 163 Cb -0.07 -0.80 -0.02 0.00 -1.53 0.00 0.00 36.38 33.96 1c1u s VAL 163 CO -0.00 -0.07 -0.06 0.20 -3.33 0.00 0.00 175.10 171.84 1c1u s ASN 164 N -0.56 4.51 0.06 3.54 0.01 -1.26 -1.80 114.94 119.43 1c1u s ASN 164 Ca -0.07 -0.23 0.07 0.00 -0.71 0.00 0.00 52.86 51.92 1c1u s ASN 164 Cb -0.03 -1.73 -0.03 0.00 0.41 0.00 0.00 41.25 39.87 1c1u s ASN 164 CO 0.04 0.13 -0.19 -0.76 -1.51 0.00 0.00 177.10 174.81 1c1u s LEU 165 N 0.59 2.20 0.35 0.60 1.43 -0.00 -4.91 118.68 118.94 1c1u s LEU 165 Ca -0.04 -0.55 -0.26 0.00 -1.03 0.00 0.00 54.13 52.26 1c1u s LEU 165 Cb -0.15 -0.86 -0.10 0.00 0.03 0.00 0.00 46.19 45.12 1c1u s LEU 165 CO 0.03 0.10 0.99 -2.16 0.23 0.00 0.00 176.35 175.54 1c1u s PRO 166 N -1.35 4.44 0.36 1.29 0.04 -1.26 -0.81 135.00 137.70 1c1u s PRO 166 Ca 0.06 1.43 -0.25 0.00 0.04 0.00 0.00 61.00 62.27 1c1u s PRO 166 Cb -0.09 -2.73 -0.09 0.00 0.04 0.00 0.00 34.50 31.62 1c1u s PRO 166 CO 0.02 0.12 1.02 0.42 0.04 0.00 0.00 177.00 178.63 1c1u s ILE 167 N -1.60 3.84 0.13 0.56 1.01 0.03 -0.58 121.20 124.59 1c1u s ILE 167 Ca 0.53 1.51 0.07 0.00 0.00 0.00 0.00 60.65 62.75 1c1u s ILE 167 Cb -0.21 -3.82 -0.04 0.00 0.01 0.00 0.00 42.46 38.40 1c1u s ILE 167 CO 0.26 0.10 -0.07 -0.69 0.00 0.00 0.00 174.94 174.54 1c1u s VAL 168 N -1.58 3.49 0.23 2.92 1.01 -0.84 -0.81 120.40 124.81 1c1u s VAL 168 Ca 0.53 -1.32 -0.31 0.00 0.00 0.00 0.00 61.98 60.89 1c1u s VAL 168 Cb -0.22 -2.67 -0.11 0.00 0.00 0.00 0.00 36.38 33.38 1c1u s VAL 168 CO 0.28 0.04 1.55 -1.61 0.00 0.00 0.00 175.10 175.36 1c1u s GLU 169 N -2.44 4.20 0.25 2.72 8.01 -1.26 -4.64 118.70 125.53 1c1u s GLU 169 Ca 0.23 2.42 -0.06 0.00 0.01 0.00 0.00 54.97 57.58 1c1u s GLU 169 Cb -0.11 -3.10 0.45 0.00 -4.31 0.00 0.00 34.13 27.07 1c1u s GLU 169 CO 0.15 -0.57 1.65 0.00 0.01 0.00 0.00 175.26 176.51 1c1u h ARG 170 N 5.73 0.16 -0.88 1.61 3.08 -1.98 -0.96 114.38 121.13 1c1u h ARG 170 Ca -0.45 -0.01 0.11 0.00 0.07 0.00 0.00 59.98 59.70 1c1u h ARG 170 Cb 1.21 -0.04 -0.07 0.00 0.08 0.00 0.00 29.97 31.16 1c1u h ARG 170 CO 0.84 0.10 0.57 -1.00 -1.07 0.00 0.00 179.97 179.42 1c1u h PRO 171 N 0.16 0.80 -0.17 0.04 0.13 -1.99 0.14 132.00 131.11 1c1u h PRO 171 Ca 0.42 -0.05 -0.13 0.00 -0.87 0.00 0.00 66.00 65.36 1c1u h PRO 171 Cb 0.73 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 31.67 1c1u h PRO 171 CO -0.60 0.53 -0.46 0.28 -0.23 0.00 0.00 178.00 177.51 1c1u h VAL 172 N 0.82 1.32 -0.10 1.56 2.07 -1.58 -0.72 116.25 119.63 1c1u h VAL 172 Ca 0.42 -1.67 -0.02 0.00 0.82 0.00 0.00 66.70 66.26 1c1u h VAL 172 Cb 0.49 1.70 -0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1c1u h VAL 172 CO -0.18 0.51 0.00 0.00 0.02 0.00 0.00 177.57 177.92 1c1u h LYS 174 N -0.09 1.06 0.00 0.00 1.57 -0.67 -2.72 116.57 115.71 1c1u h LYS 174 Ca 0.03 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1c1u h LYS 174 Cb 0.33 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1c1u h LYS 174 CO 0.00 0.76 0.00 -0.25 -0.57 0.00 0.00 179.45 179.40 1c1u n ASP 175 N -4.47 0.00 -0.32 0.86 8.00 -0.29 -2.79 116.55 117.55 1c1u n ASP 175 Ca 0.07 -1.37 0.09 0.00 0.71 0.00 0.00 54.79 54.29 1c1u n ASP 175 Cb 0.07 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.15 1c1u n ASP 175 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1c1u n SER 176 N -0.68 1.55 -4.07 -2.24 3.41 -1.03 -5.00 113.62 105.56 1c1u n SER 176 Ca 0.07 -1.28 -0.10 0.00 -0.26 0.00 0.00 58.87 57.30 1c1u n SER 176 Cb 0.03 0.59 -0.07 0.00 -0.26 0.00 0.00 64.21 64.50 1c1u n SER 176 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1c1u s THR 177 N -2.21 0.00 -1.30 6.66 -1.32 -1.12 -4.86 115.64 111.49 1c1u s THR 177 Ca 0.13 -1.67 0.21 0.00 -1.21 0.00 0.00 61.69 59.16 1c1u s THR 177 Cb 0.14 -2.34 -0.16 0.00 -1.51 0.00 0.00 72.50 68.64 1c1u s THR 177 CO 0.52 0.00 0.94 0.54 -2.21 0.00 0.00 174.62 174.41 1c1u n ARG 178 N -0.34 0.48 -2.90 7.08 1.74 -1.26 -4.94 116.66 116.52 1c1u n ARG 178 Ca 0.00 -0.31 -0.33 0.00 -0.77 0.00 0.00 57.85 56.45 1c1u n ARG 178 Cb 0.64 -1.48 -0.07 0.00 -1.02 0.00 0.00 32.46 30.53 1c1u n ARG 178 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1c1u s ILE 179 N -2.80 4.46 -0.35 0.55 1.01 -1.26 -4.98 121.20 117.83 1c1u s ILE 179 Ca 0.11 1.36 -0.29 0.00 0.00 0.00 0.00 60.65 61.83 1c1u s ILE 179 Cb 0.16 -3.61 0.02 0.00 0.01 0.00 0.00 42.46 39.04 1c1u s ILE 179 CO 0.76 -0.28 1.07 -0.60 0.00 0.00 0.00 174.94 175.89 1c1u s ARG 180 N -3.11 4.00 0.09 2.79 3.52 -1.26 -5.02 118.95 119.95 1c1u s ARG 180 Ca 0.60 0.95 -0.24 0.00 -0.13 0.00 0.00 55.73 56.91 1c1u s ARG 180 Cb -0.09 -3.77 -0.07 0.00 -1.56 0.00 0.00 34.95 29.46 1c1u s ARG 180 CO 0.14 -0.97 0.72 0.42 -0.81 0.00 0.00 175.30 174.80 1c1u s ILE 181 N 3.74 4.62 0.50 4.11 -1.09 -1.26 -4.85 121.20 126.96 1c1u s ILE 181 Ca 0.45 1.55 0.02 0.00 -2.23 0.00 0.00 60.65 60.44 1c1u s ILE 181 Cb -0.11 -4.07 0.02 0.00 -1.58 0.00 0.00 42.46 36.72 1c1u s ILE 181 CO 0.18 0.46 0.19 0.35 -1.23 0.00 0.00 174.94 174.88 1c1u n THR 182 N 2.18 0.00 0.62 2.92 -2.24 -1.26 -5.01 114.28 111.49 1c1u n THR 182 Ca -0.05 -2.17 0.13 0.00 -2.27 0.00 0.00 64.05 59.68 1c1u n THR 182 Cb 0.50 0.21 0.45 0.00 -2.10 0.00 0.00 70.33 69.39 1c1u n THR 182 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1c1u n ASP 183 N -1.56 0.60 -0.87 3.42 8.00 -1.26 -3.09 116.55 121.79 1c1u n ASP 183 Ca -0.11 0.58 0.02 0.00 0.71 0.00 0.00 54.79 55.99 1c1u n ASP 183 Cb 0.60 -0.73 0.12 0.00 -0.02 0.00 0.00 41.12 41.09 1c1u n ASP 183 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1c1u n ASN 184 N -2.09 2.33 -4.04 -2.24 3.02 -1.26 -4.83 115.26 106.14 1c1u n ASN 184 Ca 0.05 -2.25 -0.08 0.00 -0.03 0.00 0.00 54.58 52.26 1c1u n ASN 184 Cb 0.35 -0.51 -0.09 0.00 -0.61 0.00 0.00 39.78 38.92 1c1u n ASN 184 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1c1u s MET 185 N -1.57 0.82 0.16 3.52 -1.94 -1.18 -1.45 119.30 117.65 1c1u s MET 185 Ca 0.17 -1.23 -0.11 0.00 -1.71 0.00 0.00 55.69 52.81 1c1u s MET 185 Cb 0.12 0.27 0.00 0.00 2.01 0.00 0.00 34.83 37.24 1c1u s MET 185 CO 0.06 -0.22 0.33 -0.59 -0.01 0.00 0.00 175.02 174.59 1c1u s PHE 186 N -3.95 0.19 0.20 -0.03 -0.12 -0.78 -4.81 117.98 108.68 1c1u s PHE 186 Ca 0.13 -0.56 0.08 0.00 -0.05 0.00 0.00 56.93 56.52 1c1u s PHE 186 Cb 0.07 0.07 -0.05 0.00 -0.63 0.00 0.00 43.02 42.48 1c1u s PHE 186 CO -0.06 -0.74 -0.14 0.00 -0.05 0.00 0.00 175.22 174.24 1c1u s ALA 188 N -2.99 -0.41 0.00 0.00 0.00 -0.56 -2.00 121.76 115.80 1c1u s ALA 188 Ca 0.22 -0.34 0.00 0.00 0.00 0.00 0.00 51.96 51.84 1c1u s ALA 188 Cb -0.01 0.40 0.00 0.00 0.00 0.00 0.00 23.12 23.52 1c1u s ALA 188 CO 0.06 -0.45 0.00 0.41 0.00 0.00 0.00 175.76 175.78 1c1u n GLY 189 N 0.30 3.08 3.88 0.00 0.00 0.25 -2.50 105.19 110.19 1c1u n GLY 189 Ca -0.17 -1.59 -0.32 0.00 0.00 0.00 0.00 46.02 43.95 1c1u n GLY 189 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1c1u s TYR 190 N -2.00 3.43 0.55 1.61 2.02 -1.26 -4.50 117.35 117.20 1c1u s TYR 190 Ca 0.00 0.81 -0.16 0.00 -0.37 0.00 0.00 57.07 57.35 1c1u s TYR 190 Cb 0.00 -2.21 -0.06 0.00 -0.40 0.00 0.00 41.96 39.29 1c1u s TYR 190 CO 0.00 0.29 1.02 0.15 -1.57 0.00 0.00 175.55 175.44 1c1u s LYS 191 N -2.84 3.63 0.38 -0.62 -0.14 -1.26 -4.84 119.74 114.05 1c1u s LYS 191 Ca 0.46 1.10 0.13 0.00 -1.36 0.00 0.00 55.97 56.31 1c1u s LYS 191 Cb -0.11 -2.08 0.95 0.00 -1.68 0.00 0.00 37.83 34.90 1c1u s LYS 191 CO 0.22 -0.54 1.85 -1.35 -0.76 0.00 0.00 175.35 174.76 1c1u h PRO 192 N 0.72 0.53 -0.49 -1.68 0.11 -1.95 -0.26 132.00 128.99 1c1u h PRO 192 Ca -0.47 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 1c1u h PRO 192 Cb 1.20 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 1c1u h PRO 192 CO 0.59 0.35 0.30 0.22 -0.21 0.00 0.00 178.00 179.26 1c1u h ASP 192 N 0.55 0.57 0.07 -2.05 1.82 -1.96 -3.22 116.42 112.20 1c1u h ASP 192 Ca 0.48 -0.02 0.00 0.00 -0.39 0.00 0.00 57.03 57.10 1c1u h ASP 192 Cb 0.99 -0.14 0.00 0.00 0.68 0.00 0.00 39.33 40.86 1c1u h ASP 192 CO -0.22 0.43 0.00 -0.62 -1.61 0.00 0.00 179.24 177.22 1c1u n GLU 192 N -4.44 0.77 -4.04 0.28 1.02 -0.11 -4.94 120.64 109.19 1c1u n GLU 192 Ca 0.04 0.01 -0.27 0.00 -0.02 0.00 0.00 57.16 56.92 1c1u n GLU 192 Cb 0.07 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 29.96 1c1u n GLU 192 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1c1u n GLY 192 N 0.72 -0.23 3.26 0.62 0.00 -1.22 -4.96 105.19 103.38 1c1u n GLY 192 Ca 0.19 0.15 -0.13 0.00 0.00 0.00 0.00 46.02 46.23 1c1u n GLY 192 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c1u s LYS 192 N -6.72 0.59 0.21 1.61 1.02 -1.26 -5.18 119.74 110.01 1c1u s LYS 192 Ca 0.07 0.09 0.02 0.00 0.02 0.00 0.00 55.97 56.17 1c1u s LYS 192 Cb -0.04 0.27 -0.01 0.00 -0.52 0.00 0.00 37.83 37.54 1c1u s LYS 192 CO 0.91 -0.14 0.07 0.54 -0.92 0.00 0.00 175.35 175.81 1c1u n ARG 193 N 1.86 0.82 0.00 1.68 5.12 -1.26 -4.70 116.66 120.17 1c1u n ARG 193 Ca -0.18 -1.71 0.00 0.00 -1.93 0.00 0.00 57.85 54.03 1c1u n ARG 193 Cb 0.57 0.89 0.00 0.00 -1.16 0.00 0.00 32.46 32.75 1c1u n ARG 193 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1c1u n GLY 194 N 0.90 4.46 3.59 -0.13 0.00 -1.26 -4.92 105.19 107.84 1c1u n GLY 194 Ca -0.03 -1.31 0.01 0.00 0.00 0.00 0.00 46.02 44.69 1c1u n GLY 194 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1c1u s ASP 195 N 0.00 -0.02 0.70 1.61 2.15 -0.95 -4.73 116.67 115.43 1c1u s ASP 195 Ca 0.00 -0.02 -0.03 0.00 0.43 0.00 0.00 52.55 52.93 1c1u s ASP 195 Cb 0.00 0.04 0.10 0.00 -0.30 0.00 0.00 42.92 42.76 1c1u s ASP 195 CO 0.00 -0.07 0.98 0.00 -0.17 0.00 0.00 175.17 175.91 1c1u s ALA 196 N -2.10 3.51 0.30 3.66 0.00 -1.26 -0.72 121.76 125.15 1c1u s ALA 196 Ca 0.14 -1.45 -0.18 0.00 0.00 0.00 0.00 51.96 50.46 1c1u s ALA 196 Cb 0.04 -2.20 0.06 0.00 0.00 0.00 0.00 23.12 21.02 1c1u s ALA 196 CO -0.05 -1.37 0.88 0.00 0.00 0.00 0.00 175.76 175.22 1c1u n GLU 198 N -0.59 0.65 0.00 0.00 1.02 -1.26 -1.32 120.64 119.14 1c1u n GLU 198 Ca -0.06 0.24 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 1c1u n GLU 198 Cb 0.60 -1.83 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 1c1u n GLU 198 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1c1u n GLY 199 N 2.88 3.06 0.03 0.62 0.00 -1.26 -0.27 105.19 110.25 1c1u n GLY 199 Ca 0.23 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.36 1c1u n GLY 199 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1c1u n ASP 200 N 0.00 0.63 -4.53 1.61 8.00 -0.44 -3.98 116.55 117.84 1c1u n ASP 200 Ca 0.00 -0.15 -0.42 0.00 0.71 0.00 0.00 54.79 54.92 1c1u n ASP 200 Cb 0.00 0.49 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 1c1u n ASP 200 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1c1u n SER 201 N -1.88 0.27 0.00 -2.24 7.64 -1.26 -2.19 113.62 113.96 1c1u n SER 201 Ca 0.03 1.02 0.00 0.00 1.01 0.00 0.00 58.87 60.93 1c1u n SER 201 Cb 0.41 -1.22 0.00 0.00 -1.01 0.00 0.00 64.21 62.39 1c1u n SER 201 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c1u n GLY 202 N 1.48 2.81 3.95 0.23 0.00 -0.54 -0.47 105.19 112.64 1c1u n GLY 202 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 1c1u n GLY 202 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c1u s GLY 203 N -1.79 1.74 0.23 -0.02 0.00 -0.93 -3.21 107.32 103.34 1c1u s GLY 203 Ca 0.00 -1.25 -0.15 0.00 0.00 0.00 0.00 44.72 43.32 1c1u s GLY 203 CO 0.00 -0.65 0.64 2.56 0.00 0.00 0.00 173.10 175.65 1c1u s PRO 204 N -5.49 4.01 -0.20 2.90 0.04 -1.26 -0.91 135.00 134.09 1c1u s PRO 204 Ca 0.67 0.58 -0.01 0.00 0.04 0.00 0.00 61.00 62.29 1c1u s PRO 204 Cb -0.06 -2.72 0.01 0.00 0.04 0.00 0.00 34.50 31.77 1c1u s PRO 204 CO 0.48 0.33 -0.13 0.12 0.04 0.00 0.00 177.00 177.85 1c1u s PHE 205 N -1.70 2.89 0.21 0.56 2.19 -0.67 -3.61 117.98 117.85 1c1u s PHE 205 Ca 0.46 -1.44 0.08 0.00 0.33 0.00 0.00 56.93 56.36 1c1u s PHE 205 Cb -0.13 -2.00 -0.05 0.00 -1.31 0.00 0.00 43.02 39.53 1c1u s PHE 205 CO 0.19 -0.72 -0.15 0.14 1.83 0.00 0.00 175.22 176.52 1c1u s VAL 206 N 1.35 1.75 0.10 3.12 -7.23 0.22 -1.56 120.40 118.14 1c1u s VAL 206 Ca 0.04 -2.21 0.04 0.00 -1.81 0.00 0.00 61.98 58.04 1c1u s VAL 206 Cb -0.14 -2.05 -0.04 0.00 0.56 0.00 0.00 36.38 34.72 1c1u s VAL 206 CO -0.09 -0.59 -0.10 -0.04 -0.31 0.00 0.00 175.10 173.97 1c1u s MET 207 N -3.63 0.85 -0.22 4.82 -1.94 0.42 -1.10 119.30 118.50 1c1u s MET 207 Ca 0.22 -1.16 -0.06 0.00 -1.71 0.00 0.00 55.69 52.99 1c1u s MET 207 Cb -0.01 -0.54 -0.02 0.00 2.01 0.00 0.00 34.83 36.27 1c1u s MET 207 CO 0.07 0.08 0.02 0.21 -0.01 0.00 0.00 175.02 175.39 1c1u s LYS 208 N -2.78 3.60 -0.01 2.03 2.20 -1.26 -0.65 119.74 122.87 1c1u s LYS 208 Ca 0.05 -0.52 -0.30 0.00 -0.36 0.00 0.00 55.97 54.84 1c1u s LYS 208 Cb -0.03 -3.14 -0.05 0.00 -1.51 0.00 0.00 37.83 33.10 1c1u s LYS 208 CO 0.00 -0.07 1.32 0.45 -0.36 0.00 0.00 175.35 176.69 1c1u s SER 209 N 1.24 6.93 0.00 1.43 0.15 0.42 -4.88 113.70 118.99 1c1u s SER 209 Ca 0.04 2.03 0.20 0.00 0.70 0.00 0.00 55.95 58.91 1c1u s SER 209 Cb -0.15 -2.56 0.94 0.00 -1.71 0.00 0.00 66.02 62.54 1c1u s SER 209 CO 0.02 -0.65 1.62 -0.81 1.20 0.00 0.00 173.24 174.61 1c1u n PRO 210 N 5.12 0.18 -0.08 5.44 -0.04 -1.26 -0.99 135.00 143.37 1c1u n PRO 210 Ca 0.12 0.12 -0.23 0.00 -0.04 0.00 0.00 63.50 63.48 1c1u n PRO 210 Cb 0.45 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.29 1c1u n PRO 210 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1c1u n PHE 210 N -1.36 0.82 -0.31 0.54 3.72 -1.26 -4.63 117.46 114.97 1c1u n PHE 210 Ca 0.08 0.27 0.02 0.00 -0.05 0.00 0.00 57.45 57.77 1c1u n PHE 210 Cb 0.18 -1.09 0.02 0.00 -0.94 0.00 0.00 39.48 37.65 1c1u n PHE 210 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1c1u n ASN 210 N -4.03 1.83 -0.61 4.37 0.23 -1.24 -5.01 115.26 110.80 1c1u n ASN 210 Ca -0.37 -2.09 -0.08 0.00 -0.53 0.00 0.00 54.58 51.51 1c1u n ASN 210 Cb 0.85 -0.08 -0.03 0.00 -2.08 0.00 0.00 39.78 38.44 1c1u n ASN 210 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1c1u n ASN 211 N -0.60 -5.64 -4.95 0.53 4.13 -0.16 -4.98 115.26 103.59 1c1u n ASN 211 Ca 0.03 0.20 -0.23 0.00 1.68 0.00 0.00 54.58 56.25 1c1u n ASN 211 Cb 0.35 -3.84 -0.01 0.00 -1.54 0.00 0.00 39.78 34.73 1c1u n ASN 211 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1c1u s ARG 212 N -2.61 3.46 -0.15 3.52 0.52 -1.25 -4.75 118.95 117.69 1c1u s ARG 212 Ca 0.00 -0.44 -0.08 0.00 -0.52 0.00 0.00 55.73 54.68 1c1u s ARG 212 Cb 0.00 -2.71 -0.04 0.00 0.52 0.00 0.00 34.95 32.71 1c1u s ARG 212 CO 0.00 0.20 0.13 -1.58 0.02 0.00 0.00 175.30 174.07 1c1u s TRP 213 N -2.25 3.51 0.06 -0.53 0.52 -1.26 -0.44 118.94 118.56 1c1u s TRP 213 Ca 0.39 0.43 0.09 0.00 0.02 0.00 0.00 56.10 57.03 1c1u s TRP 213 Cb -0.09 -2.03 -0.03 0.00 -1.15 0.00 0.00 33.47 30.16 1c1u s TRP 213 CO 0.34 0.54 -0.25 0.71 0.02 0.00 0.00 176.95 178.31 1c1u s TYR 214 N -0.42 2.18 -0.47 -1.98 2.02 0.17 -2.66 117.35 116.18 1c1u s TYR 214 Ca 0.12 -0.40 -0.17 0.00 -0.37 0.00 0.00 57.07 56.25 1c1u s TYR 214 Cb -0.12 -1.27 0.06 0.00 -0.40 0.00 0.00 41.96 40.23 1c1u s TYR 214 CO 0.01 0.16 0.48 -1.14 -1.57 0.00 0.00 175.55 173.49 1c1u s GLN 215 N -1.42 3.05 -0.03 -0.62 0.74 -0.60 -0.43 119.66 120.34 1c1u s GLN 215 Ca 0.11 -1.07 0.09 0.00 0.05 0.00 0.00 55.36 54.54 1c1u s GLN 215 Cb -0.10 -4.08 -0.23 0.00 1.10 0.00 0.00 33.01 29.69 1c1u s GLN 215 CO 0.03 -1.05 0.70 0.52 -0.55 0.00 0.00 175.29 174.94 1c1u h MET 216 N 8.83 0.05 -4.56 1.67 2.86 -1.62 -3.39 114.93 118.75 1c1u h MET 216 Ca -0.28 -0.08 -0.28 0.00 -2.06 0.00 0.00 59.70 57.00 1c1u h MET 216 Cb 1.11 0.03 -0.14 0.00 0.06 0.00 0.00 31.60 32.66 1c1u h MET 216 CO 0.89 0.66 -0.52 0.20 1.06 0.00 0.00 176.91 179.19 1c1u s GLY 217 N -5.12 1.59 -0.05 8.32 0.00 -1.12 -1.86 107.32 109.09 1c1u s GLY 217 Ca -0.06 -1.72 0.05 0.00 0.00 0.00 0.00 44.72 42.99 1c1u s GLY 217 CO 0.82 -1.33 -0.20 -0.42 0.00 0.00 0.00 173.10 171.97 1c1u s ILE 218 N -3.90 1.64 -0.05 0.90 1.01 -1.01 -1.67 121.20 118.11 1c1u s ILE 218 Ca 0.38 -0.84 -0.30 0.00 0.00 0.00 0.00 60.65 59.89 1c1u s ILE 218 Cb 0.05 -1.39 -0.06 0.00 0.01 0.00 0.00 42.46 41.06 1c1u s ILE 218 CO 0.16 0.46 1.82 -0.69 0.00 0.00 0.00 174.94 176.70 1c1u s VAL 219 N -0.07 3.33 -0.02 2.92 1.01 -0.08 -1.45 120.40 126.04 1c1u s VAL 219 Ca -0.03 0.39 -0.05 0.00 0.00 0.00 0.00 61.98 62.29 1c1u s VAL 219 Cb -0.12 -3.28 -0.02 0.00 0.00 0.00 0.00 36.38 32.97 1c1u s VAL 219 CO 0.02 -0.06 -0.10 -0.24 0.00 0.00 0.00 175.10 174.72 1c1u n SER 220 N 7.86 0.93 -3.66 3.32 2.88 -0.81 -1.47 113.62 122.67 1c1u n SER 220 Ca 0.20 0.14 -0.08 0.00 -1.33 0.00 0.00 58.87 57.79 1c1u n SER 220 Cb 0.43 -0.41 -0.02 0.00 -0.75 0.00 0.00 64.21 63.45 1c1u n SER 220 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1c1u s TRP 221 N -1.88 0.08 0.08 0.66 1.48 -0.96 -4.93 118.94 113.46 1c1u s TRP 221 Ca -0.08 -0.55 -0.27 0.00 -1.06 0.00 0.00 56.10 54.15 1c1u s TRP 221 Cb 0.01 0.57 0.09 0.00 -1.16 0.00 0.00 33.47 32.98 1c1u s TRP 221 CO 0.12 -1.25 1.13 0.20 -4.06 0.00 0.00 176.95 173.09 1c1u s GLY 222 N -2.99 -0.20 -0.47 3.67 0.00 -1.26 -0.31 107.32 105.75 1c1u s GLY 222 Ca 0.16 0.20 0.01 0.00 0.00 0.00 0.00 44.72 45.08 1c1u s GLY 222 CO 0.09 1.26 0.23 -0.54 0.00 0.00 0.00 173.10 174.14 1c1u s GLU 223 N -2.59 2.00 0.51 2.90 2.02 -1.26 -4.98 118.70 117.29 1c1u s GLU 223 Ca 0.17 -2.20 0.00 0.00 0.02 0.00 0.00 54.97 52.96 1c1u s GLU 223 Cb 0.01 -3.46 0.00 0.00 0.10 0.00 0.00 34.13 30.78 1c1u s GLU 223 CO 0.01 -1.07 0.00 0.41 0.02 0.00 0.00 175.26 174.62 1c1u n GLY 225 N 3.88 -2.18 2.90 -1.39 0.00 -1.26 -4.74 105.19 102.39 1c1u n GLY 225 Ca 0.04 -1.67 -0.27 0.00 0.00 0.00 0.00 46.02 44.12 1c1u n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c1u n ASP 227 N 4.95 -1.82 -4.86 0.00 2.03 -1.26 -4.49 116.55 111.09 1c1u n ASP 227 Ca -0.12 -0.68 -0.34 0.00 0.52 0.00 0.00 54.79 54.17 1c1u n ASP 227 Cb 0.50 -4.83 -0.05 0.00 -0.72 0.00 0.00 41.12 36.02 1c1u n ASP 227 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1c1u s ARG 227 N -5.53 3.82 0.41 -0.67 0.52 -1.26 -4.97 118.95 111.26 1c1u s ARG 227 Ca 0.00 0.26 -0.24 0.00 -0.52 0.00 0.00 55.73 55.23 1c1u s ARG 227 Cb -0.00 -2.90 -0.09 0.00 0.52 0.00 0.00 34.95 32.48 1c1u s ARG 227 CO 0.75 0.48 1.06 -0.51 0.02 0.00 0.00 175.30 177.11 1c1u s ASP 228 N -1.92 6.67 0.00 0.23 1.11 -1.26 -2.77 116.67 118.73 1c1u s ASP 228 Ca 0.38 2.07 0.00 0.00 0.18 0.00 0.00 52.55 55.17 1c1u s ASP 228 Cb -0.14 -2.59 0.00 0.00 1.07 0.00 0.00 42.92 41.27 1c1u s ASP 228 CO 0.20 -0.55 0.00 0.61 1.18 0.00 0.00 175.17 176.60 1c1u n GLY 229 N 0.33 1.00 3.58 0.21 0.00 -1.26 -5.01 105.19 104.03 1c1u n GLY 229 Ca 0.05 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 1c1u n GLY 229 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c1u s LYS 230 N -0.14 1.91 0.22 1.61 -0.14 -1.11 -4.77 119.74 117.31 1c1u s LYS 230 Ca 0.00 -1.91 -0.01 0.00 -1.36 0.00 0.00 55.97 52.68 1c1u s LYS 230 Cb 0.00 -1.76 -0.03 0.00 -1.68 0.00 0.00 37.83 34.36 1c1u s LYS 230 CO 0.00 0.11 0.19 0.71 -0.76 0.00 0.00 175.35 175.60 1c1u s TYR 231 N -2.60 1.14 0.03 3.18 2.02 -1.26 -4.76 117.35 115.10 1c1u s TYR 231 Ca 0.34 -1.34 -0.00 0.00 -0.37 0.00 0.00 57.07 55.69 1c1u s TYR 231 Cb 0.03 -0.48 -0.04 0.00 -0.40 0.00 0.00 41.96 41.06 1c1u s TYR 231 CO 0.17 -0.72 0.16 0.20 -1.57 0.00 0.00 175.55 173.80 1c1u s GLY 232 N -3.17 2.13 0.05 0.71 0.00 -1.04 -4.43 107.32 101.57 1c1u s GLY 232 Ca 0.37 -0.85 0.07 0.00 0.00 0.00 0.00 44.72 44.31 1c1u s GLY 232 CO 0.14 -0.79 -0.17 -1.36 0.00 0.00 0.00 173.10 170.92 1c1u s PHE 233 N -1.39 2.59 0.04 1.90 0.40 0.58 -1.50 117.98 120.61 1c1u s PHE 233 Ca 0.30 -0.23 0.03 0.00 -0.60 0.00 0.00 56.93 56.43 1c1u s PHE 233 Cb -0.13 -1.46 -0.02 0.00 0.51 0.00 0.00 43.02 41.92 1c1u s PHE 233 CO 0.22 0.28 -0.10 0.71 0.70 0.00 0.00 175.22 177.04 1c1u s TYR 234 N -0.96 0.87 0.35 0.36 1.51 -0.35 -1.92 117.35 117.21 1c1u s TYR 234 Ca 0.15 -0.40 -0.27 0.00 -1.01 0.00 0.00 57.07 55.54 1c1u s TYR 234 Cb -0.11 -0.51 -0.09 0.00 -0.11 0.00 0.00 41.96 41.14 1c1u s TYR 234 CO 0.06 -0.02 1.15 0.99 -1.11 0.00 0.00 175.55 176.62 1c1u s THR 235 N -1.07 3.29 -0.84 -0.71 2.01 -0.53 -1.87 115.64 115.91 1c1u s THR 235 Ca -0.04 1.17 -0.21 0.00 0.31 0.00 0.00 61.69 62.91 1c1u s THR 235 Cb -0.08 -3.69 0.09 0.00 0.01 0.00 0.00 72.50 68.83 1c1u s THR 235 CO 0.01 0.18 1.12 -2.28 -0.69 0.00 0.00 174.62 172.96 1c1u s HIS 236 N -1.33 2.85 0.21 4.92 2.46 -0.53 -2.40 115.29 121.47 1c1u s HIS 236 Ca 0.52 -0.97 -0.10 0.00 0.47 0.00 0.00 55.06 54.99 1c1u s HIS 236 Cb -0.31 -4.36 0.21 0.00 -0.13 0.00 0.00 32.58 27.99 1c1u s HIS 236 CO 0.40 -1.63 1.84 0.28 -2.47 0.00 0.00 174.74 173.15 1c1u h VAL 237 N 6.03 1.06 -0.56 0.89 2.07 -1.69 -2.43 116.25 121.62 1c1u h VAL 237 Ca -0.01 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.24 1c1u h VAL 237 Cb 1.04 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 1c1u h VAL 237 CO 1.19 0.15 0.37 0.15 0.02 0.00 0.00 177.57 179.44 1c1u h PHE 238 N 0.82 0.69 -0.02 1.57 3.57 -1.88 -1.70 116.94 119.99 1c1u h PHE 238 Ca 0.29 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.81 1c1u h PHE 238 Cb 0.07 -0.23 -0.00 0.00 2.79 0.00 0.00 35.95 38.57 1c1u h PHE 238 CO -0.05 0.43 0.03 0.00 -2.23 0.00 0.00 178.31 176.49 1c1u h ARG 239 N 0.74 0.00 -0.29 1.11 3.08 -1.82 -1.75 114.38 115.45 1c1u h ARG 239 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1c1u h ARG 239 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.98 1c1u h ARG 239 CO -0.05 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.13 1c1u n LEU 240 N -3.51 3.16 0.11 3.04 4.77 -0.71 -4.70 117.00 119.16 1c1u n LEU 240 Ca -0.02 -2.35 0.04 0.00 -0.03 0.00 0.00 56.01 53.65 1c1u n LEU 240 Cb 0.11 -0.32 0.47 0.00 -2.33 0.00 0.00 43.42 41.35 1c1u n LEU 240 CO 0.24 0.70 1.04 0.50 -1.33 0.00 0.00 177.39 178.54 1c1u h LYS 241 N 1.79 0.29 -0.19 3.23 3.64 -0.53 -2.26 116.57 122.55 1c1u h LYS 241 Ca 0.00 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.25 1c1u h LYS 241 Cb 0.95 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.70 1c1u h LYS 241 CO 0.07 0.27 -0.31 0.87 -2.27 0.00 0.00 179.45 178.09 1c1u h LYS 242 N 0.30 0.37 -0.54 1.90 1.79 -1.84 -1.34 116.57 117.20 1c1u h LYS 242 Ca 0.07 -0.15 -0.01 0.00 -2.18 0.00 0.00 60.65 58.39 1c1u h LYS 242 Cb 0.11 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 30.72 1c1u h LYS 242 CO -0.00 0.64 0.30 2.35 -1.08 0.00 0.00 179.45 181.65 1c1u h TRP 243 N 0.32 0.74 0.22 -1.35 7.01 -1.77 -1.14 115.95 119.98 1c1u h TRP 243 Ca 0.04 -0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.03 1c1u h TRP 243 Cb 0.70 -0.24 -0.02 0.00 -2.10 0.00 0.00 29.16 27.50 1c1u h TRP 243 CO 0.02 0.54 -0.26 0.82 -2.79 0.00 0.00 178.44 176.78 1c1u h ILE 244 N 0.73 0.45 -0.32 2.65 2.04 -1.16 -1.91 117.51 119.99 1c1u h ILE 244 Ca 0.19 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.12 1c1u h ILE 244 Cb 0.05 0.45 -0.07 0.00 -0.74 0.00 0.00 36.82 36.51 1c1u h ILE 244 CO -0.03 0.00 -0.13 1.56 0.00 0.00 0.00 178.15 179.55 1c1u h GLN 245 N -0.52 -0.07 0.01 2.37 4.20 -1.02 -1.34 115.11 118.74 1c1u h GLN 245 Ca 0.00 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.75 1c1u h GLN 245 Cb 0.50 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.24 1c1u h GLN 245 CO -0.08 -0.04 -0.36 -0.22 -0.67 0.00 0.00 178.83 177.45 1c1u h LYS 246 N -0.07 -0.51 0.00 1.46 3.64 -0.95 0.61 116.57 120.76 1c1u h LYS 246 Ca 0.16 0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.51 1c1u h LYS 246 Cb 0.31 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1c1u h LYS 246 CO -0.37 -0.34 -0.29 -0.39 -2.27 0.00 0.00 179.45 175.79 1c1u h VAL 247 N -0.52 1.03 0.13 2.00 -1.51 -1.06 -0.68 116.25 115.62 1c1u h VAL 247 Ca 0.05 -1.07 -0.01 0.00 -1.23 0.00 0.00 66.70 64.44 1c1u h VAL 247 Cb 0.61 1.61 0.00 0.00 -2.13 0.00 0.00 31.29 31.38 1c1u h VAL 247 CO -0.28 0.29 -0.06 0.40 -1.23 0.00 0.00 177.57 176.68 1c1u h ILE 248 N 0.00 1.05 0.00 7.19 2.04 -0.36 -1.48 117.51 125.94 1c1u h ILE 248 Ca -0.00 -1.04 0.00 0.00 1.00 0.00 0.00 64.86 64.82 1c1u h ILE 248 Cb 0.59 1.66 0.00 0.00 -0.74 0.00 0.00 36.82 38.33 1c1u h ILE 248 CO 0.04 0.23 0.00 -0.90 0.00 0.00 0.00 178.15 177.52 1c1u n ASP 249 N -4.94 0.00 -0.03 1.72 5.68 0.12 0.07 116.55 119.17 1c1u n ASP 249 Ca -0.08 -0.40 -0.16 0.00 -0.50 0.00 0.00 54.79 53.65 1c1u n ASP 249 Cb 0.26 -0.19 -0.14 0.00 -1.14 0.00 0.00 41.12 39.91 1c1u n ASP 249 CO 0.00 0.00 0.00 1.67 -1.33 0.00 0.00 177.20 177.54 1c1u n GLN 250 N -1.19 0.70 -0.13 0.11 7.27 -0.27 -4.51 117.38 119.35 1c1u n GLN 250 Ca 0.17 0.23 0.04 0.00 0.07 0.00 0.00 57.00 57.50 1c1u n GLN 250 Cb 0.19 -1.68 0.11 0.00 2.41 0.00 0.00 30.24 31.26 1c1u n GLN 250 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 1c1u n PHE 251 N -3.25 0.32 0.00 3.69 3.72 -0.56 -5.08 117.46 116.30 1c1u n PHE 251 Ca -0.30 -0.54 0.00 0.00 -0.05 0.00 0.00 57.45 56.55 1c1u n PHE 251 Cb 1.05 -0.06 0.00 0.00 -0.94 0.00 0.00 39.48 39.53 1c1u n PHE 251 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1c1u n GLY 252 N 0.03 0.28 0.00 1.37 0.00 0.11 -5.00 105.19 101.99 1c1u n GLY 252 Ca 0.09 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.96 1c1u n GLY 252 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11