#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sb1 s VAL 17 N 0.00 5.35 -1.38 1.39 1.01 0.22 -4.14 120.40 122.86 1sb1 s VAL 17 Ca 0.00 0.17 -0.03 0.00 0.00 0.00 0.00 61.98 62.12 1sb1 s VAL 17 Cb 0.00 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.95 1sb1 s VAL 17 CO 0.00 0.45 0.44 -0.62 0.00 0.00 0.00 175.10 175.37 1sb1 n GLU 18 N 3.43 -3.77 0.00 2.72 -0.58 -1.26 -2.16 120.64 119.02 1sb1 n GLU 18 Ca -0.16 0.81 0.00 0.00 -0.42 0.00 0.00 57.16 57.38 1sb1 n GLU 18 Cb 0.52 -5.39 0.00 0.00 -0.57 0.00 0.00 31.44 26.00 1sb1 n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1sb1 n GLY 19 N -1.36 3.19 3.50 0.62 0.00 -1.26 -4.61 105.19 105.27 1sb1 n GLY 19 Ca -0.12 -1.91 -0.10 0.00 0.00 0.00 0.00 46.02 43.89 1sb1 n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1sb1 s SER 20 N -0.32 0.01 0.32 1.61 1.04 -0.24 -4.91 113.70 111.20 1sb1 s SER 20 Ca 0.00 -1.06 -0.29 0.00 0.48 0.00 0.00 55.95 55.08 1sb1 s SER 20 Cb 0.00 0.54 -0.11 0.00 0.10 0.00 0.00 66.02 66.56 1sb1 s SER 20 CO 0.00 -1.08 1.43 -1.81 0.98 0.00 0.00 173.24 172.76 1sb1 s ASP 21 N -3.06 6.56 0.57 7.02 1.01 -1.26 -0.32 116.67 127.18 1sb1 s ASP 21 Ca 0.27 2.83 -0.16 0.00 0.71 0.00 0.00 52.55 56.20 1sb1 s ASP 21 Cb 0.01 -2.65 -0.05 0.00 1.01 0.00 0.00 42.92 41.24 1sb1 s ASP 21 CO 0.10 -0.73 1.03 0.00 0.21 0.00 0.00 175.17 175.78 1sb1 s ALA 22 N -0.68 2.87 0.51 5.23 0.00 0.15 -4.75 121.76 125.09 1sb1 s ALA 22 Ca 0.55 0.30 -0.10 0.00 0.00 0.00 0.00 51.96 52.70 1sb1 s ALA 22 Cb -0.43 -3.18 -0.05 0.00 0.00 0.00 0.00 23.12 19.45 1sb1 s ALA 22 CO 0.53 -0.60 0.89 -1.21 0.00 0.00 0.00 175.76 175.37 1sb1 s GLU 23 N -4.12 3.68 0.24 0.00 2.02 -1.26 -4.93 118.70 114.33 1sb1 s GLU 23 Ca 0.62 0.55 -0.31 0.00 0.02 0.00 0.00 54.97 55.84 1sb1 s GLU 23 Cb -0.14 -2.25 -0.12 0.00 0.10 0.00 0.00 34.13 31.73 1sb1 s GLU 23 CO 0.36 -0.29 1.66 0.42 0.02 0.00 0.00 175.26 177.43 1sb1 s ILE 24 N -2.77 2.07 -0.69 -1.63 -1.09 -1.26 -1.84 121.20 113.99 1sb1 s ILE 24 Ca 0.52 0.05 0.00 0.00 -2.23 0.00 0.00 60.65 59.00 1sb1 s ILE 24 Cb -0.10 -3.04 0.00 0.00 -1.58 0.00 0.00 42.46 37.74 1sb1 s ILE 24 CO 0.42 0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.75 1sb1 n GLY 25 N 3.23 0.78 0.16 6.18 0.00 -1.26 -4.89 105.19 109.39 1sb1 n GLY 25 Ca 0.13 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1sb1 n GLY 25 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1sb1 h MET 26 N 0.19 0.01 -2.01 1.61 -1.53 -1.74 -3.35 114.93 108.11 1sb1 h MET 26 Ca -0.13 -0.01 -0.55 0.00 -3.44 0.00 0.00 59.70 55.57 1sb1 h MET 26 Cb 0.75 0.00 -0.39 0.00 -0.55 0.00 0.00 31.60 31.41 1sb1 h MET 26 CO 0.20 0.52 -1.09 0.45 0.14 0.00 0.00 176.91 177.12 1sb1 n SER 27 N -3.94 0.49 0.00 1.39 2.88 -1.26 -4.98 113.62 108.21 1sb1 n SER 27 Ca -0.01 -2.79 0.02 0.00 -1.33 0.00 0.00 58.87 54.76 1sb1 n SER 27 Cb 0.52 -0.64 0.08 0.00 -0.75 0.00 0.00 64.21 63.43 1sb1 n SER 27 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1sb1 n PRO 28 N 1.19 0.02 0.00 -1.46 -0.04 -1.26 -0.83 135.00 132.63 1sb1 n PRO 28 Ca 0.22 0.37 0.12 0.00 -0.04 0.00 0.00 63.50 64.17 1sb1 n PRO 28 Cb 0.54 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.68 1sb1 n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1sb1 n TRP 29 N -1.42 0.00 -1.98 0.54 2.14 -0.92 -1.04 117.44 114.76 1sb1 n TRP 29 Ca 0.01 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.17 1sb1 n TRP 29 Cb 0.04 -0.01 -0.03 0.00 -0.81 0.00 0.00 31.31 30.50 1sb1 n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1sb1 s GLN 30 N -2.16 4.24 0.00 -2.67 2.00 -0.01 -0.36 119.66 120.70 1sb1 s GLN 30 Ca 0.27 2.32 0.05 0.00 -2.00 0.00 0.00 55.36 56.01 1sb1 s GLN 30 Cb 0.20 -3.13 -0.01 0.00 0.80 0.00 0.00 33.01 30.87 1sb1 s GLN 30 CO 0.39 -0.49 -0.16 0.08 -0.50 0.00 0.00 175.29 174.61 1sb1 s VAL 31 N 0.43 1.23 -0.18 1.34 1.01 -0.60 -3.89 120.40 119.74 1sb1 s VAL 31 Ca 0.63 -0.76 -0.05 0.00 0.00 0.00 0.00 61.98 61.81 1sb1 s VAL 31 Cb -0.43 -1.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.89 1sb1 s VAL 31 CO 0.39 0.27 -0.01 -0.32 0.00 0.00 0.00 175.10 175.43 1sb1 s MET 32 N -0.56 3.65 -0.24 2.72 1.75 -0.40 -1.30 119.30 124.92 1sb1 s MET 32 Ca 0.05 -0.51 -0.20 0.00 -1.25 0.00 0.00 55.69 53.78 1sb1 s MET 32 Cb -0.06 -3.02 -0.02 0.00 2.84 0.00 0.00 34.83 34.56 1sb1 s MET 32 CO -0.00 0.11 0.61 -0.51 -0.65 0.00 0.00 175.02 174.58 1sb1 s LEU 33 N 0.73 4.08 -0.12 4.11 1.43 0.23 -1.27 118.68 127.85 1sb1 s LEU 33 Ca -0.00 0.70 0.02 0.00 -1.03 0.00 0.00 54.13 53.82 1sb1 s LEU 33 Cb -0.14 -2.83 -0.00 0.00 0.03 0.00 0.00 46.19 43.24 1sb1 s LEU 33 CO 0.02 -0.34 -0.19 0.12 0.23 0.00 0.00 176.35 176.20 1sb1 s PHE 34 N 2.35 2.69 0.02 0.29 5.36 0.23 -0.24 117.98 128.69 1sb1 s PHE 34 Ca 0.26 -0.96 -0.28 0.00 -0.96 0.00 0.00 56.93 54.99 1sb1 s PHE 34 Cb -0.16 -1.80 -0.04 0.00 -0.34 0.00 0.00 43.02 40.69 1sb1 s PHE 34 CO 0.09 -0.39 0.88 0.50 -1.46 0.00 0.00 175.22 174.84 1sb1 s ARG 35 N 0.49 4.56 0.05 10.12 3.52 0.06 -0.23 118.95 137.53 1sb1 s ARG 35 Ca -0.13 1.26 -0.24 0.00 -0.13 0.00 0.00 55.73 56.50 1sb1 s ARG 35 Cb -0.17 -3.42 -0.17 0.00 -1.56 0.00 0.00 34.95 29.64 1sb1 s ARG 35 CO 0.05 0.10 1.58 0.87 -0.81 0.00 0.00 175.30 177.08 1sb1 h LYS 36 N 6.28 0.01 -2.51 5.12 1.57 -1.73 -2.88 116.57 122.44 1sb1 h LYS 36 Ca -0.42 -0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.27 1sb1 h LYS 36 Cb 1.21 -0.00 -0.27 0.00 0.08 0.00 0.00 32.23 33.25 1sb1 h LYS 36 CO 0.73 0.18 -0.35 -1.54 -0.57 0.00 0.00 179.45 177.90 1sb1 s SER 36 N -5.37 -0.31 0.50 0.86 1.04 -1.26 -3.00 113.70 106.15 1sb1 s SER 36 Ca -0.14 1.00 -0.22 0.00 0.48 0.00 0.00 55.95 57.08 1sb1 s SER 36 Cb 0.05 1.32 -0.07 0.00 0.10 0.00 0.00 66.02 67.42 1sb1 s SER 36 CO 0.67 -0.23 1.18 -2.16 0.98 0.00 0.00 173.24 173.67 1sb1 s PRO 37 N 2.50 3.55 -0.24 4.02 0.04 -1.26 -5.05 135.00 138.55 1sb1 s PRO 37 Ca -0.03 1.78 -0.29 0.00 0.04 0.00 0.00 61.00 62.50 1sb1 s PRO 37 Cb -0.12 -2.26 -0.03 0.00 0.04 0.00 0.00 34.50 32.13 1sb1 s PRO 37 CO -0.13 -0.73 1.85 -0.65 0.04 0.00 0.00 177.00 177.38 1sb1 s GLN 38 N -2.91 3.49 0.18 4.56 -0.21 -1.16 -4.65 119.66 118.96 1sb1 s GLN 38 Ca 0.68 1.72 -0.22 0.00 0.02 0.00 0.00 55.36 57.56 1sb1 s GLN 38 Cb -0.29 -4.19 0.06 0.00 1.00 0.00 0.00 33.01 29.60 1sb1 s GLN 38 CO 0.34 -1.67 0.60 -1.83 -2.12 0.00 0.00 175.29 170.60 1sb1 s GLU 39 N 5.42 1.36 -0.03 2.91 -1.05 -1.09 -4.98 118.70 121.24 1sb1 s GLU 39 Ca 0.83 -0.60 -0.30 0.00 -0.15 0.00 0.00 54.97 54.75 1sb1 s GLU 39 Cb -0.27 0.58 -0.04 0.00 -0.44 0.00 0.00 34.13 33.96 1sb1 s GLU 39 CO 0.33 -0.59 1.26 -1.17 0.95 0.00 0.00 175.26 176.04 1sb1 s LEU 40 N -2.79 4.29 -0.25 1.83 1.98 -1.26 -0.76 118.68 121.72 1sb1 s LEU 40 Ca 0.03 1.91 0.03 0.00 -2.89 0.00 0.00 54.13 53.22 1sb1 s LEU 40 Cb -0.02 -3.56 -0.17 0.00 0.66 0.00 0.00 46.19 43.10 1sb1 s LEU 40 CO -0.09 -0.62 -0.20 0.18 -1.89 0.00 0.00 176.35 173.74 1sb1 n LEU 41 N 5.18 2.71 -3.83 -0.68 4.77 0.67 -4.89 117.00 120.93 1sb1 n LEU 41 Ca 0.11 -0.12 0.02 0.00 -0.03 0.00 0.00 56.01 55.99 1sb1 n LEU 41 Cb 0.45 -0.76 0.01 0.00 -2.33 0.00 0.00 43.42 40.79 1sb1 n LEU 41 CO 0.56 0.89 1.07 0.00 -1.33 0.00 0.00 177.39 178.58 1sb1 s GLY 43 N -3.44 1.80 0.07 0.00 0.00 0.17 -0.60 107.32 105.33 1sb1 s GLY 43 Ca 0.23 -1.79 -0.24 0.00 0.00 0.00 0.00 44.72 42.91 1sb1 s GLY 43 CO -0.02 -1.40 1.12 0.00 0.00 0.00 0.00 173.10 172.80 1sb1 n ALA 44 N -2.32 -3.05 -3.05 3.20 0.00 -0.42 -3.66 120.51 111.20 1sb1 n ALA 44 Ca 0.12 -0.87 -0.10 0.00 0.00 0.00 0.00 53.44 52.59 1sb1 n ALA 44 Cb 0.60 0.33 -0.10 0.00 0.00 0.00 0.00 19.45 20.29 1sb1 n ALA 44 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1sb1 s SER 45 N -3.55 0.09 -0.28 0.00 1.04 0.08 -1.55 113.70 109.54 1sb1 s SER 45 Ca 0.26 -0.30 -0.18 0.00 0.48 0.00 0.00 55.95 56.20 1sb1 s SER 45 Cb -0.02 0.18 -0.02 0.00 0.10 0.00 0.00 66.02 66.26 1sb1 s SER 45 CO 0.02 -0.36 0.52 -0.22 0.98 0.00 0.00 173.24 174.18 1sb1 s LEU 46 N -1.45 4.09 0.00 2.42 2.96 0.51 -0.47 118.68 126.74 1sb1 s LEU 46 Ca -0.15 0.44 0.12 0.00 -0.22 0.00 0.00 54.13 54.33 1sb1 s LEU 46 Cb -0.08 -2.66 -0.11 0.00 0.50 0.00 0.00 46.19 43.85 1sb1 s LEU 46 CO 0.01 -0.32 0.56 2.30 -1.32 0.00 0.00 176.35 177.57 1sb1 n ILE 47 N 5.21 0.00 -3.88 6.68 -5.35 -0.67 -1.59 119.36 119.78 1sb1 n ILE 47 Ca -0.04 -0.24 -0.04 0.00 -0.27 0.00 0.00 62.75 62.15 1sb1 n ILE 47 Cb 0.50 1.03 0.02 0.00 -1.74 0.00 0.00 39.64 39.45 1sb1 n ILE 47 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1sb1 s SER 48 N -2.04 0.01 0.11 7.28 1.04 -1.20 -4.73 113.70 114.17 1sb1 s SER 48 Ca 0.06 -0.77 0.19 0.00 0.48 0.00 0.00 55.95 55.91 1sb1 s SER 48 Cb 0.09 0.56 0.79 0.00 0.10 0.00 0.00 66.02 67.57 1sb1 s SER 48 CO 0.46 -1.12 1.59 -0.90 0.98 0.00 0.00 173.24 174.25 1sb1 n ASP 49 N -1.29 0.30 0.00 7.02 5.68 -1.26 -3.50 116.55 123.50 1sb1 n ASP 49 Ca -0.04 0.57 0.00 0.00 -0.50 0.00 0.00 54.79 54.82 1sb1 n ASP 49 Cb 0.59 -0.63 0.00 0.00 -1.14 0.00 0.00 41.12 39.94 1sb1 n ASP 49 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1sb1 n ARG 50 N -1.82 2.90 -5.03 0.11 5.12 -1.26 -1.19 116.66 115.48 1sb1 n ARG 50 Ca 0.03 -0.15 -0.28 0.00 -1.93 0.00 0.00 57.85 55.52 1sb1 n ARG 50 Cb 0.21 -0.57 -0.16 0.00 -1.16 0.00 0.00 32.46 30.77 1sb1 n ARG 50 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1sb1 s TRP 51 N -0.46 1.98 -0.04 -1.55 0.52 -1.23 -0.59 118.94 117.57 1sb1 s TRP 51 Ca 0.00 -0.51 0.05 0.00 0.02 0.00 0.00 56.10 55.66 1sb1 s TRP 51 Cb 0.00 -1.30 -0.01 0.00 -1.15 0.00 0.00 33.47 31.01 1sb1 s TRP 51 CO 0.00 -0.13 -0.21 0.08 0.02 0.00 0.00 176.95 176.71 1sb1 s VAL 52 N -0.21 1.70 -0.10 4.03 1.01 -0.10 -1.66 120.40 125.07 1sb1 s VAL 52 Ca 0.00 -0.88 -0.03 0.00 0.00 0.00 0.00 61.98 61.07 1sb1 s VAL 52 Cb -0.11 -1.45 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 1sb1 s VAL 52 CO 0.02 0.48 0.04 -0.22 0.00 0.00 0.00 175.10 175.41 1sb1 s LEU 53 N -0.12 3.78 0.00 3.92 2.96 0.38 -0.89 118.68 128.71 1sb1 s LEU 53 Ca -0.02 0.22 -0.05 0.00 -0.22 0.00 0.00 54.13 54.06 1sb1 s LEU 53 Cb -0.12 -1.88 0.02 0.00 0.50 0.00 0.00 46.19 44.71 1sb1 s LEU 53 CO 0.02 0.38 0.34 1.07 -1.32 0.00 0.00 176.35 176.84 1sb1 n THR 54 N 2.17 0.00 -3.32 3.68 5.66 -0.45 -0.74 114.28 121.28 1sb1 n THR 54 Ca -0.19 -0.74 -0.38 0.00 -3.05 0.00 0.00 64.05 59.69 1sb1 n THR 54 Cb 0.54 0.56 -0.06 0.00 -1.55 0.00 0.00 70.33 69.82 1sb1 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1sb1 s ALA 55 N -1.89 3.61 0.35 1.79 0.00 -1.26 -0.83 121.76 123.53 1sb1 s ALA 55 Ca 0.12 -0.02 0.03 0.00 0.00 0.00 0.00 51.96 52.09 1sb1 s ALA 55 Cb -0.02 -2.58 0.65 0.00 0.00 0.00 0.00 23.12 21.17 1sb1 s ALA 55 CO 0.09 0.42 1.99 0.00 0.00 0.00 0.00 175.76 178.25 1sb1 h ALA 56 N 4.54 1.59 0.00 0.00 0.00 -1.70 -1.75 119.26 121.93 1sb1 h ALA 56 Ca -0.50 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1sb1 h ALA 56 Cb 1.21 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1sb1 h ALA 56 CO 0.63 0.35 0.00 -2.39 0.00 0.00 0.00 179.25 177.84 1sb1 n HIS 57 N -4.45 0.00 0.20 0.00 1.44 -1.26 -0.82 115.22 110.33 1sb1 n HIS 57 Ca 0.08 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.88 1sb1 n HIS 57 Cb 0.10 -0.50 0.30 0.00 0.12 0.00 0.00 29.99 30.01 1sb1 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1sb1 n LEU 59 N -3.28 0.11 -3.69 0.00 4.77 -0.41 -4.90 117.00 109.59 1sb1 n LEU 59 Ca 0.01 -0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.76 1sb1 n LEU 59 Cb 0.53 0.18 -0.17 0.00 -2.33 0.00 0.00 43.42 41.63 1sb1 n LEU 59 CO 0.35 0.22 -0.35 -0.22 -1.33 0.00 0.00 177.39 176.06 1sb1 s LEU 60 N -4.64 0.47 0.15 2.23 2.96 0.00 -1.32 118.68 118.54 1sb1 s LEU 60 Ca -0.04 -0.29 -0.18 0.00 -0.22 0.00 0.00 54.13 53.40 1sb1 s LEU 60 Cb 0.02 -0.31 0.04 0.00 0.50 0.00 0.00 46.19 46.44 1sb1 s LEU 60 CO 0.33 -0.27 0.49 -0.47 -1.32 0.00 0.00 176.35 175.11 1sb1 s TYR 60 N 2.06 -0.26 0.00 5.38 5.04 0.36 -4.06 117.35 125.87 1sb1 s TYR 60 Ca 0.03 -0.04 0.00 0.00 -2.44 0.00 0.00 57.07 54.63 1sb1 s TYR 60 Cb -0.14 0.37 0.00 0.00 0.35 0.00 0.00 41.96 42.55 1sb1 s TYR 60 CO -0.06 -0.80 0.00 -2.30 -1.34 0.00 0.00 175.55 171.05 1sb1 n PRO 60 N -0.30 0.00 -0.28 4.97 -0.02 -1.26 -2.45 135.00 135.66 1sb1 n PRO 60 Ca -0.14 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.42 1sb1 n PRO 60 Cb 0.64 -0.22 0.20 0.00 -0.02 0.00 0.00 33.50 34.10 1sb1 n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1sb1 n TRP 60 N -0.02 0.55 -3.52 6.00 7.02 -1.26 -4.97 117.44 121.24 1sb1 n TRP 60 Ca 0.00 -0.90 -0.26 0.00 -1.02 0.00 0.00 57.50 55.32 1sb1 n TRP 60 Cb 0.00 -0.24 0.02 0.00 -2.42 0.00 0.00 31.31 28.68 1sb1 n TRP 60 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1sb1 n ASP 60 N -0.83 -4.96 -4.63 -0.99 8.00 -1.16 -4.96 116.55 107.02 1sb1 n ASP 60 Ca 0.18 -0.53 -0.36 0.00 0.71 0.00 0.00 54.79 54.79 1sb1 n ASP 60 Cb 0.77 -4.00 -0.10 0.00 -0.02 0.00 0.00 41.12 37.77 1sb1 n ASP 60 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1sb1 s LYS 60 N -6.21 4.01 -0.49 -1.24 2.20 -1.02 -4.98 119.74 112.01 1sb1 s LYS 60 Ca 0.50 -0.30 0.05 0.00 -0.36 0.00 0.00 55.97 55.86 1sb1 s LYS 60 Cb -0.25 -3.48 0.20 0.00 -1.51 0.00 0.00 37.83 32.79 1sb1 s LYS 60 CO 0.62 0.05 0.81 -1.71 -0.36 0.00 0.00 175.35 174.77 1sb1 n ASN 60 N 4.29 -3.09 -4.80 1.43 4.05 -1.22 -0.49 115.26 115.43 1sb1 n ASN 60 Ca -0.15 -2.76 -0.35 0.00 0.45 0.00 0.00 54.58 51.77 1sb1 n ASN 60 Cb 0.52 1.64 -0.06 0.00 1.23 0.00 0.00 39.78 43.11 1sb1 n ASN 60 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 1sb1 s PHE 60 N 0.83 3.35 0.40 1.20 0.08 -0.43 -5.03 117.98 118.38 1sb1 s PHE 60 Ca 0.30 1.66 0.08 0.00 0.12 0.00 0.00 56.93 59.08 1sb1 s PHE 60 Cb 0.06 -2.96 -0.04 0.00 -0.57 0.00 0.00 43.02 39.52 1sb1 s PHE 60 CO -0.10 -0.23 0.27 0.95 -0.10 0.00 0.00 175.22 176.01 1sb1 s THR 60 N -1.90 2.61 0.19 0.64 -4.23 -1.26 -4.93 115.64 106.75 1sb1 s THR 60 Ca 0.59 -1.53 -0.20 0.00 -1.18 0.00 0.00 61.69 59.37 1sb1 s THR 60 Cb -0.15 -3.01 0.13 0.00 1.34 0.00 0.00 72.50 70.81 1sb1 s THR 60 CO 0.20 -0.03 1.59 -0.33 -0.54 0.00 0.00 174.62 175.51 1sb1 h GLU 61 N 1.26 -0.15 0.00 3.99 3.07 -1.93 -1.69 114.58 119.13 1sb1 h GLU 61 Ca -0.42 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.45 1sb1 h GLU 61 Cb 1.26 0.03 0.00 0.00 -0.84 0.00 0.00 28.75 29.20 1sb1 h GLU 61 CO 0.63 -0.10 0.00 0.09 -1.40 0.00 0.00 179.01 178.23 1sb1 n ASN 62 N -5.43 0.00 0.15 1.42 3.02 -1.26 -2.68 115.26 110.47 1sb1 n ASN 62 Ca 0.04 -0.05 0.06 0.00 -0.03 0.00 0.00 54.58 54.60 1sb1 n ASN 62 Cb 0.35 -0.20 0.06 0.00 -0.61 0.00 0.00 39.78 39.38 1sb1 n ASN 62 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1sb1 h ASP 63 N 0.00 0.00 -3.07 6.41 3.32 -1.70 -3.47 116.42 117.91 1sb1 h ASP 63 Ca 0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 1sb1 h ASP 63 Cb 0.08 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.50 1sb1 h ASP 63 CO 0.00 0.30 -0.56 -1.48 -1.72 0.00 0.00 179.24 175.78 1sb1 s LEU 64 N -6.20 2.09 0.06 1.55 0.05 -1.09 -2.01 118.68 113.12 1sb1 s LEU 64 Ca 0.04 -1.52 0.00 0.00 0.05 0.00 0.00 54.13 52.70 1sb1 s LEU 64 Cb 0.07 -0.27 -0.04 0.00 -2.05 0.00 0.00 46.19 43.90 1sb1 s LEU 64 CO 0.73 -0.77 -0.04 -0.76 -0.55 0.00 0.00 176.35 174.96 1sb1 s LEU 65 N -3.56 2.44 -0.22 1.48 1.43 0.68 -4.51 118.68 116.42 1sb1 s LEU 65 Ca 0.29 -0.88 -0.04 0.00 -1.03 0.00 0.00 54.13 52.47 1sb1 s LEU 65 Cb 0.06 0.07 -0.01 0.00 0.03 0.00 0.00 46.19 46.34 1sb1 s LEU 65 CO 0.14 -0.48 -0.05 -0.69 0.23 0.00 0.00 176.35 175.51 1sb1 s VAL 66 N -3.22 3.34 -0.27 -1.59 1.01 -0.37 -0.60 120.40 118.71 1sb1 s VAL 66 Ca 0.03 -0.50 -0.06 0.00 0.00 0.00 0.00 61.98 61.45 1sb1 s VAL 66 Cb 0.03 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.89 1sb1 s VAL 66 CO -0.06 0.43 0.05 -0.13 0.00 0.00 0.00 175.10 175.39 1sb1 s ARG 67 N 1.46 3.23 0.05 2.72 0.52 -0.40 -0.57 118.95 125.96 1sb1 s ARG 67 Ca 0.06 -0.76 0.06 0.00 -0.52 0.00 0.00 55.73 54.57 1sb1 s ARG 67 Cb -0.14 -3.29 -0.03 0.00 0.52 0.00 0.00 34.95 32.00 1sb1 s ARG 67 CO -0.03 -0.36 -0.14 0.42 0.02 0.00 0.00 175.30 175.21 1sb1 s ILE 68 N 1.51 3.12 0.00 1.52 1.01 -0.24 -1.27 121.20 126.84 1sb1 s ILE 68 Ca 0.04 -1.12 0.00 0.00 0.00 0.00 0.00 60.65 59.57 1sb1 s ILE 68 Cb -0.16 -2.36 0.00 0.00 0.01 0.00 0.00 42.46 39.95 1sb1 s ILE 68 CO 0.01 0.29 0.00 0.61 0.00 0.00 0.00 174.94 175.86 1sb1 n GLY 69 N 1.35 0.51 3.88 6.18 0.00 -1.25 -0.80 105.19 115.05 1sb1 n GLY 69 Ca -0.15 -0.60 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 1sb1 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sb1 s LYS 70 N -1.14 3.70 0.15 1.61 1.02 -1.26 -4.18 119.74 119.64 1sb1 s LYS 70 Ca 0.00 0.54 0.00 0.00 0.02 0.00 0.00 55.97 56.53 1sb1 s LYS 70 Cb 0.00 -2.28 0.00 0.00 -0.52 0.00 0.00 37.83 35.03 1sb1 s LYS 70 CO 0.00 -0.24 0.00 1.58 -0.92 0.00 0.00 175.35 175.77 1sb1 n HIS 71 N -1.92 -1.11 -2.32 3.18 -0.00 -1.26 -4.93 115.22 106.85 1sb1 n HIS 71 Ca 0.03 0.20 -0.38 0.00 -0.00 0.00 0.00 57.72 57.57 1sb1 n HIS 71 Cb 0.54 0.35 -0.02 0.00 -0.00 0.00 0.00 29.99 30.86 1sb1 n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1sb1 s SER 72 N -5.26 6.64 -0.07 0.26 0.15 -1.26 -0.72 113.70 113.44 1sb1 s SER 72 Ca 0.00 2.33 -0.19 0.00 0.70 0.00 0.00 55.95 58.79 1sb1 s SER 72 Cb 0.00 -2.61 -0.14 0.00 -1.71 0.00 0.00 66.02 61.55 1sb1 s SER 72 CO 0.00 -0.59 0.73 -0.09 1.20 0.00 0.00 173.24 174.49 1sb1 h ARG 73 N 2.79 -0.18 0.00 5.44 2.43 -1.59 -3.41 114.38 119.86 1sb1 h ARG 73 Ca -0.48 0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 58.58 1sb1 h ARG 73 Cb 1.23 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.80 1sb1 h ARG 73 CO 0.63 0.24 -1.45 0.25 -1.51 0.00 0.00 179.97 178.13 1sb1 n THR 74 N -4.88 0.91 -2.70 0.20 -2.24 -1.26 -4.98 114.28 99.33 1sb1 n THR 74 Ca -0.07 -0.64 -0.34 0.00 -2.27 0.00 0.00 64.05 60.73 1sb1 n THR 74 Cb 0.25 -0.53 -0.06 0.00 -2.10 0.00 0.00 70.33 67.90 1sb1 n THR 74 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1sb1 s ARG 75 N -3.08 4.11 -0.47 -0.78 0.52 -1.26 -5.00 118.95 112.99 1sb1 s ARG 75 Ca -0.03 1.25 -0.24 0.00 -0.52 0.00 0.00 55.73 56.18 1sb1 s ARG 75 Cb 0.09 -2.23 0.03 0.00 0.52 0.00 0.00 34.95 33.36 1sb1 s ARG 75 CO 0.82 -0.15 0.86 -0.47 0.02 0.00 0.00 175.30 176.38 1sb1 s TYR 76 N -2.03 2.93 -1.30 -0.53 5.04 -1.26 -4.89 117.35 115.31 1sb1 s TYR 76 Ca 0.62 0.20 -0.15 0.00 -2.44 0.00 0.00 57.07 55.31 1sb1 s TYR 76 Cb -0.13 -3.84 0.10 0.00 0.35 0.00 0.00 41.96 38.44 1sb1 s TYR 76 CO 0.17 -1.09 1.77 0.39 -1.34 0.00 0.00 175.55 175.45 1sb1 n GLU 77 N 7.00 3.24 -1.60 4.97 1.02 -1.26 -4.97 120.64 129.03 1sb1 n GLU 77 Ca 0.03 -3.34 -0.47 0.00 -0.02 0.00 0.00 57.16 53.36 1sb1 n GLU 77 Cb 0.48 -3.26 -0.03 0.00 -0.02 0.00 0.00 31.44 28.60 1sb1 n GLU 77 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1sb1 n ARG 77 N 6.63 1.37 -0.88 3.49 0.63 -1.26 -1.32 116.66 125.32 1sb1 n ARG 77 Ca 0.45 0.49 0.00 0.00 -0.92 0.00 0.00 57.85 57.87 1sb1 n ARG 77 Cb 0.43 -2.00 0.00 0.00 0.45 0.00 0.00 32.46 31.33 1sb1 n ARG 77 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1sb1 n ASN 78 N 1.95 -2.35 0.06 6.15 5.03 -1.26 -4.75 115.26 120.10 1sb1 n ASN 78 Ca 0.14 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.59 1sb1 n ASN 78 Cb 0.27 -1.64 0.00 0.00 -1.02 0.00 0.00 39.78 37.39 1sb1 n ASN 78 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 1sb1 n ILE 79 N -2.26 0.56 -2.24 2.41 5.41 -0.49 -5.08 119.36 117.67 1sb1 n ILE 79 Ca 0.00 0.19 -0.33 0.00 1.00 0.00 0.00 62.75 63.61 1sb1 n ILE 79 Cb 0.13 -1.03 -0.01 0.00 -0.71 0.00 0.00 39.64 38.01 1sb1 n ILE 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1sb1 s GLU 80 N -1.71 3.63 -0.04 0.38 -1.05 -0.43 -4.79 118.70 114.69 1sb1 s GLU 80 Ca 0.00 1.11 0.04 0.00 -0.15 0.00 0.00 54.97 55.97 1sb1 s GLU 80 Cb 0.00 -2.08 -0.00 0.00 -0.44 0.00 0.00 34.13 31.61 1sb1 s GLU 80 CO 0.00 -0.55 -0.16 0.15 0.95 0.00 0.00 175.26 175.65 1sb1 s LYS 81 N -4.00 1.70 -0.19 -4.83 -0.14 0.02 -4.87 119.74 107.42 1sb1 s LYS 81 Ca 0.62 -0.58 -0.06 0.00 -1.36 0.00 0.00 55.97 54.59 1sb1 s LYS 81 Cb -0.13 -1.48 -0.03 0.00 -1.68 0.00 0.00 37.83 34.50 1sb1 s LYS 81 CO 0.33 0.23 0.02 0.42 -0.76 0.00 0.00 175.35 175.59 1sb1 s ILE 82 N 0.04 4.20 0.10 2.17 1.01 -1.26 -1.08 121.20 126.38 1sb1 s ILE 82 Ca -0.03 -0.23 0.10 0.00 0.00 0.00 0.00 60.65 60.48 1sb1 s ILE 82 Cb -0.11 -2.90 -0.04 0.00 0.01 0.00 0.00 42.46 39.43 1sb1 s ILE 82 CO 0.02 0.44 -0.26 -0.44 0.00 0.00 0.00 174.94 174.70 1sb1 s SER 83 N 0.78 3.16 0.30 3.58 0.01 0.26 -4.97 113.70 116.82 1sb1 s SER 83 Ca 0.01 -0.68 -0.00 0.00 1.31 0.00 0.00 55.95 56.59 1sb1 s SER 83 Cb -0.14 -0.23 -0.04 0.00 0.21 0.00 0.00 66.02 65.82 1sb1 s SER 83 CO 0.02 0.19 0.50 -0.04 0.41 0.00 0.00 173.24 174.33 1sb1 s MET 84 N -1.73 3.52 -0.10 12.44 -1.94 -1.26 -1.23 119.30 128.99 1sb1 s MET 84 Ca 0.12 -0.31 -0.15 0.00 -1.71 0.00 0.00 55.69 53.65 1sb1 s MET 84 Cb -0.10 -2.71 -0.05 0.00 2.01 0.00 0.00 34.83 33.98 1sb1 s MET 84 CO 0.04 0.24 0.37 -0.51 -0.01 0.00 0.00 175.02 175.15 1sb1 s LEU 85 N -3.94 4.33 -0.18 -0.03 1.02 -1.26 -1.83 118.68 116.80 1sb1 s LEU 85 Ca 0.40 0.73 -0.22 0.00 0.02 0.00 0.00 54.13 55.05 1sb1 s LEU 85 Cb -0.10 -2.51 -0.19 0.00 0.02 0.00 0.00 46.19 43.41 1sb1 s LEU 85 CO 0.33 0.16 0.36 -0.08 0.02 0.00 0.00 176.35 177.15 1sb1 h GLU 86 N 5.98 0.00 -2.62 1.70 4.81 -0.71 -3.44 114.58 120.30 1sb1 h GLU 86 Ca -0.45 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 58.68 1sb1 h GLU 86 Cb 1.19 0.00 -0.21 0.00 0.63 0.00 0.00 28.75 30.36 1sb1 h GLU 86 CO 0.70 0.88 -0.11 0.21 -0.73 0.00 0.00 179.01 179.96 1sb1 s LYS 87 N -2.27 0.74 -0.08 1.92 2.47 -1.16 -4.97 119.74 116.40 1sb1 s LYS 87 Ca -0.23 0.17 -0.02 0.00 -1.56 0.00 0.00 55.97 54.34 1sb1 s LYS 87 Cb 0.02 0.35 -0.03 0.00 -1.46 0.00 0.00 37.83 36.71 1sb1 s LYS 87 CO 0.57 -0.19 -0.01 0.42 0.16 0.00 0.00 175.35 176.30 1sb1 s ILE 88 N -0.84 4.25 -0.13 5.43 1.01 -1.26 -1.22 121.20 128.44 1sb1 s ILE 88 Ca -0.09 -0.27 -0.00 0.00 0.00 0.00 0.00 60.65 60.28 1sb1 s ILE 88 Cb -0.03 -2.78 0.03 0.00 0.01 0.00 0.00 42.46 39.68 1sb1 s ILE 88 CO 0.05 0.61 -0.07 -0.31 0.00 0.00 0.00 174.94 175.22 1sb1 s TYR 89 N -0.88 1.51 -0.09 3.97 2.02 0.73 -5.00 117.35 119.61 1sb1 s TYR 89 Ca 0.13 -0.81 -0.03 0.00 -0.37 0.00 0.00 57.07 56.00 1sb1 s TYR 89 Cb -0.11 -1.24 -0.03 0.00 -0.40 0.00 0.00 41.96 40.17 1sb1 s TYR 89 CO 0.02 -0.54 0.02 0.42 -1.57 0.00 0.00 175.55 173.91 1sb1 s ILE 90 N 1.70 4.50 0.18 2.71 -1.09 -1.26 -0.20 121.20 127.74 1sb1 s ILE 90 Ca 0.04 -0.17 -0.33 0.00 -2.23 0.00 0.00 60.65 57.95 1sb1 s ILE 90 Cb -0.13 -2.91 -0.14 0.00 -1.58 0.00 0.00 42.46 37.71 1sb1 s ILE 90 CO -0.08 0.61 1.56 1.57 -1.23 0.00 0.00 174.94 177.37 1sb1 n HIS 91 N 2.13 2.30 0.32 3.97 -0.00 -1.07 -4.83 115.22 118.04 1sb1 n HIS 91 Ca -0.19 0.28 0.21 0.00 0.46 0.00 0.00 57.72 58.47 1sb1 n HIS 91 Cb 0.54 -2.54 1.08 0.00 -0.12 0.00 0.00 29.99 28.95 1sb1 n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1sb1 h PRO 92 N 5.73 0.00 -0.28 1.57 0.13 -1.95 -2.34 132.00 134.86 1sb1 h PRO 92 Ca -0.45 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.67 1sb1 h PRO 92 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 1sb1 h PRO 92 CO 0.87 0.01 0.00 0.54 -0.23 0.00 0.00 178.00 179.19 1sb1 n ARG 93 N -3.20 2.90 -1.69 0.86 1.74 -1.26 -4.99 116.66 111.01 1sb1 n ARG 93 Ca -0.02 -2.88 -0.42 0.00 -0.77 0.00 0.00 57.85 53.76 1sb1 n ARG 93 Cb 0.12 -1.86 -0.03 0.00 -1.02 0.00 0.00 32.46 29.67 1sb1 n ARG 93 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1sb1 s TYR 94 N -2.86 1.74 -1.01 -1.55 5.04 -0.88 -4.72 117.35 113.11 1sb1 s TYR 94 Ca 0.43 -0.23 -0.13 0.00 -2.44 0.00 0.00 57.07 54.70 1sb1 s TYR 94 Cb 0.35 -4.21 0.23 0.00 0.35 0.00 0.00 41.96 38.67 1sb1 s TYR 94 CO 0.08 -5.20 1.05 1.21 -1.34 0.00 0.00 175.55 171.35 1sb1 s ASN 95 N 3.51 7.02 0.30 4.32 3.84 0.40 -4.82 114.94 129.51 1sb1 s ASN 95 Ca 0.84 -3.02 0.25 0.00 0.21 0.00 0.00 52.86 51.14 1sb1 s ASN 95 Cb -0.44 -2.26 0.63 0.00 -0.55 0.00 0.00 41.25 38.62 1sb1 s ASN 95 CO 0.39 -0.54 1.71 4.11 -2.79 0.00 0.00 177.10 179.97 1sb1 h TRP 96 N 7.37 0.00 -0.13 0.43 5.08 -1.91 0.25 115.95 127.05 1sb1 h TRP 96 Ca 0.17 0.00 -0.15 0.00 1.08 0.00 0.00 58.89 60.00 1sb1 h TRP 96 Cb 0.95 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.10 1sb1 h TRP 96 CO 0.95 0.00 -0.56 0.00 -1.28 0.00 0.00 178.44 177.56 1sb1 h ARG 97 N 0.00 0.38 0.00 0.12 3.08 -1.99 -3.44 114.38 112.53 1sb1 h ARG 97 Ca 0.00 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.81 1sb1 h ARG 97 Cb 0.84 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.92 1sb1 h ARG 97 CO 0.00 0.84 0.00 -1.91 -1.07 0.00 0.00 179.97 177.83 1sb1 n GLU 97 N -3.93 0.00 -0.35 0.04 2.13 -1.24 -4.99 120.64 112.29 1sb1 n GLU 97 Ca -0.03 0.00 0.05 0.00 0.66 0.00 0.00 57.16 57.84 1sb1 n GLU 97 Cb 0.59 -0.10 0.07 0.00 0.27 0.00 0.00 31.44 32.27 1sb1 n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1sb1 n ASN 98 N -2.43 1.14 -2.17 4.31 0.23 -1.24 -5.00 115.26 110.10 1sb1 n ASN 98 Ca 0.00 -2.55 -0.20 0.00 -0.53 0.00 0.00 54.58 51.30 1sb1 n ASN 98 Cb 0.00 -0.32 -0.02 0.00 -2.08 0.00 0.00 39.78 37.37 1sb1 n ASN 98 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1sb1 n LEU 99 N -0.66 -1.85 -4.77 -4.53 4.77 0.07 -4.94 117.00 105.10 1sb1 n LEU 99 Ca 0.08 0.03 -0.41 0.00 -0.03 0.00 0.00 56.01 55.68 1sb1 n LEU 99 Cb 0.69 -2.79 -0.01 0.00 -2.33 0.00 0.00 43.42 38.99 1sb1 n LEU 99 CO 0.00 -0.29 1.17 -0.62 -1.33 0.00 0.00 177.39 176.33 1sb1 s ASP 100 N -2.18 6.34 -1.19 -1.43 2.15 -1.21 -2.49 116.67 116.66 1sb1 s ASP 100 Ca 0.00 3.03 -0.01 0.00 0.43 0.00 0.00 52.55 56.00 1sb1 s ASP 100 Cb 0.00 -2.66 0.00 0.00 -0.30 0.00 0.00 42.92 39.96 1sb1 s ASP 100 CO 0.00 -0.89 1.00 0.54 -0.17 0.00 0.00 175.17 175.65 1sb1 n ARG 101 N 0.97 -6.67 -2.45 4.34 1.74 -1.26 -0.45 116.66 112.87 1sb1 n ARG 101 Ca 0.03 0.83 -0.39 0.00 -0.77 0.00 0.00 57.85 57.55 1sb1 n ARG 101 Cb 0.39 -5.80 -0.02 0.00 -1.02 0.00 0.00 32.46 26.01 1sb1 n ARG 101 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1sb1 s ASP 102 N -4.19 6.39 -0.10 0.55 2.15 -1.04 -4.37 116.67 116.07 1sb1 s ASP 102 Ca 0.08 -2.26 -0.16 0.00 0.43 0.00 0.00 52.55 50.64 1sb1 s ASP 102 Cb -0.03 -2.58 0.04 0.00 -0.30 0.00 0.00 42.92 40.04 1sb1 s ASP 102 CO 0.71 -1.64 0.40 -0.51 -0.17 0.00 0.00 175.17 173.96 1sb1 s ILE 103 N 5.91 0.02 0.00 4.11 2.07 -1.26 -3.82 121.20 128.23 1sb1 s ILE 103 Ca 0.58 -0.15 -0.17 0.00 -1.41 0.00 0.00 60.65 59.49 1sb1 s ILE 103 Cb 0.03 -0.62 0.03 0.00 0.13 0.00 0.00 42.46 42.03 1sb1 s ILE 103 CO 0.09 -0.09 0.36 0.00 -1.91 0.00 0.00 174.94 173.40 1sb1 s ALA 104 N -0.39 -0.90 0.11 1.50 0.00 -0.01 -2.60 121.76 119.46 1sb1 s ALA 104 Ca -0.05 0.36 0.09 0.00 0.00 0.00 0.00 51.96 52.35 1sb1 s ALA 104 Cb -0.03 0.17 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 1sb1 s ALA 104 CO 0.02 -0.34 -0.18 -0.51 0.00 0.00 0.00 175.76 174.75 1sb1 s LEU 105 N -1.59 2.67 -0.07 0.00 1.43 0.72 -1.34 118.68 120.50 1sb1 s LEU 105 Ca -0.10 -0.55 0.00 0.00 -1.03 0.00 0.00 54.13 52.45 1sb1 s LEU 105 Cb -0.03 -1.53 0.02 0.00 0.03 0.00 0.00 46.19 44.69 1sb1 s LEU 105 CO 0.02 0.19 -0.05 -0.04 0.23 0.00 0.00 176.35 176.70 1sb1 s MET 106 N -2.04 1.08 -0.13 1.70 -1.94 -0.07 -0.19 119.30 117.71 1sb1 s MET 106 Ca 0.17 -0.13 -0.11 0.00 -1.71 0.00 0.00 55.69 53.91 1sb1 s MET 106 Cb -0.11 -1.16 -0.05 0.00 2.01 0.00 0.00 34.83 35.53 1sb1 s MET 106 CO 0.09 -0.18 0.24 0.21 -0.01 0.00 0.00 175.02 175.38 1sb1 s LYS 107 N 1.38 3.97 0.37 2.03 2.20 -0.36 -0.93 119.74 128.41 1sb1 s LYS 107 Ca -0.03 0.02 -0.15 0.00 -0.36 0.00 0.00 55.97 55.45 1sb1 s LYS 107 Cb -0.13 -3.33 -0.09 0.00 -1.51 0.00 0.00 37.83 32.77 1sb1 s LYS 107 CO -0.03 0.46 0.80 -0.51 -0.36 0.00 0.00 175.35 175.71 1sb1 s LEU 108 N -0.19 3.95 0.21 5.43 1.43 0.24 -0.07 118.68 129.68 1sb1 s LEU 108 Ca 0.16 1.33 -0.08 0.00 -1.03 0.00 0.00 54.13 54.51 1sb1 s LEU 108 Cb -0.13 -4.17 0.14 0.00 0.03 0.00 0.00 46.19 42.06 1sb1 s LEU 108 CO 0.04 -0.31 1.74 0.11 0.23 0.00 0.00 176.35 178.16 1sb1 h LYS 109 N 1.86 1.15 -4.96 1.70 1.57 -1.65 -3.41 116.57 112.84 1sb1 h LYS 109 Ca -0.48 -0.26 -0.33 0.00 -1.87 0.00 0.00 60.65 57.71 1sb1 h LYS 109 Cb 1.18 -0.16 -0.20 0.00 0.08 0.00 0.00 32.23 33.13 1sb1 h LYS 109 CO 0.64 0.99 -0.74 0.15 -0.57 0.00 0.00 179.45 179.92 1sb1 s LYS 110 N -5.37 0.75 0.42 3.15 1.02 -1.26 -4.99 119.74 113.46 1sb1 s LYS 110 Ca -0.12 -1.00 -0.25 0.00 0.02 0.00 0.00 55.97 54.61 1sb1 s LYS 110 Cb 0.15 -0.54 -0.08 0.00 -0.52 0.00 0.00 37.83 36.83 1sb1 s LYS 110 CO 0.85 0.10 1.29 -2.14 -0.92 0.00 0.00 175.35 174.52 1sb1 s PRO 111 N -2.21 3.90 0.04 -1.68 0.02 -1.26 -4.85 135.00 128.96 1sb1 s PRO 111 Ca -0.01 2.12 -0.13 0.00 0.02 0.00 0.00 61.00 63.00 1sb1 s PRO 111 Cb -0.07 -2.69 -0.06 0.00 0.02 0.00 0.00 34.50 31.70 1sb1 s PRO 111 CO 0.01 -0.53 0.42 0.54 -0.33 0.00 0.00 177.00 177.11 1sb1 s VAL 112 N -1.29 5.02 0.00 3.83 0.11 -0.33 -5.03 120.40 122.72 1sb1 s VAL 112 Ca 0.58 0.73 -0.27 0.00 -2.93 0.00 0.00 61.98 60.09 1sb1 s VAL 112 Cb -0.37 -3.70 -0.04 0.00 -1.53 0.00 0.00 36.38 30.74 1sb1 s VAL 112 CO 0.47 0.45 0.84 0.00 -3.33 0.00 0.00 175.10 173.53 1sb1 s ALA 113 N -1.22 3.28 0.64 1.54 0.00 -1.26 -4.81 121.76 119.93 1sb1 s ALA 113 Ca 0.28 0.35 -0.13 0.00 0.00 0.00 0.00 51.96 52.46 1sb1 s ALA 113 Cb -0.16 -3.12 -0.02 0.00 0.00 0.00 0.00 23.12 19.82 1sb1 s ALA 113 CO 0.16 -0.09 1.05 -0.06 0.00 0.00 0.00 175.76 176.82 1sb1 s PHE 114 N 0.55 3.11 0.00 0.00 0.08 -1.26 -4.88 117.98 115.58 1sb1 s PHE 114 Ca 0.43 1.45 -0.00 0.00 0.12 0.00 0.00 56.93 58.94 1sb1 s PHE 114 Cb -0.20 -2.91 0.00 0.00 -0.57 0.00 0.00 43.02 39.33 1sb1 s PHE 114 CO 0.24 -1.10 0.01 -1.13 -0.10 0.00 0.00 175.22 173.13 1sb1 n SER 115 N -2.59 -0.01 0.27 1.36 3.41 -0.59 -4.94 113.62 110.54 1sb1 n SER 115 Ca 0.08 -1.01 0.14 0.00 -0.26 0.00 0.00 58.87 57.82 1sb1 n SER 115 Cb 0.53 0.03 0.77 0.00 -0.26 0.00 0.00 64.21 65.28 1sb1 n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1sb1 h ASP 116 N 0.01 0.00 -0.00 4.04 3.32 -1.99 -3.00 116.42 118.80 1sb1 h ASP 116 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1sb1 h ASP 116 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1sb1 h ASP 116 CO 0.00 0.09 -0.58 -1.22 -1.72 0.00 0.00 179.24 175.82 1sb1 n TYR 117 N -3.52 0.00 -3.92 4.55 4.01 -1.26 -4.77 117.16 112.26 1sb1 n TYR 117 Ca -0.02 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.43 1sb1 n TYR 117 Cb 0.23 0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 39.10 1sb1 n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1sb1 s ILE 118 N -2.20 1.34 -0.25 -0.72 1.01 -1.13 -4.10 121.20 115.15 1sb1 s ILE 118 Ca 0.07 -0.95 -0.19 0.00 0.00 0.00 0.00 60.65 59.58 1sb1 s ILE 118 Cb 0.11 -1.57 0.07 0.00 0.01 0.00 0.00 42.46 41.08 1sb1 s ILE 118 CO 0.53 0.01 0.63 -2.28 0.00 0.00 0.00 174.94 173.83 1sb1 s HIS 119 N 1.51 -0.80 0.44 3.97 2.46 -0.21 -1.53 115.29 121.13 1sb1 s HIS 119 Ca -0.03 1.80 -0.23 0.00 0.47 0.00 0.00 55.06 57.07 1sb1 s HIS 119 Cb -0.17 0.36 -0.08 0.00 -0.13 0.00 0.00 32.58 32.56 1sb1 s HIS 119 CO -0.07 -0.39 1.11 -1.25 -2.47 0.00 0.00 174.74 171.66 1sb1 s PRO 120 N 0.82 3.90 0.32 2.88 0.04 -1.26 -2.16 135.00 139.54 1sb1 s PRO 120 Ca -0.04 1.64 -0.02 0.00 0.04 0.00 0.00 61.00 62.62 1sb1 s PRO 120 Cb -0.05 -2.42 -0.04 0.00 0.04 0.00 0.00 34.50 32.03 1sb1 s PRO 120 CO -0.07 -0.40 0.54 0.54 0.04 0.00 0.00 177.00 177.66 1sb1 s VAL 121 N -1.63 5.08 0.43 -0.36 0.11 -0.62 -4.93 120.40 118.48 1sb1 s VAL 121 Ca 0.62 -0.25 -0.09 0.00 -2.93 0.00 0.00 61.98 59.32 1sb1 s VAL 121 Cb -0.25 -3.81 -0.06 0.00 -1.53 0.00 0.00 36.38 30.74 1sb1 s VAL 121 CO 0.30 -0.45 0.78 0.00 -3.33 0.00 0.00 175.10 172.40 1sb1 s LEU 123 N -4.07 3.77 0.56 0.00 1.43 -1.26 -0.94 118.68 118.17 1sb1 s LEU 123 Ca 0.50 0.21 -0.19 0.00 -1.03 0.00 0.00 54.13 53.62 1sb1 s LEU 123 Cb -0.10 -1.88 -0.05 0.00 0.03 0.00 0.00 46.19 44.19 1sb1 s LEU 123 CO 0.35 0.37 1.13 -2.16 0.23 0.00 0.00 176.35 176.27 1sb1 s PRO 124 N -0.82 3.27 0.47 1.29 0.04 -1.26 -4.93 135.00 133.06 1sb1 s PRO 124 Ca 0.13 1.60 0.08 0.00 0.04 0.00 0.00 61.00 62.85 1sb1 s PRO 124 Cb -0.12 -1.99 0.03 0.00 0.04 0.00 0.00 34.50 32.46 1sb1 s PRO 124 CO 0.03 -0.91 0.60 0.16 0.04 0.00 0.00 177.00 176.91 1sb1 s ASP 125 N -1.84 5.33 0.27 6.66 1.47 -1.26 -4.85 116.67 122.44 1sb1 s ASP 125 Ca 0.72 -0.66 -0.00 0.00 1.18 0.00 0.00 52.55 53.80 1sb1 s ASP 125 Cb -0.24 -0.29 0.55 0.00 -0.34 0.00 0.00 42.92 42.61 1sb1 s ASP 125 CO 0.29 -0.94 1.77 -0.09 0.68 0.00 0.00 175.17 176.88 1sb1 h ARG 126 N 0.57 0.66 -0.24 2.11 2.43 -1.97 -2.57 114.38 115.37 1sb1 h ARG 126 Ca -0.37 -0.04 -0.16 0.00 -0.81 0.00 0.00 59.98 58.60 1sb1 h ARG 126 Cb 1.28 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.68 1sb1 h ARG 126 CO 0.46 0.44 -0.49 1.49 -1.51 0.00 0.00 179.97 180.36 1sb1 h GLU 127 N 0.68 0.65 -0.40 0.20 4.57 -2.04 -1.53 114.58 116.71 1sb1 h GLU 127 Ca 0.48 -0.38 0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1sb1 h GLU 127 Cb 0.65 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.28 1sb1 h GLU 127 CO -0.35 1.00 0.00 2.41 -1.18 0.00 0.00 179.01 180.89 1sb1 n THR 128 N -3.99 0.03 0.00 0.32 -1.04 -0.97 -1.18 114.28 107.44 1sb1 n THR 128 Ca -0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 1sb1 n THR 128 Cb 0.58 -0.17 0.00 0.00 -1.82 0.00 0.00 70.33 68.92 1sb1 n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1sb1 n ALA 129 N 0.46 0.00 -0.10 2.41 0.00 -0.58 -1.03 120.51 121.67 1sb1 n ALA 129 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 1sb1 n ALA 129 Cb 0.06 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.48 1sb1 n ALA 129 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1sb1 h SER 129 N 0.00 0.98 0.22 0.00 0.87 -1.40 -3.37 113.55 110.85 1sb1 h SER 129 Ca 0.00 -0.49 -0.15 0.00 -1.23 0.00 0.00 61.79 59.92 1sb1 h SER 129 Cb 0.00 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.65 1sb1 h SER 129 CO 0.00 1.28 -1.93 0.18 -0.53 0.00 0.00 176.83 175.83 1sb1 n LEU 129 N -4.06 0.25 -4.13 2.23 4.77 -0.20 -4.67 117.00 111.19 1sb1 n LEU 129 Ca -0.03 0.11 -0.43 0.00 -0.03 0.00 0.00 56.01 55.63 1sb1 n LEU 129 Cb 0.57 0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.83 1sb1 n LEU 129 CO 0.49 0.18 2.20 -0.11 -1.33 0.00 0.00 177.39 178.81 1sb1 n LEU 130 N -2.58 5.98 -4.13 2.23 7.94 -1.26 -4.81 117.00 120.37 1sb1 n LEU 130 Ca -0.14 -4.17 -0.21 0.00 -1.11 0.00 0.00 56.01 50.38 1sb1 n LEU 130 Cb 0.81 -1.66 -0.14 0.00 0.53 0.00 0.00 43.42 42.96 1sb1 n LEU 130 CO 0.44 0.76 -0.47 -1.10 -1.11 0.00 0.00 177.39 175.91 1sb1 s GLN 131 N 3.01 1.06 0.29 1.96 -0.21 -1.26 -4.94 119.66 119.56 1sb1 s GLN 131 Ca 0.48 -0.63 -0.29 0.00 0.02 0.00 0.00 55.36 54.93 1sb1 s GLN 131 Cb 0.08 -1.05 -0.13 0.00 1.00 0.00 0.00 33.01 32.91 1sb1 s GLN 131 CO -0.01 0.27 1.27 0.00 -2.12 0.00 0.00 175.29 174.70 1sb1 n ALA 132 N 2.33 0.82 0.00 6.09 0.00 -1.26 -1.26 120.51 127.23 1sb1 n ALA 132 Ca -0.16 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1sb1 n ALA 132 Cb 0.55 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.80 1sb1 n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sb1 n GLY 133 N 1.38 2.81 3.73 0.00 0.00 -0.09 -4.93 105.19 108.09 1sb1 n GLY 133 Ca 0.08 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 1sb1 n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1sb1 s TYR 134 N -1.23 3.06 0.01 1.61 1.51 -0.39 -4.53 117.35 117.40 1sb1 s TYR 134 Ca 0.00 0.88 -0.09 0.00 -1.01 0.00 0.00 57.07 56.85 1sb1 s TYR 134 Cb 0.00 -3.84 -0.05 0.00 -0.11 0.00 0.00 41.96 37.96 1sb1 s TYR 134 CO 0.00 -2.90 0.31 0.15 -1.11 0.00 0.00 175.55 172.00 1sb1 s LYS 135 N 0.32 3.66 0.42 -0.62 1.02 -1.26 -0.40 119.74 122.88 1sb1 s LYS 135 Ca 0.64 0.06 0.00 0.00 0.02 0.00 0.00 55.97 56.69 1sb1 s LYS 135 Cb -0.42 -3.09 0.00 0.00 -0.52 0.00 0.00 37.83 33.81 1sb1 s LYS 135 CO 0.38 0.64 0.03 0.41 -0.92 0.00 0.00 175.35 175.89 1sb1 n GLY 136 N 1.24 3.60 3.00 -3.33 0.00 0.02 -4.85 105.19 104.88 1sb1 n GLY 136 Ca -0.12 -2.34 -0.23 0.00 0.00 0.00 0.00 46.02 43.34 1sb1 n GLY 136 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1sb1 s ARG 137 N -3.52 1.33 -0.05 1.61 3.52 0.22 -1.42 118.95 120.64 1sb1 s ARG 137 Ca 0.02 -0.34 0.06 0.00 -0.13 0.00 0.00 55.73 55.34 1sb1 s ARG 137 Cb -0.00 -1.16 -0.02 0.00 -1.56 0.00 0.00 34.95 32.21 1sb1 s ARG 137 CO 0.02 0.05 -0.21 0.08 -0.81 0.00 0.00 175.30 174.42 1sb1 s VAL 138 N 0.53 2.44 0.07 7.11 1.01 0.17 -0.37 120.40 131.36 1sb1 s VAL 138 Ca -0.10 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 60.97 1sb1 s VAL 138 Cb -0.13 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.31 1sb1 s VAL 138 CO 0.02 0.58 -0.12 0.42 0.00 0.00 0.00 175.10 176.00 1sb1 s THR 139 N -0.46 0.93 0.00 3.92 -4.23 -1.24 -1.35 115.64 113.20 1sb1 s THR 139 Ca 0.05 -1.33 0.00 0.00 -1.18 0.00 0.00 61.69 59.24 1sb1 s THR 139 Cb -0.12 -1.02 0.00 0.00 1.34 0.00 0.00 72.50 72.71 1sb1 s THR 139 CO 0.01 -0.34 0.00 0.61 -0.54 0.00 0.00 174.62 174.36 1sb1 n GLY 140 N 1.16 0.77 0.97 3.99 0.00 -0.80 -4.53 105.19 106.74 1sb1 n GLY 140 Ca -0.20 -0.90 0.08 0.00 0.00 0.00 0.00 46.02 44.99 1sb1 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1sb1 n TRP 141 N -0.27 0.93 -0.65 1.61 8.01 -1.26 -1.59 117.44 124.21 1sb1 n TRP 141 Ca 0.00 -0.70 -0.30 0.00 -1.31 0.00 0.00 57.50 55.19 1sb1 n TRP 141 Cb 0.00 -0.21 0.27 0.00 -2.01 0.00 0.00 31.31 29.36 1sb1 n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1sb1 s GLY 142 N -1.39 1.48 0.58 6.99 0.00 -1.26 -4.52 107.32 109.20 1sb1 s GLY 142 Ca 0.38 -0.91 -0.20 0.00 0.00 0.00 0.00 44.72 43.98 1sb1 s GLY 142 CO 0.14 0.07 1.27 0.70 0.00 0.00 0.00 173.10 175.28 1sb1 n ASN 143 N -5.33 2.19 0.15 1.64 3.02 0.12 -2.82 115.26 114.23 1sb1 n ASN 143 Ca 0.14 0.92 0.12 0.00 -0.03 0.00 0.00 54.58 55.72 1sb1 n ASN 143 Cb 0.60 -1.54 0.20 0.00 -0.61 0.00 0.00 39.78 38.43 1sb1 n ASN 143 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1sb1 h LEU 144 N 1.06 0.00 -7.76 3.41 3.38 -1.62 -0.28 115.31 113.50 1sb1 h LEU 144 Ca -0.50 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.33 1sb1 h LEU 144 Cb 1.32 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.91 1sb1 h LEU 144 CO 0.55 0.02 -0.40 -0.54 0.09 0.00 0.00 178.44 178.16 1sb1 s LYS 145 N -3.20 0.71 0.00 1.13 1.02 -1.26 -4.27 119.74 113.86 1sb1 s LYS 145 Ca 0.06 -0.69 0.00 0.00 0.02 0.00 0.00 55.97 55.37 1sb1 s LYS 145 Cb 0.09 0.29 0.00 0.00 -0.52 0.00 0.00 37.83 37.69 1sb1 s LYS 145 CO 0.68 -0.21 0.08 -1.91 -0.92 0.00 0.00 175.35 173.08 1sb1 n GLU 146 N 0.58 0.09 0.00 1.68 2.13 -1.26 -4.93 120.64 118.92 1sb1 n GLU 146 Ca -0.18 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.64 1sb1 n GLU 146 Cb 0.59 -1.40 0.00 0.00 0.27 0.00 0.00 31.44 30.90 1sb1 n GLU 146 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1sb1 n GLY 150 N 0.89 1.48 3.88 8.31 0.00 -1.26 -4.98 105.19 113.51 1sb1 n GLY 150 Ca 0.00 -1.61 -0.31 0.00 0.00 0.00 0.00 46.02 44.10 1sb1 n GLY 150 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1sb1 s GLN 151 N 2.80 3.76 0.58 1.61 1.11 -1.26 -2.33 119.66 125.92 1sb1 s GLN 151 Ca 0.00 0.24 -0.10 0.00 0.01 0.00 0.00 55.36 55.51 1sb1 s GLN 151 Cb 0.00 -2.60 -0.04 0.00 -1.01 0.00 0.00 33.01 29.36 1sb1 s GLN 151 CO 0.00 0.23 0.97 -1.25 0.01 0.00 0.00 175.29 175.25 1sb1 s PRO 152 N -3.18 3.60 0.05 2.91 0.04 -1.26 -4.95 135.00 132.20 1sb1 s PRO 152 Ca 0.47 0.62 -0.02 0.00 0.04 0.00 0.00 61.00 62.10 1sb1 s PRO 152 Cb -0.11 -2.16 -0.27 0.00 0.04 0.00 0.00 34.50 32.00 1sb1 s PRO 152 CO 0.25 -0.47 1.03 1.03 0.04 0.00 0.00 177.00 178.88 1sb1 h SER 153 N -0.14 0.37 -4.81 6.66 0.87 -1.97 -3.43 113.55 111.10 1sb1 h SER 153 Ca -0.45 -0.44 -0.27 0.00 -1.23 0.00 0.00 61.79 59.40 1sb1 h SER 153 Cb 1.19 -0.12 -0.15 0.00 -0.44 0.00 0.00 62.40 62.89 1sb1 h SER 153 CO 0.62 1.36 -0.65 0.68 -0.53 0.00 0.00 176.83 178.31 1sb1 s VAL 154 N -2.64 0.46 0.17 2.23 -7.23 -1.26 -1.71 120.40 110.41 1sb1 s VAL 154 Ca -0.06 -1.97 -0.33 0.00 -1.81 0.00 0.00 61.98 57.82 1sb1 s VAL 154 Cb 0.07 -2.22 -0.16 0.00 0.56 0.00 0.00 36.38 34.64 1sb1 s VAL 154 CO 0.87 -0.36 1.10 -0.11 -0.31 0.00 0.00 175.10 176.29 1sb1 n LEU 155 N -0.24 1.25 -4.74 1.32 7.94 0.11 -4.82 117.00 117.82 1sb1 n LEU 155 Ca -0.05 1.14 -0.31 0.00 -1.11 0.00 0.00 56.01 55.69 1sb1 n LEU 155 Cb 0.64 -1.18 -0.07 0.00 0.53 0.00 0.00 43.42 43.34 1sb1 n LEU 155 CO 0.33 -1.46 -0.29 -1.10 -1.11 0.00 0.00 177.39 173.76 1sb1 s GLN 156 N -0.47 2.76 0.02 1.96 -1.52 -0.62 -0.67 119.66 121.11 1sb1 s GLN 156 Ca 0.73 -0.73 0.03 0.00 -1.95 0.00 0.00 55.36 53.43 1sb1 s GLN 156 Cb -0.87 -2.66 -0.01 0.00 -0.22 0.00 0.00 33.01 29.24 1sb1 s GLN 156 CO 0.53 0.56 -0.08 0.54 -0.25 0.00 0.00 175.29 176.59 1sb1 s VAL 157 N -1.33 0.62 -0.16 1.09 0.11 0.57 -1.91 120.40 119.38 1sb1 s VAL 157 Ca 0.27 -0.70 -0.14 0.00 -2.93 0.00 0.00 61.98 58.48 1sb1 s VAL 157 Cb -0.12 -0.59 0.04 0.00 -1.53 0.00 0.00 36.38 34.18 1sb1 s VAL 157 CO 0.19 -0.08 0.43 0.54 -3.33 0.00 0.00 175.10 172.85 1sb1 s VAL 158 N -0.72 -0.00 -0.17 2.04 0.11 -0.46 -1.08 120.40 120.11 1sb1 s VAL 158 Ca -0.02 0.01 -0.10 0.00 -2.93 0.00 0.00 61.98 58.95 1sb1 s VAL 158 Cb -0.06 -0.60 -0.05 0.00 -1.53 0.00 0.00 36.38 34.14 1sb1 s VAL 158 CO 0.00 0.01 0.15 0.20 -3.33 0.00 0.00 175.10 172.13 1sb1 s ASN 159 N 0.42 6.30 0.00 3.54 0.01 -1.26 -0.66 114.94 123.29 1sb1 s ASN 159 Ca -0.02 0.34 0.01 0.00 -0.71 0.00 0.00 52.86 52.49 1sb1 s ASN 159 Cb -0.04 -2.10 -0.01 0.00 0.41 0.00 0.00 41.25 39.52 1sb1 s ASN 159 CO -0.02 0.25 -0.03 -0.76 -1.51 0.00 0.00 177.10 175.02 1sb1 s LEU 160 N -0.08 2.05 0.24 0.60 1.02 -0.51 -4.96 118.68 117.04 1sb1 s LEU 160 Ca 0.11 -0.13 -0.27 0.00 0.02 0.00 0.00 54.13 53.85 1sb1 s LEU 160 Cb -0.12 -0.13 -0.09 0.00 0.02 0.00 0.00 46.19 45.87 1sb1 s LEU 160 CO 0.01 -0.01 0.88 -2.16 0.02 0.00 0.00 176.35 175.09 1sb1 s PRO 161 N -0.32 4.69 0.39 1.29 0.04 -1.26 -0.80 135.00 139.03 1sb1 s PRO 161 Ca -0.01 1.33 -0.26 0.00 0.04 0.00 0.00 61.00 62.10 1sb1 s PRO 161 Cb -0.03 -3.16 -0.09 0.00 0.04 0.00 0.00 34.50 31.27 1sb1 s PRO 161 CO -0.00 0.48 1.23 0.42 0.04 0.00 0.00 177.00 179.17 1sb1 s ILE 162 N -1.28 2.93 0.03 0.56 1.01 0.47 -1.09 121.20 123.83 1sb1 s ILE 162 Ca 0.41 0.82 0.03 0.00 0.00 0.00 0.00 60.65 61.91 1sb1 s ILE 162 Cb -0.23 -3.48 -0.04 0.00 0.01 0.00 0.00 42.46 38.72 1sb1 s ILE 162 CO 0.28 0.11 -0.01 -0.69 0.00 0.00 0.00 174.94 174.64 1sb1 s VAL 163 N -1.31 4.06 0.28 2.92 1.01 -0.55 -0.92 120.40 125.89 1sb1 s VAL 163 Ca 0.55 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 61.50 1sb1 s VAL 163 Cb -0.34 -2.84 -0.13 0.00 0.00 0.00 0.00 36.38 33.07 1sb1 s VAL 163 CO 0.44 0.31 1.41 -0.62 0.00 0.00 0.00 175.10 176.64 1sb1 n GLU 164 N 1.18 2.20 -0.35 2.72 4.71 -1.26 -4.63 120.64 125.21 1sb1 n GLU 164 Ca -0.14 0.78 0.08 0.00 -0.01 0.00 0.00 57.16 57.87 1sb1 n GLU 164 Cb 0.52 -2.44 0.25 0.00 -1.01 0.00 0.00 31.44 28.76 1sb1 n GLU 164 CO 0.00 0.00 0.00 -0.09 0.09 0.00 0.00 177.13 177.13 1sb1 h ARG 165 N 3.85 0.86 -0.44 3.49 2.43 -1.98 -1.00 114.38 121.58 1sb1 h ARG 165 Ca -0.46 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 58.62 1sb1 h ARG 165 Cb 1.27 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.60 1sb1 h ARG 165 CO 0.73 0.57 0.09 -1.35 -1.51 0.00 0.00 179.97 178.50 1sb1 h PRO 166 N 0.88 0.67 -0.35 0.20 0.11 -2.00 -1.26 132.00 130.25 1sb1 h PRO 166 Ca 0.50 -0.13 -0.14 0.00 0.11 0.00 0.00 66.00 66.35 1sb1 h PRO 166 Cb 0.59 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.59 1sb1 h PRO 166 CO -0.30 0.62 -0.33 0.28 -0.21 0.00 0.00 178.00 178.06 1sb1 h VAL 167 N 0.65 1.28 -0.23 3.15 2.07 -1.59 -1.25 116.25 120.32 1sb1 h VAL 167 Ca 0.15 -1.49 0.01 0.00 0.82 0.00 0.00 66.70 66.18 1sb1 h VAL 167 Cb 0.26 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 1sb1 h VAL 167 CO -0.00 0.49 0.13 0.00 0.02 0.00 0.00 177.57 178.22 1sb1 h LYS 169 N 0.28 1.01 0.00 0.00 1.57 -1.16 -2.49 116.57 115.78 1sb1 h LYS 169 Ca 0.09 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1sb1 h LYS 169 Cb -0.00 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.10 1sb1 h LYS 169 CO -0.04 0.74 0.00 -0.25 -0.57 0.00 0.00 179.45 179.33 1sb1 n ASP 170 N -4.49 0.00 -0.32 0.86 8.00 -0.48 -3.01 116.55 117.11 1sb1 n ASP 170 Ca 0.06 -0.81 0.11 0.00 0.71 0.00 0.00 54.79 54.87 1sb1 n ASP 170 Cb 0.08 0.00 0.10 0.00 -0.02 0.00 0.00 41.12 41.28 1sb1 n ASP 170 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1sb1 n SER 171 N -1.00 1.50 -3.92 -2.24 3.41 -0.94 -4.99 113.62 105.45 1sb1 n SER 171 Ca 0.19 -1.18 -0.09 0.00 -0.26 0.00 0.00 58.87 57.53 1sb1 n SER 171 Cb 0.09 0.44 -0.07 0.00 -0.26 0.00 0.00 64.21 64.41 1sb1 n SER 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1sb1 s THR 172 N -2.60 0.08 -1.54 6.66 -1.32 -1.16 -4.82 115.64 110.95 1sb1 s THR 172 Ca 0.18 -1.30 0.24 0.00 -1.21 0.00 0.00 61.69 59.60 1sb1 s THR 172 Cb 0.18 -1.69 0.04 0.00 -1.51 0.00 0.00 72.50 69.52 1sb1 s THR 172 CO 0.61 -0.39 1.27 0.54 -2.21 0.00 0.00 174.62 174.44 1sb1 n ARG 173 N -0.18 0.61 -2.50 7.08 1.74 -1.26 -4.93 116.66 117.22 1sb1 n ARG 173 Ca -0.10 -0.44 -0.38 0.00 -0.77 0.00 0.00 57.85 56.16 1sb1 n ARG 173 Cb 0.63 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.54 1sb1 n ARG 173 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1sb1 s ILE 174 N -2.69 3.60 -0.30 0.55 1.01 -1.26 -4.97 121.20 117.13 1sb1 s ILE 174 Ca 0.17 1.35 -0.29 0.00 0.00 0.00 0.00 60.65 61.88 1sb1 s ILE 174 Cb 0.18 -3.76 -0.00 0.00 0.01 0.00 0.00 42.46 38.89 1sb1 s ILE 174 CO 0.64 0.13 1.36 -0.60 0.00 0.00 0.00 174.94 176.47 1sb1 s ARG 175 N -2.14 3.85 0.04 2.79 3.52 -1.26 -5.00 118.95 120.75 1sb1 s ARG 175 Ca 0.53 1.26 -0.18 0.00 -0.13 0.00 0.00 55.73 57.21 1sb1 s ARG 175 Cb -0.26 -3.92 -0.06 0.00 -1.56 0.00 0.00 34.95 29.15 1sb1 s ARG 175 CO 0.33 -1.20 0.53 0.42 -0.81 0.00 0.00 175.30 174.56 1sb1 s ILE 176 N 4.63 4.84 0.46 4.11 -1.09 -1.26 -4.88 121.20 128.01 1sb1 s ILE 176 Ca 0.59 1.11 0.06 0.00 -2.23 0.00 0.00 60.65 60.18 1sb1 s ILE 176 Cb -0.17 -3.85 -0.03 0.00 -1.58 0.00 0.00 42.46 36.83 1sb1 s ILE 176 CO 0.25 0.55 0.16 0.42 -1.23 0.00 0.00 174.94 175.09 1sb1 s THR 177 N -0.99 1.89 -1.16 2.92 -4.23 -1.26 -5.01 115.64 107.80 1sb1 s THR 177 Ca 0.28 -1.77 0.17 0.00 -1.18 0.00 0.00 61.69 59.19 1sb1 s THR 177 Cb -0.19 -2.65 0.20 0.00 1.34 0.00 0.00 72.50 71.20 1sb1 s THR 177 CO 0.17 0.00 1.53 0.47 -0.54 0.00 0.00 174.62 176.25 1sb1 n ASP 178 N -1.30 0.00 -0.73 3.99 8.00 -1.26 -2.00 116.55 123.24 1sb1 n ASP 178 Ca -0.06 0.33 0.06 0.00 0.71 0.00 0.00 54.79 55.84 1sb1 n ASP 178 Cb 0.65 -0.42 0.17 0.00 -0.02 0.00 0.00 41.12 41.50 1sb1 n ASP 178 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1sb1 n ASN 179 N -1.42 2.12 -4.19 -2.24 3.02 -1.26 -4.85 115.26 106.43 1sb1 n ASN 179 Ca 0.06 -2.01 -0.13 0.00 -0.03 0.00 0.00 54.58 52.46 1sb1 n ASN 179 Cb 0.18 -0.27 -0.10 0.00 -0.61 0.00 0.00 39.78 38.97 1sb1 n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1sb1 s MET 180 N -1.49 0.90 0.10 3.52 -1.94 -0.85 -0.56 119.30 118.98 1sb1 s MET 180 Ca 0.26 -1.28 -0.11 0.00 -1.71 0.00 0.00 55.69 52.86 1sb1 s MET 180 Cb 0.14 -0.48 0.01 0.00 2.01 0.00 0.00 34.83 36.50 1sb1 s MET 180 CO 0.17 0.06 0.25 -0.59 -0.01 0.00 0.00 175.02 174.90 1sb1 s PHE 181 N -2.94 0.06 0.23 -0.03 -0.12 -0.75 -4.81 117.98 109.62 1sb1 s PHE 181 Ca 0.10 -0.46 0.09 0.00 -0.05 0.00 0.00 56.93 56.61 1sb1 s PHE 181 Cb 0.00 0.03 -0.05 0.00 -0.63 0.00 0.00 43.02 42.38 1sb1 s PHE 181 CO -0.01 -0.60 -0.16 0.00 -0.05 0.00 0.00 175.22 174.40 1sb1 s ALA 183 N -2.77 -0.58 0.00 0.00 0.00 -0.35 -1.48 121.76 116.57 1sb1 s ALA 183 Ca 0.25 -0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.12 1sb1 s ALA 183 Cb -0.02 0.31 0.00 0.00 0.00 0.00 0.00 23.12 23.41 1sb1 s ALA 183 CO 0.09 -0.40 0.00 0.41 0.00 0.00 0.00 175.76 175.86 1sb1 n GLY 184 N 0.59 3.48 3.86 0.00 0.00 -0.25 -2.00 105.19 110.88 1sb1 n GLY 184 Ca -0.19 -1.58 -0.31 0.00 0.00 0.00 0.00 46.02 43.94 1sb1 n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1sb1 s TYR 184 N -2.00 3.43 0.66 1.61 2.02 -1.26 -4.56 117.35 117.24 1sb1 s TYR 184 Ca 0.00 1.12 -0.10 0.00 -0.37 0.00 0.00 57.07 57.73 1sb1 s TYR 184 Cb 0.00 -2.48 0.01 0.00 -0.40 0.00 0.00 41.96 39.08 1sb1 s TYR 184 CO 0.00 -0.02 1.03 0.15 -1.57 0.00 0.00 175.55 175.14 1sb1 s LYS 185 N -3.46 2.96 0.38 -0.62 -0.14 -1.26 -4.82 119.74 112.78 1sb1 s LYS 185 Ca 0.53 0.35 0.06 0.00 -1.36 0.00 0.00 55.97 55.55 1sb1 s LYS 185 Cb -0.10 -2.11 0.74 0.00 -1.68 0.00 0.00 37.83 34.68 1sb1 s LYS 185 CO 0.25 -0.87 1.96 -1.35 -0.76 0.00 0.00 175.35 174.57 1sb1 h PRO 186 N -0.46 0.48 0.00 -1.68 0.11 -1.96 -2.23 132.00 126.26 1sb1 h PRO 186 Ca -0.45 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1sb1 h PRO 186 Cb 1.25 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1sb1 h PRO 186 CO 0.63 0.44 0.00 -3.47 -0.21 0.00 0.00 178.00 175.39 1sb1 n ASP 186 N -4.36 0.00 -0.11 -2.05 -0.08 -1.26 -3.35 116.55 105.34 1sb1 n ASP 186 Ca 0.02 0.09 0.13 0.00 -1.51 0.00 0.00 54.79 53.51 1sb1 n ASP 186 Cb 0.17 -0.35 0.43 0.00 2.34 0.00 0.00 41.12 43.71 1sb1 n ASP 186 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1sb1 n GLU 186 N -1.35 0.45 0.00 -0.67 1.02 -0.84 -4.97 120.64 114.28 1sb1 n GLU 186 Ca 0.10 -0.22 0.00 0.00 -0.02 0.00 0.00 57.16 57.02 1sb1 n GLU 186 Cb 0.23 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 1sb1 n GLU 186 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1sb1 n GLY 186 N 1.39 1.25 3.75 0.62 0.00 -1.21 -4.93 105.19 106.05 1sb1 n GLY 186 Ca 0.10 -0.01 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1sb1 n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sb1 s LYS 186 N 0.00 2.18 0.00 1.61 1.02 -1.26 -5.05 119.74 118.24 1sb1 s LYS 186 Ca 0.00 1.37 0.00 0.00 0.02 0.00 0.00 55.97 57.36 1sb1 s LYS 186 Cb 0.00 -1.88 0.00 0.00 -0.52 0.00 0.00 37.83 35.43 1sb1 s LYS 186 CO 0.00 -1.73 0.00 2.89 -0.92 0.00 0.00 175.35 175.59 1sb1 n ARG 187 N -3.24 0.00 0.00 1.68 1.85 -1.26 -4.69 116.66 111.00 1sb1 n ARG 187 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.95 1sb1 n ARG 187 Cb 0.52 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.93 1sb1 n ARG 187 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1sb1 n GLY 188 N 0.00 4.26 3.60 2.89 0.00 -1.26 -4.92 105.19 109.77 1sb1 n GLY 188 Ca 0.00 -1.37 -0.03 0.00 0.00 0.00 0.00 46.02 44.62 1sb1 n GLY 188 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sb1 s ASP 189 N 0.00 -0.13 0.62 1.61 2.15 -0.92 -4.70 116.67 115.30 1sb1 s ASP 189 Ca 0.00 -0.06 -0.09 0.00 0.43 0.00 0.00 52.55 52.83 1sb1 s ASP 189 Cb 0.00 0.19 -0.01 0.00 -0.30 0.00 0.00 42.92 42.80 1sb1 s ASP 189 CO 0.00 -0.32 0.98 0.00 -0.17 0.00 0.00 175.17 175.66 1sb1 s ALA 190 N -2.52 3.13 0.07 3.66 0.00 -1.26 -0.61 121.76 124.23 1sb1 s ALA 190 Ca 0.11 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.67 1sb1 s ALA 190 Cb 0.01 -2.86 -0.00 0.00 0.00 0.00 0.00 23.12 20.27 1sb1 s ALA 190 CO -0.04 -0.82 0.08 0.00 0.00 0.00 0.00 175.76 174.98 1sb1 n GLU 192 N -0.12 1.99 0.00 0.00 0.00 -1.26 -1.38 120.64 119.87 1sb1 n GLU 192 Ca 0.01 0.71 0.00 0.00 0.00 0.00 0.00 57.16 57.88 1sb1 n GLU 192 Cb 0.12 -2.43 0.00 0.00 0.00 0.00 0.00 31.44 29.13 1sb1 n GLU 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1sb1 n GLY 193 N 2.89 3.43 0.11 8.31 0.00 -1.26 0.11 105.19 118.78 1sb1 n GLY 193 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.29 1sb1 n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1sb1 h ASP 194 N 0.00 0.00 -2.17 1.61 3.32 -1.57 -3.28 116.42 114.33 1sb1 h ASP 194 Ca 0.00 -0.08 -0.62 0.00 0.02 0.00 0.00 57.03 56.35 1sb1 h ASP 194 Cb 0.00 0.00 0.12 0.00 0.22 0.00 0.00 39.33 39.67 1sb1 h ASP 194 CO 0.00 0.04 -0.14 -1.20 -1.72 0.00 0.00 179.24 176.22 1sb1 n SER 195 N -2.45 0.22 0.00 6.45 7.64 -1.26 -1.48 113.62 122.74 1sb1 n SER 195 Ca 0.03 1.09 0.00 0.00 1.01 0.00 0.00 58.87 61.01 1sb1 n SER 195 Cb 0.48 -1.18 0.00 0.00 -1.01 0.00 0.00 64.21 62.50 1sb1 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1sb1 n GLY 196 N 1.52 2.63 3.69 0.23 0.00 -0.40 0.44 105.19 113.29 1sb1 n GLY 196 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1sb1 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sb1 s GLY 197 N -1.82 1.60 0.19 -0.02 0.00 -0.55 -3.10 107.32 103.62 1sb1 s GLY 197 Ca 0.00 -0.15 -0.13 0.00 0.00 0.00 0.00 44.72 44.44 1sb1 s GLY 197 CO 0.00 0.40 0.57 2.56 0.00 0.00 0.00 173.10 176.63 1sb1 s PRO 198 N -4.90 3.95 -0.30 2.90 0.04 -1.26 -0.59 135.00 134.84 1sb1 s PRO 198 Ca 0.65 0.46 -0.03 0.00 0.04 0.00 0.00 61.00 62.12 1sb1 s PRO 198 Cb -0.19 -2.81 0.04 0.00 0.04 0.00 0.00 34.50 31.58 1sb1 s PRO 198 CO 0.58 0.40 0.01 0.12 0.04 0.00 0.00 177.00 178.15 1sb1 s PHE 199 N -1.61 3.21 0.26 0.56 2.19 -0.16 -3.71 117.98 118.72 1sb1 s PHE 199 Ca 0.42 -1.64 0.11 0.00 0.33 0.00 0.00 56.93 56.15 1sb1 s PHE 199 Cb -0.14 -2.14 -0.05 0.00 -1.31 0.00 0.00 43.02 39.39 1sb1 s PHE 199 CO 0.20 -0.75 -0.13 0.14 1.83 0.00 0.00 175.22 176.51 1sb1 s VAL 200 N 1.32 2.88 0.01 3.12 -7.23 0.50 -1.11 120.40 119.89 1sb1 s VAL 200 Ca -0.03 -2.12 0.01 0.00 -1.81 0.00 0.00 61.98 58.03 1sb1 s VAL 200 Cb -0.19 -2.50 -0.01 0.00 0.56 0.00 0.00 36.38 34.24 1sb1 s VAL 200 CO -0.01 -0.33 -0.04 -0.04 -0.31 0.00 0.00 175.10 174.37 1sb1 s MET 201 N -3.41 0.30 -0.32 4.82 -1.94 -0.32 0.72 119.30 119.16 1sb1 s MET 201 Ca 0.29 -0.40 -0.12 0.00 -1.71 0.00 0.00 55.69 53.76 1sb1 s MET 201 Cb -0.06 -0.12 -0.03 0.00 2.01 0.00 0.00 34.83 36.63 1sb1 s MET 201 CO 0.16 0.02 0.21 0.21 -0.01 0.00 0.00 175.02 175.62 1sb1 s LYS 202 N -0.82 3.64 0.15 2.03 2.20 -1.26 -0.54 119.74 125.13 1sb1 s LYS 202 Ca -0.07 -0.54 -0.31 0.00 -0.36 0.00 0.00 55.97 54.69 1sb1 s LYS 202 Cb -0.06 -3.73 -0.10 0.00 -1.51 0.00 0.00 37.83 32.44 1sb1 s LYS 202 CO -0.00 -0.35 1.62 0.45 -0.36 0.00 0.00 175.35 176.71 1sb1 s SER 203 N 1.72 6.55 0.00 1.43 0.15 -0.04 -4.87 113.70 118.65 1sb1 s SER 203 Ca 0.06 2.63 0.30 0.00 0.70 0.00 0.00 55.95 59.65 1sb1 s SER 203 Cb -0.17 -2.59 1.41 0.00 -1.71 0.00 0.00 66.02 62.97 1sb1 s SER 203 CO 0.10 -0.87 2.01 -0.81 1.20 0.00 0.00 173.24 174.87 1sb1 n PRO 204 N 4.39 0.26 -0.05 5.44 -0.04 -1.26 -0.76 135.00 142.97 1sb1 n PRO 204 Ca 0.15 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.42 1sb1 n PRO 204 Cb 0.38 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.22 1sb1 n PRO 204 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1sb1 h PHE 204 N 0.00 0.15 0.00 0.54 0.04 -1.97 -3.41 116.94 112.29 1sb1 h PHE 204 Ca 0.00 -0.11 0.00 0.00 2.80 0.00 0.00 57.97 60.66 1sb1 h PHE 204 Cb 0.37 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.51 1sb1 h PHE 204 CO 0.00 1.31 0.00 0.27 -0.60 0.00 0.00 178.31 179.29 1sb1 n ASN 204 N -4.35 1.67 -2.14 2.17 2.04 -1.24 -5.01 115.26 108.38 1sb1 n ASN 204 Ca -0.21 -1.83 -0.17 0.00 -0.44 0.00 0.00 54.58 51.93 1sb1 n ASN 204 Cb 0.67 0.00 -0.03 0.00 -2.53 0.00 0.00 39.78 37.89 1sb1 n ASN 204 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1sb1 n ASN 205 N -0.42 -4.79 -4.74 0.53 3.02 0.06 -4.99 115.26 103.94 1sb1 n ASN 205 Ca 0.00 0.18 -0.30 0.00 -0.03 0.00 0.00 54.58 54.44 1sb1 n ASN 205 Cb 0.29 -4.11 -0.07 0.00 -0.61 0.00 0.00 39.78 35.28 1sb1 n ASN 205 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1sb1 s ARG 206 N -4.56 2.74 0.02 3.52 0.52 -1.25 -4.82 118.95 115.12 1sb1 s ARG 206 Ca 0.00 -0.79 -0.23 0.00 -0.52 0.00 0.00 55.73 54.19 1sb1 s ARG 206 Cb 0.00 -2.63 -0.05 0.00 0.52 0.00 0.00 34.95 32.79 1sb1 s ARG 206 CO 0.00 0.54 0.70 -1.58 0.02 0.00 0.00 175.30 174.98 1sb1 s TRP 207 N -1.43 3.71 -0.03 -0.53 0.52 -1.26 -0.86 118.94 119.06 1sb1 s TRP 207 Ca 0.28 1.36 0.06 0.00 0.02 0.00 0.00 56.10 57.82 1sb1 s TRP 207 Cb -0.12 -2.74 -0.01 0.00 -1.15 0.00 0.00 33.47 29.45 1sb1 s TRP 207 CO 0.21 0.29 -0.22 0.71 0.02 0.00 0.00 176.95 177.96 1sb1 s TYR 208 N -0.05 2.03 -0.46 -1.98 2.02 0.29 -2.23 117.35 116.98 1sb1 s TYR 208 Ca 0.36 -0.44 -0.22 0.00 -0.37 0.00 0.00 57.07 56.39 1sb1 s TYR 208 Cb -0.19 -1.32 0.03 0.00 -0.40 0.00 0.00 41.96 40.08 1sb1 s TYR 208 CO 0.20 -0.08 0.73 -1.14 -1.57 0.00 0.00 175.55 173.70 1sb1 s GLN 209 N -0.40 3.33 0.04 -0.62 0.74 -0.11 -1.17 119.66 121.46 1sb1 s GLN 209 Ca 0.05 -0.27 0.18 0.00 0.05 0.00 0.00 55.36 55.37 1sb1 s GLN 209 Cb -0.10 -3.96 -0.16 0.00 1.10 0.00 0.00 33.01 29.90 1sb1 s GLN 209 CO 0.00 -1.11 0.72 -1.33 -0.55 0.00 0.00 175.29 173.03 1sb1 n MET 210 N 6.55 0.63 -4.12 1.67 2.81 -0.26 -4.33 117.12 120.07 1sb1 n MET 210 Ca 0.00 0.13 -0.11 0.00 -1.81 0.00 0.00 57.70 55.91 1sb1 n MET 210 Cb 0.48 -1.74 -0.08 0.00 -0.71 0.00 0.00 33.22 31.17 1sb1 n MET 210 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1sb1 s GLY 211 N -4.78 1.09 -0.07 3.03 0.00 -0.85 -2.00 107.32 103.74 1sb1 s GLY 211 Ca -0.04 -1.37 0.03 0.00 0.00 0.00 0.00 44.72 43.34 1sb1 s GLY 211 CO 0.82 -1.08 -0.15 -0.42 0.00 0.00 0.00 173.10 172.27 1sb1 s ILE 212 N -4.07 1.32 -0.07 0.90 1.01 -0.93 -0.99 121.20 118.36 1sb1 s ILE 212 Ca 0.32 -0.60 -0.31 0.00 0.00 0.00 0.00 60.65 60.07 1sb1 s ILE 212 Cb 0.04 -1.18 -0.09 0.00 0.01 0.00 0.00 42.46 41.24 1sb1 s ILE 212 CO 0.11 0.39 2.03 0.52 0.00 0.00 0.00 174.94 177.99 1sb1 n VAL 213 N 3.66 0.60 -0.00 2.92 0.31 0.24 -0.60 118.33 125.46 1sb1 n VAL 213 Ca -0.21 -0.21 -0.03 0.00 -0.01 0.00 0.00 64.34 63.87 1sb1 n VAL 213 Cb 0.52 -2.24 -0.01 0.00 -0.91 0.00 0.00 33.84 31.20 1sb1 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1sb1 n SER 214 N 8.43 1.29 -3.86 4.52 2.88 -0.64 -1.28 113.62 124.97 1sb1 n SER 214 Ca 0.24 0.19 -0.07 0.00 -1.33 0.00 0.00 58.87 57.90 1sb1 n SER 214 Cb 0.38 -0.46 -0.02 0.00 -0.75 0.00 0.00 64.21 63.36 1sb1 n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1sb1 s TRP 215 N -2.22 -0.18 -0.17 0.66 1.48 -0.94 -4.91 118.94 112.66 1sb1 s TRP 215 Ca -0.10 -0.27 -0.30 0.00 -1.06 0.00 0.00 56.10 54.37 1sb1 s TRP 215 Cb 0.01 0.70 0.13 0.00 -1.16 0.00 0.00 33.47 33.16 1sb1 s TRP 215 CO 0.15 -1.23 1.04 0.20 -4.06 0.00 0.00 176.95 173.04 1sb1 s GLY 216 N -2.92 -0.24 -0.68 3.67 0.00 -1.26 0.09 107.32 105.97 1sb1 s GLY 216 Ca 0.11 2.05 -0.19 0.00 0.00 0.00 0.00 44.72 46.69 1sb1 s GLY 216 CO 0.07 0.99 0.80 -0.54 0.00 0.00 0.00 173.10 174.42 1sb1 s GLU 217 N -1.25 3.21 1.02 2.90 2.02 -1.26 -4.87 118.70 120.48 1sb1 s GLU 217 Ca 0.00 -1.50 0.00 0.00 0.02 0.00 0.00 54.97 53.49 1sb1 s GLU 217 Cb -0.01 -4.39 0.00 0.00 0.10 0.00 0.00 34.13 29.83 1sb1 s GLU 217 CO -0.00 -1.57 0.00 0.41 0.02 0.00 0.00 175.26 174.12 1sb1 n GLY 219 N 5.16 -1.93 2.87 -1.39 0.00 -1.26 -4.75 105.19 103.89 1sb1 n GLY 219 Ca -0.01 -1.51 -0.24 0.00 0.00 0.00 0.00 46.02 44.26 1sb1 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sb1 n ASP 221 N 4.70 -5.73 -4.78 0.00 2.03 -1.26 -4.63 116.55 106.87 1sb1 n ASP 221 Ca -0.14 -0.32 -0.38 0.00 0.52 0.00 0.00 54.79 54.47 1sb1 n ASP 221 Cb 0.50 -4.64 -0.06 0.00 -0.72 0.00 0.00 41.12 36.21 1sb1 n ASP 221 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1sb1 s ARG 221 N -5.80 4.53 0.34 -0.67 0.52 -1.26 -4.93 118.95 111.68 1sb1 s ARG 221 Ca 0.34 1.20 -0.29 0.00 -0.52 0.00 0.00 55.73 56.46 1sb1 s ARG 221 Cb -0.16 -2.97 -0.11 0.00 0.52 0.00 0.00 34.95 32.24 1sb1 s ARG 221 CO 0.42 0.40 1.41 -0.51 0.02 0.00 0.00 175.30 177.04 1sb1 s ASP 222 N -1.48 6.55 0.00 0.23 1.01 -1.26 -1.82 116.67 119.90 1sb1 s ASP 222 Ca 0.44 2.86 0.00 0.00 0.71 0.00 0.00 52.55 56.56 1sb1 s ASP 222 Cb -0.20 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 41.08 1sb1 s ASP 222 CO 0.25 -0.72 0.00 0.61 0.21 0.00 0.00 175.17 175.52 1sb1 n GLY 223 N 0.87 2.55 3.80 0.21 0.00 -1.26 -5.01 105.19 106.35 1sb1 n GLY 223 Ca 0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 1sb1 n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sb1 s LYS 224 N -0.17 2.77 0.15 1.61 -0.14 -0.75 -4.77 119.74 118.44 1sb1 s LYS 224 Ca 0.00 -1.17 0.01 0.00 -1.36 0.00 0.00 55.97 53.45 1sb1 s LYS 224 Cb 0.00 -2.47 -0.04 0.00 -1.68 0.00 0.00 37.83 33.63 1sb1 s LYS 224 CO 0.00 0.32 0.01 0.71 -0.76 0.00 0.00 175.35 175.63 1sb1 s TYR 225 N -2.21 1.06 0.07 3.18 2.02 -1.26 -4.73 117.35 115.48 1sb1 s TYR 225 Ca 0.34 -1.06 -0.13 0.00 -0.37 0.00 0.00 57.07 55.85 1sb1 s TYR 225 Cb -0.07 -0.61 -0.06 0.00 -0.40 0.00 0.00 41.96 40.82 1sb1 s TYR 225 CO 0.24 -0.28 0.45 0.20 -1.57 0.00 0.00 175.55 174.59 1sb1 s GLY 226 N -3.12 2.44 -0.05 0.71 0.00 -0.85 -4.55 107.32 101.91 1sb1 s GLY 226 Ca 0.22 -0.24 0.01 0.00 0.00 0.00 0.00 44.72 44.71 1sb1 s GLY 226 CO 0.02 0.06 -0.04 -1.36 0.00 0.00 0.00 173.10 171.77 1sb1 s PHE 227 N -1.28 3.00 0.03 1.90 0.40 0.11 -1.21 117.98 120.93 1sb1 s PHE 227 Ca 0.31 0.06 0.05 0.00 -0.60 0.00 0.00 56.93 56.74 1sb1 s PHE 227 Cb -0.15 -1.70 -0.02 0.00 0.51 0.00 0.00 43.02 41.65 1sb1 s PHE 227 CO 0.17 0.39 -0.14 0.71 0.70 0.00 0.00 175.22 177.05 1sb1 s TYR 228 N -0.90 1.19 0.17 0.36 1.51 0.38 -1.61 117.35 118.45 1sb1 s TYR 228 Ca 0.15 -0.33 -0.31 0.00 -1.01 0.00 0.00 57.07 55.57 1sb1 s TYR 228 Cb -0.11 -0.72 -0.09 0.00 -0.11 0.00 0.00 41.96 40.93 1sb1 s TYR 228 CO 0.04 0.02 1.37 0.99 -1.11 0.00 0.00 175.55 176.86 1sb1 s THR 229 N -0.75 3.14 -0.83 -0.71 2.01 0.23 -1.81 115.64 116.93 1sb1 s THR 229 Ca 0.02 0.89 -0.25 0.00 0.31 0.00 0.00 61.69 62.66 1sb1 s THR 229 Cb -0.07 -3.57 0.04 0.00 0.01 0.00 0.00 72.50 68.91 1sb1 s THR 229 CO 0.01 0.11 1.30 -2.28 -0.69 0.00 0.00 174.62 173.07 1sb1 s HIS 230 N 0.48 2.43 0.17 4.92 2.46 0.27 -2.18 115.29 123.84 1sb1 s HIS 230 Ca 0.60 -0.40 -0.15 0.00 0.47 0.00 0.00 55.06 55.59 1sb1 s HIS 230 Cb -0.38 -4.61 0.12 0.00 -0.13 0.00 0.00 32.58 27.58 1sb1 s HIS 230 CO 0.36 -1.97 1.74 0.28 -2.47 0.00 0.00 174.74 172.68 1sb1 h VAL 231 N 6.26 0.85 -0.85 0.89 2.07 -1.71 -2.82 116.25 120.93 1sb1 h VAL 231 Ca -0.11 -0.10 0.05 0.00 0.82 0.00 0.00 66.70 67.36 1sb1 h VAL 231 Cb 1.04 0.53 -0.06 0.00 -1.52 0.00 0.00 31.29 31.28 1sb1 h VAL 231 CO 1.31 0.05 0.54 0.15 0.02 0.00 0.00 177.57 179.64 1sb1 h PHE 232 N 0.29 1.00 -0.07 1.57 3.57 -1.87 -1.34 116.94 120.10 1sb1 h PHE 232 Ca 0.20 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.75 1sb1 h PHE 232 Cb 0.20 -0.33 -0.00 0.00 2.79 0.00 0.00 35.95 38.61 1sb1 h PHE 232 CO -0.16 0.54 0.09 0.00 -2.23 0.00 0.00 178.31 176.55 1sb1 h ARG 233 N 1.01 0.00 -0.27 1.11 2.47 -1.87 -1.66 114.38 115.18 1sb1 h ARG 233 Ca 0.36 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.08 1sb1 h ARG 233 Cb 0.10 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.42 1sb1 h ARG 233 CO -0.15 0.00 0.00 1.28 0.56 0.00 0.00 179.97 181.66 1sb1 n LEU 234 N -3.68 3.09 0.16 3.04 4.77 -0.58 -4.67 117.00 119.13 1sb1 n LEU 234 Ca -0.01 -2.36 0.03 0.00 -0.03 0.00 0.00 56.01 53.64 1sb1 n LEU 234 Cb 0.18 -0.31 0.42 0.00 -2.33 0.00 0.00 43.42 41.38 1sb1 n LEU 234 CO 0.26 0.69 0.88 0.50 -1.33 0.00 0.00 177.39 178.38 1sb1 h LYS 235 N 1.64 0.14 -0.79 3.23 3.64 -0.53 -2.23 116.57 121.67 1sb1 h LYS 235 Ca 0.00 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1sb1 h LYS 235 Cb 0.94 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.70 1sb1 h LYS 235 CO 0.07 0.32 0.43 0.87 -2.27 0.00 0.00 179.45 178.87 1sb1 h LYS 236 N 0.14 1.09 -0.32 1.90 1.57 -1.83 0.15 116.57 119.26 1sb1 h LYS 236 Ca 0.03 -0.12 -0.06 0.00 -1.87 0.00 0.00 60.65 58.62 1sb1 h LYS 236 Cb 0.39 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1sb1 h LYS 236 CO 0.03 0.79 -0.05 2.35 -0.57 0.00 0.00 179.45 182.00 1sb1 h TRP 237 N 1.09 0.67 -0.02 -1.35 7.01 -1.77 -1.66 115.95 119.93 1sb1 h TRP 237 Ca 0.28 -0.14 0.02 0.00 2.11 0.00 0.00 58.89 61.16 1sb1 h TRP 237 Cb 0.02 -0.17 -0.03 0.00 -2.10 0.00 0.00 29.16 26.88 1sb1 h TRP 237 CO 0.01 0.76 -0.11 0.82 -2.79 0.00 0.00 178.44 177.13 1sb1 h ILE 238 N 0.39 0.72 -0.95 2.65 2.04 -0.88 -1.85 117.51 119.62 1sb1 h ILE 238 Ca 0.08 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.95 1sb1 h ILE 238 Cb 0.53 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 37.28 1sb1 h ILE 238 CO 0.03 0.00 0.61 1.56 0.00 0.00 0.00 178.15 180.34 1sb1 h GLN 239 N -0.18 1.26 0.20 2.37 1.08 -0.68 -2.11 115.11 117.05 1sb1 h GLN 239 Ca 0.05 -0.09 -0.00 0.00 -1.45 0.00 0.00 58.65 57.15 1sb1 h GLN 239 Cb 0.24 -0.28 -0.01 0.00 -0.05 0.00 0.00 27.48 27.39 1sb1 h GLN 239 CO -0.12 0.86 -0.14 -0.22 -0.95 0.00 0.00 178.83 178.26 1sb1 h LYS 240 N 1.29 -0.32 -0.48 1.46 3.64 -0.99 0.17 116.57 121.36 1sb1 h LYS 240 Ca 0.34 0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.78 1sb1 h LYS 240 Cb -0.11 0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.74 1sb1 h LYS 240 CO -0.07 -0.21 0.26 0.28 -2.27 0.00 0.00 179.45 177.43 1sb1 h VAL 241 N -0.33 1.00 -0.42 2.00 2.07 -1.12 -0.11 116.25 119.34 1sb1 h VAL 241 Ca -0.01 -0.17 -0.13 0.00 0.82 0.00 0.00 66.70 67.20 1sb1 h VAL 241 Cb 0.29 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1sb1 h VAL 241 CO 0.01 0.09 -0.26 0.40 0.02 0.00 0.00 177.57 177.83 1sb1 h ILE 242 N 0.51 1.27 -0.58 4.57 2.04 -1.24 0.63 117.51 124.71 1sb1 h ILE 242 Ca 0.20 -1.42 -0.04 0.00 1.00 0.00 0.00 64.86 64.60 1sb1 h ILE 242 Cb 0.08 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 1sb1 h ILE 242 CO -0.12 0.48 0.21 0.44 0.00 0.00 0.00 178.15 179.16 1sb1 h ASP 243 N 0.76 0.83 -0.03 1.72 3.32 -0.34 0.81 116.42 123.48 1sb1 h ASP 243 Ca 0.09 -0.19 -0.13 0.00 0.02 0.00 0.00 57.03 56.81 1sb1 h ASP 243 Cb 0.84 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 40.18 1sb1 h ASP 243 CO 0.07 0.79 -0.50 -0.61 -1.72 0.00 0.00 179.24 177.28 1sb1 h GLN 244 N 0.81 0.40 -0.00 3.56 4.15 -0.98 -3.37 115.11 119.68 1sb1 h GLN 244 Ca 0.19 -0.39 0.00 0.00 0.77 0.00 0.00 58.65 59.23 1sb1 h GLN 244 Cb 0.24 0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.03 1sb1 h GLN 244 CO -0.01 1.04 -0.64 1.19 -1.93 0.00 0.00 178.83 178.48 1sb1 n PHE 245 N -4.28 0.00 1.46 3.99 3.72 0.21 -5.09 117.46 117.47 1sb1 n PHE 245 Ca -0.09 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.44 1sb1 n PHE 245 Cb 0.61 0.00 0.49 0.00 -0.94 0.00 0.00 39.48 39.65 1sb1 n PHE 245 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12