#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nu7 s VAL 17 N 0.00 5.30 -1.23 1.39 1.01 0.68 -4.34 120.40 123.21 1nu7 s VAL 17 Ca 0.00 0.53 -0.00 0.00 0.00 0.00 0.00 61.98 62.51 1nu7 s VAL 17 Cb 0.00 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.78 1nu7 s VAL 17 CO 0.00 0.45 0.04 -0.62 0.00 0.00 0.00 175.10 174.97 1nu7 n GLU 18 N 3.09 -1.35 -0.76 2.72 -0.58 -1.26 -2.27 120.64 120.23 1nu7 n GLU 18 Ca -0.13 0.70 0.00 0.00 -0.42 0.00 0.00 57.16 57.30 1nu7 n GLU 18 Cb 0.52 -5.00 0.00 0.00 -0.57 0.00 0.00 31.44 26.39 1nu7 n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1nu7 n GLY 19 N -1.04 2.77 3.19 0.62 0.00 -1.26 -4.80 105.19 104.67 1nu7 n GLY 19 Ca -0.16 -2.11 -0.11 0.00 0.00 0.00 0.00 46.02 43.64 1nu7 n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nu7 s SER 20 N -0.82 0.19 0.30 1.61 1.04 -0.59 -4.90 113.70 110.53 1nu7 s SER 20 Ca 0.00 -1.33 -0.30 0.00 0.48 0.00 0.00 55.95 54.80 1nu7 s SER 20 Cb 0.00 0.36 -0.11 0.00 0.10 0.00 0.00 66.02 66.37 1nu7 s SER 20 CO 0.00 -0.81 1.59 -1.81 0.98 0.00 0.00 173.24 173.18 1nu7 s ASP 21 N -3.13 6.36 0.63 7.02 1.11 -1.26 -1.17 116.67 126.24 1nu7 s ASP 21 Ca 0.35 2.97 -0.14 0.00 0.18 0.00 0.00 52.55 55.91 1nu7 s ASP 21 Cb 0.07 -2.64 -0.02 0.00 1.07 0.00 0.00 42.92 41.40 1nu7 s ASP 21 CO 0.09 -0.92 1.07 0.00 1.18 0.00 0.00 175.17 176.59 1nu7 s ALA 22 N -0.14 2.65 0.43 5.23 0.00 0.18 -4.82 121.76 125.29 1nu7 s ALA 22 Ca 0.62 0.36 -0.18 0.00 0.00 0.00 0.00 51.96 52.76 1nu7 s ALA 22 Cb -0.48 -3.24 -0.10 0.00 0.00 0.00 0.00 23.12 19.30 1nu7 s ALA 22 CO 0.50 -1.03 0.91 -1.21 0.00 0.00 0.00 175.76 174.93 1nu7 s GLU 23 N -4.29 4.11 0.16 0.00 2.02 -1.26 -4.92 118.70 114.51 1nu7 s GLU 23 Ca 0.63 0.97 -0.31 0.00 0.02 0.00 0.00 54.97 56.28 1nu7 s GLU 23 Cb -0.17 -2.23 -0.11 0.00 0.10 0.00 0.00 34.13 31.73 1nu7 s GLU 23 CO 0.42 -0.05 1.77 0.42 0.02 0.00 0.00 175.26 177.85 1nu7 s ILE 24 N -2.24 2.35 0.00 -1.63 1.01 -1.26 -1.98 121.20 117.45 1nu7 s ILE 24 Ca 0.59 0.07 0.00 0.00 0.00 0.00 0.00 60.65 61.31 1nu7 s ILE 24 Cb -0.09 -3.04 0.00 0.00 0.01 0.00 0.00 42.46 39.33 1nu7 s ILE 24 CO 0.18 0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.74 1nu7 n GLY 25 N 4.11 0.61 0.24 6.18 0.00 -1.26 -4.93 105.19 110.13 1nu7 n GLY 25 Ca 0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.33 1nu7 n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nu7 h MET 26 N 1.50 0.00 -2.08 1.61 -0.00 -1.78 -3.31 114.93 110.86 1nu7 h MET 26 Ca 0.00 0.00 -0.54 0.00 -0.00 0.00 0.00 59.70 59.16 1nu7 h MET 26 Cb 0.00 0.00 -0.40 0.00 -0.00 0.00 0.00 31.60 31.20 1nu7 h MET 26 CO 0.00 0.00 -0.98 0.45 -0.00 0.00 0.00 176.91 176.38 1nu7 n SER 27 N -3.01 1.68 0.02 -0.10 2.88 -1.26 -4.94 113.62 108.88 1nu7 n SER 27 Ca 0.03 -3.08 0.01 0.00 -1.33 0.00 0.00 58.87 54.49 1nu7 n SER 27 Cb 0.41 -0.63 0.06 0.00 -0.75 0.00 0.00 64.21 63.31 1nu7 n SER 27 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1nu7 n PRO 28 N 0.67 0.02 -0.13 -1.46 -0.04 -1.25 -0.53 135.00 132.27 1nu7 n PRO 28 Ca 0.25 0.50 0.12 0.00 -0.04 0.00 0.00 63.50 64.33 1nu7 n PRO 28 Cb 0.53 -1.57 0.23 0.00 -0.04 0.00 0.00 33.50 32.65 1nu7 n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1nu7 n TRP 29 N -1.57 0.35 -2.10 0.54 2.14 -1.01 -1.18 117.44 114.61 1nu7 n TRP 29 Ca -0.00 -0.18 -0.42 0.00 2.07 0.00 0.00 57.50 58.97 1nu7 n TRP 29 Cb 0.02 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.49 1nu7 n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1nu7 s GLN 30 N -1.65 4.29 0.01 -2.67 2.00 0.31 -0.73 119.66 121.22 1nu7 s GLN 30 Ca 0.36 2.16 0.05 0.00 -2.00 0.00 0.00 55.36 55.93 1nu7 s GLN 30 Cb 0.21 -3.21 -0.01 0.00 0.80 0.00 0.00 33.01 30.80 1nu7 s GLN 30 CO 0.31 -0.47 -0.14 0.08 -0.50 0.00 0.00 175.29 174.56 1nu7 s VAL 31 N 0.99 1.14 -0.18 1.34 1.01 -0.43 -3.96 120.40 120.32 1nu7 s VAL 31 Ca 0.65 -0.75 -0.09 0.00 0.00 0.00 0.00 61.98 61.79 1nu7 s VAL 31 Cb -0.39 -0.98 -0.05 0.00 0.00 0.00 0.00 36.38 34.96 1nu7 s VAL 31 CO 0.32 0.22 0.13 -0.04 0.00 0.00 0.00 175.10 175.73 1nu7 s MET 32 N -0.62 3.96 -0.32 2.72 -1.94 0.07 -0.84 119.30 122.33 1nu7 s MET 32 Ca 0.04 -0.19 -0.14 0.00 -1.71 0.00 0.00 55.69 53.69 1nu7 s MET 32 Cb -0.06 -3.35 -0.02 0.00 2.01 0.00 0.00 34.83 33.40 1nu7 s MET 32 CO 0.00 0.44 0.33 -1.17 -0.01 0.00 0.00 175.02 174.62 1nu7 s LEU 33 N -0.06 4.30 -0.18 -0.03 2.96 -0.09 -1.28 118.68 124.30 1nu7 s LEU 33 Ca 0.10 -0.11 -0.02 0.00 -0.22 0.00 0.00 54.13 53.89 1nu7 s LEU 33 Cb -0.11 -2.31 -0.00 0.00 0.50 0.00 0.00 46.19 44.26 1nu7 s LEU 33 CO -0.00 -0.26 -0.11 0.12 -1.32 0.00 0.00 176.35 174.78 1nu7 s PHE 34 N 1.97 2.87 -0.03 5.38 5.36 -0.11 -0.97 117.98 132.45 1nu7 s PHE 34 Ca 0.11 -0.99 -0.30 0.00 -0.96 0.00 0.00 56.93 54.80 1nu7 s PHE 34 Cb -0.16 -1.98 -0.03 0.00 -0.34 0.00 0.00 43.02 40.51 1nu7 s PHE 34 CO 0.11 -0.49 1.08 0.50 -1.46 0.00 0.00 175.22 174.96 1nu7 s ARG 35 N 1.06 4.45 0.16 10.12 3.52 -0.28 -0.59 118.95 137.40 1nu7 s ARG 35 Ca -0.00 1.54 -0.14 0.00 -0.13 0.00 0.00 55.73 57.00 1nu7 s ARG 35 Cb -0.15 -3.48 0.05 0.00 -1.56 0.00 0.00 34.95 29.81 1nu7 s ARG 35 CO -0.02 -0.25 1.75 0.87 -0.81 0.00 0.00 175.30 176.83 1nu7 h LYS 36 N 7.03 0.75 -1.96 5.12 1.57 -1.35 -2.51 116.57 125.22 1nu7 h LYS 36 Ca -0.37 -0.11 0.02 0.00 -1.87 0.00 0.00 60.65 58.32 1nu7 h LYS 36 Cb 1.19 -0.14 -0.22 0.00 0.08 0.00 0.00 32.23 33.15 1nu7 h LYS 36 CO 0.82 0.62 0.06 -1.54 -0.57 0.00 0.00 179.45 178.84 1nu7 s SER 36 N -5.91 -0.89 0.36 0.86 1.04 -1.26 -3.04 113.70 104.86 1nu7 s SER 36 Ca -0.13 1.45 -0.28 0.00 0.48 0.00 0.00 55.95 57.47 1nu7 s SER 36 Cb 0.12 1.38 -0.10 0.00 0.10 0.00 0.00 66.02 67.52 1nu7 s SER 36 CO 0.77 -0.23 1.34 -2.16 0.98 0.00 0.00 173.24 173.93 1nu7 s PRO 37 N 1.50 4.19 0.11 4.02 0.04 -1.26 -5.04 135.00 138.56 1nu7 s PRO 37 Ca -0.09 2.26 -0.35 0.00 0.04 0.00 0.00 61.00 62.86 1nu7 s PRO 37 Cb -0.05 -2.95 -0.17 0.00 0.04 0.00 0.00 34.50 31.37 1nu7 s PRO 37 CO -0.18 -0.35 1.14 1.04 0.04 0.00 0.00 177.00 178.70 1nu7 n GLN 38 N 0.53 0.82 -3.59 4.56 6.02 -1.17 -4.82 117.38 119.74 1nu7 n GLN 38 Ca 0.01 0.29 -0.02 0.00 -0.01 0.00 0.00 57.00 57.27 1nu7 n GLN 38 Cb 0.42 -1.79 -0.06 0.00 1.02 0.00 0.00 30.24 29.83 1nu7 n GLN 38 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1nu7 s GLU 39 N -0.11 0.49 -0.32 -1.09 2.12 -0.95 -4.98 118.70 113.86 1nu7 s GLU 39 Ca 0.79 1.00 -0.29 0.00 0.36 0.00 0.00 54.97 56.83 1nu7 s GLU 39 Cb -0.97 0.35 -0.01 0.00 0.26 0.00 0.00 34.13 33.76 1nu7 s GLU 39 CO 0.52 -0.13 1.49 -1.17 -0.54 0.00 0.00 175.26 175.44 1nu7 s LEU 40 N 2.02 3.73 -0.17 2.70 0.20 -1.26 -1.13 118.68 124.77 1nu7 s LEU 40 Ca -0.07 1.20 -0.17 0.00 0.69 0.00 0.00 54.13 55.78 1nu7 s LEU 40 Cb -0.06 -3.54 -0.22 0.00 -0.43 0.00 0.00 46.19 41.94 1nu7 s LEU 40 CO -0.18 -1.34 0.32 -0.07 -0.29 0.00 0.00 176.35 174.80 1nu7 h LEU 41 N 11.95 0.17 -7.99 -0.68 3.38 -1.43 -3.48 115.31 117.24 1nu7 h LEU 41 Ca -0.30 -0.70 0.02 0.00 0.09 0.00 0.00 57.88 56.99 1nu7 h LEU 41 Cb 1.13 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 1nu7 h LEU 41 CO 1.04 1.60 0.32 0.00 0.09 0.00 0.00 178.44 181.49 1nu7 n GLY 43 N -0.55 2.36 3.85 0.00 0.00 0.15 -0.92 105.19 110.08 1nu7 n GLY 43 Ca -0.07 -2.26 -0.02 0.00 0.00 0.00 0.00 46.02 43.67 1nu7 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nu7 n ALA 44 N -2.14 -2.78 -3.00 4.61 0.00 -0.02 -3.79 120.51 113.38 1nu7 n ALA 44 Ca -0.15 -1.00 -0.10 0.00 0.00 0.00 0.00 53.44 52.20 1nu7 n ALA 44 Cb 0.58 0.52 -0.11 0.00 0.00 0.00 0.00 19.45 20.44 1nu7 n ALA 44 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nu7 s SER 45 N -3.48 0.15 -0.36 0.00 1.04 0.74 -1.31 113.70 110.48 1nu7 s SER 45 Ca 0.24 -0.36 -0.22 0.00 0.48 0.00 0.00 55.95 56.09 1nu7 s SER 45 Cb -0.03 0.12 0.01 0.00 0.10 0.00 0.00 66.02 66.22 1nu7 s SER 45 CO 0.05 -0.28 0.73 -0.22 0.98 0.00 0.00 173.24 174.50 1nu7 s LEU 46 N -1.25 4.18 0.00 2.42 0.20 0.09 0.10 118.68 124.43 1nu7 s LEU 46 Ca -0.14 0.26 0.14 0.00 0.69 0.00 0.00 54.13 55.08 1nu7 s LEU 46 Cb -0.08 -2.93 0.14 0.00 -0.43 0.00 0.00 46.19 42.89 1nu7 s LEU 46 CO -0.00 -0.69 0.99 2.30 -0.29 0.00 0.00 176.35 178.66 1nu7 n ILE 47 N 5.72 0.13 -3.95 6.68 -5.35 -0.97 -1.66 119.36 119.96 1nu7 n ILE 47 Ca 0.01 -0.56 0.04 0.00 -0.27 0.00 0.00 62.75 61.97 1nu7 n ILE 47 Cb 0.48 1.19 0.01 0.00 -1.74 0.00 0.00 39.64 39.58 1nu7 n ILE 47 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1nu7 s SER 48 N -1.13 -0.00 0.00 7.28 1.04 -1.23 -4.77 113.70 114.89 1nu7 s SER 48 Ca 0.18 -0.08 0.19 0.00 0.48 0.00 0.00 55.95 56.72 1nu7 s SER 48 Cb 0.12 0.06 0.92 0.00 0.10 0.00 0.00 66.02 67.22 1nu7 s SER 48 CO 0.18 -0.12 1.57 -0.90 0.98 0.00 0.00 173.24 174.95 1nu7 n ASP 49 N -0.94 0.00 0.00 7.02 5.68 -1.26 -3.52 116.55 123.53 1nu7 n ASP 49 Ca 0.03 0.09 0.00 0.00 -0.50 0.00 0.00 54.79 54.41 1nu7 n ASP 49 Cb 0.59 -0.31 0.00 0.00 -1.14 0.00 0.00 41.12 40.26 1nu7 n ASP 49 CO 0.00 0.00 0.00 -1.14 -1.33 0.00 0.00 177.20 174.73 1nu7 n ARG 50 N -1.31 3.65 -5.02 0.11 3.00 -1.26 -0.34 116.66 115.49 1nu7 n ARG 50 Ca 0.08 -0.01 -0.28 0.00 -0.00 0.00 0.00 57.85 57.64 1nu7 n ARG 50 Cb 0.16 -0.30 -0.15 0.00 0.00 0.00 0.00 32.46 32.17 1nu7 n ARG 50 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 1nu7 s TRP 51 N -0.53 2.04 -0.04 -0.14 0.52 -1.23 -0.76 118.94 118.80 1nu7 s TRP 51 Ca 0.00 -0.39 0.03 0.00 0.02 0.00 0.00 56.10 55.77 1nu7 s TRP 51 Cb 0.00 -1.28 0.00 0.00 -1.15 0.00 0.00 33.47 31.04 1nu7 s TRP 51 CO 0.00 0.01 -0.14 0.08 0.02 0.00 0.00 176.95 176.92 1nu7 s VAL 52 N -0.61 1.20 -0.11 4.03 1.01 -0.02 -2.28 120.40 123.62 1nu7 s VAL 52 Ca 0.09 -0.57 -0.05 0.00 0.00 0.00 0.00 61.98 61.44 1nu7 s VAL 52 Cb -0.09 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 1nu7 s VAL 52 CO -0.00 0.36 0.08 -0.22 0.00 0.00 0.00 175.10 175.32 1nu7 s LEU 53 N 0.23 4.06 0.00 3.92 2.96 0.12 -0.35 118.68 129.61 1nu7 s LEU 53 Ca -0.06 0.32 -0.02 0.00 -0.22 0.00 0.00 54.13 54.15 1nu7 s LEU 53 Cb -0.12 -1.97 0.01 0.00 0.50 0.00 0.00 46.19 44.61 1nu7 s LEU 53 CO 0.02 0.38 0.22 1.07 -1.32 0.00 0.00 176.35 176.72 1nu7 n THR 54 N 2.16 0.00 -3.51 3.68 5.66 -0.22 -0.18 114.28 121.86 1nu7 n THR 54 Ca -0.19 -0.67 -0.35 0.00 -3.05 0.00 0.00 64.05 59.79 1nu7 n THR 54 Cb 0.54 0.44 -0.06 0.00 -1.55 0.00 0.00 70.33 69.70 1nu7 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nu7 s ALA 55 N -1.96 3.68 0.18 1.79 0.00 -1.26 -1.03 121.76 123.16 1nu7 s ALA 55 Ca 0.11 -0.30 -0.10 0.00 0.00 0.00 0.00 51.96 51.66 1nu7 s ALA 55 Cb -0.01 -2.35 0.09 0.00 0.00 0.00 0.00 23.12 20.85 1nu7 s ALA 55 CO 0.08 0.53 1.70 0.00 0.00 0.00 0.00 175.76 178.07 1nu7 h ALA 56 N 3.65 0.84 0.00 0.00 0.00 -1.68 -2.97 119.26 119.10 1nu7 h ALA 56 Ca -0.49 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.19 1nu7 h ALA 56 Cb 1.19 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1nu7 h ALA 56 CO 0.66 0.55 0.00 -2.39 0.00 0.00 0.00 179.25 178.07 1nu7 n HIS 57 N -4.32 0.76 0.23 0.00 1.44 -1.26 -0.48 115.22 111.59 1nu7 n HIS 57 Ca 0.04 0.38 0.12 0.00 -2.01 0.00 0.00 57.72 56.25 1nu7 n HIS 57 Cb 0.24 -1.11 0.37 0.00 0.12 0.00 0.00 29.99 29.62 1nu7 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1nu7 n LEU 59 N -3.18 1.90 -3.77 0.00 4.77 0.14 -4.87 117.00 111.99 1nu7 n LEU 59 Ca 0.02 -0.05 -0.26 0.00 -0.03 0.00 0.00 56.01 55.69 1nu7 n LEU 59 Cb 0.47 -0.22 -0.17 0.00 -2.33 0.00 0.00 43.42 41.17 1nu7 n LEU 59 CO 0.33 0.57 -0.38 -0.22 -1.33 0.00 0.00 177.39 176.36 1nu7 s LEU 60 N -5.48 1.05 0.20 2.23 2.96 0.37 -0.96 118.68 119.05 1nu7 s LEU 60 Ca -0.14 -0.55 -0.19 0.00 -0.22 0.00 0.00 54.13 53.03 1nu7 s LEU 60 Cb 0.04 -0.60 0.03 0.00 0.50 0.00 0.00 46.19 46.17 1nu7 s LEU 60 CO 0.38 -0.25 0.56 -0.47 -1.32 0.00 0.00 176.35 175.25 1nu7 s TYR 60 N 1.86 -0.19 0.00 5.38 5.04 0.25 -3.98 117.35 125.71 1nu7 s TYR 60 Ca 0.01 -0.15 0.00 0.00 -2.44 0.00 0.00 57.07 54.49 1nu7 s TYR 60 Cb -0.15 0.46 0.00 0.00 0.35 0.00 0.00 41.96 42.62 1nu7 s TYR 60 CO -0.07 -0.95 0.00 -2.30 -1.34 0.00 0.00 175.55 170.89 1nu7 n PRO 60 N -0.36 0.00 -0.56 4.97 -0.02 -1.26 -2.02 135.00 135.75 1nu7 n PRO 60 Ca -0.10 0.00 0.03 0.00 -2.02 0.00 0.00 63.50 61.41 1nu7 n PRO 60 Cb 0.62 0.00 0.21 0.00 -0.02 0.00 0.00 33.50 34.31 1nu7 n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1nu7 n TRP 60 N 0.00 0.71 -3.98 6.00 8.01 -1.26 -4.95 117.44 121.97 1nu7 n TRP 60 Ca 0.00 -1.30 -0.29 0.00 -1.31 0.00 0.00 57.50 54.61 1nu7 n TRP 60 Cb 0.00 -0.35 -0.01 0.00 -2.01 0.00 0.00 31.31 28.94 1nu7 n TRP 60 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 1nu7 n ASP 60 N -1.02 -2.08 -4.34 -0.99 4.64 -1.20 -4.95 116.55 106.61 1nu7 n ASP 60 Ca 0.25 -0.94 -0.33 0.00 -1.38 0.00 0.00 54.79 52.39 1nu7 n ASP 60 Cb 0.88 -3.29 -0.14 0.00 -1.04 0.00 0.00 41.12 37.53 1nu7 n ASP 60 CO 0.00 0.00 0.00 -0.75 -0.82 0.00 0.00 177.20 175.63 1nu7 s LYS 60 N -6.58 3.35 -0.44 -0.67 2.20 -0.86 -5.01 119.74 111.73 1nu7 s LYS 60 Ca 0.32 -0.69 0.02 0.00 -0.36 0.00 0.00 55.97 55.26 1nu7 s LYS 60 Cb -0.17 -2.67 0.22 0.00 -1.51 0.00 0.00 37.83 33.70 1nu7 s LYS 60 CO 0.88 0.12 0.94 -1.71 -0.36 0.00 0.00 175.35 175.22 1nu7 n ASN 60 N 3.78 -2.52 -4.80 1.43 2.85 -1.20 -0.58 115.26 114.22 1nu7 n ASN 60 Ca -0.18 -2.38 -0.34 0.00 -0.11 0.00 0.00 54.58 51.57 1nu7 n ASN 60 Cb 0.52 1.38 -0.05 0.00 1.24 0.00 0.00 39.78 42.87 1nu7 n ASN 60 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 1nu7 s PHE 60 N 0.74 3.18 0.49 1.20 0.08 -0.13 -5.01 117.98 118.52 1nu7 s PHE 60 Ca 0.28 1.61 0.06 0.00 0.12 0.00 0.00 56.93 59.00 1nu7 s PHE 60 Cb 0.12 -3.00 0.00 0.00 -0.57 0.00 0.00 43.02 39.57 1nu7 s PHE 60 CO -0.12 -0.52 0.33 0.95 -0.10 0.00 0.00 175.22 175.76 1nu7 s THR 60 N -1.97 1.99 0.27 0.64 -4.23 -1.26 -4.92 115.64 106.16 1nu7 s THR 60 Ca 0.63 -1.53 -0.01 0.00 -1.18 0.00 0.00 61.69 59.60 1nu7 s THR 60 Cb -0.15 -2.52 0.25 0.00 1.34 0.00 0.00 72.50 71.43 1nu7 s THR 60 CO 0.19 0.00 1.81 -0.33 -0.54 0.00 0.00 174.62 175.75 1nu7 h GLU 61 N 0.99 0.83 0.00 3.99 3.07 -1.93 -1.72 114.58 119.81 1nu7 h GLU 61 Ca -0.39 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.42 1nu7 h GLU 61 Cb 1.28 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 29.01 1nu7 h GLU 61 CO 0.61 0.55 0.00 0.09 -1.40 0.00 0.00 179.01 178.86 1nu7 n ASN 62 N -4.71 0.20 0.19 1.42 3.02 -1.26 -2.47 115.26 111.65 1nu7 n ASN 62 Ca 0.17 0.54 0.09 0.00 -0.03 0.00 0.00 54.58 55.35 1nu7 n ASN 62 Cb 0.35 -0.59 0.11 0.00 -0.61 0.00 0.00 39.78 39.05 1nu7 n ASN 62 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1nu7 h ASP 63 N 0.00 0.00 -2.12 6.41 3.45 -1.70 -3.47 116.42 118.99 1nu7 h ASP 63 Ca 0.00 0.00 -0.59 0.00 0.43 0.00 0.00 57.03 56.87 1nu7 h ASP 63 Cb 0.37 0.00 -0.14 0.00 -0.56 0.00 0.00 39.33 39.01 1nu7 h ASP 63 CO 0.00 0.17 -0.66 -0.76 -1.57 0.00 0.00 179.24 176.41 1nu7 s LEU 64 N -6.24 2.69 0.18 1.55 1.43 -1.03 -0.91 118.68 116.35 1nu7 s LEU 64 Ca 0.06 -1.24 0.01 0.00 -1.03 0.00 0.00 54.13 51.93 1nu7 s LEU 64 Cb 0.06 -0.89 -0.05 0.00 0.03 0.00 0.00 46.19 45.34 1nu7 s LEU 64 CO 0.70 -0.29 0.03 -0.76 0.23 0.00 0.00 176.35 176.26 1nu7 s LEU 65 N -3.59 1.96 -0.03 1.79 1.02 0.25 -4.53 118.68 115.55 1nu7 s LEU 65 Ca 0.33 -1.21 0.03 0.00 0.02 0.00 0.00 54.13 53.29 1nu7 s LEU 65 Cb 0.04 0.03 0.00 0.00 0.02 0.00 0.00 46.19 46.29 1nu7 s LEU 65 CO 0.16 -0.63 -0.11 -0.69 0.02 0.00 0.00 176.35 175.10 1nu7 s VAL 66 N -3.76 0.93 -0.13 -1.59 1.01 -1.00 -0.94 120.40 114.92 1nu7 s VAL 66 Ca 0.26 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 61.81 1nu7 s VAL 66 Cb 0.07 -0.81 0.01 0.00 0.00 0.00 0.00 36.38 35.64 1nu7 s VAL 66 CO 0.05 0.28 -0.19 -0.13 0.00 0.00 0.00 175.10 175.11 1nu7 s ARG 67 N 0.10 2.74 0.11 2.72 0.52 -0.40 -1.51 118.95 123.23 1nu7 s ARG 67 Ca -0.02 -0.75 0.09 0.00 -0.52 0.00 0.00 55.73 54.53 1nu7 s ARG 67 Cb -0.09 -2.26 -0.04 0.00 0.52 0.00 0.00 34.95 33.09 1nu7 s ARG 67 CO 0.01 -0.05 -0.23 0.42 0.02 0.00 0.00 175.30 175.47 1nu7 s ILE 68 N 0.93 1.88 0.00 1.52 1.01 0.48 -0.75 121.20 126.27 1nu7 s ILE 68 Ca -0.06 -1.61 0.00 0.00 0.00 0.00 0.00 60.65 58.99 1nu7 s ILE 68 Cb -0.15 -1.69 0.00 0.00 0.01 0.00 0.00 42.46 40.62 1nu7 s ILE 68 CO -0.03 -0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.51 1nu7 n GLY 69 N 1.04 0.60 3.82 6.18 0.00 -1.25 -0.63 105.19 114.95 1nu7 n GLY 69 Ca -0.19 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 1nu7 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nu7 s LYS 70 N -0.22 4.21 0.02 1.61 1.02 -1.26 -4.42 119.74 120.70 1nu7 s LYS 70 Ca 0.00 0.95 -0.02 0.00 0.02 0.00 0.00 55.97 56.92 1nu7 s LYS 70 Cb 0.00 -2.49 -0.01 0.00 -0.52 0.00 0.00 37.83 34.81 1nu7 s LYS 70 CO 0.00 0.16 -0.04 1.58 -0.92 0.00 0.00 175.35 176.13 1nu7 n HIS 71 N -0.10 0.00 -3.57 3.18 -0.00 -1.26 -4.92 115.22 108.54 1nu7 n HIS 71 Ca 0.03 0.00 -0.37 0.00 -0.00 0.00 0.00 57.72 57.38 1nu7 n HIS 71 Cb 0.53 -0.06 -0.06 0.00 -0.00 0.00 0.00 29.99 30.39 1nu7 n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1nu7 s SER 72 N -5.46 6.57 0.27 0.26 0.15 -1.26 -1.89 113.70 112.33 1nu7 s SER 72 Ca -0.03 0.67 0.25 0.00 0.70 0.00 0.00 55.95 57.53 1nu7 s SER 72 Cb 0.00 -2.19 0.57 0.00 -1.71 0.00 0.00 66.02 62.69 1nu7 s SER 72 CO 0.05 0.23 1.63 -0.09 1.20 0.00 0.00 173.24 176.25 1nu7 h ARG 73 N 5.71 0.00 0.00 5.44 2.43 -0.64 -3.37 114.38 123.96 1nu7 h ARG 73 Ca -0.47 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 1nu7 h ARG 73 Cb 1.20 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 1nu7 h ARG 73 CO 0.68 0.00 -0.08 1.79 -1.51 0.00 0.00 179.97 180.84 1nu7 h THR 74 N 0.00 0.00 -4.11 0.20 1.35 -1.91 -3.46 112.91 104.98 1nu7 h THR 74 Ca 0.00 -0.51 -0.18 0.00 -0.55 0.00 0.00 66.41 65.17 1nu7 h THR 74 Cb 0.83 1.46 -0.15 0.00 -1.73 0.00 0.00 68.15 68.56 1nu7 h THR 74 CO 0.00 0.00 -0.68 -0.13 -0.25 0.00 0.00 175.52 174.46 1nu7 s ARG 75 N -3.12 0.79 0.21 4.72 1.81 -1.26 -5.12 118.95 116.99 1nu7 s ARG 75 Ca 0.10 -1.33 -0.30 0.00 -1.72 0.00 0.00 55.73 52.48 1nu7 s ARG 75 Cb 0.12 0.05 -0.08 0.00 -0.45 0.00 0.00 34.95 34.58 1nu7 s ARG 75 CO 0.62 -0.12 1.14 -0.47 -0.68 0.00 0.00 175.30 175.80 1nu7 s TYR 76 N -3.83 3.51 -0.80 -0.53 5.04 -1.26 -4.90 117.35 114.57 1nu7 s TYR 76 Ca 0.14 1.55 -0.02 0.00 -2.44 0.00 0.00 57.07 56.30 1nu7 s TYR 76 Cb 0.07 -3.35 0.20 0.00 0.35 0.00 0.00 41.96 39.23 1nu7 s TYR 76 CO -0.05 -0.86 0.65 -1.21 -1.34 0.00 0.00 175.55 172.75 1nu7 s GLU 77 N -0.66 3.00 0.06 4.97 2.02 -1.26 -4.97 118.70 121.85 1nu7 s GLU 77 Ca 0.49 -3.06 -0.11 0.00 0.02 0.00 0.00 54.97 52.31 1nu7 s GLU 77 Cb -0.32 -3.85 -0.02 0.00 0.10 0.00 0.00 34.13 30.04 1nu7 s GLU 77 CO 0.38 -1.24 0.62 -2.13 0.02 0.00 0.00 175.26 172.91 1nu7 n ARG 77 N 2.65 -0.15 0.00 1.61 0.63 -1.26 0.20 116.66 120.34 1nu7 n ARG 77 Ca 0.17 0.61 0.12 0.00 -0.92 0.00 0.00 57.85 57.83 1nu7 n ARG 77 Cb 0.37 -0.90 0.57 0.00 0.45 0.00 0.00 32.46 32.95 1nu7 n ARG 77 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1nu7 n ASN 78 N -4.12 0.00 0.00 6.15 3.02 -1.26 -4.20 115.26 114.85 1nu7 n ASN 78 Ca 0.01 0.27 0.00 0.00 -0.03 0.00 0.00 54.58 54.83 1nu7 n ASN 78 Cb 0.09 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 38.85 1nu7 n ASN 78 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 1nu7 n ILE 79 N -1.41 0.00 -2.67 2.41 -5.35 -0.72 -5.09 119.36 106.52 1nu7 n ILE 79 Ca 0.08 0.00 -0.34 0.00 -0.27 0.00 0.00 62.75 62.23 1nu7 n ILE 79 Cb 0.25 0.08 -0.05 0.00 -1.74 0.00 0.00 39.64 38.18 1nu7 n ILE 79 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1nu7 s GLU 80 N -0.58 4.00 -0.04 6.28 2.12 0.13 -4.53 118.70 126.09 1nu7 s GLU 80 Ca 0.00 1.25 -0.01 0.00 0.36 0.00 0.00 54.97 56.57 1nu7 s GLU 80 Cb 0.00 -2.14 0.03 0.00 0.26 0.00 0.00 34.13 32.28 1nu7 s GLU 80 CO 0.00 -0.24 0.04 0.21 -0.54 0.00 0.00 175.26 174.73 1nu7 s LYS 81 N -3.20 0.02 -0.16 4.30 2.36 0.20 -4.89 119.74 118.36 1nu7 s LYS 81 Ca 0.65 0.28 -0.07 0.00 -2.55 0.00 0.00 55.97 54.28 1nu7 s LYS 81 Cb -0.13 -0.48 -0.04 0.00 -1.05 0.00 0.00 37.83 36.13 1nu7 s LYS 81 CO 0.17 -0.27 0.07 0.42 1.55 0.00 0.00 175.35 177.29 1nu7 s ILE 82 N 1.78 4.92 -0.03 5.43 -1.09 -1.26 -0.39 121.20 130.56 1nu7 s ILE 82 Ca 0.00 0.00 0.02 0.00 -2.23 0.00 0.00 60.65 58.45 1nu7 s ILE 82 Cb -0.12 -3.19 0.00 0.00 -1.58 0.00 0.00 42.46 37.57 1nu7 s ILE 82 CO -0.03 0.50 -0.09 -0.44 -1.23 0.00 0.00 174.94 173.66 1nu7 s SER 83 N -0.04 1.17 0.55 3.58 0.01 -0.57 -4.97 113.70 113.43 1nu7 s SER 83 Ca 0.07 -0.18 -0.16 0.00 1.31 0.00 0.00 55.95 56.99 1nu7 s SER 83 Cb -0.12 -0.32 -0.06 0.00 0.21 0.00 0.00 66.02 65.73 1nu7 s SER 83 CO 0.01 0.06 1.01 -0.04 0.41 0.00 0.00 173.24 174.68 1nu7 s MET 84 N 0.22 3.75 -0.13 12.44 -1.94 -1.26 -2.38 119.30 130.00 1nu7 s MET 84 Ca -0.03 0.99 -0.10 0.00 -1.71 0.00 0.00 55.69 54.84 1nu7 s MET 84 Cb -0.09 -2.10 -0.05 0.00 2.01 0.00 0.00 34.83 34.61 1nu7 s MET 84 CO 0.00 -0.44 0.20 -0.51 -0.01 0.00 0.00 175.02 174.26 1nu7 s LEU 85 N -4.31 4.35 -0.09 -0.03 2.01 -1.26 -2.26 118.68 117.09 1nu7 s LEU 85 Ca 0.60 0.49 -0.10 0.00 0.01 0.00 0.00 54.13 55.13 1nu7 s LEU 85 Cb -0.11 -2.19 -0.28 0.00 0.01 0.00 0.00 46.19 43.62 1nu7 s LEU 85 CO 0.35 0.31 0.51 -0.08 1.01 0.00 0.00 176.35 178.45 1nu7 h GLU 86 N 5.52 0.31 -2.08 1.70 4.81 -0.41 -3.44 114.58 120.99 1nu7 h GLU 86 Ca -0.50 -0.53 -0.05 0.00 -0.13 0.00 0.00 59.36 58.15 1nu7 h GLU 86 Cb 1.20 0.20 -0.21 0.00 0.63 0.00 0.00 28.75 30.57 1nu7 h GLU 86 CO 0.65 1.26 0.10 0.21 -0.73 0.00 0.00 179.01 180.49 1nu7 s LYS 87 N -2.55 0.83 -0.18 1.92 2.36 -1.14 -4.98 119.74 116.01 1nu7 s LYS 87 Ca -0.20 0.85 -0.08 0.00 -2.55 0.00 0.00 55.97 53.99 1nu7 s LYS 87 Cb 0.06 0.40 -0.04 0.00 -1.05 0.00 0.00 37.83 37.20 1nu7 s LYS 87 CO 0.80 -0.13 0.09 0.42 1.55 0.00 0.00 175.35 178.08 1nu7 s ILE 88 N 0.14 5.05 -0.29 5.43 -1.09 -1.26 -0.91 121.20 128.27 1nu7 s ILE 88 Ca -0.02 0.05 0.01 0.00 -2.23 0.00 0.00 60.65 58.47 1nu7 s ILE 88 Cb -0.04 -3.27 0.08 0.00 -1.58 0.00 0.00 42.46 37.65 1nu7 s ILE 88 CO 0.02 0.48 0.01 -0.31 -1.23 0.00 0.00 174.94 173.91 1nu7 s TYR 89 N 0.14 2.69 -0.03 3.97 2.02 0.49 -5.00 117.35 121.63 1nu7 s TYR 89 Ca 0.07 -2.16 -0.16 0.00 -0.37 0.00 0.00 57.07 54.45 1nu7 s TYR 89 Cb -0.12 -2.04 -0.05 0.00 -0.40 0.00 0.00 41.96 39.35 1nu7 s TYR 89 CO -0.00 -0.86 0.42 0.42 -1.57 0.00 0.00 175.55 173.97 1nu7 s ILE 90 N 1.28 5.06 0.10 2.71 1.01 -1.26 -0.70 121.20 129.41 1nu7 s ILE 90 Ca 0.03 0.86 -0.34 0.00 0.00 0.00 0.00 60.65 61.21 1nu7 s ILE 90 Cb -0.19 -3.74 -0.13 0.00 0.01 0.00 0.00 42.46 38.41 1nu7 s ILE 90 CO -0.11 0.52 1.66 1.57 0.00 0.00 0.00 174.94 178.57 1nu7 n HIS 91 N 2.28 2.30 0.32 3.97 -0.00 -1.07 -4.83 115.22 118.18 1nu7 n HIS 91 Ca -0.12 0.19 0.20 0.00 -0.00 0.00 0.00 57.72 57.99 1nu7 n HIS 91 Cb 0.52 -2.58 1.04 0.00 -0.00 0.00 0.00 29.99 28.97 1nu7 n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1nu7 h PRO 92 N 6.79 0.00 -0.44 1.57 0.13 -1.95 -2.23 132.00 135.87 1nu7 h PRO 92 Ca -0.46 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.48 1nu7 h PRO 92 Cb 1.26 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.27 1nu7 h PRO 92 CO 0.90 0.01 0.05 0.54 -0.23 0.00 0.00 178.00 179.28 1nu7 n ARG 93 N -3.18 2.23 -1.86 0.86 1.74 -1.26 -4.96 116.66 110.24 1nu7 n ARG 93 Ca -0.02 -3.09 -0.42 0.00 -0.77 0.00 0.00 57.85 53.55 1nu7 n ARG 93 Cb 0.14 -1.89 -0.03 0.00 -1.02 0.00 0.00 32.46 29.66 1nu7 n ARG 93 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1nu7 s TYR 94 N -3.15 1.64 -1.18 -1.55 5.04 -0.84 -4.73 117.35 112.58 1nu7 s TYR 94 Ca 0.46 0.10 -0.11 0.00 -2.44 0.00 0.00 57.07 55.09 1nu7 s TYR 94 Cb 0.40 -4.05 0.21 0.00 0.35 0.00 0.00 41.96 38.88 1nu7 s TYR 94 CO 0.04 -4.27 1.41 -1.71 -1.34 0.00 0.00 175.55 169.68 1nu7 n ASN 95 N 8.27 5.40 0.14 4.32 2.85 0.46 -4.82 115.26 131.88 1nu7 n ASN 95 Ca 0.20 -3.05 -0.00 0.00 -0.11 0.00 0.00 54.58 51.61 1nu7 n ASN 95 Cb 0.43 -1.48 0.19 0.00 1.24 0.00 0.00 39.78 40.17 1nu7 n ASN 95 CO 0.00 0.00 0.00 4.11 -2.11 0.00 0.00 177.26 179.26 1nu7 h TRP 96 N 6.63 0.00 0.00 1.20 5.08 -1.91 -1.32 115.95 125.63 1nu7 h TRP 96 Ca 0.28 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.25 1nu7 h TRP 96 Cb 0.81 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.97 1nu7 h TRP 96 CO 1.01 0.59 0.00 0.00 -1.28 0.00 0.00 178.44 178.76 1nu7 h ARG 97 N 0.00 0.00 0.00 0.12 3.08 -2.00 -3.41 114.38 112.17 1nu7 h ARG 97 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1nu7 h ARG 97 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.12 1nu7 h ARG 97 CO 0.08 0.00 -0.51 -1.91 -1.07 0.00 0.00 179.97 176.56 1nu7 n GLU 97 N -2.94 0.00 -0.46 0.04 2.13 -1.19 -5.01 120.64 113.21 1nu7 n GLU 97 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1nu7 n GLU 97 Cb 0.25 -0.46 0.00 0.00 0.27 0.00 0.00 31.44 31.50 1nu7 n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1nu7 n ASN 98 N -3.20 0.00 -2.54 4.31 0.23 -1.17 -4.84 115.26 108.05 1nu7 n ASN 98 Ca 0.00 -1.41 -0.18 0.00 -0.53 0.00 0.00 54.58 52.46 1nu7 n ASN 98 Cb 0.25 -0.08 -0.00 0.00 -2.08 0.00 0.00 39.78 37.87 1nu7 n ASN 98 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1nu7 n LEU 99 N 0.00 -1.76 -4.72 -4.53 4.77 -0.51 -4.91 117.00 105.34 1nu7 n LEU 99 Ca 0.00 -0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 1nu7 n LEU 99 Cb 0.58 -2.65 -0.03 0.00 -2.33 0.00 0.00 43.42 38.99 1nu7 n LEU 99 CO 0.00 -0.11 1.25 -0.62 -1.33 0.00 0.00 177.39 176.57 1nu7 s ASP 100 N -2.16 6.55 -0.79 -1.43 2.15 -1.23 -2.25 116.67 117.50 1nu7 s ASP 100 Ca 0.06 2.68 -0.01 0.00 0.43 0.00 0.00 52.55 55.70 1nu7 s ASP 100 Cb -0.03 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 40.00 1nu7 s ASP 100 CO 0.07 -0.85 0.67 0.54 -0.17 0.00 0.00 175.17 175.43 1nu7 n ARG 101 N 3.79 -4.44 -2.55 4.34 1.74 -1.26 -0.40 116.66 117.87 1nu7 n ARG 101 Ca 0.13 0.54 -0.42 0.00 -0.77 0.00 0.00 57.85 57.34 1nu7 n ARG 101 Cb 0.38 -4.66 -0.01 0.00 -1.02 0.00 0.00 32.46 27.15 1nu7 n ARG 101 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1nu7 s ASP 102 N -3.72 6.71 -0.05 0.55 2.15 -0.95 -4.42 116.67 116.93 1nu7 s ASP 102 Ca 0.09 -2.27 -0.15 0.00 0.43 0.00 0.00 52.55 50.64 1nu7 s ASP 102 Cb -0.04 -2.58 0.03 0.00 -0.30 0.00 0.00 42.92 40.03 1nu7 s ASP 102 CO 0.47 -1.30 0.35 -0.51 -0.17 0.00 0.00 175.17 174.00 1nu7 s ILE 103 N 4.65 0.04 0.06 4.11 2.07 -1.26 -3.72 121.20 127.14 1nu7 s ILE 103 Ca 0.54 -0.31 -0.18 0.00 -1.41 0.00 0.00 60.65 59.29 1nu7 s ILE 103 Cb 0.03 -0.60 0.04 0.00 0.13 0.00 0.00 42.46 42.05 1nu7 s ILE 103 CO 0.06 -0.17 0.41 0.00 -1.91 0.00 0.00 174.94 173.33 1nu7 s ALA 104 N -0.86 -1.00 0.12 1.50 0.00 -0.19 -2.60 121.76 118.73 1nu7 s ALA 104 Ca -0.09 0.24 0.10 0.00 0.00 0.00 0.00 51.96 52.21 1nu7 s ALA 104 Cb -0.04 0.42 -0.04 0.00 0.00 0.00 0.00 23.12 23.46 1nu7 s ALA 104 CO 0.03 -0.49 -0.26 -0.51 0.00 0.00 0.00 175.76 174.53 1nu7 s LEU 105 N -2.16 2.31 -0.07 0.00 1.43 0.13 -1.06 118.68 119.25 1nu7 s LEU 105 Ca -0.04 -0.73 -0.00 0.00 -1.03 0.00 0.00 54.13 52.33 1nu7 s LEU 105 Cb -0.00 -1.15 0.02 0.00 0.03 0.00 0.00 46.19 45.10 1nu7 s LEU 105 CO -0.04 0.16 -0.03 -0.04 0.23 0.00 0.00 176.35 176.62 1nu7 s MET 106 N -2.00 0.91 -0.17 1.70 -1.94 0.52 -0.38 119.30 117.95 1nu7 s MET 106 Ca 0.12 -0.05 -0.15 0.00 -1.71 0.00 0.00 55.69 53.90 1nu7 s MET 106 Cb -0.10 -1.08 -0.04 0.00 2.01 0.00 0.00 34.83 35.62 1nu7 s MET 106 CO 0.05 -0.21 0.34 0.21 -0.01 0.00 0.00 175.02 175.40 1nu7 s LYS 107 N 1.54 4.24 0.55 2.03 2.20 -0.09 -0.84 119.74 129.37 1nu7 s LYS 107 Ca -0.01 0.15 -0.17 0.00 -0.36 0.00 0.00 55.97 55.58 1nu7 s LYS 107 Cb -0.13 -3.46 -0.06 0.00 -1.51 0.00 0.00 37.83 32.66 1nu7 s LYS 107 CO -0.04 0.14 1.02 -0.51 -0.36 0.00 0.00 175.35 175.60 1nu7 s LEU 108 N 0.76 3.59 0.12 5.43 1.43 0.06 0.25 118.68 130.31 1nu7 s LEU 108 Ca 0.18 1.71 -0.16 0.00 -1.03 0.00 0.00 54.13 54.83 1nu7 s LEU 108 Cb -0.14 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.53 1nu7 s LEU 108 CO 0.06 -0.86 1.61 0.11 0.23 0.00 0.00 176.35 177.50 1nu7 h LYS 109 N 0.77 0.60 -6.03 1.70 1.79 -1.73 -3.40 116.57 110.26 1nu7 h LYS 109 Ca -0.47 -0.15 -0.55 0.00 -2.18 0.00 0.00 60.65 57.30 1nu7 h LYS 109 Cb 1.20 -0.07 -0.17 0.00 -1.58 0.00 0.00 32.23 31.61 1nu7 h LYS 109 CO 0.59 0.65 -0.78 0.15 -1.08 0.00 0.00 179.45 178.98 1nu7 s LYS 110 N -5.26 1.37 0.51 3.15 1.02 -1.26 -4.97 119.74 114.30 1nu7 s LYS 110 Ca -0.13 -1.50 -0.20 0.00 0.02 0.00 0.00 55.97 54.17 1nu7 s LYS 110 Cb 0.09 -1.44 -0.07 0.00 -0.52 0.00 0.00 37.83 35.89 1nu7 s LYS 110 CO 0.76 0.29 1.07 -1.25 -0.92 0.00 0.00 175.35 175.30 1nu7 s PRO 111 N -2.97 3.62 0.07 -1.68 0.04 -1.26 -4.82 135.00 127.99 1nu7 s PRO 111 Ca 0.19 1.43 -0.01 0.00 0.04 0.00 0.00 61.00 62.64 1nu7 s PRO 111 Cb -0.05 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 1nu7 s PRO 111 CO 0.08 -0.59 0.24 0.14 0.04 0.00 0.00 177.00 176.91 1nu7 s VAL 112 N -1.96 5.35 0.17 -0.36 -7.23 0.53 -5.00 120.40 111.90 1nu7 s VAL 112 Ca 0.69 -0.26 -0.24 0.00 -1.81 0.00 0.00 61.98 60.35 1nu7 s VAL 112 Cb -0.19 -3.62 -0.08 0.00 0.56 0.00 0.00 36.38 33.06 1nu7 s VAL 112 CO 0.23 0.15 0.75 0.00 -0.31 0.00 0.00 175.10 175.92 1nu7 s ALA 113 N -1.51 3.46 0.73 1.32 0.00 -1.26 -4.76 121.76 119.73 1nu7 s ALA 113 Ca 0.35 0.31 -0.11 0.00 0.00 0.00 0.00 51.96 52.51 1nu7 s ALA 113 Cb -0.13 -2.91 0.03 0.00 0.00 0.00 0.00 23.12 20.11 1nu7 s ALA 113 CO 0.26 0.31 1.11 -0.06 0.00 0.00 0.00 175.76 177.38 1nu7 s PHE 114 N -1.20 3.23 0.03 0.00 0.08 -1.26 -4.88 117.98 113.98 1nu7 s PHE 114 Ca 0.36 0.96 -0.03 0.00 0.12 0.00 0.00 56.93 58.34 1nu7 s PHE 114 Cb -0.22 -3.17 0.01 0.00 -0.57 0.00 0.00 43.02 39.07 1nu7 s PHE 114 CO 0.25 -1.32 0.16 -1.13 -0.10 0.00 0.00 175.22 173.08 1nu7 n SER 115 N -3.07 -0.27 0.30 1.36 3.41 -0.63 -4.92 113.62 109.80 1nu7 n SER 115 Ca 0.07 -1.15 0.18 0.00 -0.26 0.00 0.00 58.87 57.72 1nu7 n SER 115 Cb 0.58 0.44 0.96 0.00 -0.26 0.00 0.00 64.21 65.93 1nu7 n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1nu7 h ASP 116 N 0.30 0.00 -0.00 4.04 3.32 -1.99 -2.99 116.42 119.10 1nu7 h ASP 116 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1nu7 h ASP 116 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1nu7 h ASP 116 CO 0.06 0.03 -0.52 -1.22 -1.72 0.00 0.00 179.24 175.87 1nu7 n TYR 117 N -3.34 0.00 -4.04 4.55 4.01 -1.26 -4.86 117.16 112.22 1nu7 n TYR 117 Ca -0.02 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.45 1nu7 n TYR 117 Cb 0.16 0.00 -0.17 0.00 -0.31 0.00 0.00 39.34 39.02 1nu7 n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1nu7 s ILE 118 N -2.04 1.20 -0.22 -0.72 1.01 -1.13 -4.19 121.20 115.10 1nu7 s ILE 118 Ca 0.05 -0.41 -0.26 0.00 0.00 0.00 0.00 60.65 60.03 1nu7 s ILE 118 Cb 0.09 -1.17 0.07 0.00 0.01 0.00 0.00 42.46 41.47 1nu7 s ILE 118 CO 0.46 0.39 0.73 -2.28 0.00 0.00 0.00 174.94 174.24 1nu7 s HIS 119 N 1.50 -0.74 0.51 3.97 2.46 -0.33 -1.60 115.29 121.06 1nu7 s HIS 119 Ca 0.02 1.70 -0.17 0.00 0.47 0.00 0.00 55.06 57.08 1nu7 s HIS 119 Cb -0.13 0.31 -0.08 0.00 -0.13 0.00 0.00 32.58 32.55 1nu7 s HIS 119 CO -0.07 -0.42 0.98 -1.25 -2.47 0.00 0.00 174.74 171.51 1nu7 s PRO 120 N 0.00 3.97 0.22 2.88 0.04 -1.26 -2.39 135.00 138.46 1nu7 s PRO 120 Ca -0.02 0.97 0.04 0.00 0.04 0.00 0.00 61.00 62.02 1nu7 s PRO 120 Cb -0.04 -2.14 -0.03 0.00 0.04 0.00 0.00 34.50 32.33 1nu7 s PRO 120 CO 0.03 -0.26 0.35 0.54 0.04 0.00 0.00 177.00 177.71 1nu7 s VAL 121 N -2.60 5.26 0.28 -0.36 0.11 -0.66 -4.91 120.40 117.52 1nu7 s VAL 121 Ca 0.59 -0.83 -0.10 0.00 -2.93 0.00 0.00 61.98 58.71 1nu7 s VAL 121 Cb -0.10 -3.82 -0.07 0.00 -1.53 0.00 0.00 36.38 30.86 1nu7 s VAL 121 CO 0.30 -0.27 0.61 0.00 -3.33 0.00 0.00 175.10 172.41 1nu7 s LEU 123 N -3.07 4.36 0.45 0.00 1.43 -1.26 -0.61 118.68 119.98 1nu7 s LEU 123 Ca 0.49 0.33 -0.10 0.00 -1.03 0.00 0.00 54.13 53.81 1nu7 s LEU 123 Cb -0.11 -2.82 -0.06 0.00 0.03 0.00 0.00 46.19 43.24 1nu7 s LEU 123 CO 0.23 0.21 0.82 -2.16 0.23 0.00 0.00 176.35 175.68 1nu7 s PRO 124 N -2.24 3.74 0.60 1.29 0.04 -1.26 -4.91 135.00 132.26 1nu7 s PRO 124 Ca 0.32 0.50 0.05 0.00 0.04 0.00 0.00 61.00 61.91 1nu7 s PRO 124 Cb -0.13 -2.33 0.11 0.00 0.04 0.00 0.00 34.50 32.19 1nu7 s PRO 124 CO 0.23 -0.14 0.83 -0.40 0.04 0.00 0.00 177.00 177.56 1nu7 n ASP 125 N -1.64 1.69 -0.25 6.66 3.85 -1.26 -4.75 116.55 120.84 1nu7 n ASP 125 Ca 0.03 -2.29 0.01 0.00 -0.71 0.00 0.00 54.79 51.83 1nu7 n ASP 125 Cb 0.54 -0.48 0.14 0.00 -1.35 0.00 0.00 41.12 39.97 1nu7 n ASP 125 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.20 176.10 1nu7 h ARG 126 N 0.00 0.60 -0.27 0.11 2.43 -1.98 -2.90 114.38 112.36 1nu7 h ARG 126 Ca -0.28 -0.04 -0.19 0.00 -0.81 0.00 0.00 59.98 58.67 1nu7 h ARG 126 Cb 1.16 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.58 1nu7 h ARG 126 CO 0.35 0.40 -0.58 1.05 -1.51 0.00 0.00 179.97 179.68 1nu7 h GLU 127 N 0.62 0.87 -1.01 0.20 -0.00 -2.04 -1.32 114.58 111.90 1nu7 h GLU 127 Ca 0.35 -0.58 0.00 0.00 -0.00 0.00 0.00 59.36 59.14 1nu7 h GLU 127 Cb 0.36 0.08 0.00 0.00 -0.00 0.00 0.00 28.75 29.19 1nu7 h GLU 127 CO -0.26 1.21 0.00 2.41 -0.00 0.00 0.00 179.01 182.36 1nu7 n THR 128 N -4.00 0.02 0.00 -1.06 -1.04 -1.10 -0.30 114.28 106.80 1nu7 n THR 128 Ca -0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 1nu7 n THR 128 Cb 0.65 -0.27 0.00 0.00 -1.82 0.00 0.00 70.33 68.88 1nu7 n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nu7 n ALA 129 N 0.73 0.00 0.06 2.41 0.00 -0.50 -1.01 120.51 122.20 1nu7 n ALA 129 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 1nu7 n ALA 129 Cb 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.35 1nu7 n ALA 129 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1nu7 h SER 129 N 0.00 0.00 0.52 0.00 4.64 -0.93 -3.37 113.55 114.40 1nu7 h SER 129 Ca 0.00 -0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.07 1nu7 h SER 129 Cb 0.00 -0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 1nu7 h SER 129 CO 0.00 1.00 -1.66 0.18 -0.87 0.00 0.00 176.83 175.48 1nu7 n LEU 129 N -3.34 0.77 -3.73 5.97 4.32 -0.18 -4.56 117.00 116.26 1nu7 n LEU 129 Ca -0.01 0.36 -0.42 0.00 -0.02 0.00 0.00 56.01 55.92 1nu7 n LEU 129 Cb 0.95 0.16 -0.00 0.00 -1.62 0.00 0.00 43.42 42.91 1nu7 n LEU 129 CO 0.47 0.30 2.34 0.18 -1.22 0.00 0.00 177.39 179.46 1nu7 n LEU 130 N -2.94 7.08 -4.34 2.23 4.77 -1.26 -4.84 117.00 117.70 1nu7 n LEU 130 Ca -0.15 -4.51 -0.30 0.00 -0.03 0.00 0.00 56.01 51.01 1nu7 n LEU 130 Cb 0.97 -1.52 -0.15 0.00 -2.33 0.00 0.00 43.42 40.40 1nu7 n LEU 130 CO 0.44 1.45 -0.57 -1.10 -1.33 0.00 0.00 177.39 176.29 1nu7 s GLN 131 N 1.12 1.78 0.23 3.23 -0.21 -1.26 -4.96 119.66 119.58 1nu7 s GLN 131 Ca 0.46 -1.11 -0.30 0.00 0.02 0.00 0.00 55.36 54.42 1nu7 s GLN 131 Cb 0.13 -1.96 -0.15 0.00 1.00 0.00 0.00 33.01 32.03 1nu7 s GLN 131 CO -0.04 0.51 1.07 0.00 -2.12 0.00 0.00 175.29 174.70 1nu7 n ALA 132 N 1.75 -0.58 0.00 6.09 0.00 -1.26 -1.53 120.51 124.98 1nu7 n ALA 132 Ca -0.17 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1nu7 n ALA 132 Cb 0.52 -2.01 0.00 0.00 0.00 0.00 0.00 19.45 17.96 1nu7 n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nu7 n GLY 133 N 1.66 2.86 3.76 0.00 0.00 0.21 -4.94 105.19 108.74 1nu7 n GLY 133 Ca 0.13 -0.51 -0.41 0.00 0.00 0.00 0.00 46.02 45.22 1nu7 n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nu7 s TYR 134 N -1.42 2.89 -0.11 1.61 1.51 -0.58 -4.59 117.35 116.66 1nu7 s TYR 134 Ca 0.00 1.19 -0.05 0.00 -1.01 0.00 0.00 57.07 57.20 1nu7 s TYR 134 Cb 0.00 -3.84 -0.04 0.00 -0.11 0.00 0.00 41.96 37.97 1nu7 s TYR 134 CO 0.00 -2.53 0.10 0.15 -1.11 0.00 0.00 175.55 172.16 1nu7 s LYS 135 N -1.38 3.30 0.50 -0.62 1.02 -1.26 -0.14 119.74 121.16 1nu7 s LYS 135 Ca 0.54 -0.21 0.02 0.00 0.02 0.00 0.00 55.97 56.33 1nu7 s LYS 135 Cb -0.43 -3.07 -0.02 0.00 -0.52 0.00 0.00 37.83 33.79 1nu7 s LYS 135 CO 0.53 0.76 0.01 0.20 -0.92 0.00 0.00 175.35 175.92 1nu7 s GLY 136 N -1.00 2.97 -0.05 -3.33 0.00 0.22 -4.84 107.32 101.30 1nu7 s GLY 136 Ca 0.15 -0.56 0.06 0.00 0.00 0.00 0.00 44.72 44.37 1nu7 s GLY 136 CO 0.04 -2.18 -0.24 -1.60 0.00 0.00 0.00 173.10 169.12 1nu7 s ARG 137 N -3.86 2.48 -0.03 2.90 3.52 0.41 -1.40 118.95 122.96 1nu7 s ARG 137 Ca 0.09 -0.88 0.07 0.00 -0.13 0.00 0.00 55.73 54.87 1nu7 s ARG 137 Cb 0.02 -2.17 -0.01 0.00 -1.56 0.00 0.00 34.95 31.23 1nu7 s ARG 137 CO 0.05 0.44 -0.24 0.08 -0.81 0.00 0.00 175.30 174.81 1nu7 s VAL 138 N -0.29 1.89 0.08 7.11 1.01 -0.44 0.57 120.40 130.33 1nu7 s VAL 138 Ca 0.00 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 61.00 1nu7 s VAL 138 Cb -0.13 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 1nu7 s VAL 138 CO 0.02 0.53 -0.08 0.42 0.00 0.00 0.00 175.10 176.00 1nu7 s THR 139 N -0.39 0.71 0.00 3.92 -4.23 -1.23 -1.62 115.64 112.79 1nu7 s THR 139 Ca 0.04 -1.57 0.00 0.00 -1.18 0.00 0.00 61.69 58.98 1nu7 s THR 139 Cb -0.11 -1.24 0.00 0.00 1.34 0.00 0.00 72.50 72.49 1nu7 s THR 139 CO 0.01 -0.63 0.00 0.61 -0.54 0.00 0.00 174.62 174.07 1nu7 n GLY 140 N 0.62 0.67 0.78 3.99 0.00 -0.69 -4.52 105.19 106.04 1nu7 n GLY 140 Ca -0.17 -1.04 0.08 0.00 0.00 0.00 0.00 46.02 44.90 1nu7 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1nu7 n TRP 141 N -0.56 0.79 -0.99 1.61 8.01 -1.26 -0.99 117.44 124.05 1nu7 n TRP 141 Ca 0.00 -0.81 -0.30 0.00 -1.31 0.00 0.00 57.50 55.07 1nu7 n TRP 141 Cb 0.00 -0.25 0.25 0.00 -2.01 0.00 0.00 31.31 29.30 1nu7 n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1nu7 s GLY 142 N -1.81 1.57 0.51 6.99 0.00 -1.26 -4.45 107.32 108.86 1nu7 s GLY 142 Ca 0.38 -1.01 -0.22 0.00 0.00 0.00 0.00 44.72 43.86 1nu7 s GLY 142 CO 0.10 -0.08 1.08 0.70 0.00 0.00 0.00 173.10 174.89 1nu7 n ASN 143 N -4.94 1.44 0.16 1.64 3.02 -0.31 -2.99 115.26 113.28 1nu7 n ASN 143 Ca 0.14 0.94 0.13 0.00 -0.03 0.00 0.00 54.58 55.77 1nu7 n ASN 143 Cb 0.60 -1.42 0.45 0.00 -0.61 0.00 0.00 39.78 38.80 1nu7 n ASN 143 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1nu7 h LEU 144 N 1.18 0.00 -7.11 3.41 3.38 -1.43 -1.32 115.31 113.43 1nu7 h LEU 144 Ca -0.47 0.00 0.35 0.00 0.09 0.00 0.00 57.88 57.85 1nu7 h LEU 144 Cb 1.34 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.95 1nu7 h LEU 144 CO 0.55 0.00 0.91 -1.59 0.09 0.00 0.00 178.44 178.39 1nu7 s LYS 145 N -3.28 0.21 0.55 1.13 -2.85 -1.26 -4.20 119.74 110.04 1nu7 s LYS 145 Ca 0.06 -0.11 -0.18 0.00 -1.00 0.00 0.00 55.97 54.74 1nu7 s LYS 145 Cb 0.10 0.07 -0.05 0.00 -2.06 0.00 0.00 37.83 35.89 1nu7 s LYS 145 CO 0.52 -0.10 1.09 -2.00 0.10 0.00 0.00 175.35 174.97 1nu7 s GLU 146 N -2.23 3.39 0.24 1.78 2.12 -1.26 -4.95 118.70 117.79 1nu7 s GLU 146 Ca 0.14 1.45 0.10 0.00 0.36 0.00 0.00 54.97 57.02 1nu7 s GLU 146 Cb 0.05 -2.03 -0.05 0.00 0.26 0.00 0.00 34.13 32.37 1nu7 s GLU 146 CO -0.05 -0.79 -0.17 0.95 -0.54 0.00 0.00 175.26 174.66 1nu7 s THR 147 N -2.01 2.12 0.35 -1.70 -4.23 -1.26 -5.04 115.64 103.87 1nu7 s THR 147 Ca 0.69 -2.30 0.33 0.00 -1.18 0.00 0.00 61.69 59.22 1nu7 s THR 147 Cb -0.20 -2.17 0.35 0.00 1.34 0.00 0.00 72.50 71.82 1nu7 s THR 147 CO 0.29 -0.49 2.09 4.11 -0.54 0.00 0.00 174.62 180.08 1nu7 h TRP 148 N 2.44 0.00 -3.84 3.99 5.08 -1.99 -3.42 115.95 118.20 1nu7 h TRP 148 Ca -0.39 0.00 -0.19 0.00 1.08 0.00 0.00 58.89 59.39 1nu7 h TRP 148 Cb 1.24 0.00 -0.24 0.00 -3.00 0.00 0.00 29.16 27.16 1nu7 h TRP 148 CO 0.76 0.07 -0.69 -0.08 -1.28 0.00 0.00 178.44 177.22 1nu7 s THR 149 N -3.98 0.07 0.25 0.12 -1.32 -1.26 -5.02 115.64 104.50 1nu7 s THR 149 Ca -0.02 -0.54 -0.03 0.00 -1.21 0.00 0.00 61.69 59.89 1nu7 s THR 149 Cb 0.12 -0.18 0.22 0.00 -1.51 0.00 0.00 72.50 71.15 1nu7 s THR 149 CO 0.54 -0.30 1.76 0.00 -2.21 0.00 0.00 174.62 174.41 1nu7 h ALA 149 N 5.21 1.14 0.00 11.08 0.00 -1.98 0.35 119.26 135.07 1nu7 h ALA 149 Ca -0.29 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1nu7 h ALA 149 Cb 1.21 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1nu7 h ALA 149 CO 0.45 -0.11 -0.05 -0.91 0.00 0.00 0.00 179.25 178.62 1nu7 h ASN 149 N 0.57 0.00 -0.98 0.00 4.21 -1.97 -2.85 115.58 114.56 1nu7 h ASN 149 Ca 0.42 0.00 0.31 0.00 1.21 0.00 0.00 56.30 58.24 1nu7 h ASN 149 Cb 0.57 0.00 -0.15 0.00 -1.12 0.00 0.00 38.32 37.62 1nu7 h ASN 149 CO -0.35 0.05 0.48 0.58 -1.29 0.00 0.00 177.43 176.90 1nu7 h VAL 149 N 0.00 0.27 0.00 2.81 2.07 -1.31 -3.46 116.25 116.64 1nu7 h VAL 149 Ca -0.00 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.43 1nu7 h VAL 149 Cb 0.29 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 1nu7 h VAL 149 CO 0.01 0.05 0.00 0.61 0.02 0.00 0.00 177.57 178.26 1nu7 n GLY 149 N -1.31 -1.27 3.58 2.17 0.00 -1.08 -4.98 105.19 102.29 1nu7 n GLY 149 Ca 0.30 -2.09 -0.39 0.00 0.00 0.00 0.00 46.02 43.83 1nu7 n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nu7 s LYS 149 N 0.00 3.86 -0.91 1.61 1.02 -1.26 -4.97 119.74 119.10 1nu7 s LYS 149 Ca 0.00 -0.20 -0.03 0.00 0.02 0.00 0.00 55.97 55.76 1nu7 s LYS 149 Cb 0.00 -3.70 0.22 0.00 -0.52 0.00 0.00 37.83 33.83 1nu7 s LYS 149 CO 0.00 -0.32 0.81 0.20 -0.92 0.00 0.00 175.35 175.11 1nu7 s GLY 150 N 1.70 3.06 -0.04 -3.33 0.00 -1.26 -5.06 107.32 102.39 1nu7 s GLY 150 Ca 0.12 -3.80 -0.06 0.00 0.00 0.00 0.00 44.72 40.98 1nu7 s GLY 150 CO 0.11 1.21 0.21 1.20 0.00 0.00 0.00 173.10 175.82 1nu7 s GLN 151 N -1.24 3.51 0.80 2.90 -0.21 -1.26 -1.42 119.66 122.73 1nu7 s GLN 151 Ca 0.27 -0.15 -0.12 0.00 0.02 0.00 0.00 55.36 55.39 1nu7 s GLN 151 Cb -0.08 -3.12 0.07 0.00 1.00 0.00 0.00 33.01 30.87 1nu7 s GLN 151 CO -0.11 0.70 1.10 -1.25 -2.12 0.00 0.00 175.29 173.61 1nu7 s PRO 152 N -1.56 2.11 -0.18 2.91 0.04 -1.26 -5.00 135.00 132.05 1nu7 s PRO 152 Ca 0.23 0.56 -0.05 0.00 0.04 0.00 0.00 61.00 61.79 1nu7 s PRO 152 Cb -0.13 -1.93 -0.22 0.00 0.04 0.00 0.00 34.50 32.26 1nu7 s PRO 152 CO 0.13 -1.59 0.12 -1.13 0.04 0.00 0.00 177.00 174.58 1nu7 n SER 153 N -3.40 2.06 -4.86 6.66 3.41 -1.26 -4.79 113.62 111.44 1nu7 n SER 153 Ca 0.07 0.11 -0.36 0.00 -0.26 0.00 0.00 58.87 58.43 1nu7 n SER 153 Cb 0.57 -0.72 -0.06 0.00 -0.26 0.00 0.00 64.21 63.75 1nu7 n SER 153 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1nu7 s VAL 154 N -2.53 5.09 0.17 -3.33 1.01 -1.26 0.11 120.40 119.66 1nu7 s VAL 154 Ca -0.28 0.54 -0.33 0.00 0.00 0.00 0.00 61.98 61.92 1nu7 s VAL 154 Cb 0.08 -3.65 -0.16 0.00 0.00 0.00 0.00 36.38 32.65 1nu7 s VAL 154 CO 0.69 0.37 1.14 -0.11 0.00 0.00 0.00 175.10 177.19 1nu7 n LEU 155 N 1.16 1.44 -4.81 3.92 7.94 -0.79 -4.78 117.00 121.08 1nu7 n LEU 155 Ca -0.10 1.14 -0.35 0.00 -1.11 0.00 0.00 56.01 55.60 1nu7 n LEU 155 Cb 0.52 -1.21 -0.07 0.00 0.53 0.00 0.00 43.42 43.20 1nu7 n LEU 155 CO 0.41 -1.36 -0.22 -1.10 -1.11 0.00 0.00 177.39 174.01 1nu7 s GLN 156 N -0.44 3.22 -0.01 1.96 -1.52 -0.16 -0.64 119.66 122.06 1nu7 s GLN 156 Ca 0.73 -0.33 0.02 0.00 -1.95 0.00 0.00 55.36 53.83 1nu7 s GLN 156 Cb -0.86 -2.98 -0.00 0.00 -0.22 0.00 0.00 33.01 28.95 1nu7 s GLN 156 CO 0.53 0.71 -0.08 0.54 -0.25 0.00 0.00 175.29 176.73 1nu7 s VAL 157 N -1.09 0.66 -0.00 1.09 0.11 -0.31 -1.71 120.40 119.14 1nu7 s VAL 157 Ca 0.19 -0.33 -0.01 0.00 -2.93 0.00 0.00 61.98 58.90 1nu7 s VAL 157 Cb -0.12 -0.57 -0.00 0.00 -1.53 0.00 0.00 36.38 34.16 1nu7 s VAL 157 CO 0.09 0.20 0.02 0.54 -3.33 0.00 0.00 175.10 172.62 1nu7 s VAL 158 N -0.02 0.02 -0.16 2.04 0.11 -0.64 -1.54 120.40 120.19 1nu7 s VAL 158 Ca 0.01 -0.16 -0.08 0.00 -2.93 0.00 0.00 61.98 58.82 1nu7 s VAL 158 Cb -0.05 -0.09 -0.04 0.00 -1.53 0.00 0.00 36.38 34.67 1nu7 s VAL 158 CO -0.00 -0.09 0.10 0.20 -3.33 0.00 0.00 175.10 171.98 1nu7 s ASN 159 N -0.25 5.99 0.02 3.54 0.01 -1.26 -1.33 114.94 121.66 1nu7 s ASN 159 Ca -0.03 0.24 0.01 0.00 -0.71 0.00 0.00 52.86 52.37 1nu7 s ASN 159 Cb -0.02 -1.99 -0.01 0.00 0.41 0.00 0.00 41.25 39.63 1nu7 s ASN 159 CO -0.00 0.25 -0.04 -0.76 -1.51 0.00 0.00 177.10 175.04 1nu7 s LEU 160 N -0.09 2.15 0.15 0.60 1.43 -0.50 -4.96 118.68 117.46 1nu7 s LEU 160 Ca 0.09 -0.32 -0.18 0.00 -1.03 0.00 0.00 54.13 52.69 1nu7 s LEU 160 Cb -0.12 -0.06 -0.07 0.00 0.03 0.00 0.00 46.19 45.97 1nu7 s LEU 160 CO 0.00 -0.14 0.61 -2.16 0.23 0.00 0.00 176.35 174.90 1nu7 s PRO 161 N -0.91 4.14 0.33 1.29 0.04 -1.26 -0.61 135.00 138.02 1nu7 s PRO 161 Ca -0.07 0.69 -0.28 0.00 0.04 0.00 0.00 61.00 61.37 1nu7 s PRO 161 Cb -0.06 -3.01 -0.10 0.00 0.04 0.00 0.00 34.50 31.37 1nu7 s PRO 161 CO -0.00 0.50 1.20 0.42 0.04 0.00 0.00 177.00 179.16 1nu7 s ILE 162 N -1.38 3.08 0.10 0.56 1.09 0.80 -0.49 121.20 124.96 1nu7 s ILE 162 Ca 0.37 1.04 0.07 0.00 -1.10 0.00 0.00 60.65 61.03 1nu7 s ILE 162 Cb -0.17 -3.64 -0.04 0.00 -1.06 0.00 0.00 42.46 37.55 1nu7 s ILE 162 CO 0.20 0.21 -0.10 0.68 -0.10 0.00 0.00 174.94 175.84 1nu7 s VAL 163 N -1.21 3.39 0.43 2.92 -7.23 -0.47 -0.62 120.40 117.61 1nu7 s VAL 163 Ca 0.49 -1.23 -0.24 0.00 -1.81 0.00 0.00 61.98 59.19 1nu7 s VAL 163 Cb -0.35 -2.58 -0.10 0.00 0.56 0.00 0.00 36.38 33.92 1nu7 s VAL 163 CO 0.45 0.13 1.12 -1.84 -0.31 0.00 0.00 175.10 174.66 1nu7 n GLU 164 N 0.77 1.56 -0.22 4.82 0.00 -1.26 -4.61 120.64 121.70 1nu7 n GLU 164 Ca -0.13 0.56 -0.02 0.00 0.00 0.00 0.00 57.16 57.57 1nu7 n GLU 164 Cb 0.52 -2.19 0.09 0.00 0.00 0.00 0.00 31.44 29.86 1nu7 n GLU 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1nu7 h ARG 165 N 1.69 0.59 -0.69 3.44 3.08 -1.98 -2.03 114.38 118.49 1nu7 h ARG 165 Ca -0.46 -0.04 0.05 0.00 0.07 0.00 0.00 59.98 59.60 1nu7 h ARG 165 Cb 1.32 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 31.20 1nu7 h ARG 165 CO 0.58 0.39 0.45 -1.35 -1.07 0.00 0.00 179.97 178.97 1nu7 h PRO 166 N 0.61 0.75 -0.32 0.04 0.11 -1.99 0.38 132.00 131.59 1nu7 h PRO 166 Ca 0.29 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.26 1nu7 h PRO 166 Cb 0.22 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 1nu7 h PRO 166 CO -0.20 0.50 -0.17 0.28 -0.21 0.00 0.00 178.00 178.20 1nu7 h VAL 167 N 0.77 1.29 -0.00 3.15 2.07 -1.79 -0.46 116.25 121.28 1nu7 h VAL 167 Ca 0.28 -1.29 0.01 0.00 0.82 0.00 0.00 66.70 66.52 1nu7 h VAL 167 Cb 0.15 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 1nu7 h VAL 167 CO -0.09 0.42 -0.06 0.00 0.02 0.00 0.00 177.57 177.87 1nu7 h LYS 169 N -0.10 0.73 0.00 0.00 3.64 -0.22 -2.26 116.57 118.36 1nu7 h LYS 169 Ca 0.03 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1nu7 h LYS 169 Cb 0.13 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 1nu7 h LYS 169 CO -0.06 0.48 0.00 -0.44 -2.27 0.00 0.00 179.45 177.16 1nu7 h ASP 170 N 0.75 0.00 0.94 4.20 3.45 -0.82 -3.22 116.42 121.72 1nu7 h ASP 170 Ca 0.28 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.74 1nu7 h ASP 170 Cb 0.10 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.87 1nu7 h ASP 170 CO -0.14 0.00 0.00 -1.54 -1.57 0.00 0.00 179.24 175.99 1nu7 n SER 171 N -2.71 0.07 -3.81 6.45 3.41 -0.36 -4.87 113.62 111.79 1nu7 n SER 171 Ca 0.03 0.51 -0.11 0.00 -0.26 0.00 0.00 58.87 59.04 1nu7 n SER 171 Cb 0.38 -0.53 -0.08 0.00 -0.26 0.00 0.00 64.21 63.73 1nu7 n SER 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1nu7 s THR 172 N -3.01 0.10 -2.00 6.66 -1.32 -1.22 -4.85 115.64 110.00 1nu7 s THR 172 Ca 0.12 -0.86 0.26 0.00 -1.21 0.00 0.00 61.69 60.00 1nu7 s THR 172 Cb 0.17 -1.00 0.26 0.00 -1.51 0.00 0.00 72.50 70.42 1nu7 s THR 172 CO 0.49 -0.47 1.48 0.54 -2.21 0.00 0.00 174.62 174.45 1nu7 n ARG 173 N 0.50 1.13 -2.53 7.08 1.74 -1.26 -4.84 116.66 118.48 1nu7 n ARG 173 Ca -0.18 -0.75 -0.41 0.00 -0.77 0.00 0.00 57.85 55.74 1nu7 n ARG 173 Cb 0.60 -1.48 -0.04 0.00 -1.02 0.00 0.00 32.46 30.51 1nu7 n ARG 173 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1nu7 s ILE 174 N -2.39 3.90 -0.34 0.55 1.01 -1.26 -4.95 121.20 117.73 1nu7 s ILE 174 Ca 0.26 1.64 -0.28 0.00 0.00 0.00 0.00 60.65 62.26 1nu7 s ILE 174 Cb 0.19 -4.04 -0.02 0.00 0.01 0.00 0.00 42.46 38.60 1nu7 s ILE 174 CO 0.49 0.28 1.82 -0.60 0.00 0.00 0.00 174.94 176.93 1nu7 s ARG 175 N -0.34 3.29 0.61 2.79 3.52 -1.26 -4.99 118.95 122.56 1nu7 s ARG 175 Ca 0.49 1.42 -0.07 0.00 -0.13 0.00 0.00 55.73 57.44 1nu7 s ARG 175 Cb -0.29 -4.22 0.01 0.00 -1.56 0.00 0.00 34.95 28.89 1nu7 s ARG 175 CO 0.35 -1.91 0.95 0.96 -0.81 0.00 0.00 175.30 174.83 1nu7 s ILE 176 N 7.08 3.70 0.24 4.11 -0.00 -1.26 -4.84 121.20 130.23 1nu7 s ILE 176 Ca 0.80 0.15 0.01 0.00 -0.00 0.00 0.00 60.65 61.61 1nu7 s ILE 176 Cb -0.22 -3.49 -0.05 0.00 -0.00 0.00 0.00 42.46 38.70 1nu7 s ILE 176 CO 0.33 -0.54 0.10 0.42 -0.00 0.00 0.00 174.94 175.25 1nu7 s THR 177 N -3.07 0.46 -1.31 8.37 -4.23 -1.26 -5.01 115.64 109.58 1nu7 s THR 177 Ca 0.55 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 59.15 1nu7 s THR 177 Cb -0.11 -2.60 0.14 0.00 1.34 0.00 0.00 72.50 71.28 1nu7 s THR 177 CO 0.47 -0.01 1.22 0.47 -0.54 0.00 0.00 174.62 176.23 1nu7 n ASP 178 N -0.42 0.00 -0.94 3.99 8.00 -1.26 -1.92 116.55 124.00 1nu7 n ASP 178 Ca 0.00 0.24 0.07 0.00 0.71 0.00 0.00 54.79 55.81 1nu7 n ASP 178 Cb 0.66 -0.34 0.21 0.00 -0.02 0.00 0.00 41.12 41.63 1nu7 n ASP 178 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1nu7 n ASN 179 N -1.34 2.73 -4.26 -2.24 3.02 -1.26 -4.89 115.26 107.02 1nu7 n ASN 179 Ca 0.04 -2.12 -0.15 0.00 -0.03 0.00 0.00 54.58 52.32 1nu7 n ASN 179 Cb 0.09 -0.37 -0.10 0.00 -0.61 0.00 0.00 39.78 38.79 1nu7 n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1nu7 s MET 180 N -1.54 1.13 0.06 3.52 -1.94 -0.81 -0.55 119.30 119.17 1nu7 s MET 180 Ca 0.31 -1.52 -0.12 0.00 -1.71 0.00 0.00 55.69 52.65 1nu7 s MET 180 Cb 0.18 -0.52 0.01 0.00 2.01 0.00 0.00 34.83 36.51 1nu7 s MET 180 CO 0.18 -0.02 0.26 -0.59 -0.01 0.00 0.00 175.02 174.84 1nu7 s PHE 181 N -3.44 -0.01 0.21 -0.03 -0.12 -0.52 -4.77 117.98 109.30 1nu7 s PHE 181 Ca 0.21 -0.25 0.11 0.00 -0.05 0.00 0.00 56.93 56.95 1nu7 s PHE 181 Cb 0.04 0.04 -0.05 0.00 -0.63 0.00 0.00 43.02 42.43 1nu7 s PHE 181 CO 0.03 -0.52 -0.22 0.00 -0.05 0.00 0.00 175.22 174.46 1nu7 s ALA 183 N -1.95 0.08 0.00 0.00 0.00 -0.64 -1.37 121.76 117.88 1nu7 s ALA 183 Ca 0.23 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.42 1nu7 s ALA 183 Cb -0.07 0.31 0.00 0.00 0.00 0.00 0.00 23.12 23.36 1nu7 s ALA 183 CO 0.11 -0.38 0.00 0.41 0.00 0.00 0.00 175.76 175.90 1nu7 n GLY 184 N 0.39 4.12 3.80 0.00 0.00 0.36 -2.05 105.19 111.82 1nu7 n GLY 184 Ca -0.17 -1.61 -0.34 0.00 0.00 0.00 0.00 46.02 43.90 1nu7 n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nu7 s TYR 184 N -2.25 3.13 0.53 1.61 2.02 -1.26 -4.57 117.35 116.56 1nu7 s TYR 184 Ca 0.00 1.60 -0.11 0.00 -0.37 0.00 0.00 57.07 58.19 1nu7 s TYR 184 Cb 0.00 -3.02 -0.05 0.00 -0.40 0.00 0.00 41.96 38.49 1nu7 s TYR 184 CO 0.00 -0.60 0.91 0.15 -1.57 0.00 0.00 175.55 174.45 1nu7 s LYS 185 N -3.07 3.69 0.32 -0.62 1.02 -1.26 -4.78 119.74 115.03 1nu7 s LYS 185 Ca 0.64 0.61 0.09 0.00 0.02 0.00 0.00 55.97 57.33 1nu7 s LYS 185 Cb -0.16 -2.22 0.91 0.00 -0.52 0.00 0.00 37.83 35.84 1nu7 s LYS 185 CO 0.20 -0.32 1.67 -1.35 -0.92 0.00 0.00 175.35 174.62 1nu7 h PRO 186 N 0.36 0.32 -0.99 -1.68 0.11 -1.95 -1.36 132.00 126.81 1nu7 h PRO 186 Ca -0.46 -0.02 -0.54 0.00 0.11 0.00 0.00 66.00 65.09 1nu7 h PRO 186 Cb 1.19 -0.07 -0.31 0.00 0.11 0.00 0.00 31.00 31.92 1nu7 h PRO 186 CO 0.62 0.21 0.68 -0.40 -0.21 0.00 0.00 178.00 178.90 1nu7 n ASP 186 N -5.09 4.26 -0.00 -2.05 5.68 -1.26 -3.94 116.55 114.15 1nu7 n ASP 186 Ca 0.27 -3.64 0.10 0.00 -0.50 0.00 0.00 54.79 51.02 1nu7 n ASP 186 Cb 0.83 -0.86 -0.12 0.00 -1.14 0.00 0.00 41.12 39.83 1nu7 n ASP 186 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1nu7 n GLU 186 N -1.12 0.11 0.00 0.11 1.02 -0.51 -5.00 120.64 115.25 1nu7 n GLU 186 Ca 0.60 -0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.74 1nu7 n GLU 186 Cb 1.54 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 31.47 1nu7 n GLU 186 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nu7 n GLY 186 N 1.49 1.98 3.67 0.62 0.00 -1.25 -4.96 105.19 106.73 1nu7 n GLY 186 Ca 0.04 -0.20 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 1nu7 n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nu7 n LYS 186 N 0.00 0.36 -3.31 1.61 5.02 -1.26 -5.04 118.16 115.53 1nu7 n LYS 186 Ca 0.00 0.19 -0.15 0.00 -2.02 0.00 0.00 58.31 56.33 1nu7 n LYS 186 Cb 0.00 -2.38 -0.04 0.00 -0.02 0.00 0.00 35.03 32.60 1nu7 n LYS 186 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1nu7 n ARG 187 N -2.72 1.11 0.00 1.97 1.74 -1.26 -4.70 116.66 112.81 1nu7 n ARG 187 Ca 0.13 -1.84 0.00 0.00 -0.77 0.00 0.00 57.85 55.37 1nu7 n ARG 187 Cb 0.50 0.70 0.00 0.00 -1.02 0.00 0.00 32.46 32.64 1nu7 n ARG 187 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nu7 n GLY 188 N 1.41 4.55 3.63 -0.13 0.00 -1.26 -4.89 105.19 108.49 1nu7 n GLY 188 Ca -0.08 -1.23 0.02 0.00 0.00 0.00 0.00 46.02 44.73 1nu7 n GLY 188 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1nu7 s ASP 189 N 0.00 -0.05 0.54 1.61 2.15 -0.96 -4.64 116.67 115.32 1nu7 s ASP 189 Ca 0.00 -0.12 0.03 0.00 0.43 0.00 0.00 52.55 52.88 1nu7 s ASP 189 Cb 0.00 0.14 0.04 0.00 -0.30 0.00 0.00 42.92 42.80 1nu7 s ASP 189 CO 0.00 -0.27 0.76 0.00 -0.17 0.00 0.00 175.17 175.49 1nu7 s ALA 190 N -2.36 4.03 0.23 3.66 0.00 -1.26 -0.23 121.76 125.83 1nu7 s ALA 190 Ca 0.15 -1.45 -0.04 0.00 0.00 0.00 0.00 51.96 50.62 1nu7 s ALA 190 Cb 0.05 -1.97 0.01 0.00 0.00 0.00 0.00 23.12 21.22 1nu7 s ALA 190 CO -0.04 -0.73 0.37 0.00 0.00 0.00 0.00 175.76 175.36 1nu7 n GLU 192 N -0.36 1.24 0.00 0.00 -0.58 -1.26 -0.52 120.64 119.15 1nu7 n GLU 192 Ca -0.01 0.44 0.00 0.00 -0.42 0.00 0.00 57.16 57.17 1nu7 n GLU 192 Cb 0.38 -1.93 0.00 0.00 -0.57 0.00 0.00 31.44 29.32 1nu7 n GLU 192 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1nu7 n GLY 193 N 1.93 2.33 0.10 0.62 0.00 -1.26 -1.16 105.19 107.76 1nu7 n GLY 193 Ca 0.14 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.28 1nu7 n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1nu7 h ASP 194 N 0.00 0.00 -1.70 1.61 3.32 -1.13 -3.33 116.42 115.19 1nu7 h ASP 194 Ca 0.00 -0.10 -0.63 0.00 0.02 0.00 0.00 57.03 56.32 1nu7 h ASP 194 Cb 0.00 0.00 0.13 0.00 0.22 0.00 0.00 39.33 39.68 1nu7 h ASP 194 CO 0.00 0.05 -0.45 -1.20 -1.72 0.00 0.00 179.24 175.91 1nu7 n SER 195 N -2.46 -0.99 0.00 6.45 7.64 -1.26 -1.03 113.62 121.98 1nu7 n SER 195 Ca 0.02 1.03 0.00 0.00 1.01 0.00 0.00 58.87 60.93 1nu7 n SER 195 Cb 0.50 -1.04 0.00 0.00 -1.01 0.00 0.00 64.21 62.66 1nu7 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nu7 n GLY 196 N 1.87 3.11 3.73 0.23 0.00 0.08 -0.68 105.19 113.54 1nu7 n GLY 196 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 1nu7 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nu7 s GLY 197 N -1.46 1.67 0.23 -0.02 0.00 -0.20 -3.19 107.32 104.36 1nu7 s GLY 197 Ca 0.00 0.32 -0.12 0.00 0.00 0.00 0.00 44.72 44.92 1nu7 s GLY 197 CO 0.00 0.70 0.59 2.56 0.00 0.00 0.00 173.10 176.96 1nu7 s PRO 198 N -4.83 3.89 -0.41 2.90 0.04 -1.26 -1.56 135.00 133.77 1nu7 s PRO 198 Ca 0.63 0.41 -0.06 0.00 0.04 0.00 0.00 61.00 62.02 1nu7 s PRO 198 Cb -0.19 -2.66 0.09 0.00 0.04 0.00 0.00 34.50 31.78 1nu7 s PRO 198 CO 0.57 0.32 0.22 0.12 0.04 0.00 0.00 177.00 178.27 1nu7 s PHE 199 N -1.78 3.42 0.20 0.56 2.19 -0.44 -3.53 117.98 118.60 1nu7 s PHE 199 Ca 0.47 -1.89 0.06 0.00 0.33 0.00 0.00 56.93 55.90 1nu7 s PHE 199 Cb -0.12 -3.02 -0.04 0.00 -1.31 0.00 0.00 43.02 38.53 1nu7 s PHE 199 CO 0.20 -0.90 0.13 0.14 1.83 0.00 0.00 175.22 176.62 1nu7 s VAL 200 N 1.31 4.33 0.00 3.12 -7.23 0.19 -1.38 120.40 120.74 1nu7 s VAL 200 Ca 0.04 -1.27 0.02 0.00 -1.81 0.00 0.00 61.98 58.95 1nu7 s VAL 200 Cb -0.23 -3.25 -0.01 0.00 0.56 0.00 0.00 36.38 33.45 1nu7 s VAL 200 CO -0.01 -0.20 -0.05 -0.04 -0.31 0.00 0.00 175.10 174.49 1nu7 s MET 201 N -3.36 0.40 -0.24 4.82 -1.94 -0.28 0.15 119.30 118.85 1nu7 s MET 201 Ca 0.31 -0.23 -0.14 0.00 -1.71 0.00 0.00 55.69 53.92 1nu7 s MET 201 Cb -0.09 -0.36 -0.04 0.00 2.01 0.00 0.00 34.83 36.35 1nu7 s MET 201 CO 0.23 0.10 0.34 0.21 -0.01 0.00 0.00 175.02 175.89 1nu7 s LYS 202 N -0.26 4.09 -0.04 2.03 2.20 -1.26 -0.30 119.74 126.19 1nu7 s LYS 202 Ca 0.01 0.05 -0.30 0.00 -0.36 0.00 0.00 55.97 55.36 1nu7 s LYS 202 Cb -0.03 -3.59 -0.03 0.00 -1.51 0.00 0.00 37.83 32.68 1nu7 s LYS 202 CO -0.00 -0.12 1.08 0.45 -0.36 0.00 0.00 175.35 176.40 1nu7 s SER 203 N 1.30 7.20 0.49 1.43 0.15 0.18 -4.91 113.70 119.54 1nu7 s SER 203 Ca 0.15 1.72 0.31 0.00 0.70 0.00 0.00 55.95 58.83 1nu7 s SER 203 Cb -0.15 -2.56 1.22 0.00 -1.71 0.00 0.00 66.02 62.82 1nu7 s SER 203 CO 0.08 -0.44 1.91 1.55 1.20 0.00 0.00 173.24 177.54 1nu7 h PRO 204 N 7.08 0.00 0.09 5.44 0.13 -1.97 -0.12 132.00 142.65 1nu7 h PRO 204 Ca -0.36 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.64 1nu7 h PRO 204 Cb 1.18 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.32 1nu7 h PRO 204 CO 0.83 0.00 -0.60 0.74 -0.23 0.00 0.00 178.00 178.73 1nu7 h PHE 204 N 0.00 0.34 0.00 1.56 0.05 -1.97 -3.41 116.94 113.51 1nu7 h PHE 204 Ca 0.00 -0.25 0.00 0.00 3.82 0.00 0.00 57.97 61.54 1nu7 h PHE 204 Cb 0.53 -0.01 0.00 0.00 2.00 0.00 0.00 35.95 38.46 1nu7 h PHE 204 CO 0.00 1.23 0.00 0.27 -0.18 0.00 0.00 178.31 179.63 1nu7 n ASN 204 N -4.28 1.44 -1.22 2.17 0.23 -1.23 -5.02 115.26 107.35 1nu7 n ASN 204 Ca -0.14 -1.59 -0.15 0.00 -0.53 0.00 0.00 54.58 52.16 1nu7 n ASN 204 Cb 0.71 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.35 1nu7 n ASN 204 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1nu7 n ASN 205 N -0.30 -4.85 -4.84 0.53 4.05 -0.06 -5.01 115.26 104.80 1nu7 n ASN 205 Ca 0.00 0.36 -0.25 0.00 0.45 0.00 0.00 54.58 55.14 1nu7 n ASN 205 Cb 0.21 -3.72 -0.05 0.00 1.23 0.00 0.00 39.78 37.46 1nu7 n ASN 205 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 1nu7 s ARG 206 N -3.39 3.04 -0.06 1.20 0.52 -1.25 -4.84 118.95 114.17 1nu7 s ARG 206 Ca 0.00 -0.84 -0.14 0.00 -0.52 0.00 0.00 55.73 54.23 1nu7 s ARG 206 Cb 0.00 -2.71 -0.05 0.00 0.52 0.00 0.00 34.95 32.71 1nu7 s ARG 206 CO 0.00 0.48 0.36 -1.58 0.02 0.00 0.00 175.30 174.58 1nu7 s TRP 207 N -1.81 3.63 -0.03 -0.53 0.52 -1.26 -0.64 118.94 118.82 1nu7 s TRP 207 Ca 0.32 0.84 0.07 0.00 0.02 0.00 0.00 56.10 57.35 1nu7 s TRP 207 Cb -0.10 -2.29 -0.02 0.00 -1.15 0.00 0.00 33.47 29.92 1nu7 s TRP 207 CO 0.25 0.52 -0.24 0.71 0.02 0.00 0.00 176.95 178.21 1nu7 s TYR 208 N -0.56 2.16 -0.53 -1.98 1.51 0.59 -2.50 117.35 116.04 1nu7 s TYR 208 Ca 0.21 -0.47 -0.21 0.00 -1.01 0.00 0.00 57.07 55.60 1nu7 s TYR 208 Cb -0.15 -1.40 0.06 0.00 -0.11 0.00 0.00 41.96 40.35 1nu7 s TYR 208 CO 0.10 -0.08 0.73 -1.14 -1.11 0.00 0.00 175.55 174.05 1nu7 s GLN 209 N -0.45 3.17 0.13 -0.62 0.74 0.22 -1.13 119.66 121.73 1nu7 s GLN 209 Ca 0.06 -0.75 0.16 0.00 0.05 0.00 0.00 55.36 54.89 1nu7 s GLN 209 Cb -0.10 -4.10 -0.07 0.00 1.10 0.00 0.00 33.01 29.83 1nu7 s GLN 209 CO 0.00 -1.35 1.02 0.52 -0.55 0.00 0.00 175.29 174.93 1nu7 h MET 210 N 9.12 0.00 -4.27 1.67 2.86 -1.55 -3.39 114.93 119.37 1nu7 h MET 210 Ca -0.27 0.00 -0.24 0.00 -2.06 0.00 0.00 59.70 57.13 1nu7 h MET 210 Cb 1.09 0.00 -0.11 0.00 0.06 0.00 0.00 31.60 32.64 1nu7 h MET 210 CO 1.02 0.35 -0.35 0.20 1.06 0.00 0.00 176.91 179.19 1nu7 s GLY 211 N -4.68 1.37 -0.09 8.32 0.00 -0.87 -1.71 107.32 109.66 1nu7 s GLY 211 Ca -0.01 -1.50 0.00 0.00 0.00 0.00 0.00 44.72 43.21 1nu7 s GLY 211 CO 0.79 -1.10 -0.07 -0.42 0.00 0.00 0.00 173.10 172.29 1nu7 s ILE 212 N -3.69 0.94 -0.14 0.90 1.01 -0.89 -1.33 121.20 118.00 1nu7 s ILE 212 Ca 0.33 -0.27 -0.36 0.00 0.00 0.00 0.00 60.65 60.35 1nu7 s ILE 212 Cb 0.02 -0.95 -0.13 0.00 0.01 0.00 0.00 42.46 41.41 1nu7 s ILE 212 CO 0.16 0.34 1.82 0.52 0.00 0.00 0.00 174.94 177.78 1nu7 n VAL 213 N 4.69 0.46 0.03 2.92 0.31 -0.60 -0.65 118.33 125.49 1nu7 n VAL 213 Ca -0.15 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 1nu7 n VAL 213 Cb 0.50 -1.63 0.00 0.00 -0.91 0.00 0.00 33.84 31.81 1nu7 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1nu7 n SER 214 N 6.05 0.66 -3.25 4.52 2.88 -0.61 -0.74 113.62 123.13 1nu7 n SER 214 Ca 0.24 0.10 -0.11 0.00 -1.33 0.00 0.00 58.87 57.77 1nu7 n SER 214 Cb 0.24 -0.19 -0.01 0.00 -0.75 0.00 0.00 64.21 63.50 1nu7 n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1nu7 s TRP 215 N -2.00 0.43 0.00 0.66 1.48 -1.01 -4.94 118.94 113.56 1nu7 s TRP 215 Ca 0.00 -0.90 0.00 0.00 -1.06 0.00 0.00 56.10 54.14 1nu7 s TRP 215 Cb 0.00 0.44 0.00 0.00 -1.16 0.00 0.00 33.47 32.75 1nu7 s TRP 215 CO 0.00 -1.33 0.00 0.41 -4.06 0.00 0.00 176.95 171.97 1nu7 n GLY 216 N -0.52 0.87 3.27 3.67 0.00 -1.26 -0.03 105.19 111.19 1nu7 n GLY 216 Ca -0.04 -0.80 -0.37 0.00 0.00 0.00 0.00 46.02 44.81 1nu7 n GLY 216 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nu7 s GLU 217 N -2.00 2.71 2.09 1.61 2.02 -1.26 -4.96 118.70 118.91 1nu7 s GLU 217 Ca 0.00 -1.11 0.00 0.00 0.02 0.00 0.00 54.97 53.88 1nu7 s GLU 217 Cb 0.00 -3.37 0.00 0.00 0.10 0.00 0.00 34.13 30.86 1nu7 s GLU 217 CO 0.00 -0.59 0.00 0.41 0.02 0.00 0.00 175.26 175.10 1nu7 n GLY 219 N 4.79 -0.76 2.87 -1.39 0.00 -1.26 -4.68 105.19 104.76 1nu7 n GLY 219 Ca -0.13 -1.11 -0.17 0.00 0.00 0.00 0.00 46.02 44.61 1nu7 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nu7 n ASP 221 N 3.76 -4.52 -4.78 0.00 2.03 -1.26 -4.41 116.55 107.37 1nu7 n ASP 221 Ca -0.22 0.14 -0.37 0.00 0.52 0.00 0.00 54.79 54.86 1nu7 n ASP 221 Cb 0.53 -3.82 -0.04 0.00 -0.72 0.00 0.00 41.12 37.07 1nu7 n ASP 221 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1nu7 s ARG 221 N -4.95 4.22 0.27 -0.67 0.52 -1.26 -4.92 118.95 112.16 1nu7 s ARG 221 Ca 0.00 1.55 -0.29 0.00 -0.52 0.00 0.00 55.73 56.47 1nu7 s ARG 221 Cb 0.00 -2.62 -0.10 0.00 0.52 0.00 0.00 34.95 32.75 1nu7 s ARG 221 CO 0.00 -0.10 1.23 -0.51 0.02 0.00 0.00 175.30 175.94 1nu7 s ASP 222 N -1.47 6.98 0.00 0.23 1.01 -1.26 -2.55 116.67 119.60 1nu7 s ASP 222 Ca 0.56 2.46 0.00 0.00 0.71 0.00 0.00 52.55 56.28 1nu7 s ASP 222 Cb -0.23 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.07 1nu7 s ASP 222 CO 0.29 -0.40 0.00 0.61 0.21 0.00 0.00 175.17 175.88 1nu7 n GLY 223 N 1.40 0.71 3.50 0.21 0.00 -1.26 -5.01 105.19 104.74 1nu7 n GLY 223 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 1nu7 n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nu7 s LYS 224 N -0.14 1.82 0.06 1.61 3.01 -1.06 -4.77 119.74 120.28 1nu7 s LYS 224 Ca 0.00 -1.21 0.03 0.00 -1.01 0.00 0.00 55.97 53.78 1nu7 s LYS 224 Cb 0.00 -2.11 -0.03 0.00 -1.01 0.00 0.00 37.83 34.68 1nu7 s LYS 224 CO 0.00 0.47 -0.10 0.71 0.51 0.00 0.00 175.35 176.94 1nu7 s TYR 225 N -1.27 0.91 0.33 3.18 2.02 -1.26 -4.73 117.35 116.53 1nu7 s TYR 225 Ca 0.19 -0.54 -0.27 0.00 -0.37 0.00 0.00 57.07 56.09 1nu7 s TYR 225 Cb -0.10 -0.52 -0.09 0.00 -0.40 0.00 0.00 41.96 40.84 1nu7 s TYR 225 CO 0.11 -0.03 1.02 0.20 -1.57 0.00 0.00 175.55 175.28 1nu7 s GLY 226 N -1.86 2.89 -0.07 0.71 0.00 -0.87 -4.59 107.32 103.52 1nu7 s GLY 226 Ca -0.04 0.70 -0.01 0.00 0.00 0.00 0.00 44.72 45.38 1nu7 s GLY 226 CO 0.01 1.20 -0.01 -1.36 0.00 0.00 0.00 173.10 172.93 1nu7 s PHE 227 N -1.46 3.10 0.04 1.90 0.40 0.96 -1.62 117.98 121.30 1nu7 s PHE 227 Ca 0.50 0.14 0.07 0.00 -0.60 0.00 0.00 56.93 57.05 1nu7 s PHE 227 Cb -0.24 -1.76 -0.02 0.00 0.51 0.00 0.00 43.02 41.51 1nu7 s PHE 227 CO 0.31 0.44 -0.20 0.71 0.70 0.00 0.00 175.22 177.18 1nu7 s TYR 228 N -0.89 1.75 0.06 0.36 1.51 0.18 -1.57 117.35 118.74 1nu7 s TYR 228 Ca 0.14 -0.37 -0.31 0.00 -1.01 0.00 0.00 57.07 55.52 1nu7 s TYR 228 Cb -0.11 -1.04 -0.06 0.00 -0.11 0.00 0.00 41.96 40.63 1nu7 s TYR 228 CO 0.03 0.08 1.24 0.99 -1.11 0.00 0.00 175.55 176.78 1nu7 s THR 229 N -0.79 3.90 -0.63 -0.71 2.01 0.18 -1.44 115.64 118.16 1nu7 s THR 229 Ca 0.07 1.36 -0.27 0.00 0.31 0.00 0.00 61.69 63.15 1nu7 s THR 229 Cb -0.09 -3.87 0.02 0.00 0.01 0.00 0.00 72.50 68.57 1nu7 s THR 229 CO 0.02 0.10 1.38 -2.28 -0.69 0.00 0.00 174.62 173.15 1nu7 s HIS 230 N 1.17 2.27 0.16 4.92 2.46 0.29 -2.09 115.29 124.46 1nu7 s HIS 230 Ca 0.60 0.33 -0.15 0.00 0.47 0.00 0.00 55.06 56.31 1nu7 s HIS 230 Cb -0.31 -4.46 0.05 0.00 -0.13 0.00 0.00 32.58 27.73 1nu7 s HIS 230 CO 0.29 -1.99 1.81 0.28 -2.47 0.00 0.00 174.74 172.66 1nu7 h VAL 231 N 6.29 1.14 -0.66 0.89 2.07 -1.63 -2.86 116.25 121.49 1nu7 h VAL 231 Ca -0.27 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 66.93 1nu7 h VAL 231 Cb 1.08 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 1nu7 h VAL 231 CO 1.22 0.14 0.27 0.15 0.02 0.00 0.00 177.57 179.37 1nu7 h PHE 232 N 0.66 0.96 0.00 1.57 3.57 -1.86 -1.38 116.94 120.46 1nu7 h PHE 232 Ca 0.18 -0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 1nu7 h PHE 232 Cb -0.04 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 38.40 1nu7 h PHE 232 CO -0.03 0.73 -0.00 0.00 -2.23 0.00 0.00 178.31 176.78 1nu7 h ARG 233 N 0.94 0.00 -0.19 1.11 2.47 -1.88 -2.24 114.38 114.60 1nu7 h ARG 233 Ca 0.22 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.94 1nu7 h ARG 233 Cb 0.17 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.49 1nu7 h ARG 233 CO -0.02 0.00 0.00 1.28 0.56 0.00 0.00 179.97 181.79 1nu7 n LEU 234 N -3.10 2.45 0.27 3.04 4.77 -0.61 -4.72 117.00 119.09 1nu7 n LEU 234 Ca -0.02 -1.82 0.10 0.00 -0.03 0.00 0.00 56.01 54.23 1nu7 n LEU 234 Cb 0.14 -0.13 0.70 0.00 -2.33 0.00 0.00 43.42 41.80 1nu7 n LEU 234 CO 0.22 0.60 1.07 0.50 -1.33 0.00 0.00 177.39 178.45 1nu7 h LYS 235 N 1.38 0.00 -0.29 3.23 1.63 -0.68 -2.32 116.57 119.52 1nu7 h LYS 235 Ca 0.00 0.00 -0.08 0.00 -0.85 0.00 0.00 60.65 59.72 1nu7 h LYS 235 Cb 0.59 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.22 1nu7 h LYS 235 CO 0.00 0.02 -0.11 0.87 -3.45 0.00 0.00 179.45 176.77 1nu7 h LYS 236 N 0.00 0.59 -0.29 1.90 1.57 -1.84 -1.47 116.57 117.02 1nu7 h LYS 236 Ca -0.00 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.53 1nu7 h LYS 236 Cb 0.03 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1nu7 h LYS 236 CO 0.00 0.81 0.15 2.35 -0.57 0.00 0.00 179.45 182.19 1nu7 h TRP 237 N 0.34 0.41 -0.32 -1.35 7.01 -1.82 -0.36 115.95 119.85 1nu7 h TRP 237 Ca 0.07 -0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.12 1nu7 h TRP 237 Cb 0.62 -0.13 -0.07 0.00 -2.10 0.00 0.00 29.16 27.48 1nu7 h TRP 237 CO 0.06 0.35 -0.11 0.82 -2.79 0.00 0.00 178.44 176.76 1nu7 h ILE 238 N 0.35 0.61 -0.57 2.65 2.04 -1.30 -0.83 117.51 120.45 1nu7 h ILE 238 Ca 0.10 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.94 1nu7 h ILE 238 Cb 0.08 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 1nu7 h ILE 238 CO -0.02 0.00 0.28 1.56 0.00 0.00 0.00 178.15 179.97 1nu7 h GLN 239 N -0.05 0.81 -0.18 2.37 4.20 -1.07 -1.09 115.11 120.10 1nu7 h GLN 239 Ca 0.16 -0.12 0.01 0.00 0.06 0.00 0.00 58.65 58.76 1nu7 h GLN 239 Cb 0.29 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 1nu7 h GLN 239 CO -0.36 0.66 0.09 0.87 -0.67 0.00 0.00 178.83 179.42 1nu7 h LYS 240 N 0.77 0.18 0.24 1.46 1.57 -0.49 -0.62 116.57 119.69 1nu7 h LYS 240 Ca 0.20 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1nu7 h LYS 240 Cb 0.11 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 1nu7 h LYS 240 CO -0.03 0.12 -0.26 0.28 -0.57 0.00 0.00 179.45 179.00 1nu7 h VAL 241 N 0.19 0.45 -0.54 0.50 2.07 -1.00 -0.20 116.25 117.71 1nu7 h VAL 241 Ca 0.07 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.59 1nu7 h VAL 241 Cb 0.02 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.21 1nu7 h VAL 241 CO -0.05 0.00 0.32 0.40 0.02 0.00 0.00 177.57 178.26 1nu7 h ILE 242 N -0.53 1.16 0.00 4.57 2.04 -1.02 0.38 117.51 124.10 1nu7 h ILE 242 Ca -0.00 -0.36 -0.14 0.00 1.00 0.00 0.00 64.86 65.36 1nu7 h ILE 242 Cb 0.50 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 1nu7 h ILE 242 CO -0.07 0.17 -0.66 0.44 0.00 0.00 0.00 178.15 178.03 1nu7 h ASP 243 N 0.74 0.00 0.88 1.72 3.45 -0.91 -0.98 116.42 121.33 1nu7 h ASP 243 Ca 0.20 0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.63 1nu7 h ASP 243 Cb -0.02 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 38.75 1nu7 h ASP 243 CO -0.04 0.66 -1.14 1.67 -1.57 0.00 0.00 179.24 178.82 1nu7 n GLN 244 N -3.30 0.61 -0.14 3.56 7.27 -0.11 -4.37 117.38 120.91 1nu7 n GLN 244 Ca 0.01 0.12 0.04 0.00 0.07 0.00 0.00 57.00 57.24 1nu7 n GLN 244 Cb 0.78 -1.80 0.05 0.00 2.41 0.00 0.00 30.24 31.68 1nu7 n GLN 244 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 1nu7 n PHE 245 N -2.69 0.00 0.80 3.69 3.72 0.09 -5.07 117.46 118.00 1nu7 n PHE 245 Ca -0.02 -0.50 0.06 0.00 -0.05 0.00 0.00 57.45 56.95 1nu7 n PHE 245 Cb 0.60 -0.08 0.38 0.00 -0.94 0.00 0.00 39.48 39.44 1nu7 n PHE 245 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12