#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 4.89 -1.47 1.39 1.01 0.06 -4.12 120.40 122.16 1nu7 s VAL 17 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 61.98 61.94 1nu7 s VAL 17 Cb 0.00 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.21 1nu7 s VAL 17 CO 0.00 0.51 0.40 1.21 0.00 0.00 0.00 175.10 177.22 1nu7 n GLU 18 N 3.04 -3.62 0.00 2.72 4.07 -1.26 -2.56 120.64 123.04 1nu7 n GLU 18 Ca -0.17 0.86 0.00 0.00 -0.06 0.00 0.00 57.16 57.78 1nu7 n GLU 18 Cb 0.53 -5.50 0.00 0.00 -0.06 0.00 0.00 31.44 26.41 1nu7 n GLU 18 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1nu7 n GLY 19 N -1.33 4.34 3.45 8.31 0.00 -1.26 -4.73 105.19 113.96 1nu7 n GLY 19 Ca -0.14 -1.99 -0.10 0.00 0.00 0.00 0.00 46.02 43.79 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 -0.07 0.01 0.26 1.61 1.04 0.35 -4.89 113.70 112.02 1nu7 s SER 20 Ca 0.00 -1.10 -0.31 0.00 0.48 0.00 0.00 55.95 55.02 1nu7 s SER 20 Cb 0.00 0.51 -0.12 0.00 0.10 0.00 0.00 66.02 66.51 1nu7 s SER 20 CO 0.00 -1.03 1.60 0.47 0.98 0.00 0.00 173.24 175.26 1nu7 n ASP 21 N -0.35 3.74 -4.81 7.02 9.92 -1.26 -0.68 116.55 130.13 1nu7 n ASP 21 Ca -0.00 1.12 -0.33 0.00 -0.53 0.00 0.00 54.79 55.05 1nu7 n ASP 21 Cb 0.63 -1.56 -0.02 0.00 -0.64 0.00 0.00 41.12 39.53 1nu7 n ASP 21 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1nu7 s ALA 22 N 0.28 2.86 0.35 2.24 0.00 0.19 -4.82 121.76 122.85 1nu7 s ALA 22 Ca 0.67 0.41 -0.18 0.00 0.00 0.00 0.00 51.96 52.87 1nu7 s ALA 22 Cb -0.52 -3.21 -0.10 0.00 0.00 0.00 0.00 23.12 19.29 1nu7 s ALA 22 CO 0.45 -0.51 0.81 -1.21 0.00 0.00 0.00 175.76 175.30 1nu7 s GLU 23 N -3.79 4.13 0.03 0.00 2.02 -1.26 -4.91 118.70 114.92 1nu7 s GLU 23 Ca 0.64 0.86 -0.35 0.00 0.02 0.00 0.00 54.97 56.14 1nu7 s GLU 23 Cb -0.15 -2.41 -0.13 0.00 0.10 0.00 0.00 34.13 31.54 1nu7 s GLU 23 CO 0.30 0.13 1.68 -0.89 0.02 0.00 0.00 175.26 176.50 1nu7 n ILE 24 N -0.30 0.24 -1.10 -1.63 -0.00 -1.26 -1.76 119.36 113.55 1nu7 n ILE 24 Ca 0.04 -0.04 -0.03 0.00 -0.00 0.00 0.00 62.75 62.71 1nu7 n ILE 24 Cb 0.53 -1.58 -0.01 0.00 -0.00 0.00 0.00 39.64 38.58 1nu7 n ILE 24 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1nu7 n GLY 25 N 3.76 0.61 0.14 7.39 0.00 -1.26 -4.90 105.19 110.94 1nu7 n GLY 25 Ca 0.20 -0.33 0.13 0.00 0.00 0.00 0.00 46.02 46.01 1nu7 n GLY 25 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1nu7 h MET 26 N 0.35 0.00 -1.45 1.61 -1.53 -1.72 -3.32 114.93 108.87 1nu7 h MET 26 Ca -0.07 0.00 -0.44 0.00 -3.44 0.00 0.00 59.70 55.75 1nu7 h MET 26 Cb 0.41 0.00 -0.33 0.00 -0.55 0.00 0.00 31.60 31.13 1nu7 h MET 26 CO 0.10 0.00 -0.96 0.45 0.14 0.00 0.00 176.91 176.64 1nu7 n SER 27 N -2.38 -0.35 0.13 1.39 2.88 -1.26 -4.97 113.62 109.06 1nu7 n SER 27 Ca 0.03 -3.04 0.09 0.00 -1.33 0.00 0.00 58.87 54.62 1nu7 n SER 27 Cb 0.32 0.07 0.47 0.00 -0.75 0.00 0.00 64.21 64.32 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 0.86 0.11 0.00 -1.46 -0.04 -1.25 -0.85 135.00 132.37 1nu7 n PRO 28 Ca 0.19 0.61 0.13 0.00 -0.04 0.00 0.00 63.50 64.39 1nu7 n PRO 28 Cb 0.62 -1.89 0.42 0.00 -0.04 0.00 0.00 33.50 32.60 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 -2.11 0.00 -1.77 0.54 2.14 -0.93 -1.77 117.44 113.53 1nu7 n TRP 29 Ca -0.01 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.14 1nu7 n TRP 29 Cb 0.05 -0.02 -0.02 0.00 -0.81 0.00 0.00 31.31 30.51 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 -2.08 4.13 0.05 -2.67 2.00 -0.03 -0.63 119.66 120.42 1nu7 s GLN 30 Ca 0.34 2.57 0.06 0.00 -2.00 0.00 0.00 55.36 56.33 1nu7 s GLN 30 Cb 0.21 -3.06 -0.02 0.00 0.80 0.00 0.00 33.01 30.93 1nu7 s GLN 30 CO 0.36 -0.68 -0.16 0.08 -0.50 0.00 0.00 175.29 174.39 1nu7 s VAL 31 N 0.59 1.27 -0.22 1.34 1.01 -0.16 -3.92 120.40 120.31 1nu7 s VAL 31 Ca 0.69 -1.13 -0.06 0.00 0.00 0.00 0.00 61.98 61.47 1nu7 s VAL 31 Cb -0.48 -1.15 -0.02 0.00 0.00 0.00 0.00 36.38 34.72 1nu7 s VAL 31 CO 0.40 0.00 0.02 -0.32 0.00 0.00 0.00 175.10 175.20 1nu7 s MET 32 N -1.31 3.60 -0.22 2.72 1.75 -0.23 -1.28 119.30 124.33 1nu7 s MET 32 Ca 0.03 -0.52 -0.17 0.00 -1.25 0.00 0.00 55.69 53.78 1nu7 s MET 32 Cb -0.09 -3.16 -0.03 0.00 2.84 0.00 0.00 34.83 34.39 1nu7 s MET 32 CO 0.02 -0.09 0.46 -1.17 -0.65 0.00 0.00 175.02 173.59 1nu7 s LEU 33 N 1.29 4.11 -0.12 4.11 2.96 -0.27 -1.32 118.68 129.44 1nu7 s LEU 33 Ca 0.04 0.55 0.03 0.00 -0.22 0.00 0.00 54.13 54.52 1nu7 s LEU 33 Cb -0.15 -2.61 0.01 0.00 0.50 0.00 0.00 46.19 43.95 1nu7 s LEU 33 CO 0.02 -0.18 -0.20 0.12 -1.32 0.00 0.00 176.35 174.79 1nu7 s PHE 34 N 1.75 2.38 -0.07 5.38 5.36 -0.03 -0.89 117.98 131.87 1nu7 s PHE 34 Ca 0.21 -1.10 -0.30 0.00 -0.96 0.00 0.00 56.93 54.78 1nu7 s PHE 34 Cb -0.15 -1.64 -0.02 0.00 -0.34 0.00 0.00 43.02 40.87 1nu7 s PHE 34 CO 0.09 -0.50 1.00 0.50 -1.46 0.00 0.00 175.22 174.84 1nu7 s ARG 35 N 0.72 4.47 0.20 10.12 3.52 0.07 -0.93 118.95 137.11 1nu7 s ARG 35 Ca -0.11 1.40 -0.05 0.00 -0.13 0.00 0.00 55.73 56.84 1nu7 s ARG 35 Cb -0.16 -3.51 0.13 0.00 -1.56 0.00 0.00 34.95 29.85 1nu7 s ARG 35 CO 0.02 -0.22 1.58 0.87 -0.81 0.00 0.00 175.30 176.74 1nu7 h LYS 36 N 6.99 0.78 -2.00 5.12 1.57 -1.62 -2.39 116.57 125.01 1nu7 h LYS 36 Ca -0.35 -0.35 0.08 0.00 -1.87 0.00 0.00 60.65 58.16 1nu7 h LYS 36 Cb 1.17 -0.02 -0.20 0.00 0.08 0.00 0.00 32.23 33.27 1nu7 h LYS 36 CO 0.82 0.98 -0.13 0.45 -0.57 0.00 0.00 179.45 180.99 1nu7 s SER 36 N -6.79 -1.14 0.21 0.86 0.15 -1.26 -3.10 113.70 102.63 1nu7 s SER 36 Ca -0.09 1.57 -0.30 0.00 0.70 0.00 0.00 55.95 57.83 1nu7 s SER 36 Cb 0.12 2.29 -0.09 0.00 -1.71 0.00 0.00 66.02 66.63 1nu7 s SER 36 CO 0.85 -0.22 1.34 -2.16 1.20 0.00 0.00 173.24 174.24 1nu7 s PRO 37 N 2.88 4.36 0.08 5.44 0.04 -1.26 -5.07 135.00 141.47 1nu7 s PRO 37 Ca -0.06 2.11 -0.36 0.00 0.04 0.00 0.00 61.00 62.72 1nu7 s PRO 37 Cb -0.12 -3.18 -0.18 0.00 0.04 0.00 0.00 34.50 31.06 1nu7 s PRO 37 CO -0.19 -0.28 1.02 1.04 0.04 0.00 0.00 177.00 178.62 1nu7 n GLN 38 N 2.55 0.33 -3.64 4.56 6.02 -1.18 -4.84 117.38 121.18 1nu7 n GLN 38 Ca 0.06 0.12 -0.05 0.00 -0.01 0.00 0.00 57.00 57.12 1nu7 n GLN 38 Cb 0.42 -1.55 -0.07 0.00 1.02 0.00 0.00 30.24 30.07 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 -0.19 0.47 -0.36 -1.09 2.12 -0.90 -4.98 118.70 113.77 1nu7 s GLU 39 Ca 0.82 0.72 -0.29 0.00 0.36 0.00 0.00 54.97 56.58 1nu7 s GLU 39 Cb -1.10 0.14 0.01 0.00 0.26 0.00 0.00 34.13 33.44 1nu7 s GLU 39 CO 0.55 -0.08 1.33 -1.17 -0.54 0.00 0.00 175.26 175.34 1nu7 s LEU 40 N 1.04 3.75 -0.15 2.70 0.20 -1.26 -0.75 118.68 124.19 1nu7 s LEU 40 Ca -0.05 1.00 -0.21 0.00 0.69 0.00 0.00 54.13 55.55 1nu7 s LEU 40 Cb -0.04 -3.54 -0.24 0.00 -0.43 0.00 0.00 46.19 41.94 1nu7 s LEU 40 CO -0.13 -1.23 0.48 -0.07 -0.29 0.00 0.00 176.35 175.11 1nu7 h LEU 41 N 11.42 0.14 -7.97 -0.68 3.38 -1.38 -3.48 115.31 116.74 1nu7 h LEU 41 Ca -0.26 -0.76 0.05 0.00 0.09 0.00 0.00 57.88 57.00 1nu7 h LEU 41 Cb 1.10 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 1nu7 h LEU 41 CO 1.06 1.42 0.37 0.00 0.09 0.00 0.00 178.44 181.38 1nu7 s GLY 43 N -3.15 1.73 0.12 0.00 0.00 0.33 -1.11 107.32 105.25 1nu7 s GLY 43 Ca 0.17 -2.02 -0.25 0.00 0.00 0.00 0.00 44.72 42.62 1nu7 s GLY 43 CO 0.09 -1.49 1.10 0.00 0.00 0.00 0.00 173.10 172.79 1nu7 s ALA 44 N -2.88 -1.82 0.02 3.20 0.00 -0.41 -3.98 121.76 115.89 1nu7 s ALA 44 Ca 0.64 -0.07 0.01 0.00 0.00 0.00 0.00 51.96 52.54 1nu7 s ALA 44 Cb -0.05 0.71 -0.02 0.00 0.00 0.00 0.00 23.12 23.76 1nu7 s ALA 44 CO 0.42 -1.07 -0.04 -1.54 0.00 0.00 0.00 175.76 173.53 1nu7 s SER 45 N -3.33 0.35 -0.22 0.00 1.04 0.55 -0.99 113.70 111.10 1nu7 s SER 45 Ca 0.20 -0.41 -0.20 0.00 0.48 0.00 0.00 55.95 56.02 1nu7 s SER 45 Cb -0.01 0.06 -0.02 0.00 0.10 0.00 0.00 66.02 66.15 1nu7 s SER 45 CO 0.03 -0.21 0.60 -0.22 0.98 0.00 0.00 173.24 174.42 1nu7 s LEU 46 N -1.19 4.11 0.00 2.42 0.20 0.19 -0.77 118.68 123.65 1nu7 s LEU 46 Ca -0.11 0.75 0.07 0.00 0.69 0.00 0.00 54.13 55.53 1nu7 s LEU 46 Cb -0.08 -2.84 0.03 0.00 -0.43 0.00 0.00 46.19 42.88 1nu7 s LEU 46 CO -0.01 -0.29 0.64 2.30 -0.29 0.00 0.00 176.35 178.71 1nu7 n ILE 47 N 4.85 0.00 -3.94 6.68 -5.35 -0.76 -1.79 119.36 119.05 1nu7 n ILE 47 Ca -0.02 -0.47 0.02 0.00 -0.27 0.00 0.00 62.75 62.01 1nu7 n ILE 47 Cb 0.50 1.12 0.01 0.00 -1.74 0.00 0.00 39.64 39.53 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 -0.84 -0.00 0.00 7.28 1.04 -1.21 -4.80 113.70 115.17 1nu7 s SER 48 Ca 0.07 -0.24 0.16 0.00 0.48 0.00 0.00 55.95 56.42 1nu7 s SER 48 Cb 0.06 0.18 0.77 0.00 0.10 0.00 0.00 66.02 67.13 1nu7 s SER 48 CO 0.13 -0.36 1.46 -0.90 0.98 0.00 0.00 173.24 174.55 1nu7 n ASP 49 N -1.02 0.00 0.00 7.02 5.75 -1.26 -3.39 116.55 123.65 1nu7 n ASP 49 Ca 0.02 0.15 0.00 0.00 -0.01 0.00 0.00 54.79 54.95 1nu7 n ASP 49 Cb 0.59 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 40.35 1nu7 n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1nu7 n ARG 50 N -1.33 3.47 -4.92 0.11 5.12 -1.26 0.24 116.66 118.08 1nu7 n ARG 50 Ca 0.07 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.69 1nu7 n ARG 50 Cb 0.14 -0.40 -0.15 0.00 -1.16 0.00 0.00 32.46 30.89 1nu7 n ARG 50 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1nu7 s TRP 51 N -0.67 2.20 -0.04 -1.55 0.52 -1.22 -0.73 118.94 117.45 1nu7 s TRP 51 Ca 0.00 -0.41 0.03 0.00 0.02 0.00 0.00 56.10 55.74 1nu7 s TRP 51 Cb 0.00 -1.34 0.00 0.00 -1.15 0.00 0.00 33.47 30.99 1nu7 s TRP 51 CO 0.00 0.09 -0.11 0.08 0.02 0.00 0.00 176.95 177.03 1nu7 s VAL 52 N -0.76 0.95 -0.08 4.03 1.01 -0.33 -1.82 120.40 123.39 1nu7 s VAL 52 Ca 0.10 -0.44 -0.03 0.00 0.00 0.00 0.00 61.98 61.62 1nu7 s VAL 52 Cb -0.10 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 1nu7 s VAL 52 CO 0.01 0.29 0.06 -0.22 0.00 0.00 0.00 175.10 175.25 1nu7 s LEU 53 N 0.26 3.90 0.00 3.92 2.96 0.05 -0.54 118.68 129.23 1nu7 s LEU 53 Ca -0.05 0.25 -0.05 0.00 -0.22 0.00 0.00 54.13 54.06 1nu7 s LEU 53 Cb -0.10 -1.98 0.02 0.00 0.50 0.00 0.00 46.19 44.62 1nu7 s LEU 53 CO 0.01 0.37 0.33 1.07 -1.32 0.00 0.00 176.35 176.81 1nu7 n THR 54 N 1.92 0.00 -3.39 3.68 5.66 -0.66 -0.33 114.28 121.16 1nu7 n THR 54 Ca -0.18 -0.68 -0.35 0.00 -3.05 0.00 0.00 64.05 59.80 1nu7 n THR 54 Cb 0.54 0.52 -0.06 0.00 -1.55 0.00 0.00 70.33 69.79 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 -1.82 3.59 0.15 1.79 0.00 -1.26 -1.47 121.76 122.73 1nu7 s ALA 55 Ca 0.11 -0.18 -0.13 0.00 0.00 0.00 0.00 51.96 51.76 1nu7 s ALA 55 Cb -0.02 -2.49 0.03 0.00 0.00 0.00 0.00 23.12 20.65 1nu7 s ALA 55 CO 0.08 0.47 1.67 0.00 0.00 0.00 0.00 175.76 177.99 1nu7 h ALA 56 N 3.36 0.67 0.00 0.00 0.00 -1.70 -2.82 119.26 118.76 1nu7 h ALA 56 Ca -0.48 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.24 1nu7 h ALA 56 Cb 1.19 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1nu7 h ALA 56 CO 0.66 0.33 0.00 -2.39 0.00 0.00 0.00 179.25 177.86 1nu7 n HIS 57 N -4.48 0.25 0.25 0.00 1.44 -1.26 -0.53 115.22 110.88 1nu7 n HIS 57 Ca 0.02 0.12 0.12 0.00 -2.01 0.00 0.00 57.72 55.97 1nu7 n HIS 57 Cb 0.20 -0.69 0.19 0.00 0.12 0.00 0.00 29.99 29.80 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 -3.02 1.22 -3.65 0.00 4.77 0.30 -4.86 117.00 111.76 1nu7 n LEU 59 Ca 0.04 -0.04 -0.22 0.00 -0.03 0.00 0.00 56.01 55.77 1nu7 n LEU 59 Cb 0.52 -0.05 -0.18 0.00 -2.33 0.00 0.00 43.42 41.39 1nu7 n LEU 59 CO 0.34 0.51 -0.34 -0.22 -1.33 0.00 0.00 177.39 176.35 1nu7 s LEU 60 N -5.36 0.20 0.23 2.23 2.96 -0.02 -0.63 118.68 118.29 1nu7 s LEU 60 Ca -0.13 -0.13 -0.19 0.00 -0.22 0.00 0.00 54.13 53.46 1nu7 s LEU 60 Cb 0.05 -0.17 0.02 0.00 0.50 0.00 0.00 46.19 46.59 1nu7 s LEU 60 CO 0.47 -0.28 0.60 -0.47 -1.32 0.00 0.00 176.35 175.35 1nu7 s TYR 60 N 2.16 -0.13 0.00 5.38 5.04 0.19 -4.02 117.35 125.97 1nu7 s TYR 60 Ca 0.04 -0.25 0.00 0.00 -2.44 0.00 0.00 57.07 54.42 1nu7 s TYR 60 Cb -0.13 0.51 0.00 0.00 0.35 0.00 0.00 41.96 42.68 1nu7 s TYR 60 CO -0.05 -1.05 0.00 -2.30 -1.34 0.00 0.00 175.55 170.81 1nu7 n PRO 60 N -0.40 0.00 -0.18 4.97 -0.02 -1.26 -2.61 135.00 135.50 1nu7 n PRO 60 Ca -0.07 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.50 1nu7 n PRO 60 Cb 0.61 0.00 0.14 0.00 -0.02 0.00 0.00 33.50 34.24 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 0.00 -3.91 6.00 8.01 -1.26 -4.98 117.44 121.31 1nu7 n TRP 60 Ca 0.00 -1.03 -0.29 0.00 -1.31 0.00 0.00 57.50 54.87 1nu7 n TRP 60 Cb 0.00 -0.16 0.02 0.00 -2.01 0.00 0.00 31.31 29.16 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 -1.31 -3.59 -4.43 -0.99 2.03 -1.19 -4.95 116.55 102.12 1nu7 n ASP 60 Ca 0.16 -0.83 -0.34 0.00 0.52 0.00 0.00 54.79 54.29 1nu7 n ASP 60 Cb 0.65 -3.74 -0.13 0.00 -0.72 0.00 0.00 41.12 37.19 1nu7 n ASP 60 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1nu7 s LYS 60 N -6.52 3.56 -0.48 -0.67 2.20 -1.07 -5.01 119.74 111.75 1nu7 s LYS 60 Ca 0.49 -0.56 0.04 0.00 -0.36 0.00 0.00 55.97 55.58 1nu7 s LYS 60 Cb -0.25 -2.96 0.20 0.00 -1.51 0.00 0.00 37.83 33.31 1nu7 s LYS 60 CO 0.84 0.07 0.81 1.21 -0.36 0.00 0.00 175.35 177.93 1nu7 s ASN 60 N 0.80 -1.18 0.17 1.43 3.04 -1.21 -0.64 114.94 117.35 1nu7 s ASN 60 Ca -0.01 -1.40 -0.24 0.00 0.04 0.00 0.00 52.86 51.25 1nu7 s ASN 60 Cb -0.14 1.54 -0.08 0.00 -1.54 0.00 0.00 41.25 41.03 1nu7 s ASN 60 CO 0.02 -0.04 0.76 -0.36 -3.04 0.00 0.00 177.10 174.44 1nu7 s PHE 60 N 0.91 3.87 0.48 0.43 0.08 0.19 -5.01 117.98 118.94 1nu7 s PHE 60 Ca 0.28 1.59 0.07 0.00 0.12 0.00 0.00 56.93 59.00 1nu7 s PHE 60 Cb 0.03 -2.74 0.01 0.00 -0.57 0.00 0.00 43.02 39.75 1nu7 s PHE 60 CO -0.06 0.49 0.42 0.95 -0.10 0.00 0.00 175.22 176.92 1nu7 s THR 60 N -1.20 2.20 0.21 0.64 -4.23 -1.26 -4.90 115.64 107.10 1nu7 s THR 60 Ca 0.37 -1.39 -0.11 0.00 -1.18 0.00 0.00 61.69 59.38 1nu7 s THR 60 Cb -0.22 -2.59 0.18 0.00 1.34 0.00 0.00 72.50 71.21 1nu7 s THR 60 CO 0.25 0.00 1.67 -0.33 -0.54 0.00 0.00 174.62 175.68 1nu7 h GLU 61 N 0.86 0.14 0.00 3.99 3.07 -1.94 -1.94 114.58 118.75 1nu7 h GLU 61 Ca -0.39 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.47 1nu7 h GLU 61 Cb 1.28 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 29.16 1nu7 h GLU 61 CO 0.56 0.09 0.00 -0.91 -1.40 0.00 0.00 179.01 177.36 1nu7 h ASN 62 N 0.14 0.00 1.19 1.42 2.35 -1.96 -2.57 115.58 116.15 1nu7 h ASN 62 Ca 0.31 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.06 1nu7 h ASN 62 Cb 0.50 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.87 1nu7 h ASN 62 CO -0.49 0.00 -0.12 0.47 -1.65 0.00 0.00 177.43 175.64 1nu7 n ASP 63 N -2.37 0.54 -4.46 5.81 8.00 -0.73 -4.93 116.55 118.41 1nu7 n ASP 63 Ca 0.00 0.43 -0.22 0.00 0.71 0.00 0.00 54.79 55.72 1nu7 n ASP 63 Cb 0.16 -0.51 -0.11 0.00 -0.02 0.00 0.00 41.12 40.65 1nu7 n ASP 63 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1nu7 s LEU 64 N -3.94 2.24 0.20 0.64 1.43 -0.97 -1.62 118.68 116.66 1nu7 s LEU 64 Ca 0.11 -1.37 -0.10 0.00 -1.03 0.00 0.00 54.13 51.74 1nu7 s LEU 64 Cb 0.15 -0.43 -0.01 0.00 0.03 0.00 0.00 46.19 45.93 1nu7 s LEU 64 CO 0.60 -0.59 0.36 -1.48 0.23 0.00 0.00 176.35 175.47 1nu7 s LEU 65 N -3.50 0.67 -0.04 1.79 0.05 -0.11 -4.53 118.68 113.01 1nu7 s LEU 65 Ca 0.36 -0.92 0.07 0.00 0.05 0.00 0.00 54.13 53.69 1nu7 s LEU 65 Cb 0.09 1.40 -0.01 0.00 -2.05 0.00 0.00 46.19 45.61 1nu7 s LEU 65 CO 0.16 -0.99 -0.25 -0.69 -0.55 0.00 0.00 176.35 174.02 1nu7 s VAL 66 N -4.00 2.03 -0.20 1.48 1.01 -0.62 -0.85 120.40 119.25 1nu7 s VAL 66 Ca 0.21 -1.07 0.01 0.00 0.00 0.00 0.00 61.98 61.13 1nu7 s VAL 66 Cb 0.02 -1.70 0.03 0.00 0.00 0.00 0.00 36.38 34.73 1nu7 s VAL 66 CO 0.04 0.57 -0.17 -0.13 0.00 0.00 0.00 175.10 175.41 1nu7 s ARG 67 N -0.36 2.74 0.14 2.72 0.52 -0.44 -0.56 118.95 123.71 1nu7 s ARG 67 Ca 0.02 -0.92 0.09 0.00 -0.52 0.00 0.00 55.73 54.40 1nu7 s ARG 67 Cb -0.12 -2.60 -0.04 0.00 0.52 0.00 0.00 34.95 32.71 1nu7 s ARG 67 CO 0.02 -0.30 -0.14 0.42 0.02 0.00 0.00 175.30 175.31 1nu7 s ILE 68 N 1.27 3.02 0.00 1.52 1.01 0.12 -1.06 121.20 127.08 1nu7 s ILE 68 Ca 0.02 -1.53 0.00 0.00 0.00 0.00 0.00 60.65 59.13 1nu7 s ILE 68 Cb -0.15 -2.43 0.00 0.00 0.01 0.00 0.00 42.46 39.89 1nu7 s ILE 68 CO -0.11 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.47 1nu7 n GLY 69 N 0.52 0.43 3.87 6.18 0.00 -1.25 -0.33 105.19 114.61 1nu7 n GLY 69 Ca -0.14 -0.72 -0.31 0.00 0.00 0.00 0.00 46.02 44.86 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 -1.32 3.81 0.10 1.61 1.02 -1.26 -4.30 119.74 119.40 1nu7 s LYS 70 Ca 0.00 0.55 0.00 0.00 0.02 0.00 0.00 55.97 56.54 1nu7 s LYS 70 Cb 0.00 -2.35 0.00 0.00 -0.52 0.00 0.00 37.83 34.96 1nu7 s LYS 70 CO 0.00 -0.07 0.00 1.58 -0.92 0.00 0.00 175.35 175.94 1nu7 n HIS 71 N -1.32 -0.19 -3.57 3.18 -0.00 -1.26 -4.92 115.22 107.14 1nu7 n HIS 71 Ca 0.03 0.03 -0.37 0.00 -0.00 0.00 0.00 57.72 57.41 1nu7 n HIS 71 Cb 0.54 0.05 -0.07 0.00 -0.00 0.00 0.00 29.99 30.51 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 -5.78 6.55 0.16 0.26 0.15 -1.26 -1.68 113.70 112.10 1nu7 s SER 72 Ca 0.00 0.65 0.05 0.00 0.70 0.00 0.00 55.95 57.34 1nu7 s SER 72 Cb 0.00 -2.19 -0.03 0.00 -1.71 0.00 0.00 66.02 62.09 1nu7 s SER 72 CO 0.00 0.21 1.36 -0.09 1.20 0.00 0.00 173.24 175.93 1nu7 h ARG 73 N 5.82 0.11 0.00 5.44 2.43 0.11 -3.37 114.38 124.93 1nu7 h ARG 73 Ca -0.46 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 58.57 1nu7 h ARG 73 Cb 1.19 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 1nu7 h ARG 73 CO 0.69 0.94 0.00 0.25 -1.51 0.00 0.00 179.97 180.33 1nu7 n THR 74 N -3.58 0.93 -3.90 0.20 -2.24 -1.26 -4.80 114.28 99.63 1nu7 n THR 74 Ca -0.03 0.23 -0.09 0.00 -2.27 0.00 0.00 64.05 61.90 1nu7 n THR 74 Cb 0.83 -0.97 -0.08 0.00 -2.10 0.00 0.00 70.33 68.02 1nu7 n THR 74 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1nu7 s ARG 75 N -2.99 0.77 0.04 -0.78 1.81 -1.26 -5.12 118.95 111.41 1nu7 s ARG 75 Ca 0.08 -0.96 -0.30 0.00 -1.72 0.00 0.00 55.73 52.83 1nu7 s ARG 75 Cb 0.10 0.30 -0.05 0.00 -0.45 0.00 0.00 34.95 34.86 1nu7 s ARG 75 CO 0.28 -0.22 1.12 -0.47 -0.68 0.00 0.00 175.30 175.33 1nu7 s TYR 76 N -3.64 3.51 -0.72 -0.53 5.04 -1.26 -4.89 117.35 114.85 1nu7 s TYR 76 Ca 0.04 1.44 -0.05 0.00 -2.44 0.00 0.00 57.07 56.05 1nu7 s TYR 76 Cb 0.04 -3.32 0.19 0.00 0.35 0.00 0.00 41.96 39.22 1nu7 s TYR 76 CO -0.10 -0.84 0.58 -1.21 -1.34 0.00 0.00 175.55 172.64 1nu7 s GLU 77 N 1.09 2.94 0.59 4.97 2.02 -1.26 -4.98 118.70 124.07 1nu7 s GLU 77 Ca 0.56 -2.65 0.30 0.00 0.02 0.00 0.00 54.97 53.20 1nu7 s GLU 77 Cb -0.26 -3.94 1.81 0.00 0.10 0.00 0.00 34.13 31.85 1nu7 s GLU 77 CO 0.28 -1.21 2.25 0.07 0.02 0.00 0.00 175.26 176.67 1nu7 h ARG 77 N 7.03 0.00 0.00 1.61 0.11 -1.94 0.74 114.38 121.93 1nu7 h ARG 77 Ca 0.04 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.11 1nu7 h ARG 77 Cb 0.95 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.03 1nu7 h ARG 77 CO 0.74 0.00 -0.56 -0.91 0.10 0.00 0.00 179.97 179.34 1nu7 h ASN 78 N 0.00 0.00 0.00 0.08 2.35 -2.01 -3.40 115.58 112.60 1nu7 h ASN 78 Ca 0.01 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.74 1nu7 h ASN 78 Cb 0.03 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.40 1nu7 h ASN 78 CO -0.00 0.04 -1.06 2.30 -1.65 0.00 0.00 177.43 177.06 1nu7 n ILE 79 N -2.89 0.06 -2.34 2.81 -5.35 -1.08 -5.07 119.36 105.50 1nu7 n ILE 79 Ca 0.01 -0.04 -0.38 0.00 -0.27 0.00 0.00 62.75 62.08 1nu7 n ILE 79 Cb 0.56 -0.93 -0.02 0.00 -1.74 0.00 0.00 39.64 37.51 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 -2.02 4.11 -0.05 6.28 2.12 0.23 -4.59 118.70 124.78 1nu7 s GLU 80 Ca -0.00 1.80 0.01 0.00 0.36 0.00 0.00 54.97 57.13 1nu7 s GLU 80 Cb 0.00 -2.69 0.02 0.00 0.26 0.00 0.00 34.13 31.72 1nu7 s GLU 80 CO 0.04 -0.26 -0.06 0.15 -0.54 0.00 0.00 175.26 174.58 1nu7 s LYS 81 N -2.26 1.07 -0.18 4.30 -0.14 0.55 -4.89 119.74 118.19 1nu7 s LYS 81 Ca 0.56 -0.18 -0.05 0.00 -1.36 0.00 0.00 55.97 54.94 1nu7 s LYS 81 Cb -0.30 -1.01 -0.03 0.00 -1.68 0.00 0.00 37.83 34.81 1nu7 s LYS 81 CO 0.37 -0.06 0.00 0.42 -0.76 0.00 0.00 175.35 175.32 1nu7 s ILE 82 N 0.90 4.14 -0.04 2.17 1.09 -1.26 0.13 121.20 128.34 1nu7 s ILE 82 Ca -0.11 -0.26 0.06 0.00 -1.10 0.00 0.00 60.65 59.23 1nu7 s ILE 82 Cb -0.15 -2.85 -0.01 0.00 -1.06 0.00 0.00 42.46 38.40 1nu7 s ILE 82 CO 0.01 0.46 -0.21 -0.44 -0.10 0.00 0.00 174.94 174.65 1nu7 s SER 83 N 0.60 2.58 0.32 3.58 0.01 0.28 -4.96 113.70 116.10 1nu7 s SER 83 Ca -0.00 -0.42 -0.26 0.00 1.31 0.00 0.00 55.95 56.58 1nu7 s SER 83 Cb -0.14 -0.57 -0.10 0.00 0.21 0.00 0.00 66.02 65.43 1nu7 s SER 83 CO 0.02 0.22 0.94 -0.32 0.41 0.00 0.00 173.24 174.51 1nu7 s MET 84 N -0.21 4.58 -0.06 12.44 1.75 -1.26 -1.59 119.30 134.95 1nu7 s MET 84 Ca 0.00 1.32 -0.17 0.00 -1.25 0.00 0.00 55.69 55.59 1nu7 s MET 84 Cb -0.11 -2.82 -0.05 0.00 2.84 0.00 0.00 34.83 34.69 1nu7 s MET 84 CO 0.02 0.29 0.45 -0.51 -0.65 0.00 0.00 175.02 174.62 1nu7 s LEU 85 N -2.02 4.37 -0.09 4.11 1.43 -1.26 -2.04 118.68 123.18 1nu7 s LEU 85 Ca 0.50 0.90 0.07 0.00 -1.03 0.00 0.00 54.13 54.56 1nu7 s LEU 85 Cb -0.19 -2.66 -0.24 0.00 0.03 0.00 0.00 46.19 43.13 1nu7 s LEU 85 CO 0.24 0.15 0.50 1.21 0.23 0.00 0.00 176.35 178.67 1nu7 n GLU 86 N 2.81 0.67 -3.64 1.70 2.13 0.63 -4.73 120.64 120.22 1nu7 n GLU 86 Ca -0.10 0.26 -0.08 0.00 0.66 0.00 0.00 57.16 57.90 1nu7 n GLU 86 Cb 0.52 -1.74 -0.07 0.00 0.27 0.00 0.00 31.44 30.42 1nu7 n GLU 86 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1nu7 s LYS 87 N -2.57 0.45 -0.07 5.31 2.36 -1.14 -5.00 119.74 119.07 1nu7 s LYS 87 Ca -0.11 0.55 0.00 0.00 -2.55 0.00 0.00 55.97 53.86 1nu7 s LYS 87 Cb 0.07 0.21 -0.03 0.00 -1.05 0.00 0.00 37.83 37.03 1nu7 s LYS 87 CO 0.80 -0.06 -0.05 0.42 1.55 0.00 0.00 175.35 178.01 1nu7 s ILE 88 N 0.31 3.84 -0.29 5.43 1.01 -1.26 -0.82 121.20 129.41 1nu7 s ILE 88 Ca 0.03 -0.43 0.01 0.00 0.00 0.00 0.00 60.65 60.26 1nu7 s ILE 88 Cb -0.05 -2.58 0.09 0.00 0.01 0.00 0.00 42.46 39.93 1nu7 s ILE 88 CO -0.08 0.60 0.05 -0.31 0.00 0.00 0.00 174.94 175.20 1nu7 s TYR 89 N -0.80 2.34 0.25 3.97 2.02 0.28 -4.99 117.35 120.42 1nu7 s TYR 89 Ca 0.12 -2.01 -0.17 0.00 -0.37 0.00 0.00 57.07 54.64 1nu7 s TYR 89 Cb -0.11 -1.95 -0.08 0.00 -0.40 0.00 0.00 41.96 39.42 1nu7 s TYR 89 CO 0.02 -0.85 0.71 0.42 -1.57 0.00 0.00 175.55 174.27 1nu7 s ILE 90 N 1.40 4.64 0.12 2.71 -1.09 -1.26 -1.26 121.20 126.46 1nu7 s ILE 90 Ca 0.06 1.11 -0.31 0.00 -2.23 0.00 0.00 60.65 59.28 1nu7 s ILE 90 Cb -0.18 -3.76 -0.10 0.00 -1.58 0.00 0.00 42.46 36.84 1nu7 s ILE 90 CO -0.15 0.08 1.72 -2.28 -1.23 0.00 0.00 174.94 173.08 1nu7 s HIS 91 N -1.67 2.46 0.60 3.97 2.46 -0.98 -4.85 115.29 117.28 1nu7 s HIS 91 Ca 0.46 0.22 0.31 0.00 0.47 0.00 0.00 55.06 56.52 1nu7 s HIS 91 Cb -0.14 -4.07 1.84 0.00 -0.13 0.00 0.00 32.58 30.07 1nu7 s HIS 91 CO 0.20 -4.28 2.24 -1.00 -2.47 0.00 0.00 174.74 169.42 1nu7 h PRO 92 N 8.02 0.00 -0.70 2.88 0.13 -1.94 -1.23 132.00 139.17 1nu7 h PRO 92 Ca -0.44 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.28 1nu7 h PRO 92 Cb 1.21 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.10 1nu7 h PRO 92 CO 0.94 0.00 0.21 0.54 -0.23 0.00 0.00 178.00 179.45 1nu7 n ARG 93 N -3.78 2.31 -2.17 0.86 1.74 -1.26 -4.94 116.66 109.42 1nu7 n ARG 93 Ca -0.02 -3.28 -0.43 0.00 -0.77 0.00 0.00 57.85 53.35 1nu7 n ARG 93 Cb 0.13 -2.06 -0.02 0.00 -1.02 0.00 0.00 32.46 29.48 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 -3.42 2.25 -1.17 -1.55 5.04 -0.47 -4.70 117.35 113.34 1nu7 s TYR 94 Ca 0.53 0.58 -0.09 0.00 -2.44 0.00 0.00 57.07 55.65 1nu7 s TYR 94 Cb 0.45 -3.89 0.23 0.00 0.35 0.00 0.00 41.96 39.10 1nu7 s TYR 94 CO 0.03 -2.79 1.47 -1.71 -1.34 0.00 0.00 175.55 171.21 1nu7 n ASN 95 N 7.84 5.54 -0.02 4.32 2.85 -0.08 -4.84 115.26 130.87 1nu7 n ASN 95 Ca 0.17 -3.12 -0.07 0.00 -0.11 0.00 0.00 54.58 51.45 1nu7 n ASN 95 Cb 0.45 -1.43 0.11 0.00 1.24 0.00 0.00 39.78 40.14 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 6.30 0.69 0.00 1.20 5.08 -1.92 -1.70 115.95 125.60 1nu7 h TRP 96 Ca 0.27 -0.19 0.00 0.00 1.08 0.00 0.00 58.89 60.05 1nu7 h TRP 96 Cb 0.76 -0.15 0.00 0.00 -3.00 0.00 0.00 29.16 26.77 1nu7 h TRP 96 CO 1.02 0.88 0.00 0.07 -1.28 0.00 0.00 178.44 179.13 1nu7 h ARG 97 N 0.49 0.00 0.00 0.12 0.11 -2.00 -3.40 114.38 109.69 1nu7 h ARG 97 Ca 0.05 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.07 1nu7 h ARG 97 Cb 0.88 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.95 1nu7 h ARG 97 CO 0.08 0.00 -0.77 -1.91 0.10 0.00 0.00 179.97 177.47 1nu7 n GLU 97 N -2.81 0.15 -0.72 0.08 2.13 -1.19 -4.99 120.64 113.29 1nu7 n GLU 97 Ca 0.00 0.06 -0.01 0.00 0.66 0.00 0.00 57.16 57.88 1nu7 n GLU 97 Cb 0.22 -0.76 -0.01 0.00 0.27 0.00 0.00 31.44 31.16 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 -3.57 -0.04 -2.10 4.31 6.94 -1.17 -4.83 115.26 114.79 1nu7 n ASN 98 Ca -0.09 -1.61 -0.15 0.00 -0.02 0.00 0.00 54.58 52.72 1nu7 n ASN 98 Cb 0.34 -0.05 -0.03 0.00 -2.36 0.00 0.00 39.78 37.69 1nu7 n ASN 98 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1nu7 n LEU 99 N 0.07 -1.28 -4.70 -4.53 4.77 -0.65 -4.91 117.00 105.77 1nu7 n LEU 99 Ca -0.04 0.21 -0.44 0.00 -0.03 0.00 0.00 56.01 55.71 1nu7 n LEU 99 Cb 0.68 -2.32 -0.02 0.00 -2.33 0.00 0.00 43.42 39.43 1nu7 n LEU 99 CO -0.03 -0.36 1.11 -0.67 -1.33 0.00 0.00 177.39 176.11 1nu7 n ASP 100 N -1.48 3.19 -3.20 -1.43 2.03 -1.23 -2.02 116.55 112.40 1nu7 n ASP 100 Ca -0.17 1.14 -0.18 0.00 0.52 0.00 0.00 54.79 56.10 1nu7 n ASP 100 Cb 0.59 -1.49 0.08 0.00 -0.72 0.00 0.00 41.12 39.57 1nu7 n ASP 100 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1nu7 n ARG 101 N 2.12 -6.49 -2.33 -0.67 1.74 -1.26 -0.91 116.66 108.86 1nu7 n ARG 101 Ca 0.11 0.75 -0.36 0.00 -0.77 0.00 0.00 57.85 57.57 1nu7 n ARG 101 Cb 0.33 -5.50 -0.03 0.00 -1.02 0.00 0.00 32.46 26.24 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 -3.75 5.95 -0.07 0.55 -1.08 -0.86 -4.43 116.67 112.99 1nu7 s ASP 102 Ca 0.26 -1.96 -0.21 0.00 -0.52 0.00 0.00 52.55 50.11 1nu7 s ASP 102 Cb -0.11 -2.58 0.04 0.00 -1.46 0.00 0.00 42.92 38.81 1nu7 s ASP 102 CO 0.65 -2.09 0.48 -0.51 0.52 0.00 0.00 175.17 174.21 1nu7 s ILE 103 N 7.49 0.02 0.09 4.11 2.07 -1.26 -3.61 121.20 130.12 1nu7 s ILE 103 Ca 0.60 -0.21 -0.15 0.00 -1.41 0.00 0.00 60.65 59.49 1nu7 s ILE 103 Cb 0.01 -0.77 0.03 0.00 0.13 0.00 0.00 42.46 41.86 1nu7 s ILE 103 CO 0.09 -0.11 0.36 0.00 -1.91 0.00 0.00 174.94 173.36 1nu7 s ALA 104 N -0.91 -0.82 0.13 1.50 0.00 -0.54 -2.32 121.76 118.79 1nu7 s ALA 104 Ca -0.10 -0.02 0.11 0.00 0.00 0.00 0.00 51.96 51.95 1nu7 s ALA 104 Cb -0.03 0.52 -0.04 0.00 0.00 0.00 0.00 23.12 23.56 1nu7 s ALA 104 CO 0.05 -0.54 -0.26 -0.51 0.00 0.00 0.00 175.76 174.50 1nu7 s LEU 105 N -2.48 2.32 -0.06 0.00 1.43 -0.39 -1.66 118.68 117.84 1nu7 s LEU 105 Ca -0.00 -0.75 0.00 0.00 -1.03 0.00 0.00 54.13 52.35 1nu7 s LEU 105 Cb 0.01 -1.18 0.02 0.00 0.03 0.00 0.00 46.19 45.08 1nu7 s LEU 105 CO -0.08 0.16 -0.03 -0.04 0.23 0.00 0.00 176.35 176.60 1nu7 s MET 106 N -2.06 0.77 -0.20 1.70 -1.94 0.29 -0.56 119.30 117.31 1nu7 s MET 106 Ca 0.13 -0.03 -0.14 0.00 -1.71 0.00 0.00 55.69 53.94 1nu7 s MET 106 Cb -0.10 -0.93 -0.04 0.00 2.01 0.00 0.00 34.83 35.77 1nu7 s MET 106 CO 0.06 -0.18 0.31 0.21 -0.01 0.00 0.00 175.02 175.41 1nu7 s LYS 107 N 1.37 4.17 0.47 2.03 2.47 0.00 -1.19 119.74 129.06 1nu7 s LYS 107 Ca -0.04 0.06 -0.20 0.00 -1.56 0.00 0.00 55.97 54.23 1nu7 s LYS 107 Cb -0.13 -3.51 -0.09 0.00 -1.46 0.00 0.00 37.83 32.63 1nu7 s LYS 107 CO -0.03 0.05 1.01 -0.51 0.16 0.00 0.00 175.35 176.03 1nu7 s LEU 108 N 1.04 3.88 0.39 5.43 1.43 0.09 -0.27 118.68 130.67 1nu7 s LEU 108 Ca 0.16 1.84 0.15 0.00 -1.03 0.00 0.00 54.13 55.24 1nu7 s LEU 108 Cb -0.14 -4.55 0.80 0.00 0.03 0.00 0.00 46.19 42.33 1nu7 s LEU 108 CO 0.06 -0.63 1.85 0.50 0.23 0.00 0.00 176.35 178.36 1nu7 h LYS 109 N 1.67 0.00 -4.70 1.70 3.11 -1.70 -3.41 116.57 113.24 1nu7 h LYS 109 Ca -0.49 0.00 -0.29 0.00 -2.81 0.00 0.00 60.65 57.06 1nu7 h LYS 109 Cb 1.21 0.00 -0.20 0.00 -1.00 0.00 0.00 32.23 32.23 1nu7 h LYS 109 CO 0.60 0.34 -0.74 0.15 -2.81 0.00 0.00 179.45 176.99 1nu7 s LYS 110 N -4.16 0.62 0.46 1.90 1.02 -1.26 -4.99 119.74 113.32 1nu7 s LYS 110 Ca -0.03 -0.86 -0.22 0.00 0.02 0.00 0.00 55.97 54.88 1nu7 s LYS 110 Cb 0.14 -0.37 -0.08 0.00 -0.52 0.00 0.00 37.83 37.00 1nu7 s LYS 110 CO 0.71 0.06 1.12 -1.25 -0.92 0.00 0.00 175.35 175.06 1nu7 s PRO 111 N -1.89 3.82 -0.00 -1.68 0.04 -1.26 -4.80 135.00 129.23 1nu7 s PRO 111 Ca -0.06 1.64 -0.07 0.00 0.04 0.00 0.00 61.00 62.54 1nu7 s PRO 111 Cb -0.08 -2.36 -0.05 0.00 0.04 0.00 0.00 34.50 32.06 1nu7 s PRO 111 CO 0.00 -0.47 0.27 0.14 0.04 0.00 0.00 177.00 176.99 1nu7 s VAL 112 N -1.65 5.29 0.41 -0.36 -7.23 0.14 -4.99 120.40 112.00 1nu7 s VAL 112 Ca 0.64 0.24 -0.22 0.00 -1.81 0.00 0.00 61.98 60.82 1nu7 s VAL 112 Cb -0.25 -3.57 -0.10 0.00 0.56 0.00 0.00 36.38 33.03 1nu7 s VAL 112 CO 0.30 0.40 0.97 0.00 -0.31 0.00 0.00 175.10 176.46 1nu7 s ALA 113 N -1.26 3.06 0.56 1.32 0.00 -1.26 -4.74 121.76 119.44 1nu7 s ALA 113 Ca 0.26 0.50 -0.04 0.00 0.00 0.00 0.00 51.96 52.68 1nu7 s ALA 113 Cb -0.13 -3.19 0.01 0.00 0.00 0.00 0.00 23.12 19.81 1nu7 s ALA 113 CO 0.15 0.04 0.85 -0.06 0.00 0.00 0.00 175.76 176.73 1nu7 s PHE 114 N -1.95 3.23 0.01 0.00 0.08 -1.26 -4.91 117.98 113.17 1nu7 s PHE 114 Ca 0.59 0.53 -0.00 0.00 0.12 0.00 0.00 56.93 58.17 1nu7 s PHE 114 Cb -0.14 -2.65 0.00 0.00 -0.57 0.00 0.00 43.02 39.66 1nu7 s PHE 114 CO 0.18 -0.73 0.02 -1.13 -0.10 0.00 0.00 175.22 173.46 1nu7 n SER 115 N -2.47 -0.04 0.30 1.36 3.41 -0.02 -4.93 113.62 111.24 1nu7 n SER 115 Ca 0.04 -1.02 0.18 0.00 -0.26 0.00 0.00 58.87 57.81 1nu7 n SER 115 Cb 0.58 0.06 0.92 0.00 -0.26 0.00 0.00 64.21 65.51 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 0.03 0.00 0.00 4.04 3.32 -1.98 -3.00 116.42 118.83 1nu7 h ASP 116 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1nu7 h ASP 116 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1nu7 h ASP 116 CO 0.01 0.03 -0.62 -1.22 -1.72 0.00 0.00 179.24 175.72 1nu7 n TYR 117 N -3.25 0.00 -3.87 4.55 4.01 -1.26 -4.85 117.16 112.49 1nu7 n TYR 117 Ca -0.02 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.45 1nu7 n TYR 117 Cb 0.19 -0.01 -0.16 0.00 -0.31 0.00 0.00 39.34 39.04 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 -2.20 1.00 -0.22 -0.72 1.01 -1.13 -4.20 121.20 114.73 1nu7 s ILE 118 Ca 0.04 -0.58 -0.21 0.00 0.00 0.00 0.00 60.65 59.91 1nu7 s ILE 118 Cb 0.09 -1.21 0.06 0.00 0.01 0.00 0.00 42.46 41.41 1nu7 s ILE 118 CO 0.51 0.10 0.60 -2.28 0.00 0.00 0.00 174.94 173.87 1nu7 s HIS 119 N 1.68 -0.66 0.40 3.97 2.46 -0.73 -0.84 115.29 121.57 1nu7 s HIS 119 Ca 0.01 1.61 -0.23 0.00 0.47 0.00 0.00 55.06 56.91 1nu7 s HIS 119 Cb -0.15 0.23 -0.10 0.00 -0.13 0.00 0.00 32.58 32.43 1nu7 s HIS 119 CO -0.07 -0.32 1.00 -1.25 -2.47 0.00 0.00 174.74 171.63 1nu7 s PRO 120 N 0.33 4.21 0.55 2.88 0.04 -1.26 -2.19 135.00 139.55 1nu7 s PRO 120 Ca -0.00 1.35 -0.04 0.00 0.04 0.00 0.00 61.00 62.35 1nu7 s PRO 120 Cb -0.04 -2.44 0.00 0.00 0.04 0.00 0.00 34.50 32.07 1nu7 s PRO 120 CO 0.01 -0.07 0.83 0.54 0.04 0.00 0.00 177.00 178.34 1nu7 s VAL 121 N -1.83 3.79 0.18 -0.36 0.11 -0.74 -4.92 120.40 116.63 1nu7 s VAL 121 Ca 0.59 -0.14 -0.05 0.00 -2.93 0.00 0.00 61.98 59.45 1nu7 s VAL 121 Cb -0.17 -3.47 -0.06 0.00 -1.53 0.00 0.00 36.38 31.15 1nu7 s VAL 121 CO 0.22 -0.44 0.42 0.00 -3.33 0.00 0.00 175.10 171.97 1nu7 s LEU 123 N -2.88 4.31 0.63 0.00 1.43 -1.26 -0.40 118.68 120.51 1nu7 s LEU 123 Ca 0.42 0.43 -0.14 0.00 -1.03 0.00 0.00 54.13 53.81 1nu7 s LEU 123 Cb -0.12 -2.05 -0.02 0.00 0.03 0.00 0.00 46.19 44.03 1nu7 s LEU 123 CO 0.25 0.39 1.06 -2.16 0.23 0.00 0.00 176.35 176.13 1nu7 s PRO 124 N -0.94 3.14 0.57 1.29 0.04 -1.26 -4.92 135.00 132.91 1nu7 s PRO 124 Ca 0.14 1.17 0.09 0.00 0.04 0.00 0.00 61.00 62.45 1nu7 s PRO 124 Cb -0.12 -2.01 0.08 0.00 0.04 0.00 0.00 34.50 32.49 1nu7 s PRO 124 CO 0.04 -0.96 0.73 0.16 0.04 0.00 0.00 177.00 177.01 1nu7 s ASP 125 N -3.00 5.02 0.23 6.66 3.84 -1.26 -4.73 116.67 123.43 1nu7 s ASP 125 Ca 0.63 -0.92 -0.07 0.00 -0.00 0.00 0.00 52.55 52.18 1nu7 s ASP 125 Cb -0.16 0.33 0.39 0.00 -1.38 0.00 0.00 42.92 42.10 1nu7 s ASP 125 CO 0.42 -1.31 1.69 -0.09 -0.00 0.00 0.00 175.17 175.88 1nu7 h ARG 126 N 0.27 0.24 -0.17 2.11 2.43 -1.97 -2.75 114.38 114.54 1nu7 h ARG 126 Ca -0.31 -0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 58.72 1nu7 h ARG 126 Cb 1.29 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1nu7 h ARG 126 CO 0.43 0.16 -0.40 0.93 -1.51 0.00 0.00 179.97 179.59 1nu7 h GLU 127 N 0.24 0.56 -0.21 0.20 4.39 -2.04 -0.50 114.58 117.23 1nu7 h GLU 127 Ca 0.37 -0.38 0.00 0.00 0.34 0.00 0.00 59.36 59.69 1nu7 h GLU 127 Cb 0.61 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 1nu7 h GLU 127 CO -0.48 1.00 0.00 2.41 -1.16 0.00 0.00 179.01 180.78 1nu7 n THR 128 N -4.28 0.00 0.00 1.13 -1.04 -1.04 0.13 114.28 109.19 1nu7 n THR 128 Ca -0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 1nu7 n THR 128 Cb 0.53 -0.04 0.00 0.00 -1.82 0.00 0.00 70.33 69.00 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 0.40 0.00 0.09 2.41 0.00 -0.20 -0.70 120.51 122.51 1nu7 n ALA 129 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 1nu7 n ALA 129 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.33 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 0.36 0.79 0.00 4.64 0.82 -3.37 113.55 116.80 1nu7 h SER 129 Ca 0.00 -0.37 -0.22 0.00 -0.47 0.00 0.00 61.79 60.73 1nu7 h SER 129 Cb 0.00 -0.12 -0.04 0.00 -0.31 0.00 0.00 62.40 61.94 1nu7 h SER 129 CO 0.00 1.26 -1.31 -0.07 -0.87 0.00 0.00 176.83 175.85 1nu7 h LEU 129 N 0.08 0.00 -5.96 5.97 4.07 -1.12 -3.40 115.31 114.96 1nu7 h LEU 129 Ca -0.10 0.00 -0.72 0.00 0.08 0.00 0.00 57.88 57.14 1nu7 h LEU 129 Cb 1.87 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 43.55 1nu7 h LEU 129 CO 0.18 0.85 2.97 0.18 -1.08 0.00 0.00 178.44 181.55 1nu7 n LEU 130 N -3.12 7.09 -4.35 1.67 4.77 -1.26 -4.84 117.00 116.96 1nu7 n LEU 130 Ca -0.08 -4.30 -0.28 0.00 -0.03 0.00 0.00 56.01 51.31 1nu7 n LEU 130 Cb 0.94 -1.60 -0.14 0.00 -2.33 0.00 0.00 43.42 40.29 1nu7 n LEU 130 CO 0.45 1.31 -0.56 -1.10 -1.33 0.00 0.00 177.39 176.16 1nu7 s GLN 131 N 2.34 1.49 0.15 3.23 -0.21 -1.26 -4.97 119.66 120.44 1nu7 s GLN 131 Ca 0.48 -1.23 -0.34 0.00 0.02 0.00 0.00 55.36 54.30 1nu7 s GLN 131 Cb 0.14 -1.83 -0.14 0.00 1.00 0.00 0.00 33.01 32.17 1nu7 s GLN 131 CO -0.07 0.45 1.54 0.00 -2.12 0.00 0.00 175.29 175.10 1nu7 n ALA 132 N 1.26 1.09 0.00 6.09 0.00 -1.26 -1.55 120.51 126.13 1nu7 n ALA 132 Ca -0.18 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1nu7 n ALA 132 Cb 0.53 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.66 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 3.27 2.98 3.77 0.00 0.00 0.28 -4.94 105.19 110.55 1nu7 n GLY 133 Ca 0.17 -0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.40 2.87 -0.03 1.61 1.51 -0.60 -4.61 117.35 115.71 1nu7 s TYR 134 Ca 0.00 1.37 -0.01 0.00 -1.01 0.00 0.00 57.07 57.41 1nu7 s TYR 134 Cb 0.00 -3.74 -0.04 0.00 -0.11 0.00 0.00 41.96 38.07 1nu7 s TYR 134 CO 0.00 -2.17 0.07 0.15 -1.11 0.00 0.00 175.55 172.50 1nu7 s LYS 135 N -2.01 3.09 0.45 -0.62 1.02 -1.26 -0.20 119.74 120.21 1nu7 s LYS 135 Ca 0.53 -0.44 0.03 0.00 0.02 0.00 0.00 55.97 56.11 1nu7 s LYS 135 Cb -0.40 -2.88 -0.04 0.00 -0.52 0.00 0.00 37.83 33.99 1nu7 s LYS 135 CO 0.54 0.67 0.03 0.20 -0.92 0.00 0.00 175.35 175.86 1nu7 s GLY 136 N -1.52 2.75 -0.04 -3.33 0.00 0.97 -4.85 107.32 101.31 1nu7 s GLY 136 Ca 0.20 -1.16 0.07 0.00 0.00 0.00 0.00 44.72 43.83 1nu7 s GLY 136 CO 0.11 -2.09 -0.24 -1.60 0.00 0.00 0.00 173.10 169.27 1nu7 s ARG 137 N -3.81 2.26 -0.06 2.90 3.52 0.50 -0.50 118.95 123.76 1nu7 s ARG 137 Ca 0.19 -0.88 0.06 0.00 -0.13 0.00 0.00 55.73 54.96 1nu7 s ARG 137 Cb 0.05 -2.03 -0.01 0.00 -1.56 0.00 0.00 34.95 31.40 1nu7 s ARG 137 CO 0.10 0.44 -0.24 0.08 -0.81 0.00 0.00 175.30 174.86 1nu7 s VAL 138 N -0.33 2.00 0.16 7.11 1.01 -0.29 -0.29 120.40 129.77 1nu7 s VAL 138 Ca 0.02 -1.03 0.06 0.00 0.00 0.00 0.00 61.98 61.03 1nu7 s VAL 138 Cb -0.12 -1.70 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 1nu7 s VAL 138 CO 0.02 0.56 -0.13 0.42 0.00 0.00 0.00 175.10 175.96 1nu7 s THR 139 N -0.07 1.47 0.00 3.92 -4.23 -1.24 -1.69 115.64 113.80 1nu7 s THR 139 Ca -0.06 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.45 1nu7 s THR 139 Cb -0.14 -1.82 0.00 0.00 1.34 0.00 0.00 72.50 71.87 1nu7 s THR 139 CO 0.04 -0.56 0.00 0.61 -0.54 0.00 0.00 174.62 174.17 1nu7 n GLY 140 N -0.01 1.97 1.20 3.99 0.00 -0.71 -4.59 105.19 107.05 1nu7 n GLY 140 Ca -0.11 -1.02 0.08 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.85 1.10 -0.38 1.61 8.01 -1.26 -1.49 117.44 124.18 1nu7 n TRP 141 Ca 0.00 -0.64 -0.16 0.00 -1.31 0.00 0.00 57.50 55.39 1nu7 n TRP 141 Cb 0.00 -0.20 0.15 0.00 -2.01 0.00 0.00 31.31 29.25 1nu7 n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1nu7 n GLY 142 N 0.65 -3.39 3.75 6.99 0.00 -1.26 -4.39 105.19 107.54 1nu7 n GLY 142 Ca 0.21 -1.34 -0.38 0.00 0.00 0.00 0.00 46.02 44.51 1nu7 n GLY 142 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nu7 s ASN 143 N -2.79 5.42 0.18 1.61 0.01 -0.29 -3.26 114.94 115.82 1nu7 s ASN 143 Ca 0.37 2.69 0.26 0.00 -0.71 0.00 0.00 52.86 55.47 1nu7 s ASN 143 Cb -0.05 -2.63 0.79 0.00 0.41 0.00 0.00 41.25 39.77 1nu7 s ASN 143 CO 0.30 -1.46 1.74 0.18 -1.51 0.00 0.00 177.10 176.34 1nu7 n LEU 144 N -0.94 0.74 -3.51 0.60 4.77 -0.12 -1.19 117.00 117.35 1nu7 n LEU 144 Ca 0.10 0.53 -0.09 0.00 -0.03 0.00 0.00 56.01 56.52 1nu7 n LEU 144 Cb 0.45 -0.32 -0.02 0.00 -2.33 0.00 0.00 43.42 41.21 1nu7 n LEU 144 CO 0.52 -0.15 0.63 -0.75 -1.33 0.00 0.00 177.39 176.31 1nu7 s LYS 145 N -3.10 0.96 0.32 3.23 2.20 -1.26 -4.21 119.74 117.89 1nu7 s LYS 145 Ca 0.10 -0.38 -0.26 0.00 -0.36 0.00 0.00 55.97 55.07 1nu7 s LYS 145 Cb 0.13 0.43 -0.10 0.00 -1.51 0.00 0.00 37.83 36.78 1nu7 s LYS 145 CO 0.61 -0.42 0.95 -2.00 -0.36 0.00 0.00 175.35 174.12 1nu7 s GLU 146 N -3.28 4.58 0.30 4.03 2.12 -1.26 -4.90 118.70 120.29 1nu7 s GLU 146 Ca 0.05 1.33 0.08 0.00 0.36 0.00 0.00 54.97 56.79 1nu7 s GLU 146 Cb -0.01 -2.80 -0.04 0.00 0.26 0.00 0.00 34.13 31.54 1nu7 s GLU 146 CO -0.09 0.28 0.13 0.95 -0.54 0.00 0.00 175.26 175.99 1nu7 s THR 147 N -1.61 3.46 -0.05 -1.70 -4.23 -1.26 -5.03 115.64 105.22 1nu7 s THR 147 Ca 0.50 -1.67 0.31 0.00 -1.18 0.00 0.00 61.69 59.65 1nu7 s THR 147 Cb -0.19 -3.04 0.37 0.00 1.34 0.00 0.00 72.50 70.98 1nu7 s THR 147 CO 0.24 -0.27 1.90 4.11 -0.54 0.00 0.00 174.62 180.06 1nu7 h TRP 148 N 1.60 0.00 -3.64 3.99 5.08 -1.99 -3.43 115.95 117.56 1nu7 h TRP 148 Ca -0.45 0.00 -0.20 0.00 1.08 0.00 0.00 58.89 59.32 1nu7 h TRP 148 Cb 1.25 0.00 -0.26 0.00 -3.00 0.00 0.00 29.16 27.15 1nu7 h TRP 148 CO 0.62 0.00 -0.65 0.99 -1.28 0.00 0.00 178.44 178.12 1nu7 s THR 149 N -3.56 0.02 0.43 0.12 2.01 -1.26 -5.02 115.64 108.38 1nu7 s THR 149 Ca 0.02 -0.19 0.13 0.00 0.31 0.00 0.00 61.69 61.97 1nu7 s THR 149 Cb 0.09 -0.14 0.32 0.00 0.01 0.00 0.00 72.50 72.78 1nu7 s THR 149 CO 0.54 -0.10 1.98 0.00 -0.69 0.00 0.00 174.62 176.35 1nu7 h ALA 149 N 5.71 1.99 0.00 7.40 0.00 -1.97 -0.48 119.26 131.91 1nu7 h ALA 149 Ca -0.26 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 1nu7 h ALA 149 Cb 1.21 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1nu7 h ALA 149 CO 0.46 -0.12 -0.26 -0.91 0.00 0.00 0.00 179.25 178.42 1nu7 h ASN 149 N 0.43 0.00 -1.27 0.00 4.21 -1.97 -2.86 115.58 114.13 1nu7 h ASN 149 Ca 0.28 0.00 0.37 0.00 1.21 0.00 0.00 56.30 58.16 1nu7 h ASN 149 Cb 0.51 0.00 -0.08 0.00 -1.12 0.00 0.00 38.32 37.63 1nu7 h ASN 149 CO -0.08 0.26 0.87 0.58 -1.29 0.00 0.00 177.43 177.76 1nu7 h VAL 149 N 0.00 0.33 0.00 2.81 2.07 -1.49 -3.45 116.25 116.52 1nu7 h VAL 149 Ca -0.00 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1nu7 h VAL 149 Cb 0.68 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 1nu7 h VAL 149 CO 0.03 0.02 0.00 0.61 0.02 0.00 0.00 177.57 178.26 1nu7 n GLY 149 N -1.64 0.05 3.49 2.17 0.00 -1.08 -4.95 105.19 103.23 1nu7 n GLY 149 Ca 0.30 -1.67 -0.35 0.00 0.00 0.00 0.00 46.02 44.31 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 3.69 -0.80 1.61 1.02 -1.26 -4.93 119.74 119.06 1nu7 s LYS 149 Ca 0.00 -0.49 -0.02 0.00 0.02 0.00 0.00 55.97 55.48 1nu7 s LYS 149 Cb 0.00 -3.08 0.20 0.00 -0.52 0.00 0.00 37.83 34.42 1nu7 s LYS 149 CO 0.00 0.08 0.66 0.20 -0.92 0.00 0.00 175.35 175.37 1nu7 s GLY 150 N 0.82 2.90 0.01 -3.33 0.00 -1.26 -5.07 107.32 101.39 1nu7 s GLY 150 Ca 0.01 -3.68 -0.05 0.00 0.00 0.00 0.00 44.72 41.00 1nu7 s GLY 150 CO 0.02 1.16 0.24 1.20 0.00 0.00 0.00 173.10 175.72 1nu7 s GLN 151 N -0.99 3.52 0.87 2.90 -0.21 -1.26 -0.94 119.66 123.55 1nu7 s GLN 151 Ca 0.24 -0.18 -0.13 0.00 0.02 0.00 0.00 55.36 55.32 1nu7 s GLN 151 Cb -0.11 -3.07 0.12 0.00 1.00 0.00 0.00 33.01 30.95 1nu7 s GLN 151 CO -0.10 0.65 1.18 -1.25 -2.12 0.00 0.00 175.29 173.64 1nu7 s PRO 152 N -1.89 1.46 -0.23 2.91 0.04 -1.26 -4.99 135.00 131.04 1nu7 s PRO 152 Ca 0.28 0.12 0.10 0.00 0.04 0.00 0.00 61.00 61.54 1nu7 s PRO 152 Cb -0.13 -1.89 -0.21 0.00 0.04 0.00 0.00 34.50 32.31 1nu7 s PRO 152 CO 0.18 -1.94 -0.08 -1.13 0.04 0.00 0.00 177.00 174.06 1nu7 n SER 153 N -3.56 1.02 -4.82 6.66 3.41 -1.26 -4.79 113.62 110.27 1nu7 n SER 153 Ca 0.08 -0.07 -0.35 0.00 -0.26 0.00 0.00 58.87 58.28 1nu7 n SER 153 Cb 0.60 0.28 -0.07 0.00 -0.26 0.00 0.00 64.21 64.76 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 -2.51 5.05 0.09 -3.33 1.01 -1.26 0.15 120.40 119.60 1nu7 s VAL 154 Ca -0.23 -0.14 -0.37 0.00 0.00 0.00 0.00 61.98 61.25 1nu7 s VAL 154 Cb 0.08 -3.26 -0.17 0.00 0.00 0.00 0.00 36.38 33.03 1nu7 s VAL 154 CO 0.71 0.47 1.26 -0.11 0.00 0.00 0.00 175.10 177.43 1nu7 n LEU 155 N 1.53 1.32 -4.91 3.92 7.94 -0.68 -4.78 117.00 121.35 1nu7 n LEU 155 Ca -0.16 1.13 -0.32 0.00 -1.11 0.00 0.00 56.01 55.55 1nu7 n LEU 155 Cb 0.54 -1.15 -0.04 0.00 0.53 0.00 0.00 43.42 43.29 1nu7 n LEU 155 CO 0.36 -1.25 -0.16 -1.10 -1.11 0.00 0.00 177.39 174.13 1nu7 s GLN 156 N 0.25 3.41 0.02 1.96 -1.52 -0.56 -0.64 119.66 122.59 1nu7 s GLN 156 Ca 0.83 -0.41 0.03 0.00 -1.95 0.00 0.00 55.36 53.86 1nu7 s GLN 156 Cb -0.99 -3.04 -0.01 0.00 -0.22 0.00 0.00 33.01 28.74 1nu7 s GLN 156 CO 0.49 0.63 -0.09 0.08 -0.25 0.00 0.00 175.29 176.16 1nu7 s VAL 157 N -1.43 0.65 -0.11 1.09 1.01 0.15 -1.73 120.40 120.03 1nu7 s VAL 157 Ca 0.32 -0.63 -0.14 0.00 0.00 0.00 0.00 61.98 61.53 1nu7 s VAL 157 Cb -0.13 -0.60 0.03 0.00 0.00 0.00 0.00 36.38 35.68 1nu7 s VAL 157 CO 0.24 -0.01 0.37 0.54 0.00 0.00 0.00 175.10 176.24 1nu7 s VAL 158 N -0.60 0.01 -0.11 2.92 0.11 -0.68 -0.49 120.40 121.55 1nu7 s VAL 158 Ca -0.01 -0.11 -0.03 0.00 -2.93 0.00 0.00 61.98 58.90 1nu7 s VAL 158 Cb -0.06 -0.56 -0.03 0.00 -1.53 0.00 0.00 36.38 34.20 1nu7 s VAL 158 CO 0.00 -0.06 0.01 0.20 -3.33 0.00 0.00 175.10 171.92 1nu7 s ASN 159 N -0.20 5.27 0.01 3.54 0.01 -1.26 -1.14 114.94 121.18 1nu7 s ASN 159 Ca -0.04 0.10 -0.02 0.00 -0.71 0.00 0.00 52.86 52.20 1nu7 s ASN 159 Cb -0.03 -1.63 -0.01 0.00 0.41 0.00 0.00 41.25 39.99 1nu7 s ASN 159 CO 0.02 0.31 0.01 -0.76 -1.51 0.00 0.00 177.10 175.17 1nu7 s LEU 160 N -0.49 2.05 0.14 0.60 1.43 0.35 -4.94 118.68 117.81 1nu7 s LEU 160 Ca 0.09 -0.35 -0.22 0.00 -1.03 0.00 0.00 54.13 52.62 1nu7 s LEU 160 Cb -0.12 0.21 -0.08 0.00 0.03 0.00 0.00 46.19 46.23 1nu7 s LEU 160 CO 0.02 -0.26 0.69 -2.16 0.23 0.00 0.00 176.35 174.87 1nu7 s PRO 161 N -1.18 4.39 0.24 1.29 0.04 -1.26 -0.02 135.00 138.50 1nu7 s PRO 161 Ca -0.13 0.97 -0.30 0.00 0.04 0.00 0.00 61.00 61.58 1nu7 s PRO 161 Cb -0.08 -3.20 -0.09 0.00 0.04 0.00 0.00 34.50 31.17 1nu7 s PRO 161 CO -0.00 0.57 1.24 0.42 0.04 0.00 0.00 177.00 179.27 1nu7 s ILE 162 N -1.18 3.24 0.14 0.56 1.01 0.72 -0.42 121.20 125.27 1nu7 s ILE 162 Ca 0.34 1.12 0.05 0.00 0.00 0.00 0.00 60.65 62.16 1nu7 s ILE 162 Cb -0.21 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.51 1nu7 s ILE 162 CO 0.23 0.21 0.07 0.68 0.00 0.00 0.00 174.94 176.14 1nu7 s VAL 163 N -0.48 4.24 0.33 2.92 -7.23 -0.87 -0.56 120.40 118.75 1nu7 s VAL 163 Ca 0.51 -1.10 -0.29 0.00 -1.81 0.00 0.00 61.98 59.29 1nu7 s VAL 163 Cb -0.35 -3.12 -0.11 0.00 0.56 0.00 0.00 36.38 33.36 1nu7 s VAL 163 CO 0.42 -0.04 1.44 -1.83 -0.31 0.00 0.00 175.10 174.78 1nu7 s GLU 164 N -2.84 4.21 0.31 4.82 1.03 -1.26 -4.68 118.70 120.29 1nu7 s GLU 164 Ca 0.29 2.43 0.07 0.00 0.03 0.00 0.00 54.97 57.79 1nu7 s GLU 164 Cb -0.10 -3.03 0.79 0.00 -0.80 0.00 0.00 34.13 30.99 1nu7 s GLU 164 CO 0.21 -0.42 1.77 0.00 -1.33 0.00 0.00 175.26 175.49 1nu7 h ARG 165 N 3.63 0.69 -0.45 -4.83 3.08 -1.98 -0.11 114.38 114.42 1nu7 h ARG 165 Ca -0.49 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.51 1nu7 h ARG 165 Cb 1.23 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 31.10 1nu7 h ARG 165 CO 0.68 0.46 0.25 -1.35 -1.07 0.00 0.00 179.97 178.94 1nu7 h PRO 166 N 0.71 0.61 -0.22 0.04 0.11 -2.00 -0.31 132.00 130.95 1nu7 h PRO 166 Ca 0.59 -0.06 -0.15 0.00 0.11 0.00 0.00 66.00 66.49 1nu7 h PRO 166 Cb 0.98 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1nu7 h PRO 166 CO -0.39 0.45 -0.47 0.28 -0.21 0.00 0.00 178.00 177.66 1nu7 h VAL 167 N 0.62 1.31 -0.44 3.15 2.07 -1.40 -1.74 116.25 119.83 1nu7 h VAL 167 Ca 0.16 -1.69 0.03 0.00 0.82 0.00 0.00 66.70 66.03 1nu7 h VAL 167 Cb 0.01 1.82 -0.04 0.00 -1.52 0.00 0.00 31.29 31.57 1nu7 h VAL 167 CO -0.03 0.53 0.22 0.00 0.02 0.00 0.00 177.57 178.32 1nu7 h LYS 169 N 0.45 0.30 0.00 0.00 3.64 -1.01 -2.75 116.57 117.20 1nu7 h LYS 169 Ca 0.19 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1nu7 h LYS 169 Cb 0.08 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1nu7 h LYS 169 CO -0.12 0.27 0.00 -0.25 -2.27 0.00 0.00 179.45 177.07 1nu7 n ASP 170 N -4.89 0.55 0.21 4.20 10.43 -0.66 -3.30 116.55 123.10 1nu7 n ASP 170 Ca -0.03 0.61 0.13 0.00 2.57 0.00 0.00 54.79 58.07 1nu7 n ASP 170 Cb 0.07 -0.74 0.24 0.00 1.84 0.00 0.00 41.12 42.53 1nu7 n ASP 170 CO 0.00 0.00 0.00 0.77 -1.07 0.00 0.00 177.20 176.90 1nu7 h SER 171 N 0.00 0.00 -4.97 -2.24 4.64 -1.02 -3.47 113.55 106.50 1nu7 h SER 171 Ca 0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 1nu7 h SER 171 Cb 0.42 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.36 1nu7 h SER 171 CO 0.00 0.00 -0.69 0.28 -0.87 0.00 0.00 176.83 175.55 1nu7 s THR 172 N -3.24 0.41 -1.73 2.95 -1.32 -1.21 -4.85 115.64 106.65 1nu7 s THR 172 Ca 0.07 -1.81 0.23 0.00 -1.21 0.00 0.00 61.69 58.97 1nu7 s THR 172 Cb 0.06 -1.52 0.03 0.00 -1.51 0.00 0.00 72.50 69.56 1nu7 s THR 172 CO 0.65 -0.92 1.20 0.54 -2.21 0.00 0.00 174.62 173.88 1nu7 n ARG 173 N 0.13 0.85 -2.19 7.08 1.74 -1.26 -4.89 116.66 118.12 1nu7 n ARG 173 Ca -0.14 -0.65 -0.38 0.00 -0.77 0.00 0.00 57.85 55.91 1nu7 n ARG 173 Cb 0.61 -1.49 -0.01 0.00 -1.02 0.00 0.00 32.46 30.55 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 -2.60 2.94 -0.44 0.55 -1.09 -1.26 -4.93 121.20 114.38 1nu7 s ILE 174 Ca 0.18 0.77 -0.29 0.00 -2.23 0.00 0.00 60.65 59.08 1nu7 s ILE 174 Cb 0.18 -3.42 0.02 0.00 -1.58 0.00 0.00 42.46 37.65 1nu7 s ILE 174 CO 0.61 0.05 1.27 -0.60 -1.23 0.00 0.00 174.94 175.05 1nu7 s ARG 175 N -2.44 3.67 0.42 2.79 3.52 -1.26 -5.01 118.95 120.64 1nu7 s ARG 175 Ca 0.60 0.78 -0.13 0.00 -0.13 0.00 0.00 55.73 56.85 1nu7 s ARG 175 Cb -0.32 -3.96 -0.07 0.00 -1.56 0.00 0.00 34.95 29.04 1nu7 s ARG 175 CO 0.40 -1.45 0.82 0.96 -0.81 0.00 0.00 175.30 175.23 1nu7 s ILE 176 N 4.88 4.70 0.37 4.11 -4.36 -1.26 -4.84 121.20 124.81 1nu7 s ILE 176 Ca 0.54 0.83 0.04 0.00 -0.26 0.00 0.00 60.65 61.80 1nu7 s ILE 176 Cb -0.11 -3.71 -0.05 0.00 1.25 0.00 0.00 42.46 39.85 1nu7 s ILE 176 CO 0.31 -0.51 0.07 0.42 0.24 0.00 0.00 174.94 175.48 1nu7 s THR 177 N -2.37 1.04 -0.83 8.37 -4.23 -1.26 -5.01 115.64 111.34 1nu7 s THR 177 Ca 0.54 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 59.20 1nu7 s THR 177 Cb -0.10 -2.61 0.14 0.00 1.34 0.00 0.00 72.50 71.26 1nu7 s THR 177 CO 0.29 0.00 1.47 0.47 -0.54 0.00 0.00 174.62 176.31 1nu7 n ASP 178 N -0.93 0.19 -0.71 3.99 8.00 -1.26 -2.02 116.55 123.81 1nu7 n ASP 178 Ca -0.05 0.55 0.05 0.00 0.71 0.00 0.00 54.79 56.05 1nu7 n ASP 178 Cb 0.66 -0.59 0.15 0.00 -0.02 0.00 0.00 41.12 41.32 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 -1.72 2.03 -4.13 -2.24 3.02 -1.26 -4.87 115.26 106.09 1nu7 n ASN 179 Ca 0.02 -2.07 -0.09 0.00 -0.03 0.00 0.00 54.58 52.41 1nu7 n ASN 179 Cb 0.15 -0.29 -0.10 0.00 -0.61 0.00 0.00 39.78 38.94 1nu7 n ASN 179 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nu7 s MET 180 N -1.59 0.76 0.05 3.52 0.23 -0.86 -0.74 119.30 120.68 1nu7 s MET 180 Ca 0.23 -1.31 -0.06 0.00 -1.03 0.00 0.00 55.69 53.52 1nu7 s MET 180 Cb 0.13 0.07 -0.01 0.00 -1.53 0.00 0.00 34.83 33.49 1nu7 s MET 180 CO 0.14 -0.11 0.11 -0.59 -2.03 0.00 0.00 175.02 172.53 1nu7 s PHE 181 N -3.85 0.23 0.25 3.16 -0.12 -0.44 -4.79 117.98 112.42 1nu7 s PHE 181 Ca 0.13 -0.61 0.10 0.00 -0.05 0.00 0.00 56.93 56.50 1nu7 s PHE 181 Cb 0.07 -0.15 -0.04 0.00 -0.63 0.00 0.00 43.02 42.26 1nu7 s PHE 181 CO -0.05 -0.42 -0.09 0.00 -0.05 0.00 0.00 175.22 174.60 1nu7 s ALA 183 N -2.21 -0.36 0.00 0.00 0.00 -0.57 -2.06 121.76 116.57 1nu7 s ALA 183 Ca 0.29 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.18 1nu7 s ALA 183 Cb -0.07 0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.14 1nu7 s ALA 183 CO 0.17 -0.20 0.00 0.41 0.00 0.00 0.00 175.76 176.14 1nu7 n GLY 184 N 1.55 3.63 3.80 0.00 0.00 0.44 -2.33 105.19 112.28 1nu7 n GLY 184 Ca -0.22 -1.30 -0.36 0.00 0.00 0.00 0.00 46.02 44.14 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 -2.00 3.59 0.67 1.61 2.02 -1.26 -4.55 117.35 117.43 1nu7 s TYR 184 Ca 0.00 1.59 -0.11 0.00 -0.37 0.00 0.00 57.07 58.18 1nu7 s TYR 184 Cb 0.00 -2.79 -0.01 0.00 -0.40 0.00 0.00 41.96 38.76 1nu7 s TYR 184 CO 0.00 0.19 1.05 0.15 -1.57 0.00 0.00 175.55 175.37 1nu7 s LYS 185 N -2.29 3.20 0.22 -0.62 1.02 -1.26 -4.78 119.74 115.23 1nu7 s LYS 185 Ca 0.50 0.85 -0.15 0.00 0.02 0.00 0.00 55.97 57.20 1nu7 s LYS 185 Cb -0.16 -2.03 0.26 0.00 -0.52 0.00 0.00 37.83 35.38 1nu7 s LYS 185 CO 0.21 -0.89 1.59 -1.35 -0.92 0.00 0.00 175.35 173.99 1nu7 h PRO 186 N -0.56 -0.05 -1.17 -1.68 0.11 -1.94 -1.41 132.00 125.31 1nu7 h PRO 186 Ca -0.44 0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.19 1nu7 h PRO 186 Cb 1.20 0.01 -0.23 0.00 0.11 0.00 0.00 31.00 32.10 1nu7 h PRO 186 CO 0.59 -0.03 0.63 -0.40 -0.21 0.00 0.00 178.00 178.58 1nu7 n ASP 186 N -5.49 6.17 -0.15 -2.05 5.68 -1.26 -3.93 116.55 115.52 1nu7 n ASP 186 Ca 0.09 -3.41 0.09 0.00 -0.50 0.00 0.00 54.79 51.06 1nu7 n ASP 186 Cb 0.39 -0.94 -0.07 0.00 -1.14 0.00 0.00 41.12 39.36 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 -0.48 1.17 0.00 0.11 1.02 -0.53 -5.00 120.64 116.93 1nu7 n GLU 186 Ca 0.48 -0.31 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 1nu7 n GLU 186 Cb 0.84 -1.36 0.00 0.00 -0.02 0.00 0.00 31.44 30.90 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 1.38 1.99 3.57 0.62 0.00 -1.25 -4.95 105.19 106.54 1nu7 n GLY 186 Ca 0.05 -0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.53 -2.94 1.61 4.76 -1.26 -5.04 118.16 114.76 1nu7 n LYS 186 Ca 0.00 -0.10 -0.09 0.00 -2.87 0.00 0.00 58.31 55.25 1nu7 n LYS 186 Cb 0.00 -2.19 -0.03 0.00 -1.84 0.00 0.00 35.03 30.97 1nu7 n LYS 186 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1nu7 n ARG 187 N -3.45 0.54 0.00 1.97 1.74 -1.26 -4.75 116.66 111.44 1nu7 n ARG 187 Ca 0.10 -1.37 0.00 0.00 -0.77 0.00 0.00 57.85 55.81 1nu7 n ARG 187 Cb 0.53 0.89 0.00 0.00 -1.02 0.00 0.00 32.46 32.86 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 0.54 3.98 3.62 -0.13 0.00 -1.26 -4.91 105.19 107.03 1nu7 n GLY 188 Ca -0.00 -1.48 0.01 0.00 0.00 0.00 0.00 46.02 44.55 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 -0.06 0.72 1.61 2.15 -1.06 -4.62 116.67 115.40 1nu7 s ASP 189 Ca 0.00 -0.14 -0.02 0.00 0.43 0.00 0.00 52.55 52.82 1nu7 s ASP 189 Cb 0.00 0.17 0.12 0.00 -0.30 0.00 0.00 42.92 42.91 1nu7 s ASP 189 CO 0.00 -0.31 0.99 0.00 -0.17 0.00 0.00 175.17 175.68 1nu7 s ALA 190 N -2.45 3.60 0.29 3.66 0.00 -1.26 -0.76 121.76 124.84 1nu7 s ALA 190 Ca 0.14 -1.60 -0.10 0.00 0.00 0.00 0.00 51.96 50.40 1nu7 s ALA 190 Cb 0.05 -2.10 0.04 0.00 0.00 0.00 0.00 23.12 21.10 1nu7 s ALA 190 CO -0.04 -1.43 0.56 0.00 0.00 0.00 0.00 175.76 174.85 1nu7 n GLU 192 N -0.41 1.12 0.00 0.00 2.13 -1.26 -0.26 120.64 121.96 1nu7 n GLU 192 Ca -0.06 0.40 0.00 0.00 0.66 0.00 0.00 57.16 58.16 1nu7 n GLU 192 Cb 0.45 -1.88 0.00 0.00 0.27 0.00 0.00 31.44 30.27 1nu7 n GLU 192 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1nu7 n GLY 193 N 1.98 3.16 0.16 8.31 0.00 -1.26 -1.13 105.19 116.40 1nu7 n GLY 193 Ca 0.15 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.24 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 -0.95 1.61 3.45 -0.96 -3.29 116.42 116.27 1nu7 h ASP 194 Ca 0.00 0.00 -0.69 0.00 0.43 0.00 0.00 57.03 56.77 1nu7 h ASP 194 Cb 0.00 0.00 0.08 0.00 -0.56 0.00 0.00 39.33 38.85 1nu7 h ASP 194 CO 0.00 0.25 -0.23 -1.20 -1.57 0.00 0.00 179.24 176.49 1nu7 n SER 195 N -3.04 -0.62 0.00 6.45 7.64 -1.26 -0.91 113.62 121.88 1nu7 n SER 195 Ca 0.01 1.09 0.00 0.00 1.01 0.00 0.00 58.87 60.97 1nu7 n SER 195 Cb 0.65 -0.89 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 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 1.67 2.50 3.80 0.23 0.00 0.08 -0.51 105.19 112.96 1nu7 n GLY 196 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.12 1.67 0.24 -0.02 0.00 -0.09 -2.93 107.32 104.06 1nu7 s GLY 197 Ca 0.00 0.16 -0.17 0.00 0.00 0.00 0.00 44.72 44.70 1nu7 s GLY 197 CO 0.00 0.48 0.70 2.56 0.00 0.00 0.00 173.10 176.84 1nu7 s PRO 198 N -4.99 4.14 -0.47 2.90 0.04 -1.26 -1.06 135.00 134.30 1nu7 s PRO 198 Ca 0.59 0.75 -0.06 0.00 0.04 0.00 0.00 61.00 62.32 1nu7 s PRO 198 Cb -0.15 -2.77 0.12 0.00 0.04 0.00 0.00 34.50 31.74 1nu7 s PRO 198 CO 0.55 0.35 0.30 0.12 0.04 0.00 0.00 177.00 178.37 1nu7 s PHE 199 N -1.63 3.50 0.22 0.56 2.19 -0.76 -3.69 117.98 118.37 1nu7 s PHE 199 Ca 0.45 -2.18 0.04 0.00 0.33 0.00 0.00 56.93 55.57 1nu7 s PHE 199 Cb -0.15 -3.37 -0.03 0.00 -1.31 0.00 0.00 43.02 38.16 1nu7 s PHE 199 CO 0.20 -0.97 0.34 0.14 1.83 0.00 0.00 175.22 176.76 1nu7 s VAL 200 N 1.12 5.28 -0.00 3.12 -7.23 0.60 -1.46 120.40 121.82 1nu7 s VAL 200 Ca 0.08 -0.91 0.01 0.00 -1.81 0.00 0.00 61.98 59.35 1nu7 s VAL 200 Cb -0.24 -3.83 -0.00 0.00 0.56 0.00 0.00 36.38 32.87 1nu7 s VAL 200 CO -0.03 -0.27 -0.02 -0.04 -0.31 0.00 0.00 175.10 174.43 1nu7 s MET 201 N -3.80 0.15 -0.18 4.82 -1.94 0.57 -0.37 119.30 118.55 1nu7 s MET 201 Ca 0.34 -0.09 -0.16 0.00 -1.71 0.00 0.00 55.69 54.07 1nu7 s MET 201 Cb -0.10 -0.13 -0.04 0.00 2.01 0.00 0.00 34.83 36.57 1nu7 s MET 201 CO 0.29 0.03 0.41 0.21 -0.01 0.00 0.00 175.02 175.95 1nu7 s LYS 202 N -0.11 4.22 0.06 2.03 2.20 -1.26 0.57 119.74 127.45 1nu7 s LYS 202 Ca -0.00 0.25 -0.30 0.00 -0.36 0.00 0.00 55.97 55.56 1nu7 s LYS 202 Cb -0.01 -3.50 -0.05 0.00 -1.51 0.00 0.00 37.83 32.76 1nu7 s LYS 202 CO -0.00 0.03 1.00 0.45 -0.36 0.00 0.00 175.35 176.47 1nu7 s SER 203 N 0.88 7.38 0.17 1.43 0.15 0.04 -4.92 113.70 118.83 1nu7 s SER 203 Ca 0.20 1.77 0.24 0.00 0.70 0.00 0.00 55.95 58.86 1nu7 s SER 203 Cb -0.15 -2.58 0.91 0.00 -1.71 0.00 0.00 66.02 62.50 1nu7 s SER 203 CO 0.08 -0.21 1.74 -0.81 1.20 0.00 0.00 173.24 175.24 1nu7 n PRO 204 N 3.41 0.17 -0.04 5.44 -0.04 -1.26 -0.70 135.00 141.98 1nu7 n PRO 204 Ca 0.05 0.26 -0.19 0.00 -0.04 0.00 0.00 63.50 63.57 1nu7 n PRO 204 Cb 0.50 -1.74 -0.13 0.00 -0.04 0.00 0.00 33.50 32.08 1nu7 n PRO 204 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1nu7 h PHE 204 N 0.00 0.20 0.00 0.54 -1.00 -1.97 -3.40 116.94 111.31 1nu7 h PHE 204 Ca 0.00 -0.15 0.00 0.00 2.81 0.00 0.00 57.97 60.63 1nu7 h PHE 204 Cb 0.52 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 40.07 1nu7 h PHE 204 CO 0.00 1.35 0.00 0.27 -1.61 0.00 0.00 178.31 178.32 1nu7 n ASN 204 N -4.28 1.82 -4.27 2.17 0.23 -1.25 -5.00 115.26 104.67 1nu7 n ASN 204 Ca -0.21 -1.86 -0.38 0.00 -0.53 0.00 0.00 54.58 51.60 1nu7 n ASN 204 Cb 0.71 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 38.36 1nu7 n ASN 204 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1nu7 n ASN 205 N -0.43 -2.64 -4.92 0.53 2.04 0.12 -4.98 115.26 104.98 1nu7 n ASN 205 Ca 0.00 -1.04 -0.22 0.00 -0.44 0.00 0.00 54.58 52.88 1nu7 n ASN 205 Cb 0.24 -2.22 -0.03 0.00 -2.53 0.00 0.00 39.78 35.24 1nu7 n ASN 205 CO 0.00 0.00 0.00 -0.13 -0.44 0.00 0.00 177.26 176.69 1nu7 s ARG 206 N -6.96 3.29 -0.17 -3.83 0.52 -1.25 -4.78 118.95 105.76 1nu7 s ARG 206 Ca 0.75 -0.82 -0.14 0.00 -0.52 0.00 0.00 55.73 55.00 1nu7 s ARG 206 Cb -0.42 -2.81 -0.04 0.00 0.52 0.00 0.00 34.95 32.19 1nu7 s ARG 206 CO 0.92 0.44 0.32 -1.58 0.02 0.00 0.00 175.30 175.42 1nu7 s TRP 207 N -1.97 3.44 -0.10 -0.53 0.52 -1.26 -0.78 118.94 118.26 1nu7 s TRP 207 Ca 0.34 0.60 0.01 0.00 0.02 0.00 0.00 56.10 57.07 1nu7 s TRP 207 Cb -0.09 -2.40 -0.02 0.00 -1.15 0.00 0.00 33.47 29.81 1nu7 s TRP 207 CO 0.28 0.17 -0.13 0.71 0.02 0.00 0.00 176.95 177.99 1nu7 s TYR 208 N 0.70 2.77 -0.51 -1.98 1.51 0.19 -1.79 117.35 118.24 1nu7 s TYR 208 Ca 0.17 -0.46 -0.23 0.00 -1.01 0.00 0.00 57.07 55.55 1nu7 s TYR 208 Cb -0.14 -1.76 0.04 0.00 -0.11 0.00 0.00 41.96 39.99 1nu7 s TYR 208 CO 0.05 -0.06 0.82 -1.14 -1.11 0.00 0.00 175.55 174.12 1nu7 s GLN 209 N -0.07 3.31 -0.02 -0.62 0.74 0.47 -0.32 119.66 123.16 1nu7 s GLN 209 Ca -0.02 -0.34 0.14 0.00 0.05 0.00 0.00 55.36 55.19 1nu7 s GLN 209 Cb -0.14 -4.02 -0.20 0.00 1.10 0.00 0.00 33.01 29.75 1nu7 s GLN 209 CO 0.04 -1.31 0.68 -1.33 -0.55 0.00 0.00 175.29 172.82 1nu7 n MET 210 N 6.95 0.63 -4.23 1.67 2.81 -0.53 -4.20 117.12 120.22 1nu7 n MET 210 Ca 0.00 0.25 -0.14 0.00 -1.81 0.00 0.00 57.70 56.00 1nu7 n MET 210 Cb 0.47 -1.78 -0.10 0.00 -0.71 0.00 0.00 33.22 31.11 1nu7 n MET 210 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1nu7 s GLY 211 N -5.02 1.68 -0.07 3.03 0.00 -0.85 -1.50 107.32 104.58 1nu7 s GLY 211 Ca -0.04 -1.80 -0.01 0.00 0.00 0.00 0.00 44.72 42.88 1nu7 s GLY 211 CO 0.82 -1.43 -0.03 -0.42 0.00 0.00 0.00 173.10 172.05 1nu7 s ILE 212 N -3.96 0.56 -0.16 0.90 1.01 -0.92 -1.82 121.20 116.81 1nu7 s ILE 212 Ca 0.39 -0.03 -0.37 0.00 0.00 0.00 0.00 60.65 60.65 1nu7 s ILE 212 Cb 0.06 -0.66 -0.13 0.00 0.01 0.00 0.00 42.46 41.74 1nu7 s ILE 212 CO 0.16 0.28 1.81 0.52 0.00 0.00 0.00 174.94 177.71 1nu7 n VAL 213 N 4.85 0.45 0.04 2.92 0.31 -0.23 -0.74 118.33 125.94 1nu7 n VAL 213 Ca -0.12 -0.08 -0.00 0.00 -0.01 0.00 0.00 64.34 64.13 1nu7 n VAL 213 Cb 0.50 -1.59 -0.00 0.00 -0.91 0.00 0.00 33.84 31.84 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 5.99 1.12 -3.54 4.52 2.88 -0.38 -0.74 113.62 123.47 1nu7 n SER 214 Ca 0.24 0.14 -0.09 0.00 -1.33 0.00 0.00 58.87 57.83 1nu7 n SER 214 Cb 0.23 -0.34 -0.02 0.00 -0.75 0.00 0.00 64.21 63.32 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 -2.03 0.28 -0.19 0.66 1.48 -0.98 -4.92 118.94 113.23 1nu7 s TRP 215 Ca -0.01 -0.73 -0.36 0.00 -1.06 0.00 0.00 56.10 53.95 1nu7 s TRP 215 Cb 0.00 0.45 0.15 0.00 -1.16 0.00 0.00 33.47 32.91 1nu7 s TRP 215 CO 0.01 -1.24 1.38 0.20 -4.06 0.00 0.00 176.95 173.24 1nu7 s GLY 216 N -3.05 -0.34 -0.36 3.67 0.00 -1.26 0.03 107.32 106.02 1nu7 s GLY 216 Ca 0.19 1.44 -0.08 0.00 0.00 0.00 0.00 44.72 46.27 1nu7 s GLY 216 CO 0.11 0.42 0.15 -0.54 0.00 0.00 0.00 173.10 173.24 1nu7 s GLU 217 N -2.10 2.68 2.16 2.90 2.02 -1.26 -4.95 118.70 120.15 1nu7 s GLU 217 Ca 0.13 -1.17 0.00 0.00 0.02 0.00 0.00 54.97 53.95 1nu7 s GLU 217 Cb 0.03 -3.57 0.00 0.00 0.10 0.00 0.00 34.13 30.69 1nu7 s GLU 217 CO -0.04 -0.70 0.00 0.41 0.02 0.00 0.00 175.26 174.95 1nu7 n GLY 219 N 4.88 -0.76 2.79 -1.39 0.00 -1.26 -4.71 105.19 104.74 1nu7 n GLY 219 Ca -0.12 -1.14 -0.15 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 4.01 -4.64 -4.78 0.00 2.03 -1.26 -4.53 116.55 107.38 1nu7 n ASP 221 Ca -0.25 -0.27 -0.38 0.00 0.52 0.00 0.00 54.79 54.40 1nu7 n ASP 221 Cb 0.52 -3.81 -0.06 0.00 -0.72 0.00 0.00 41.12 37.04 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 -5.76 4.55 0.15 -0.67 0.52 -1.26 -4.92 118.95 111.56 1nu7 s ARG 221 Ca 0.31 1.20 -0.31 0.00 -0.52 0.00 0.00 55.73 56.40 1nu7 s ARG 221 Cb -0.15 -3.03 -0.09 0.00 0.52 0.00 0.00 34.95 32.19 1nu7 s ARG 221 CO 0.38 0.43 1.49 -0.51 0.02 0.00 0.00 175.30 177.11 1nu7 s ASP 222 N -1.42 6.69 0.00 0.23 1.01 -1.26 -2.15 116.67 119.77 1nu7 s ASP 222 Ca 0.43 2.50 0.00 0.00 0.71 0.00 0.00 52.55 56.19 1nu7 s ASP 222 Cb -0.21 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.13 1nu7 s ASP 222 CO 0.25 -0.75 0.00 0.61 0.21 0.00 0.00 175.17 175.50 1nu7 n GLY 223 N 3.56 0.48 3.32 0.21 0.00 -1.26 -5.00 105.19 106.49 1nu7 n GLY 223 Ca 0.12 -0.34 -0.27 0.00 0.00 0.00 0.00 46.02 45.53 1nu7 n GLY 223 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1nu7 s LYS 224 N -0.64 1.40 0.04 1.61 2.47 -0.92 -4.77 119.74 118.93 1nu7 s LYS 224 Ca 0.00 -1.15 0.02 0.00 -1.56 0.00 0.00 55.97 53.28 1nu7 s LYS 224 Cb 0.00 -1.68 -0.02 0.00 -1.46 0.00 0.00 37.83 34.66 1nu7 s LYS 224 CO 0.00 0.41 -0.08 0.71 0.16 0.00 0.00 175.35 176.55 1nu7 s TYR 225 N -0.98 0.70 0.47 4.03 2.02 -1.26 -4.69 117.35 117.64 1nu7 s TYR 225 Ca 0.10 -0.49 -0.21 0.00 -0.37 0.00 0.00 57.07 56.10 1nu7 s TYR 225 Cb -0.10 -0.42 -0.09 0.00 -0.40 0.00 0.00 41.96 40.96 1nu7 s TYR 225 CO 0.04 -0.07 1.03 0.20 -1.57 0.00 0.00 175.55 175.17 1nu7 s GLY 226 N -1.55 2.51 -0.02 0.71 0.00 -0.99 -4.64 107.32 103.35 1nu7 s GLY 226 Ca -0.09 0.59 0.06 0.00 0.00 0.00 0.00 44.72 45.27 1nu7 s GLY 226 CO 0.00 0.91 -0.18 -1.36 0.00 0.00 0.00 173.10 172.48 1nu7 s PHE 227 N -1.98 2.58 0.03 1.90 0.40 0.10 -1.51 117.98 119.51 1nu7 s PHE 227 Ca 0.66 -0.25 0.06 0.00 -0.60 0.00 0.00 56.93 56.80 1nu7 s PHE 227 Cb -0.16 -1.55 -0.02 0.00 0.51 0.00 0.00 43.02 41.80 1nu7 s PHE 227 CO 0.20 0.16 -0.17 0.71 0.70 0.00 0.00 175.22 176.81 1nu7 s TYR 228 N -0.77 1.53 -0.13 0.36 1.51 0.18 -1.25 117.35 118.79 1nu7 s TYR 228 Ca 0.12 -0.35 -0.29 0.00 -1.01 0.00 0.00 57.07 55.54 1nu7 s TYR 228 Cb -0.10 -0.92 -0.03 0.00 -0.11 0.00 0.00 41.96 40.80 1nu7 s TYR 228 CO 0.02 0.05 1.37 0.99 -1.11 0.00 0.00 175.55 176.86 1nu7 s THR 229 N -0.74 4.09 -0.45 -0.71 2.01 0.08 -1.33 115.64 118.59 1nu7 s THR 229 Ca 0.05 1.32 -0.28 0.00 0.31 0.00 0.00 61.69 63.09 1nu7 s THR 229 Cb -0.08 -3.85 -0.01 0.00 0.01 0.00 0.00 72.50 68.57 1nu7 s THR 229 CO 0.01 -0.11 1.70 -2.28 -0.69 0.00 0.00 174.62 173.25 1nu7 s HIS 230 N 3.59 1.94 0.15 4.92 2.46 0.08 -2.17 115.29 126.25 1nu7 s HIS 230 Ca 0.60 0.66 -0.12 0.00 0.47 0.00 0.00 55.06 56.66 1nu7 s HIS 230 Cb -0.25 -4.19 0.03 0.00 -0.13 0.00 0.00 32.58 28.04 1nu7 s HIS 230 CO 0.19 -2.47 1.63 0.28 -2.47 0.00 0.00 174.74 171.89 1nu7 h VAL 231 N 6.71 1.26 -0.77 0.89 2.07 -1.57 -3.03 116.25 121.80 1nu7 h VAL 231 Ca -0.30 -0.99 -0.05 0.00 0.82 0.00 0.00 66.70 66.18 1nu7 h VAL 231 Cb 1.15 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.78 1nu7 h VAL 231 CO 1.11 0.35 0.29 0.15 0.02 0.00 0.00 177.57 179.49 1nu7 h PHE 232 N 0.74 1.19 -0.25 1.57 3.57 -1.85 -1.96 116.94 119.96 1nu7 h PHE 232 Ca 0.15 -0.10 0.07 0.00 3.53 0.00 0.00 57.97 61.63 1nu7 h PHE 232 Cb 0.44 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 1nu7 h PHE 232 CO 0.03 0.91 0.21 0.00 -2.23 0.00 0.00 178.31 177.24 1nu7 h ARG 233 N 1.13 0.00 -0.31 1.11 3.08 -1.91 -1.55 114.38 115.93 1nu7 h ARG 233 Ca 0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.31 1nu7 h ARG 233 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.29 1nu7 h ARG 233 CO -0.02 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.16 1nu7 n LEU 234 N -4.12 3.50 0.19 3.04 4.77 -0.80 -4.68 117.00 118.90 1nu7 n LEU 234 Ca 0.03 -2.54 0.04 0.00 -0.03 0.00 0.00 56.01 53.51 1nu7 n LEU 234 Cb 0.36 -0.40 0.40 0.00 -2.33 0.00 0.00 43.42 41.44 1nu7 n LEU 234 CO 0.32 0.70 0.75 0.50 -1.33 0.00 0.00 177.39 178.33 1nu7 h LYS 235 N 1.99 0.00 -0.44 3.23 3.64 -0.62 -2.27 116.57 122.09 1nu7 h LYS 235 Ca 0.00 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.24 1nu7 h LYS 235 Cb 1.13 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.94 1nu7 h LYS 235 CO 0.13 0.34 -0.27 0.87 -2.27 0.00 0.00 179.45 178.25 1nu7 h LYS 236 N 0.00 0.96 -0.02 1.90 1.57 -1.83 -1.24 116.57 117.90 1nu7 h LYS 236 Ca -0.00 -0.45 -0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1nu7 h LYS 236 Cb 0.64 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.94 1nu7 h LYS 236 CO 0.04 1.11 0.01 2.35 -0.57 0.00 0.00 179.45 182.40 1nu7 h TRP 237 N 0.80 0.03 -0.44 -1.35 7.01 -1.86 -0.84 115.95 119.31 1nu7 h TRP 237 Ca 0.09 -0.00 0.09 0.00 2.11 0.00 0.00 58.89 61.18 1nu7 h TRP 237 Cb 0.86 -0.01 -0.08 0.00 -2.10 0.00 0.00 29.16 27.82 1nu7 h TRP 237 CO 0.06 0.08 -0.10 0.82 -2.79 0.00 0.00 178.44 176.51 1nu7 h ILE 238 N -0.02 0.57 -0.66 2.65 2.04 -1.20 -0.64 117.51 120.25 1nu7 h ILE 238 Ca 0.01 -0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.83 1nu7 h ILE 238 Cb 0.06 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 36.67 1nu7 h ILE 238 CO -0.00 0.00 0.26 1.56 0.00 0.00 0.00 178.15 179.97 1nu7 h GLN 239 N 0.01 0.99 -0.18 2.37 4.20 -1.06 -0.35 115.11 121.09 1nu7 h GLN 239 Ca 0.21 -0.18 0.01 0.00 0.06 0.00 0.00 58.65 58.75 1nu7 h GLN 239 Cb 0.32 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.93 1nu7 h GLN 239 CO -0.44 0.83 0.08 0.87 -0.67 0.00 0.00 178.83 179.50 1nu7 h LYS 240 N 0.93 0.18 0.26 1.46 1.57 -0.44 0.13 116.57 120.66 1nu7 h LYS 240 Ca 0.22 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1nu7 h LYS 240 Cb 0.22 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 1nu7 h LYS 240 CO -0.02 0.12 -0.24 0.28 -0.57 0.00 0.00 179.45 179.02 1nu7 h VAL 241 N 0.19 0.49 -0.33 0.50 2.07 -0.84 0.26 116.25 118.59 1nu7 h VAL 241 Ca 0.08 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.57 1nu7 h VAL 241 Cb 0.02 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 1nu7 h VAL 241 CO -0.06 0.00 0.11 0.40 0.02 0.00 0.00 177.57 178.04 1nu7 h ILE 242 N -0.52 1.14 0.00 4.57 2.04 -0.82 0.31 117.51 124.23 1nu7 h ILE 242 Ca -0.01 -0.47 -0.19 0.00 1.00 0.00 0.00 64.86 65.19 1nu7 h ILE 242 Cb 0.48 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.31 1nu7 h ILE 242 CO -0.04 0.17 -0.92 0.44 0.00 0.00 0.00 178.15 177.80 1nu7 h ASP 243 N 0.46 0.00 0.16 1.72 3.32 -0.46 -3.33 116.42 118.29 1nu7 h ASP 243 Ca 0.11 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.92 1nu7 h ASP 243 Cb 0.14 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.70 1nu7 h ASP 243 CO -0.01 0.92 -1.15 -0.61 -1.72 0.00 0.00 179.24 176.68 1nu7 h GLN 244 N 0.00 0.34 -6.21 3.56 4.15 -0.61 -3.47 115.11 112.87 1nu7 h GLN 244 Ca -0.01 -0.58 -0.49 0.00 0.77 0.00 0.00 58.65 58.35 1nu7 h GLN 244 Cb 1.64 0.22 -0.03 0.00 0.21 0.00 0.00 27.48 29.52 1nu7 h GLN 244 CO 0.12 1.28 -0.47 -0.06 -1.93 0.00 0.00 178.83 177.77 1nu7 s PHE 245 N -2.48 3.12 0.00 3.99 0.08 0.07 -5.10 117.98 117.66 1nu7 s PHE 245 Ca -0.14 -0.16 0.00 0.00 0.12 0.00 0.00 56.93 56.75 1nu7 s PHE 245 Cb 0.03 -1.60 0.00 0.00 -0.57 0.00 0.00 43.02 40.87 1nu7 s PHE 245 CO 0.84 0.36 0.00 0.41 -0.10 0.00 0.00 175.22 176.73