#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pff h ALA 66 N 0.00 1.02 0.04 7.33 0.00 -2.00 -1.04 119.26 124.60 1pff h ALA 66 Ca 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1pff h ALA 66 Cb 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.47 1pff h ALA 66 CO 0.00 0.49 -0.02 1.25 0.00 0.00 0.00 179.25 180.97 1pff h LEU 67 N 1.09 -0.04 -0.74 0.00 5.85 -1.98 -2.46 115.31 117.03 1pff h LEU 67 Ca 0.29 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.89 1pff h LEU 67 Cb -0.03 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 1pff h LEU 67 CO -0.05 0.12 0.47 -0.33 -0.34 0.00 0.00 178.44 178.31 1pff h GLU 68 N -0.21 0.89 -0.91 1.25 5.08 -1.83 -1.67 114.58 117.18 1pff h GLU 68 Ca -0.00 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1pff h GLU 68 Cb 0.19 -0.20 -0.05 0.00 0.50 0.00 0.00 28.75 29.19 1pff h GLU 68 CO 0.01 0.59 0.60 0.78 -1.00 0.00 0.00 179.01 179.99 1pff h GLY 69 N 0.91 1.28 0.93 -3.84 0.00 -1.14 -1.31 103.07 99.90 1pff h GLY 69 Ca 0.30 -0.47 -0.10 0.00 0.00 0.00 0.00 47.33 47.06 1pff h GLY 69 CO -0.11 0.46 -0.19 0.50 0.00 0.00 0.00 176.54 177.19 1pff h LYS 70 N 1.22 0.64 -0.50 4.80 1.57 -0.89 -2.29 116.57 121.12 1pff h LYS 70 Ca 0.34 -0.30 -0.11 0.00 -1.87 0.00 0.00 60.65 58.70 1pff h LYS 70 Cb -0.13 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 1pff h LYS 70 CO -0.08 0.90 -0.12 0.82 -0.57 0.00 0.00 179.45 180.40 1pff h ILE 71 N 0.39 1.27 -0.86 1.86 1.08 -1.28 -1.93 117.51 118.04 1pff h ILE 71 Ca 0.06 -1.25 0.02 0.00 -0.39 0.00 0.00 64.86 63.30 1pff h ILE 71 Cb 0.73 1.01 -0.05 0.00 -3.07 0.00 0.00 36.82 35.45 1pff h ILE 71 CO 0.05 0.44 0.56 0.00 -0.69 0.00 0.00 178.15 178.51 1pff h ALA 72 N 1.02 1.11 -0.74 1.87 0.00 -1.19 -1.11 119.26 120.22 1pff h ALA 72 Ca 0.13 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1pff h ALA 72 Cb 0.66 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1pff h ALA 72 CO 0.05 0.43 0.24 0.87 0.00 0.00 0.00 179.25 180.84 1pff h LYS 73 N 1.11 1.14 -0.29 0.00 1.57 -1.19 0.17 116.57 119.07 1pff h LYS 73 Ca 0.33 -0.24 -0.06 0.00 -1.87 0.00 0.00 60.65 58.82 1pff h LYS 73 Cb -0.05 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.07 1pff h LYS 73 CO -0.10 0.97 -0.05 -0.07 -0.57 0.00 0.00 179.45 179.63 1pff h LEU 74 N 1.10 0.44 -2.08 2.94 3.38 -0.66 -2.95 115.31 117.49 1pff h LEU 74 Ca 0.24 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1pff h LEU 74 Cb 0.30 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1pff h LEU 74 CO -0.01 0.55 0.00 -0.62 0.09 0.00 0.00 178.44 178.45 1pff n GLU 75 N -4.26 2.39 -3.21 1.13 -0.58 -0.48 -4.83 120.64 110.80 1pff n GLU 75 Ca 0.01 -2.06 -0.23 0.00 -0.42 0.00 0.00 57.16 54.45 1pff n GLU 75 Cb 0.27 -1.49 0.03 0.00 -0.57 0.00 0.00 31.44 29.68 1pff n GLU 75 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1pff n HIS 76 N 1.38 -2.04 -3.23 -0.32 8.25 -0.33 -4.65 115.22 114.26 1pff n HIS 76 Ca 0.17 0.58 -0.27 0.00 -0.26 0.00 0.00 57.72 57.94 1pff n HIS 76 Cb 0.59 -4.17 -0.02 0.00 1.12 0.00 0.00 29.99 27.52 1pff n HIS 76 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1pff s ALA 77 N -3.14 3.61 0.19 -1.41 0.00 0.45 -4.95 121.76 116.50 1pff s ALA 77 Ca 0.38 -0.68 -0.05 0.00 0.00 0.00 0.00 51.96 51.61 1pff s ALA 77 Cb -0.18 -2.28 0.10 0.00 0.00 0.00 0.00 23.12 20.77 1pff s ALA 77 CO 0.46 0.04 1.52 0.93 0.00 0.00 0.00 175.76 178.72 1pff h GLU 78 N 1.09 0.67 -3.45 0.00 5.08 -1.82 -3.41 114.58 112.73 1pff h GLU 78 Ca -0.48 -0.37 -0.04 0.00 -1.00 0.00 0.00 59.36 57.46 1pff h GLU 78 Cb 1.20 0.02 -0.11 0.00 0.50 0.00 0.00 28.75 30.37 1pff h GLU 78 CO 0.64 0.99 -0.07 0.00 -1.00 0.00 0.00 179.01 179.56 1pff s ALA 79 N -4.18 -0.74 -0.01 3.43 0.00 -0.46 -4.76 121.76 115.04 1pff s ALA 79 Ca -0.08 -0.33 -0.07 0.00 0.00 0.00 0.00 51.96 51.48 1pff s ALA 79 Cb 0.12 0.82 0.00 0.00 0.00 0.00 0.00 23.12 24.06 1pff s ALA 79 CO 0.85 -0.74 0.14 0.00 0.00 0.00 0.00 175.76 176.01 1pff s ALA 81 N -1.02 2.00 0.25 0.00 0.00 0.88 -4.82 121.76 119.05 1pff s ALA 81 Ca -0.11 -0.98 -0.21 0.00 0.00 0.00 0.00 51.96 50.66 1pff s ALA 81 Cb -0.06 -1.04 -0.09 0.00 0.00 0.00 0.00 23.12 21.93 1pff s ALA 81 CO 0.01 -0.28 0.78 0.00 0.00 0.00 0.00 175.76 176.27 1pff s ALA 82 N 1.27 3.36 0.35 0.00 0.00 -1.26 -0.32 121.76 125.15 1pff s ALA 82 Ca 0.02 0.25 0.04 0.00 0.00 0.00 0.00 51.96 52.26 1pff s ALA 82 Cb -0.14 -2.91 -0.04 0.00 0.00 0.00 0.00 23.12 20.04 1pff s ALA 82 CO -0.09 0.29 0.14 0.95 0.00 0.00 0.00 175.76 177.05 1pff s THR 83 N -1.56 0.55 0.12 0.00 -4.23 0.04 -4.30 115.64 106.26 1pff s THR 83 Ca 0.45 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.24 1pff s THR 83 Cb -0.17 -2.50 0.31 0.00 1.34 0.00 0.00 72.50 71.48 1pff s THR 83 CO 0.22 0.00 1.90 0.00 -0.54 0.00 0.00 174.62 176.20 1pff h ALA 84 N 2.04 1.02 -2.34 3.99 0.00 -1.15 -1.31 119.26 121.51 1pff h ALA 84 Ca -0.35 -0.11 0.16 0.00 0.00 0.00 0.00 54.91 54.62 1pff h ALA 84 Cb 1.26 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.94 1pff h ALA 84 CO 0.56 0.15 0.48 -1.54 0.00 0.00 0.00 179.25 178.90 1pff s SER 85 N -5.98 -0.21 0.22 0.00 1.04 -1.26 -3.07 113.70 104.43 1pff s SER 85 Ca 0.01 -0.34 -0.09 0.00 0.48 0.00 0.00 55.95 56.01 1pff s SER 85 Cb 0.10 0.47 0.19 0.00 0.10 0.00 0.00 66.02 66.88 1pff s SER 85 CO 0.59 -0.86 1.88 1.23 0.98 0.00 0.00 173.24 177.06 1pff h GLY 86 N 2.00 1.12 1.04 7.32 0.00 -1.74 -1.03 103.07 111.77 1pff h GLY 86 Ca -0.24 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 46.68 1pff h GLY 86 CO 0.26 0.37 0.51 1.98 0.00 0.00 0.00 176.54 179.67 1pff h MET 87 N 1.03 1.26 -0.90 4.80 1.85 -1.92 -1.61 114.93 119.44 1pff h MET 87 Ca 0.30 -0.14 0.04 0.00 -0.61 0.00 0.00 59.70 59.29 1pff h MET 87 Cb -0.07 -0.25 -0.05 0.00 0.43 0.00 0.00 31.60 31.65 1pff h MET 87 CO -0.08 0.91 0.59 0.78 -0.40 0.00 0.00 176.91 178.71 1pff h GLY 88 N 1.27 1.30 0.79 1.39 0.00 -1.75 0.31 103.07 106.38 1pff h GLY 88 Ca 0.32 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 47.19 1pff h GLY 88 CO -0.05 0.38 0.01 0.00 0.00 0.00 0.00 176.54 176.88 1pff h ALA 89 N 1.47 0.17 0.02 3.60 0.00 -0.62 -0.15 119.26 123.76 1pff h ALA 89 Ca 0.36 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1pff h ALA 89 Cb 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1pff h ALA 89 CO -0.11 -0.16 -0.01 0.82 0.00 0.00 0.00 179.25 179.79 1pff h ILE 90 N -0.03 1.02 -0.28 0.00 2.04 -1.03 -2.47 117.51 116.76 1pff h ILE 90 Ca 0.04 -0.12 -0.00 0.00 1.00 0.00 0.00 64.86 65.77 1pff h ILE 90 Cb 0.32 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 1pff h ILE 90 CO 0.00 0.03 0.17 0.00 0.00 0.00 0.00 178.15 178.36 1pff h ALA 91 N 0.90 0.35 0.00 1.87 0.00 -0.36 -0.27 119.26 121.75 1pff h ALA 91 Ca -0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1pff h ALA 91 Cb 0.07 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1pff h ALA 91 CO 0.00 -0.16 -0.11 0.00 0.00 0.00 0.00 179.25 178.99 1pff h ALA 92 N 1.07 1.14 0.05 0.00 0.00 -1.02 -0.61 119.26 119.89 1pff h ALA 92 Ca 0.10 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1pff h ALA 92 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1pff h ALA 92 CO -0.02 0.14 -0.02 0.77 0.00 0.00 0.00 179.25 180.12 1pff h SER 93 N 0.00 -0.05 -0.14 0.00 0.02 -1.00 -3.32 113.55 109.06 1pff h SER 93 Ca -0.00 -0.27 -0.03 0.00 -0.84 0.00 0.00 61.79 60.64 1pff h SER 93 Cb 0.43 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 62.98 1pff h SER 93 CO 0.01 0.57 -0.05 -0.37 -1.14 0.00 0.00 176.83 175.86 1pff h VAL 94 N -1.00 1.30 -0.37 2.27 -1.51 -0.87 -3.07 116.25 113.00 1pff h VAL 94 Ca -0.01 -1.03 -0.03 0.00 -1.23 0.00 0.00 66.70 64.40 1pff h VAL 94 Cb 0.32 1.70 -0.02 0.00 -2.13 0.00 0.00 31.29 31.16 1pff h VAL 94 CO 0.01 0.30 0.09 -0.50 -1.23 0.00 0.00 177.57 176.24 1pff h TRP 95 N -0.05 0.54 -0.65 5.19 4.06 -1.35 -2.59 115.95 121.11 1pff h TRP 95 Ca 0.03 -0.03 -0.00 0.00 2.06 0.00 0.00 58.89 60.95 1pff h TRP 95 Cb 0.49 -0.17 -0.03 0.00 -1.00 0.00 0.00 29.16 28.45 1pff h TRP 95 CO 0.06 0.48 0.40 1.15 -3.56 0.00 0.00 178.44 176.96 1pff h THR 96 N 0.53 1.18 -0.40 1.49 2.02 -1.64 -3.19 112.91 112.90 1pff h THR 96 Ca 0.12 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.93 1pff h THR 96 Cb 0.21 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 66.87 1pff h THR 96 CO -0.00 0.18 0.00 0.49 0.37 0.00 0.00 175.52 176.56 1pff n PHE 97 N -4.41 0.62 -4.49 3.16 3.01 -1.01 -4.96 117.46 109.38 1pff n PHE 97 Ca 0.06 -0.54 -0.25 0.00 1.01 0.00 0.00 57.45 57.73 1pff n PHE 97 Cb 0.06 -0.06 -0.10 0.00 -0.01 0.00 0.00 39.48 39.37 1pff n PHE 97 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1pff s LEU 98 N -1.20 2.78 0.18 4.37 1.43 -1.02 -4.95 118.68 120.26 1pff s LEU 98 Ca 0.29 -1.13 -0.16 0.00 -1.03 0.00 0.00 54.13 52.11 1pff s LEU 98 Cb 0.17 -1.10 0.02 0.00 0.03 0.00 0.00 46.19 45.31 1pff s LEU 98 CO 0.18 -0.18 0.46 -1.59 0.23 0.00 0.00 176.35 175.44 1pff s LYS 99 N -3.62 1.28 0.22 1.70 -2.85 -1.26 -4.94 119.74 110.27 1pff s LYS 99 Ca 0.33 -0.89 -0.32 0.00 -1.00 0.00 0.00 55.97 54.08 1pff s LYS 99 Cb 0.01 0.49 -0.14 0.00 -2.06 0.00 0.00 37.83 36.13 1pff s LYS 99 CO 0.17 -0.53 1.43 0.00 0.10 0.00 0.00 175.35 176.52 1pff n ALA 100 N -0.30 1.04 0.00 0.59 0.00 -1.26 -1.46 120.51 119.12 1pff n ALA 100 Ca -0.11 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1pff n ALA 100 Cb 0.63 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.80 1pff n ALA 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pff n GLY 101 N 2.40 0.15 3.93 0.00 0.00 -0.01 -4.97 105.19 106.69 1pff n GLY 101 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 1pff n GLY 101 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1pff s ASP 102 N -2.07 4.51 -0.01 1.61 1.01 -0.54 -4.88 116.67 116.29 1pff s ASP 102 Ca 0.00 0.46 0.04 0.00 0.71 0.00 0.00 52.55 53.76 1pff s ASP 102 Cb 0.00 -0.98 -0.01 0.00 1.01 0.00 0.00 42.92 42.94 1pff s ASP 102 CO 0.00 -1.82 -0.12 -2.28 0.21 0.00 0.00 175.17 171.16 1pff s HIS 103 N -3.40 1.09 -0.04 4.23 5.65 -0.10 -1.32 115.29 121.39 1pff s HIS 103 Ca 0.63 -0.22 0.04 0.00 0.25 0.00 0.00 55.06 55.75 1pff s HIS 103 Cb -0.10 -0.71 -0.00 0.00 -1.18 0.00 0.00 32.58 30.59 1pff s HIS 103 CO 0.47 -0.04 -0.16 -1.17 -0.65 0.00 0.00 174.74 173.19 1pff s LEU 104 N -0.20 1.88 -0.19 8.88 0.20 0.23 -0.98 118.68 128.50 1pff s LEU 104 Ca 0.03 -0.33 -0.05 0.00 0.69 0.00 0.00 54.13 54.47 1pff s LEU 104 Cb -0.06 -0.91 -0.03 0.00 -0.43 0.00 0.00 46.19 44.76 1pff s LEU 104 CO -0.00 0.13 0.00 -0.63 -0.29 0.00 0.00 176.35 175.56 1pff s ILE 105 N 0.12 4.10 0.12 6.68 1.01 -0.30 -1.60 121.20 131.32 1pff s ILE 105 Ca -0.05 -0.27 0.09 0.00 0.00 0.00 0.00 60.65 60.42 1pff s ILE 105 Cb -0.12 -2.84 -0.04 0.00 0.01 0.00 0.00 42.46 39.48 1pff s ILE 105 CO 0.02 0.45 -0.21 -0.55 0.00 0.00 0.00 174.94 174.64 1pff s SER 106 N 0.75 2.69 0.69 3.58 0.15 -0.28 -0.68 113.70 120.59 1pff s SER 106 Ca 0.00 -0.72 -0.15 0.00 0.70 0.00 0.00 55.95 55.78 1pff s SER 106 Cb -0.14 -0.16 0.02 0.00 -1.71 0.00 0.00 66.02 64.03 1pff s SER 106 CO 0.02 0.06 1.15 -0.62 1.20 0.00 0.00 173.24 175.06 1pff s ASP 107 N -2.05 4.69 0.00 5.45 3.68 -0.61 -0.73 116.67 127.10 1pff s ASP 107 Ca 0.09 2.17 0.21 0.00 2.13 0.00 0.00 52.55 57.15 1pff s ASP 107 Cb -0.09 -2.57 0.71 0.00 -1.45 0.00 0.00 42.92 39.52 1pff s ASP 107 CO 0.05 -1.92 1.53 -0.90 0.13 0.00 0.00 175.17 174.06 1pff n ASP 108 N -2.53 1.90 -4.13 -0.34 5.75 0.38 -4.55 116.55 113.04 1pff n ASP 108 Ca 0.12 -1.74 -0.38 0.00 -0.01 0.00 0.00 54.79 52.78 1pff n ASP 108 Cb 0.51 -0.12 -0.08 0.00 -1.03 0.00 0.00 41.12 40.41 1pff n ASP 108 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1pff s LEU 110 N -0.37 2.35 0.26 0.00 1.43 -1.26 -4.20 118.68 116.89 1pff s LEU 110 Ca 0.20 -0.61 -0.30 0.00 -1.03 0.00 0.00 54.13 52.39 1pff s LEU 110 Cb -0.16 -1.34 -0.14 0.00 0.03 0.00 0.00 46.19 44.59 1pff s LEU 110 CO -0.06 0.23 1.29 0.00 0.23 0.00 0.00 176.35 178.03 1pff n TYR 111 N 1.37 1.93 -0.38 0.29 9.36 -1.26 -4.81 117.16 123.66 1pff n TYR 111 Ca -0.17 0.53 0.02 0.00 3.32 0.00 0.00 57.90 61.60 1pff n TYR 111 Cb 0.52 -2.39 0.08 0.00 -0.63 0.00 0.00 39.34 36.92 1pff n TYR 111 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1pff n GLY 112 N 1.72 -1.92 0.29 2.98 0.00 -1.26 -1.70 105.19 105.30 1pff n GLY 112 Ca 0.10 1.10 -0.06 0.00 0.00 0.00 0.00 46.02 47.16 1pff n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pff h THR 114 N 0.80 1.24 -0.57 0.00 2.02 -1.70 -1.78 112.91 112.91 1pff h THR 114 Ca 0.14 -0.49 -0.03 0.00 0.77 0.00 0.00 66.41 66.81 1pff h THR 114 Cb 0.54 -0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.92 1pff h THR 114 CO 0.03 0.24 0.26 -0.74 0.37 0.00 0.00 175.52 175.68 1pff h HIS 115 N 1.19 0.84 -0.66 3.16 6.17 -1.17 -2.08 115.15 122.61 1pff h HIS 115 Ca 0.31 -0.05 -0.02 0.00 0.71 0.00 0.00 60.37 61.33 1pff h HIS 115 Cb -0.08 -0.26 -0.03 0.00 2.52 0.00 0.00 27.41 29.57 1pff h HIS 115 CO -0.00 0.66 0.33 0.00 0.71 0.00 0.00 177.93 179.63 1pff h ALA 116 N 1.10 0.85 -0.39 5.26 0.00 -1.14 0.58 119.26 125.52 1pff h ALA 116 Ca 0.19 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1pff h ALA 116 Cb 0.15 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1pff h ALA 116 CO -0.02 0.39 0.20 1.25 0.00 0.00 0.00 179.25 181.07 1pff h LEU 117 N 0.91 0.30 -0.01 0.00 5.85 -1.06 -1.18 115.31 120.11 1pff h LEU 117 Ca 0.23 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 1pff h LEU 117 Cb 0.09 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.08 1pff h LEU 117 CO -0.03 0.22 -0.06 -0.26 -0.34 0.00 0.00 178.44 177.96 1pff h PHE 118 N 0.41 0.09 -0.32 1.25 0.04 -1.09 -0.69 116.94 116.63 1pff h PHE 118 Ca 0.16 -0.04 -0.12 0.00 2.80 0.00 0.00 57.97 60.78 1pff h PHE 118 Cb 0.06 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 1pff h PHE 118 CO -0.09 0.73 -0.26 1.49 -0.60 0.00 0.00 178.31 179.57 1pff h GLU 119 N -0.58 0.73 0.00 1.51 4.81 0.19 -3.32 114.58 117.92 1pff h GLU 119 Ca -0.00 -0.37 -0.39 0.00 -0.13 0.00 0.00 59.36 58.47 1pff h GLU 119 Cb 0.74 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.06 1pff h GLU 119 CO 0.01 0.99 -2.29 0.72 -0.73 0.00 0.00 179.01 177.71 1pff n HIS 120 N -4.26 0.00 -0.02 0.92 8.25 -0.46 -4.49 115.22 115.16 1pff n HIS 120 Ca -0.03 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.32 1pff n HIS 120 Cb 0.46 -0.83 -0.09 0.00 1.12 0.00 0.00 29.99 30.64 1pff n HIS 120 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 1pff h GLN 121 N -0.75 -0.06 -0.43 -0.41 1.08 -1.31 -2.68 115.11 110.56 1pff h GLN 121 Ca -0.58 0.00 0.05 0.00 -1.45 0.00 0.00 58.65 56.67 1pff h GLN 121 Cb 1.54 0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 28.94 1pff h GLN 121 CO -0.33 0.58 0.18 -0.07 -0.95 0.00 0.00 178.83 178.24 1pff h LEU 122 N -0.88 0.23 -1.41 1.46 3.38 -1.26 -2.87 115.31 113.96 1pff h LEU 122 Ca -0.01 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1pff h LEU 122 Cb 0.67 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 1pff h LEU 122 CO 0.01 0.17 0.32 0.03 0.09 0.00 0.00 178.44 179.06 1pff h ARG 123 N 0.37 0.72 0.00 1.13 3.08 -1.66 -1.75 114.38 116.27 1pff h ARG 123 Ca 0.19 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.18 1pff h ARG 123 Cb 0.15 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.04 1pff h ARG 123 CO -0.17 0.51 0.00 1.57 -1.07 0.00 0.00 179.97 180.81 1pff h LYS 124 N 0.73 0.00 -0.82 0.04 2.10 -1.25 -2.72 116.57 114.65 1pff h LYS 124 Ca 0.19 0.00 -0.33 0.00 -2.00 0.00 0.00 60.65 58.51 1pff h LYS 124 Cb -0.02 0.00 -0.20 0.00 -0.90 0.00 0.00 32.23 31.11 1pff h LYS 124 CO -0.04 0.00 0.40 1.19 -2.00 0.00 0.00 179.45 179.01 1pff n PHE 125 N -2.67 2.62 -1.04 0.07 3.72 -0.70 -4.95 117.46 114.51 1pff n PHE 125 Ca 0.03 -1.47 -0.01 0.00 -0.05 0.00 0.00 57.45 55.95 1pff n PHE 125 Cb 0.38 -0.78 -0.01 0.00 -0.94 0.00 0.00 39.48 38.13 1pff n PHE 125 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1pff n GLY 126 N -0.59 0.50 3.72 1.37 0.00 -1.03 -4.01 105.19 105.16 1pff n GLY 126 Ca 0.48 -0.55 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 1pff n GLY 126 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pff s VAL 127 N -2.00 5.17 0.09 1.61 1.01 -0.95 -0.83 120.40 124.49 1pff s VAL 127 Ca 0.00 1.01 -0.25 0.00 0.00 0.00 0.00 61.98 62.74 1pff s VAL 127 Cb 0.00 -3.84 -0.06 0.00 0.00 0.00 0.00 36.38 32.47 1pff s VAL 127 CO 0.00 0.32 0.78 -1.61 0.00 0.00 0.00 175.10 174.59 1pff s GLU 128 N 0.61 4.53 -0.06 2.72 2.02 -0.44 -3.79 118.70 124.29 1pff s GLU 128 Ca 0.27 1.12 0.02 0.00 0.02 0.00 0.00 54.97 56.39 1pff s GLU 128 Cb -0.15 -3.33 0.02 0.00 0.10 0.00 0.00 34.13 30.76 1pff s GLU 128 CO 0.11 0.37 -0.08 0.08 0.02 0.00 0.00 175.26 175.76 1pff s VAL 129 N -0.39 0.84 -0.14 2.63 1.01 -1.26 -0.60 120.40 122.48 1pff s VAL 129 Ca 0.38 -0.30 -0.03 0.00 0.00 0.00 0.00 61.98 62.03 1pff s VAL 129 Cb -0.21 -0.80 -0.03 0.00 0.00 0.00 0.00 36.38 35.34 1pff s VAL 129 CO 0.24 0.29 -0.04 -1.81 0.00 0.00 0.00 175.10 173.79 1pff s ASP 130 N 0.80 4.82 -0.26 3.32 1.01 -0.63 -4.99 116.67 120.74 1pff s ASP 130 Ca -0.13 -0.10 -0.11 0.00 0.71 0.00 0.00 52.55 52.92 1pff s ASP 130 Cb -0.15 -1.72 -0.05 0.00 1.01 0.00 0.00 42.92 42.01 1pff s ASP 130 CO 0.02 0.20 0.21 -0.36 0.21 0.00 0.00 175.17 175.44 1pff s PHE 131 N 0.18 3.25 0.12 4.23 0.40 -1.26 -1.13 117.98 123.78 1pff s PHE 131 Ca -0.02 0.19 0.03 0.00 -0.60 0.00 0.00 56.93 56.54 1pff s PHE 131 Cb -0.14 -2.37 -0.04 0.00 0.51 0.00 0.00 43.02 40.98 1pff s PHE 131 CO 0.03 -0.10 -0.09 0.96 0.70 0.00 0.00 175.22 176.72 1pff s ILE 132 N 1.57 0.97 -0.64 0.64 -4.36 0.09 -4.79 121.20 114.68 1pff s ILE 132 Ca 0.08 -1.92 -0.26 0.00 -0.26 0.00 0.00 60.65 58.29 1pff s ILE 132 Cb -0.15 -1.68 0.04 0.00 1.25 0.00 0.00 42.46 41.92 1pff s ILE 132 CO 0.09 -0.74 1.13 -0.62 0.24 0.00 0.00 174.94 175.04 1pff s ASP 133 N -2.96 6.28 0.00 4.36 -1.08 -1.26 -0.47 116.67 121.54 1pff s ASP 133 Ca 0.12 -0.37 0.29 0.00 -0.52 0.00 0.00 52.55 52.07 1pff s ASP 133 Cb 0.02 -2.51 1.73 0.00 -1.46 0.00 0.00 42.92 40.70 1pff s ASP 133 CO -0.01 -1.55 2.11 0.23 0.52 0.00 0.00 175.17 176.47 1pff n MET 134 N 8.43 0.99 0.00 4.34 2.81 -1.26 -2.40 117.12 130.04 1pff n MET 134 Ca 0.03 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 56.05 1pff n MET 134 Cb 0.48 -1.45 0.42 0.00 -0.71 0.00 0.00 33.22 31.96 1pff n MET 134 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1pff n ALA 135 N -0.95 3.04 -2.65 3.04 0.00 -1.26 -4.73 120.51 117.00 1pff n ALA 135 Ca 0.22 -0.27 -0.42 0.00 0.00 0.00 0.00 53.44 52.97 1pff n ALA 135 Cb 0.10 -1.26 -0.03 0.00 0.00 0.00 0.00 19.45 18.26 1pff n ALA 135 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1pff s VAL 136 N -2.89 4.75 0.27 0.00 1.01 -1.01 -5.00 120.40 117.54 1pff s VAL 136 Ca 0.15 1.72 -0.30 0.00 0.00 0.00 0.00 61.98 63.55 1pff s VAL 136 Cb 0.18 -4.21 -0.13 0.00 0.00 0.00 0.00 36.38 32.23 1pff s VAL 136 CO 0.60 -0.15 1.41 -2.65 0.00 0.00 0.00 175.10 174.31 1pff n PRO 137 N 6.19 2.15 -0.30 2.72 -0.02 -1.26 -2.04 135.00 142.45 1pff n PRO 137 Ca 0.08 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 1pff n PRO 137 Cb 0.47 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 1pff n PRO 137 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pff n GLY 138 N 1.85 2.13 0.26 -1.23 0.00 -1.26 -4.91 105.19 102.02 1pff n GLY 138 Ca 0.10 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.08 1pff n GLY 138 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1pff h ASN 139 N 0.00 0.56 0.10 1.61 -1.24 -1.73 -1.68 115.58 113.21 1pff h ASN 139 Ca 0.00 -0.16 -0.01 0.00 0.71 0.00 0.00 56.30 56.84 1pff h ASN 139 Cb 0.00 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 38.90 1pff h ASN 139 CO 0.00 0.73 -0.05 0.40 -1.29 0.00 0.00 177.43 177.22 1pff h ILE 140 N 0.52 1.08 -0.32 2.57 2.04 -1.90 -2.99 117.51 118.52 1pff h ILE 140 Ca 0.09 -0.78 -0.06 0.00 1.00 0.00 0.00 64.86 65.11 1pff h ILE 140 Cb 0.56 1.57 -0.02 0.00 -0.74 0.00 0.00 36.82 38.20 1pff h ILE 140 CO 0.04 0.19 -0.05 1.05 0.00 0.00 0.00 178.15 179.37 1pff h GLU 141 N -0.51 0.50 -0.26 2.37 4.11 -1.75 -1.43 114.58 117.61 1pff h GLU 141 Ca -0.01 -0.12 0.03 0.00 0.07 0.00 0.00 59.36 59.33 1pff h GLU 141 Cb 0.41 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1pff h GLU 141 CO 0.02 0.57 0.18 -0.22 0.07 0.00 0.00 179.01 179.63 1pff h LYS 142 N 0.48 0.21 -0.43 1.06 3.64 -1.32 -2.84 116.57 117.36 1pff h LYS 142 Ca 0.10 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1pff h LYS 142 Cb 0.39 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1pff h LYS 142 CO 0.02 0.14 0.00 0.72 -2.27 0.00 0.00 179.45 178.06 1pff n HIS 143 N -4.49 0.56 -2.20 1.91 8.25 -0.55 -4.95 115.22 113.74 1pff n HIS 143 Ca 0.02 -0.28 -0.41 0.00 -0.26 0.00 0.00 57.72 56.79 1pff n HIS 143 Cb 0.18 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.26 1pff n HIS 143 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1pff s LEU 144 N -1.35 4.43 0.24 2.41 1.43 -1.08 -5.01 118.68 119.76 1pff s LEU 144 Ca 0.39 2.49 0.06 0.00 -1.03 0.00 0.00 54.13 56.03 1pff s LEU 144 Cb 0.22 -3.62 -0.05 0.00 0.03 0.00 0.00 46.19 42.76 1pff s LEU 144 CO 0.30 -0.50 -0.06 -0.54 0.23 0.00 0.00 176.35 175.78 1pff s LYS 145 N -0.77 1.41 0.51 1.70 1.02 -1.26 -5.02 119.74 117.32 1pff s LYS 145 Ca 0.53 -1.69 0.23 0.00 0.02 0.00 0.00 55.97 55.06 1pff s LYS 145 Cb -0.37 -0.94 1.32 0.00 -0.52 0.00 0.00 37.83 37.31 1pff s LYS 145 CO 0.43 0.02 1.98 -1.35 -0.92 0.00 0.00 175.35 175.52 1pff h PRO 146 N 2.43 0.09 -0.70 -1.68 0.11 -2.02 -1.89 132.00 128.34 1pff h PRO 146 Ca -0.39 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1pff h PRO 146 Cb 1.22 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1pff h PRO 146 CO 0.65 0.06 0.00 0.27 -0.21 0.00 0.00 178.00 178.77 1pff n ASN 147 N -4.40 4.21 -4.71 -2.05 6.94 -1.26 -4.97 115.26 109.03 1pff n ASN 147 Ca 0.11 -2.17 -0.42 0.00 -0.02 0.00 0.00 54.58 52.07 1pff n ASN 147 Cb 0.58 -0.52 -0.03 0.00 -2.36 0.00 0.00 39.78 37.45 1pff n ASN 147 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1pff s THR 148 N -1.35 3.06 -0.01 5.53 2.01 -0.71 -0.93 115.64 123.24 1pff s THR 148 Ca 0.49 0.70 0.01 0.00 0.31 0.00 0.00 61.69 63.21 1pff s THR 148 Cb 0.28 -3.45 -0.02 0.00 0.01 0.00 0.00 72.50 69.32 1pff s THR 148 CO 0.30 0.04 0.02 0.54 -0.69 0.00 0.00 174.62 174.82 1pff n ARG 149 N 4.38 2.15 -3.81 4.92 5.12 -0.15 -4.78 116.66 124.49 1pff n ARG 149 Ca 0.13 -0.01 -0.13 0.00 -1.93 0.00 0.00 57.85 55.92 1pff n ARG 149 Cb 0.41 -1.03 -0.14 0.00 -1.16 0.00 0.00 32.46 30.54 1pff n ARG 149 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1pff s ILE 150 N -2.06 -0.02 -0.19 0.55 1.01 -1.23 -1.17 121.20 118.09 1pff s ILE 150 Ca -0.01 0.06 -0.01 0.00 0.00 0.00 0.00 60.65 60.68 1pff s ILE 150 Cb 0.01 -0.16 -0.00 0.00 0.01 0.00 0.00 42.46 42.32 1pff s ILE 150 CO 0.06 0.02 -0.11 -0.69 0.00 0.00 0.00 174.94 174.22 1pff s VAL 151 N 0.37 2.88 -0.05 2.92 1.01 -0.14 -1.15 120.40 126.23 1pff s VAL 151 Ca -0.03 -0.67 0.04 0.00 0.00 0.00 0.00 61.98 61.32 1pff s VAL 151 Cb -0.04 -2.26 -0.00 0.00 0.00 0.00 0.00 36.38 34.08 1pff s VAL 151 CO -0.01 0.48 -0.17 -0.47 0.00 0.00 0.00 175.10 174.93 1pff s TYR 152 N 1.18 1.72 0.23 5.22 6.14 0.14 -0.59 117.35 131.39 1pff s TYR 152 Ca 0.02 -0.53 -0.21 0.00 0.64 0.00 0.00 57.07 56.99 1pff s TYR 152 Cb -0.14 -1.17 0.04 0.00 0.42 0.00 0.00 41.96 41.10 1pff s TYR 152 CO -0.04 -0.20 0.65 -0.59 0.64 0.00 0.00 175.55 176.01 1pff s PHE 153 N 0.15 -0.27 0.04 4.97 -0.12 -0.90 -1.57 117.98 120.27 1pff s PHE 153 Ca -0.06 -0.10 0.07 0.00 -0.05 0.00 0.00 56.93 56.79 1pff s PHE 153 Cb -0.12 0.61 -0.03 0.00 -0.63 0.00 0.00 43.02 42.85 1pff s PHE 153 CO 0.03 -1.08 -0.20 -1.21 -0.05 0.00 0.00 175.22 172.71 1pff s GLU 154 N -3.87 2.03 -0.12 1.99 2.02 -1.26 -1.34 118.70 118.15 1pff s GLU 154 Ca 0.08 -0.99 -0.10 0.00 0.02 0.00 0.00 54.97 53.98 1pff s GLU 154 Cb -0.04 -2.15 0.04 0.00 0.10 0.00 0.00 34.13 32.08 1pff s GLU 154 CO -0.00 0.54 0.31 -0.08 0.02 0.00 0.00 175.26 176.05 1pff s THR 155 N -0.88 -0.01 0.60 3.63 -1.32 -1.24 -3.84 115.64 112.58 1pff s THR 155 Ca 0.14 0.03 -0.19 0.00 -1.21 0.00 0.00 61.69 60.46 1pff s THR 155 Cb -0.10 -0.45 -0.03 0.00 -1.51 0.00 0.00 72.50 70.40 1pff s THR 155 CO 0.04 0.01 1.20 -2.84 -2.21 0.00 0.00 174.62 170.82 1pff s PRO 156 N 0.43 2.97 0.71 7.08 0.02 -1.26 -4.53 135.00 140.41 1pff s PRO 156 Ca -0.02 1.80 -0.07 0.00 0.02 0.00 0.00 61.00 62.73 1pff s PRO 156 Cb -0.04 -1.93 0.06 0.00 0.02 0.00 0.00 34.50 32.61 1pff s PRO 156 CO -0.02 -1.20 1.02 0.00 -0.33 0.00 0.00 177.00 176.47 1pff s ALA 157 N -1.64 3.13 -0.03 -1.55 0.00 0.10 -4.87 121.76 116.90 1pff s ALA 157 Ca 0.77 -0.88 -0.23 0.00 0.00 0.00 0.00 51.96 51.61 1pff s ALA 157 Cb -0.30 -2.63 -0.22 0.00 0.00 0.00 0.00 23.12 19.97 1pff s ALA 157 CO 0.33 -1.30 1.10 -2.95 0.00 0.00 0.00 175.76 172.94 1pff h ASN 158 N -0.61 0.27 0.04 0.00 7.08 -1.89 -1.15 115.58 119.32 1pff h ASN 158 Ca -0.45 -0.71 -0.00 0.00 -3.08 0.00 0.00 56.30 52.06 1pff h ASN 158 Cb 1.31 -0.08 0.00 0.00 -2.08 0.00 0.00 38.32 37.47 1pff h ASN 158 CO 0.61 0.94 -0.02 1.55 -2.08 0.00 0.00 177.43 178.43 1pff h PRO 159 N -0.39 -0.05 -0.05 4.14 0.14 -1.91 -3.42 132.00 130.46 1pff h PRO 159 Ca -0.03 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.12 1pff h PRO 159 Cb 0.96 0.01 0.00 0.00 0.14 0.00 0.00 31.00 32.11 1pff h PRO 159 CO 0.05 0.22 0.00 0.25 0.14 0.00 0.00 178.00 178.66 1pff n THR 160 N -4.78 1.91 -2.78 1.56 -2.24 -1.26 -4.70 114.28 102.00 1pff n THR 160 Ca -0.03 -2.11 -0.17 0.00 -2.27 0.00 0.00 64.05 59.46 1pff n THR 160 Cb 0.14 -0.19 0.02 0.00 -2.10 0.00 0.00 70.33 68.20 1pff n THR 160 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1pff n LEU 161 N -1.19 -2.34 -4.67 3.22 7.99 -0.43 -4.75 117.00 114.83 1pff n LEU 161 Ca 0.16 -0.20 -0.44 0.00 -0.01 0.00 0.00 56.01 55.52 1pff n LEU 161 Cb 0.67 -2.40 -0.02 0.00 -0.11 0.00 0.00 43.42 41.55 1pff n LEU 161 CO 0.04 0.14 0.94 1.17 -1.51 0.00 0.00 177.39 178.17 1pff n LYS 162 N -3.18 1.96 -3.92 3.23 4.81 -1.24 -4.40 118.16 115.41 1pff n LYS 162 Ca -0.10 0.69 -0.35 0.00 -0.87 0.00 0.00 58.31 57.68 1pff n LYS 162 Cb 0.60 -2.31 -0.10 0.00 0.02 0.00 0.00 35.03 33.24 1pff n LYS 162 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1pff s VAL 163 N -0.36 4.77 -0.15 3.15 1.01 -1.26 0.01 120.40 127.57 1pff s VAL 163 Ca 0.65 -0.03 -0.04 0.00 0.00 0.00 0.00 61.98 62.56 1pff s VAL 163 Cb -0.65 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 1pff s VAL 163 CO 0.53 0.42 -0.03 -0.63 0.00 0.00 0.00 175.10 175.39 1pff s ILE 164 N 0.71 3.97 -0.49 2.22 1.01 -1.26 -4.76 121.20 122.59 1pff s ILE 164 Ca 0.04 -0.33 -0.27 0.00 0.00 0.00 0.00 60.65 60.08 1pff s ILE 164 Cb -0.13 -2.74 -0.02 0.00 0.01 0.00 0.00 42.46 39.58 1pff s ILE 164 CO 0.02 0.50 1.81 -0.62 0.00 0.00 0.00 174.94 176.65 1pff s ASP 165 N 0.31 5.56 0.06 3.58 3.68 -1.26 -4.88 116.67 123.71 1pff s ASP 165 Ca -0.03 0.73 -0.26 0.00 2.13 0.00 0.00 52.55 55.12 1pff s ASP 165 Cb -0.14 -2.53 -0.17 0.00 -1.45 0.00 0.00 42.92 38.63 1pff s ASP 165 CO 0.03 -2.08 1.56 0.40 0.13 0.00 0.00 175.17 175.21 1pff h ILE 166 N 6.84 0.82 -0.78 4.11 2.04 -1.97 0.11 117.51 128.69 1pff h ILE 166 Ca -0.29 -0.24 0.08 0.00 1.00 0.00 0.00 64.86 65.41 1pff h ILE 166 Cb 1.16 0.97 -0.06 0.00 -0.74 0.00 0.00 36.82 38.15 1pff h ILE 166 CO 1.14 0.06 0.45 -0.08 0.00 0.00 0.00 178.15 179.72 1pff h GLU 167 N -0.42 0.77 -0.24 2.37 4.81 -1.90 -0.76 114.58 119.20 1pff h GLU 167 Ca -0.03 -0.05 -0.17 0.00 -0.13 0.00 0.00 59.36 58.99 1pff h GLU 167 Cb 0.32 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.52 1pff h GLU 167 CO 0.05 0.51 -0.52 0.22 -0.73 0.00 0.00 179.01 178.54 1pff h ASP 168 N 0.79 0.76 -0.57 1.04 3.58 -1.88 -1.60 116.42 118.54 1pff h ASP 168 Ca 0.36 -0.39 0.02 0.00 0.42 0.00 0.00 57.03 57.43 1pff h ASP 168 Cb 0.27 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 41.07 1pff h ASP 168 CO -0.21 1.14 0.36 0.00 -2.88 0.00 0.00 179.24 177.64 1pff h ALA 169 N 0.88 0.73 -0.29 -0.78 0.00 -0.25 -0.87 119.26 118.68 1pff h ALA 169 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1pff h ALA 169 Cb 1.09 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1pff h ALA 169 CO 0.11 0.11 0.19 0.28 0.00 0.00 0.00 179.25 179.94 1pff h VAL 170 N 0.72 1.08 -0.97 0.00 2.07 -1.00 -1.40 116.25 116.75 1pff h VAL 170 Ca 0.22 -0.16 0.03 0.00 0.82 0.00 0.00 66.70 67.61 1pff h VAL 170 Cb -0.03 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 30.35 1pff h VAL 170 CO -0.07 0.08 0.64 0.11 0.02 0.00 0.00 177.57 178.34 1pff h LYS 171 N 0.39 1.21 -0.26 1.57 1.57 -0.95 0.27 116.57 120.36 1pff h LYS 171 Ca 0.11 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 1pff h LYS 171 Cb -0.03 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 31.99 1pff h LYS 171 CO -0.02 0.80 0.09 1.96 -0.57 0.00 0.00 179.45 181.70 1pff h GLN 172 N 1.24 0.40 -0.04 3.15 4.20 -0.90 -2.86 115.11 120.30 1pff h GLN 172 Ca 0.38 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.99 1pff h GLN 172 Cb -0.03 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 27.69 1pff h GLN 172 CO -0.11 0.46 -0.06 0.00 -0.67 0.00 0.00 178.83 178.45 1pff h ALA 173 N 0.92 1.82 0.00 3.87 0.00 -0.43 -1.88 119.26 123.56 1pff h ALA 173 Ca 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pff h ALA 173 Cb 0.23 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1pff h ALA 173 CO -0.00 0.14 0.00 0.54 0.00 0.00 0.00 179.25 179.92 1pff n ARG 174 N -4.43 0.69 0.00 0.00 5.12 0.01 -2.40 116.66 115.64 1pff n ARG 174 Ca -0.02 0.00 0.07 0.00 -1.93 0.00 0.00 57.85 55.97 1pff n ARG 174 Cb 0.16 -1.50 0.39 0.00 -1.16 0.00 0.00 32.46 30.35 1pff n ARG 174 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1pff n LYS 175 N -1.01 0.33 -3.82 5.56 4.76 -0.71 -4.59 118.16 118.68 1pff n LYS 175 Ca 0.17 0.07 -0.12 0.00 -2.87 0.00 0.00 58.31 55.56 1pff n LYS 175 Cb 0.08 -1.50 -0.11 0.00 -1.84 0.00 0.00 35.03 31.66 1pff n LYS 175 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 1pff s GLN 176 N -2.25 0.40 0.64 1.97 0.74 -1.01 -5.16 119.66 114.99 1pff s GLN 176 Ca 0.18 -0.05 -0.15 0.00 0.05 0.00 0.00 55.36 55.39 1pff s GLN 176 Cb 0.09 0.18 -0.01 0.00 1.10 0.00 0.00 33.01 34.37 1pff s GLN 176 CO 0.18 -0.09 1.08 0.15 -0.55 0.00 0.00 175.29 176.07 1pff s LYS 177 N -0.68 3.00 -1.33 1.67 1.02 -1.26 -4.26 119.74 117.89 1pff s LYS 177 Ca -0.08 1.25 -0.08 0.00 0.02 0.00 0.00 55.97 57.09 1pff s LYS 177 Cb -0.04 -1.99 0.01 0.00 -0.52 0.00 0.00 37.83 35.29 1pff s LYS 177 CO 0.01 -1.07 1.16 -0.25 -0.92 0.00 0.00 175.35 174.28 1pff n ASP 178 N -2.39 -5.87 -4.69 2.83 8.00 -1.26 -5.01 116.55 108.17 1pff n ASP 178 Ca 0.09 -0.54 -0.35 0.00 0.71 0.00 0.00 54.79 54.70 1pff n ASP 178 Cb 0.53 -5.01 -0.09 0.00 -0.02 0.00 0.00 41.12 36.52 1pff n ASP 178 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1pff s ILE 179 N -3.32 4.77 -0.27 0.53 1.01 -1.26 -4.79 121.20 117.87 1pff s ILE 179 Ca 0.52 -0.05 -0.20 0.00 0.00 0.00 0.00 60.65 60.92 1pff s ILE 179 Cb -0.23 -3.10 -0.02 0.00 0.01 0.00 0.00 42.46 39.12 1pff s ILE 179 CO 0.72 0.53 0.59 -0.76 0.00 0.00 0.00 174.94 176.02 1pff s LEU 180 N -0.19 4.08 -0.21 2.97 1.43 -0.32 -4.96 118.68 121.48 1pff s LEU 180 Ca 0.07 0.57 -0.17 0.00 -1.03 0.00 0.00 54.13 53.58 1pff s LEU 180 Cb -0.12 -2.78 -0.03 0.00 0.03 0.00 0.00 46.19 43.28 1pff s LEU 180 CO 0.01 -0.37 0.46 -0.69 0.23 0.00 0.00 176.35 175.99 1pff s VAL 181 N 2.47 5.14 -0.10 -1.59 1.01 -1.26 -0.96 120.40 125.11 1pff s VAL 181 Ca 0.24 0.81 0.03 0.00 0.00 0.00 0.00 61.98 63.06 1pff s VAL 181 Cb -0.15 -3.78 0.01 0.00 0.00 0.00 0.00 36.38 32.45 1pff s VAL 181 CO 0.10 0.19 -0.19 -0.63 0.00 0.00 0.00 175.10 174.57 1pff s ILE 182 N 1.63 1.69 -0.07 2.22 1.01 0.24 -1.03 121.20 126.90 1pff s ILE 182 Ca 0.21 -0.78 0.04 0.00 0.00 0.00 0.00 60.65 60.11 1pff s ILE 182 Cb -0.15 -1.50 0.00 0.00 0.01 0.00 0.00 42.46 40.82 1pff s ILE 182 CO 0.09 0.48 -0.18 -0.69 0.00 0.00 0.00 174.94 174.63 1pff s VAL 183 N 0.68 1.58 -0.47 2.92 1.01 -0.45 -2.12 120.40 123.56 1pff s VAL 183 Ca -0.12 -0.76 -0.25 0.00 0.00 0.00 0.00 61.98 60.85 1pff s VAL 183 Cb -0.16 -1.38 0.03 0.00 0.00 0.00 0.00 36.38 34.87 1pff s VAL 183 CO 0.03 0.45 0.88 -0.62 0.00 0.00 0.00 175.10 175.85 1pff s ASP 184 N 0.29 6.45 -0.26 3.32 3.68 -0.45 -1.14 116.67 128.56 1pff s ASP 184 Ca -0.11 -0.00 0.13 0.00 2.13 0.00 0.00 52.55 54.69 1pff s ASP 184 Cb -0.15 -2.43 0.73 0.00 -1.45 0.00 0.00 42.92 39.62 1pff s ASP 184 CO 0.05 -1.03 1.70 -3.20 0.13 0.00 0.00 175.17 172.82 1pff n ASN 185 N 7.06 4.91 0.08 -0.34 5.15 -0.30 -3.73 115.26 128.10 1pff n ASN 185 Ca 0.05 -3.10 -0.12 0.00 -0.60 0.00 0.00 54.58 50.81 1pff n ASN 185 Cb 0.48 -0.68 -0.05 0.00 -0.53 0.00 0.00 39.78 39.00 1pff n ASN 185 CO 0.00 0.00 0.00 0.74 1.40 0.00 0.00 177.26 179.40 1pff h THR 186 N 2.95 0.43 0.04 -0.44 2.02 -1.91 0.66 112.91 116.66 1pff h THR 186 Ca 0.11 0.00 -0.23 0.00 0.77 0.00 0.00 66.41 67.06 1pff h THR 186 Cb 2.00 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.83 1pff h THR 186 CO 0.53 0.00 -1.01 -0.26 0.37 0.00 0.00 175.52 175.15 1pff h PHE 187 N -0.42 0.39 -0.18 3.16 0.04 -1.87 -3.13 116.94 114.94 1pff h PHE 187 Ca 0.05 -0.24 -0.08 0.00 2.80 0.00 0.00 57.97 60.50 1pff h PHE 187 Cb 0.48 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 38.59 1pff h PHE 187 CO -0.27 1.11 -0.20 0.00 -0.60 0.00 0.00 178.31 178.35 1pff h ALA 188 N 0.81 0.26 -0.71 2.45 0.00 -1.79 -3.42 119.26 116.85 1pff h ALA 188 Ca -0.08 -0.36 0.07 0.00 0.00 0.00 0.00 54.91 54.55 1pff h ALA 188 Cb 1.68 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.38 1pff h ALA 188 CO 0.16 0.20 -0.26 -1.13 0.00 0.00 0.00 179.25 178.22 1pff n SER 189 N -4.46 -1.59 0.28 0.00 3.41 0.22 -3.67 113.62 107.80 1pff n SER 189 Ca -0.06 0.30 0.19 0.00 -0.26 0.00 0.00 58.87 59.03 1pff n SER 189 Cb 0.41 -1.01 0.92 0.00 -0.26 0.00 0.00 64.21 64.27 1pff n SER 189 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1pff h PRO 190 N -0.29 0.00 -0.23 4.33 0.11 -1.81 -1.90 132.00 132.21 1pff h PRO 190 Ca -0.04 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.99 1pff h PRO 190 Cb 0.28 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.38 1pff h PRO 190 CO 0.02 0.00 -0.21 0.82 -0.21 0.00 0.00 178.00 178.41 1pff h ILE 191 N 0.00 1.25 0.00 4.15 1.08 -1.88 -3.38 117.51 118.73 1pff h ILE 191 Ca 0.00 -1.16 -0.24 0.00 -0.39 0.00 0.00 64.86 63.08 1pff h ILE 191 Cb 0.15 1.31 -0.04 0.00 -3.07 0.00 0.00 36.82 35.16 1pff h ILE 191 CO 0.00 0.37 -1.89 0.18 -0.69 0.00 0.00 178.15 176.12 1pff n LEU 192 N -4.15 1.01 -3.89 1.44 4.77 -0.76 -4.80 117.00 110.61 1pff n LEU 192 Ca -0.00 -0.03 -0.15 0.00 -0.03 0.00 0.00 56.01 55.80 1pff n LEU 192 Cb 0.37 0.01 -0.15 0.00 -2.33 0.00 0.00 43.42 41.33 1pff n LEU 192 CO 0.41 0.47 -0.38 -0.89 -1.33 0.00 0.00 177.39 175.67 1pff s THR 193 N -2.31 0.21 -0.60 -5.08 2.01 -0.96 -0.73 115.64 108.18 1pff s THR 193 Ca -0.12 -0.07 0.04 0.00 0.31 0.00 0.00 61.69 61.85 1pff s THR 193 Cb 0.04 -0.21 0.15 0.00 0.01 0.00 0.00 72.50 72.50 1pff s THR 193 CO 0.47 0.08 0.37 0.20 -0.69 0.00 0.00 174.62 175.05 1pff s ASN 194 N 0.18 4.41 0.52 3.53 -0.87 -1.26 -4.18 114.94 117.27 1pff s ASN 194 Ca -0.01 -3.37 0.21 0.00 -1.57 0.00 0.00 52.86 48.11 1pff s ASN 194 Cb -0.04 -1.56 1.33 0.00 -0.02 0.00 0.00 41.25 40.97 1pff s ASN 194 CO -0.00 -0.16 2.06 -0.65 -2.57 0.00 0.00 177.10 175.77 1pff h PRO 195 N 5.98 0.01 -0.41 -0.60 0.11 -1.95 -1.04 132.00 134.11 1pff h PRO 195 Ca 0.04 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1pff h PRO 195 Cb 0.83 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.92 1pff h PRO 195 CO 0.68 0.01 0.26 -0.07 -0.21 0.00 0.00 178.00 178.66 1pff h LEU 196 N 0.01 0.47 -2.15 2.35 3.38 -1.83 -0.80 115.31 116.75 1pff h LEU 196 Ca 0.15 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1pff h LEU 196 Cb 0.58 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 1pff h LEU 196 CO -0.00 0.35 -0.04 0.44 0.09 0.00 0.00 178.44 179.28 1pff h ASP 197 N 0.55 0.00 -0.63 -0.43 5.19 -1.47 -1.85 116.42 117.79 1pff h ASP 197 Ca 0.15 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.56 1pff h ASP 197 Cb -0.04 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.47 1pff h ASP 197 CO -0.03 0.04 0.00 0.18 -3.12 0.00 0.00 179.24 176.31 1pff n LEU 198 N -4.10 4.02 0.00 1.55 4.77 -0.32 -4.94 117.00 117.98 1pff n LEU 198 Ca -0.03 -2.02 0.00 0.00 -0.03 0.00 0.00 56.01 53.93 1pff n LEU 198 Cb 0.12 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 1pff n LEU 198 CO 0.31 0.81 0.00 0.61 -1.33 0.00 0.00 177.39 177.79 1pff n GLY 199 N 1.29 0.56 3.74 -0.72 0.00 -0.70 -4.52 105.19 104.85 1pff n GLY 199 Ca 0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.85 1pff n GLY 199 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1pff n VAL 200 N -2.00 3.13 0.02 1.61 0.31 -1.09 -4.92 118.33 115.39 1pff n VAL 200 Ca 0.00 -0.50 -0.21 0.00 -0.01 0.00 0.00 64.34 63.62 1pff n VAL 200 Cb 0.00 -1.72 -0.14 0.00 -0.91 0.00 0.00 33.84 31.07 1pff n VAL 200 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1pff h ASP 201 N 1.92 0.42 -3.70 4.52 3.32 -1.43 -3.41 116.42 118.07 1pff h ASP 201 Ca -0.50 -0.87 -0.41 0.00 0.02 0.00 0.00 57.03 55.27 1pff h ASP 201 Cb 1.29 -0.14 -0.31 0.00 0.22 0.00 0.00 39.33 40.39 1pff h ASP 201 CO 0.59 1.61 -0.78 -0.63 -1.72 0.00 0.00 179.24 178.32 1pff s ILE 202 N -2.48 0.65 -0.10 0.35 1.01 -0.77 -4.38 121.20 115.48 1pff s ILE 202 Ca -0.19 -0.26 0.02 0.00 0.00 0.00 0.00 60.65 60.22 1pff s ILE 202 Cb 0.04 -0.60 -0.02 0.00 0.01 0.00 0.00 42.46 41.89 1pff s ILE 202 CO 0.78 0.22 -0.14 -0.69 0.00 0.00 0.00 174.94 175.11 1pff s VAL 203 N 0.39 2.98 0.14 2.92 1.01 -0.52 -1.34 120.40 125.98 1pff s VAL 203 Ca -0.05 -0.71 0.10 0.00 0.00 0.00 0.00 61.98 61.31 1pff s VAL 203 Cb -0.10 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 1pff s VAL 203 CO 0.00 0.55 -0.19 0.68 0.00 0.00 0.00 175.10 176.15 1pff s VAL 204 N -0.09 2.73 0.02 2.92 -7.23 -0.30 -0.75 120.40 117.71 1pff s VAL 204 Ca -0.02 -1.66 0.01 0.00 -1.81 0.00 0.00 61.98 58.50 1pff s VAL 204 Cb -0.14 -2.28 -0.01 0.00 0.56 0.00 0.00 36.38 34.51 1pff s VAL 204 CO 0.04 0.02 -0.05 -1.00 -0.31 0.00 0.00 175.10 173.80 1pff s HIS 205 N -1.32 0.44 -0.35 2.82 3.76 -0.33 -1.15 115.29 119.16 1pff s HIS 205 Ca 0.19 -0.31 -0.20 0.00 -0.15 0.00 0.00 55.06 54.59 1pff s HIS 205 Cb -0.10 -0.28 0.00 0.00 1.11 0.00 0.00 32.58 33.32 1pff s HIS 205 CO 0.10 -0.07 0.62 0.45 -0.85 0.00 0.00 174.74 175.00 1pff s SER 206 N -0.88 6.42 0.40 1.40 0.15 -1.26 -1.62 113.70 118.32 1pff s SER 206 Ca -0.06 0.15 0.29 0.00 0.70 0.00 0.00 55.95 57.03 1pff s SER 206 Cb -0.06 -2.32 1.30 0.00 -1.71 0.00 0.00 66.02 63.22 1pff s SER 206 CO -0.00 -0.57 1.86 0.00 1.20 0.00 0.00 173.24 175.73 1pff h ALA 207 N 8.44 1.00 -0.54 5.45 0.00 -1.17 -3.24 119.26 129.21 1pff h ALA 207 Ca -0.27 0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.70 1pff h ALA 207 Cb 1.11 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.85 1pff h ALA 207 CO 0.83 0.00 0.25 1.15 0.00 0.00 0.00 179.25 181.48 1pff h THR 208 N 0.00 0.91 0.06 0.00 2.02 -1.79 -0.61 112.91 113.50 1pff h THR 208 Ca 0.00 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 67.01 1pff h THR 208 Cb 0.31 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 67.10 1pff h THR 208 CO 0.00 0.09 -0.03 0.11 0.37 0.00 0.00 175.52 176.06 1pff h LYS 209 N 0.48 -0.08 0.00 6.66 1.79 -1.88 -3.42 116.57 120.14 1pff h LYS 209 Ca 0.25 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.72 1pff h LYS 209 Cb 0.20 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 1pff h LYS 209 CO -0.20 0.41 -0.63 0.66 -1.08 0.00 0.00 179.45 178.62 1pff n TYR 210 N -4.88 0.00 -0.07 -1.35 4.02 -1.25 -1.07 117.16 112.55 1pff n TYR 210 Ca -0.09 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.69 1pff n TYR 210 Cb 0.26 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.53 1pff n TYR 210 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 1pff h ILE 211 N 0.00 1.28 -3.89 -0.72 2.04 -1.81 -3.42 117.51 110.98 1pff h ILE 211 Ca 0.00 -0.99 -0.51 0.00 1.00 0.00 0.00 64.86 64.36 1pff h ILE 211 Cb 0.63 1.50 0.05 0.00 -0.74 0.00 0.00 36.82 38.26 1pff h ILE 211 CO 0.00 0.30 0.56 0.21 0.00 0.00 0.00 178.15 179.22 1pff s ASN 212 N -5.96 6.73 0.00 1.72 2.47 -0.25 -3.94 114.94 115.72 1pff s ASN 212 Ca -0.14 2.49 0.25 0.00 0.42 0.00 0.00 52.86 55.89 1pff s ASN 212 Cb 0.07 -2.63 1.51 0.00 -1.45 0.00 0.00 41.25 38.74 1pff s ASN 212 CO 0.74 -0.54 1.97 0.61 -3.72 0.00 0.00 177.10 176.16 1pff n GLY 213 N 0.81 -0.97 0.00 1.21 0.00 -1.26 -4.86 105.19 100.11 1pff n GLY 213 Ca 0.02 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1pff n GLY 213 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1pff n HIS 214 N -0.87 -0.15 -0.67 1.61 -0.00 -1.26 -4.73 115.22 109.14 1pff n HIS 214 Ca 0.19 0.00 0.07 0.00 -0.00 0.00 0.00 57.72 57.98 1pff n HIS 214 Cb 0.09 0.00 0.15 0.00 -0.00 0.00 0.00 29.99 30.24 1pff n HIS 214 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 1pff n THR 215 N 0.00 1.67 -0.12 3.57 -2.24 -1.26 -4.74 114.28 111.16 1pff n THR 215 Ca 0.00 -1.66 0.11 0.00 -2.27 0.00 0.00 64.05 60.22 1pff n THR 215 Cb 0.00 0.04 0.25 0.00 -2.10 0.00 0.00 70.33 68.52 1pff n THR 215 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1pff n ASP 216 N -0.59 3.58 -4.21 3.42 5.75 -1.26 -4.94 116.55 118.29 1pff n ASP 216 Ca 0.14 -1.98 -0.26 0.00 -0.01 0.00 0.00 54.79 52.68 1pff n ASP 216 Cb 0.60 -0.36 -0.15 0.00 -1.03 0.00 0.00 41.12 40.18 1pff n ASP 216 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1pff s VAL 217 N -1.13 1.59 -0.18 2.12 1.01 -1.26 -5.12 120.40 117.42 1pff s VAL 217 Ca 0.40 -0.91 -0.02 0.00 0.00 0.00 0.00 61.98 61.45 1pff s VAL 217 Cb 0.22 -1.33 -0.01 0.00 0.00 0.00 0.00 36.38 35.26 1pff s VAL 217 CO 0.29 0.40 -0.09 -0.69 0.00 0.00 0.00 175.10 175.01 1pff s VAL 218 N -0.53 3.12 -0.02 2.92 1.01 -1.26 -4.49 120.40 121.16 1pff s VAL 218 Ca 0.08 -0.60 -0.28 0.00 0.00 0.00 0.00 61.98 61.17 1pff s VAL 218 Cb -0.08 -2.37 0.10 0.00 0.00 0.00 0.00 36.38 34.03 1pff s VAL 218 CO -0.00 0.47 0.84 0.00 0.00 0.00 0.00 175.10 176.41 1pff s ALA 219 N 1.03 -1.80 0.23 5.51 0.00 -1.18 -4.53 121.76 121.02 1pff s ALA 219 Ca -0.00 1.09 0.01 0.00 0.00 0.00 0.00 51.96 53.06 1pff s ALA 219 Cb -0.15 0.20 -0.05 0.00 0.00 0.00 0.00 23.12 23.13 1pff s ALA 219 CO -0.01 -0.58 0.07 0.20 0.00 0.00 0.00 175.76 175.43 1pff s GLY 220 N -2.08 1.59 -0.04 0.00 0.00 -0.50 -0.59 107.32 105.70 1pff s GLY 220 Ca 0.01 -1.79 -0.04 0.00 0.00 0.00 0.00 44.72 42.91 1pff s GLY 220 CO -0.05 -1.57 0.10 1.08 0.00 0.00 0.00 173.10 172.66 1pff s LEU 221 N -3.27 1.62 -0.11 0.66 1.43 -0.64 -0.78 118.68 117.59 1pff s LEU 221 Ca 0.34 0.19 0.03 0.00 -1.03 0.00 0.00 54.13 53.65 1pff s LEU 221 Cb 0.07 0.35 0.01 0.00 0.03 0.00 0.00 46.19 46.65 1pff s LEU 221 CO 0.11 -0.04 -0.19 -0.69 0.23 0.00 0.00 176.35 175.77 1pff s VAL 222 N 0.01 1.75 -0.08 -1.59 1.01 0.56 -1.18 120.40 120.88 1pff s VAL 222 Ca -0.00 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.21 1pff s VAL 222 Cb -0.01 -1.56 -0.00 0.00 0.00 0.00 0.00 36.38 34.81 1pff s VAL 222 CO 0.00 0.49 -0.22 0.00 0.00 0.00 0.00 175.10 175.37 1pff n SER 224 N 3.35 -0.10 -4.73 0.00 2.88 -0.75 -1.44 113.62 112.84 1pff n SER 224 Ca -0.19 -1.05 -0.35 0.00 -1.33 0.00 0.00 58.87 55.95 1pff n SER 224 Cb 0.53 0.15 0.08 0.00 -0.75 0.00 0.00 64.21 64.22 1pff n SER 224 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1pff s ARG 225 N -2.00 2.29 0.24 -1.46 0.52 -1.26 -1.35 118.95 115.92 1pff s ARG 225 Ca 0.01 1.83 -0.05 0.00 -0.52 0.00 0.00 55.73 57.00 1pff s ARG 225 Cb -0.00 -1.84 0.38 0.00 0.52 0.00 0.00 34.95 34.01 1pff s ARG 225 CO 0.00 -1.74 1.80 0.00 0.02 0.00 0.00 175.30 175.38 1pff h ALA 226 N -0.03 1.12 -0.41 2.13 0.00 -1.91 -1.33 119.26 118.83 1pff h ALA 226 Ca -0.49 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.35 1pff h ALA 226 Cb 1.30 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1pff h ALA 226 CO 0.51 0.04 -0.23 0.38 0.00 0.00 0.00 179.25 179.95 1pff h ASP 227 N 0.72 0.84 0.02 0.00 2.03 -1.99 0.67 116.42 118.71 1pff h ASP 227 Ca 0.38 -0.31 -0.00 0.00 -0.73 0.00 0.00 57.03 56.37 1pff h ASP 227 Cb 0.38 -0.23 0.00 0.00 -0.83 0.00 0.00 39.33 38.65 1pff h ASP 227 CO -0.26 1.04 -0.01 0.40 -1.03 0.00 0.00 179.24 179.38 1pff h ILE 228 N 0.72 1.09 -0.48 4.15 2.04 -1.85 -3.05 117.51 120.13 1pff h ILE 228 Ca 0.10 -0.36 -0.00 0.00 1.00 0.00 0.00 64.86 65.59 1pff h ILE 228 Cb 0.76 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 1pff h ILE 228 CO 0.06 0.09 0.28 0.40 0.00 0.00 0.00 178.15 178.98 1pff h ILE 229 N -0.19 1.14 -0.61 -0.67 1.08 -1.08 -0.48 117.51 116.70 1pff h ILE 229 Ca -0.00 -0.33 0.10 0.00 -0.39 0.00 0.00 64.86 64.24 1pff h ILE 229 Cb 0.18 0.48 -0.08 0.00 -3.07 0.00 0.00 36.82 34.32 1pff h ILE 229 CO 0.01 0.15 0.21 0.00 -0.69 0.00 0.00 178.15 177.82 1pff h ALA 230 N 1.65 0.78 -0.20 1.87 0.00 -0.82 -0.57 119.26 121.98 1pff h ALA 230 Ca 0.17 0.10 -0.20 0.00 0.00 0.00 0.00 54.91 54.98 1pff h ALA 230 Cb -0.01 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1pff h ALA 230 CO -0.03 -0.23 -0.68 0.87 0.00 0.00 0.00 179.25 179.18 1pff h LYS 231 N 0.37 0.78 -0.66 0.00 1.57 -1.19 -1.60 116.57 115.84 1pff h LYS 231 Ca 0.32 -0.58 0.06 0.00 -1.87 0.00 0.00 60.65 58.58 1pff h LYS 231 Cb 0.42 0.10 -0.06 0.00 0.08 0.00 0.00 32.23 32.77 1pff h LYS 231 CO -0.34 1.20 0.36 0.28 -0.57 0.00 0.00 179.45 180.38 1pff h VAL 232 N 0.56 0.95 0.15 0.50 2.07 -0.86 0.10 116.25 119.72 1pff h VAL 232 Ca -0.02 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 1pff h VAL 232 Cb 1.30 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 1pff h VAL 232 CO 0.14 0.12 -0.07 0.11 0.02 0.00 0.00 177.57 177.89 1pff h LYS 233 N 0.66 -0.19 0.00 1.57 1.57 -1.06 0.23 116.57 119.34 1pff h LYS 233 Ca 0.30 0.01 -0.14 0.00 -1.87 0.00 0.00 60.65 58.95 1pff h LYS 233 Cb 0.20 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 1pff h LYS 233 CO -0.19 0.24 -0.65 0.66 -0.57 0.00 0.00 179.45 178.94 1pff h SER 234 N -0.75 0.00 0.00 0.86 4.64 -1.24 -1.62 113.55 115.44 1pff h SER 234 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1pff h SER 234 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1pff h SER 234 CO 0.03 0.65 -0.56 0.00 -0.87 0.00 0.00 176.83 176.08 1pff n GLN 235 N -3.42 0.30 -0.13 4.77 6.02 0.31 -3.83 117.38 121.41 1pff n GLN 235 Ca 0.00 0.12 -0.04 0.00 -0.01 0.00 0.00 57.00 57.07 1pff n GLN 235 Cb 0.73 -1.00 0.04 0.00 1.02 0.00 0.00 30.24 31.03 1pff n GLN 235 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1pff h GLY 236 N -0.56 0.50 0.00 1.08 0.00 -0.89 0.13 103.07 103.32 1pff h GLY 236 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 47.33 47.25 1pff h GLY 236 CO 0.00 -0.05 -0.48 -2.22 0.00 0.00 0.00 176.54 173.79 1pff h ILE 237 N 0.21 0.61 -0.48 2.60 2.04 -0.59 -1.41 117.51 120.48 1pff h ILE 237 Ca 0.21 -1.59 -0.12 0.00 1.00 0.00 0.00 64.86 64.36 1pff h ILE 237 Cb 0.26 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1pff h ILE 237 CO -0.27 0.21 -0.18 0.11 0.00 0.00 0.00 178.15 178.01 1pff h LYS 238 N -1.00 0.96 0.00 2.37 1.57 -1.35 0.83 116.57 119.95 1pff h LYS 238 Ca -0.09 -0.39 -0.43 0.00 -1.87 0.00 0.00 60.65 57.87 1pff h LYS 238 Cb 0.70 -0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.90 1pff h LYS 238 CO -0.06 1.05 -2.43 -0.25 -0.57 0.00 0.00 179.45 177.20 1pff n ASP 239 N -4.12 1.81 -0.07 0.86 8.00 -0.27 -4.65 116.55 118.10 1pff n ASP 239 Ca 0.01 0.30 -0.11 0.00 0.71 0.00 0.00 54.79 55.69 1pff n ASP 239 Cb 0.43 -0.74 -0.09 0.00 -0.02 0.00 0.00 41.12 40.70 1pff n ASP 239 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1pff h ILE 240 N -0.90 1.17 0.00 0.53 2.04 -0.87 -3.41 117.51 116.07 1pff h ILE 240 Ca -0.65 -1.95 -0.32 0.00 1.00 0.00 0.00 64.86 62.94 1pff h ILE 240 Cb 1.58 2.28 -0.06 0.00 -0.74 0.00 0.00 36.82 39.87 1pff h ILE 240 CO -0.39 0.40 -2.22 0.35 0.00 0.00 0.00 178.15 176.29 1pff n THR 241 N -4.63 1.22 -1.77 -0.27 -2.24 -0.53 -4.98 114.28 101.07 1pff n THR 241 Ca -0.11 -0.72 -0.21 0.00 -2.27 0.00 0.00 64.05 60.74 1pff n THR 241 Cb 0.39 -0.60 -0.07 0.00 -2.10 0.00 0.00 70.33 67.94 1pff n THR 241 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pff n GLY 242 N 1.96 1.46 2.57 3.38 0.00 0.28 -4.89 105.19 109.96 1pff n GLY 242 Ca -0.30 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 1pff n GLY 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pff n ALA 243 N 0.66 6.41 -1.97 4.61 0.00 -1.25 -4.95 120.51 124.02 1pff n ALA 243 Ca -0.22 -3.86 -0.40 0.00 0.00 0.00 0.00 53.44 48.96 1pff n ALA 243 Cb 0.68 -3.27 -0.06 0.00 0.00 0.00 0.00 19.45 16.80 1pff n ALA 243 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1pff s ILE 244 N 1.71 4.30 0.35 0.00 1.01 -1.26 -0.95 121.20 126.36 1pff s ILE 244 Ca 0.55 1.93 -0.26 0.00 0.00 0.00 0.00 60.65 62.86 1pff s ILE 244 Cb 0.15 -4.25 -0.09 0.00 0.01 0.00 0.00 42.46 38.28 1pff s ILE 244 CO -0.06 0.46 1.07 -0.51 0.00 0.00 0.00 174.94 175.90 1pff s ILE 245 N -0.86 3.60 0.16 2.92 2.07 -1.26 -3.85 121.20 123.98 1pff s ILE 245 Ca 0.40 1.38 -0.30 0.00 -1.41 0.00 0.00 60.65 60.71 1pff s ILE 245 Cb -0.24 -3.78 -0.08 0.00 0.13 0.00 0.00 42.46 38.48 1pff s ILE 245 CO 0.29 0.15 1.32 -0.55 -1.91 0.00 0.00 174.94 174.24 1pff s SER 246 N -1.28 6.90 0.54 4.50 0.15 -1.26 -4.93 113.70 118.32 1pff s SER 246 Ca 0.53 2.33 0.22 0.00 0.70 0.00 0.00 55.95 59.72 1pff s SER 246 Cb -0.26 -2.60 1.41 0.00 -1.71 0.00 0.00 66.02 62.85 1pff s SER 246 CO 0.33 -0.55 2.10 1.55 1.20 0.00 0.00 173.24 177.87 1pff h PRO 247 N 5.95 0.00 -0.16 5.44 0.13 -1.98 0.83 132.00 142.21 1pff h PRO 247 Ca -0.44 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.59 1pff h PRO 247 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1pff h PRO 247 CO 0.80 0.00 -0.33 1.25 -0.23 0.00 0.00 178.00 179.50 1pff h HIS 248 N 0.00 0.64 -0.61 1.56 -0.00 -2.00 -1.90 115.15 112.85 1pff h HIS 248 Ca 0.09 -0.23 -0.03 0.00 -0.00 0.00 0.00 60.37 60.19 1pff h HIS 248 Cb 0.38 -0.12 -0.03 0.00 -0.00 0.00 0.00 27.41 27.65 1pff h HIS 248 CO 0.00 0.96 0.24 -0.44 -0.00 0.00 0.00 177.93 178.69 1pff h ASP 249 N 0.14 0.84 -0.76 3.26 3.45 -1.83 -2.31 116.42 119.21 1pff h ASP 249 Ca 0.00 -0.17 0.03 0.00 0.43 0.00 0.00 57.03 57.33 1pff h ASP 249 Cb 0.92 -0.22 -0.05 0.00 -0.56 0.00 0.00 39.33 39.43 1pff h ASP 249 CO 0.07 0.78 0.48 0.00 -1.57 0.00 0.00 179.24 179.01 1pff h ALA 250 N 1.09 1.00 -0.11 3.45 0.00 -0.83 0.71 119.26 124.57 1pff h ALA 250 Ca 0.20 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1pff h ALA 250 Cb 0.20 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1pff h ALA 250 CO -0.02 0.29 0.04 2.35 0.00 0.00 0.00 179.25 181.91 1pff h TRP 251 N 0.94 0.16 -0.95 0.00 7.01 -1.16 -0.35 115.95 121.61 1pff h TRP 251 Ca 0.30 -0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.34 1pff h TRP 251 Cb 0.01 -0.05 -0.06 0.00 -2.10 0.00 0.00 29.16 26.96 1pff h TRP 251 CO -0.03 0.26 0.61 -0.07 -2.79 0.00 0.00 178.44 176.42 1pff h LEU 252 N 0.02 0.99 -0.44 0.65 3.38 -1.07 -1.53 115.31 117.31 1pff h LEU 252 Ca 0.04 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 1pff h LEU 252 Cb 0.17 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1pff h LEU 252 CO -0.00 0.65 0.09 0.40 0.09 0.00 0.00 178.44 179.67 1pff h ILE 253 N 1.14 1.24 -0.90 1.22 1.08 -0.63 -0.49 117.51 120.17 1pff h ILE 253 Ca 0.40 -0.86 0.09 0.00 -0.39 0.00 0.00 64.86 64.10 1pff h ILE 253 Cb 0.10 0.95 -0.07 0.00 -3.07 0.00 0.00 36.82 34.72 1pff h ILE 253 CO -0.15 0.30 0.55 0.74 -0.69 0.00 0.00 178.15 178.90 1pff h THR 254 N 0.59 0.97 -0.26 -0.27 2.02 -0.54 -1.13 112.91 114.28 1pff h THR 254 Ca 0.14 -0.32 -0.14 0.00 0.77 0.00 0.00 66.41 66.86 1pff h THR 254 Cb 0.35 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.71 1pff h THR 254 CO 0.01 0.17 -0.41 0.03 0.37 0.00 0.00 175.52 175.69 1pff h ARG 255 N 0.93 0.63 -0.68 6.66 2.47 -1.06 -2.97 114.38 120.38 1pff h ARG 255 Ca 0.42 -0.33 0.14 0.00 -1.26 0.00 0.00 59.98 58.95 1pff h ARG 255 Cb 0.32 0.01 -0.04 0.00 -1.65 0.00 0.00 29.97 28.60 1pff h ARG 255 CO -0.22 0.93 0.46 0.78 0.56 0.00 0.00 179.97 182.47 1pff h GLY 256 N 1.01 0.54 2.00 0.04 0.00 0.14 -2.29 103.07 104.51 1pff h GLY 256 Ca 0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.22 1pff h GLY 256 CO 0.08 0.06 -0.04 -0.91 0.00 0.00 0.00 176.54 175.73 1pff h THR 257 N 0.33 0.26 0.00 4.70 1.35 -1.22 -2.04 112.91 116.30 1pff h THR 257 Ca 0.33 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.89 1pff h THR 257 Cb 0.81 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.45 1pff h THR 257 CO -0.09 0.04 0.00 -0.07 -0.25 0.00 0.00 175.52 175.16 1pff h LEU 258 N 0.00 0.00 -1.97 3.87 3.38 -1.57 -3.08 115.31 115.94 1pff h LEU 258 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1pff h LEU 258 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1pff h LEU 258 CO 0.01 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.89 1pff n THR 259 N -3.02 0.48 -0.03 0.22 -2.24 -0.82 -4.80 114.28 104.07 1pff n THR 259 Ca 0.01 -0.74 -0.11 0.00 -2.27 0.00 0.00 64.05 60.95 1pff n THR 259 Cb 0.32 0.77 -0.05 0.00 -2.10 0.00 0.00 70.33 69.28 1pff n THR 259 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1pff h LEU 260 N 0.22 0.19 -0.30 3.22 5.85 -1.34 -0.90 115.31 122.27 1pff h LEU 260 Ca 0.00 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.71 1pff h LEU 260 Cb 0.28 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.20 1pff h LEU 260 CO 0.00 0.21 -0.04 -0.78 -0.34 0.00 0.00 178.44 177.49 1pff h ASP 261 N 0.16 -0.21 -0.02 1.25 1.82 -1.87 -0.81 116.42 116.73 1pff h ASP 261 Ca 0.06 0.08 0.01 0.00 -0.39 0.00 0.00 57.03 56.79 1pff h ASP 261 Cb 0.06 0.16 -0.01 0.00 0.68 0.00 0.00 39.33 40.21 1pff h ASP 261 CO -0.01 -0.07 -0.03 -0.03 -1.61 0.00 0.00 179.24 177.49 1pff h MET 262 N 0.03 -0.05 -0.43 0.28 4.05 -1.86 -2.06 114.93 114.89 1pff h MET 262 Ca 0.14 0.00 -0.13 0.00 -0.28 0.00 0.00 59.70 59.44 1pff h MET 262 Cb 0.21 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.01 1pff h MET 262 CO -0.28 -0.03 -0.22 0.00 0.23 0.00 0.00 176.91 176.60 1pff h ARG 263 N -0.05 0.92 -0.28 0.39 3.08 -0.90 -1.47 114.38 116.07 1pff h ARG 263 Ca 0.02 -0.41 -0.07 0.00 0.07 0.00 0.00 59.98 59.60 1pff h ARG 263 Cb 0.08 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 1pff h ARG 263 CO -0.05 1.06 -0.08 0.28 -1.07 0.00 0.00 179.97 180.11 1pff h VAL 264 N 0.75 1.28 -0.16 2.04 2.07 -1.16 -2.17 116.25 118.90 1pff h VAL 264 Ca 0.10 -1.12 -0.11 0.00 0.82 0.00 0.00 66.70 66.39 1pff h VAL 264 Cb 0.79 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 1pff h VAL 264 CO 0.07 0.35 -0.34 0.11 0.02 0.00 0.00 177.57 177.78 1pff h LYS 265 N 0.31 0.52 -0.58 1.57 1.57 -1.35 -1.26 116.57 117.35 1pff h LYS 265 Ca 0.07 -0.34 -0.02 0.00 -1.87 0.00 0.00 60.65 58.49 1pff h LYS 265 Cb 0.56 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.89 1pff h LYS 265 CO 0.03 0.95 0.27 -0.09 -0.57 0.00 0.00 179.45 180.04 1pff h ARG 266 N 0.16 0.84 -0.55 3.15 9.65 -1.35 0.45 114.38 126.73 1pff h ARG 266 Ca 0.00 -0.13 -0.00 0.00 -1.10 0.00 0.00 59.98 58.76 1pff h ARG 266 Cb 0.93 -0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 29.34 1pff h ARG 266 CO 0.07 0.69 0.34 0.00 2.80 0.00 0.00 179.97 183.88 1pff h ALA 267 N 1.11 0.70 -0.57 2.80 0.00 -1.36 -0.30 119.26 121.64 1pff h ALA 267 Ca 0.20 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1pff h ALA 267 Cb 0.13 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1pff h ALA 267 CO -0.02 0.17 0.09 0.00 0.00 0.00 0.00 179.25 179.49 1pff h ALA 268 N 1.18 0.75 -0.16 0.00 0.00 -1.02 0.20 119.26 120.21 1pff h ALA 268 Ca 0.20 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.88 1pff h ALA 268 Cb -0.04 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1pff h ALA 268 CO -0.04 0.50 -0.01 0.93 0.00 0.00 0.00 179.25 180.64 1pff h GLU 269 N 0.84 0.04 -0.70 0.00 5.08 -0.74 -1.26 114.58 117.84 1pff h GLU 269 Ca 0.17 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.56 1pff h GLU 269 Cb 0.42 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.62 1pff h GLU 269 CO 0.01 0.03 0.44 -0.91 -1.00 0.00 0.00 179.01 177.57 1pff h ASN 270 N 0.04 0.71 -0.67 1.42 2.35 -0.85 -3.11 115.58 115.47 1pff h ASN 270 Ca 0.07 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.78 1pff h ASN 270 Cb 0.09 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.28 1pff h ASN 270 CO -0.13 0.49 0.23 0.00 -1.65 0.00 0.00 177.43 176.37 1pff h ALA 271 N 1.30 0.88 -0.58 -0.83 0.00 0.03 0.28 119.26 120.33 1pff h ALA 271 Ca 0.28 -0.20 0.09 0.00 0.00 0.00 0.00 54.91 55.08 1pff h ALA 271 Cb 0.02 -0.26 -0.07 0.00 0.00 0.00 0.00 17.79 17.48 1pff h ALA 271 CO -0.11 0.53 0.20 0.37 0.00 0.00 0.00 179.25 180.25 1pff h GLN 272 N 0.97 0.36 -0.27 0.00 5.75 -1.20 0.26 115.11 120.98 1pff h GLN 272 Ca 0.22 -0.02 -0.04 0.00 -0.15 0.00 0.00 58.65 58.65 1pff h GLN 272 Cb 0.27 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 1pff h GLN 272 CO -0.01 0.24 0.00 0.87 -2.65 0.00 0.00 178.83 177.28 1pff h LYS 273 N 0.37 0.48 -0.34 1.69 1.79 -1.30 -1.74 116.57 117.53 1pff h LYS 273 Ca 0.29 -0.15 -0.00 0.00 -2.18 0.00 0.00 60.65 58.61 1pff h LYS 273 Cb 0.37 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.96 1pff h LYS 273 CO -0.31 0.64 0.21 0.28 -1.08 0.00 0.00 179.45 179.19 1pff h VAL 274 N 0.27 1.11 -0.71 0.50 2.07 -0.66 -1.51 116.25 117.32 1pff h VAL 274 Ca 0.08 -0.24 0.05 0.00 0.82 0.00 0.00 66.70 67.41 1pff h VAL 274 Cb 0.42 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 30.79 1pff h VAL 274 CO 0.01 0.11 0.42 0.00 0.02 0.00 0.00 177.57 178.13 1pff h ALA 275 N 1.10 0.95 -0.49 1.67 0.00 -0.36 0.21 119.26 122.33 1pff h ALA 275 Ca 0.12 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 1pff h ALA 275 Cb -0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1pff h ALA 275 CO -0.02 0.15 -0.10 0.93 0.00 0.00 0.00 179.25 180.20 1pff h GLU 276 N 0.80 0.91 -0.42 0.00 5.08 -1.10 0.03 114.58 119.88 1pff h GLU 276 Ca 0.31 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1pff h GLU 276 Cb 0.12 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 1pff h GLU 276 CO -0.15 0.97 0.22 0.35 -1.00 0.00 0.00 179.01 179.40 1pff h PHE 277 N 0.82 0.58 -0.48 4.33 3.57 -0.62 -2.57 116.94 122.55 1pff h PHE 277 Ca 0.13 -0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.50 1pff h PHE 277 Cb 0.63 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 1pff h PHE 277 CO 0.04 0.44 -0.15 -0.07 -2.23 0.00 0.00 178.31 176.34 1pff h LEU 278 N 0.54 0.94 -1.71 0.59 3.38 -0.72 -1.99 115.31 116.33 1pff h LEU 278 Ca 0.15 -0.32 0.08 0.00 0.09 0.00 0.00 57.88 57.87 1pff h LEU 278 Cb 0.06 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 1pff h LEU 278 CO -0.02 1.08 0.33 -0.74 0.09 0.00 0.00 178.44 179.18 1pff h HIS 279 N 0.82 0.35 0.00 1.13 2.76 -0.84 -2.38 115.15 116.99 1pff h HIS 279 Ca 0.12 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.30 1pff h HIS 279 Cb 0.70 -0.11 0.00 0.00 1.55 0.00 0.00 27.41 29.54 1pff h HIS 279 CO 0.04 0.18 -0.93 0.39 -1.30 0.00 0.00 177.93 176.31 1pff n GLU 280 N -4.47 0.14 -2.58 5.26 1.02 -0.97 -4.93 120.64 114.12 1pff n GLU 280 Ca 0.07 -0.01 -0.42 0.00 -0.02 0.00 0.00 57.16 56.78 1pff n GLU 280 Cb 0.32 -1.54 -0.03 0.00 -0.02 0.00 0.00 31.44 30.17 1pff n GLU 280 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1pff s HIS 281 N -3.10 3.56 0.37 -0.32 2.46 -0.79 -4.96 115.29 112.52 1pff s HIS 281 Ca 0.06 1.52 0.05 0.00 0.47 0.00 0.00 55.06 57.16 1pff s HIS 281 Cb 0.16 -3.26 0.74 0.00 -0.13 0.00 0.00 32.58 30.09 1pff s HIS 281 CO 0.80 -0.60 1.99 0.87 -2.47 0.00 0.00 174.74 175.34 1pff h LYS 282 N 6.78 0.72 0.00 2.88 1.79 -1.92 -2.11 116.57 124.71 1pff h LYS 282 Ca -0.41 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.01 1pff h LYS 282 Cb 1.22 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 31.70 1pff h LYS 282 CO 0.78 0.48 0.00 0.00 -1.08 0.00 0.00 179.45 179.62 1pff h ALA 283 N 1.63 1.00 -2.92 3.86 0.00 -1.93 -3.43 119.26 117.48 1pff h ALA 283 Ca 0.26 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.59 1pff h ALA 283 Cb 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.81 1pff h ALA 283 CO -0.07 0.00 -0.16 0.08 0.00 0.00 0.00 179.25 179.10 1pff s VAL 284 N -3.34 5.18 0.00 0.00 1.01 -0.80 -4.47 120.40 117.99 1pff s VAL 284 Ca 0.06 0.91 0.00 0.00 0.00 0.00 0.00 61.98 62.94 1pff s VAL 284 Cb 0.09 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.68 1pff s VAL 284 CO 0.55 0.35 0.00 0.29 0.00 0.00 0.00 175.10 176.29 1pff n LYS 285 N 3.49 0.00 -2.98 2.72 4.76 0.11 -4.83 118.16 121.43 1pff n LYS 285 Ca -0.08 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 54.96 1pff n LYS 285 Cb 0.52 0.00 -0.05 0.00 -1.84 0.00 0.00 35.03 33.66 1pff n LYS 285 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1pff s LYS 286 N 0.83 4.48 -0.17 1.97 2.47 -1.25 -4.85 119.74 123.22 1pff s LYS 286 Ca 0.00 1.05 -0.08 0.00 -1.56 0.00 0.00 55.97 55.38 1pff s LYS 286 Cb 0.00 -3.39 -0.04 0.00 -1.46 0.00 0.00 37.83 32.94 1pff s LYS 286 CO 0.00 0.21 0.09 0.08 0.16 0.00 0.00 175.35 175.89 1pff s VAL 287 N 0.22 5.09 -0.42 4.02 1.01 -1.26 -0.77 120.40 128.29 1pff s VAL 287 Ca 0.39 0.07 -0.08 0.00 0.00 0.00 0.00 61.98 62.36 1pff s VAL 287 Cb -0.20 -3.28 0.09 0.00 0.00 0.00 0.00 36.38 32.99 1pff s VAL 287 CO 0.22 0.50 0.26 -0.31 0.00 0.00 0.00 175.10 175.77 1pff s TYR 288 N -0.02 3.37 -0.23 5.22 1.51 0.17 -4.87 117.35 122.51 1pff s TYR 288 Ca 0.08 -1.68 -0.09 0.00 -1.01 0.00 0.00 57.07 54.37 1pff s TYR 288 Cb -0.12 -3.05 0.09 0.00 -0.11 0.00 0.00 41.96 38.78 1pff s TYR 288 CO 0.00 -0.88 0.50 -0.47 -1.11 0.00 0.00 175.55 173.59 1pff s TYR 289 N 1.38 -0.92 0.56 2.71 5.04 -1.26 -1.66 117.35 123.20 1pff s TYR 289 Ca 0.04 1.73 0.27 0.00 -2.44 0.00 0.00 57.07 56.68 1pff s TYR 289 Cb -0.23 0.45 1.47 0.00 0.35 0.00 0.00 41.96 44.00 1pff s TYR 289 CO 0.01 -0.51 1.97 -1.35 -1.34 0.00 0.00 175.55 174.34 1pff h PRO 290 N 7.84 0.00 0.00 4.97 0.11 -1.85 -1.72 132.00 141.35 1pff h PRO 290 Ca -0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.90 1pff h PRO 290 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1pff h PRO 290 CO 0.15 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.35 1pff n GLY 291 N -1.57 -1.35 3.71 -0.55 0.00 -1.26 -4.30 105.19 99.87 1pff n GLY 291 Ca 0.09 -0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1pff n GLY 291 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pff s LEU 292 N -3.41 4.34 0.62 0.99 1.43 -0.65 -4.94 118.68 117.06 1pff s LEU 292 Ca 0.10 1.45 0.32 0.00 -1.03 0.00 0.00 54.13 54.98 1pff s LEU 292 Cb 0.14 -3.36 1.81 0.00 0.03 0.00 0.00 46.19 44.80 1pff s LEU 292 CO 0.44 -0.21 2.13 -0.65 0.23 0.00 0.00 176.35 178.29 1pff h PRO 293 N 6.80 0.00 0.00 1.29 0.11 -1.88 -0.81 132.00 137.51 1pff h PRO 293 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1pff h PRO 293 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1pff h PRO 293 CO 0.76 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.30 1pff n ASP 294 N -3.51 0.38 -4.69 -2.05 8.00 -1.26 -4.76 116.55 108.66 1pff n ASP 294 Ca 0.00 0.55 -0.42 0.00 0.71 0.00 0.00 54.79 55.63 1pff n ASP 294 Cb 0.28 -0.65 -0.03 0.00 -0.02 0.00 0.00 41.12 40.71 1pff n ASP 294 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 1pff s HIS 295 N -3.08 3.34 0.29 1.24 2.46 -0.31 -4.95 115.29 114.27 1pff s HIS 295 Ca 0.10 1.38 0.02 0.00 0.47 0.00 0.00 55.06 57.03 1pff s HIS 295 Cb 0.14 -3.32 0.59 0.00 -0.13 0.00 0.00 32.58 29.85 1pff s HIS 295 CO 0.49 -0.86 1.85 -1.35 -2.47 0.00 0.00 174.74 172.40 1pff h PRO 296 N 7.28 0.93 -0.22 2.88 0.11 -1.87 -1.03 132.00 140.07 1pff h PRO 296 Ca -0.33 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1pff h PRO 296 Cb 1.16 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1pff h PRO 296 CO 0.86 0.62 0.00 0.41 -0.21 0.00 0.00 178.00 179.68 1pff n GLY 297 N -1.36 -0.16 0.19 -0.55 0.00 -1.26 -4.40 105.19 97.64 1pff n GLY 297 Ca 0.18 -0.13 -0.05 0.00 0.00 0.00 0.00 46.02 46.02 1pff n GLY 297 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1pff h HIS 298 N 0.69 0.41 -0.35 1.61 6.17 -1.37 0.24 115.15 122.55 1pff h HIS 298 Ca 0.00 0.02 -0.09 0.00 0.71 0.00 0.00 60.37 61.01 1pff h HIS 298 Cb 0.23 -0.12 -0.02 0.00 2.52 0.00 0.00 27.41 30.03 1pff h HIS 298 CO 0.09 0.20 -0.18 0.93 0.71 0.00 0.00 177.93 179.68 1pff h GLU 299 N 0.45 0.64 -0.31 5.26 5.08 -1.82 -0.15 114.58 123.72 1pff h GLU 299 Ca 0.21 -0.22 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 1pff h GLU 299 Cb 0.14 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1pff h GLU 299 CO -0.16 0.78 -0.02 0.82 -1.00 0.00 0.00 179.01 179.43 1pff h ILE 300 N 0.57 1.26 -0.88 3.13 2.04 -1.69 -3.07 117.51 118.88 1pff h ILE 300 Ca 0.09 -0.99 0.02 0.00 1.00 0.00 0.00 64.86 64.98 1pff h ILE 300 Cb 0.62 1.30 -0.05 0.00 -0.74 0.00 0.00 36.82 37.96 1pff h ILE 300 CO 0.04 0.32 0.58 0.00 0.00 0.00 0.00 178.15 179.09 1pff h ALA 301 N 0.83 1.14 -0.59 1.87 0.00 -0.18 -2.29 119.26 120.03 1pff h ALA 301 Ca 0.08 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.01 1pff h ALA 301 Cb 0.47 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1pff h ALA 301 CO 0.02 0.48 0.39 -0.22 0.00 0.00 0.00 179.25 179.93 1pff h LYS 302 N 1.16 0.54 0.00 0.00 3.64 -0.96 0.16 116.57 121.12 1pff h LYS 302 Ca 0.33 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1pff h LYS 302 Cb -0.08 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.62 1pff h LYS 302 CO -0.09 0.36 -0.51 1.57 -2.27 0.00 0.00 179.45 178.51 1pff h LYS 303 N 0.56 0.00 -0.00 1.90 2.10 -1.33 -3.38 116.57 116.42 1pff h LYS 303 Ca 0.26 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.91 1pff h LYS 303 Cb 0.30 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.63 1pff h LYS 303 CO -0.08 0.00 -0.01 0.00 -2.00 0.00 0.00 179.45 177.36 1pff n GLN 304 N -2.87 0.37 -4.38 0.07 10.64 -0.93 -5.00 117.38 115.29 1pff n GLN 304 Ca 0.02 -0.53 -0.26 0.00 -1.83 0.00 0.00 57.00 54.40 1pff n GLN 304 Cb 0.54 -0.97 -0.17 0.00 -0.86 0.00 0.00 30.24 28.78 1pff n GLN 304 CO 0.00 0.00 0.00 -1.64 -1.83 0.00 0.00 177.06 173.59 1pff s MET 305 N -0.32 1.77 0.30 2.61 -1.94 0.53 -4.40 119.30 117.85 1pff s MET 305 Ca 0.02 -0.40 0.06 0.00 -1.71 0.00 0.00 55.69 53.65 1pff s MET 305 Cb 0.02 -1.56 0.49 0.00 2.01 0.00 0.00 34.83 35.79 1pff s MET 305 CO 0.03 -0.07 1.74 0.87 -0.01 0.00 0.00 175.02 177.58 1pff h LYS 306 N 7.38 0.31 -4.59 2.03 1.57 -1.23 -3.43 116.57 118.63 1pff h LYS 306 Ca -0.31 -0.13 -0.29 0.00 -1.87 0.00 0.00 60.65 58.06 1pff h LYS 306 Cb 1.17 -0.01 -0.14 0.00 0.08 0.00 0.00 32.23 33.33 1pff h LYS 306 CO 0.46 0.60 -0.53 -1.64 -0.57 0.00 0.00 179.45 177.77 1pff s MET 307 N -4.34 1.39 -0.12 3.15 -1.94 -1.26 -5.09 119.30 111.10 1pff s MET 307 Ca -0.05 -1.71 0.15 0.00 -1.71 0.00 0.00 55.69 52.37 1pff s MET 307 Cb 0.14 0.31 0.64 0.00 2.01 0.00 0.00 34.83 37.93 1pff s MET 307 CO 0.77 -0.49 1.53 1.19 -0.01 0.00 0.00 175.02 178.01 1pff n PHE 308 N -0.38 1.41 0.00 -0.03 3.01 -1.26 -4.96 117.46 115.25 1pff n PHE 308 Ca 0.03 -0.54 0.00 0.00 1.01 0.00 0.00 57.45 57.95 1pff n PHE 308 Cb 0.65 -0.28 0.00 0.00 -0.01 0.00 0.00 39.48 39.84 1pff n PHE 308 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1pff n GLY 309 N 0.92 -1.19 0.18 1.37 0.00 -1.26 -4.54 105.19 100.66 1pff n GLY 309 Ca 0.23 -1.59 0.02 0.00 0.00 0.00 0.00 46.02 44.67 1pff n GLY 309 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1pff n SER 310 N -1.20 2.10 -4.74 1.61 3.41 -1.26 -4.33 113.62 109.21 1pff n SER 310 Ca 0.00 -1.85 -0.39 0.00 -0.26 0.00 0.00 58.87 56.37 1pff n SER 310 Cb 0.00 -0.06 -0.05 0.00 -0.26 0.00 0.00 64.21 63.84 1pff n SER 310 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1pff s MET 311 N -0.88 4.36 0.05 4.33 -1.94 -1.26 -0.47 119.30 123.49 1pff s MET 311 Ca 0.06 0.72 0.06 0.00 -1.71 0.00 0.00 55.69 54.82 1pff s MET 311 Cb 0.03 -3.39 -0.02 0.00 2.01 0.00 0.00 34.83 33.46 1pff s MET 311 CO 0.05 0.23 -0.16 0.42 -0.01 0.00 0.00 175.02 175.55 1pff s ILE 312 N 0.29 1.27 0.16 2.53 1.01 0.46 -4.83 121.20 122.08 1pff s ILE 312 Ca 0.32 -1.13 0.07 0.00 0.00 0.00 0.00 60.65 59.91 1pff s ILE 312 Cb -0.17 -1.15 -0.04 0.00 0.01 0.00 0.00 42.46 41.10 1pff s ILE 312 CO 0.16 0.00 -0.15 0.00 0.00 0.00 0.00 174.94 174.95 1pff s ALA 313 N -0.93 1.79 -0.04 9.38 0.00 -0.67 -0.01 121.76 131.29 1pff s ALA 313 Ca 0.03 -1.45 -0.24 0.00 0.00 0.00 0.00 51.96 50.29 1pff s ALA 313 Cb -0.09 -0.11 0.05 0.00 0.00 0.00 0.00 23.12 22.97 1pff s ALA 313 CO 0.02 0.13 0.52 -0.59 0.00 0.00 0.00 175.76 175.84 1pff s PHE 314 N -2.35 -0.46 -0.02 0.00 -0.71 -0.53 0.44 117.98 114.35 1pff s PHE 314 Ca 0.15 0.77 -0.19 0.00 -1.04 0.00 0.00 56.93 56.61 1pff s PHE 314 Cb -0.04 0.28 -0.05 0.00 -1.21 0.00 0.00 43.02 42.00 1pff s PHE 314 CO 0.05 -0.52 0.55 -0.51 -1.34 0.00 0.00 175.22 173.46 1pff s ASP 315 N -1.23 6.91 0.44 1.98 1.01 0.05 -1.01 116.67 124.81 1pff s ASP 315 Ca -0.12 1.08 0.07 0.00 0.71 0.00 0.00 52.55 54.29 1pff s ASP 315 Cb -0.02 -2.34 -0.02 0.00 1.01 0.00 0.00 42.92 41.55 1pff s ASP 315 CO 0.08 0.11 0.31 0.68 0.21 0.00 0.00 175.17 176.55 1pff s VAL 316 N -0.14 2.30 -1.28 -1.27 -7.23 -0.94 0.06 120.40 111.91 1pff s VAL 316 Ca 0.29 -1.51 -0.18 0.00 -1.81 0.00 0.00 61.98 58.77 1pff s VAL 316 Cb -0.17 -2.81 0.02 0.00 0.56 0.00 0.00 36.38 33.98 1pff s VAL 316 CO 0.16 0.00 1.89 -0.67 -0.31 0.00 0.00 175.10 176.16 1pff n ASP 318 N -1.48 4.24 0.00 4.85 2.03 -1.26 -4.70 116.55 120.22 1pff n ASP 318 Ca 0.01 -2.85 0.00 0.00 0.52 0.00 0.00 54.79 52.47 1pff n ASP 318 Cb 0.63 -1.69 0.00 0.00 -0.72 0.00 0.00 41.12 39.35 1pff n ASP 318 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1pff n GLY 319 N 5.13 1.95 0.27 0.27 0.00 -1.26 -4.45 105.19 107.11 1pff n GLY 319 Ca 0.49 -1.89 -0.05 0.00 0.00 0.00 0.00 46.02 44.57 1pff n GLY 319 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1pff h LEU 320 N 0.00 0.80 -0.96 0.99 6.46 -1.88 -2.41 115.31 118.31 1pff h LEU 320 Ca 0.00 -0.02 -0.05 0.00 -0.12 0.00 0.00 57.88 57.69 1pff h LEU 320 Cb 0.00 -0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 39.71 1pff h LEU 320 CO 0.00 0.58 0.15 -0.33 -0.62 0.00 0.00 178.44 178.22 1pff h GLU 321 N 0.94 0.91 -0.62 1.25 3.07 -1.89 -0.95 114.58 117.29 1pff h GLU 321 Ca 0.26 -0.19 -0.09 0.00 -0.50 0.00 0.00 59.36 58.84 1pff h GLU 321 Cb -0.10 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 27.65 1pff h GLU 321 CO -0.06 0.81 0.06 0.87 -1.40 0.00 0.00 179.01 179.29 1pff h LYS 322 N 0.88 1.06 -0.41 2.33 1.57 -1.71 -2.38 116.57 117.91 1pff h LYS 322 Ca 0.19 -0.31 0.02 0.00 -1.87 0.00 0.00 60.65 58.68 1pff h LYS 322 Cb 0.30 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 1pff h LYS 322 CO -0.00 1.01 0.24 0.00 -0.57 0.00 0.00 179.45 180.12 1pff h ALA 323 N 1.01 0.51 -0.79 3.86 0.00 -0.92 -1.49 119.26 121.45 1pff h ALA 323 Ca 0.18 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.11 1pff h ALA 323 Cb 0.49 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 1pff h ALA 323 CO 0.02 -0.10 0.51 0.87 0.00 0.00 0.00 179.25 180.56 1pff h LYS 324 N 0.48 0.98 -0.39 0.00 1.79 -1.05 -0.24 116.57 118.13 1pff h LYS 324 Ca 0.16 -0.06 -0.04 0.00 -2.18 0.00 0.00 60.65 58.54 1pff h LYS 324 Cb 0.01 -0.22 -0.02 0.00 -1.58 0.00 0.00 32.23 30.43 1pff h LYS 324 CO -0.08 0.65 0.09 -0.22 -1.08 0.00 0.00 179.45 178.81 1pff h LYS 325 N 1.01 0.63 0.15 3.15 3.64 -1.21 -0.58 116.57 123.37 1pff h LYS 325 Ca 0.31 -0.15 0.01 0.00 -1.27 0.00 0.00 60.65 59.54 1pff h LYS 325 Cb -0.03 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 1pff h LYS 325 CO -0.10 0.66 -0.17 0.28 -2.27 0.00 0.00 179.45 177.85 1pff h VAL 326 N 0.49 0.62 -0.08 2.00 2.07 -0.92 -2.93 116.25 117.49 1pff h VAL 326 Ca 0.12 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.61 1pff h VAL 326 Cb 0.31 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1pff h VAL 326 CO 0.00 0.00 -0.12 -0.07 0.02 0.00 0.00 177.57 177.41 1pff h LEU 327 N -0.37 0.12 -1.73 2.57 3.38 -0.94 0.69 115.31 119.02 1pff h LEU 327 Ca 0.01 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1pff h LEU 327 Cb 0.35 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1pff h LEU 327 CO -0.06 0.25 0.00 0.44 0.09 0.00 0.00 178.44 179.17 1pff h ASP 328 N 0.12 0.00 -0.27 -0.43 3.32 -0.92 -3.00 116.42 115.25 1pff h ASP 328 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1pff h ASP 328 Cb 0.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1pff h ASP 328 CO 0.02 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.13 1pff n ASN 329 N -2.70 3.16 -4.72 6.45 3.02 0.22 -4.95 115.26 115.74 1pff n ASN 329 Ca -0.01 -2.42 -0.39 0.00 -0.03 0.00 0.00 54.58 51.73 1pff n ASN 329 Cb 0.15 -0.33 -0.05 0.00 -0.61 0.00 0.00 39.78 38.94 1pff n ASN 329 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pff n HIS 331 N 3.70 0.00 -0.14 0.00 8.25 -1.26 -4.80 115.22 120.97 1pff n HIS 331 Ca -0.03 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.31 1pff n HIS 331 Cb 0.51 -0.06 -0.02 0.00 1.12 0.00 0.00 29.99 31.55 1pff n HIS 331 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1pff h VAL 332 N -0.11 1.28 -3.19 1.59 2.07 -1.93 -3.38 116.25 112.58 1pff h VAL 332 Ca 0.00 -1.19 -0.58 0.00 0.82 0.00 0.00 66.70 65.74 1pff h VAL 332 Cb 0.11 1.22 -0.07 0.00 -1.52 0.00 0.00 31.29 31.04 1pff h VAL 332 CO 0.00 0.40 0.76 -0.69 0.02 0.00 0.00 177.57 178.06 1pff s VAL 333 N -4.78 4.65 0.11 2.57 1.01 -1.26 -4.68 120.40 118.01 1pff s VAL 333 Ca -0.12 1.85 -0.03 0.00 0.00 0.00 0.00 61.98 63.68 1pff s VAL 333 Cb 0.10 -4.31 -0.05 0.00 0.00 0.00 0.00 36.38 32.12 1pff s VAL 333 CO 0.82 -0.26 0.30 -0.44 0.00 0.00 0.00 175.10 175.52 1pff s SER 334 N 1.37 6.43 0.35 3.32 0.01 -0.79 -4.69 113.70 119.70 1pff s SER 334 Ca 0.43 0.45 -0.28 0.00 1.31 0.00 0.00 55.95 57.86 1pff s SER 334 Cb -0.14 -2.03 -0.09 0.00 0.21 0.00 0.00 66.02 63.96 1pff s SER 334 CO 0.09 0.10 1.22 -0.76 0.41 0.00 0.00 173.24 174.30 1pff s LEU 335 N -2.59 4.37 -0.17 2.44 1.43 -1.26 -0.84 118.68 122.07 1pff s LEU 335 Ca 0.38 2.49 -0.25 0.00 -1.03 0.00 0.00 54.13 55.72 1pff s LEU 335 Cb -0.13 -3.77 0.06 0.00 0.03 0.00 0.00 46.19 42.39 1pff s LEU 335 CO 0.26 -0.51 0.65 0.00 0.23 0.00 0.00 176.35 176.99 1pff s ALA 336 N -1.24 -1.64 -0.08 4.21 0.00 -0.83 -4.84 121.76 117.34 1pff s ALA 336 Ca 0.51 1.60 0.14 0.00 0.00 0.00 0.00 51.96 54.21 1pff s ALA 336 Cb -0.35 -0.64 -0.11 0.00 0.00 0.00 0.00 23.12 22.02 1pff s ALA 336 CO 0.46 -0.33 1.05 -0.39 0.00 0.00 0.00 175.76 176.55 1pff h VAL 337 N 3.69 0.85 -3.41 0.00 -1.51 -1.93 -3.40 116.25 110.54 1pff h VAL 337 Ca -0.28 -2.40 -0.67 0.00 -1.23 0.00 0.00 66.70 62.12 1pff h VAL 337 Cb 1.16 2.33 -0.31 0.00 -2.13 0.00 0.00 31.29 32.34 1pff h VAL 337 CO 0.21 0.49 -0.76 -0.44 -1.23 0.00 0.00 177.57 175.84 1pff s SER 338 N -6.17 4.13 0.58 4.19 0.01 -1.26 -4.97 113.70 110.21 1pff s SER 338 Ca -0.01 -0.71 -0.02 0.00 1.31 0.00 0.00 55.95 56.52 1pff s SER 338 Cb 0.08 -1.66 0.03 0.00 0.21 0.00 0.00 66.02 64.69 1pff s SER 338 CO 0.80 -0.08 0.85 -0.76 0.41 0.00 0.00 173.24 174.45 1pff s LEU 339 N 1.36 3.21 0.00 2.44 1.43 -1.26 -5.01 118.68 120.85 1pff s LEU 339 Ca 0.02 0.32 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 1pff s LEU 339 Cb -0.15 -3.12 0.00 0.00 0.03 0.00 0.00 46.19 42.94 1pff s LEU 339 CO -0.05 -1.17 0.00 0.61 0.23 0.00 0.00 176.35 175.96 1pff n GLY 340 N -2.50 2.31 0.00 -3.19 0.00 -1.26 -4.83 105.19 95.72 1pff n GLY 340 Ca 0.06 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.14 1pff n GLY 340 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pff n GLY 341 N 1.27 1.54 0.20 -0.02 0.00 -0.24 -4.81 105.19 103.15 1pff n GLY 341 Ca 0.00 -2.07 0.15 0.00 0.00 0.00 0.00 46.02 44.10 1pff n GLY 341 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1pff n PRO 342 N 0.82 1.27 -4.22 1.61 -0.04 -1.26 -4.70 135.00 128.48 1pff n PRO 342 Ca 0.00 -0.40 -0.31 0.00 -0.04 0.00 0.00 63.50 62.75 1pff n PRO 342 Cb 0.00 -1.48 -0.09 0.00 -0.04 0.00 0.00 33.50 31.90 1pff n PRO 342 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1pff s GLU 343 N -1.99 2.55 0.03 0.54 2.02 -1.26 -0.15 118.70 120.44 1pff s GLU 343 Ca 0.42 -0.80 -0.30 0.00 0.02 0.00 0.00 54.97 54.31 1pff s GLU 343 Cb 0.21 -2.54 -0.06 0.00 0.10 0.00 0.00 34.13 31.84 1pff s GLU 343 CO 0.34 0.56 1.39 -1.12 0.02 0.00 0.00 175.26 176.45 1pff s SER 344 N -2.02 6.86 0.09 -0.19 0.01 -1.26 -4.20 113.70 112.98 1pff s SER 344 Ca 0.23 2.15 0.06 0.00 1.31 0.00 0.00 55.95 59.70 1pff s SER 344 Cb -0.12 -2.57 -0.03 0.00 0.21 0.00 0.00 66.02 63.52 1pff s SER 344 CO 0.15 -0.69 -0.16 -0.76 0.41 0.00 0.00 173.24 172.18 1pff s LEU 345 N 2.08 2.30 0.02 2.44 1.43 -0.07 -1.88 118.68 124.98 1pff s LEU 345 Ca 0.64 -0.66 -0.04 0.00 -1.03 0.00 0.00 54.13 53.04 1pff s LEU 345 Cb -0.32 -0.64 -0.01 0.00 0.03 0.00 0.00 46.19 45.24 1pff s LEU 345 CO 0.27 -0.04 0.06 -0.51 0.23 0.00 0.00 176.35 176.36 1pff s ILE 346 N -1.31 0.10 0.14 -0.59 2.07 -0.02 -0.03 121.20 121.57 1pff s ILE 346 Ca 0.02 -0.87 -0.20 0.00 -1.41 0.00 0.00 60.65 58.19 1pff s ILE 346 Cb -0.10 -0.45 0.06 0.00 0.13 0.00 0.00 42.46 42.10 1pff s ILE 346 CO 0.03 -0.48 0.52 0.00 -1.91 0.00 0.00 174.94 173.10 1pff s GLN 347 N -1.65 1.19 -0.38 3.50 -2.07 -0.41 -1.96 119.66 117.89 1pff s GLN 347 Ca -0.13 -0.56 0.02 0.00 -1.82 0.00 0.00 55.36 52.87 1pff s GLN 347 Cb -0.07 0.54 0.11 0.00 -1.09 0.00 0.00 33.01 32.49 1pff s GLN 347 CO -0.01 -0.50 0.11 -1.58 -1.32 0.00 0.00 175.29 172.00 1pff s HIS 348 N -3.74 3.68 0.22 9.60 5.65 -1.26 -0.81 115.29 128.62 1pff s HIS 348 Ca 0.02 -2.88 -0.08 0.00 0.25 0.00 0.00 55.06 52.36 1pff s HIS 348 Cb 0.00 -2.99 0.30 0.00 -1.18 0.00 0.00 32.58 28.71 1pff s HIS 348 CO -0.12 -0.94 1.78 -1.35 -0.65 0.00 0.00 174.74 173.46 1pff h PRO 349 N 7.61 0.55 0.00 2.88 0.11 -1.93 0.61 132.00 141.83 1pff h PRO 349 Ca -0.06 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.01 1pff h PRO 349 Cb 1.01 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 1pff h PRO 349 CO 0.58 0.36 -0.02 0.00 -0.21 0.00 0.00 178.00 178.71 1pff h ALA 350 N 1.41 1.32 0.00 -0.75 0.00 -1.84 0.22 119.26 119.62 1pff h ALA 350 Ca 0.33 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.13 1pff h ALA 350 Cb 0.34 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1pff h ALA 350 CO -0.26 0.03 -1.66 -1.13 0.00 0.00 0.00 179.25 176.22 1pff n SER 351 N -3.58 2.16 -0.11 0.00 3.41 -1.01 -3.43 113.62 111.07 1pff n SER 351 Ca -0.03 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.45 1pff n SER 351 Cb 0.11 1.23 -0.13 0.00 -0.26 0.00 0.00 64.21 65.16 1pff n SER 351 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1pff n MET 352 N -2.15 0.75 -0.00 4.33 2.81 0.18 -4.55 117.12 118.48 1pff n MET 352 Ca -0.09 0.08 -0.00 0.00 -1.81 0.00 0.00 57.70 55.87 1pff n MET 352 Cb 0.56 -1.48 -0.00 0.00 -0.71 0.00 0.00 33.22 31.59 1pff n MET 352 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1pff n THR 353 N -2.99 0.04 -0.89 2.03 -2.24 -0.30 -4.79 114.28 105.15 1pff n THR 353 Ca -0.37 -0.02 0.08 0.00 -2.27 0.00 0.00 64.05 61.47 1pff n THR 353 Cb 1.02 -0.79 0.25 0.00 -2.10 0.00 0.00 70.33 68.70 1pff n THR 353 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1pff n HIS 354 N -2.23 0.92 0.01 4.78 8.25 0.62 -4.66 115.22 122.92 1pff n HIS 354 Ca -0.01 -0.82 0.20 0.00 -0.26 0.00 0.00 57.72 56.83 1pff n HIS 354 Cb 0.52 -0.29 0.70 0.00 1.12 0.00 0.00 29.99 32.04 1pff n HIS 354 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1pff h ALA 355 N 1.92 2.46 0.00 -1.41 0.00 -1.70 -0.97 119.26 119.55 1pff h ALA 355 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1pff h ALA 355 Cb 1.37 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1pff h ALA 355 CO 0.20 -0.65 -0.10 0.41 0.00 0.00 0.00 179.25 179.12 1pff n GLY 356 N -1.63 -1.55 3.72 0.00 0.00 -1.26 -4.80 105.19 99.66 1pff n GLY 356 Ca 0.09 -0.10 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 1pff n GLY 356 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pff s VAL 357 N -3.06 5.07 0.18 1.61 1.01 -0.37 -5.01 120.40 119.83 1pff s VAL 357 Ca 0.12 1.35 -0.33 0.00 0.00 0.00 0.00 61.98 63.12 1pff s VAL 357 Cb 0.16 -4.00 -0.15 0.00 0.00 0.00 0.00 36.38 32.39 1pff s VAL 357 CO 0.59 0.27 1.29 -2.65 0.00 0.00 0.00 175.10 174.60 1pff n PRO 358 N 3.74 1.48 -0.22 2.72 -0.02 -1.26 -4.74 135.00 136.71 1pff n PRO 358 Ca -0.02 0.53 -0.01 0.00 -2.02 0.00 0.00 63.50 61.97 1pff n PRO 358 Cb 0.51 -2.11 0.05 0.00 -0.02 0.00 0.00 33.50 31.93 1pff n PRO 358 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1pff h LYS 359 N 3.98 -0.04 0.00 -0.52 3.64 -1.93 -0.20 116.57 121.49 1pff h LYS 359 Ca -0.44 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 58.92 1pff h LYS 359 Cb 1.32 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.14 1pff h LYS 359 CO 0.74 -0.03 -0.10 0.93 -2.27 0.00 0.00 179.45 178.72 1pff h GLU 360 N -0.04 0.00 -0.05 1.90 5.08 -1.97 -1.54 114.58 117.94 1pff h GLU 360 Ca 0.30 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.42 1pff h GLU 360 Cb 0.50 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.76 1pff h GLU 360 CO -0.68 0.10 -0.90 0.93 -1.00 0.00 0.00 179.01 177.47 1pff h GLU 361 N 0.00 0.62 -0.49 2.33 5.08 -1.41 -0.57 114.58 120.14 1pff h GLU 361 Ca -0.00 -0.59 0.02 0.00 -1.00 0.00 0.00 59.36 57.79 1pff h GLU 361 Cb 0.19 0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1pff h GLU 361 CO 0.01 1.20 0.29 0.00 -1.00 0.00 0.00 179.01 179.52 1pff h ARG 362 N 0.38 0.56 -0.36 2.33 3.08 -0.72 -2.77 114.38 116.89 1pff h ARG 362 Ca -0.08 -0.03 -0.15 0.00 0.07 0.00 0.00 59.98 59.79 1pff h ARG 362 Cb 1.53 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 31.45 1pff h ARG 362 CO 0.17 0.37 -0.36 0.93 -1.07 0.00 0.00 179.97 180.02 1pff h GLU 363 N 0.58 0.87 -0.51 0.04 5.08 -1.04 0.83 114.58 120.42 1pff h GLU 363 Ca 0.20 -0.46 0.04 0.00 -1.00 0.00 0.00 59.36 58.13 1pff h GLU 363 Cb 0.03 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 1pff h GLU 363 CO -0.09 1.11 0.34 0.00 -1.00 0.00 0.00 179.01 179.37 1pff h ALA 364 N 0.75 1.77 -0.32 3.43 0.00 -1.09 -2.18 119.26 121.61 1pff h ALA 364 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1pff h ALA 364 Cb 0.95 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1pff h ALA 364 CO 0.09 0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.51 1pff n ALA 365 N -2.48 2.46 -0.56 0.00 0.00 -1.02 -4.92 120.51 113.98 1pff n ALA 365 Ca 0.06 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.90 1pff n ALA 365 Cb 0.16 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.62 1pff n ALA 365 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pff n GLY 366 N 1.07 0.68 3.23 0.00 0.00 -0.82 -4.91 105.19 104.45 1pff n GLY 366 Ca 0.12 -0.30 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 1pff n GLY 366 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1pff s LEU 367 N 0.00 3.87 0.42 0.99 2.96 0.25 -4.82 118.68 122.34 1pff s LEU 367 Ca 0.00 -1.06 0.08 0.00 -0.22 0.00 0.00 54.13 52.93 1pff s LEU 367 Cb 0.00 -1.77 -0.00 0.00 0.50 0.00 0.00 46.19 44.91 1pff s LEU 367 CO 0.00 -0.24 0.48 0.42 -1.32 0.00 0.00 176.35 175.69 1pff s THR 368 N 1.35 2.85 -1.58 3.68 -4.23 -1.26 -2.60 115.64 113.86 1pff s THR 368 Ca -0.02 -1.16 0.25 0.00 -1.18 0.00 0.00 61.69 59.59 1pff s THR 368 Cb -0.19 -3.00 0.52 0.00 1.34 0.00 0.00 72.50 71.17 1pff s THR 368 CO -0.00 -0.00 1.86 0.47 -0.54 0.00 0.00 174.62 176.41 1pff n ASP 369 N -1.71 0.00 0.17 3.99 9.92 -1.26 -2.96 116.55 124.70 1pff n ASP 369 Ca 0.06 -0.26 0.10 0.00 -0.53 0.00 0.00 54.79 54.16 1pff n ASP 369 Cb 0.60 -0.21 0.10 0.00 -0.64 0.00 0.00 41.12 40.97 1pff n ASP 369 CO 0.00 0.00 0.00 0.78 0.13 0.00 0.00 177.20 178.11 1pff h ASN 370 N 0.00 0.00 -3.33 -2.24 -0.26 -1.87 -3.14 115.58 104.74 1pff h ASN 370 Ca 0.00 0.00 -0.56 0.00 -0.56 0.00 0.00 56.30 55.18 1pff h ASN 370 Cb 0.17 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 37.39 1pff h ASN 370 CO 0.00 0.09 0.39 -0.22 -1.06 0.00 0.00 177.43 176.63 1pff s LEU 371 N -6.00 4.28 -0.10 1.61 2.96 -1.15 -2.21 118.68 118.07 1pff s LEU 371 Ca 0.04 1.45 0.00 0.00 -0.22 0.00 0.00 54.13 55.40 1pff s LEU 371 Cb 0.07 -3.42 -0.02 0.00 0.50 0.00 0.00 46.19 43.31 1pff s LEU 371 CO 0.72 -0.32 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.70 1pff s ILE 372 N 1.52 3.42 -0.14 6.68 1.01 -0.18 -4.01 121.20 129.50 1pff s ILE 372 Ca 0.46 -0.56 -0.03 0.00 0.00 0.00 0.00 60.65 60.52 1pff s ILE 372 Cb -0.19 -2.41 -0.03 0.00 0.01 0.00 0.00 42.46 39.84 1pff s ILE 372 CO 0.20 0.56 -0.05 -0.13 0.00 0.00 0.00 174.94 175.51 1pff s ARG 373 N -0.27 3.50 -0.13 2.79 0.52 0.01 -1.45 118.95 123.91 1pff s ARG 373 Ca 0.03 -0.55 0.01 0.00 -0.52 0.00 0.00 55.73 54.70 1pff s ARG 373 Cb -0.13 -2.83 0.02 0.00 0.52 0.00 0.00 34.95 32.53 1pff s ARG 373 CO 0.03 0.30 -0.14 -1.17 0.02 0.00 0.00 175.30 174.33 1pff s LEU 374 N 0.19 1.67 -0.42 2.53 2.96 0.99 -1.29 118.68 125.30 1pff s LEU 374 Ca -0.03 -0.45 -0.15 0.00 -0.22 0.00 0.00 54.13 53.28 1pff s LEU 374 Cb -0.14 -1.12 0.03 0.00 0.50 0.00 0.00 46.19 45.46 1pff s LEU 374 CO 0.03 -0.03 0.32 -0.55 -1.32 0.00 0.00 176.35 174.80 1pff s SER 375 N 1.28 6.12 0.03 3.68 0.15 0.95 -0.41 113.70 125.51 1pff s SER 375 Ca -0.00 -1.00 -0.30 0.00 0.70 0.00 0.00 55.95 55.35 1pff s SER 375 Cb -0.14 -2.16 -0.04 0.00 -1.71 0.00 0.00 66.02 61.97 1pff s SER 375 CO -0.07 -0.50 1.01 -0.69 1.20 0.00 0.00 173.24 174.20 1pff s VAL 376 N 1.67 4.65 0.00 4.45 1.01 0.38 -0.89 120.40 131.67 1pff s VAL 376 Ca 0.05 1.96 0.00 0.00 0.00 0.00 0.00 61.98 63.99 1pff s VAL 376 Cb -0.20 -4.26 0.00 0.00 0.00 0.00 0.00 36.38 31.92 1pff s VAL 376 CO 0.09 0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.99 1pff n GLY 377 N 2.79 1.75 1.47 4.51 0.00 -1.26 -4.79 105.19 109.66 1pff n GLY 377 Ca 0.06 -2.05 0.11 0.00 0.00 0.00 0.00 46.02 44.13 1pff n GLY 377 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pff s GLU 379 N -1.37 0.05 -0.04 0.00 8.01 -1.26 -4.89 118.70 119.20 1pff s GLU 379 Ca 0.50 1.10 -0.36 0.00 0.01 0.00 0.00 54.97 56.22 1pff s GLU 379 Cb 0.29 -1.65 -0.14 0.00 -4.31 0.00 0.00 34.13 28.32 1pff s GLU 379 CO 0.30 -3.15 1.65 -1.71 0.01 0.00 0.00 175.26 172.36 1pff n ASN 380 N -4.55 2.67 -0.03 -0.19 2.85 -1.26 -4.85 115.26 109.91 1pff n ASN 380 Ca 0.07 1.06 0.04 0.00 -0.11 0.00 0.00 54.58 55.64 1pff n ASN 380 Cb 0.54 -1.28 0.41 0.00 1.24 0.00 0.00 39.78 40.69 1pff n ASN 380 CO 0.00 0.00 0.00 1.62 -2.11 0.00 0.00 177.26 176.77 1pff h VAL 381 N 4.46 1.10 -0.69 3.44 3.04 -1.95 -1.99 116.25 123.66 1pff h VAL 381 Ca -0.47 -0.20 -0.06 0.00 -1.01 0.00 0.00 66.70 64.96 1pff h VAL 381 Cb 1.29 0.45 -0.03 0.00 -2.01 0.00 0.00 31.29 31.00 1pff h VAL 381 CO 0.90 0.11 0.21 -0.61 -1.01 0.00 0.00 177.57 177.16 1pff h GLN 382 N 0.59 1.07 -0.85 4.17 5.75 -1.99 -0.33 115.11 123.52 1pff h GLN 382 Ca 0.17 -0.22 -0.02 0.00 -0.15 0.00 0.00 58.65 58.43 1pff h GLN 382 Cb -0.02 -0.16 -0.04 0.00 1.07 0.00 0.00 27.48 28.33 1pff h GLN 382 CO -0.04 0.92 0.44 -0.44 -2.65 0.00 0.00 178.83 177.06 1pff h ASP 383 N 1.03 1.08 -0.06 -0.69 3.32 -1.74 0.20 116.42 119.56 1pff h ASP 383 Ca 0.22 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 1pff h ASP 383 Cb 0.30 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.57 1pff h ASP 383 CO -0.01 0.89 0.00 0.40 -1.72 0.00 0.00 179.24 178.81 1pff h ILE 384 N 1.20 1.23 -0.56 0.35 2.04 -1.23 -2.31 117.51 118.23 1pff h ILE 384 Ca 0.30 -0.72 -0.00 0.00 1.00 0.00 0.00 64.86 65.44 1pff h ILE 384 Cb 0.07 1.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.73 1pff h ILE 384 CO -0.04 0.20 0.34 0.40 0.00 0.00 0.00 178.15 179.04 1pff h ILE 385 N -0.17 1.17 -0.58 -0.67 2.04 -0.86 -2.38 117.51 116.06 1pff h ILE 385 Ca 0.02 -0.39 0.08 0.00 1.00 0.00 0.00 64.86 65.56 1pff h ILE 385 Cb 0.31 0.41 -0.06 0.00 -0.74 0.00 0.00 36.82 36.74 1pff h ILE 385 CO 0.00 0.18 0.23 0.44 0.00 0.00 0.00 178.15 179.00 1pff h ASP 386 N 0.76 0.26 -0.01 1.72 3.32 -0.56 -0.24 116.42 121.67 1pff h ASP 386 Ca 0.20 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.32 1pff h ASP 386 Cb -0.01 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 1pff h ASP 386 CO -0.04 0.16 0.01 -0.78 -1.72 0.00 0.00 179.24 176.87 1pff h ASP 387 N 0.43 0.01 -0.38 6.45 3.58 -1.12 -2.59 116.42 122.81 1pff h ASP 387 Ca 0.28 -0.03 -0.13 0.00 0.42 0.00 0.00 57.03 57.57 1pff h ASP 387 Cb 0.31 -0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.34 1pff h ASP 387 CO -0.27 0.04 -0.26 -0.07 -2.88 0.00 0.00 179.24 175.81 1pff h LEU 388 N -0.01 0.92 -0.40 2.28 3.38 -1.12 -2.64 115.31 117.71 1pff h LEU 388 Ca 0.00 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1pff h LEU 388 Cb 0.03 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 1pff h LEU 388 CO -0.00 1.12 0.26 0.50 0.09 0.00 0.00 178.44 180.41 1pff h LYS 389 N 0.76 0.52 -0.53 1.13 3.64 -0.99 0.15 116.57 121.26 1pff h LYS 389 Ca 0.09 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.45 1pff h LYS 389 Cb 0.81 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.49 1pff h LYS 389 CO 0.07 0.35 0.34 0.37 -2.27 0.00 0.00 179.45 178.31 1pff h GLN 390 N 0.54 0.68 -0.07 1.90 -0.00 -1.41 -0.64 115.11 116.11 1pff h GLN 390 Ca 0.14 -0.04 -0.01 0.00 -0.00 0.00 0.00 58.65 58.74 1pff h GLN 390 Cb -0.06 -0.15 -0.00 0.00 0.00 0.00 0.00 27.48 27.27 1pff h GLN 390 CO -0.03 0.45 0.00 0.00 0.00 0.00 0.00 178.83 179.25 1pff h ALA 391 N 1.20 0.09 -0.37 3.38 0.00 -1.09 -3.25 119.26 119.23 1pff h ALA 391 Ca 0.20 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 1pff h ALA 391 Cb -0.06 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1pff h ALA 391 CO -0.06 -0.24 -0.19 -0.07 0.00 0.00 0.00 179.25 178.70 1pff h LEU 392 N -0.15 0.71 -2.13 0.00 3.38 -0.67 -2.89 115.31 113.56 1pff h LEU 392 Ca 0.02 -0.24 0.04 0.00 0.09 0.00 0.00 57.88 57.80 1pff h LEU 392 Cb 0.32 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1pff h LEU 392 CO 0.00 0.90 0.13 0.44 0.09 0.00 0.00 178.44 180.00 1pff h ASP 393 N 0.63 0.00 1.09 -0.43 3.32 -1.15 -1.76 116.42 118.13 1pff h ASP 393 Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1pff h ASP 393 Cb 0.67 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.22 1pff h ASP 393 CO 0.05 0.00 0.00 -0.07 -1.72 0.00 0.00 179.24 177.50 1pff h LEU 394 N 0.00 0.00 -2.32 1.55 3.38 -1.54 -2.93 115.31 113.46 1pff h LEU 394 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1pff h LEU 394 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1pff h LEU 394 CO -0.00 0.00 0.00 0.55 0.09 0.00 0.00 178.44 179.08 1pff n VAL 395 N -2.95 0.52 0.91 1.22 3.14 -0.66 -5.09 118.33 115.42 1pff n VAL 395 Ca 0.01 -0.76 0.07 0.00 -2.96 0.00 0.00 64.34 60.71 1pff n VAL 395 Cb 0.32 0.96 0.43 0.00 -1.06 0.00 0.00 33.84 34.49 1pff n VAL 395 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26