#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3nn9 s ASP 83 N 0.00 1.37 0.25 2.89 -1.08 -1.26 -4.92 116.67 113.92 3nn9 s ASP 83 Ca 0.00 -0.79 -0.30 0.00 -0.52 0.00 0.00 52.55 50.94 3nn9 s ASP 83 Cb 0.00 0.02 -0.14 0.00 -1.46 0.00 0.00 42.92 41.34 3nn9 s ASP 83 CO 0.00 -0.26 1.25 0.49 0.52 0.00 0.00 175.17 177.16 3nn9 n PHE 84 N 0.64 1.79 -2.19 -5.34 3.72 -1.26 -4.39 117.46 110.44 3nn9 n PHE 84 Ca -0.17 0.57 -0.38 0.00 -0.05 0.00 0.00 57.45 57.42 3nn9 n PHE 84 Cb 0.57 -2.37 -0.01 0.00 -0.94 0.00 0.00 39.48 36.74 3nn9 n PHE 84 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 3nn9 s ASN 85 N -0.06 6.27 -0.10 4.37 2.47 -0.65 -4.74 114.94 122.50 3nn9 s ASN 85 Ca 0.65 2.44 0.02 0.00 0.42 0.00 0.00 52.86 56.39 3nn9 s ASN 85 Cb -0.69 -2.62 0.01 0.00 -1.45 0.00 0.00 41.25 36.50 3nn9 s ASN 85 CO 0.55 -0.86 -0.17 0.20 -3.72 0.00 0.00 177.10 173.10 3nn9 s ASN 86 N -1.09 2.48 -1.02 -4.21 0.01 -1.26 -0.77 114.94 109.08 3nn9 s ASN 86 Ca 0.60 -0.44 -0.24 0.00 -0.71 0.00 0.00 52.86 52.07 3nn9 s ASN 86 Cb -0.32 -1.13 -0.07 0.00 0.41 0.00 0.00 41.25 40.14 3nn9 s ASN 86 CO 0.40 0.05 1.96 -0.76 -1.51 0.00 0.00 177.10 177.24 3nn9 s LEU 87 N 0.79 3.10 -0.10 0.60 1.43 -1.26 -4.75 118.68 118.48 3nn9 s LEU 87 Ca -0.10 -1.06 0.03 0.00 -1.03 0.00 0.00 54.13 51.96 3nn9 s LEU 87 Cb -0.16 -2.57 -0.24 0.00 0.03 0.00 0.00 46.19 43.25 3nn9 s LEU 87 CO 0.01 -2.95 0.43 0.41 0.23 0.00 0.00 176.35 174.48 3nn9 n THR 88 N 7.90 1.68 -2.70 5.49 -1.04 -1.26 -1.13 114.28 123.21 3nn9 n THR 88 Ca 0.42 -0.72 -0.21 0.00 -2.04 0.00 0.00 64.05 61.51 3nn9 n THR 88 Cb 0.47 -1.37 0.03 0.00 -1.82 0.00 0.00 70.33 67.64 3nn9 n THR 88 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3nn9 s LYS 89 N -2.57 2.62 0.54 -2.82 1.02 -1.26 -4.56 119.74 112.71 3nn9 s LYS 89 Ca -0.16 -0.79 0.05 0.00 0.02 0.00 0.00 55.97 55.10 3nn9 s LYS 89 Cb 0.07 -2.52 0.04 0.00 -0.52 0.00 0.00 37.83 34.90 3nn9 s LYS 89 CO 0.78 -0.63 0.38 0.20 -0.92 0.00 0.00 175.35 175.16 3nn9 s GLY 90 N -4.40 2.42 0.24 -3.33 0.00 -1.26 -1.02 107.32 99.97 3nn9 s GLY 90 Ca 0.56 -1.18 -0.20 0.00 0.00 0.00 0.00 44.72 43.90 3nn9 s GLY 90 CO 0.38 -1.96 0.75 1.08 0.00 0.00 0.00 173.10 173.35 3nn9 s LEU 91 N -4.26 4.33 0.92 0.66 1.43 -1.26 -0.50 118.68 120.00 3nn9 s LEU 91 Ca 0.32 1.46 -0.12 0.00 -1.03 0.00 0.00 54.13 54.76 3nn9 s LEU 91 Cb -0.02 -3.65 0.14 0.00 0.03 0.00 0.00 46.19 42.69 3nn9 s LEU 91 CO 0.20 0.01 1.09 0.00 0.23 0.00 0.00 176.35 177.88 3nn9 s THR 93 N -2.96 4.04 -0.41 0.00 -4.23 -1.26 -4.92 115.64 105.90 3nn9 s THR 93 Ca 0.64 1.70 -0.13 0.00 -1.18 0.00 0.00 61.69 62.71 3nn9 s THR 93 Cb -0.18 -4.08 0.04 0.00 1.34 0.00 0.00 72.50 69.61 3nn9 s THR 93 CO 0.57 0.26 0.28 -0.63 -0.54 0.00 0.00 174.62 174.56 3nn9 s ILE 94 N -0.01 4.95 -0.64 2.99 1.01 -1.26 -3.97 121.20 124.27 3nn9 s ILE 94 Ca 0.50 -0.86 0.14 0.00 0.00 0.00 0.00 60.65 60.43 3nn9 s ILE 94 Cb -0.28 -3.82 -0.16 0.00 0.01 0.00 0.00 42.46 38.22 3nn9 s ILE 94 CO 0.33 -0.35 0.59 0.59 0.00 0.00 0.00 174.94 176.10 3nn9 n ASN 95 N 5.10 0.71 -1.80 3.58 5.03 0.85 -4.99 115.26 123.74 3nn9 n ASN 95 Ca -0.11 -0.80 -0.01 0.00 0.87 0.00 0.00 54.58 54.54 3nn9 n ASN 95 Cb 0.46 1.03 0.01 0.00 -1.02 0.00 0.00 39.78 40.25 3nn9 n ASN 95 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 3nn9 n SER 96 N -1.37 -0.53 -4.05 6.41 3.41 -0.80 -4.60 113.62 112.10 3nn9 n SER 96 Ca 0.02 -1.25 -0.22 0.00 -0.26 0.00 0.00 58.87 57.17 3nn9 n SER 96 Cb 0.23 0.86 -0.16 0.00 -0.26 0.00 0.00 64.21 64.88 3nn9 n SER 96 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 3nn9 s TRP 97 N -4.24 1.17 0.16 7.33 0.52 -1.26 -1.32 118.94 121.30 3nn9 s TRP 97 Ca 0.08 -0.29 0.07 0.00 0.02 0.00 0.00 56.10 55.98 3nn9 s TRP 97 Cb -0.01 -0.80 -0.04 0.00 -1.15 0.00 0.00 33.47 31.47 3nn9 s TRP 97 CO 0.01 -0.10 0.00 -3.38 0.02 0.00 0.00 176.95 173.50 3nn9 s HIS 98 N 0.08 2.87 0.32 -1.98 -3.43 0.19 -4.89 115.29 108.45 3nn9 s HIS 98 Ca -0.02 -0.12 -0.29 0.00 -0.80 0.00 0.00 55.06 53.83 3nn9 s HIS 98 Cb -0.09 -1.41 -0.10 0.00 -1.43 0.00 0.00 32.58 29.55 3nn9 s HIS 98 CO 0.01 0.51 1.39 0.42 -2.00 0.00 0.00 174.74 175.07 3nn9 s ILE 99 N -1.65 2.52 -0.00 -5.38 1.09 -1.26 -2.19 121.20 114.32 3nn9 s ILE 99 Ca 0.27 0.50 -0.01 0.00 -1.10 0.00 0.00 60.65 60.32 3nn9 s ILE 99 Cb -0.10 -3.32 -0.00 0.00 -1.06 0.00 0.00 42.46 37.98 3nn9 s ILE 99 CO 0.18 0.11 -0.01 0.00 -0.10 0.00 0.00 174.94 175.12 3nn9 n TYR 100 N 1.14 0.00 -4.24 3.97 9.36 0.34 -4.81 117.16 122.92 3nn9 n TYR 100 Ca 0.02 0.00 -0.15 0.00 3.32 0.00 0.00 57.90 61.09 3nn9 n TYR 100 Cb 0.41 -0.01 -0.10 0.00 -0.63 0.00 0.00 39.34 39.00 3nn9 n TYR 100 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 3nn9 s GLY 101 N -3.09 1.04 -0.28 2.98 0.00 -0.93 -4.97 107.32 102.07 3nn9 s GLY 101 Ca -0.01 -1.41 -0.20 0.00 0.00 0.00 0.00 44.72 43.10 3nn9 s GLY 101 CO 0.01 -1.49 0.88 1.25 0.00 0.00 0.00 173.10 173.75 3nn9 s LYS 102 N -3.37 0.58 -0.01 2.90 2.20 -1.26 -0.29 119.74 120.50 3nn9 s LYS 102 Ca 0.13 0.84 0.10 0.00 -0.36 0.00 0.00 55.97 56.69 3nn9 s LYS 102 Cb 0.00 0.21 -0.15 0.00 -1.51 0.00 0.00 37.83 36.38 3nn9 s LYS 102 CO 0.01 -0.09 0.28 -0.40 -0.36 0.00 0.00 175.35 174.79 3nn9 n ASP 103 N 3.20 2.02 -3.25 1.43 5.68 -1.21 -4.69 116.55 119.71 3nn9 n ASP 103 Ca -0.16 -0.21 -0.23 0.00 -0.50 0.00 0.00 54.79 53.68 3nn9 n ASP 103 Cb 0.57 1.34 0.04 0.00 -1.14 0.00 0.00 41.12 41.93 3nn9 n ASP 103 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3nn9 n ASN 104 N -1.68 -5.87 -0.29 -1.12 3.02 -1.26 -4.41 115.26 103.64 3nn9 n ASN 104 Ca -0.01 -0.39 0.03 0.00 -0.03 0.00 0.00 54.58 54.18 3nn9 n ASN 104 Cb 0.24 -4.72 0.23 0.00 -0.61 0.00 0.00 39.78 34.92 3nn9 n ASN 104 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3nn9 h ALA 105 N 1.01 1.49 0.03 5.41 0.00 -1.90 -2.52 119.26 122.78 3nn9 h ALA 105 Ca -0.53 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.10 3nn9 h ALA 105 Cb 1.36 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.87 3nn9 h ALA 105 CO 0.57 0.39 -1.01 0.28 0.00 0.00 0.00 179.25 179.49 3nn9 h VAL 106 N 1.04 1.40 0.30 0.00 2.07 -1.90 -0.06 116.25 119.10 3nn9 h VAL 106 Ca 0.37 -2.53 0.00 0.00 0.82 0.00 0.00 66.70 65.37 3nn9 h VAL 106 Cb 0.13 2.51 -0.03 0.00 -1.52 0.00 0.00 31.29 32.37 3nn9 h VAL 106 CO -0.13 0.75 -0.40 0.03 0.02 0.00 0.00 177.57 177.85 3nn9 h ARG 107 N 0.22 -0.72 -0.01 1.57 3.08 -1.85 -2.18 114.38 114.49 3nn9 h ARG 107 Ca -0.10 0.05 -0.10 0.00 0.07 0.00 0.00 59.98 59.91 3nn9 h ARG 107 Cb 1.66 0.16 -0.01 0.00 0.08 0.00 0.00 29.97 31.86 3nn9 h ARG 107 CO 0.18 -0.48 -0.45 0.82 -1.07 0.00 0.00 179.97 178.96 3nn9 h ILE 108 N -0.75 1.33 0.00 2.04 2.04 -1.48 -2.40 117.51 118.29 3nn9 h ILE 108 Ca -0.01 -1.56 -0.03 0.00 1.00 0.00 0.00 64.86 64.26 3nn9 h ILE 108 Cb 0.70 1.83 -0.00 0.00 -0.74 0.00 0.00 36.82 38.61 3nn9 h ILE 108 CO -0.13 0.45 -0.12 1.23 0.00 0.00 0.00 178.15 179.58 3nn9 h GLY 109 N 1.35 0.00 1.07 5.37 0.00 -0.82 -2.64 103.07 107.40 3nn9 h GLY 109 Ca -0.00 0.00 0.10 0.00 0.00 0.00 0.00 47.33 47.43 3nn9 h GLY 109 CO 0.06 0.00 0.37 -2.09 0.00 0.00 0.00 176.54 174.88 3nn9 h GLU 110 N 0.00 0.00 -0.17 4.80 4.22 -0.85 -3.24 114.58 119.34 3nn9 h GLU 110 Ca -0.00 0.00 -0.20 0.00 0.08 0.00 0.00 59.36 59.24 3nn9 h GLU 110 Cb 0.46 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 29.39 3nn9 h GLU 110 CO 0.02 0.00 -0.85 -3.47 -2.18 0.00 0.00 179.01 172.52 3nn9 n ASP 111 N -3.75 0.57 -4.07 1.04 2.03 -1.06 -4.97 116.55 106.35 3nn9 n ASP 111 Ca 0.06 -2.04 -0.10 0.00 0.52 0.00 0.00 54.79 53.22 3nn9 n ASP 111 Cb 0.53 -0.14 -0.08 0.00 -0.72 0.00 0.00 41.12 40.71 3nn9 n ASP 111 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 3nn9 s SER 112 N -2.43 0.09 -1.03 1.67 0.01 -1.02 -5.07 113.70 105.92 3nn9 s SER 112 Ca 0.23 -1.09 -0.14 0.00 1.31 0.00 0.00 55.95 56.26 3nn9 s SER 112 Cb 0.32 0.43 0.19 0.00 0.21 0.00 0.00 66.02 67.17 3nn9 s SER 112 CO -0.09 -0.90 1.14 -1.81 0.41 0.00 0.00 173.24 171.99 3nn9 s ASP 113 N -3.05 6.93 -0.17 2.44 1.01 -1.26 -4.70 116.67 117.87 3nn9 s ASP 113 Ca 0.26 -2.78 -0.07 0.00 0.71 0.00 0.00 52.55 50.66 3nn9 s ASP 113 Cb 0.04 -2.32 -0.04 0.00 1.01 0.00 0.00 42.92 41.61 3nn9 s ASP 113 CO 0.06 -0.71 0.08 -0.69 0.21 0.00 0.00 175.17 174.12 3nn9 s VAL 114 N 1.01 4.93 0.48 -1.27 1.01 -1.26 -1.84 120.40 123.45 3nn9 s VAL 114 Ca 0.32 0.01 -0.18 0.00 0.00 0.00 0.00 61.98 62.13 3nn9 s VAL 114 Cb -0.06 -3.21 -0.09 0.00 0.00 0.00 0.00 36.38 33.02 3nn9 s VAL 114 CO -0.06 0.48 0.97 -0.76 0.00 0.00 0.00 175.10 175.73 3nn9 s LEU 115 N 0.17 3.75 -0.11 3.92 1.43 0.18 -1.30 118.68 126.72 3nn9 s LEU 115 Ca 0.05 1.63 -0.27 0.00 -1.03 0.00 0.00 54.13 54.51 3nn9 s LEU 115 Cb -0.12 -4.52 -0.02 0.00 0.03 0.00 0.00 46.19 41.56 3nn9 s LEU 115 CO 0.00 -0.50 0.89 -0.69 0.23 0.00 0.00 176.35 176.28 3nn9 s VAL 116 N -2.43 4.87 0.00 -1.59 1.01 -0.37 -4.68 120.40 117.20 3nn9 s VAL 116 Ca 0.60 1.81 0.00 0.00 0.00 0.00 0.00 61.98 64.39 3nn9 s VAL 116 Cb -0.10 -4.21 0.00 0.00 0.00 0.00 0.00 36.38 32.07 3nn9 s VAL 116 CO 0.24 0.07 0.00 0.35 0.00 0.00 0.00 175.10 175.75 3nn9 n THR 117 N 4.43 0.00 0.00 3.92 -2.24 -1.26 -1.25 114.28 117.89 3nn9 n THR 117 Ca 0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 3nn9 n THR 117 Cb 0.49 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 3nn9 n THR 117 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3nn9 n ARG 118 N 0.00 -2.76 -3.79 -0.78 1.74 -1.04 -4.22 116.66 105.81 3nn9 n ARG 118 Ca 0.00 0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.81 3nn9 n ARG 118 Cb 0.00 0.00 0.02 0.00 -1.02 0.00 0.00 32.46 31.46 3nn9 n ARG 118 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3nn9 n GLU 119 N -0.14 -2.78 -1.81 5.56 4.71 -1.26 -2.05 120.64 122.86 3nn9 n GLU 119 Ca 0.00 0.47 -0.32 0.00 -0.01 0.00 0.00 57.16 57.30 3nn9 n GLU 119 Cb 0.00 -4.51 0.03 0.00 -1.01 0.00 0.00 31.44 25.95 3nn9 n GLU 119 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 3nn9 s PRO 120 N -6.19 3.07 0.00 3.49 0.04 -1.26 -4.26 135.00 129.89 3nn9 s PRO 120 Ca 0.19 1.14 0.00 0.00 0.04 0.00 0.00 61.00 62.38 3nn9 s PRO 120 Cb -0.07 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.47 3nn9 s PRO 120 CO 0.86 -1.01 0.00 2.48 0.04 0.00 0.00 177.00 179.37 3nn9 n TYR 121 N -2.52 -0.51 -3.76 0.56 4.11 0.83 -4.88 117.16 110.99 3nn9 n TYR 121 Ca 0.09 0.00 -0.13 0.00 -0.00 0.00 0.00 57.90 57.85 3nn9 n TYR 121 Cb 0.53 0.00 -0.14 0.00 -0.00 0.00 0.00 39.34 39.73 3nn9 n TYR 121 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.86 176.94 3nn9 s VAL 122 N -2.70 -0.04 0.02 -3.48 1.01 -1.26 -1.72 120.40 112.24 3nn9 s VAL 122 Ca 0.00 0.13 -0.04 0.00 0.00 0.00 0.00 61.98 62.07 3nn9 s VAL 122 Cb 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 36.38 36.10 3nn9 s VAL 122 CO 0.00 0.05 0.05 -0.55 0.00 0.00 0.00 175.10 174.65 3nn9 s SER 123 N 0.92 0.19 0.02 3.32 0.15 -0.63 -4.71 113.70 112.96 3nn9 s SER 123 Ca -0.07 -0.49 0.08 0.00 0.70 0.00 0.00 55.95 56.18 3nn9 s SER 123 Cb -0.09 0.17 -0.02 0.00 -1.71 0.00 0.00 66.02 64.37 3nn9 s SER 123 CO -0.05 -0.41 -0.24 0.00 1.20 0.00 0.00 173.24 173.74 3nn9 s ASP 125 N -0.91 5.16 0.49 0.00 1.11 0.07 -4.38 116.67 118.20 3nn9 s ASP 125 Ca 0.10 -0.18 0.18 0.00 0.18 0.00 0.00 52.55 52.82 3nn9 s ASP 125 Cb -0.09 -0.62 1.20 0.00 1.07 0.00 0.00 42.92 44.48 3nn9 s ASP 125 CO 0.01 -1.22 2.03 -0.65 1.18 0.00 0.00 175.17 176.51 3nn9 h PRO 126 N 0.06 0.18 0.00 8.23 0.11 -1.96 -3.27 132.00 135.34 3nn9 h PRO 126 Ca -0.40 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.70 3nn9 h PRO 126 Cb 1.29 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 3nn9 h PRO 126 CO 0.48 0.12 -1.17 -0.40 -0.21 0.00 0.00 178.00 176.82 3nn9 n ASP 127 N -4.45 4.18 -3.79 -2.05 5.68 -1.26 -4.91 116.55 109.94 3nn9 n ASP 127 Ca 0.07 0.00 -0.13 0.00 -0.50 0.00 0.00 54.79 54.23 3nn9 n ASP 127 Cb 0.38 1.13 -0.10 0.00 -1.14 0.00 0.00 41.12 41.38 3nn9 n ASP 127 CO 0.00 0.00 0.00 -1.83 -1.33 0.00 0.00 177.20 174.04 3nn9 s GLU 128 N -2.24 0.43 -0.03 0.11 -1.05 -1.23 -5.14 118.70 109.55 3nn9 s GLU 128 Ca -0.01 0.07 -0.13 0.00 -0.15 0.00 0.00 54.97 54.75 3nn9 s GLU 128 Cb 0.02 0.20 -0.05 0.00 -0.44 0.00 0.00 34.13 33.86 3nn9 s GLU 128 CO 0.15 -0.09 0.36 0.00 0.95 0.00 0.00 175.26 176.63 3nn9 s ARG 130 N -0.92 1.09 0.22 0.00 0.52 -0.11 -4.22 118.95 115.54 3nn9 s ARG 130 Ca 0.22 -1.34 -0.08 0.00 -0.52 0.00 0.00 55.73 54.00 3nn9 s ARG 130 Cb -0.16 -0.91 -0.07 0.00 0.52 0.00 0.00 34.95 34.34 3nn9 s ARG 130 CO 0.11 0.16 0.52 -0.06 0.02 0.00 0.00 175.30 176.05 3nn9 s PHE 131 N -2.49 3.44 0.03 -0.53 0.08 -0.95 -1.60 117.98 115.95 3nn9 s PHE 131 Ca 0.13 0.80 -0.03 0.00 0.12 0.00 0.00 56.93 57.95 3nn9 s PHE 131 Cb -0.03 -2.20 -0.02 0.00 -0.57 0.00 0.00 43.02 40.20 3nn9 s PHE 131 CO 0.03 0.29 0.03 0.71 -0.10 0.00 0.00 175.22 176.19 3nn9 s TYR 132 N -1.80 0.25 -0.01 0.36 1.51 -0.70 -1.13 117.35 115.84 3nn9 s TYR 132 Ca 0.46 -0.55 -0.30 0.00 -1.01 0.00 0.00 57.07 55.67 3nn9 s TYR 132 Cb -0.11 -0.19 0.11 0.00 -0.11 0.00 0.00 41.96 41.66 3nn9 s TYR 132 CO 0.22 -0.28 1.16 0.00 -1.11 0.00 0.00 175.55 175.55 3nn9 s ALA 133 N -2.15 -2.04 -0.35 3.71 0.00 -0.95 -0.12 121.76 119.86 3nn9 s ALA 133 Ca -0.09 0.74 -0.14 0.00 0.00 0.00 0.00 51.96 52.47 3nn9 s ALA 133 Cb -0.04 0.35 -0.01 0.00 0.00 0.00 0.00 23.12 23.41 3nn9 s ALA 133 CO -0.03 -0.94 0.29 -0.51 0.00 0.00 0.00 175.76 174.56 3nn9 s LEU 134 N -2.79 4.54 0.77 0.00 1.02 -0.87 -1.72 118.68 119.63 3nn9 s LEU 134 Ca 0.12 -0.40 -0.12 0.00 0.02 0.00 0.00 54.13 53.76 3nn9 s LEU 134 Cb 0.02 -2.21 0.06 0.00 0.02 0.00 0.00 46.19 44.08 3nn9 s LEU 134 CO -0.03 -0.29 1.11 -0.55 0.02 0.00 0.00 176.35 176.61 3nn9 s SER 135 N 1.73 4.32 0.00 2.29 0.15 0.03 -2.51 113.70 119.70 3nn9 s SER 135 Ca 0.08 1.96 0.08 0.00 0.70 0.00 0.00 55.95 58.77 3nn9 s SER 135 Cb -0.17 -2.54 0.05 0.00 -1.71 0.00 0.00 66.02 61.64 3nn9 s SER 135 CO 0.11 -2.16 0.71 0.00 1.20 0.00 0.00 173.24 173.09 3nn9 n GLN 136 N -3.38 0.80 -2.26 5.44 1.13 -0.38 -3.92 117.38 114.81 3nn9 n GLN 136 Ca 0.10 -0.86 -0.05 0.00 -1.94 0.00 0.00 57.00 54.25 3nn9 n GLN 136 Cb 0.52 -1.12 0.00 0.00 0.11 0.00 0.00 30.24 29.76 3nn9 n GLN 136 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3nn9 n GLY 137 N 0.58 0.31 3.46 1.08 0.00 -1.18 -4.56 105.19 104.87 3nn9 n GLY 137 Ca 0.04 -0.64 -0.13 0.00 0.00 0.00 0.00 46.02 45.29 3nn9 n GLY 137 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3nn9 s THR 138 N -2.46 0.00 0.44 2.61 2.01 -1.26 -5.04 115.64 111.95 3nn9 s THR 138 Ca 0.03 0.00 -0.07 0.00 0.31 0.00 0.00 61.69 61.97 3nn9 s THR 138 Cb -0.02 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.45 3nn9 s THR 138 CO 0.04 0.00 0.76 0.42 -0.69 0.00 0.00 174.62 175.15 3nn9 s THR 139 N -2.93 4.88 0.37 -0.82 -4.23 -1.26 -1.24 115.64 110.41 3nn9 s THR 139 Ca -0.02 0.30 0.09 0.00 -1.18 0.00 0.00 61.69 60.88 3nn9 s THR 139 Cb -0.01 -3.82 0.32 0.00 1.34 0.00 0.00 72.50 70.33 3nn9 s THR 139 CO -0.06 -0.71 1.90 0.40 -0.54 0.00 0.00 174.62 175.61 3nn9 h ILE 140 N 0.58 0.89 -0.02 2.99 2.04 -1.47 -2.17 117.51 120.35 3nn9 h ILE 140 Ca -0.47 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.16 3nn9 h ILE 140 Cb 1.20 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 3nn9 h ILE 140 CO 0.63 0.12 -0.21 -1.14 0.00 0.00 0.00 178.15 177.55 3nn9 n ARG 141 N -4.52 1.39 -1.90 2.37 3.00 -1.26 -4.79 116.66 110.94 3nn9 n ARG 141 Ca 0.15 -0.98 -0.32 0.00 -0.00 0.00 0.00 57.85 56.70 3nn9 n ARG 141 Cb 0.40 -1.48 0.02 0.00 0.00 0.00 0.00 32.46 31.40 3nn9 n ARG 141 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 3nn9 s GLY 142 N -2.29 1.88 0.49 5.14 0.00 -0.82 -4.95 107.32 106.78 3nn9 s GLY 142 Ca 0.27 0.18 0.20 0.00 0.00 0.00 0.00 44.72 45.37 3nn9 s GLY 142 CO 0.45 0.48 2.06 0.50 0.00 0.00 0.00 173.10 176.59 3nn9 h LYS 143 N -0.01 0.00 0.00 2.90 1.57 -1.90 -2.20 116.57 116.93 3nn9 h LYS 143 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 3nn9 h LYS 143 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 3nn9 h LYS 143 CO 0.58 0.13 0.00 0.72 -0.57 0.00 0.00 179.45 180.32 3nn9 n HIS 144 N -4.09 0.00 0.54 -1.35 8.25 -1.26 -2.17 115.22 115.14 3nn9 n HIS 144 Ca -0.02 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.56 3nn9 n HIS 144 Cb 0.21 0.00 0.43 0.00 1.12 0.00 0.00 29.99 31.76 3nn9 n HIS 144 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 3nn9 n SER 145 N -0.99 0.80 -4.66 0.41 3.41 -0.83 -4.71 113.62 107.06 3nn9 n SER 145 Ca 0.16 0.61 -0.43 0.00 -0.26 0.00 0.00 58.87 58.95 3nn9 n SER 145 Cb 0.07 -0.81 -0.02 0.00 -0.26 0.00 0.00 64.21 63.18 3nn9 n SER 145 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 3nn9 s ASN 146 N -4.51 6.84 0.00 4.04 3.84 -0.92 -2.99 114.94 121.24 3nn9 s ASN 146 Ca 0.08 1.88 0.00 0.00 0.21 0.00 0.00 52.86 55.03 3nn9 s ASN 146 Cb 0.11 -2.54 0.00 0.00 -0.55 0.00 0.00 41.25 38.28 3nn9 s ASN 146 CO 0.53 -0.83 0.00 0.61 -2.79 0.00 0.00 177.10 174.62 3nn9 n GLY 147 N 3.82 0.63 0.41 1.21 0.00 -0.87 -5.00 105.19 105.39 3nn9 n GLY 147 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3nn9 n GLY 147 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3nn9 n THR 148 N -1.37 0.00 0.19 2.61 -2.24 -1.16 -2.83 114.28 109.48 3nn9 n THR 148 Ca 0.00 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 3nn9 n THR 148 Cb 0.00 -0.33 0.12 0.00 -2.10 0.00 0.00 70.33 68.02 3nn9 n THR 148 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 3nn9 h ILE 149 N 0.00 0.07 -3.86 2.28 2.10 -1.88 -3.39 117.51 112.83 3nn9 h ILE 149 Ca 0.00 -1.11 -0.50 0.00 1.08 0.00 0.00 64.86 64.33 3nn9 h ILE 149 Cb 0.31 1.93 0.02 0.00 -1.09 0.00 0.00 36.82 37.99 3nn9 h ILE 149 CO 0.00 0.04 0.46 -1.00 -1.08 0.00 0.00 178.15 176.58 3nn9 s HIS 150 N -3.22 3.44 -0.16 2.19 3.76 -1.13 -4.98 115.29 115.19 3nn9 s HIS 150 Ca 0.05 1.67 0.17 0.00 -0.15 0.00 0.00 55.06 56.80 3nn9 s HIS 150 Cb 0.06 -3.26 -0.04 0.00 1.11 0.00 0.00 32.58 30.45 3nn9 s HIS 150 CO 0.70 -0.67 1.06 -0.44 -0.85 0.00 0.00 174.74 174.55 3nn9 h ASP 151 N 3.34 0.00 -3.68 1.40 3.32 -1.93 -3.47 116.42 115.41 3nn9 h ASP 151 Ca -0.47 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.31 3nn9 h ASP 151 Cb 1.22 0.00 -0.30 0.00 0.22 0.00 0.00 39.33 40.46 3nn9 h ASP 151 CO 0.65 0.45 -0.73 -0.13 -1.72 0.00 0.00 179.24 177.76 3nn9 s ARG 152 N -3.01 0.07 0.06 3.56 0.52 -1.26 -4.91 118.95 113.98 3nn9 s ARG 152 Ca -0.00 0.03 -0.27 0.00 -0.52 0.00 0.00 55.73 54.97 3nn9 s ARG 152 Cb 0.08 -0.15 0.10 0.00 0.52 0.00 0.00 34.95 35.50 3nn9 s ARG 152 CO 0.78 -0.04 1.17 -1.54 0.02 0.00 0.00 175.30 175.70 3nn9 s SER 153 N 0.34 -0.06 0.00 0.23 1.04 -1.26 -5.03 113.70 108.96 3nn9 s SER 153 Ca -0.03 -0.30 0.30 0.00 0.48 0.00 0.00 55.95 56.40 3nn9 s SER 153 Cb -0.05 0.29 1.68 0.00 0.10 0.00 0.00 66.02 68.04 3nn9 s SER 153 CO -0.01 -0.55 2.11 0.00 0.98 0.00 0.00 173.24 175.77 3nn9 n GLN 154 N -0.60 0.71 -0.06 4.02 3.00 -1.26 -4.12 117.38 119.07 3nn9 n GLN 154 Ca -0.05 0.00 0.11 0.00 -0.01 0.00 0.00 57.00 57.05 3nn9 n GLN 154 Cb 0.61 -1.50 0.12 0.00 0.00 0.00 0.00 30.24 29.47 3nn9 n GLN 154 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 3nn9 n TYR 155 N -1.14 0.16 -3.13 1.08 4.01 -1.26 -4.93 117.16 111.95 3nn9 n TYR 155 Ca 0.19 -0.09 -0.31 0.00 -0.16 0.00 0.00 57.90 57.52 3nn9 n TYR 155 Cb 0.17 -0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.15 3nn9 n TYR 155 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 3nn9 s ARG 156 N -1.61 3.85 0.04 -0.72 0.52 -1.26 -3.12 118.95 116.65 3nn9 s ARG 156 Ca 0.28 0.45 -0.18 0.00 -0.52 0.00 0.00 55.73 55.76 3nn9 s ARG 156 Cb 0.18 -2.49 0.04 0.00 0.52 0.00 0.00 34.95 33.20 3nn9 s ARG 156 CO 0.27 0.14 0.41 0.00 0.02 0.00 0.00 175.30 176.13 3nn9 s ALA 157 N -2.08 -0.99 -0.07 2.13 0.00 -1.25 -3.14 121.76 116.35 3nn9 s ALA 157 Ca 0.51 0.32 -0.28 0.00 0.00 0.00 0.00 51.96 52.51 3nn9 s ALA 157 Cb -0.10 0.32 -0.02 0.00 0.00 0.00 0.00 23.12 23.31 3nn9 s ALA 157 CO 0.24 -0.44 0.90 -1.17 0.00 0.00 0.00 175.76 175.29 3nn9 s LEU 158 N -1.94 4.30 0.07 0.00 2.96 -0.71 -0.79 118.68 122.56 3nn9 s LEU 158 Ca -0.06 1.45 0.05 0.00 -0.22 0.00 0.00 54.13 55.36 3nn9 s LEU 158 Cb -0.01 -3.41 -0.03 0.00 0.50 0.00 0.00 46.19 43.24 3nn9 s LEU 158 CO -0.02 -0.30 -0.15 0.27 -1.32 0.00 0.00 176.35 174.83 3nn9 s ILE 159 N 1.40 1.18 0.19 6.68 -4.36 -0.70 -0.14 121.20 125.45 3nn9 s ILE 159 Ca 0.46 -1.26 0.08 0.00 -0.26 0.00 0.00 60.65 59.67 3nn9 s ILE 159 Cb -0.19 -1.11 -0.04 0.00 1.25 0.00 0.00 42.46 42.36 3nn9 s ILE 159 CO 0.21 -0.15 -0.17 -0.94 0.24 0.00 0.00 174.94 174.13 3nn9 s SER 160 N -1.62 2.72 0.16 4.36 1.04 0.44 -2.25 113.70 118.54 3nn9 s SER 160 Ca -0.00 -0.94 -0.13 0.00 0.48 0.00 0.00 55.95 55.36 3nn9 s SER 160 Cb -0.10 -0.16 0.01 0.00 0.10 0.00 0.00 66.02 65.88 3nn9 s SER 160 CO 0.02 -0.08 0.38 -1.66 0.98 0.00 0.00 173.24 172.88 3nn9 s TRP 161 N -2.46 0.08 0.36 5.02 -2.14 -0.28 -1.48 118.94 118.04 3nn9 s TRP 161 Ca 0.20 -0.43 -0.26 0.00 2.66 0.00 0.00 56.10 58.26 3nn9 s TRP 161 Cb -0.04 0.16 -0.12 0.00 -3.10 0.00 0.00 33.47 30.37 3nn9 s TRP 161 CO 0.07 -0.76 1.05 -2.30 -2.66 0.00 0.00 176.95 172.35 3nn9 n PRO 162 N -0.24 1.48 -1.60 3.25 -0.02 -1.26 -2.23 135.00 134.37 3nn9 n PRO 162 Ca -0.11 0.52 -0.44 0.00 -2.02 0.00 0.00 63.50 61.45 3nn9 n PRO 162 Cb 0.63 -2.01 -0.04 0.00 -0.02 0.00 0.00 33.50 32.06 3nn9 n PRO 162 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3nn9 n LEU 163 N 0.84 3.35 0.00 2.45 7.94 -1.26 -2.09 117.00 128.24 3nn9 n LEU 163 Ca 0.09 0.48 0.00 0.00 -1.11 0.00 0.00 56.01 55.47 3nn9 n LEU 163 Cb 0.36 -1.49 0.00 0.00 0.53 0.00 0.00 43.42 42.82 3nn9 n LEU 163 CO 0.59 -0.41 0.00 -1.20 -1.11 0.00 0.00 177.39 175.26 3nn9 n SER 164 N 9.92 -2.22 -4.93 1.96 7.64 -1.26 -5.02 113.62 119.70 3nn9 n SER 164 Ca 0.28 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.91 3nn9 n SER 164 Cb 0.39 -0.37 0.04 0.00 -1.01 0.00 0.00 64.21 63.27 3nn9 n SER 164 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3nn9 s SER 165 N -2.03 5.29 0.39 6.43 0.01 -0.89 -4.22 113.70 118.68 3nn9 s SER 165 Ca 0.00 0.46 -0.14 0.00 1.31 0.00 0.00 55.95 57.59 3nn9 s SER 165 Cb 0.00 -1.34 -0.08 0.00 0.21 0.00 0.00 66.02 64.81 3nn9 s SER 165 CO 0.00 -1.23 0.80 -2.84 0.41 0.00 0.00 173.24 170.38 3nn9 s PRO 166 N -5.00 3.91 -0.82 12.44 0.02 -1.26 -4.74 135.00 139.55 3nn9 s PRO 166 Ca 0.56 0.65 -0.25 0.00 0.02 0.00 0.00 61.00 61.98 3nn9 s PRO 166 Cb -0.11 -2.35 -0.05 0.00 0.02 0.00 0.00 34.50 32.01 3nn9 s PRO 166 CO 0.43 -0.00 1.96 -1.25 -0.33 0.00 0.00 177.00 177.81 3nn9 s PRO 167 N -3.54 2.52 0.35 5.54 0.04 -1.26 -4.92 135.00 133.72 3nn9 s PRO 167 Ca 0.54 -0.01 -0.02 0.00 0.04 0.00 0.00 61.00 61.55 3nn9 s PRO 167 Cb -0.10 -4.88 -0.04 0.00 0.04 0.00 0.00 34.50 29.52 3nn9 s PRO 167 CO 0.25 -3.27 0.59 0.99 0.04 0.00 0.00 177.00 175.60 3nn9 s THR 168 N 10.10 5.05 0.30 1.26 2.01 -1.26 0.49 115.64 133.59 3nn9 s THR 168 Ca 0.71 -0.17 0.08 0.00 0.31 0.00 0.00 61.69 62.62 3nn9 s THR 168 Cb -0.09 -3.82 0.03 0.00 0.01 0.00 0.00 72.50 68.64 3nn9 s THR 168 CO 0.05 -0.52 1.70 0.58 -0.69 0.00 0.00 174.62 175.75 3nn9 h VAL 169 N 0.89 1.32 0.00 3.82 2.07 -1.73 -3.23 116.25 119.39 3nn9 h VAL 169 Ca -0.49 -1.58 0.00 0.00 0.82 0.00 0.00 66.70 65.45 3nn9 h VAL 169 Cb 1.21 1.76 0.00 0.00 -1.52 0.00 0.00 31.29 32.74 3nn9 h VAL 169 CO 0.63 0.47 -1.19 -1.22 0.02 0.00 0.00 177.57 176.27 3nn9 n TYR 169 N -4.00 0.53 0.64 1.57 4.01 -1.26 -4.37 117.16 114.28 3nn9 n TYR 169 Ca -0.02 0.16 0.07 0.00 -0.16 0.00 0.00 57.90 57.95 3nn9 n TYR 169 Cb 0.49 -0.69 0.01 0.00 -0.31 0.00 0.00 39.34 38.84 3nn9 n TYR 169 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 3nn9 n ASN 170 N -2.34 1.63 -4.89 7.72 2.04 -1.22 -5.04 115.26 113.16 3nn9 n ASN 170 Ca -0.00 -1.32 -0.30 0.00 -0.44 0.00 0.00 54.58 52.53 3nn9 n ASN 170 Cb 0.51 0.40 -0.04 0.00 -2.53 0.00 0.00 39.78 38.12 3nn9 n ASN 170 CO 0.00 0.00 0.00 -0.44 -0.44 0.00 0.00 177.26 176.38 3nn9 s SER 171 N -1.69 6.50 -0.08 0.53 0.01 -1.22 -4.61 113.70 113.14 3nn9 s SER 171 Ca 0.13 0.83 0.01 0.00 1.31 0.00 0.00 55.95 58.23 3nn9 s SER 171 Cb 0.12 -2.19 0.02 0.00 0.21 0.00 0.00 66.02 64.17 3nn9 s SER 171 CO 0.34 -0.19 -0.10 -0.60 0.41 0.00 0.00 173.24 173.10 3nn9 s ARG 172 N -3.40 1.56 -0.23 12.44 3.52 -0.55 -4.97 118.95 127.33 3nn9 s ARG 172 Ca 0.46 -0.33 -0.19 0.00 -0.13 0.00 0.00 55.73 55.55 3nn9 s ARG 172 Cb -0.11 -1.43 -0.03 0.00 -1.56 0.00 0.00 34.95 31.82 3nn9 s ARG 172 CO 0.28 -0.10 0.54 0.08 -0.81 0.00 0.00 175.30 175.29 3nn9 s VAL 173 N 1.09 5.07 -0.06 7.11 1.01 -1.26 -0.42 120.40 132.95 3nn9 s VAL 173 Ca -0.07 0.97 -0.10 0.00 0.00 0.00 0.00 61.98 62.78 3nn9 s VAL 173 Cb -0.14 -3.86 -0.30 0.00 0.00 0.00 0.00 36.38 32.08 3nn9 s VAL 173 CO -0.01 0.12 0.64 -0.33 0.00 0.00 0.00 175.10 175.51 3nn9 h GLU 174 N 7.72 0.38 -1.81 2.72 4.39 -0.90 -3.49 114.58 123.59 3nn9 h GLU 174 Ca -0.31 -0.65 0.23 0.00 0.34 0.00 0.00 59.36 58.97 3nn9 h GLU 174 Cb 1.14 0.24 -0.14 0.00 -0.10 0.00 0.00 28.75 29.90 3nn9 h GLU 174 CO 0.74 1.31 0.68 0.00 -1.16 0.00 0.00 179.01 180.58 3nn9 s ILE 176 N -2.74 5.20 0.00 0.00 -1.09 -1.26 -1.74 121.20 119.57 3nn9 s ILE 176 Ca 0.11 0.83 0.00 0.00 -2.23 0.00 0.00 60.65 59.36 3nn9 s ILE 176 Cb 0.01 -3.77 0.00 0.00 -1.58 0.00 0.00 42.46 37.12 3nn9 s ILE 176 CO -0.04 0.31 0.00 0.61 -1.23 0.00 0.00 174.94 174.59 3nn9 n GLY 177 N 3.48 2.75 1.55 6.18 0.00 -1.19 -4.27 105.19 113.69 3nn9 n GLY 177 Ca -0.08 -0.83 0.09 0.00 0.00 0.00 0.00 46.02 45.20 3nn9 n GLY 177 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 3nn9 n TRP 178 N -0.83 1.47 -3.72 1.61 4.27 0.13 -3.96 117.44 116.41 3nn9 n TRP 178 Ca 0.00 -0.63 -0.13 0.00 -3.89 0.00 0.00 57.50 52.85 3nn9 n TRP 178 Cb 0.00 -0.25 -0.10 0.00 -1.36 0.00 0.00 31.31 29.60 3nn9 n TRP 178 CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 3nn9 s SER 179 N -0.95 -0.42 0.36 -0.67 0.15 -1.25 -4.90 113.70 106.02 3nn9 s SER 179 Ca 0.50 0.75 -0.13 0.00 0.70 0.00 0.00 55.95 57.77 3nn9 s SER 179 Cb 0.33 0.79 0.04 0.00 -1.71 0.00 0.00 66.02 65.46 3nn9 s SER 179 CO 0.23 -0.21 0.70 -0.94 1.20 0.00 0.00 173.24 174.22 3nn9 s SER 180 N -0.04 0.17 0.11 5.45 1.04 -1.26 -2.56 113.70 116.61 3nn9 s SER 180 Ca -0.02 -1.14 -0.26 0.00 0.48 0.00 0.00 55.95 55.01 3nn9 s SER 180 Cb -0.03 0.78 0.07 0.00 0.10 0.00 0.00 66.02 66.94 3nn9 s SER 180 CO 0.01 -1.54 0.86 0.28 0.98 0.00 0.00 173.24 173.83 3nn9 s THR 181 N -2.76 0.00 -0.29 2.02 -1.32 -1.16 -0.67 115.64 111.47 3nn9 s THR 181 Ca 0.19 -0.36 -0.19 0.00 -1.21 0.00 0.00 61.69 60.11 3nn9 s THR 181 Cb -0.04 -1.49 0.17 0.00 -1.51 0.00 0.00 72.50 69.63 3nn9 s THR 181 CO 0.13 0.00 1.16 -0.55 -2.21 0.00 0.00 174.62 173.15 3nn9 s SER 182 N -2.75 -0.27 0.07 8.08 0.15 -1.26 -1.41 113.70 116.32 3nn9 s SER 182 Ca 0.08 0.45 -0.09 0.00 0.70 0.00 0.00 55.95 57.09 3nn9 s SER 182 Cb -0.02 0.90 0.00 0.00 -1.71 0.00 0.00 66.02 65.19 3nn9 s SER 182 CO -0.04 -0.07 0.19 0.00 1.20 0.00 0.00 173.24 174.52 3nn9 s HIS 184 N -3.26 3.27 -2.25 0.00 2.46 -1.26 -1.71 115.29 112.55 3nn9 s HIS 184 Ca 0.00 0.17 0.27 0.00 0.47 0.00 0.00 55.06 55.97 3nn9 s HIS 184 Cb 0.02 -1.96 0.79 0.00 -0.13 0.00 0.00 32.58 31.31 3nn9 s HIS 184 CO -0.08 0.34 1.59 -0.40 -2.47 0.00 0.00 174.74 173.73 3nn9 n ASP 185 N 2.83 1.50 0.00 9.88 5.68 0.15 -4.69 116.55 131.90 3nn9 n ASP 185 Ca -0.18 -1.33 0.00 0.00 -0.50 0.00 0.00 54.79 52.78 3nn9 n ASP 185 Cb 0.53 0.08 0.00 0.00 -1.14 0.00 0.00 41.12 40.59 3nn9 n ASP 185 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3nn9 n GLY 186 N 1.27 2.00 0.10 6.12 0.00 -1.26 -1.63 105.19 111.78 3nn9 n GLY 186 Ca 0.15 -0.65 -0.15 0.00 0.00 0.00 0.00 46.02 45.37 3nn9 n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3nn9 n LYS 187 N 0.00 0.53 -3.98 1.61 5.02 -1.26 -3.26 118.16 116.82 3nn9 n LYS 187 Ca 0.00 0.39 -0.12 0.00 -2.02 0.00 0.00 58.31 56.56 3nn9 n LYS 187 Cb 0.00 -1.59 -0.02 0.00 -0.02 0.00 0.00 35.03 33.40 3nn9 n LYS 187 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3nn9 s THR 188 N -2.51 0.00 -0.12 -0.18 -1.32 -1.26 -4.85 115.64 105.40 3nn9 s THR 188 Ca -0.27 -1.37 -0.12 0.00 -1.21 0.00 0.00 61.69 58.72 3nn9 s THR 188 Cb 0.06 -2.69 -0.05 0.00 -1.51 0.00 0.00 72.50 68.32 3nn9 s THR 188 CO 0.42 0.00 0.27 -0.60 -2.21 0.00 0.00 174.62 172.50 3nn9 s ARG 189 N -2.87 3.97 -0.12 7.08 3.52 -1.26 -0.68 118.95 128.60 3nn9 s ARG 189 Ca 0.24 0.09 -0.02 0.00 -0.13 0.00 0.00 55.73 55.91 3nn9 s ARG 189 Cb -0.02 -3.32 -0.03 0.00 -1.56 0.00 0.00 34.95 30.02 3nn9 s ARG 189 CO 0.16 0.48 -0.02 1.41 -0.81 0.00 0.00 175.30 176.52 3nn9 s MET 190 N -0.27 3.28 0.06 5.12 -2.45 -0.69 -2.43 119.30 121.92 3nn9 s MET 190 Ca 0.17 -0.47 0.07 0.00 -1.25 0.00 0.00 55.69 54.21 3nn9 s MET 190 Cb -0.13 -2.83 -0.03 0.00 1.25 0.00 0.00 34.83 33.09 3nn9 s MET 190 CO 0.06 0.49 -0.19 -1.12 1.05 0.00 0.00 175.02 175.30 3nn9 s SER 191 N -0.30 2.25 -0.13 1.11 0.01 -0.08 -2.29 113.70 114.28 3nn9 s SER 191 Ca 0.06 -0.57 -0.02 0.00 1.31 0.00 0.00 55.95 56.73 3nn9 s SER 191 Cb -0.12 -0.15 0.04 0.00 0.21 0.00 0.00 66.02 66.00 3nn9 s SER 191 CO 0.02 0.08 0.01 -0.63 0.41 0.00 0.00 173.24 173.13 3nn9 s ILE 192 N -0.97 0.48 0.18 1.44 1.01 -0.50 -1.09 121.20 121.75 3nn9 s ILE 192 Ca 0.05 -0.21 0.07 0.00 0.00 0.00 0.00 60.65 60.56 3nn9 s ILE 192 Cb -0.09 -0.79 -0.04 0.00 0.01 0.00 0.00 42.46 41.55 3nn9 s ILE 192 CO 0.02 0.05 0.03 0.00 0.00 0.00 0.00 174.94 175.05 3nn9 s ILE 194 N -1.79 1.96 0.20 0.00 1.01 -1.06 -1.48 121.20 120.04 3nn9 s ILE 194 Ca 0.29 -0.98 -0.03 0.00 0.00 0.00 0.00 60.65 59.93 3nn9 s ILE 194 Cb -0.09 -1.69 -0.03 0.00 0.01 0.00 0.00 42.46 40.65 3nn9 s ILE 194 CO 0.20 0.54 0.17 -0.94 0.00 0.00 0.00 174.94 174.91 3nn9 s SER 195 N 0.25 0.14 0.00 3.58 1.04 -0.85 -0.69 113.70 117.16 3nn9 s SER 195 Ca -0.15 -1.29 0.00 0.00 0.48 0.00 0.00 55.95 54.99 3nn9 s SER 195 Cb -0.17 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.35 3nn9 s SER 195 CO 0.07 -0.87 0.00 0.61 0.98 0.00 0.00 173.24 174.04 3nn9 n GLY 196 N -0.26 2.93 3.72 7.32 0.00 -1.26 -0.84 105.19 116.79 3nn9 n GLY 196 Ca 0.00 -1.70 -0.29 0.00 0.00 0.00 0.00 46.02 44.04 3nn9 n GLY 196 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3nn9 s PRO 197 N -1.92 0.77 0.37 1.61 0.04 -1.26 -4.84 135.00 129.77 3nn9 s PRO 197 Ca 0.00 0.48 0.04 0.00 0.04 0.00 0.00 61.00 61.56 3nn9 s PRO 197 Cb 0.00 -1.78 0.72 0.00 0.04 0.00 0.00 34.50 33.48 3nn9 s PRO 197 CO 0.00 -2.49 2.01 -0.91 0.04 0.00 0.00 177.00 175.65 3nn9 h ASN 198 N -1.72 0.65 -0.55 6.66 4.21 -1.97 -2.30 115.58 120.56 3nn9 h ASN 198 Ca -0.53 -0.01 -0.06 0.00 1.21 0.00 0.00 56.30 56.91 3nn9 h ASN 198 Cb 1.32 -0.16 -0.04 0.00 -1.12 0.00 0.00 38.32 38.33 3nn9 h ASN 198 CO 0.59 0.46 0.07 -0.46 -1.29 0.00 0.00 177.43 176.79 3nn9 n ASN 199 N -4.46 5.04 -2.47 5.81 6.94 -1.25 -1.45 115.26 123.42 3nn9 n ASN 199 Ca 0.07 -3.06 -0.04 0.00 -0.02 0.00 0.00 54.58 51.53 3nn9 n ASN 199 Cb 0.10 -0.67 0.06 0.00 -2.36 0.00 0.00 39.78 36.90 3nn9 n ASN 199 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 3nn9 n ASN 200 N 0.13 -1.24 -4.94 0.53 2.85 -0.89 -4.84 115.26 106.85 3nn9 n ASN 200 Ca 0.30 -1.90 -0.24 0.00 -0.11 0.00 0.00 54.58 52.63 3nn9 n ASN 200 Cb 1.19 0.76 0.03 0.00 1.24 0.00 0.00 39.78 43.00 3nn9 n ASN 200 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3nn9 s ALA 201 N 0.10 3.57 -0.19 5.20 0.00 -1.08 -4.31 121.76 125.05 3nn9 s ALA 201 Ca 0.10 -0.99 -0.24 0.00 0.00 0.00 0.00 51.96 50.82 3nn9 s ALA 201 Cb 0.24 -2.33 0.06 0.00 0.00 0.00 0.00 23.12 21.10 3nn9 s ALA 201 CO -0.06 -0.71 0.64 -1.54 0.00 0.00 0.00 175.76 174.09 3nn9 s SER 202 N -4.33 -0.65 -0.14 0.00 1.04 -0.02 -1.76 113.70 107.83 3nn9 s SER 202 Ca 0.54 1.14 -0.06 0.00 0.48 0.00 0.00 55.95 58.04 3nn9 s SER 202 Cb -0.10 1.12 -0.04 0.00 0.10 0.00 0.00 66.02 67.10 3nn9 s SER 202 CO 0.41 -0.32 0.08 0.00 0.98 0.00 0.00 173.24 174.39 3nn9 s ALA 203 N -0.05 3.54 -0.05 5.32 0.00 -0.34 -2.02 121.76 128.17 3nn9 s ALA 203 Ca -0.03 -0.72 0.04 0.00 0.00 0.00 0.00 51.96 51.24 3nn9 s ALA 203 Cb -0.04 -1.85 0.00 0.00 0.00 0.00 0.00 23.12 21.24 3nn9 s ALA 203 CO 0.03 0.41 -0.15 0.54 0.00 0.00 0.00 175.76 176.59 3nn9 s VAL 204 N -0.36 1.31 -0.28 0.00 0.11 -0.55 -0.47 120.40 120.16 3nn9 s VAL 204 Ca 0.09 -0.63 -0.13 0.00 -2.93 0.00 0.00 61.98 58.39 3nn9 s VAL 204 Cb -0.12 -1.15 -0.04 0.00 -1.53 0.00 0.00 36.38 33.54 3nn9 s VAL 204 CO 0.02 0.39 0.27 -0.63 -3.33 0.00 0.00 175.10 171.81 3nn9 s ILE 205 N 0.24 5.25 -0.20 7.04 1.09 0.61 -2.60 121.20 132.62 3nn9 s ILE 205 Ca -0.07 0.30 -0.09 0.00 -1.10 0.00 0.00 60.65 59.69 3nn9 s ILE 205 Cb -0.13 -3.61 -0.04 0.00 -1.06 0.00 0.00 42.46 37.62 3nn9 s ILE 205 CO 0.03 0.19 0.10 0.26 -0.10 0.00 0.00 174.94 175.42 3nn9 s TRP 206 N 1.89 3.29 -0.02 3.97 0.52 -0.25 -0.80 118.94 127.53 3nn9 s TRP 206 Ca 0.10 0.13 0.03 0.00 0.02 0.00 0.00 56.10 56.38 3nn9 s TRP 206 Cb -0.16 -2.14 -0.00 0.00 -1.15 0.00 0.00 33.47 30.02 3nn9 s TRP 206 CO 0.11 0.13 -0.10 -0.47 0.02 0.00 0.00 176.95 176.64 3nn9 s TYR 207 N 0.58 1.01 -1.48 -1.98 5.04 -0.62 -0.90 117.35 119.01 3nn9 s TYR 207 Ca 0.05 -0.24 -0.07 0.00 -2.44 0.00 0.00 57.07 54.37 3nn9 s TYR 207 Cb -0.12 -0.70 0.05 0.00 0.35 0.00 0.00 41.96 41.54 3nn9 s TYR 207 CO 0.01 -0.08 0.69 -1.71 -1.34 0.00 0.00 175.55 173.12 3nn9 n ASN 208 N 3.13 -2.18 -0.90 4.32 5.15 -1.02 -2.14 115.26 121.61 3nn9 n ASN 208 Ca -0.17 -0.92 -0.12 0.00 -0.60 0.00 0.00 54.58 52.78 3nn9 n ASN 208 Cb 0.55 -3.40 -0.05 0.00 -0.53 0.00 0.00 39.78 36.35 3nn9 n ASN 208 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3nn9 n ARG 209 N -4.44 -1.47 -4.70 1.20 1.74 -1.26 -5.02 116.66 102.70 3nn9 n ARG 209 Ca -0.14 0.89 -0.26 0.00 -0.77 0.00 0.00 57.85 57.57 3nn9 n ARG 209 Cb 0.61 -5.20 -0.14 0.00 -1.02 0.00 0.00 32.46 26.70 3nn9 n ARG 209 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3nn9 s ARG 210 N -2.92 1.45 0.04 5.56 0.52 -0.91 -5.12 118.95 117.57 3nn9 s ARG 210 Ca 0.00 -0.92 -0.31 0.00 -0.52 0.00 0.00 55.73 53.98 3nn9 s ARG 210 Cb 0.00 -1.54 -0.07 0.00 0.52 0.00 0.00 34.95 33.86 3nn9 s ARG 210 CO 0.00 0.40 1.49 -1.25 0.02 0.00 0.00 175.30 175.96 3nn9 s PRO 211 N -1.09 4.26 0.05 3.54 0.05 -1.26 -1.58 135.00 138.96 3nn9 s PRO 211 Ca 0.08 2.12 -0.02 0.00 0.05 0.00 0.00 61.00 63.22 3nn9 s PRO 211 Cb -0.09 -3.53 -0.01 0.00 0.05 0.00 0.00 34.50 30.93 3nn9 s PRO 211 CO 0.01 -0.61 -0.04 0.28 0.05 0.00 0.00 177.00 176.69 3nn9 n VAL 212 N 4.58 0.99 -4.86 -0.36 0.31 0.02 -4.93 118.33 114.07 3nn9 n VAL 212 Ca 0.14 0.28 -0.29 0.00 -0.01 0.00 0.00 64.34 64.45 3nn9 n VAL 212 Cb 0.42 -1.64 -0.15 0.00 -0.91 0.00 0.00 33.84 31.57 3nn9 n VAL 212 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3nn9 s THR 213 N -2.09 2.06 0.05 2.52 2.01 -1.11 -4.98 115.64 114.10 3nn9 s THR 213 Ca -0.03 -1.36 0.06 0.00 0.31 0.00 0.00 61.69 60.66 3nn9 s THR 213 Cb 0.01 -1.77 -0.02 0.00 0.01 0.00 0.00 72.50 70.73 3nn9 s THR 213 CO 0.05 0.34 -0.16 -1.61 -0.69 0.00 0.00 174.62 172.54 3nn9 s GLU 214 N -1.24 1.04 -0.01 4.92 8.01 -1.26 -0.28 118.70 129.88 3nn9 s GLU 214 Ca 0.11 -0.84 0.05 0.00 0.01 0.00 0.00 54.97 54.30 3nn9 s GLU 214 Cb -0.10 -1.09 -0.01 0.00 -4.31 0.00 0.00 34.13 28.62 3nn9 s GLU 214 CO 0.02 0.27 -0.16 0.42 0.01 0.00 0.00 175.26 175.82 3nn9 s ILE 215 N -0.88 1.24 0.28 -1.63 1.01 0.37 -5.00 121.20 116.59 3nn9 s ILE 215 Ca 0.03 -0.68 0.08 0.00 0.00 0.00 0.00 60.65 60.08 3nn9 s ILE 215 Cb -0.08 -1.03 -0.04 0.00 0.01 0.00 0.00 42.46 41.32 3nn9 s ILE 215 CO 0.02 0.34 0.11 0.21 0.00 0.00 0.00 174.94 175.62 3nn9 s ASN 216 N -0.39 4.97 0.11 3.58 3.04 -1.26 -1.20 114.94 123.80 3nn9 s ASN 216 Ca 0.06 -0.51 -0.36 0.00 0.04 0.00 0.00 52.86 52.09 3nn9 s ASN 216 Cb -0.06 -1.04 -0.16 0.00 -1.54 0.00 0.00 41.25 38.45 3nn9 s ASN 216 CO -0.01 -0.08 1.42 1.07 -3.04 0.00 0.00 177.10 176.46 3nn9 n THR 217 N -1.07 0.01 -0.10 -5.21 5.66 -0.72 -4.93 114.28 107.92 3nn9 n THR 217 Ca -0.06 -0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.83 3nn9 n THR 217 Cb 0.59 -1.07 -0.16 0.00 -1.55 0.00 0.00 70.33 68.14 3nn9 n THR 217 CO 0.00 0.00 0.00 -2.67 -3.05 0.00 0.00 175.07 169.35 3nn9 n TRP 218 N 2.82 0.00 -0.21 1.09 2.14 -1.26 -4.64 117.44 117.38 3nn9 n TRP 218 Ca 0.18 0.00 0.03 0.00 2.07 0.00 0.00 57.50 59.78 3nn9 n TRP 218 Cb 0.23 -1.00 0.08 0.00 -0.81 0.00 0.00 31.31 29.80 3nn9 n TRP 218 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 3nn9 n ALA 219 N -2.78 2.13 -3.57 -1.67 0.00 -1.26 -5.02 120.51 108.33 3nn9 n ALA 219 Ca -0.34 -1.27 -0.26 0.00 0.00 0.00 0.00 53.44 51.57 3nn9 n ALA 219 Cb 1.15 -0.21 -0.00 0.00 0.00 0.00 0.00 19.45 20.38 3nn9 n ALA 219 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3nn9 n ARG 220 N -0.27 -3.62 -3.32 0.00 1.74 -1.26 -4.60 116.66 105.34 3nn9 n ARG 220 Ca 0.06 0.48 -0.09 0.00 -0.77 0.00 0.00 57.85 57.52 3nn9 n ARG 220 Cb 0.38 -5.21 -0.07 0.00 -1.02 0.00 0.00 32.46 26.54 3nn9 n ARG 220 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3nn9 s ASN 221 N -2.88 0.43 -0.35 0.55 3.04 -1.22 -3.93 114.94 110.58 3nn9 s ASN 221 Ca 0.49 -0.24 -0.24 0.00 0.04 0.00 0.00 52.86 52.90 3nn9 s ASN 221 Cb -0.26 1.07 0.04 0.00 -1.54 0.00 0.00 41.25 40.56 3nn9 s ASN 221 CO 0.60 -0.34 0.47 -0.38 -3.04 0.00 0.00 177.10 174.41 3nn9 n ILE 222 N 5.35 -2.64 -1.74 -5.21 5.41 -0.53 -1.61 119.36 118.39 3nn9 n ILE 222 Ca -0.01 0.04 -0.42 0.00 1.00 0.00 0.00 62.75 63.36 3nn9 n ILE 222 Cb 0.49 -2.41 -0.03 0.00 -0.71 0.00 0.00 39.64 36.99 3nn9 n ILE 222 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 3nn9 s LEU 223 N -2.05 4.13 0.28 1.39 2.96 -1.26 -4.56 118.68 119.56 3nn9 s LEU 223 Ca 0.24 2.32 0.02 0.00 -0.22 0.00 0.00 54.13 56.49 3nn9 s LEU 223 Cb -0.02 -3.53 -0.05 0.00 0.50 0.00 0.00 46.19 43.09 3nn9 s LEU 223 CO 0.62 -1.28 0.10 0.00 -1.32 0.00 0.00 176.35 174.47 3nn9 s ARG 224 N 4.90 1.49 0.00 1.98 1.04 -0.82 -4.93 118.95 122.60 3nn9 s ARG 224 Ca 0.88 -1.82 0.00 0.00 -1.04 0.00 0.00 55.73 53.75 3nn9 s ARG 224 Cb -0.37 -0.32 0.00 0.00 -2.04 0.00 0.00 34.95 32.21 3nn9 s ARG 224 CO 0.37 -0.32 0.00 -2.37 -0.04 0.00 0.00 175.30 172.95 3nn9 n THR 225 N -0.53 0.00 -0.09 4.99 5.66 -1.26 -2.32 114.28 120.73 3nn9 n THR 225 Ca -0.00 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.87 3nn9 n THR 225 Cb 0.66 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.40 3nn9 n THR 225 CO 0.00 0.00 0.00 1.56 -3.05 0.00 0.00 175.07 173.58 3nn9 h GLN 226 N 0.00 0.68 -3.17 1.09 4.20 -1.72 -3.39 115.11 112.80 3nn9 h GLN 226 Ca 0.00 -0.35 -0.26 0.00 0.06 0.00 0.00 58.65 58.10 3nn9 h GLN 226 Cb 0.00 0.01 0.05 0.00 0.30 0.00 0.00 27.48 27.84 3nn9 h GLN 226 CO 0.00 0.96 -0.39 0.39 -0.67 0.00 0.00 178.83 179.12 3nn9 n GLU 227 N -4.29 -3.42 -3.64 1.46 -0.58 0.16 -4.02 120.64 106.31 3nn9 n GLU 227 Ca -0.04 0.57 0.01 0.00 -0.42 0.00 0.00 57.16 57.28 3nn9 n GLU 227 Cb 0.46 -4.73 -0.01 0.00 -0.57 0.00 0.00 31.44 26.59 3nn9 n GLU 227 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3nn9 s SER 228 N -2.88 -0.08 0.55 1.62 1.04 -1.26 -4.70 113.70 108.00 3nn9 s SER 228 Ca 0.22 -0.18 -0.21 0.00 0.48 0.00 0.00 55.95 56.26 3nn9 s SER 228 Cb -0.10 0.22 -0.05 0.00 0.10 0.00 0.00 66.02 66.20 3nn9 s SER 228 CO 0.27 -0.41 1.26 -1.83 0.98 0.00 0.00 173.24 173.51 3nn9 s GLU 229 N -2.58 3.17 0.65 4.02 -1.05 -1.26 -4.22 118.70 117.43 3nn9 s GLU 229 Ca 0.14 1.98 -0.05 0.00 -0.15 0.00 0.00 54.97 56.89 3nn9 s GLU 229 Cb 0.04 -2.14 0.14 0.00 -0.44 0.00 0.00 34.13 31.72 3nn9 s GLU 229 CO -0.03 -1.09 0.89 0.00 0.95 0.00 0.00 175.26 175.98 3nn9 s VAL 231 N -2.74 -0.02 0.11 0.00 1.01 -1.26 -4.61 120.40 112.88 3nn9 s VAL 231 Ca 0.55 0.09 0.10 0.00 0.00 0.00 0.00 61.98 62.72 3nn9 s VAL 231 Cb -0.02 -0.10 -0.04 0.00 0.00 0.00 0.00 36.38 36.21 3nn9 s VAL 231 CO 0.38 0.04 -0.23 0.00 0.00 0.00 0.00 175.10 175.28 3nn9 s HIS 233 N -1.04 0.84 -1.03 0.00 2.46 -0.14 -4.65 115.29 111.73 3nn9 s HIS 233 Ca 0.15 -0.26 -0.09 0.00 0.47 0.00 0.00 55.06 55.33 3nn9 s HIS 233 Cb -0.10 -0.75 0.01 0.00 -0.13 0.00 0.00 32.58 31.61 3nn9 s HIS 233 CO 0.07 -0.23 0.17 -1.71 -2.47 0.00 0.00 174.74 170.56 3nn9 n ASN 234 N 4.21 -0.56 0.00 9.88 5.15 0.05 -0.76 115.26 133.24 3nn9 n ASN 234 Ca -0.22 -0.93 0.00 0.00 -0.60 0.00 0.00 54.58 52.83 3nn9 n ASN 234 Cb 0.51 -1.14 0.00 0.00 -0.53 0.00 0.00 39.78 38.62 3nn9 n ASN 234 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3nn9 n GLY 235 N -2.02 2.37 3.70 8.20 0.00 -1.26 -5.01 105.19 111.17 3nn9 n GLY 235 Ca -0.18 -0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.24 3nn9 n GLY 235 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3nn9 s VAL 236 N -0.94 4.99 -0.33 1.61 1.01 0.07 -4.33 120.40 122.47 3nn9 s VAL 236 Ca 0.00 1.53 0.01 0.00 0.00 0.00 0.00 61.98 63.52 3nn9 s VAL 236 Cb 0.00 -4.08 0.10 0.00 0.00 0.00 0.00 36.38 32.40 3nn9 s VAL 236 CO 0.00 0.18 0.10 0.00 0.00 0.00 0.00 175.10 175.38 3nn9 s PRO 238 N 1.28 4.33 -0.04 0.00 0.05 -1.25 -2.93 135.00 136.44 3nn9 s PRO 238 Ca 0.11 2.20 0.03 0.00 0.05 0.00 0.00 61.00 63.39 3nn9 s PRO 238 Cb -0.19 -3.12 0.00 0.00 0.05 0.00 0.00 34.50 31.24 3nn9 s PRO 238 CO -0.18 -0.29 -0.13 0.08 0.05 0.00 0.00 177.00 176.53 3nn9 s VAL 239 N -0.32 1.14 -0.04 -0.36 1.01 -0.03 -4.53 120.40 117.27 3nn9 s VAL 239 Ca 0.55 -0.53 -0.19 0.00 0.00 0.00 0.00 61.98 61.81 3nn9 s VAL 239 Cb -0.40 -1.01 -0.05 0.00 0.00 0.00 0.00 36.38 34.93 3nn9 s VAL 239 CO 0.45 0.34 0.52 -0.69 0.00 0.00 0.00 175.10 175.72 3nn9 s VAL 240 N 0.29 5.02 0.06 2.92 1.01 -1.26 -0.99 120.40 127.45 3nn9 s VAL 240 Ca -0.07 1.07 0.04 0.00 0.00 0.00 0.00 61.98 63.02 3nn9 s VAL 240 Cb -0.12 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 3nn9 s VAL 240 CO 0.02 0.42 -0.12 -0.36 0.00 0.00 0.00 175.10 175.06 3nn9 s PHE 241 N -0.08 1.00 -0.02 5.22 0.40 -0.89 -4.15 117.98 119.46 3nn9 s PHE 241 Ca 0.28 -0.48 0.05 0.00 -0.60 0.00 0.00 56.93 56.18 3nn9 s PHE 241 Cb -0.17 -0.57 -0.01 0.00 0.51 0.00 0.00 43.02 42.78 3nn9 s PHE 241 CO 0.14 0.00 -0.17 0.99 0.70 0.00 0.00 175.22 176.88 3nn9 s THR 242 N -1.34 1.38 -0.04 0.64 2.01 -0.98 -1.84 115.64 115.48 3nn9 s THR 242 Ca -0.05 -0.74 -0.01 0.00 0.31 0.00 0.00 61.69 61.20 3nn9 s THR 242 Cb -0.10 -1.16 0.03 0.00 0.01 0.00 0.00 72.50 71.29 3nn9 s THR 242 CO 0.01 0.39 0.07 -0.62 -0.69 0.00 0.00 174.62 173.79 3nn9 s ASP 243 N -0.33 0.42 0.00 3.53 -1.08 0.54 -1.94 116.67 117.81 3nn9 s ASP 243 Ca 0.05 0.12 0.00 0.00 -0.52 0.00 0.00 52.55 52.20 3nn9 s ASP 243 Cb -0.08 -0.02 0.00 0.00 -1.46 0.00 0.00 42.92 41.37 3nn9 s ASP 243 CO -0.00 -0.18 0.00 0.61 0.52 0.00 0.00 175.17 176.12 3nn9 n GLY 244 N 4.63 0.90 3.76 2.66 0.00 -0.63 0.06 105.19 116.57 3nn9 n GLY 244 Ca -0.18 -1.94 -0.38 0.00 0.00 0.00 0.00 46.02 43.52 3nn9 n GLY 244 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3nn9 s SER 245 N -4.00 5.72 -0.09 1.61 0.15 -1.26 -4.69 113.70 111.14 3nn9 s SER 245 Ca 0.00 2.54 0.18 0.00 0.70 0.00 0.00 55.95 59.37 3nn9 s SER 245 Cb 0.00 -2.62 0.67 0.00 -1.71 0.00 0.00 66.02 62.36 3nn9 s SER 245 CO 0.00 -1.25 1.58 0.00 1.20 0.00 0.00 173.24 174.77 3nn9 n ALA 246 N -0.76 2.87 -2.16 5.45 0.00 -1.26 -4.21 120.51 120.44 3nn9 n ALA 246 Ca 0.09 -1.55 -0.01 0.00 0.00 0.00 0.00 53.44 51.97 3nn9 n ALA 246 Cb 0.46 -0.93 -0.01 0.00 0.00 0.00 0.00 19.45 18.97 3nn9 n ALA 246 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3nn9 n THR 247 N 1.09 0.00 -4.03 0.00 -1.04 -1.26 -4.24 114.28 104.80 3nn9 n THR 247 Ca 0.24 -0.33 0.03 0.00 -2.04 0.00 0.00 64.05 61.96 3nn9 n THR 247 Cb 0.80 0.57 0.01 0.00 -1.82 0.00 0.00 70.33 69.89 3nn9 n THR 247 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3nn9 n GLY 248 N 0.16 0.17 3.64 3.41 0.00 -1.26 -4.97 105.19 106.34 3nn9 n GLY 248 Ca -0.05 -0.95 -0.45 0.00 0.00 0.00 0.00 46.02 44.56 3nn9 n GLY 248 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3nn9 n PRO 249 N -0.71 1.77 -4.57 1.61 -0.02 -1.26 -4.77 135.00 127.05 3nn9 n PRO 249 Ca 0.05 0.63 -0.26 0.00 -2.02 0.00 0.00 63.50 61.89 3nn9 n PRO 249 Cb 0.41 -2.20 -0.10 0.00 -0.02 0.00 0.00 33.50 31.59 3nn9 n PRO 249 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3nn9 s ALA 250 N -0.35 3.00 -0.39 3.55 0.00 -1.26 -4.15 121.76 122.17 3nn9 s ALA 250 Ca 0.66 -1.77 -0.11 0.00 0.00 0.00 0.00 51.96 50.75 3nn9 s ALA 250 Cb -0.69 0.40 0.04 0.00 0.00 0.00 0.00 23.12 22.87 3nn9 s ALA 250 CO 0.53 -0.20 0.23 -1.21 0.00 0.00 0.00 175.76 175.11 3nn9 s GLU 251 N -3.80 2.79 -0.09 0.00 2.02 0.11 -4.96 118.70 114.76 3nn9 s GLU 251 Ca 0.29 -1.17 -0.02 0.00 0.02 0.00 0.00 54.97 54.10 3nn9 s GLU 251 Cb 0.07 -3.77 -0.03 0.00 0.10 0.00 0.00 34.13 30.50 3nn9 s GLU 251 CO 0.14 -0.77 0.00 0.99 0.02 0.00 0.00 175.26 175.65 3nn9 s THR 252 N 1.54 4.31 0.02 3.63 2.01 -1.26 -0.34 115.64 125.55 3nn9 s THR 252 Ca 0.02 -0.25 0.04 0.00 0.31 0.00 0.00 61.69 61.82 3nn9 s THR 252 Cb -0.20 -2.81 -0.02 0.00 0.01 0.00 0.00 72.50 69.48 3nn9 s THR 252 CO 0.06 0.60 -0.13 -0.13 -0.69 0.00 0.00 174.62 174.33 3nn9 s ARG 253 N -0.80 0.89 -0.31 4.92 0.52 -0.76 -1.58 118.95 121.82 3nn9 s ARG 253 Ca 0.12 -0.65 -0.07 0.00 -0.52 0.00 0.00 55.73 54.61 3nn9 s ARG 253 Cb -0.11 -0.87 0.01 0.00 0.52 0.00 0.00 34.95 34.49 3nn9 s ARG 253 CO 0.02 0.22 0.10 0.42 0.02 0.00 0.00 175.30 176.08 3nn9 s ILE 254 N -0.70 4.05 -0.09 1.52 1.09 0.61 -2.09 121.20 125.59 3nn9 s ILE 254 Ca 0.02 -0.74 -0.15 0.00 -1.10 0.00 0.00 60.65 58.68 3nn9 s ILE 254 Cb -0.07 -3.12 -0.05 0.00 -1.06 0.00 0.00 42.46 38.16 3nn9 s ILE 254 CO 0.01 0.02 0.37 -0.31 -0.10 0.00 0.00 174.94 174.92 3nn9 s TYR 255 N 1.50 3.58 -0.30 3.97 1.51 -0.16 -1.29 117.35 126.16 3nn9 s TYR 255 Ca 0.02 0.80 -0.09 0.00 -1.01 0.00 0.00 57.07 56.79 3nn9 s TYR 255 Cb -0.18 -2.34 -0.01 0.00 -0.11 0.00 0.00 41.96 39.32 3nn9 s TYR 255 CO 0.03 0.40 0.15 0.71 -1.11 0.00 0.00 175.55 175.73 3nn9 s TYR 256 N -0.14 3.17 -0.01 2.71 1.51 -0.87 -0.85 117.35 122.87 3nn9 s TYR 256 Ca 0.21 -0.53 -0.01 0.00 -1.01 0.00 0.00 57.07 55.73 3nn9 s TYR 256 Cb -0.15 -2.34 -0.04 0.00 -0.11 0.00 0.00 41.96 39.32 3nn9 s TYR 256 CO 0.09 -0.43 0.09 -0.06 -1.11 0.00 0.00 175.55 174.12 3nn9 s PHE 257 N 1.62 3.33 -0.12 2.71 0.08 -1.15 -0.63 117.98 123.82 3nn9 s PHE 257 Ca 0.05 0.24 -0.04 0.00 0.12 0.00 0.00 56.93 57.30 3nn9 s PHE 257 Cb -0.17 -1.76 0.06 0.00 -0.57 0.00 0.00 43.02 40.58 3nn9 s PHE 257 CO 0.06 0.57 0.20 0.21 -0.10 0.00 0.00 175.22 176.16 3nn9 s LYS 258 N -1.68 0.09 -1.45 0.44 2.20 -0.10 -0.72 119.74 118.51 3nn9 s LYS 258 Ca 0.22 0.55 -0.07 0.00 -0.36 0.00 0.00 55.97 56.31 3nn9 s LYS 258 Cb -0.12 -0.37 0.05 0.00 -1.51 0.00 0.00 37.83 35.87 3nn9 s LYS 258 CO 0.13 -0.36 0.75 0.39 -0.36 0.00 0.00 175.35 175.91 3nn9 n GLU 259 N 5.33 -4.61 0.00 4.03 1.02 -1.26 -2.26 120.64 122.89 3nn9 n GLU 259 Ca -0.05 0.54 0.00 0.00 -0.02 0.00 0.00 57.16 57.63 3nn9 n GLU 259 Cb 0.50 -5.15 0.00 0.00 -0.02 0.00 0.00 31.44 26.77 3nn9 n GLU 259 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3nn9 n GLY 260 N -1.68 2.35 3.72 0.62 0.00 -1.26 -4.95 105.19 103.99 3nn9 n GLY 260 Ca -0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 3nn9 n GLY 260 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3nn9 s LYS 261 N -0.65 3.24 -0.04 1.61 2.20 -0.96 -4.22 119.74 120.93 3nn9 s LYS 261 Ca 0.00 -0.33 -0.30 0.00 -0.36 0.00 0.00 55.97 54.98 3nn9 s LYS 261 Cb 0.00 -2.95 -0.04 0.00 -1.51 0.00 0.00 37.83 33.33 3nn9 s LYS 261 CO 0.00 0.66 1.25 0.42 -0.36 0.00 0.00 175.35 177.32 3nn9 s ILE 262 N -0.73 4.11 -0.18 5.43 1.01 -1.26 -0.92 121.20 128.66 3nn9 s ILE 262 Ca 0.12 1.45 -0.12 0.00 0.00 0.00 0.00 60.65 62.11 3nn9 s ILE 262 Cb -0.12 -3.94 -0.21 0.00 0.01 0.00 0.00 42.46 38.20 3nn9 s ILE 262 CO 0.02 0.00 0.18 0.18 0.00 0.00 0.00 174.94 175.32 3nn9 n LEU 263 N 5.21 2.34 -3.77 2.97 4.77 0.20 -4.93 117.00 123.78 3nn9 n LEU 263 Ca 0.11 0.26 -0.04 0.00 -0.03 0.00 0.00 56.01 56.32 3nn9 n LEU 263 Cb 0.46 -1.02 -0.01 0.00 -2.33 0.00 0.00 43.42 40.52 3nn9 n LEU 263 CO 0.56 0.64 0.72 -0.75 -1.33 0.00 0.00 177.39 177.23 3nn9 s LYS 264 N -2.48 1.24 0.09 3.23 2.20 -1.24 -5.04 119.74 117.75 3nn9 s LYS 264 Ca -0.28 -0.71 -0.17 0.00 -0.36 0.00 0.00 55.97 54.46 3nn9 s LYS 264 Cb 0.07 0.41 0.04 0.00 -1.51 0.00 0.00 37.83 36.84 3nn9 s LYS 264 CO 0.66 -0.57 0.42 1.67 -0.36 0.00 0.00 175.35 177.17 3nn9 s TRP 265 N -3.14 -0.25 0.07 4.03 1.48 -1.26 -2.05 118.94 117.82 3nn9 s TRP 265 Ca 0.13 0.05 0.02 0.00 -1.06 0.00 0.00 56.10 55.24 3nn9 s TRP 265 Cb -0.02 0.26 -0.03 0.00 -1.16 0.00 0.00 33.47 32.52 3nn9 s TRP 265 CO 0.03 -0.66 -0.07 -1.21 -4.06 0.00 0.00 176.95 170.98 3nn9 s GLU 266 N -3.27 0.67 0.55 3.25 2.02 -0.41 -4.98 118.70 116.53 3nn9 s GLU 266 Ca -0.00 -1.02 -0.16 0.00 0.02 0.00 0.00 54.97 53.81 3nn9 s GLU 266 Cb 0.01 -0.26 -0.06 0.00 0.10 0.00 0.00 34.13 33.92 3nn9 s GLU 266 CO -0.08 0.02 1.02 -1.25 0.02 0.00 0.00 175.26 174.99 3nn9 s PRO 267 N -2.60 3.68 0.33 0.39 0.04 -1.26 -0.28 135.00 135.30 3nn9 s PRO 267 Ca -0.00 1.03 -0.29 0.00 0.04 0.00 0.00 61.00 61.78 3nn9 s PRO 267 Cb -0.03 -2.09 -0.12 0.00 0.04 0.00 0.00 34.50 32.30 3nn9 s PRO 267 CO -0.02 -0.50 1.50 -0.11 0.04 0.00 0.00 177.00 177.91 3nn9 n LEU 268 N -1.86 4.36 -4.08 -3.56 -0.00 -0.62 -4.85 117.00 106.40 3nn9 n LEU 268 Ca 0.07 1.19 -0.08 0.00 -0.00 0.00 0.00 56.01 57.19 3nn9 n LEU 268 Cb 0.54 -1.58 -0.10 0.00 -0.00 0.00 0.00 43.42 42.27 3nn9 n LEU 268 CO 0.48 0.04 -0.36 0.00 -0.00 0.00 0.00 177.39 177.54 3nn9 s ALA 269 N -0.63 0.49 0.00 1.96 0.00 -1.26 -5.03 121.76 117.29 3nn9 s ALA 269 Ca 0.58 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 51.45 3nn9 s ALA 269 Cb -0.51 0.23 0.00 0.00 0.00 0.00 0.00 23.12 22.84 3nn9 s ALA 269 CO 0.57 -0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.44 3nn9 n GLY 270 N 0.43 -0.59 0.80 0.00 0.00 -1.26 -3.20 105.19 101.37 3nn9 n GLY 270 Ca -0.16 -2.18 0.09 0.00 0.00 0.00 0.00 46.02 43.78 3nn9 n GLY 270 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3nn9 n THR 271 N 0.00 0.45 -2.30 2.61 -2.24 -0.82 -4.88 114.28 107.09 3nn9 n THR 271 Ca 0.00 -0.55 -0.42 0.00 -2.27 0.00 0.00 64.05 60.81 3nn9 n THR 271 Cb 0.00 0.46 -0.03 0.00 -2.10 0.00 0.00 70.33 68.66 3nn9 n THR 271 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3nn9 s ALA 272 N -1.55 3.51 0.10 6.98 0.00 -1.26 -4.76 121.76 124.78 3nn9 s ALA 272 Ca 0.33 0.92 0.11 0.00 0.00 0.00 0.00 51.96 53.31 3nn9 s ALA 272 Cb 0.18 -3.52 0.07 0.00 0.00 0.00 0.00 23.12 19.85 3nn9 s ALA 272 CO 0.25 -0.63 1.43 0.87 0.00 0.00 0.00 175.76 177.68 3nn9 h LYS 273 N 7.12 0.00 -2.25 0.00 1.57 -1.93 -3.47 116.57 117.60 3nn9 h LYS 273 Ca -0.40 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.35 3nn9 h LYS 273 Cb 1.20 0.00 -0.23 0.00 0.08 0.00 0.00 32.23 33.28 3nn9 h LYS 273 CO 0.86 0.74 -0.13 -1.58 -0.57 0.00 0.00 179.45 178.77 3nn9 s HIS 274 N -3.05 -0.92 -0.04 -1.35 5.04 -1.26 -4.78 115.29 108.93 3nn9 s HIS 274 Ca 0.01 1.83 0.07 0.00 -1.54 0.00 0.00 55.06 55.43 3nn9 s HIS 274 Cb 0.10 0.51 -0.02 0.00 0.04 0.00 0.00 32.58 33.21 3nn9 s HIS 274 CO 0.78 -0.48 -0.24 0.42 -2.34 0.00 0.00 174.74 172.88 3nn9 s ILE 275 N 1.77 2.21 -0.10 0.89 -1.09 -1.26 -3.74 121.20 119.88 3nn9 s ILE 275 Ca -0.09 -1.03 -0.14 0.00 -2.23 0.00 0.00 60.65 57.16 3nn9 s ILE 275 Cb -0.07 -1.79 0.03 0.00 -1.58 0.00 0.00 42.46 39.05 3nn9 s ILE 275 CO -0.17 0.58 0.36 -0.70 -1.23 0.00 0.00 174.94 173.78 3nn9 s GLU 276 N -0.46 0.52 -1.28 2.79 2.56 -0.39 -4.80 118.70 117.63 3nn9 s GLU 276 Ca 0.05 0.30 -0.12 0.00 0.00 0.00 0.00 54.97 55.20 3nn9 s GLU 276 Cb -0.11 0.25 0.00 0.00 2.00 0.00 0.00 34.13 36.26 3nn9 s GLU 276 CO 0.01 -0.10 0.58 0.39 -0.56 0.00 0.00 175.26 175.58 3nn9 n GLU 277 N 2.35 -2.05 -1.80 4.30 1.02 -1.26 -0.51 120.64 122.68 3nn9 n GLU 277 Ca -0.16 0.37 -0.42 0.00 -0.02 0.00 0.00 57.16 56.94 3nn9 n GLU 277 Cb 0.57 -4.10 -0.02 0.00 -0.02 0.00 0.00 31.44 27.87 3nn9 n GLU 277 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3nn9 s SER 279 N 0.57 3.89 0.25 0.00 0.01 0.06 -4.64 113.70 113.84 3nn9 s SER 279 Ca 0.64 -0.55 0.09 0.00 1.31 0.00 0.00 55.95 57.45 3nn9 s SER 279 Cb -0.47 -1.64 -0.05 0.00 0.21 0.00 0.00 66.02 64.07 3nn9 s SER 279 CO 0.45 -0.03 -0.15 0.00 0.41 0.00 0.00 173.24 173.92 3nn9 s TYR 281 N -2.76 0.02 0.03 0.00 1.13 -0.37 -4.58 117.35 110.81 3nn9 s TYR 281 Ca 0.27 -0.42 -0.07 0.00 -1.41 0.00 0.00 57.07 55.44 3nn9 s TYR 281 Cb -0.02 0.46 -0.01 0.00 -1.10 0.00 0.00 41.96 41.30 3nn9 s TYR 281 CO 0.11 -1.09 0.12 0.20 -2.51 0.00 0.00 175.55 172.39 3nn9 s GLY 282 N -2.95 0.11 0.05 5.49 0.00 -1.26 -0.89 107.32 107.87 3nn9 s GLY 282 Ca 0.15 -0.39 -0.19 0.00 0.00 0.00 0.00 44.72 44.29 3nn9 s GLY 282 CO 0.06 -0.54 0.44 -1.83 0.00 0.00 0.00 173.10 171.23 3nn9 s GLU 283 N -2.26 0.95 -0.56 2.90 4.04 -1.08 -5.00 118.70 117.70 3nn9 s GLU 283 Ca -0.08 -0.34 -0.10 0.00 0.04 0.00 0.00 54.97 54.48 3nn9 s GLU 283 Cb -0.03 0.43 0.01 0.00 0.02 0.00 0.00 34.13 34.56 3nn9 s GLU 283 CO -0.03 -0.33 0.20 0.54 -1.84 0.00 0.00 175.26 173.80 3nn9 n ARG 284 N 0.46 -0.78 -2.85 -4.83 1.74 -0.19 -2.03 116.66 108.17 3nn9 n ARG 284 Ca -0.18 -0.18 -0.19 0.00 -0.77 0.00 0.00 57.85 56.52 3nn9 n ARG 284 Cb 0.60 -0.79 0.00 0.00 -1.02 0.00 0.00 32.46 31.25 3nn9 n ARG 284 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3nn9 n ALA 285 N -2.63 -0.89 -3.01 7.54 0.00 -0.28 -5.01 120.51 116.23 3nn9 n ALA 285 Ca -0.08 0.15 -0.21 0.00 0.00 0.00 0.00 53.44 53.30 3nn9 n ALA 285 Cb 0.25 -2.51 -0.15 0.00 0.00 0.00 0.00 19.45 17.04 3nn9 n ALA 285 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3nn9 s GLU 286 N -5.48 1.03 -0.17 0.00 2.12 -0.86 -4.40 118.70 110.93 3nn9 s GLU 286 Ca 0.19 -0.33 -0.06 0.00 0.36 0.00 0.00 54.97 55.13 3nn9 s GLU 286 Cb -0.09 -0.95 -0.03 0.00 0.26 0.00 0.00 34.13 33.31 3nn9 s GLU 286 CO 0.23 0.13 0.01 0.42 -0.54 0.00 0.00 175.26 175.52 3nn9 s ILE 287 N 0.17 4.33 -0.08 -3.70 1.01 -0.14 -2.63 121.20 120.16 3nn9 s ILE 287 Ca -0.03 -0.20 0.05 0.00 0.00 0.00 0.00 60.65 60.47 3nn9 s ILE 287 Cb -0.09 -2.93 -0.01 0.00 0.01 0.00 0.00 42.46 39.45 3nn9 s ILE 287 CO 0.01 0.47 -0.24 -0.89 0.00 0.00 0.00 174.94 174.29 3nn9 s THR 288 N 0.44 2.15 -0.09 2.92 2.01 -0.07 -0.56 115.64 122.43 3nn9 s THR 288 Ca -0.00 -1.02 0.03 0.00 0.31 0.00 0.00 61.69 61.01 3nn9 s THR 288 Cb -0.13 -1.80 0.01 0.00 0.01 0.00 0.00 72.50 70.58 3nn9 s THR 288 CO 0.02 0.56 -0.19 0.00 -0.69 0.00 0.00 174.62 174.32 3nn9 s THR 290 N 0.56 3.59 0.17 0.00 2.01 0.12 -1.69 115.64 120.40 3nn9 s THR 290 Ca -0.15 -0.46 0.01 0.00 0.31 0.00 0.00 61.69 61.40 3nn9 s THR 290 Cb -0.17 -2.57 -0.00 0.00 0.01 0.00 0.00 72.50 69.77 3nn9 s THR 290 CO 0.05 0.49 0.03 0.00 -0.69 0.00 0.00 174.62 174.50 3nn9 s ARG 292 N -2.62 2.27 -0.44 0.00 3.52 0.33 -4.01 118.95 117.99 3nn9 s ARG 292 Ca 0.04 -0.74 -0.27 0.00 -0.13 0.00 0.00 55.73 54.63 3nn9 s ARG 292 Cb 0.00 -2.32 0.03 0.00 -1.56 0.00 0.00 34.95 31.10 3nn9 s ARG 292 CO 0.03 -0.33 1.03 0.34 -0.81 0.00 0.00 175.30 175.56 3nn9 s ASP 293 N 1.41 6.63 0.15 -2.12 -1.08 -1.25 -1.27 116.67 119.16 3nn9 s ASP 293 Ca 0.02 0.44 0.04 0.00 -0.52 0.00 0.00 52.55 52.53 3nn9 s ASP 293 Cb -0.14 -2.50 -0.06 0.00 -1.46 0.00 0.00 42.92 38.75 3nn9 s ASP 293 CO -0.10 -1.08 1.35 -1.13 0.52 0.00 0.00 175.17 174.73 3nn9 h ASN 294 N 8.93 0.16 0.57 -0.34 -0.73 -1.86 -3.37 115.58 118.93 3nn9 h ASN 294 Ca -0.23 -0.14 -0.03 0.00 1.87 0.00 0.00 56.30 57.77 3nn9 h ASN 294 Cb 1.07 -0.05 -0.00 0.00 0.27 0.00 0.00 38.32 39.61 3nn9 h ASN 294 CO 1.06 1.00 -0.33 -0.25 -0.37 0.00 0.00 177.43 178.54 3nn9 h TRP 295 N 0.05 -0.88 0.00 0.67 7.01 -1.89 -1.90 115.95 119.02 3nn9 h TRP 295 Ca -0.04 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.95 3nn9 h TRP 295 Cb 1.60 0.31 0.00 0.00 -2.10 0.00 0.00 29.16 28.96 3nn9 h TRP 295 CO 0.02 -0.50 -0.08 0.00 -2.79 0.00 0.00 178.44 175.09 3nn9 n GLN 296 N -4.44 0.00 -4.76 2.65 10.64 -1.26 -0.84 117.38 119.36 3nn9 n GLN 296 Ca -0.10 -0.39 -0.33 0.00 -1.83 0.00 0.00 57.00 54.34 3nn9 n GLN 296 Cb 0.34 -0.32 -0.14 0.00 -0.86 0.00 0.00 30.24 29.27 3nn9 n GLN 296 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 3nn9 s GLY 297 N -0.15 1.56 0.00 2.61 0.00 -1.26 -4.30 107.32 105.78 3nn9 s GLY 297 Ca 0.00 -0.90 0.24 0.00 0.00 0.00 0.00 44.72 44.07 3nn9 s GLY 297 CO 0.00 -0.27 1.31 1.44 0.00 0.00 0.00 173.10 175.58 3nn9 n SER 298 N 3.32 2.49 -4.96 1.64 7.64 -0.99 -4.67 113.62 118.09 3nn9 n SER 298 Ca -0.18 -1.78 -0.22 0.00 1.01 0.00 0.00 58.87 57.70 3nn9 n SER 298 Cb 0.53 0.10 -0.02 0.00 -1.01 0.00 0.00 64.21 63.81 3nn9 n SER 298 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3nn9 s ASN 299 N -2.12 6.32 -0.07 6.43 4.22 -1.26 -1.97 114.94 126.49 3nn9 s ASN 299 Ca 0.27 0.19 0.01 0.00 -2.14 0.00 0.00 52.86 51.20 3nn9 s ASN 299 Cb 0.20 -1.92 -0.03 0.00 1.28 0.00 0.00 41.25 40.78 3nn9 s ASN 299 CO 0.37 -0.13 -0.07 -0.13 -2.04 0.00 0.00 177.10 175.10 3nn9 s ARG 300 N -4.02 2.75 0.49 3.55 0.52 -1.26 -4.74 118.95 116.24 3nn9 s ARG 300 Ca 0.36 -0.55 -0.23 0.00 -0.52 0.00 0.00 55.73 54.78 3nn9 s ARG 300 Cb -0.09 -2.59 -0.07 0.00 0.52 0.00 0.00 34.95 32.72 3nn9 s ARG 300 CO 0.31 0.66 1.29 -2.14 0.02 0.00 0.00 175.30 175.44 3nn9 s PRO 301 N -0.79 3.52 -0.01 3.54 0.02 -1.26 -1.40 135.00 138.63 3nn9 s PRO 301 Ca 0.12 2.09 0.02 0.00 0.02 0.00 0.00 61.00 63.25 3nn9 s PRO 301 Cb -0.11 -2.42 -0.00 0.00 0.02 0.00 0.00 34.50 31.99 3nn9 s PRO 301 CO 0.01 -0.84 -0.07 0.08 -0.33 0.00 0.00 177.00 175.86 3nn9 s VAL 302 N -1.36 0.56 -0.17 3.83 1.01 -0.37 -1.43 120.40 122.47 3nn9 s VAL 302 Ca 0.66 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 62.34 3nn9 s VAL 302 Cb -0.37 -0.49 -0.01 0.00 0.00 0.00 0.00 36.38 35.52 3nn9 s VAL 302 CO 0.45 0.17 -0.11 -0.63 0.00 0.00 0.00 175.10 174.98 3nn9 s ILE 303 N -0.01 3.01 -0.16 2.22 1.01 -0.68 -1.28 121.20 125.30 3nn9 s ILE 303 Ca 0.01 -0.64 -0.07 0.00 0.00 0.00 0.00 60.65 59.94 3nn9 s ILE 303 Cb -0.05 -2.31 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 3nn9 s ILE 303 CO -0.00 0.49 0.07 -0.13 0.00 0.00 0.00 174.94 175.37 3nn9 s ARG 304 N 0.92 3.81 -0.01 2.79 0.52 -0.06 -2.18 118.95 124.74 3nn9 s ARG 304 Ca -0.02 -0.31 0.07 0.00 -0.52 0.00 0.00 55.73 54.95 3nn9 s ARG 304 Cb -0.15 -3.18 -0.02 0.00 0.52 0.00 0.00 34.95 32.12 3nn9 s ARG 304 CO -0.01 0.40 -0.24 0.42 0.02 0.00 0.00 175.30 175.89 3nn9 s ILE 305 N 0.03 1.88 -0.41 1.52 1.01 0.28 -1.05 121.20 124.44 3nn9 s ILE 305 Ca 0.06 -1.05 -0.08 0.00 0.00 0.00 0.00 60.65 59.58 3nn9 s ILE 305 Cb -0.12 -1.57 0.08 0.00 0.01 0.00 0.00 42.46 40.87 3nn9 s ILE 305 CO 0.01 0.50 0.24 -0.62 0.00 0.00 0.00 174.94 175.06 3nn9 s ASP 306 N -0.64 5.53 0.50 3.58 -1.08 -0.32 -0.96 116.67 123.28 3nn9 s ASP 306 Ca 0.09 -1.59 0.34 0.00 -0.52 0.00 0.00 52.55 50.87 3nn9 s ASP 306 Cb -0.09 -1.95 1.64 0.00 -1.46 0.00 0.00 42.92 41.07 3nn9 s ASP 306 CO -0.01 -0.53 2.02 1.55 0.52 0.00 0.00 175.17 178.73 3nn9 h PRO 307 N 8.33 0.00 0.00 4.34 0.13 -1.85 0.37 132.00 143.32 3nn9 h PRO 307 Ca -0.21 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.82 3nn9 h PRO 307 Cb 1.08 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.19 3nn9 h PRO 307 CO 0.74 0.00 -0.68 0.28 -0.23 0.00 0.00 178.00 178.11 3nn9 h VAL 308 N 0.00 0.75 0.00 1.56 2.07 -1.95 -3.31 116.25 115.37 3nn9 h VAL 308 Ca 0.00 -1.78 0.00 0.00 0.82 0.00 0.00 66.70 65.74 3nn9 h VAL 308 Cb 0.22 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 3nn9 h VAL 308 CO 0.00 0.25 0.00 0.00 0.02 0.00 0.00 177.57 177.84 3nn9 h ALA 309 N -0.59 1.00 -5.66 1.67 0.00 -1.98 -3.47 119.26 110.23 3nn9 h ALA 309 Ca -0.15 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.45 3nn9 h ALA 309 Cb 0.89 0.00 0.16 0.00 0.00 0.00 0.00 17.79 18.84 3nn9 h ALA 309 CO -0.09 0.00 -0.84 -1.33 0.00 0.00 0.00 179.25 176.99 3nn9 n MET 310 N -3.02 -3.64 -4.28 0.00 0.00 0.13 -5.03 117.12 101.27 3nn9 n MET 310 Ca 0.02 0.79 -0.15 0.00 0.00 0.00 0.00 57.70 58.36 3nn9 n MET 310 Cb 0.37 -5.59 -0.10 0.00 0.00 0.00 0.00 33.22 27.89 3nn9 n MET 310 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 3nn9 s THR 311 N -3.42 0.43 0.24 2.03 2.01 -1.07 -4.98 115.64 110.87 3nn9 s THR 311 Ca 0.28 -2.00 -0.12 0.00 0.31 0.00 0.00 61.69 60.17 3nn9 s THR 311 Cb -0.05 -2.54 -0.01 0.00 0.01 0.00 0.00 72.50 69.92 3nn9 s THR 311 CO 0.76 -0.06 0.45 -1.38 -0.69 0.00 0.00 174.62 173.70 3nn9 s HIS 312 N -3.85 0.40 0.17 4.92 -3.43 -1.26 -1.17 115.29 111.08 3nn9 s HIS 312 Ca 0.36 -0.75 -0.11 0.00 -0.80 0.00 0.00 55.06 53.76 3nn9 s HIS 312 Cb 0.07 0.14 -0.00 0.00 -1.43 0.00 0.00 32.58 31.36 3nn9 s HIS 312 CO 0.12 -0.96 0.34 0.95 -2.00 0.00 0.00 174.74 173.19 3nn9 s THR 313 N -4.02 0.05 0.02 -5.38 -4.23 -0.22 -4.91 115.64 96.95 3nn9 s THR 313 Ca 0.23 -1.28 -0.04 0.00 -1.18 0.00 0.00 61.69 59.42 3nn9 s THR 313 Cb -0.00 -1.81 -0.01 0.00 1.34 0.00 0.00 72.50 72.02 3nn9 s THR 313 CO 0.09 -0.25 0.07 -0.94 -0.54 0.00 0.00 174.62 173.05 3nn9 s SER 314 N -2.95 0.14 0.00 3.99 1.04 -1.19 -0.88 113.70 113.84 3nn9 s SER 314 Ca 0.16 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.20 3nn9 s SER 314 Cb 0.02 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.32 3nn9 s SER 314 CO -0.00 -0.38 0.00 1.67 0.98 0.00 0.00 173.24 175.51 3nn9 n GLN 315 N 1.33 0.00 -4.48 4.02 7.27 -0.41 -1.95 117.38 123.17 3nn9 n GLN 315 Ca -0.22 0.00 -0.24 0.00 0.07 0.00 0.00 57.00 56.61 3nn9 n GLN 315 Cb 0.56 0.00 -0.10 0.00 2.41 0.00 0.00 30.24 33.11 3nn9 n GLN 315 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 3nn9 s TYR 316 N -5.75 2.21 -0.06 3.69 1.51 -0.66 -1.23 117.35 117.05 3nn9 s TYR 316 Ca 0.00 -0.50 -0.30 0.00 -1.01 0.00 0.00 57.07 55.27 3nn9 s TYR 316 Cb 0.00 -1.15 -0.02 0.00 -0.11 0.00 0.00 41.96 40.68 3nn9 s TYR 316 CO 0.00 0.54 1.04 0.42 -1.11 0.00 0.00 175.55 176.44 3nn9 s ILE 317 N -2.70 4.68 0.28 2.71 1.01 -0.49 -4.72 121.20 121.97 3nn9 s ILE 317 Ca 0.30 1.94 -0.01 0.00 0.00 0.00 0.00 60.65 62.88 3nn9 s ILE 317 Cb 0.00 -4.25 0.16 0.00 0.01 0.00 0.00 42.46 38.38 3nn9 s ILE 317 CO 0.14 0.05 1.83 0.00 0.00 0.00 0.00 174.94 176.96 3nn9 n SER 319 N -4.28 0.42 0.16 0.00 2.88 0.76 -2.61 113.62 110.94 3nn9 n SER 319 Ca 0.04 1.01 0.13 0.00 -1.33 0.00 0.00 58.87 58.72 3nn9 n SER 319 Cb 0.22 -1.25 0.46 0.00 -0.75 0.00 0.00 64.21 62.89 3nn9 n SER 319 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3nn9 h PRO 320 N 1.31 0.00 -6.32 -1.46 0.11 -1.76 -3.43 132.00 120.45 3nn9 h PRO 320 Ca -0.42 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.12 3nn9 h PRO 320 Cb 1.36 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.44 3nn9 h PRO 320 CO 0.55 0.00 1.23 0.08 -0.21 0.00 0.00 178.00 179.66 3nn9 s VAL 321 N -3.29 3.56 -0.12 3.15 1.01 -1.26 -4.01 120.40 119.44 3nn9 s VAL 321 Ca 0.06 0.56 -0.17 0.00 0.00 0.00 0.00 61.98 62.43 3nn9 s VAL 321 Cb 0.10 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.66 3nn9 s VAL 321 CO 0.51 -0.51 0.44 -0.76 0.00 0.00 0.00 175.10 174.78 3nn9 s LEU 322 N 6.65 4.29 -0.05 3.92 1.43 -1.26 -5.00 118.68 128.65 3nn9 s LEU 322 Ca 0.75 0.77 0.09 0.00 -1.03 0.00 0.00 54.13 54.70 3nn9 s LEU 322 Cb -0.20 -2.62 0.18 0.00 0.03 0.00 0.00 46.19 43.57 3nn9 s LEU 322 CO 0.33 0.05 1.12 0.35 0.23 0.00 0.00 176.35 178.42 3nn9 n THR 323 N 3.51 1.38 -2.46 5.49 -2.24 -1.18 -4.99 114.28 113.79 3nn9 n THR 323 Ca -0.09 -1.45 -0.25 0.00 -2.27 0.00 0.00 64.05 60.00 3nn9 n THR 323 Cb 0.52 0.22 0.13 0.00 -2.10 0.00 0.00 70.33 69.09 3nn9 n THR 323 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3nn9 s ASP 324 N -1.63 4.07 -0.22 3.42 -1.08 -0.83 -4.68 116.67 115.71 3nn9 s ASP 324 Ca 0.16 -0.26 -0.13 0.00 -0.52 0.00 0.00 52.55 51.81 3nn9 s ASP 324 Cb 0.13 -0.03 0.07 0.00 -1.46 0.00 0.00 42.92 41.62 3nn9 s ASP 324 CO 0.04 -2.06 0.55 0.21 0.52 0.00 0.00 175.17 174.43 3nn9 s ASN 325 N -4.78 -0.73 0.79 -0.34 3.84 -1.26 -4.38 114.94 108.08 3nn9 s ASN 325 Ca 0.68 1.20 -0.11 0.00 0.21 0.00 0.00 52.86 54.85 3nn9 s ASN 325 Cb -0.05 1.08 0.07 0.00 -0.55 0.00 0.00 41.25 41.80 3nn9 s ASN 325 CO 0.46 -0.22 1.09 -2.16 -2.79 0.00 0.00 177.10 173.48 3nn9 s PRO 326 N 1.48 2.11 0.01 0.43 0.04 -1.26 -3.45 135.00 134.36 3nn9 s PRO 326 Ca -0.09 1.06 -0.19 0.00 0.04 0.00 0.00 61.00 61.81 3nn9 s PRO 326 Cb -0.07 -1.89 0.04 0.00 0.04 0.00 0.00 34.50 32.62 3nn9 s PRO 326 CO -0.16 -1.71 0.42 -0.98 0.04 0.00 0.00 177.00 174.61 3nn9 s ARG 327 N -4.93 0.86 0.79 4.56 1.70 -0.16 -4.88 118.95 116.89 3nn9 s ARG 327 Ca 0.61 -0.21 -0.11 0.00 -0.47 0.00 0.00 55.73 55.55 3nn9 s ARG 327 Cb -0.17 0.39 0.07 0.00 -0.57 0.00 0.00 34.95 34.67 3nn9 s ARG 327 CO 0.56 -0.28 1.09 -1.25 -1.08 0.00 0.00 175.30 174.34 3nn9 s PRO 328 N -1.92 2.11 0.68 3.89 0.04 -1.26 -4.72 135.00 133.82 3nn9 s PRO 328 Ca -0.09 1.01 -0.17 0.00 0.04 0.00 0.00 61.00 61.80 3nn9 s PRO 328 Cb -0.02 -1.89 -0.01 0.00 0.04 0.00 0.00 34.50 32.61 3nn9 s PRO 328 CO 0.02 -1.70 0.96 -0.25 0.04 0.00 0.00 177.00 176.06 3nn9 n ASP 329 N -3.54 0.55 -4.68 6.66 8.00 -1.26 -4.93 116.55 117.35 3nn9 n ASP 329 Ca 0.08 0.71 -0.45 0.00 0.71 0.00 0.00 54.79 55.84 3nn9 n ASP 329 Cb 0.54 -1.40 -0.04 0.00 -0.02 0.00 0.00 41.12 40.20 3nn9 n ASP 329 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3nn9 n ASP 330 N -1.32 3.50 -2.78 -2.24 8.00 -1.26 -5.00 116.55 115.44 3nn9 n ASP 330 Ca 0.13 1.03 0.00 0.00 0.71 0.00 0.00 54.79 56.66 3nn9 n ASP 330 Cb 0.49 -1.45 0.00 0.00 -0.02 0.00 0.00 41.12 40.13 3nn9 n ASP 330 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 3nn9 n PRO 331 N 4.92 0.83 -0.08 -0.24 -0.04 -1.26 -5.04 135.00 134.10 3nn9 n PRO 331 Ca 0.19 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.57 3nn9 n PRO 331 Cb 0.32 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.66 3nn9 n PRO 331 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3nn9 n THR 332 N -0.38 1.04 -4.27 0.52 -1.04 -1.26 -4.89 114.28 104.01 3nn9 n THR 332 Ca 0.00 -0.63 -0.19 0.00 -2.04 0.00 0.00 64.05 61.19 3nn9 n THR 332 Cb 0.00 -0.62 -0.11 0.00 -1.82 0.00 0.00 70.33 67.78 3nn9 n THR 332 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3nn9 s VAL 333 N -2.37 1.47 0.45 12.58 1.01 -1.26 -4.67 120.40 127.61 3nn9 s VAL 333 Ca -0.08 -1.78 0.01 0.00 0.00 0.00 0.00 61.98 60.13 3nn9 s VAL 333 Cb 0.05 -1.63 -0.00 0.00 0.00 0.00 0.00 36.38 34.79 3nn9 s VAL 333 CO 0.61 -0.39 0.04 0.61 0.00 0.00 0.00 175.10 175.97 3nn9 n GLY 335 N 0.45 3.52 3.13 4.51 0.00 0.11 -4.66 105.19 112.26 3nn9 n GLY 335 Ca -0.15 -2.29 -0.30 0.00 0.00 0.00 0.00 46.02 43.29 3nn9 n GLY 335 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3nn9 s LYS 336 N -3.63 2.58 -0.04 1.61 1.02 -1.07 -4.91 119.74 115.30 3nn9 s LYS 336 Ca 0.05 -0.71 0.07 0.00 0.02 0.00 0.00 55.97 55.41 3nn9 s LYS 336 Cb 0.00 -2.05 -0.24 0.00 -0.52 0.00 0.00 37.83 35.02 3nn9 s LYS 336 CO 0.04 0.06 0.69 0.00 -0.92 0.00 0.00 175.35 175.22 3nn9 n ASN 338 N -3.19 0.60 -3.97 0.00 4.13 -1.26 -1.65 115.26 109.91 3nn9 n ASN 338 Ca -0.18 -1.78 -0.11 0.00 1.68 0.00 0.00 54.58 54.20 3nn9 n ASN 338 Cb 1.04 -0.13 -0.12 0.00 -1.54 0.00 0.00 39.78 39.03 3nn9 n ASN 338 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 3nn9 s ASP 339 N -0.89 0.33 0.28 6.41 1.01 -1.26 -4.86 116.67 117.69 3nn9 s ASP 339 Ca 0.04 -0.39 -0.30 0.00 0.71 0.00 0.00 52.55 52.61 3nn9 s ASP 339 Cb 0.04 0.06 -0.13 0.00 1.01 0.00 0.00 42.92 43.90 3nn9 s ASP 339 CO 0.00 -0.21 1.35 -0.81 0.21 0.00 0.00 175.17 175.72 3nn9 n PRO 340 N 1.92 2.06 -2.55 8.23 -0.04 -1.26 -4.80 135.00 138.56 3nn9 n PRO 340 Ca -0.21 0.73 -0.43 0.00 -0.04 0.00 0.00 63.50 63.55 3nn9 n PRO 340 Cb 0.56 -2.35 -0.02 0.00 -0.04 0.00 0.00 33.50 31.65 3nn9 n PRO 340 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 3nn9 s TYR 341 N -0.49 3.07 0.77 0.54 5.04 -1.26 -4.90 117.35 120.13 3nn9 s TYR 341 Ca 0.63 1.20 -0.11 0.00 -2.44 0.00 0.00 57.07 56.35 3nn9 s TYR 341 Cb -0.62 -3.50 0.06 0.00 0.35 0.00 0.00 41.96 38.25 3nn9 s TYR 341 CO 0.55 -1.06 1.09 -1.25 -1.34 0.00 0.00 175.55 173.54 3nn9 s PRO 342 N 3.50 2.28 0.00 4.97 0.04 -1.26 -2.34 135.00 142.18 3nn9 s PRO 342 Ca 0.49 0.64 0.00 0.00 0.04 0.00 0.00 61.00 62.17 3nn9 s PRO 342 Cb -0.17 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.43 3nn9 s PRO 342 CO 0.12 -1.49 0.00 0.41 0.04 0.00 0.00 177.00 176.09 3nn9 n GLY 343 N -2.23 3.02 2.91 0.56 0.00 -1.26 -4.85 105.19 103.34 3nn9 n GLY 343 Ca 0.07 -0.40 -0.14 0.00 0.00 0.00 0.00 46.02 45.56 3nn9 n GLY 343 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3nn9 s ASN 344 N -0.03 -0.03 0.08 1.61 3.84 -1.26 -4.73 114.94 114.41 3nn9 s ASN 344 Ca 0.00 0.30 0.07 0.00 0.21 0.00 0.00 52.86 53.44 3nn9 s ASN 344 Cb 0.00 0.19 -0.04 0.00 -0.55 0.00 0.00 41.25 40.85 3nn9 s ASN 344 CO 0.00 -0.16 -0.15 0.20 -2.79 0.00 0.00 177.10 174.20 3nn9 s ASN 345 N 1.27 4.03 -0.94 -4.21 -0.87 -1.26 -4.52 114.94 108.44 3nn9 s ASN 345 Ca -0.08 -0.44 -0.06 0.00 -1.57 0.00 0.00 52.86 50.71 3nn9 s ASN 345 Cb -0.12 -0.67 0.01 0.00 -0.02 0.00 0.00 41.25 40.45 3nn9 s ASN 345 CO -0.06 0.21 0.78 0.59 -2.57 0.00 0.00 177.10 176.06 3nn9 n ASN 346 N 1.10 -4.98 -3.52 -1.22 5.03 -0.02 -5.00 115.26 106.66 3nn9 n ASN 346 Ca -0.15 -0.36 -0.09 0.00 0.87 0.00 0.00 54.58 54.85 3nn9 n ASN 346 Cb 0.52 -3.59 -0.03 0.00 -1.02 0.00 0.00 39.78 35.67 3nn9 n ASN 346 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 3nn9 s ASN 347 N -3.19 -0.38 0.00 6.41 2.47 -0.90 -4.98 114.94 114.36 3nn9 s ASN 347 Ca 0.39 0.11 0.00 0.00 0.42 0.00 0.00 52.86 53.78 3nn9 s ASN 347 Cb -0.17 0.38 0.00 0.00 -1.45 0.00 0.00 41.25 40.01 3nn9 s ASN 347 CO 0.48 -0.57 0.00 0.61 -3.72 0.00 0.00 177.10 173.90 3nn9 n GLY 348 N -0.00 1.40 3.31 1.21 0.00 -1.25 -4.71 105.19 105.15 3nn9 n GLY 348 Ca -0.10 -0.62 -0.14 0.00 0.00 0.00 0.00 46.02 45.16 3nn9 n GLY 348 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3nn9 s VAL 349 N -2.23 0.03 0.25 1.61 0.11 -1.22 -4.77 120.40 114.17 3nn9 s VAL 349 Ca 0.00 -0.23 -0.30 0.00 -2.93 0.00 0.00 61.98 58.52 3nn9 s VAL 349 Cb 0.00 -0.66 -0.11 0.00 -1.53 0.00 0.00 36.38 34.08 3nn9 s VAL 349 CO 0.00 -0.12 1.56 -0.75 -3.33 0.00 0.00 175.10 172.46 3nn9 s LYS 350 N -0.72 4.18 0.00 1.54 2.20 -1.26 -4.79 119.74 120.89 3nn9 s LYS 350 Ca -0.08 2.47 0.00 0.00 -0.36 0.00 0.00 55.97 58.00 3nn9 s LYS 350 Cb -0.04 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.21 3nn9 s LYS 350 CO 0.04 -0.59 0.00 0.41 -0.36 0.00 0.00 175.35 174.85 3nn9 n GLY 351 N 2.64 3.64 2.22 5.54 0.00 -1.25 -3.47 105.19 114.51 3nn9 n GLY 351 Ca 0.10 -1.41 -0.05 0.00 0.00 0.00 0.00 46.02 44.65 3nn9 n GLY 351 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3nn9 n PHE 352 N 0.00 -1.80 -3.51 1.61 -1.74 -1.26 -4.50 117.46 106.26 3nn9 n PHE 352 Ca 0.00 -1.09 -0.08 0.00 -0.56 0.00 0.00 57.45 55.72 3nn9 n PHE 352 Cb 0.00 0.54 -0.02 0.00 1.52 0.00 0.00 39.48 41.52 3nn9 n PHE 352 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 3nn9 s SER 353 N -2.22 -0.35 -0.29 5.98 1.04 -1.26 -3.88 113.70 112.72 3nn9 s SER 353 Ca 0.09 0.02 -0.05 0.00 0.48 0.00 0.00 55.95 56.49 3nn9 s SER 353 Cb -0.03 0.36 0.02 0.00 0.10 0.00 0.00 66.02 66.47 3nn9 s SER 353 CO 0.07 -0.58 0.04 -0.31 0.98 0.00 0.00 173.24 173.45 3nn9 s TYR 354 N -2.97 3.15 -0.74 5.02 2.02 -0.16 -4.86 117.35 118.81 3nn9 s TYR 354 Ca 0.05 -1.23 -0.10 0.00 -0.37 0.00 0.00 57.07 55.42 3nn9 s TYR 354 Cb -0.01 -2.20 0.19 0.00 -0.40 0.00 0.00 41.96 39.54 3nn9 s TYR 354 CO -0.08 -0.65 0.64 -0.51 -1.57 0.00 0.00 175.55 173.38 3nn9 s LEU 355 N 1.43 6.17 -0.39 -1.29 1.43 -1.26 -1.57 118.68 123.20 3nn9 s LEU 355 Ca 0.01 -2.73 0.09 0.00 -1.03 0.00 0.00 54.13 50.47 3nn9 s LEU 355 Cb -0.17 -2.07 0.27 0.00 0.03 0.00 0.00 46.19 44.24 3nn9 s LEU 355 CO 0.01 -0.50 0.59 -0.67 0.23 0.00 0.00 176.35 176.00 3nn9 n ASP 356 N 3.82 0.16 0.00 2.29 2.03 -1.26 -4.99 116.55 118.61 3nn9 n ASP 356 Ca 0.11 -2.80 0.00 0.00 0.52 0.00 0.00 54.79 52.62 3nn9 n ASP 356 Cb 0.43 -0.51 0.00 0.00 -0.72 0.00 0.00 41.12 40.33 3nn9 n ASP 356 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3nn9 n GLY 357 N 1.16 3.24 0.25 0.27 0.00 -1.26 -1.18 105.19 107.67 3nn9 n GLY 357 Ca 0.21 -0.19 0.07 0.00 0.00 0.00 0.00 46.02 46.11 3nn9 n GLY 357 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3nn9 h VAL 358 N 0.00 1.03 -0.09 1.61 3.04 -1.94 -0.71 116.25 119.19 3nn9 h VAL 358 Ca 0.00 -0.19 -0.06 0.00 -1.01 0.00 0.00 66.70 65.44 3nn9 h VAL 358 Cb 0.00 1.10 -0.02 0.00 -2.01 0.00 0.00 31.29 30.36 3nn9 h VAL 358 CO 0.00 0.05 0.08 -3.20 -1.01 0.00 0.00 177.57 173.49 3nn9 n ASN 359 N -4.45 5.55 -4.65 3.17 5.15 -0.32 -4.32 115.26 115.38 3nn9 n ASN 359 Ca -0.03 -2.53 -0.35 0.00 -0.60 0.00 0.00 54.58 51.08 3nn9 n ASN 359 Cb 0.14 -1.12 -0.09 0.00 -0.53 0.00 0.00 39.78 38.18 3nn9 n ASN 359 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 3nn9 s THR 360 N -0.42 4.86 -0.10 -0.44 2.01 -1.20 -4.04 115.64 116.32 3nn9 s THR 360 Ca 0.06 -0.01 0.01 0.00 0.31 0.00 0.00 61.69 62.05 3nn9 s THR 360 Cb 0.04 -3.18 0.02 0.00 0.01 0.00 0.00 72.50 69.39 3nn9 s THR 360 CO -0.00 0.47 -0.10 0.26 -0.69 0.00 0.00 174.62 174.56 3nn9 s TRP 361 N 0.28 1.52 -0.13 4.92 0.52 -0.61 -1.42 118.94 124.03 3nn9 s TRP 361 Ca 0.04 -0.70 -0.06 0.00 0.02 0.00 0.00 56.10 55.40 3nn9 s TRP 361 Cb -0.12 -1.20 -0.04 0.00 -1.15 0.00 0.00 33.47 30.96 3nn9 s TRP 361 CO 0.00 -0.45 0.09 -0.51 0.02 0.00 0.00 176.95 176.10 3nn9 s LEU 362 N 1.35 4.04 -0.10 2.99 1.43 0.13 -0.99 118.68 127.54 3nn9 s LEU 362 Ca -0.02 0.28 -0.07 0.00 -1.03 0.00 0.00 54.13 53.30 3nn9 s LEU 362 Cb -0.14 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 3nn9 s LEU 362 CO -0.04 0.33 0.16 -0.83 0.23 0.00 0.00 176.35 176.19 3nn9 s GLY 363 N -0.56 2.17 0.12 -3.19 0.00 -1.25 -0.21 107.32 104.41 3nn9 s GLY 363 Ca 0.11 -0.65 -0.21 0.00 0.00 0.00 0.00 44.72 43.97 3nn9 s GLY 363 CO 0.02 -0.41 0.53 1.09 0.00 0.00 0.00 173.10 174.34 3nn9 s ARG 364 N -1.19 1.17 0.65 2.90 1.70 0.26 -4.72 118.95 119.73 3nn9 s ARG 364 Ca 0.17 -0.47 -0.17 0.00 -0.47 0.00 0.00 55.73 54.80 3nn9 s ARG 364 Cb -0.12 0.53 -0.00 0.00 -0.57 0.00 0.00 34.95 34.79 3nn9 s ARG 364 CO 0.07 -0.48 1.18 0.95 -1.08 0.00 0.00 175.30 175.93 3nn9 s THR 365 N -3.46 2.73 -0.11 4.99 -4.23 -1.26 -1.31 115.64 112.99 3nn9 s THR 365 Ca 0.00 0.39 -0.21 0.00 -1.18 0.00 0.00 61.69 60.69 3nn9 s THR 365 Cb -0.00 -3.01 -0.27 0.00 1.34 0.00 0.00 72.50 70.56 3nn9 s THR 365 CO -0.10 -0.16 0.64 0.40 -0.54 0.00 0.00 174.62 174.87 3nn9 h ILE 366 N 0.32 1.30 -3.63 2.99 2.04 -1.53 -3.45 117.51 115.54 3nn9 h ILE 366 Ca -0.49 -2.40 -0.53 0.00 1.00 0.00 0.00 64.86 62.45 3nn9 h ILE 366 Cb 1.28 2.92 0.08 0.00 -0.74 0.00 0.00 36.82 40.36 3nn9 h ILE 366 CO 0.53 0.63 0.77 -0.55 0.00 0.00 0.00 178.15 179.53 3nn9 s SER 367 N -6.83 6.53 0.16 1.72 0.15 -0.96 -4.88 113.70 109.59 3nn9 s SER 367 Ca -0.19 2.84 0.25 0.00 0.70 0.00 0.00 55.95 59.55 3nn9 s SER 367 Cb 0.02 -2.64 0.45 0.00 -1.71 0.00 0.00 66.02 62.14 3nn9 s SER 367 CO 0.74 -0.76 1.44 0.16 1.20 0.00 0.00 173.24 176.02 3nn9 h ILE 368 N 3.24 0.00 0.00 6.45 3.07 -1.87 -3.39 117.51 125.00 3nn9 h ILE 368 Ca -0.48 -0.53 -0.31 0.00 1.55 0.00 0.00 64.86 65.08 3nn9 h ILE 368 Cb 1.23 1.24 -0.06 0.00 -0.27 0.00 0.00 36.82 38.96 3nn9 h ILE 368 CO 0.72 0.00 -2.19 0.00 -1.05 0.00 0.00 178.15 175.63 3nn9 n ALA 369 N -1.85 1.56 -2.51 0.16 0.00 -1.26 -0.99 120.51 115.62 3nn9 n ALA 369 Ca 0.04 -0.96 -0.24 0.00 0.00 0.00 0.00 53.44 52.28 3nn9 n ALA 369 Cb 0.45 -0.02 -0.10 0.00 0.00 0.00 0.00 19.45 19.78 3nn9 n ALA 369 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3nn9 s SER 370 N -5.77 2.78 -1.06 0.00 1.04 -1.26 -4.63 113.70 104.79 3nn9 s SER 370 Ca -0.23 -1.47 -0.20 0.00 0.48 0.00 0.00 55.95 54.53 3nn9 s SER 370 Cb 0.07 0.07 0.09 0.00 0.10 0.00 0.00 66.02 66.34 3nn9 s SER 370 CO 0.54 -0.68 1.40 -0.13 0.98 0.00 0.00 173.24 175.35 3nn9 s ARG 371 N -3.83 3.70 -0.18 4.02 0.52 -1.26 -4.41 118.95 117.51 3nn9 s ARG 371 Ca 0.31 -1.58 -0.16 0.00 -0.52 0.00 0.00 55.73 53.78 3nn9 s ARG 371 Cb 0.07 -5.24 0.05 0.00 0.52 0.00 0.00 34.95 30.35 3nn9 s ARG 371 CO 0.14 -2.05 0.48 -1.54 0.02 0.00 0.00 175.30 172.35 3nn9 s SER 372 N 4.28 -0.52 0.03 0.23 1.04 -1.26 -2.32 113.70 115.19 3nn9 s SER 372 Ca 0.43 0.98 0.00 0.00 0.48 0.00 0.00 55.95 57.84 3nn9 s SER 372 Cb -0.01 0.97 0.00 0.00 0.10 0.00 0.00 66.02 67.08 3nn9 s SER 372 CO -0.06 -0.17 0.00 0.61 0.98 0.00 0.00 173.24 174.60 3nn9 n GLY 373 N 3.04 -2.24 3.64 7.32 0.00 -0.27 -2.26 105.19 114.42 3nn9 n GLY 373 Ca -0.15 -1.46 -0.07 0.00 0.00 0.00 0.00 46.02 44.35 3nn9 n GLY 373 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3nn9 s TYR 374 N -2.45 -0.64 0.01 1.61 5.04 0.43 -3.51 117.35 117.84 3nn9 s TYR 374 Ca 0.00 1.38 -0.11 0.00 -2.44 0.00 0.00 57.07 55.91 3nn9 s TYR 374 Cb 0.00 0.39 0.01 0.00 0.35 0.00 0.00 41.96 42.71 3nn9 s TYR 374 CO 0.00 -0.31 0.21 -1.83 -1.34 0.00 0.00 175.55 172.28 3nn9 s GLU 375 N 0.90 0.60 -0.12 4.97 -1.05 -0.43 -0.19 118.70 123.39 3nn9 s GLU 375 Ca -0.04 -0.38 -0.03 0.00 -0.15 0.00 0.00 54.97 54.37 3nn9 s GLU 375 Cb -0.04 0.26 -0.03 0.00 -0.44 0.00 0.00 34.13 33.87 3nn9 s GLU 375 CO -0.11 -0.16 0.01 -1.64 0.95 0.00 0.00 175.26 174.30 3nn9 s MET 376 N -1.65 3.31 -0.03 -4.83 -1.94 0.08 -0.57 119.30 113.67 3nn9 s MET 376 Ca -0.12 -0.41 0.01 0.00 -1.71 0.00 0.00 55.69 53.46 3nn9 s MET 376 Cb -0.05 -2.90 0.01 0.00 2.01 0.00 0.00 34.83 33.90 3nn9 s MET 376 CO 0.01 0.53 -0.05 -0.51 -0.01 0.00 0.00 175.02 175.00 3nn9 s LEU 377 N -0.41 1.58 -0.32 -0.03 1.43 0.71 -0.92 118.68 120.71 3nn9 s LEU 377 Ca 0.08 -0.11 -0.18 0.00 -1.03 0.00 0.00 54.13 52.89 3nn9 s LEU 377 Cb -0.12 -0.37 -0.01 0.00 0.03 0.00 0.00 46.19 45.72 3nn9 s LEU 377 CO 0.02 -0.01 0.52 -0.75 0.23 0.00 0.00 176.35 176.36 3nn9 s LYS 378 N 0.51 3.78 -0.31 1.70 2.20 0.30 -0.69 119.74 127.22 3nn9 s LYS 378 Ca -0.06 0.01 -0.02 0.00 -0.36 0.00 0.00 55.97 55.55 3nn9 s LYS 378 Cb -0.10 -3.76 0.10 0.00 -1.51 0.00 0.00 37.83 32.57 3nn9 s LYS 378 CO -0.00 -0.55 0.11 0.08 -0.36 0.00 0.00 175.35 174.63 3nn9 s VAL 379 N 2.39 0.57 0.07 4.02 1.01 -0.50 -0.33 120.40 127.63 3nn9 s VAL 379 Ca 0.20 -1.23 -0.31 0.00 0.00 0.00 0.00 61.98 60.64 3nn9 s VAL 379 Cb -0.15 -1.44 -0.08 0.00 0.00 0.00 0.00 36.38 34.71 3nn9 s VAL 379 CO 0.12 -0.71 1.56 -2.84 0.00 0.00 0.00 175.10 173.23 3nn9 s PRO 380 N 1.72 4.23 -1.28 2.72 0.02 -1.26 -2.57 135.00 138.59 3nn9 s PRO 380 Ca 0.10 2.23 -0.05 0.00 0.02 0.00 0.00 61.00 63.29 3nn9 s PRO 380 Cb -0.17 -3.50 0.01 0.00 0.02 0.00 0.00 34.50 30.86 3nn9 s PRO 380 CO -0.28 -0.65 0.71 0.09 -0.33 0.00 0.00 177.00 176.54 3nn9 n ASN 381 N 5.16 -5.61 -0.18 2.53 3.02 -0.28 -4.85 115.26 115.05 3nn9 n ASN 381 Ca 0.14 -0.33 0.21 0.00 -0.03 0.00 0.00 54.58 54.58 3nn9 n ASN 381 Cb 0.41 -4.36 0.59 0.00 -0.61 0.00 0.00 39.78 35.81 3nn9 n ASN 381 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3nn9 h ALA 382 N 0.87 2.38 -0.16 5.41 0.00 -1.75 -1.34 119.26 124.66 3nn9 h ALA 382 Ca -0.47 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.30 3nn9 h ALA 382 Cb 1.32 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 3nn9 h ALA 382 CO 0.49 -0.62 -0.49 1.25 0.00 0.00 0.00 179.25 179.88 3nn9 h LEU 383 N 0.25 0.47 0.00 0.00 5.85 -1.90 0.23 115.31 120.21 3nn9 h LEU 383 Ca 0.41 -0.23 -0.17 0.00 0.84 0.00 0.00 57.88 58.73 3nn9 h LEU 383 Cb 1.20 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 42.07 3nn9 h LEU 383 CO -0.10 0.88 -1.65 0.35 -0.34 0.00 0.00 178.44 177.59 3nn9 n THR 384 N -3.97 0.63 -3.36 1.05 -2.24 -0.91 -2.68 114.28 102.80 3nn9 n THR 384 Ca -0.02 -0.40 -0.38 0.00 -2.27 0.00 0.00 64.05 60.98 3nn9 n THR 384 Cb 0.56 -0.72 -0.07 0.00 -2.10 0.00 0.00 70.33 68.00 3nn9 n THR 384 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3nn9 s ASP 385 N -4.14 6.45 -0.12 3.42 -1.08 -0.55 -4.94 116.67 115.71 3nn9 s ASP 385 Ca -0.05 0.54 0.11 0.00 -0.52 0.00 0.00 52.55 52.63 3nn9 s ASP 385 Cb 0.03 -2.24 0.54 0.00 -1.46 0.00 0.00 42.92 39.78 3nn9 s ASP 385 CO 0.39 -0.10 1.36 -0.90 0.52 0.00 0.00 175.17 176.45 3nn9 n ASP 386 N 4.55 3.87 0.00 -0.34 5.75 -1.26 -3.51 116.55 125.61 3nn9 n ASP 386 Ca -0.08 -2.47 0.00 0.00 -0.01 0.00 0.00 54.79 52.23 3nn9 n ASP 386 Cb 0.51 -0.55 0.00 0.00 -1.03 0.00 0.00 41.12 40.05 3nn9 n ASP 386 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3nn9 n LYS 387 N 0.58 0.77 -1.73 0.11 5.02 -1.26 0.07 118.16 121.72 3nn9 n LYS 387 Ca 0.19 -0.74 -0.42 0.00 -2.02 0.00 0.00 58.31 55.31 3nn9 n LYS 387 Cb 0.78 -0.64 -0.03 0.00 -0.02 0.00 0.00 35.03 35.12 3nn9 n LYS 387 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3nn9 s SER 388 N -0.26 6.48 0.32 4.39 1.04 -1.24 -4.90 113.70 119.52 3nn9 s SER 388 Ca 0.00 2.62 0.08 0.00 0.48 0.00 0.00 55.95 59.13 3nn9 s SER 388 Cb 0.00 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.55 3nn9 s SER 388 CO 0.00 -1.03 0.15 -0.54 0.98 0.00 0.00 173.24 172.80 3nn9 s LYS 389 N 4.18 2.48 0.65 4.02 -0.14 -1.26 -4.31 119.74 125.36 3nn9 s LYS 389 Ca 0.85 -1.42 -0.16 0.00 -1.36 0.00 0.00 55.97 53.88 3nn9 s LYS 389 Cb -0.42 -2.27 -0.01 0.00 -1.68 0.00 0.00 37.83 33.46 3nn9 s LYS 389 CO 0.39 0.19 1.12 -2.14 -0.76 0.00 0.00 175.35 174.15 3nn9 s PRO 390 N -3.84 2.82 -0.00 -1.68 0.02 -1.26 -4.47 135.00 126.59 3nn9 s PRO 390 Ca 0.36 1.46 0.01 0.00 0.02 0.00 0.00 61.00 62.86 3nn9 s PRO 390 Cb -0.04 -1.95 -0.02 0.00 0.02 0.00 0.00 34.50 32.51 3nn9 s PRO 390 CO 0.23 -1.25 0.03 2.41 -0.33 0.00 0.00 177.00 178.10 3nn9 n THR 391 N -2.27 0.01 -3.52 0.99 -1.04 0.56 -4.99 114.28 104.02 3nn9 n THR 391 Ca 0.11 -0.04 -0.11 0.00 -2.04 0.00 0.00 64.05 61.97 3nn9 n THR 391 Cb 0.52 0.30 -0.04 0.00 -1.82 0.00 0.00 70.33 69.29 3nn9 n THR 391 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 3nn9 s GLN 392 N -2.10 0.87 0.25 -2.82 0.74 -1.25 -5.00 119.66 110.35 3nn9 s GLN 392 Ca -0.01 -0.08 -0.01 0.00 0.05 0.00 0.00 55.36 55.31 3nn9 s GLN 392 Cb 0.01 0.40 -0.03 0.00 1.10 0.00 0.00 33.01 34.50 3nn9 s GLN 392 CO 0.06 -0.33 0.25 0.20 -0.55 0.00 0.00 175.29 174.93 3nn9 s GLY 394 N -1.86 1.47 -0.30 2.59 0.00 -1.26 -0.54 107.32 107.42 3nn9 s GLY 394 Ca -0.01 -1.62 -0.09 0.00 0.00 0.00 0.00 44.72 43.01 3nn9 s GLY 394 CO -0.03 -1.24 0.63 1.62 0.00 0.00 0.00 173.10 174.08 3nn9 s GLN 395 N -3.87 0.57 0.00 2.90 0.74 -0.10 -4.97 119.66 114.93 3nn9 s GLN 395 Ca 0.36 1.37 -0.30 0.00 0.05 0.00 0.00 55.36 56.84 3nn9 s GLN 395 Cb 0.04 0.80 -0.04 0.00 1.10 0.00 0.00 33.01 34.91 3nn9 s GLN 395 CO 0.16 -0.26 1.18 0.99 -0.55 0.00 0.00 175.29 176.81 3nn9 s THR 396 N 2.88 4.21 -0.18 -0.34 2.01 -1.26 -0.74 115.64 122.22 3nn9 s THR 396 Ca -0.02 1.56 -0.03 0.00 0.31 0.00 0.00 61.69 63.51 3nn9 s THR 396 Cb -0.12 -4.00 -0.10 0.00 0.01 0.00 0.00 72.50 68.28 3nn9 s THR 396 CO -0.19 0.07 -0.19 -0.38 -0.69 0.00 0.00 174.62 173.24 3nn9 n ILE 397 N 4.24 0.99 -4.46 1.82 2.08 0.73 -4.66 119.36 120.11 3nn9 n ILE 397 Ca 0.10 -0.32 -0.20 0.00 0.56 0.00 0.00 62.75 62.88 3nn9 n ILE 397 Cb 0.47 -1.39 -0.14 0.00 -0.75 0.00 0.00 39.64 37.83 3nn9 n ILE 397 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 3nn9 s VAL 398 N -2.34 0.98 0.45 1.39 1.01 -0.89 -1.23 120.40 119.76 3nn9 s VAL 398 Ca -0.24 -0.68 -0.07 0.00 0.00 0.00 0.00 61.98 60.99 3nn9 s VAL 398 Cb 0.08 -0.85 -0.05 0.00 0.00 0.00 0.00 36.38 35.56 3nn9 s VAL 398 CO 0.36 0.16 0.78 -0.76 0.00 0.00 0.00 175.10 175.64 3nn9 s LEU 399 N -0.59 3.71 0.48 3.92 1.43 -1.26 -0.43 118.68 125.93 3nn9 s LEU 399 Ca 0.03 1.00 0.32 0.00 -1.03 0.00 0.00 54.13 54.45 3nn9 s LEU 399 Cb -0.06 -3.93 1.69 0.00 0.03 0.00 0.00 46.19 43.92 3nn9 s LEU 399 CO 0.00 -0.51 1.99 -1.13 0.23 0.00 0.00 176.35 176.93 3nn9 h ASN 400 N 0.63 0.00 0.16 2.29 -0.00 -1.91 -0.75 115.58 116.01 3nn9 h ASN 400 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 55.83 3nn9 h ASN 400 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.52 3nn9 h ASN 400 CO 0.63 0.00 -0.06 0.35 -0.00 0.00 0.00 177.43 178.34 3nn9 n THR 401 N -2.67 0.00 -4.38 -3.57 -2.24 -1.26 -4.11 114.28 96.05 3nn9 n THR 401 Ca -0.02 -0.10 -0.26 0.00 -2.27 0.00 0.00 64.05 61.40 3nn9 n THR 401 Cb 0.10 -0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.22 3nn9 n THR 401 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3nn9 s ASP 402 N -2.23 3.78 0.36 3.42 1.01 -0.29 -5.00 116.67 117.73 3nn9 s ASP 402 Ca 0.36 -0.79 -0.24 0.00 0.71 0.00 0.00 52.55 52.59 3nn9 s ASP 402 Cb 0.21 -0.44 -0.10 0.00 1.01 0.00 0.00 42.92 43.59 3nn9 s ASP 402 CO 0.41 0.09 0.94 0.26 0.21 0.00 0.00 175.17 177.09 3nn9 s TRP 403 N -1.86 3.53 0.00 4.23 0.52 -1.26 -1.12 118.94 122.99 3nn9 s TRP 403 Ca 0.24 1.70 0.00 0.00 0.02 0.00 0.00 56.10 58.06 3nn9 s TRP 403 Cb -0.08 -2.89 0.00 0.00 -1.15 0.00 0.00 33.47 29.36 3nn9 s TRP 403 CO 0.13 0.08 0.00 -1.13 0.02 0.00 0.00 176.95 176.05 3nn9 n SER 404 N 0.07 0.00 0.00 2.95 3.41 -0.98 -4.56 113.62 114.50 3nn9 n SER 404 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 3nn9 n SER 404 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 3nn9 n SER 404 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3nn9 n GLY 405 N 4.20 0.17 3.84 5.00 0.00 -0.91 -1.93 105.19 115.56 3nn9 n GLY 405 Ca 0.00 -1.04 -0.31 0.00 0.00 0.00 0.00 46.02 44.68 3nn9 n GLY 405 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3nn9 s TYR 406 N -4.00 3.33 0.04 1.61 1.51 -1.25 -4.68 117.35 113.91 3nn9 s TYR 406 Ca 0.00 1.34 -0.16 0.00 -1.01 0.00 0.00 57.07 57.25 3nn9 s TYR 406 Cb 0.00 -2.83 0.03 0.00 -0.11 0.00 0.00 41.96 39.05 3nn9 s TYR 406 CO 0.00 -1.02 0.35 -1.54 -1.11 0.00 0.00 175.55 172.22 3nn9 s SER 407 N -3.98 -0.19 0.30 2.29 1.04 -1.23 0.19 113.70 112.12 3nn9 s SER 407 Ca 0.57 -0.10 -0.19 0.00 0.48 0.00 0.00 55.95 56.71 3nn9 s SER 407 Cb -0.13 0.38 0.06 0.00 0.10 0.00 0.00 66.02 66.44 3nn9 s SER 407 CO 0.54 -0.63 0.88 -0.83 0.98 0.00 0.00 173.24 174.19 3nn9 s GLY 408 N -2.01 0.22 -0.07 7.32 0.00 -1.08 -3.87 107.32 107.83 3nn9 s GLY 408 Ca -0.05 -0.53 -0.00 0.00 0.00 0.00 0.00 44.72 44.13 3nn9 s GLY 408 CO -0.03 0.71 -0.04 -1.35 0.00 0.00 0.00 173.10 172.39 3nn9 s SER 409 N -3.18 4.88 0.16 1.64 1.04 -1.26 -2.31 113.70 114.68 3nn9 s SER 409 Ca 0.17 0.04 -0.12 0.00 0.48 0.00 0.00 55.95 56.53 3nn9 s SER 409 Cb -0.04 -1.29 0.01 0.00 0.10 0.00 0.00 66.02 64.80 3nn9 s SER 409 CO 0.08 0.37 0.36 0.72 0.98 0.00 0.00 173.24 175.75 3nn9 s PHE 410 N -0.84 0.16 0.04 5.02 -0.71 -1.15 -4.65 117.98 115.86 3nn9 s PHE 410 Ca 0.13 -0.52 -0.14 0.00 -1.04 0.00 0.00 56.93 55.36 3nn9 s PHE 410 Cb -0.11 0.11 0.02 0.00 -1.21 0.00 0.00 43.02 41.83 3nn9 s PHE 410 CO 0.02 -0.76 0.30 -1.64 -1.34 0.00 0.00 175.22 171.80 3nn9 s MET 411 N -3.91 0.80 -0.85 1.99 -1.94 -1.26 -2.22 119.30 111.91 3nn9 s MET 411 Ca 0.12 -0.50 -0.13 0.00 -1.71 0.00 0.00 55.69 53.48 3nn9 s MET 411 Cb 0.02 0.35 0.22 0.00 2.01 0.00 0.00 34.83 37.43 3nn9 s MET 411 CO -0.03 -0.26 0.78 0.34 -0.01 0.00 0.00 175.02 175.85 3nn9 s ASP 412 N -2.04 6.71 0.19 3.03 2.15 -1.26 -4.74 116.67 120.70 3nn9 s ASP 412 Ca -0.05 -2.82 0.18 0.00 0.43 0.00 0.00 52.55 50.29 3nn9 s ASP 412 Cb -0.01 -2.18 0.83 0.00 -0.30 0.00 0.00 42.92 41.26 3nn9 s ASP 412 CO -0.03 -0.52 1.56 -1.22 -0.17 0.00 0.00 175.17 174.79 3nn9 n TYR 412 N 3.77 0.53 -0.60 -5.34 4.01 -1.26 -2.35 117.16 115.92 3nn9 n TYR 412 Ca 0.15 0.23 0.09 0.00 -0.16 0.00 0.00 57.90 58.21 3nn9 n TYR 412 Cb 0.45 -0.87 0.32 0.00 -0.31 0.00 0.00 39.34 38.93 3nn9 n TYR 412 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 3nn9 n TRP 412 N -2.00 1.25 -2.65 -0.72 8.01 -1.26 -4.99 117.44 115.08 3nn9 n TRP 412 Ca 0.01 -0.62 -0.38 0.00 -1.31 0.00 0.00 57.50 55.20 3nn9 n TRP 412 Cb 0.14 -0.21 -0.05 0.00 -2.01 0.00 0.00 31.31 29.17 3nn9 n TRP 412 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3nn9 s ALA 413 N -1.82 3.25 0.37 6.99 0.00 -0.99 -5.03 121.76 124.52 3nn9 s ALA 413 Ca 0.46 0.67 -0.27 0.00 0.00 0.00 0.00 51.96 52.81 3nn9 s ALA 413 Cb 0.30 -3.24 -0.09 0.00 0.00 0.00 0.00 23.12 20.08 3nn9 s ALA 413 CO 0.22 0.02 1.28 -1.21 0.00 0.00 0.00 175.76 176.07 3nn9 s GLU 414 N -1.85 4.19 0.00 0.00 2.02 -1.26 -5.00 118.70 116.80 3nn9 s GLU 414 Ca 0.49 2.14 0.00 0.00 0.02 0.00 0.00 54.97 57.62 3nn9 s GLU 414 Cb -0.24 -2.91 0.00 0.00 0.10 0.00 0.00 34.13 31.08 3nn9 s GLU 414 CO 0.30 -0.30 0.00 0.41 0.02 0.00 0.00 175.26 175.69 3nn9 n GLY 415 N 0.74 2.95 0.16 -1.39 0.00 -1.26 -4.92 105.19 101.48 3nn9 n GLY 415 Ca 0.02 -1.47 0.13 0.00 0.00 0.00 0.00 46.02 44.69 3nn9 n GLY 415 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3nn9 h GLU 416 N 0.00 0.00 -3.03 1.61 4.11 -1.97 -3.48 114.58 111.82 3nn9 h GLU 416 Ca 0.00 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.32 3nn9 h GLU 416 Cb 0.00 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 29.06 3nn9 h GLU 416 CO 0.00 0.00 -0.23 0.00 0.07 0.00 0.00 179.01 178.85 3nn9 s TYR 418 N -1.67 3.17 -0.16 0.00 2.02 0.35 -4.63 117.35 116.43 3nn9 s TYR 418 Ca -0.11 0.93 -0.19 0.00 -0.37 0.00 0.00 57.07 57.33 3nn9 s TYR 418 Cb -0.04 -3.67 -0.03 0.00 -0.40 0.00 0.00 41.96 37.82 3nn9 s TYR 418 CO 0.02 -2.37 0.54 0.50 -1.57 0.00 0.00 175.55 172.67 3nn9 s ARG 419 N 1.35 4.27 0.20 -0.62 3.52 -1.26 -0.65 118.95 125.75 3nn9 s ARG 419 Ca 0.64 0.50 -0.30 0.00 -0.13 0.00 0.00 55.73 56.45 3nn9 s ARG 419 Cb -0.36 -3.51 -0.08 0.00 -1.56 0.00 0.00 34.95 29.44 3nn9 s ARG 419 CO 0.30 -0.04 0.94 0.00 -0.81 0.00 0.00 175.30 175.68 3nn9 s ALA 420 N 1.26 3.32 0.21 6.12 0.00 -1.26 -4.54 121.76 126.87 3nn9 s ALA 420 Ca 0.27 0.59 0.01 0.00 0.00 0.00 0.00 51.96 52.83 3nn9 s ALA 420 Cb -0.16 -3.21 -0.05 0.00 0.00 0.00 0.00 23.12 19.70 3nn9 s ALA 420 CO 0.11 0.14 0.06 0.00 0.00 0.00 0.00 175.76 176.07 3nn9 s PHE 422 N -3.76 0.12 0.15 0.00 -0.12 -0.21 -2.93 117.98 111.23 3nn9 s PHE 422 Ca 0.32 -0.55 0.02 0.00 -0.05 0.00 0.00 56.93 56.67 3nn9 s PHE 422 Cb 0.07 0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 42.89 3nn9 s PHE 422 CO 0.09 -1.17 -0.03 1.52 -0.05 0.00 0.00 175.22 175.58 3nn9 s TYR 423 N -3.76 1.13 -0.03 3.49 -0.85 -0.98 -1.57 117.35 114.78 3nn9 s TYR 423 Ca 0.17 -0.96 0.01 0.00 -0.52 0.00 0.00 57.07 55.77 3nn9 s TYR 423 Cb -0.04 -0.64 0.02 0.00 0.38 0.00 0.00 41.96 41.69 3nn9 s TYR 423 CO 0.09 -0.16 -0.00 0.08 -1.52 0.00 0.00 175.55 174.04 3nn9 s VAL 424 N -3.61 0.19 0.16 -3.49 1.01 0.36 -2.64 120.40 112.37 3nn9 s VAL 424 Ca 0.20 0.05 -0.25 0.00 0.00 0.00 0.00 61.98 61.98 3nn9 s VAL 424 Cb 0.05 -0.26 -0.08 0.00 0.00 0.00 0.00 36.38 36.09 3nn9 s VAL 424 CO 0.01 0.13 0.75 -0.70 0.00 0.00 0.00 175.10 175.30 3nn9 s GLU 425 N 0.86 4.52 -0.31 2.72 2.12 0.13 -1.40 118.70 127.34 3nn9 s GLU 425 Ca -0.09 1.11 0.02 0.00 0.36 0.00 0.00 54.97 56.37 3nn9 s GLU 425 Cb -0.12 -3.25 0.09 0.00 0.26 0.00 0.00 34.13 31.11 3nn9 s GLU 425 CO -0.01 0.58 0.05 -0.51 -0.54 0.00 0.00 175.26 174.82 3nn9 s LEU 426 N -1.17 3.35 0.09 2.70 1.43 -0.98 -2.15 118.68 121.96 3nn9 s LEU 426 Ca 0.35 -1.76 -0.15 0.00 -1.03 0.00 0.00 54.13 51.55 3nn9 s LEU 426 Cb -0.23 -1.25 -0.06 0.00 0.03 0.00 0.00 46.19 44.68 3nn9 s LEU 426 CO 0.25 -0.36 0.50 -0.63 0.23 0.00 0.00 176.35 176.34 3nn9 s ILE 427 N 1.27 4.90 0.06 -0.59 1.01 -0.81 -1.01 121.20 126.03 3nn9 s ILE 427 Ca 0.07 0.85 0.04 0.00 0.00 0.00 0.00 60.65 61.61 3nn9 s ILE 427 Cb -0.18 -3.75 -0.03 0.00 0.01 0.00 0.00 42.46 38.51 3nn9 s ILE 427 CO -0.14 0.37 -0.12 -0.13 0.00 0.00 0.00 174.94 174.92 3nn9 s ARG 428 N -1.62 0.75 0.33 2.79 1.81 -0.04 -4.73 118.95 118.24 3nn9 s ARG 428 Ca 0.33 -0.84 0.00 0.00 -1.72 0.00 0.00 55.73 53.50 3nn9 s ARG 428 Cb -0.16 -0.70 0.00 0.00 -0.45 0.00 0.00 34.95 33.64 3nn9 s ARG 428 CO 0.18 0.16 0.00 0.41 -0.68 0.00 0.00 175.30 175.37 3nn9 n GLY 429 N 1.50 -0.86 3.76 -3.53 0.00 -1.26 -0.98 105.19 103.83 3nn9 n GLY 429 Ca -0.21 -1.81 -0.39 0.00 0.00 0.00 0.00 46.02 43.61 3nn9 n GLY 429 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3nn9 s ARG 430 N 0.00 3.70 0.08 1.61 0.52 -0.75 -0.80 118.95 123.31 3nn9 s ARG 430 Ca 0.00 2.08 0.23 0.00 -0.52 0.00 0.00 55.73 57.52 3nn9 s ARG 430 Cb 0.00 -2.54 0.13 0.00 0.52 0.00 0.00 34.95 33.06 3nn9 s ARG 430 CO 0.00 -0.69 1.11 -0.35 0.02 0.00 0.00 175.30 175.39 3nn9 n PRO 431 N -0.33 0.32 0.08 3.54 -0.04 -1.26 -4.70 135.00 132.61 3nn9 n PRO 431 Ca 0.06 0.03 -0.10 0.00 -0.04 0.00 0.00 63.50 63.45 3nn9 n PRO 431 Cb 0.45 -1.64 -0.11 0.00 -0.04 0.00 0.00 33.50 32.17 3nn9 n PRO 431 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 3nn9 h LYS 432 N 0.00 0.13 -3.35 0.54 1.79 -1.95 -3.33 116.57 110.40 3nn9 h LYS 432 Ca 0.00 -0.20 -0.69 0.00 -2.18 0.00 0.00 60.65 57.58 3nn9 h LYS 432 Cb 0.76 0.07 -0.37 0.00 -1.58 0.00 0.00 32.23 31.12 3nn9 h LYS 432 CO 0.00 1.07 -0.26 -1.21 -1.08 0.00 0.00 179.45 177.96 3nn9 s GLU 433 N -2.78 2.92 0.00 3.15 2.02 0.02 -4.90 118.70 119.13 3nn9 s GLU 433 Ca -0.01 -3.07 0.19 0.00 0.02 0.00 0.00 54.97 52.10 3nn9 s GLU 433 Cb 0.09 -3.79 1.04 0.00 0.10 0.00 0.00 34.13 31.57 3nn9 s GLU 433 CO 0.84 -1.24 1.57 -0.40 0.02 0.00 0.00 175.26 176.06 3nn9 n ASP 434 N 2.60 0.00 -0.22 -0.19 5.75 -1.25 -2.91 116.55 120.33 3nn9 n ASP 434 Ca 0.17 -0.23 0.15 0.00 -0.01 0.00 0.00 54.79 54.86 3nn9 n ASP 434 Cb 0.37 -0.17 0.72 0.00 -1.03 0.00 0.00 41.12 41.01 3nn9 n ASP 434 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3nn9 n LYS 435 N -1.17 1.25 -4.43 0.11 5.02 -1.26 -4.76 118.16 112.92 3nn9 n LYS 435 Ca 0.11 -0.45 -0.26 0.00 -2.02 0.00 0.00 58.31 55.69 3nn9 n LYS 435 Cb 0.12 -1.49 -0.10 0.00 -0.02 0.00 0.00 35.03 33.54 3nn9 n LYS 435 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3nn9 s VAL 436 N -2.06 2.20 -2.36 -0.18 -7.23 -1.25 -4.99 120.40 104.53 3nn9 s VAL 436 Ca 0.41 -1.92 0.20 0.00 -1.81 0.00 0.00 61.98 58.86 3nn9 s VAL 436 Cb 0.21 -2.94 0.21 0.00 0.56 0.00 0.00 36.38 34.42 3nn9 s VAL 436 CO 0.37 -0.04 1.17 0.79 -0.31 0.00 0.00 175.10 177.07 3nn9 n TRP 437 N -1.03 0.11 -4.08 2.82 7.02 -1.26 -4.60 117.44 116.41 3nn9 n TRP 437 Ca -0.04 -0.07 -0.24 0.00 -1.02 0.00 0.00 57.50 56.14 3nn9 n TRP 437 Cb 0.65 -0.00 -0.07 0.00 -2.42 0.00 0.00 31.31 29.48 3nn9 n TRP 437 CO 0.00 0.00 0.00 1.67 -2.02 0.00 0.00 177.69 177.34 3nn9 s TRP 438 N -1.56 2.65 -0.05 -5.99 1.48 -1.25 -2.06 118.94 112.16 3nn9 s TRP 438 Ca 0.25 -0.49 0.04 0.00 -1.06 0.00 0.00 56.10 54.84 3nn9 s TRP 438 Cb 0.17 -1.82 0.00 0.00 -1.16 0.00 0.00 33.47 30.67 3nn9 s TRP 438 CO 0.25 0.24 -0.15 0.99 -4.06 0.00 0.00 176.95 174.22 3nn9 s THR 439 N -2.52 1.31 0.33 0.66 2.01 -1.26 -1.80 115.64 114.37 3nn9 s THR 439 Ca 0.40 -0.63 -0.08 0.00 0.31 0.00 0.00 61.69 61.69 3nn9 s THR 439 Cb 0.00 -1.15 0.03 0.00 0.01 0.00 0.00 72.50 71.40 3nn9 s THR 439 CO 0.23 0.39 0.57 -0.24 -0.69 0.00 0.00 174.62 174.87 3nn9 n SER 440 N 3.33 -1.64 -3.95 3.53 2.88 -0.15 -4.61 113.62 113.01 3nn9 n SER 440 Ca -0.19 -2.50 -0.11 0.00 -1.33 0.00 0.00 58.87 54.73 3nn9 n SER 440 Cb 0.53 2.84 -0.07 0.00 -0.75 0.00 0.00 64.21 66.75 3nn9 n SER 440 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3nn9 s ASN 441 N -2.84 0.22 0.45 -3.46 4.22 -1.26 -0.86 114.94 111.41 3nn9 s ASN 441 Ca 0.19 -1.23 0.03 0.00 -2.14 0.00 0.00 52.86 49.71 3nn9 s ASN 441 Cb -0.03 0.51 -0.02 0.00 1.28 0.00 0.00 41.25 42.99 3nn9 s ASN 441 CO 0.14 -1.04 0.07 -0.94 -2.04 0.00 0.00 177.10 173.29 3nn9 s SER 442 N -3.12 3.40 0.02 3.54 1.04 -0.18 -4.41 113.70 113.99 3nn9 s SER 442 Ca 0.31 -1.66 0.08 0.00 0.48 0.00 0.00 55.95 55.16 3nn9 s SER 442 Cb 0.03 0.49 -0.03 0.00 0.10 0.00 0.00 66.02 66.61 3nn9 s SER 442 CO 0.13 -0.89 -0.22 -0.63 0.98 0.00 0.00 173.24 172.61 3nn9 s ILE 443 N -3.05 2.47 -0.01 -1.02 1.01 -1.26 -2.31 121.20 117.02 3nn9 s ILE 443 Ca 0.16 -1.20 0.05 0.00 0.00 0.00 0.00 60.65 59.67 3nn9 s ILE 443 Cb 0.02 -1.98 -0.01 0.00 0.01 0.00 0.00 42.46 40.50 3nn9 s ILE 443 CO 0.10 0.41 -0.18 0.54 0.00 0.00 0.00 174.94 175.81 3nn9 s VAL 444 N -0.81 1.40 0.07 2.92 0.11 -0.50 -3.36 120.40 120.22 3nn9 s VAL 444 Ca 0.13 -0.75 0.01 0.00 -2.93 0.00 0.00 61.98 58.43 3nn9 s VAL 444 Cb -0.10 -1.16 -0.04 0.00 -1.53 0.00 0.00 36.38 33.55 3nn9 s VAL 444 CO 0.03 0.39 -0.06 -0.94 -3.33 0.00 0.00 175.10 171.20 3nn9 s SER 445 N -0.41 0.83 0.01 3.54 1.04 0.60 -0.49 113.70 118.82 3nn9 s SER 445 Ca 0.07 -0.85 -0.06 0.00 0.48 0.00 0.00 55.95 55.59 3nn9 s SER 445 Cb -0.07 0.11 -0.00 0.00 0.10 0.00 0.00 66.02 66.16 3nn9 s SER 445 CO -0.01 -0.42 0.10 -0.32 0.98 0.00 0.00 173.24 173.57 3nn9 s MET 446 N -3.11 0.44 0.36 4.02 1.75 -0.61 -0.50 119.30 121.65 3nn9 s MET 446 Ca 0.03 -0.44 0.04 0.00 -1.25 0.00 0.00 55.69 54.07 3nn9 s MET 446 Cb 0.01 0.18 -0.06 0.00 2.84 0.00 0.00 34.83 37.80 3nn9 s MET 446 CO -0.04 -0.10 0.06 0.00 -0.65 0.00 0.00 175.02 174.28 3nn9 s SER 448 N -3.56 5.78 0.01 0.00 1.04 0.11 -0.64 113.70 116.44 3nn9 s SER 448 Ca 0.33 0.61 -0.02 0.00 0.48 0.00 0.00 55.95 57.35 3nn9 s SER 448 Cb 0.08 -1.74 -0.01 0.00 0.10 0.00 0.00 66.02 64.44 3nn9 s SER 448 CO 0.15 -0.87 0.02 -0.55 0.98 0.00 0.00 173.24 172.98 3nn9 s SER 449 N -4.24 0.16 0.00 7.02 0.15 -0.43 -4.69 113.70 111.67 3nn9 s SER 449 Ca 0.51 -0.38 0.27 0.00 0.70 0.00 0.00 55.95 57.05 3nn9 s SER 449 Cb -0.10 0.13 0.84 0.00 -1.71 0.00 0.00 66.02 65.18 3nn9 s SER 449 CO 0.43 -0.30 1.63 0.35 1.20 0.00 0.00 173.24 176.54 3nn9 n THR 450 N 1.64 0.00 -2.16 6.45 -2.24 -1.25 -0.10 114.28 116.61 3nn9 n THR 450 Ca -0.23 -0.06 -0.28 0.00 -2.27 0.00 0.00 64.05 61.21 3nn9 n THR 450 Cb 0.55 0.14 0.04 0.00 -2.10 0.00 0.00 70.33 68.96 3nn9 n THR 450 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3nn9 s GLU 451 N -2.70 2.86 -0.77 -0.78 0.41 -1.26 -4.70 118.70 111.77 3nn9 s GLU 451 Ca 0.20 0.19 -0.11 0.00 -0.41 0.00 0.00 54.97 54.84 3nn9 s GLU 451 Cb 0.19 -2.16 0.20 0.00 -1.78 0.00 0.00 34.13 30.58 3nn9 s GLU 451 CO 0.57 -0.87 0.68 -0.06 -0.49 0.00 0.00 175.26 175.08 3nn9 s PHE 452 N -3.16 3.66 0.42 1.61 0.40 -1.26 -3.55 117.98 116.09 3nn9 s PHE 452 Ca 0.56 -2.14 -0.02 0.00 -0.60 0.00 0.00 56.93 54.73 3nn9 s PHE 452 Cb -0.11 -3.67 -0.03 0.00 0.51 0.00 0.00 43.02 39.72 3nn9 s PHE 452 CO 0.48 -0.96 0.67 -0.51 0.70 0.00 0.00 175.22 175.61 3nn9 s LEU 453 N 0.17 3.81 0.72 -0.37 1.43 -1.26 -5.04 118.68 118.13 3nn9 s LEU 453 Ca 0.17 0.69 -0.12 0.00 -1.03 0.00 0.00 54.13 53.83 3nn9 s LEU 453 Cb -0.13 -3.60 0.03 0.00 0.03 0.00 0.00 46.19 42.52 3nn9 s LEU 453 CO -0.07 -0.45 1.09 -0.83 0.23 0.00 0.00 176.35 176.32 3nn9 s GLY 454 N -4.08 1.86 0.15 -3.19 0.00 -1.26 -4.88 107.32 95.92 3nn9 s GLY 454 Ca 0.44 0.34 0.07 0.00 0.00 0.00 0.00 44.72 45.57 3nn9 s GLY 454 CO 0.41 0.69 -0.01 -0.86 0.00 0.00 0.00 173.10 173.32 3nn9 s GLN 455 N -4.61 2.40 0.22 2.90 -2.07 -1.26 -5.02 119.66 112.22 3nn9 s GLN 455 Ca 0.63 -1.05 -0.00 0.00 -1.82 0.00 0.00 55.36 53.11 3nn9 s GLN 455 Cb -0.18 -2.38 -0.04 0.00 -1.09 0.00 0.00 33.01 29.32 3nn9 s GLN 455 CO 0.50 0.47 0.12 -0.46 -1.32 0.00 0.00 175.29 174.60 3nn9 s TRP 456 N -1.60 1.28 0.22 9.60 -0.00 -1.26 -5.11 118.94 122.05 3nn9 s TRP 456 Ca 0.26 -1.31 0.07 0.00 -0.00 0.00 0.00 56.10 55.12 3nn9 s TRP 456 Cb -0.10 -0.67 -0.04 0.00 -0.00 0.00 0.00 33.47 32.66 3nn9 s TRP 456 CO 0.18 -0.53 0.14 0.16 -0.00 0.00 0.00 176.95 176.90 3nn9 s ASP 457 N -3.21 5.39 -0.54 5.86 -4.77 -1.26 -4.73 116.67 113.41 3nn9 s ASP 457 Ca 0.38 -0.25 0.04 0.00 -3.30 0.00 0.00 52.55 49.42 3nn9 s ASP 457 Cb 0.07 -1.34 0.17 0.00 -1.09 0.00 0.00 42.92 40.73 3nn9 s ASP 457 CO 0.12 0.01 0.40 0.26 0.70 0.00 0.00 175.17 176.66 3nn9 s TRP 458 N -1.98 2.23 0.74 2.11 0.52 -0.37 -5.00 118.94 117.20 3nn9 s TRP 458 Ca 0.32 -2.77 -0.12 0.00 0.02 0.00 0.00 56.10 53.55 3nn9 s TRP 458 Cb -0.09 -1.76 0.04 0.00 -1.15 0.00 0.00 33.47 30.51 3nn9 s TRP 458 CO 0.23 -0.70 1.11 -1.25 0.02 0.00 0.00 176.95 176.37 3nn9 s PRO 459 N -0.57 2.53 0.16 4.98 0.04 -1.26 -4.78 135.00 136.09 3nn9 s PRO 459 Ca 0.28 0.43 -0.16 0.00 0.04 0.00 0.00 61.00 61.59 3nn9 s PRO 459 Cb -0.02 -1.99 0.09 0.00 0.04 0.00 0.00 34.50 32.63 3nn9 s PRO 459 CO -0.17 -1.26 1.69 0.22 0.04 0.00 0.00 177.00 177.52 3nn9 h ASP 460 N -0.82 -0.20 0.00 6.66 3.58 -1.94 -3.48 116.42 120.22 3nn9 h ASP 460 Ca -0.46 0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.09 3nn9 h ASP 460 Cb 1.27 0.17 0.00 0.00 1.72 0.00 0.00 39.33 42.49 3nn9 h ASP 460 CO 0.63 -0.06 0.00 0.61 -2.88 0.00 0.00 179.24 177.54 3nn9 n GLY 461 N -1.27 0.83 3.85 -0.78 0.00 -1.26 -4.76 105.19 101.80 3nn9 n GLY 461 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 3nn9 n GLY 461 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3nn9 s ALA 462 N -2.59 2.88 -0.32 4.61 0.00 -1.26 -4.91 121.76 120.18 3nn9 s ALA 462 Ca 0.00 -0.10 -0.06 0.00 0.00 0.00 0.00 51.96 51.80 3nn9 s ALA 462 Cb 0.00 -3.10 0.03 0.00 0.00 0.00 0.00 23.12 20.05 3nn9 s ALA 462 CO 0.00 -1.00 0.08 0.15 0.00 0.00 0.00 175.76 174.99 3nn9 s LYS 463 N -5.18 2.78 0.48 0.00 1.02 -1.26 -4.99 119.74 112.60 3nn9 s LYS 463 Ca 0.57 -1.06 0.22 0.00 0.02 0.00 0.00 55.97 55.72 3nn9 s LYS 463 Cb -0.12 -3.38 1.26 0.00 -0.52 0.00 0.00 37.83 35.07 3nn9 s LYS 463 CO 0.54 -0.57 1.93 0.82 -0.92 0.00 0.00 175.35 177.15 3nn9 h ILE 464 N 6.09 0.71 0.00 2.17 1.08 -2.02 -2.09 117.51 123.44 3nn9 h ILE 464 Ca -0.26 -0.07 0.00 0.00 -0.39 0.00 0.00 64.86 64.14 3nn9 h ILE 464 Cb 1.10 0.49 0.00 0.00 -3.07 0.00 0.00 36.82 35.34 3nn9 h ILE 464 CO 0.60 0.04 0.00 -0.33 -0.69 0.00 0.00 178.15 177.76 3nn9 h GLU 465 N 0.20 0.00 0.00 2.37 5.08 -2.01 0.60 114.58 120.82 3nn9 h GLU 465 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 3nn9 h GLU 465 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 3nn9 h GLU 465 CO -0.07 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 178.60 3nn9 n TYR 466 N -2.52 0.13 0.67 4.33 4.01 -0.79 -3.06 117.16 119.94 3nn9 n TYR 466 Ca -0.01 0.04 0.12 0.00 -0.16 0.00 0.00 57.90 57.89 3nn9 n TYR 466 Cb 0.09 -0.57 0.23 0.00 -0.31 0.00 0.00 39.34 38.78 3nn9 n TYR 466 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 3nn9 n PHE 467 N -1.61 0.31 0.95 -0.72 3.72 0.20 -5.13 117.46 115.19 3nn9 n PHE 467 Ca 0.06 -0.16 0.11 0.00 -0.05 0.00 0.00 57.45 57.42 3nn9 n PHE 467 Cb 0.31 0.00 0.10 0.00 -0.94 0.00 0.00 39.48 38.95 3nn9 n PHE 467 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99