#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qwg s ASP 83 N 0.00 3.54 0.32 0.55 1.01 -1.26 -4.88 116.67 115.95 2qwg s ASP 83 Ca 0.00 -0.99 -0.29 0.00 0.71 0.00 0.00 52.55 51.98 2qwg s ASP 83 Cb 0.00 -0.29 -0.11 0.00 1.01 0.00 0.00 42.92 43.54 2qwg s ASP 83 CO 0.00 0.06 1.46 -0.36 0.21 0.00 0.00 175.17 176.54 2qwg s PHE 84 N -2.32 2.81 0.31 4.23 0.08 -1.26 -4.22 117.98 117.61 2qwg s PHE 84 Ca 0.28 1.12 -0.28 0.00 0.12 0.00 0.00 56.93 58.16 2qwg s PHE 84 Cb -0.06 -3.91 -0.09 0.00 -0.57 0.00 0.00 43.02 38.39 2qwg s PHE 84 CO 0.14 -2.79 1.07 1.21 -0.10 0.00 0.00 175.22 174.74 2qwg s ASN 85 N 0.01 7.17 -0.05 1.36 2.47 -0.21 -4.72 114.94 120.97 2qwg s ASN 85 Ca 0.55 2.17 0.06 0.00 0.42 0.00 0.00 52.86 56.07 2qwg s ASN 85 Cb -0.44 -2.61 -0.01 0.00 -1.45 0.00 0.00 41.25 36.73 2qwg s ASN 85 CO 0.54 -0.21 -0.25 0.20 -3.72 0.00 0.00 177.10 173.66 2qwg s ASN 86 N -1.10 3.00 -1.20 -4.21 0.01 -1.26 -1.48 114.94 108.69 2qwg s ASN 86 Ca 0.48 -0.49 -0.21 0.00 -0.71 0.00 0.00 52.86 51.93 2qwg s ASN 86 Cb -0.29 -0.72 -0.02 0.00 0.41 0.00 0.00 41.25 40.64 2qwg s ASN 86 CO 0.36 0.25 1.83 -0.76 -1.51 0.00 0.00 177.10 177.28 2qwg s LEU 87 N -0.24 3.39 0.01 0.60 1.43 -1.26 -4.68 118.68 117.93 2qwg s LEU 87 Ca -0.01 -1.90 0.22 0.00 -1.03 0.00 0.00 54.13 51.42 2qwg s LEU 87 Cb -0.13 -2.58 -0.10 0.00 0.03 0.00 0.00 46.19 43.41 2qwg s LEU 87 CO 0.03 -2.24 0.90 0.35 0.23 0.00 0.00 176.35 175.61 2qwg n THR 88 N 7.22 0.07 -3.86 5.49 -2.24 -1.26 -0.01 114.28 119.69 2qwg n THR 88 Ca 0.45 -0.19 -0.21 0.00 -2.27 0.00 0.00 64.05 61.84 2qwg n THR 88 Cb 0.47 0.46 -0.03 0.00 -2.10 0.00 0.00 70.33 69.13 2qwg n THR 88 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2qwg s LYS 89 N -3.17 3.11 0.47 -0.78 1.02 -1.26 -4.63 119.74 114.48 2qwg s LYS 89 Ca 0.03 -0.99 0.07 0.00 0.02 0.00 0.00 55.97 55.10 2qwg s LYS 89 Cb 0.15 -2.72 0.03 0.00 -0.52 0.00 0.00 37.83 34.77 2qwg s LYS 89 CO 0.84 0.28 0.64 0.20 -0.92 0.00 0.00 175.35 176.39 2qwg s GLY 90 N -3.99 1.90 0.54 -3.33 0.00 -1.26 -0.34 107.32 100.83 2qwg s GLY 90 Ca 0.38 -1.67 -0.19 0.00 0.00 0.00 0.00 44.72 43.23 2qwg s GLY 90 CO 0.28 -1.43 1.09 1.08 0.00 0.00 0.00 173.10 174.12 2qwg s LEU 91 N -4.47 3.73 0.66 0.66 1.43 -1.26 -0.94 118.68 118.49 2qwg s LEU 91 Ca 0.56 2.06 -0.11 0.00 -1.03 0.00 0.00 54.13 55.61 2qwg s LEU 91 Cb -0.09 -4.57 -0.01 0.00 0.03 0.00 0.00 46.19 41.54 2qwg s LEU 91 CO 0.35 -1.11 1.05 0.00 0.23 0.00 0.00 176.35 176.86 2qwg s THR 93 N -3.05 3.71 -0.54 0.00 2.01 -1.26 -4.83 115.64 111.68 2qwg s THR 93 Ca 0.57 1.18 -0.18 0.00 0.31 0.00 0.00 61.69 63.57 2qwg s THR 93 Cb -0.13 -3.76 0.09 0.00 0.01 0.00 0.00 72.50 68.71 2qwg s THR 93 CO 0.53 0.05 0.62 -0.63 -0.69 0.00 0.00 174.62 174.51 2qwg s ILE 94 N 1.59 4.92 -0.33 1.82 1.01 -1.26 -4.06 121.20 124.88 2qwg s ILE 94 Ca 0.62 -0.88 0.20 0.00 0.00 0.00 0.00 60.65 60.60 2qwg s ILE 94 Cb -0.32 -4.37 -0.29 0.00 0.01 0.00 0.00 42.46 37.49 2qwg s ILE 94 CO 0.28 -0.93 0.58 0.59 0.00 0.00 0.00 174.94 175.46 2qwg n ASN 95 N 6.05 0.51 -3.41 3.58 5.03 -0.37 -5.01 115.26 121.64 2qwg n ASN 95 Ca -0.09 -0.32 0.01 0.00 0.87 0.00 0.00 54.58 55.05 2qwg n ASN 95 Cb 0.43 1.63 0.01 0.00 -1.02 0.00 0.00 39.78 40.84 2qwg n ASN 95 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 2qwg n SER 96 N -1.97 -1.20 -4.10 6.41 3.41 -1.06 -4.58 113.62 110.53 2qwg n SER 96 Ca -0.01 -1.38 -0.27 0.00 -0.26 0.00 0.00 58.87 56.95 2qwg n SER 96 Cb 0.46 1.89 -0.17 0.00 -0.26 0.00 0.00 64.21 66.13 2qwg n SER 96 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 2qwg s TRP 97 N -2.23 1.86 0.21 7.33 0.52 -1.26 -0.33 118.94 125.04 2qwg s TRP 97 Ca 0.25 -0.70 0.07 0.00 0.02 0.00 0.00 56.10 55.74 2qwg s TRP 97 Cb -0.01 -1.30 -0.04 0.00 -1.15 0.00 0.00 33.47 30.97 2qwg s TRP 97 CO 0.01 -0.31 0.12 -3.38 0.02 0.00 0.00 176.95 173.41 2qwg s HIS 98 N 0.47 3.03 0.21 -1.98 -3.43 0.62 -4.91 115.29 109.31 2qwg s HIS 98 Ca -0.15 -0.10 -0.30 0.00 -0.80 0.00 0.00 55.06 53.71 2qwg s HIS 98 Cb -0.16 -1.41 -0.09 0.00 -1.43 0.00 0.00 32.58 29.49 2qwg s HIS 98 CO 0.05 0.53 1.38 -1.50 -2.00 0.00 0.00 174.74 173.21 2qwg s ILE 99 N -1.98 2.96 -0.04 -5.38 1.10 -1.26 -1.77 121.20 114.83 2qwg s ILE 99 Ca 0.31 0.78 -0.04 0.00 -0.51 0.00 0.00 60.65 61.19 2qwg s ILE 99 Cb -0.09 -3.50 -0.03 0.00 0.15 0.00 0.00 42.46 39.00 2qwg s ILE 99 CO 0.23 0.11 -0.10 0.00 -2.11 0.00 0.00 174.94 173.07 2qwg n TYR 100 N 2.69 0.00 -3.72 3.50 9.36 -0.10 -4.82 117.16 124.07 2qwg n TYR 100 Ca 0.07 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.15 2qwg n TYR 100 Cb 0.41 -0.23 -0.08 0.00 -0.63 0.00 0.00 39.34 38.82 2qwg n TYR 100 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 2qwg s GLY 101 N -4.80 -0.22 -0.22 2.98 0.00 -0.87 -4.99 107.32 99.20 2qwg s GLY 101 Ca -0.10 0.46 -0.12 0.00 0.00 0.00 0.00 44.72 44.96 2qwg s GLY 101 CO 0.13 0.22 0.53 1.25 0.00 0.00 0.00 173.10 175.24 2qwg s LYS 102 N -1.44 0.53 -0.00 2.90 2.20 -1.26 -0.11 119.74 122.55 2qwg s LYS 102 Ca -0.12 1.00 0.18 0.00 -0.36 0.00 0.00 55.97 56.66 2qwg s LYS 102 Cb -0.04 0.07 -0.20 0.00 -1.51 0.00 0.00 37.83 36.15 2qwg s LYS 102 CO 0.04 -0.16 0.75 -0.40 -0.36 0.00 0.00 175.35 175.23 2qwg n ASP 103 N 4.33 0.85 -4.04 1.43 5.68 -0.88 -4.64 116.55 119.28 2qwg n ASP 103 Ca -0.21 -0.89 -0.33 0.00 -0.50 0.00 0.00 54.79 52.86 2qwg n ASP 103 Cb 0.57 1.04 -0.02 0.00 -1.14 0.00 0.00 41.12 41.56 2qwg n ASP 103 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2qwg n ASN 104 N -1.46 -3.34 -0.16 -1.12 3.02 -1.26 -4.26 115.26 106.68 2qwg n ASN 104 Ca 0.03 -0.87 -0.04 0.00 -0.03 0.00 0.00 54.58 53.67 2qwg n ASN 104 Cb 0.29 -2.75 0.05 0.00 -0.61 0.00 0.00 39.78 36.76 2qwg n ASN 104 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qwg h ALA 105 N 0.93 0.61 -0.53 5.41 0.00 -1.90 -1.51 119.26 122.27 2qwg h ALA 105 Ca -0.55 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.28 2qwg h ALA 105 Cb 1.36 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 2qwg h ALA 105 CO 0.72 -0.14 -0.14 0.28 0.00 0.00 0.00 179.25 179.97 2qwg h VAL 106 N 0.43 1.27 0.63 0.00 2.07 -1.89 0.17 116.25 118.93 2qwg h VAL 106 Ca 0.22 -1.30 -0.03 0.00 0.82 0.00 0.00 66.70 66.41 2qwg h VAL 106 Cb 0.16 1.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.94 2qwg h VAL 106 CO -0.18 0.46 -0.30 0.03 0.02 0.00 0.00 177.57 177.60 2qwg h ARG 107 N 0.91 -0.81 -0.77 1.57 3.08 -1.80 -2.85 114.38 113.71 2qwg h ARG 107 Ca 0.13 0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.20 2qwg h ARG 107 Cb 0.71 0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.91 2qwg h ARG 107 CO 0.05 -0.54 0.33 0.82 -1.07 0.00 0.00 179.97 179.57 2qwg h ILE 108 N -0.86 1.25 0.00 2.04 2.04 -1.27 -2.75 117.51 117.95 2qwg h ILE 108 Ca -0.09 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.01 2qwg h ILE 108 Cb 0.65 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.04 2qwg h ILE 108 CO 0.14 0.31 0.00 0.61 0.00 0.00 0.00 178.15 179.22 2qwg n GLY 109 N -0.96 -0.76 0.25 5.37 0.00 0.58 -2.08 105.19 107.59 2qwg n GLY 109 Ca 0.07 -0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.15 2qwg n GLY 109 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2qwg h GLU 110 N 0.00 0.00 -0.57 1.61 4.22 -1.25 -3.30 114.58 115.29 2qwg h GLU 110 Ca 0.00 0.00 -0.28 0.00 0.08 0.00 0.00 59.36 59.16 2qwg h GLU 110 Cb 0.14 0.00 -0.36 0.00 0.50 0.00 0.00 28.75 29.04 2qwg h GLU 110 CO 0.00 0.16 -1.01 -3.47 -2.18 0.00 0.00 179.01 172.50 2qwg n ASP 111 N -3.66 0.97 -3.60 1.04 2.03 -0.88 -4.95 116.55 107.49 2qwg n ASP 111 Ca -0.02 -2.33 -0.06 0.00 0.52 0.00 0.00 54.79 52.90 2qwg n ASP 111 Cb 0.28 -0.27 -0.02 0.00 -0.72 0.00 0.00 41.12 40.39 2qwg n ASP 111 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2qwg s SER 112 N -3.10 -0.28 -1.16 1.67 1.04 -1.21 -5.08 113.70 105.59 2qwg s SER 112 Ca 0.25 -0.15 -0.18 0.00 0.48 0.00 0.00 55.95 56.35 2qwg s SER 112 Cb 0.39 0.41 -0.05 0.00 0.10 0.00 0.00 66.02 66.88 2qwg s SER 112 CO -0.02 -0.71 2.08 0.47 0.98 0.00 0.00 173.24 176.03 2qwg n ASP 113 N -0.33 3.32 -4.71 7.02 8.00 -1.26 -4.63 116.55 123.96 2qwg n ASP 113 Ca -0.08 -2.77 -0.35 0.00 0.71 0.00 0.00 54.79 52.30 2qwg n ASP 113 Cb 0.61 -1.44 -0.08 0.00 -0.02 0.00 0.00 41.12 40.19 2qwg n ASP 113 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2qwg s VAL 114 N 4.21 5.32 0.46 2.53 1.01 -1.26 -0.68 120.40 131.99 2qwg s VAL 114 Ca 0.52 0.16 -0.23 0.00 0.00 0.00 0.00 61.98 62.43 2qwg s VAL 114 Cb 0.13 -3.43 -0.07 0.00 0.00 0.00 0.00 36.38 33.01 2qwg s VAL 114 CO 0.01 0.44 1.15 -0.76 0.00 0.00 0.00 175.10 175.94 2qwg s LEU 115 N 0.41 4.01 0.12 3.92 1.43 0.91 -1.37 118.68 128.12 2qwg s LEU 115 Ca 0.07 2.27 -0.30 0.00 -1.03 0.00 0.00 54.13 55.14 2qwg s LEU 115 Cb -0.11 -4.25 -0.06 0.00 0.03 0.00 0.00 46.19 41.79 2qwg s LEU 115 CO -0.01 -0.88 0.97 -0.69 0.23 0.00 0.00 176.35 175.96 2qwg s VAL 116 N -1.57 4.46 0.25 -1.59 1.01 -0.26 -4.68 120.40 118.01 2qwg s VAL 116 Ca 0.63 2.05 0.06 0.00 0.00 0.00 0.00 61.98 64.72 2qwg s VAL 116 Cb -0.27 -4.31 -0.02 0.00 0.00 0.00 0.00 36.38 31.77 2qwg s VAL 116 CO 0.33 0.32 0.21 0.35 0.00 0.00 0.00 175.10 176.32 2qwg n THR 117 N 2.74 0.00 -3.69 3.92 -2.24 -1.26 -0.45 114.28 113.31 2qwg n THR 117 Ca 0.02 -1.80 0.01 0.00 -2.27 0.00 0.00 64.05 60.01 2qwg n THR 117 Cb 0.49 0.90 -0.00 0.00 -2.10 0.00 0.00 70.33 69.62 2qwg n THR 117 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2qwg s ARG 118 N -3.00 0.58 -1.26 -0.78 0.52 -1.02 -3.72 118.95 110.28 2qwg s ARG 118 Ca 0.29 -0.33 -0.02 0.00 -0.52 0.00 0.00 55.73 55.15 2qwg s ARG 118 Cb 0.01 0.19 -0.01 0.00 0.52 0.00 0.00 34.95 35.67 2qwg s ARG 118 CO 0.21 -0.27 0.76 0.39 0.02 0.00 0.00 175.30 176.41 2qwg n GLU 119 N -0.53 -4.61 -1.90 3.54 4.71 -1.26 -1.52 120.64 119.07 2qwg n GLU 119 Ca -0.07 0.65 -0.29 0.00 -0.01 0.00 0.00 57.16 57.44 2qwg n GLU 119 Cb 0.62 -5.23 0.10 0.00 -1.01 0.00 0.00 31.44 25.92 2qwg n GLU 119 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 2qwg s PRO 120 N -5.78 1.85 0.15 3.49 0.04 -1.26 -3.90 135.00 129.59 2qwg s PRO 120 Ca 0.07 0.07 -0.19 0.00 0.04 0.00 0.00 61.00 61.00 2qwg s PRO 120 Cb -0.02 -1.94 0.07 0.00 0.04 0.00 0.00 34.50 32.65 2qwg s PRO 120 CO 0.80 -1.67 0.89 2.48 0.04 0.00 0.00 177.00 179.54 2qwg n TYR 121 N -3.36 -1.21 -4.18 0.56 4.11 -0.09 -4.83 117.16 108.16 2qwg n TYR 121 Ca 0.09 -1.07 -0.16 0.00 -0.00 0.00 0.00 57.90 56.75 2qwg n TYR 121 Cb 0.61 0.52 -0.12 0.00 -0.00 0.00 0.00 39.34 40.34 2qwg n TYR 121 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.86 176.94 2qwg s VAL 122 N -2.13 0.79 -0.19 -3.48 1.01 -1.26 -1.04 120.40 114.10 2qwg s VAL 122 Ca 0.20 -0.98 -0.19 0.00 0.00 0.00 0.00 61.98 61.01 2qwg s VAL 122 Cb -0.02 -0.77 0.05 0.00 0.00 0.00 0.00 36.38 35.64 2qwg s VAL 122 CO 0.05 -0.17 0.54 -0.55 0.00 0.00 0.00 175.10 174.96 2qwg s SER 123 N -1.28 -0.55 0.09 3.32 0.15 -0.76 -4.52 113.70 110.14 2qwg s SER 123 Ca -0.04 1.04 0.04 0.00 0.70 0.00 0.00 55.95 57.70 2qwg s SER 123 Cb -0.08 1.06 -0.04 0.00 -1.71 0.00 0.00 66.02 65.24 2qwg s SER 123 CO 0.01 -0.21 0.03 0.00 1.20 0.00 0.00 173.24 174.27 2qwg s ASP 125 N -2.39 4.89 0.58 0.00 1.11 0.15 -4.33 116.67 116.69 2qwg s ASP 125 Ca 0.27 -0.90 0.31 0.00 0.18 0.00 0.00 52.55 52.42 2qwg s ASP 125 Cb -0.12 -0.29 1.79 0.00 1.07 0.00 0.00 42.92 45.37 2qwg s ASP 125 CO 0.20 -0.78 2.21 -0.65 1.18 0.00 0.00 175.17 177.33 2qwg h PRO 126 N 0.97 0.00 -0.01 8.23 0.11 -1.96 -3.14 132.00 136.20 2qwg h PRO 126 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2qwg h PRO 126 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2qwg h PRO 126 CO 0.58 0.04 0.00 -0.40 -0.21 0.00 0.00 178.00 178.01 2qwg n ASP 127 N -3.65 1.61 -3.59 -2.05 5.75 -1.26 -4.91 116.55 108.44 2qwg n ASP 127 Ca -0.03 -1.58 -0.12 0.00 -0.01 0.00 0.00 54.79 53.05 2qwg n ASP 127 Cb 0.13 -0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.16 2qwg n ASP 127 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 2qwg s GLU 128 N -0.59 0.66 -0.08 0.11 2.12 -1.19 -5.16 118.70 114.58 2qwg s GLU 128 Ca 0.01 0.36 0.03 0.00 0.36 0.00 0.00 54.97 55.72 2qwg s GLU 128 Cb 0.00 0.32 -0.02 0.00 0.26 0.00 0.00 34.13 34.69 2qwg s GLU 128 CO 0.00 -0.17 -0.15 0.00 -0.54 0.00 0.00 175.26 174.41 2qwg s ARG 130 N -0.34 0.81 0.31 0.00 0.52 -0.64 -3.66 118.95 115.94 2qwg s ARG 130 Ca 0.03 -1.19 -0.15 0.00 -0.52 0.00 0.00 55.73 53.91 2qwg s ARG 130 Cb -0.13 -0.37 -0.09 0.00 0.52 0.00 0.00 34.95 34.88 2qwg s ARG 130 CO 0.02 0.04 0.72 -0.06 0.02 0.00 0.00 175.30 176.04 2qwg s PHE 131 N -2.80 3.40 0.08 -0.53 0.08 -0.50 -1.84 117.98 115.86 2qwg s PHE 131 Ca 0.06 1.20 0.02 0.00 0.12 0.00 0.00 56.93 58.33 2qwg s PHE 131 Cb -0.00 -2.51 -0.04 0.00 -0.57 0.00 0.00 43.02 39.90 2qwg s PHE 131 CO -0.02 0.13 -0.07 0.71 -0.10 0.00 0.00 175.22 175.87 2qwg s TYR 132 N -1.94 0.82 -0.08 0.36 1.51 -0.20 -0.87 117.35 116.95 2qwg s TYR 132 Ca 0.53 -0.75 -0.32 0.00 -1.01 0.00 0.00 57.07 55.52 2qwg s TYR 132 Cb -0.11 -0.48 0.14 0.00 -0.11 0.00 0.00 41.96 41.40 2qwg s TYR 132 CO 0.18 -0.12 1.35 0.00 -1.11 0.00 0.00 175.55 175.85 2qwg s ALA 133 N -2.73 -2.32 -0.51 3.71 0.00 -0.75 -0.91 121.76 118.24 2qwg s ALA 133 Ca 0.03 0.97 -0.17 0.00 0.00 0.00 0.00 51.96 52.79 2qwg s ALA 133 Cb -0.01 0.21 0.08 0.00 0.00 0.00 0.00 23.12 23.40 2qwg s ALA 133 CO -0.03 -0.98 0.53 -0.51 0.00 0.00 0.00 175.76 174.78 2qwg s LEU 134 N -2.84 5.46 0.82 0.00 1.43 -0.58 -0.98 118.68 121.99 2qwg s LEU 134 Ca 0.14 -1.28 -0.11 0.00 -1.03 0.00 0.00 54.13 51.85 2qwg s LEU 134 Cb 0.05 -2.29 0.08 0.00 0.03 0.00 0.00 46.19 44.07 2qwg s LEU 134 CO -0.05 -0.83 1.12 -0.55 0.23 0.00 0.00 176.35 176.27 2qwg s SER 135 N 2.93 3.95 0.00 2.29 0.15 -0.30 -2.43 113.70 120.28 2qwg s SER 135 Ca 0.09 1.99 0.15 0.00 0.70 0.00 0.00 55.95 58.88 2qwg s SER 135 Cb -0.23 -2.54 0.29 0.00 -1.71 0.00 0.00 66.02 61.82 2qwg s SER 135 CO 0.08 -2.41 1.18 0.00 1.20 0.00 0.00 173.24 173.29 2qwg n GLN 136 N -3.68 2.08 -3.20 5.44 1.13 0.41 -3.08 117.38 116.48 2qwg n GLN 136 Ca 0.10 -1.88 -0.15 0.00 -1.94 0.00 0.00 57.00 53.13 2qwg n GLN 136 Cb 0.52 -1.33 0.05 0.00 0.11 0.00 0.00 30.24 29.60 2qwg n GLN 136 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2qwg n GLY 137 N 0.85 -0.05 3.54 1.08 0.00 -1.11 -4.61 105.19 104.89 2qwg n GLY 137 Ca 0.13 -0.06 -0.08 0.00 0.00 0.00 0.00 46.02 46.01 2qwg n GLY 137 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2qwg s THR 138 N -3.22 0.00 0.59 2.61 -1.32 -1.26 -5.05 115.64 107.99 2qwg s THR 138 Ca 0.34 0.00 -0.07 0.00 -1.21 0.00 0.00 61.69 60.75 2qwg s THR 138 Cb -0.15 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 69.83 2qwg s THR 138 CO 0.49 0.00 0.92 0.42 -2.21 0.00 0.00 174.62 174.23 2qwg s THR 139 N -2.58 4.04 0.16 5.08 -4.23 -1.26 -1.10 115.64 115.75 2qwg s THR 139 Ca 0.05 0.22 -0.12 0.00 -1.18 0.00 0.00 61.69 60.66 2qwg s THR 139 Cb -0.01 -3.60 0.04 0.00 1.34 0.00 0.00 72.50 70.27 2qwg s THR 139 CO -0.06 -0.66 1.64 0.40 -0.54 0.00 0.00 174.62 175.40 2qwg h ILE 140 N -0.17 1.26 0.00 2.99 2.04 -1.49 -2.81 117.51 119.32 2qwg h ILE 140 Ca -0.46 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 64.40 2qwg h ILE 140 Cb 1.24 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 2qwg h ILE 140 CO 0.61 0.36 0.00 0.54 0.00 0.00 0.00 178.15 179.67 2qwg n ARG 141 N -4.33 0.24 -2.10 2.37 5.12 -1.26 -4.74 116.66 111.96 2qwg n ARG 141 Ca 0.02 0.21 -0.35 0.00 -1.93 0.00 0.00 57.85 55.80 2qwg n ARG 141 Cb 0.28 -1.79 0.02 0.00 -1.16 0.00 0.00 32.46 29.81 2qwg n ARG 141 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2qwg s GLY 142 N -3.54 2.60 0.52 -0.13 0.00 -1.06 -4.93 107.32 100.79 2qwg s GLY 142 Ca 0.10 0.85 0.23 0.00 0.00 0.00 0.00 44.72 45.90 2qwg s GLY 142 CO 0.58 1.22 2.12 0.50 0.00 0.00 0.00 173.10 177.52 2qwg h LYS 143 N 0.92 0.00 0.00 2.90 1.57 -1.90 -1.71 116.57 118.35 2qwg h LYS 143 Ca -0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 2qwg h LYS 143 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.58 2qwg h LYS 143 CO 0.56 0.08 0.00 0.72 -0.57 0.00 0.00 179.45 180.24 2qwg n HIS 144 N -4.04 0.00 0.34 -1.35 8.25 -1.26 -2.29 115.22 114.88 2qwg n HIS 144 Ca -0.03 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.58 2qwg n HIS 144 Cb 0.17 -0.09 0.57 0.00 1.12 0.00 0.00 29.99 31.76 2qwg n HIS 144 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2qwg h SER 145 N 0.00 0.00 -2.61 0.41 4.64 -1.48 -3.43 113.55 111.08 2qwg h SER 145 Ca 0.00 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.77 2qwg h SER 145 Cb 0.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 2qwg h SER 145 CO 0.00 0.00 1.13 0.21 -0.87 0.00 0.00 176.83 177.30 2qwg s ASN 146 N -5.06 6.49 0.00 4.97 3.84 -0.97 -2.39 114.94 121.81 2qwg s ASN 146 Ca 0.03 2.04 0.00 0.00 0.21 0.00 0.00 52.86 55.14 2qwg s ASN 146 Cb 0.09 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 38.26 2qwg s ASN 146 CO 0.49 -1.10 0.00 0.61 -2.79 0.00 0.00 177.10 174.30 2qwg n GLY 147 N 4.43 0.52 0.00 1.21 0.00 -0.60 -4.97 105.19 105.77 2qwg n GLY 147 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2qwg n GLY 147 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qwg n THR 148 N -1.34 0.00 0.18 2.61 -2.24 -1.01 -2.03 114.28 110.45 2qwg n THR 148 Ca 0.00 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.82 2qwg n THR 148 Cb 0.00 -0.75 0.33 0.00 -2.10 0.00 0.00 70.33 67.81 2qwg n THR 148 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 2qwg h ILE 149 N 0.00 1.01 -3.95 2.28 2.10 -1.84 -3.39 117.51 113.71 2qwg h ILE 149 Ca 0.00 -1.55 -0.53 0.00 1.08 0.00 0.00 64.86 63.85 2qwg h ILE 149 Cb 0.00 1.91 0.10 0.00 -1.09 0.00 0.00 36.82 37.74 2qwg h ILE 149 CO 0.00 0.40 0.68 -1.00 -1.08 0.00 0.00 178.15 177.15 2qwg s HIS 150 N -3.70 2.66 0.00 2.19 3.76 -0.86 -4.98 115.29 114.36 2qwg s HIS 150 Ca -0.01 1.30 -0.17 0.00 -0.15 0.00 0.00 55.06 56.04 2qwg s HIS 150 Cb 0.12 -3.84 -0.34 0.00 1.11 0.00 0.00 32.58 29.62 2qwg s HIS 150 CO 0.70 -2.57 0.94 -0.44 -0.85 0.00 0.00 174.74 172.52 2qwg h ASP 151 N 2.70 0.74 -3.57 1.40 3.32 -1.91 -3.45 116.42 115.64 2qwg h ASP 151 Ca -0.50 -0.93 -0.59 0.00 0.02 0.00 0.00 57.03 55.03 2qwg h ASP 151 Cb 1.25 -0.24 -0.38 0.00 0.22 0.00 0.00 39.33 40.17 2qwg h ASP 151 CO 0.63 1.65 -0.78 -0.13 -1.72 0.00 0.00 179.24 178.88 2qwg s ARG 152 N -2.56 1.45 0.24 3.56 0.52 -1.26 -4.88 118.95 116.02 2qwg s ARG 152 Ca -0.11 -0.89 0.01 0.00 -0.52 0.00 0.00 55.73 54.22 2qwg s ARG 152 Cb 0.03 -2.50 -0.04 0.00 0.52 0.00 0.00 34.95 32.96 2qwg s ARG 152 CO 0.91 -0.60 0.12 -1.54 0.02 0.00 0.00 175.30 174.21 2qwg s SER 153 N 1.48 0.80 0.00 0.23 1.04 -1.26 -5.02 113.70 110.97 2qwg s SER 153 Ca -0.05 -1.42 0.26 0.00 0.48 0.00 0.00 55.95 55.23 2qwg s SER 153 Cb -0.19 0.29 1.45 0.00 0.10 0.00 0.00 66.02 67.68 2qwg s SER 153 CO -0.06 -0.81 1.92 0.00 0.98 0.00 0.00 173.24 175.27 2qwg n GLN 154 N -0.40 0.60 -0.10 4.02 3.00 -1.26 -3.42 117.38 119.81 2qwg n GLN 154 Ca 0.01 0.02 0.12 0.00 -0.01 0.00 0.00 57.00 57.14 2qwg n GLN 154 Cb 0.66 -1.50 0.21 0.00 0.00 0.00 0.00 30.24 29.61 2qwg n GLN 154 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 2qwg n TYR 155 N -1.15 0.27 -3.04 1.08 4.01 -1.26 -4.95 117.16 112.12 2qwg n TYR 155 Ca 0.16 -0.14 -0.28 0.00 -0.16 0.00 0.00 57.90 57.48 2qwg n TYR 155 Cb 0.15 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.16 2qwg n TYR 155 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2qwg s ARG 156 N -1.73 3.63 -0.09 -0.72 0.52 -1.22 -2.76 118.95 116.58 2qwg s ARG 156 Ca 0.34 0.13 -0.31 0.00 -0.52 0.00 0.00 55.73 55.38 2qwg s ARG 156 Cb 0.21 -2.51 0.09 0.00 0.52 0.00 0.00 34.95 33.26 2qwg s ARG 156 CO 0.31 0.04 0.79 0.00 0.02 0.00 0.00 175.30 176.45 2qwg s ALA 157 N -2.35 -1.82 -0.09 2.13 0.00 -1.15 -2.50 121.76 115.97 2qwg s ALA 157 Ca 0.46 1.42 -0.29 0.00 0.00 0.00 0.00 51.96 53.54 2qwg s ALA 157 Cb -0.10 -0.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.75 2qwg s ALA 157 CO 0.35 -0.35 1.00 -1.17 0.00 0.00 0.00 175.76 175.58 2qwg s LEU 158 N -1.14 4.26 0.14 0.00 2.96 0.89 -1.15 118.68 124.65 2qwg s LEU 158 Ca -0.08 1.54 0.08 0.00 -0.22 0.00 0.00 54.13 55.45 2qwg s LEU 158 Cb -0.00 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.10 2qwg s LEU 158 CO 0.07 -0.41 -0.18 0.27 -1.32 0.00 0.00 176.35 174.78 2qwg s ILE 159 N 1.85 1.66 0.12 6.68 -4.36 -0.15 -0.49 121.20 126.52 2qwg s ILE 159 Ca 0.49 -1.78 0.05 0.00 -0.26 0.00 0.00 60.65 59.14 2qwg s ILE 159 Cb -0.19 -1.69 -0.04 0.00 1.25 0.00 0.00 42.46 41.79 2qwg s ILE 159 CO 0.19 -0.29 -0.12 -0.94 0.24 0.00 0.00 174.94 174.02 2qwg s SER 160 N -2.45 1.81 0.20 4.36 1.04 0.76 -1.81 113.70 117.62 2qwg s SER 160 Ca 0.12 -0.85 -0.19 0.00 0.48 0.00 0.00 55.95 55.51 2qwg s SER 160 Cb -0.06 -0.04 0.04 0.00 0.10 0.00 0.00 66.02 66.05 2qwg s SER 160 CO 0.05 -0.21 0.57 -1.66 0.98 0.00 0.00 173.24 172.96 2qwg s TRP 161 N -2.45 -0.22 0.43 5.02 -2.14 -0.05 -0.31 118.94 119.22 2qwg s TRP 161 Ca 0.09 -0.11 -0.26 0.00 2.66 0.00 0.00 56.10 58.49 2qwg s TRP 161 Cb -0.03 0.47 -0.09 0.00 -3.10 0.00 0.00 33.47 30.72 2qwg s TRP 161 CO 0.02 -0.94 1.45 -2.30 -2.66 0.00 0.00 176.95 172.51 2qwg n PRO 162 N -0.36 2.35 -1.60 3.25 -0.02 -1.26 -1.42 135.00 135.94 2qwg n PRO 162 Ca -0.11 0.83 -0.52 0.00 -2.02 0.00 0.00 63.50 61.69 2qwg n PRO 162 Cb 0.63 -2.64 -0.06 0.00 -0.02 0.00 0.00 33.50 31.41 2qwg n PRO 162 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2qwg n LEU 163 N -0.04 1.75 0.00 2.45 7.94 -1.24 -1.60 117.00 126.26 2qwg n LEU 163 Ca 0.04 1.12 0.00 0.00 -1.11 0.00 0.00 56.01 56.06 2qwg n LEU 163 Cb 0.41 -1.21 0.00 0.00 0.53 0.00 0.00 43.42 43.15 2qwg n LEU 163 CO 0.60 -0.99 0.00 -1.20 -1.11 0.00 0.00 177.39 174.69 2qwg n SER 164 N 2.58 -1.25 -4.91 1.96 7.64 -1.26 -5.00 113.62 113.37 2qwg n SER 164 Ca 0.18 0.00 -0.27 0.00 1.01 0.00 0.00 58.87 59.79 2qwg n SER 164 Cb 0.20 -1.55 0.02 0.00 -1.01 0.00 0.00 64.21 61.87 2qwg n SER 164 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2qwg s SER 165 N -2.34 5.79 0.52 6.43 0.01 -0.63 -4.21 113.70 119.27 2qwg s SER 165 Ca 0.00 0.77 -0.06 0.00 1.31 0.00 0.00 55.95 57.98 2qwg s SER 165 Cb 0.00 -1.86 -0.03 0.00 0.21 0.00 0.00 66.02 64.35 2qwg s SER 165 CO 0.00 -0.92 0.83 -2.16 0.41 0.00 0.00 173.24 171.40 2qwg s PRO 166 N -4.92 3.39 -0.87 12.44 0.04 -1.26 -4.68 135.00 139.14 2qwg s PRO 166 Ca 0.52 0.18 -0.25 0.00 0.04 0.00 0.00 61.00 61.50 2qwg s PRO 166 Cb -0.10 -2.33 0.01 0.00 0.04 0.00 0.00 34.50 32.12 2qwg s PRO 166 CO 0.45 -0.36 1.57 -1.25 0.04 0.00 0.00 177.00 177.45 2qwg s PRO 167 N -4.84 3.14 0.38 0.56 0.04 -1.26 -4.90 135.00 128.11 2qwg s PRO 167 Ca 0.50 -0.48 0.04 0.00 0.04 0.00 0.00 61.00 61.09 2qwg s PRO 167 Cb -0.10 -4.86 -0.01 0.00 0.04 0.00 0.00 34.50 29.57 2qwg s PRO 167 CO 0.46 -2.51 0.55 0.95 0.04 0.00 0.00 177.00 176.48 2qwg s THR 168 N 6.82 4.11 0.47 1.26 -4.23 -1.26 -0.06 115.64 122.75 2qwg s THR 168 Ca 0.51 -0.78 0.14 0.00 -1.18 0.00 0.00 61.69 60.38 2qwg s THR 168 Cb -0.05 -3.47 0.21 0.00 1.34 0.00 0.00 72.50 70.54 2qwg s THR 168 CO 0.03 -0.24 2.04 0.58 -0.54 0.00 0.00 174.62 176.49 2qwg h VAL 169 N 0.70 1.09 0.00 2.29 2.07 -1.25 -2.71 116.25 118.43 2qwg h VAL 169 Ca -0.46 -0.40 -0.00 0.00 0.82 0.00 0.00 66.70 66.65 2qwg h VAL 169 Cb 1.25 1.18 -0.00 0.00 -1.52 0.00 0.00 31.29 32.20 2qwg h VAL 169 CO 0.55 0.12 -1.04 -1.22 0.02 0.00 0.00 177.57 176.00 2qwg n TYR 69 N -4.40 0.95 0.24 1.57 4.01 -1.26 -4.32 117.16 113.95 2qwg n TYR 69 Ca -0.02 0.28 0.03 0.00 -0.16 0.00 0.00 57.90 58.02 2qwg n TYR 69 Cb 0.19 -0.95 0.03 0.00 -0.31 0.00 0.00 39.34 38.29 2qwg n TYR 69 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2qwg n ASN 170 N -2.67 1.58 -4.72 7.72 2.04 -1.18 -5.02 115.26 113.02 2qwg n ASN 170 Ca -0.00 -1.30 -0.40 0.00 -0.44 0.00 0.00 54.58 52.43 2qwg n ASN 170 Cb 0.55 -0.01 -0.04 0.00 -2.53 0.00 0.00 39.78 37.75 2qwg n ASN 170 CO 0.00 0.00 0.00 -0.44 -0.44 0.00 0.00 177.26 176.38 2qwg s SER 171 N -0.55 7.08 -0.21 0.53 0.01 -1.03 -4.61 113.70 114.91 2qwg s SER 171 Ca 0.08 1.30 -0.06 0.00 1.31 0.00 0.00 55.95 58.57 2qwg s SER 171 Cb 0.05 -2.45 -0.03 0.00 0.21 0.00 0.00 66.02 63.81 2qwg s SER 171 CO 0.08 -0.13 0.03 -0.60 0.41 0.00 0.00 173.24 173.03 2qwg s ARG 172 N 0.77 3.68 -0.13 12.44 3.52 0.57 -4.90 118.95 134.91 2qwg s ARG 172 Ca 0.40 -0.48 -0.29 0.00 -0.13 0.00 0.00 55.73 55.23 2qwg s ARG 172 Cb -0.19 -3.17 -0.01 0.00 -1.56 0.00 0.00 34.95 30.03 2qwg s ARG 172 CO 0.20 -0.01 1.02 0.08 -0.81 0.00 0.00 175.30 175.79 2qwg s VAL 173 N 1.08 4.74 -0.05 7.11 1.01 -1.26 -0.17 120.40 132.87 2qwg s VAL 173 Ca 0.03 2.03 0.01 0.00 0.00 0.00 0.00 61.98 64.04 2qwg s VAL 173 Cb -0.14 -4.30 -0.26 0.00 0.00 0.00 0.00 36.38 31.68 2qwg s VAL 173 CO 0.02 -0.04 0.65 -0.33 0.00 0.00 0.00 175.10 175.40 2qwg h GLU 174 N 7.19 0.17 -1.11 2.72 4.39 -1.13 -3.48 114.58 123.33 2qwg h GLU 174 Ca -0.28 -0.30 0.36 0.00 0.34 0.00 0.00 59.36 59.48 2qwg h GLU 174 Cb 1.13 0.11 -0.16 0.00 -0.10 0.00 0.00 28.75 29.73 2qwg h GLU 174 CO 0.88 0.96 0.96 0.00 -1.16 0.00 0.00 179.01 180.65 2qwg s ILE 176 N -2.10 5.33 0.00 0.00 -1.09 -1.26 -0.07 121.20 122.01 2qwg s ILE 176 Ca 0.14 0.45 0.00 0.00 -2.23 0.00 0.00 60.65 59.01 2qwg s ILE 176 Cb 0.04 -3.57 0.00 0.00 -1.58 0.00 0.00 42.46 37.35 2qwg s ILE 176 CO -0.05 0.44 0.00 0.61 -1.23 0.00 0.00 174.94 174.71 2qwg n GLY 177 N 3.12 -0.06 0.08 6.18 0.00 -1.04 -4.43 105.19 109.04 2qwg n GLY 177 Ca -0.14 -1.43 0.07 0.00 0.00 0.00 0.00 46.02 44.53 2qwg n GLY 177 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2qwg n TRP 178 N -1.22 0.03 -3.63 1.61 4.27 0.23 -2.94 117.44 115.78 2qwg n TRP 178 Ca 0.00 -0.87 -0.12 0.00 -3.89 0.00 0.00 57.50 52.62 2qwg n TRP 178 Cb 0.00 -0.13 -0.07 0.00 -1.36 0.00 0.00 31.31 29.75 2qwg n TRP 178 CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 2qwg s SER 179 N -2.38 -0.71 0.34 -0.67 0.15 -1.24 -4.90 113.70 104.29 2qwg s SER 179 Ca 0.24 1.33 -0.17 0.00 0.70 0.00 0.00 55.95 58.05 2qwg s SER 179 Cb 0.21 1.34 0.04 0.00 -1.71 0.00 0.00 66.02 65.90 2qwg s SER 179 CO 0.03 -0.23 0.74 -0.94 1.20 0.00 0.00 173.24 174.04 2qwg s SER 180 N 0.53 -0.05 0.20 5.45 1.04 -1.26 -1.31 113.70 118.31 2qwg s SER 180 Ca -0.01 -0.97 -0.22 0.00 0.48 0.00 0.00 55.95 55.24 2qwg s SER 180 Cb -0.05 0.79 0.05 0.00 0.10 0.00 0.00 66.02 66.91 2qwg s SER 180 CO -0.03 -1.53 0.63 0.28 0.98 0.00 0.00 173.24 173.57 2qwg s THR 181 N -2.98 0.00 -0.20 2.02 -1.32 -0.94 -0.07 115.64 112.16 2qwg s THR 181 Ca 0.15 -0.42 -0.28 0.00 -1.21 0.00 0.00 61.69 59.93 2qwg s THR 181 Cb -0.05 -1.40 0.12 0.00 -1.51 0.00 0.00 72.50 69.66 2qwg s THR 181 CO 0.10 -0.01 0.97 -0.55 -2.21 0.00 0.00 174.62 172.91 2qwg s SER 182 N -2.82 -0.44 -0.04 8.08 0.15 -1.26 -0.74 113.70 116.63 2qwg s SER 182 Ca 0.05 0.64 -0.29 0.00 0.70 0.00 0.00 55.95 57.05 2qwg s SER 182 Cb -0.03 0.58 0.09 0.00 -1.71 0.00 0.00 66.02 64.95 2qwg s SER 182 CO -0.05 -0.30 0.78 0.00 1.20 0.00 0.00 173.24 174.87 2qwg s HIS 184 N -1.80 3.51 -2.69 0.00 2.46 -1.26 -0.80 115.29 114.71 2qwg s HIS 184 Ca -0.05 0.44 0.24 0.00 0.47 0.00 0.00 55.06 56.16 2qwg s HIS 184 Cb -0.00 -2.01 0.49 0.00 -0.13 0.00 0.00 32.58 30.93 2qwg s HIS 184 CO 0.02 0.56 1.43 -0.40 -2.47 0.00 0.00 174.74 173.88 2qwg n ASP 185 N 2.54 2.63 0.00 9.88 5.68 -0.55 -4.60 116.55 132.13 2qwg n ASP 185 Ca -0.19 -1.86 0.00 0.00 -0.50 0.00 0.00 54.79 52.25 2qwg n ASP 185 Cb 0.54 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 2qwg n ASP 185 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qwg n GLY 186 N 1.32 2.59 0.12 6.12 0.00 -1.26 -1.05 105.19 113.04 2qwg n GLY 186 Ca 0.17 -0.82 -0.26 0.00 0.00 0.00 0.00 46.02 45.10 2qwg n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qwg n LYS 187 N 0.00 0.58 -3.91 1.61 5.02 -1.26 -3.42 118.16 116.77 2qwg n LYS 187 Ca 0.00 0.39 -0.09 0.00 -2.02 0.00 0.00 58.31 56.59 2qwg n LYS 187 Cb 0.00 -1.60 -0.02 0.00 -0.02 0.00 0.00 35.03 33.39 2qwg n LYS 187 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2qwg s THR 188 N -2.45 0.00 -0.01 -0.18 -1.32 -1.26 -4.65 115.64 105.77 2qwg s THR 188 Ca -0.35 -1.19 -0.07 0.00 -1.21 0.00 0.00 61.69 58.87 2qwg s THR 188 Cb 0.11 -2.41 -0.05 0.00 -1.51 0.00 0.00 72.50 68.64 2qwg s THR 188 CO 0.53 0.00 0.27 -0.60 -2.21 0.00 0.00 174.62 172.61 2qwg s ARG 189 N -3.33 3.59 -0.15 7.08 3.52 -1.26 -1.48 118.95 126.92 2qwg s ARG 189 Ca 0.18 -0.04 -0.02 0.00 -0.13 0.00 0.00 55.73 55.72 2qwg s ARG 189 Cb -0.04 -3.10 -0.02 0.00 -1.56 0.00 0.00 34.95 30.24 2qwg s ARG 189 CO 0.11 0.66 -0.08 1.41 -0.81 0.00 0.00 175.30 176.59 2qwg s MET 190 N -1.63 3.51 -0.02 5.12 -2.45 0.02 -1.51 119.30 122.34 2qwg s MET 190 Ca 0.26 -0.61 0.05 0.00 -1.25 0.00 0.00 55.69 54.14 2qwg s MET 190 Cb -0.13 -2.80 -0.01 0.00 1.25 0.00 0.00 34.83 33.14 2qwg s MET 190 CO 0.15 0.18 -0.18 -1.12 1.05 0.00 0.00 175.02 175.10 2qwg s SER 191 N 0.48 2.08 -0.07 1.11 0.01 -0.30 -1.02 113.70 115.98 2qwg s SER 191 Ca -0.06 -0.32 0.02 0.00 1.31 0.00 0.00 55.95 56.90 2qwg s SER 191 Cb -0.15 -0.29 0.01 0.00 0.21 0.00 0.00 66.02 65.81 2qwg s SER 191 CO 0.04 0.21 -0.13 -0.63 0.41 0.00 0.00 173.24 173.13 2qwg s ILE 192 N -0.34 1.20 -0.03 1.44 1.01 0.08 -0.49 121.20 124.07 2qwg s ILE 192 Ca 0.05 -0.51 0.03 0.00 0.00 0.00 0.00 60.65 60.23 2qwg s ILE 192 Cb -0.08 -1.10 -0.00 0.00 0.01 0.00 0.00 42.46 41.30 2qwg s ILE 192 CO -0.00 0.37 -0.12 0.00 0.00 0.00 0.00 174.94 175.19 2qwg s ILE 194 N 0.05 3.24 0.27 0.00 1.01 -0.42 -1.45 121.20 123.89 2qwg s ILE 194 Ca -0.01 -0.64 -0.02 0.00 0.00 0.00 0.00 60.65 59.98 2qwg s ILE 194 Cb -0.08 -2.30 -0.02 0.00 0.01 0.00 0.00 42.46 40.06 2qwg s ILE 194 CO 0.01 0.58 0.30 -0.94 0.00 0.00 0.00 174.94 174.88 2qwg s SER 195 N -0.52 0.60 0.00 3.58 1.04 -0.74 -0.60 113.70 117.06 2qwg s SER 195 Ca 0.07 -1.41 0.00 0.00 0.48 0.00 0.00 55.95 55.09 2qwg s SER 195 Cb -0.12 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.52 2qwg s SER 195 CO 0.02 -1.04 0.00 0.61 0.98 0.00 0.00 173.24 173.81 2qwg n GLY 196 N -0.43 2.75 3.73 7.32 0.00 -1.26 -0.78 105.19 116.52 2qwg n GLY 196 Ca 0.02 -2.01 -0.29 0.00 0.00 0.00 0.00 46.02 43.74 2qwg n GLY 196 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qwg s PRO 197 N -1.98 1.18 0.28 1.61 0.04 -1.26 -4.75 135.00 130.12 2qwg s PRO 197 Ca 0.00 0.66 0.02 0.00 0.04 0.00 0.00 61.00 61.72 2qwg s PRO 197 Cb 0.00 -1.81 0.59 0.00 0.04 0.00 0.00 34.50 33.32 2qwg s PRO 197 CO 0.00 -2.25 1.80 -0.91 0.04 0.00 0.00 177.00 175.68 2qwg h ASN 198 N -1.55 0.80 -0.60 6.66 2.35 -1.97 -1.63 115.58 119.63 2qwg h ASN 198 Ca -0.50 0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 2qwg h ASN 198 Cb 1.30 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.59 2qwg h ASN 198 CO 0.57 0.37 0.00 -0.46 -1.65 0.00 0.00 177.43 176.26 2qwg n ASN 199 N -4.72 3.37 -2.42 5.81 0.23 -1.26 -0.33 115.26 115.94 2qwg n ASN 199 Ca 0.20 -2.05 -0.02 0.00 -0.53 0.00 0.00 54.58 52.18 2qwg n ASN 199 Cb 0.43 -0.42 0.07 0.00 -2.08 0.00 0.00 39.78 37.78 2qwg n ASN 199 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 2qwg n ASN 200 N 1.24 -0.31 -4.82 0.53 2.85 -0.65 -4.70 115.26 109.40 2qwg n ASN 200 Ca 0.21 -2.12 -0.30 0.00 -0.11 0.00 0.00 54.58 52.26 2qwg n ASN 200 Cb 0.55 0.21 0.07 0.00 1.24 0.00 0.00 39.78 41.86 2qwg n ASN 200 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2qwg s ALA 201 N -1.08 2.44 -0.15 5.20 0.00 -1.00 -4.43 121.76 122.75 2qwg s ALA 201 Ca 0.15 -0.13 -0.15 0.00 0.00 0.00 0.00 51.96 51.83 2qwg s ALA 201 Cb 0.35 -3.12 0.04 0.00 0.00 0.00 0.00 23.12 20.39 2qwg s ALA 201 CO -0.09 -1.52 0.42 -1.54 0.00 0.00 0.00 175.76 173.03 2qwg s SER 202 N -3.91 -0.42 0.06 0.00 1.04 0.04 -1.16 113.70 109.35 2qwg s SER 202 Ca 0.60 0.79 -0.12 0.00 0.48 0.00 0.00 55.95 57.70 2qwg s SER 202 Cb -0.14 0.81 -0.06 0.00 0.10 0.00 0.00 66.02 66.74 2qwg s SER 202 CO 0.54 -0.18 0.42 0.00 0.98 0.00 0.00 173.24 175.00 2qwg s ALA 203 N 0.08 3.70 -0.11 5.32 0.00 0.06 -1.79 121.76 129.03 2qwg s ALA 203 Ca -0.01 -0.31 0.00 0.00 0.00 0.00 0.00 51.96 51.64 2qwg s ALA 203 Cb -0.03 -2.33 0.02 0.00 0.00 0.00 0.00 23.12 20.78 2qwg s ALA 203 CO 0.01 0.53 -0.09 0.54 0.00 0.00 0.00 175.76 176.75 2qwg s VAL 204 N -1.31 1.08 -0.28 0.00 0.11 -0.53 -1.19 120.40 118.27 2qwg s VAL 204 Ca 0.31 -0.35 -0.18 0.00 -2.93 0.00 0.00 61.98 58.83 2qwg s VAL 204 Cb -0.15 -1.07 -0.02 0.00 -1.53 0.00 0.00 36.38 33.61 2qwg s VAL 204 CO 0.17 0.37 0.50 -0.63 -3.33 0.00 0.00 175.10 172.18 2qwg s ILE 205 N 1.48 5.06 -0.07 7.04 1.09 0.11 -2.36 121.20 133.56 2qwg s ILE 205 Ca 0.01 0.72 -0.03 0.00 -1.10 0.00 0.00 60.65 60.25 2qwg s ILE 205 Cb -0.13 -3.85 -0.04 0.00 -1.06 0.00 0.00 42.46 37.38 2qwg s ILE 205 CO -0.06 0.02 0.06 0.26 -0.10 0.00 0.00 174.94 175.12 2qwg s TRP 206 N 2.31 3.30 -0.08 3.97 0.52 0.35 -0.62 118.94 128.70 2qwg s TRP 206 Ca 0.20 0.28 -0.03 0.00 0.02 0.00 0.00 56.10 56.56 2qwg s TRP 206 Cb -0.16 -1.81 0.04 0.00 -1.15 0.00 0.00 33.47 30.40 2qwg s TRP 206 CO 0.10 0.56 0.17 -0.47 0.02 0.00 0.00 176.95 177.34 2qwg s TYR 207 N -1.02 -0.21 -1.55 -1.98 5.04 -0.06 -1.15 117.35 116.41 2qwg s TYR 207 Ca 0.17 0.58 -0.05 0.00 -2.44 0.00 0.00 57.07 55.33 2qwg s TYR 207 Cb -0.12 -0.07 0.01 0.00 0.35 0.00 0.00 41.96 42.13 2qwg s TYR 207 CO 0.06 -0.20 0.63 -1.71 -1.34 0.00 0.00 175.55 173.00 2qwg n ASN 208 N 4.33 -6.17 -1.62 4.32 5.15 -0.57 -2.52 115.26 118.19 2qwg n ASN 208 Ca -0.24 -0.30 -0.18 0.00 -0.60 0.00 0.00 54.58 53.26 2qwg n ASN 208 Cb 0.52 -4.97 -0.05 0.00 -0.53 0.00 0.00 39.78 34.74 2qwg n ASN 208 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2qwg n ARG 209 N -4.07 -1.30 -4.38 1.20 1.74 -1.26 -5.00 116.66 103.58 2qwg n ARG 209 Ca -0.11 1.02 -0.22 0.00 -0.77 0.00 0.00 57.85 57.78 2qwg n ARG 209 Cb 0.62 -5.37 -0.13 0.00 -1.02 0.00 0.00 32.46 26.56 2qwg n ARG 209 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2qwg s ARG 210 N -4.03 1.07 0.09 5.56 0.52 -1.05 -5.12 118.95 116.00 2qwg s ARG 210 Ca 0.00 -0.93 -0.31 0.00 -0.52 0.00 0.00 55.73 53.98 2qwg s ARG 210 Cb 0.00 -1.16 -0.06 0.00 0.52 0.00 0.00 34.95 34.24 2qwg s ARG 210 CO 0.00 0.28 1.21 -1.25 0.02 0.00 0.00 175.30 175.56 2qwg s PRO 211 N -1.42 4.44 0.00 3.54 0.04 -1.26 -0.88 135.00 139.45 2qwg s PRO 211 Ca 0.03 1.81 0.00 0.00 0.04 0.00 0.00 61.00 62.89 2qwg s PRO 211 Cb -0.09 -3.32 0.00 0.00 0.04 0.00 0.00 34.50 31.13 2qwg s PRO 211 CO 0.02 -0.23 0.00 0.28 0.04 0.00 0.00 177.00 177.11 2qwg n VAL 212 N 3.62 0.00 -4.21 -0.36 0.31 0.21 -4.92 118.33 112.97 2qwg n VAL 212 Ca 0.08 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.23 2qwg n VAL 212 Cb 0.46 -1.39 -0.11 0.00 -0.91 0.00 0.00 33.84 31.88 2qwg n VAL 212 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2qwg s THR 213 N -2.00 1.23 0.00 2.52 2.01 -0.98 -5.00 115.64 113.42 2qwg s THR 213 Ca 0.00 -1.58 0.02 0.00 0.31 0.00 0.00 61.69 60.45 2qwg s THR 213 Cb 0.00 -1.37 -0.01 0.00 0.01 0.00 0.00 72.50 71.13 2qwg s THR 213 CO 0.00 -0.36 -0.08 -1.61 -0.69 0.00 0.00 174.62 171.88 2qwg s GLU 214 N -2.37 0.59 -0.09 4.92 8.01 -1.26 0.05 118.70 128.54 2qwg s GLU 214 Ca 0.05 -0.35 0.01 0.00 0.01 0.00 0.00 54.97 54.69 2qwg s GLU 214 Cb -0.06 -0.54 0.02 0.00 -4.31 0.00 0.00 34.13 29.23 2qwg s GLU 214 CO 0.02 0.14 -0.10 0.42 0.01 0.00 0.00 175.26 175.75 2qwg s ILE 215 N -0.37 1.13 0.31 -1.63 1.01 -0.34 -4.99 121.20 116.33 2qwg s ILE 215 Ca 0.01 -0.41 -0.15 0.00 0.00 0.00 0.00 60.65 60.09 2qwg s ILE 215 Cb -0.04 -1.09 -0.09 0.00 0.01 0.00 0.00 42.46 41.26 2qwg s ILE 215 CO -0.00 0.37 0.73 0.21 0.00 0.00 0.00 174.94 176.25 2qwg s ASN 216 N 1.19 6.80 0.20 3.58 3.04 -1.26 -0.76 114.94 127.72 2qwg s ASN 216 Ca -0.04 1.28 -0.31 0.00 0.04 0.00 0.00 52.86 53.82 2qwg s ASN 216 Cb -0.14 -2.37 -0.16 0.00 -1.54 0.00 0.00 41.25 37.04 2qwg s ASN 216 CO -0.03 -0.18 0.99 1.07 -3.04 0.00 0.00 177.10 175.92 2qwg n THR 217 N -0.24 1.35 0.19 -5.21 5.66 -0.31 -4.91 114.28 110.81 2qwg n THR 217 Ca 0.03 -0.34 0.08 0.00 -3.05 0.00 0.00 64.05 60.77 2qwg n THR 217 Cb 0.53 -0.66 -0.12 0.00 -1.55 0.00 0.00 70.33 68.52 2qwg n THR 217 CO 0.00 0.00 0.00 -2.67 -3.05 0.00 0.00 175.07 169.35 2qwg n TRP 218 N 0.86 0.00 0.00 1.09 2.14 -1.26 -4.55 117.44 115.72 2qwg n TRP 218 Ca 0.14 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.71 2qwg n TRP 218 Cb 0.25 -0.29 0.00 0.00 -0.81 0.00 0.00 31.31 30.46 2qwg n TRP 218 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2qwg n ALA 219 N -1.91 2.44 -3.49 -1.67 0.00 -1.26 -5.02 120.51 109.60 2qwg n ALA 219 Ca -0.02 -0.44 -0.25 0.00 0.00 0.00 0.00 53.44 52.73 2qwg n ALA 219 Cb 0.40 -0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.89 2qwg n ALA 219 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qwg n ARG 220 N -0.12 -6.15 -3.20 0.00 5.12 -1.26 -4.66 116.66 106.39 2qwg n ARG 220 Ca 0.00 0.77 -0.16 0.00 -1.93 0.00 0.00 57.85 56.53 2qwg n ARG 220 Cb 0.00 -5.70 -0.06 0.00 -1.16 0.00 0.00 32.46 25.54 2qwg n ARG 220 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 2qwg s ASN 221 N -3.09 0.39 -0.87 0.55 3.04 -1.20 -4.08 114.94 109.68 2qwg s ASN 221 Ca 0.51 -2.07 -0.05 0.00 0.04 0.00 0.00 52.86 51.29 2qwg s ASN 221 Cb -0.24 0.68 -0.00 0.00 -1.54 0.00 0.00 41.25 40.15 2qwg s ASN 221 CO 0.63 -0.17 0.69 -0.38 -3.04 0.00 0.00 177.10 174.83 2qwg n ILE 222 N 3.43 -6.55 -1.65 -5.21 5.41 0.55 -1.36 119.36 113.99 2qwg n ILE 222 Ca 0.19 -0.34 -0.46 0.00 1.00 0.00 0.00 62.75 63.14 2qwg n ILE 222 Cb 0.50 -4.80 -0.03 0.00 -0.71 0.00 0.00 39.64 34.59 2qwg n ILE 222 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 2qwg n LEU 223 N -2.70 2.69 -3.71 1.39 7.94 -1.26 -4.58 117.00 116.77 2qwg n LEU 223 Ca -0.14 1.13 -0.10 0.00 -1.11 0.00 0.00 56.01 55.79 2qwg n LEU 223 Cb 0.60 -1.37 -0.04 0.00 0.53 0.00 0.00 43.42 43.13 2qwg n LEU 223 CO 0.61 -0.67 0.21 0.00 -1.11 0.00 0.00 177.39 176.43 2qwg s ARG 224 N -0.22 1.25 0.00 1.96 1.70 -0.16 -4.93 118.95 118.55 2qwg s ARG 224 Ca 0.71 -0.82 0.00 0.00 -0.47 0.00 0.00 55.73 55.15 2qwg s ARG 224 Cb -0.71 0.49 0.00 0.00 -0.57 0.00 0.00 34.95 34.16 2qwg s ARG 224 CO 0.49 -0.51 0.00 -2.37 -1.08 0.00 0.00 175.30 171.83 2qwg n THR 225 N -0.29 0.00 -0.09 4.99 5.66 -1.26 -1.45 114.28 121.84 2qwg n THR 225 Ca -0.12 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 60.82 2qwg n THR 225 Cb 0.63 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.41 2qwg n THR 225 CO 0.00 0.00 0.00 1.56 -3.05 0.00 0.00 175.07 173.58 2qwg h GLN 226 N 0.00 -0.05 -0.09 1.09 4.20 -1.69 -3.38 115.11 115.19 2qwg h GLN 226 Ca 0.00 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.68 2qwg h GLN 226 Cb 0.00 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 2qwg h GLN 226 CO 0.00 -0.03 -0.03 0.39 -0.67 0.00 0.00 178.83 178.48 2qwg n GLU 227 N -5.30 -0.22 -3.95 1.46 -0.58 0.90 -3.94 120.64 109.00 2qwg n GLU 227 Ca 0.01 0.42 -0.09 0.00 -0.42 0.00 0.00 57.16 57.07 2qwg n GLU 227 Cb 0.22 -3.90 -0.03 0.00 -0.57 0.00 0.00 31.44 27.16 2qwg n GLU 227 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2qwg s SER 228 N -2.64 0.04 0.46 1.62 1.04 -1.25 -4.65 113.70 108.31 2qwg s SER 228 Ca 0.00 -0.98 -0.24 0.00 0.48 0.00 0.00 55.95 55.22 2qwg s SER 228 Cb 0.00 0.67 -0.07 0.00 0.10 0.00 0.00 66.02 66.72 2qwg s SER 228 CO 0.00 -1.30 1.24 -1.83 0.98 0.00 0.00 173.24 172.33 2qwg s GLU 229 N -3.58 3.70 0.85 4.02 -1.05 -1.26 -4.13 118.70 117.24 2qwg s GLU 229 Ca 0.20 1.97 -0.08 0.00 -0.15 0.00 0.00 54.97 56.92 2qwg s GLU 229 Cb -0.03 -2.48 0.17 0.00 -0.44 0.00 0.00 34.13 31.36 2qwg s GLU 229 CO 0.11 -0.66 1.16 0.00 0.95 0.00 0.00 175.26 176.82 2qwg s VAL 231 N -3.51 0.67 0.23 0.00 1.01 -1.26 -4.63 120.40 112.91 2qwg s VAL 231 Ca 0.71 -0.72 0.11 0.00 0.00 0.00 0.00 61.98 62.07 2qwg s VAL 231 Cb -0.04 -0.63 -0.05 0.00 0.00 0.00 0.00 36.38 35.66 2qwg s VAL 231 CO 0.49 -0.07 -0.16 0.00 0.00 0.00 0.00 175.10 175.36 2qwg s HIS 233 N -2.05 -0.72 -1.57 0.00 2.46 0.47 -4.61 115.29 109.26 2qwg s HIS 233 Ca 0.26 1.32 -0.13 0.00 0.47 0.00 0.00 55.06 56.98 2qwg s HIS 233 Cb -0.07 0.19 0.10 0.00 -0.13 0.00 0.00 32.58 32.68 2qwg s HIS 233 CO 0.14 -0.48 0.84 -1.71 -2.47 0.00 0.00 174.74 171.06 2qwg n ASN 234 N 5.38 -3.57 0.00 9.88 5.15 -0.55 -1.06 115.26 130.48 2qwg n ASN 234 Ca -0.07 -0.89 0.00 0.00 -0.60 0.00 0.00 54.58 53.01 2qwg n ASN 234 Cb 0.50 -3.39 0.00 0.00 -0.53 0.00 0.00 39.78 36.36 2qwg n ASN 234 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2qwg n GLY 235 N -1.60 3.20 3.63 8.20 0.00 -1.26 -5.01 105.19 112.35 2qwg n GLY 235 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2qwg n GLY 235 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qwg s VAL 236 N -2.03 4.98 -0.40 1.61 1.01 -0.22 -4.22 120.40 121.12 2qwg s VAL 236 Ca 0.00 1.18 0.04 0.00 0.00 0.00 0.00 61.98 63.20 2qwg s VAL 236 Cb 0.00 -3.95 0.11 0.00 0.00 0.00 0.00 36.38 32.54 2qwg s VAL 236 CO 0.00 0.03 0.12 0.00 0.00 0.00 0.00 175.10 175.25 2qwg s PRO 238 N 0.52 4.00 -0.01 0.00 0.02 -1.22 -2.47 135.00 135.85 2qwg s PRO 238 Ca 0.13 1.52 -0.00 0.00 0.02 0.00 0.00 61.00 62.67 2qwg s PRO 238 Cb -0.21 -2.41 0.01 0.00 0.02 0.00 0.00 34.50 31.91 2qwg s PRO 238 CO -0.06 -0.29 0.01 0.08 -0.33 0.00 0.00 177.00 176.42 2qwg s VAL 239 N -1.72 -0.01 -0.20 3.83 1.01 -0.02 -4.24 120.40 119.05 2qwg s VAL 239 Ca 0.61 0.05 -0.08 0.00 0.00 0.00 0.00 61.98 62.56 2qwg s VAL 239 Cb -0.22 -0.03 -0.04 0.00 0.00 0.00 0.00 36.38 36.09 2qwg s VAL 239 CO 0.27 0.02 0.09 -0.69 0.00 0.00 0.00 175.10 174.79 2qwg s VAL 240 N 0.24 4.89 0.30 2.92 1.01 -1.26 -0.79 120.40 127.71 2qwg s VAL 240 Ca -0.02 0.01 0.11 0.00 0.00 0.00 0.00 61.98 62.08 2qwg s VAL 240 Cb -0.03 -3.23 -0.05 0.00 0.00 0.00 0.00 36.38 33.07 2qwg s VAL 240 CO -0.01 0.42 -0.12 -0.36 0.00 0.00 0.00 175.10 175.03 2qwg s PHE 241 N 0.67 2.41 0.01 5.22 0.40 -0.34 -3.73 117.98 122.62 2qwg s PHE 241 Ca 0.05 -0.36 0.00 0.00 -0.60 0.00 0.00 56.93 56.02 2qwg s PHE 241 Cb -0.13 -1.16 -0.01 0.00 0.51 0.00 0.00 43.02 42.24 2qwg s PHE 241 CO 0.01 0.65 -0.02 0.99 0.70 0.00 0.00 175.22 177.56 2qwg s THR 242 N -2.50 0.09 -0.07 0.64 2.01 -0.53 -1.50 115.64 113.79 2qwg s THR 242 Ca 0.31 -0.31 -0.05 0.00 0.31 0.00 0.00 61.69 61.96 2qwg s THR 242 Cb -0.03 -0.14 0.03 0.00 0.01 0.00 0.00 72.50 72.37 2qwg s THR 242 CO 0.17 -0.14 0.18 -0.62 -0.69 0.00 0.00 174.62 173.52 2qwg s ASP 243 N -0.47 -0.17 0.00 3.53 -1.08 -0.67 -0.99 116.67 116.83 2qwg s ASP 243 Ca -0.04 0.37 0.00 0.00 -0.52 0.00 0.00 52.55 52.35 2qwg s ASP 243 Cb -0.03 0.30 0.00 0.00 -1.46 0.00 0.00 42.92 41.73 2qwg s ASP 243 CO -0.00 -0.12 0.00 0.61 0.52 0.00 0.00 175.17 176.18 2qwg n GLY 244 N 3.75 0.20 3.64 2.66 0.00 -0.46 -0.76 105.19 114.21 2qwg n GLY 244 Ca -0.21 -2.31 -0.40 0.00 0.00 0.00 0.00 46.02 43.10 2qwg n GLY 244 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2qwg n SER 245 N 0.00 1.60 -0.54 1.61 2.88 -1.26 -4.77 113.62 113.13 2qwg n SER 245 Ca 0.00 1.01 0.11 0.00 -1.33 0.00 0.00 58.87 58.66 2qwg n SER 245 Cb 0.00 -1.41 0.07 0.00 -0.75 0.00 0.00 64.21 62.12 2qwg n SER 245 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2qwg n ALA 246 N -0.66 3.31 -2.15 -1.46 0.00 -1.26 -4.22 120.51 114.06 2qwg n ALA 246 Ca 0.09 -0.62 0.02 0.00 0.00 0.00 0.00 53.44 52.93 2qwg n ALA 246 Cb 0.41 -0.84 0.09 0.00 0.00 0.00 0.00 19.45 19.11 2qwg n ALA 246 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2qwg n THR 247 N 0.14 1.18 -3.88 0.00 -2.24 -1.26 -3.55 114.28 104.67 2qwg n THR 247 Ca 0.11 -2.32 -0.03 0.00 -2.27 0.00 0.00 64.05 59.53 2qwg n THR 247 Cb 0.47 0.38 0.02 0.00 -2.10 0.00 0.00 70.33 69.10 2qwg n THR 247 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2qwg s GLY 248 N -2.79 0.12 0.50 3.38 0.00 -1.26 -4.95 107.32 102.32 2qwg s GLY 248 Ca 0.36 -0.35 -0.24 0.00 0.00 0.00 0.00 44.72 44.50 2qwg s GLY 248 CO -0.10 2.28 1.39 2.56 0.00 0.00 0.00 173.10 179.23 2qwg s PRO 249 N -2.20 3.43 0.37 2.90 0.04 -1.26 -4.78 135.00 133.50 2qwg s PRO 249 Ca 0.21 2.33 0.05 0.00 0.04 0.00 0.00 61.00 63.63 2qwg s PRO 249 Cb -0.03 -2.47 -0.03 0.00 0.04 0.00 0.00 34.50 32.02 2qwg s PRO 249 CO 0.05 -0.99 0.18 0.00 0.04 0.00 0.00 177.00 176.29 2qwg s ALA 250 N -1.25 2.44 -0.66 8.56 0.00 -1.26 -4.38 121.76 125.21 2qwg s ALA 250 Ca 0.66 -1.57 -0.09 0.00 0.00 0.00 0.00 51.96 50.95 2qwg s ALA 250 Cb -0.42 1.06 0.17 0.00 0.00 0.00 0.00 23.12 23.93 2qwg s ALA 250 CO 0.52 -0.47 0.54 -1.21 0.00 0.00 0.00 175.76 175.14 2qwg s GLU 251 N -3.64 2.95 -0.05 0.00 2.02 0.06 -4.98 118.70 115.07 2qwg s GLU 251 Ca 0.31 -2.27 -0.13 0.00 0.02 0.00 0.00 54.97 52.90 2qwg s GLU 251 Cb 0.03 -4.07 -0.05 0.00 0.10 0.00 0.00 34.13 30.13 2qwg s GLU 251 CO 0.19 -1.23 0.34 0.99 0.02 0.00 0.00 175.26 175.57 2qwg s THR 252 N 0.48 5.17 0.05 3.63 2.01 -1.26 -1.66 115.64 124.06 2qwg s THR 252 Ca 0.14 0.68 0.04 0.00 0.31 0.00 0.00 61.69 62.86 2qwg s THR 252 Cb -0.19 -3.64 -0.03 0.00 0.01 0.00 0.00 72.50 68.65 2qwg s THR 252 CO -0.04 0.55 -0.12 -0.13 -0.69 0.00 0.00 174.62 174.19 2qwg s ARG 253 N -0.78 0.74 -0.24 4.92 0.52 -0.56 -1.59 118.95 121.96 2qwg s ARG 253 Ca 0.21 -0.83 -0.03 0.00 -0.52 0.00 0.00 55.73 54.55 2qwg s ARG 253 Cb -0.15 -0.69 0.01 0.00 0.52 0.00 0.00 34.95 34.64 2qwg s ARG 253 CO 0.10 0.15 -0.04 0.42 0.02 0.00 0.00 175.30 175.96 2qwg s ILE 254 N -1.18 3.26 -0.05 1.52 -1.09 -0.35 -1.19 121.20 122.12 2qwg s ILE 254 Ca -0.03 -0.70 -0.03 0.00 -2.23 0.00 0.00 60.65 57.66 2qwg s ILE 254 Cb -0.09 -2.57 -0.04 0.00 -1.58 0.00 0.00 42.46 38.18 2qwg s ILE 254 CO 0.01 0.31 0.11 -0.31 -1.23 0.00 0.00 174.94 173.83 2qwg s TYR 255 N 1.43 3.42 -0.31 3.97 1.51 0.03 -1.26 117.35 126.14 2qwg s TYR 255 Ca 0.04 0.33 -0.01 0.00 -1.01 0.00 0.00 57.07 56.42 2qwg s TYR 255 Cb -0.15 -1.83 0.06 0.00 -0.11 0.00 0.00 41.96 39.93 2qwg s TYR 255 CO -0.03 0.61 0.01 0.71 -1.11 0.00 0.00 175.55 175.75 2qwg s TYR 256 N -1.12 3.34 0.13 2.71 1.51 0.19 -0.84 117.35 123.26 2qwg s TYR 256 Ca 0.20 -2.08 0.03 0.00 -1.01 0.00 0.00 57.07 54.21 2qwg s TYR 256 Cb -0.12 -2.28 -0.04 0.00 -0.11 0.00 0.00 41.96 39.42 2qwg s TYR 256 CO 0.10 -0.85 0.19 -0.06 -1.11 0.00 0.00 175.55 173.82 2qwg s PHE 257 N 1.19 3.33 -0.11 2.71 0.08 -1.03 -0.66 117.98 123.48 2qwg s PHE 257 Ca -0.03 0.09 -0.04 0.00 0.12 0.00 0.00 56.93 57.07 2qwg s PHE 257 Cb -0.20 -1.62 0.06 0.00 -0.57 0.00 0.00 43.02 40.68 2qwg s PHE 257 CO -0.02 0.53 0.20 0.21 -0.10 0.00 0.00 175.22 176.04 2qwg s LYS 258 N -2.91 0.09 -1.46 0.44 2.20 -0.21 -0.80 119.74 117.09 2qwg s LYS 258 Ca 0.32 0.58 -0.11 0.00 -0.36 0.00 0.00 55.97 56.41 2qwg s LYS 258 Cb -0.11 -0.31 0.05 0.00 -1.51 0.00 0.00 37.83 35.95 2qwg s LYS 258 CO 0.26 -0.34 0.97 0.39 -0.36 0.00 0.00 175.35 176.27 2qwg n GLU 259 N 5.33 -6.17 -0.90 4.03 1.02 -1.26 -1.30 120.64 121.38 2qwg n GLU 259 Ca -0.05 0.71 0.00 0.00 -0.02 0.00 0.00 57.16 57.80 2qwg n GLU 259 Cb 0.50 -5.65 0.00 0.00 -0.02 0.00 0.00 31.44 26.27 2qwg n GLU 259 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qwg n GLY 260 N -1.75 0.60 3.71 0.62 0.00 -1.26 -4.92 105.19 102.18 2qwg n GLY 260 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2qwg n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qwg s LYS 261 N -0.37 2.64 -0.21 1.61 1.02 -0.42 -3.99 119.74 120.02 2qwg s LYS 261 Ca 0.00 -0.79 -0.29 0.00 0.02 0.00 0.00 55.97 54.91 2qwg s LYS 261 Cb 0.00 -2.59 0.00 0.00 -0.52 0.00 0.00 37.83 34.72 2qwg s LYS 261 CO 0.00 0.55 1.10 0.42 -0.92 0.00 0.00 175.35 176.50 2qwg s ILE 262 N -1.31 4.58 -0.07 2.17 1.01 -1.26 -1.04 121.20 125.27 2qwg s ILE 262 Ca 0.26 1.90 -0.01 0.00 0.00 0.00 0.00 60.65 62.81 2qwg s ILE 262 Cb -0.12 -4.23 -0.26 0.00 0.01 0.00 0.00 42.46 37.87 2qwg s ILE 262 CO 0.19 -0.16 0.55 -0.07 0.00 0.00 0.00 174.94 175.44 2qwg h LEU 263 N 9.46 0.30 -7.00 2.97 3.38 -1.24 -3.48 115.31 119.71 2qwg h LEU 263 Ca -0.21 -0.61 0.21 0.00 0.09 0.00 0.00 57.88 57.35 2qwg h LEU 263 Cb 1.07 -0.10 -0.19 0.00 0.09 0.00 0.00 40.66 41.53 2qwg h LEU 263 CO 0.97 1.54 0.73 -0.75 0.09 0.00 0.00 178.44 181.03 2qwg s LYS 264 N -2.58 0.42 0.03 1.13 2.20 -1.19 -5.03 119.74 114.72 2qwg s LYS 264 Ca -0.15 -0.11 -0.02 0.00 -0.36 0.00 0.00 55.97 55.33 2qwg s LYS 264 Cb 0.07 0.19 -0.02 0.00 -1.51 0.00 0.00 37.83 36.56 2qwg s LYS 264 CO 0.80 -0.17 0.02 1.67 -0.36 0.00 0.00 175.35 177.31 2qwg s TRP 265 N -2.31 0.27 0.10 4.03 1.48 -1.26 -0.64 118.94 120.61 2qwg s TRP 265 Ca 0.07 -0.58 0.06 0.00 -1.06 0.00 0.00 56.10 54.59 2qwg s TRP 265 Cb -0.01 -0.20 -0.03 0.00 -1.16 0.00 0.00 33.47 32.07 2qwg s TRP 265 CO -0.05 -0.28 -0.14 -1.21 -4.06 0.00 0.00 176.95 171.21 2qwg s GLU 266 N -2.19 0.96 0.49 3.25 2.02 -0.39 -4.97 118.70 117.86 2qwg s GLU 266 Ca -0.09 -1.14 -0.20 0.00 0.02 0.00 0.00 54.97 53.55 2qwg s GLU 266 Cb -0.04 -0.89 -0.08 0.00 0.10 0.00 0.00 34.13 33.22 2qwg s GLU 266 CO -0.03 0.18 1.05 -1.25 0.02 0.00 0.00 175.26 175.23 2qwg s PRO 267 N -2.36 3.76 0.33 0.39 0.04 -1.26 -1.21 135.00 134.69 2qwg s PRO 267 Ca 0.05 1.41 -0.29 0.00 0.04 0.00 0.00 61.00 62.21 2qwg s PRO 267 Cb -0.07 -2.11 -0.12 0.00 0.04 0.00 0.00 34.50 32.25 2qwg s PRO 267 CO 0.03 -0.48 1.38 -0.11 0.04 0.00 0.00 177.00 177.86 2qwg n LEU 268 N -0.96 3.84 -4.42 -3.56 7.94 -0.62 -4.84 117.00 114.38 2qwg n LEU 268 Ca 0.09 1.20 -0.22 0.00 -1.11 0.00 0.00 56.01 55.97 2qwg n LEU 268 Cb 0.52 -1.52 -0.09 0.00 0.53 0.00 0.00 43.42 42.86 2qwg n LEU 268 CO 0.40 -0.28 -0.21 0.00 -1.11 0.00 0.00 177.39 176.20 2qwg s ALA 269 N -0.83 2.38 0.00 1.96 0.00 -1.26 -5.02 121.76 119.00 2qwg s ALA 269 Ca 0.58 -1.62 0.00 0.00 0.00 0.00 0.00 51.96 50.91 2qwg s ALA 269 Cb -0.55 0.91 0.00 0.00 0.00 0.00 0.00 23.12 23.48 2qwg s ALA 269 CO 0.59 -0.41 0.00 0.41 0.00 0.00 0.00 175.76 176.35 2qwg n GLY 270 N -0.72 -1.69 0.54 0.00 0.00 -1.26 -3.50 105.19 98.57 2qwg n GLY 270 Ca -0.02 -2.03 0.10 0.00 0.00 0.00 0.00 46.02 44.07 2qwg n GLY 270 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qwg n THR 271 N 0.00 0.00 -1.97 2.61 -2.24 -0.49 -4.88 114.28 107.31 2qwg n THR 271 Ca 0.00 -0.36 -0.42 0.00 -2.27 0.00 0.00 64.05 61.00 2qwg n THR 271 Cb 0.00 1.28 -0.03 0.00 -2.10 0.00 0.00 70.33 69.49 2qwg n THR 271 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qwg s ALA 272 N -2.00 3.72 -0.40 6.98 0.00 -1.26 -4.61 121.76 124.19 2qwg s ALA 272 Ca 0.18 1.34 0.23 0.00 0.00 0.00 0.00 51.96 53.71 2qwg s ALA 272 Cb 0.16 -3.60 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 2qwg s ALA 272 CO 0.41 -0.76 0.93 1.63 0.00 0.00 0.00 175.76 177.97 2qwg n LYS 273 N 3.54 0.44 -3.64 0.00 4.76 -1.26 -4.93 118.16 117.07 2qwg n LYS 273 Ca 0.12 -0.01 -0.09 0.00 -2.87 0.00 0.00 58.31 55.46 2qwg n LYS 273 Cb 0.39 -1.64 -0.07 0.00 -1.84 0.00 0.00 35.03 31.87 2qwg n LYS 273 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 2qwg s HIS 274 N -3.30 -0.92 -0.08 2.13 2.46 -1.26 -4.69 115.29 109.63 2qwg s HIS 274 Ca 0.00 1.96 0.04 0.00 0.47 0.00 0.00 55.06 57.54 2qwg s HIS 274 Cb 0.13 0.48 0.00 0.00 -0.13 0.00 0.00 32.58 33.06 2qwg s HIS 274 CO 0.82 -0.45 -0.21 0.42 -2.47 0.00 0.00 174.74 172.85 2qwg s ILE 275 N 1.11 1.80 -0.01 0.89 -1.09 -1.26 -3.96 121.20 118.68 2qwg s ILE 275 Ca -0.06 -0.88 -0.04 0.00 -2.23 0.00 0.00 60.65 57.44 2qwg s ILE 275 Cb -0.05 -1.56 0.00 0.00 -1.58 0.00 0.00 42.46 39.27 2qwg s ILE 275 CO -0.12 0.50 0.09 -1.61 -1.23 0.00 0.00 174.94 172.57 2qwg s GLU 276 N 0.31 0.28 -0.70 2.79 0.41 0.52 -4.82 118.70 117.49 2qwg s GLU 276 Ca -0.14 -0.19 -0.02 0.00 -0.41 0.00 0.00 54.97 54.20 2qwg s GLU 276 Cb -0.16 0.12 0.00 0.00 -1.78 0.00 0.00 34.13 32.31 2qwg s GLU 276 CO 0.06 -0.06 0.49 0.39 -0.49 0.00 0.00 175.26 175.66 2qwg n GLU 277 N 2.21 -1.19 -2.22 1.61 1.02 -1.26 -1.17 120.64 119.64 2qwg n GLU 277 Ca -0.18 0.55 -0.41 0.00 -0.02 0.00 0.00 57.16 57.10 2qwg n GLU 277 Cb 0.57 -1.80 -0.03 0.00 -0.02 0.00 0.00 31.44 30.16 2qwg n GLU 277 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2qwg s SER 279 N -0.26 5.23 0.26 0.00 0.01 0.65 -4.60 113.70 114.98 2qwg s SER 279 Ca 0.51 -0.24 0.09 0.00 1.31 0.00 0.00 55.95 57.62 2qwg s SER 279 Cb -0.37 -1.94 -0.05 0.00 0.21 0.00 0.00 66.02 63.86 2qwg s SER 279 CO 0.45 -0.06 -0.15 0.00 0.41 0.00 0.00 173.24 173.90 2qwg s TYR 281 N -2.75 -0.37 0.09 0.00 -0.85 -0.62 -4.37 117.35 108.47 2qwg s TYR 281 Ca 0.28 0.11 0.06 0.00 -0.52 0.00 0.00 57.07 56.99 2qwg s TYR 281 Cb -0.01 0.41 -0.03 0.00 0.38 0.00 0.00 41.96 42.70 2qwg s TYR 281 CO 0.12 -0.78 -0.16 0.20 -1.52 0.00 0.00 175.55 173.41 2qwg s GLY 282 N -2.78 1.01 -0.22 5.49 0.00 -1.26 -0.84 107.32 108.72 2qwg s GLY 282 Ca 0.02 -1.11 -0.26 0.00 0.00 0.00 0.00 44.72 43.36 2qwg s GLY 282 CO -0.12 -1.14 0.73 -1.83 0.00 0.00 0.00 173.10 170.74 2qwg s GLU 283 N -1.92 0.87 -1.32 2.90 4.04 -0.26 -4.96 118.70 118.04 2qwg s GLU 283 Ca 0.02 0.80 -0.19 0.00 0.04 0.00 0.00 54.97 55.64 2qwg s GLU 283 Cb -0.09 0.42 0.03 0.00 0.02 0.00 0.00 34.13 34.50 2qwg s GLU 283 CO 0.03 -0.15 0.37 0.54 -1.84 0.00 0.00 175.26 174.21 2qwg n ARG 284 N 2.24 -0.53 -2.12 -4.83 1.74 0.54 -0.99 116.66 112.71 2qwg n ARG 284 Ca -0.15 0.05 -0.19 0.00 -0.77 0.00 0.00 57.85 56.80 2qwg n ARG 284 Cb 0.56 -2.81 -0.03 0.00 -1.02 0.00 0.00 32.46 29.15 2qwg n ARG 284 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qwg n ALA 285 N -4.74 -0.53 -2.77 7.54 0.00 0.99 -4.99 120.51 116.00 2qwg n ALA 285 Ca -0.20 0.20 -0.19 0.00 0.00 0.00 0.00 53.44 53.26 2qwg n ALA 285 Cb 0.60 -1.99 -0.15 0.00 0.00 0.00 0.00 19.45 17.91 2qwg n ALA 285 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2qwg s GLU 286 N -4.56 0.76 -0.18 0.00 2.12 -0.16 -4.46 118.70 112.22 2qwg s GLU 286 Ca 0.00 -0.31 -0.03 0.00 0.36 0.00 0.00 54.97 54.99 2qwg s GLU 286 Cb 0.00 -0.73 -0.02 0.00 0.26 0.00 0.00 34.13 33.64 2qwg s GLU 286 CO 0.00 0.17 -0.06 0.42 -0.54 0.00 0.00 175.26 175.25 2qwg s ILE 287 N -0.10 3.47 -0.16 -3.70 1.01 -0.67 -1.10 121.20 119.95 2qwg s ILE 287 Ca 0.02 -0.48 -0.02 0.00 0.00 0.00 0.00 60.65 60.16 2qwg s ILE 287 Cb -0.05 -2.54 -0.02 0.00 0.01 0.00 0.00 42.46 39.87 2qwg s ILE 287 CO -0.00 0.46 -0.07 -0.89 0.00 0.00 0.00 174.94 174.44 2qwg s THR 288 N 0.91 3.53 -0.14 2.92 2.01 -0.02 -0.03 115.64 124.82 2qwg s THR 288 Ca -0.01 -0.48 0.02 0.00 0.31 0.00 0.00 61.69 61.53 2qwg s THR 288 Cb -0.15 -2.53 0.01 0.00 0.01 0.00 0.00 72.50 69.84 2qwg s THR 288 CO 0.01 0.49 -0.20 0.00 -0.69 0.00 0.00 174.62 174.23 2qwg s THR 290 N 0.79 4.42 0.00 0.00 2.01 0.43 -0.74 115.64 122.54 2qwg s THR 290 Ca -0.07 -0.22 0.00 0.00 0.31 0.00 0.00 61.69 61.70 2qwg s THR 290 Cb -0.16 -3.12 0.00 0.00 0.01 0.00 0.00 72.50 69.23 2qwg s THR 290 CO -0.01 0.26 0.00 0.00 -0.69 0.00 0.00 174.62 174.19 2qwg s LYS 292 N 1.91 0.49 -0.70 0.00 2.20 -0.32 -4.17 119.74 119.16 2qwg s LYS 292 Ca 0.00 0.08 -0.19 0.00 -0.36 0.00 0.00 55.97 55.50 2qwg s LYS 292 Cb 0.00 -0.74 0.12 0.00 -1.51 0.00 0.00 37.83 35.70 2qwg s LYS 292 CO 0.00 -0.20 0.83 0.34 -0.36 0.00 0.00 175.35 175.96 2qwg s ASP 293 N 1.46 6.36 0.31 1.43 -1.08 -1.25 -0.35 116.67 123.54 2qwg s ASP 293 Ca -0.03 -1.69 0.13 0.00 -0.52 0.00 0.00 52.55 50.43 2qwg s ASP 293 Cb -0.13 -2.32 0.49 0.00 -1.46 0.00 0.00 42.92 39.50 2qwg s ASP 293 CO -0.03 -1.07 1.67 -1.13 0.52 0.00 0.00 175.17 175.14 2qwg h ASN 294 N 8.96 0.00 0.65 -0.34 -1.24 -1.81 -3.29 115.58 118.51 2qwg h ASN 294 Ca -0.14 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 56.84 2qwg h ASN 294 Cb 1.07 0.00 0.01 0.00 0.73 0.00 0.00 38.32 40.12 2qwg h ASN 294 CO 1.06 0.53 -0.31 -0.25 -1.29 0.00 0.00 177.43 177.17 2qwg h TRP 295 N 0.00 -0.81 0.00 0.67 7.01 -1.84 0.03 115.95 121.01 2qwg h TRP 295 Ca -0.01 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 60.98 2qwg h TRP 295 Cb 0.98 0.27 0.00 0.00 -2.10 0.00 0.00 29.16 28.31 2qwg h TRP 295 CO 0.00 -0.50 -0.58 1.04 -2.79 0.00 0.00 178.44 175.61 2qwg n GLN 296 N -5.11 2.30 -2.81 2.65 6.02 -1.26 -0.51 117.38 118.65 2qwg n GLN 296 Ca -0.11 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.47 2qwg n GLN 296 Cb 0.34 -0.79 -0.04 0.00 1.02 0.00 0.00 30.24 30.77 2qwg n GLN 296 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2qwg s GLY 297 N -2.16 2.93 -0.01 1.08 0.00 -1.24 -4.40 107.32 103.51 2qwg s GLY 297 Ca 0.00 0.48 0.20 0.00 0.00 0.00 0.00 44.72 45.39 2qwg s GLY 297 CO 0.00 1.36 0.62 1.44 0.00 0.00 0.00 173.10 176.52 2qwg n SER 298 N 2.88 0.67 -4.93 1.64 7.64 -0.85 -4.50 113.62 116.18 2qwg n SER 298 Ca 0.01 -0.46 -0.25 0.00 1.01 0.00 0.00 58.87 59.18 2qwg n SER 298 Cb 0.50 1.48 0.01 0.00 -1.01 0.00 0.00 64.21 65.18 2qwg n SER 298 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2qwg s ASN 299 N -3.59 5.98 -0.17 6.43 4.22 -1.26 -1.57 114.94 124.98 2qwg s ASN 299 Ca -0.00 0.63 -0.10 0.00 -2.14 0.00 0.00 52.86 51.25 2qwg s ASN 299 Cb 0.14 -1.89 -0.05 0.00 1.28 0.00 0.00 41.25 40.73 2qwg s ASN 299 CO 0.81 -0.69 0.17 -0.13 -2.04 0.00 0.00 177.10 175.22 2qwg s ARG 300 N -4.69 4.04 0.55 3.55 0.52 -1.26 -4.64 118.95 117.01 2qwg s ARG 300 Ca 0.48 -0.12 -0.20 0.00 -0.52 0.00 0.00 55.73 55.37 2qwg s ARG 300 Cb -0.10 -3.37 -0.05 0.00 0.52 0.00 0.00 34.95 31.95 2qwg s ARG 300 CO 0.42 0.40 1.22 -1.25 0.02 0.00 0.00 175.30 176.11 2qwg s PRO 301 N 0.04 3.20 -0.04 3.54 0.04 -1.26 -0.73 135.00 139.80 2qwg s PRO 301 Ca 0.12 1.86 0.02 0.00 0.04 0.00 0.00 61.00 63.04 2qwg s PRO 301 Cb -0.12 -2.09 0.01 0.00 0.04 0.00 0.00 34.50 32.34 2qwg s PRO 301 CO 0.01 -1.04 -0.08 0.08 0.04 0.00 0.00 177.00 176.01 2qwg s VAL 302 N -1.55 0.74 -0.19 -0.36 1.01 0.14 -0.85 120.40 119.34 2qwg s VAL 302 Ca 0.73 -0.30 -0.01 0.00 0.00 0.00 0.00 61.98 62.40 2qwg s VAL 302 Cb -0.31 -0.69 0.01 0.00 0.00 0.00 0.00 36.38 35.39 2qwg s VAL 302 CO 0.35 0.25 -0.14 -0.63 0.00 0.00 0.00 175.10 174.93 2qwg s ILE 303 N 0.44 2.60 -0.17 2.22 1.01 0.08 -1.43 121.20 125.95 2qwg s ILE 303 Ca -0.07 -0.76 -0.05 0.00 0.00 0.00 0.00 60.65 59.77 2qwg s ILE 303 Cb -0.11 -2.13 -0.03 0.00 0.01 0.00 0.00 42.46 40.20 2qwg s ILE 303 CO 0.01 0.49 0.00 -0.13 0.00 0.00 0.00 174.94 175.31 2qwg s ARG 304 N 1.32 3.76 -0.05 2.79 0.52 -0.89 -0.10 118.95 126.31 2qwg s ARG 304 Ca 0.04 -0.46 0.05 0.00 -0.52 0.00 0.00 55.73 54.85 2qwg s ARG 304 Cb -0.14 -3.04 -0.02 0.00 0.52 0.00 0.00 34.95 32.27 2qwg s ARG 304 CO -0.08 0.22 -0.20 0.42 0.02 0.00 0.00 175.30 175.67 2qwg s ILE 305 N 0.47 2.51 -0.42 1.52 1.01 0.96 -1.34 121.20 125.91 2qwg s ILE 305 Ca -0.01 -0.92 -0.13 0.00 0.00 0.00 0.00 60.65 59.59 2qwg s ILE 305 Cb -0.14 -1.94 0.05 0.00 0.01 0.00 0.00 42.46 40.44 2qwg s ILE 305 CO 0.02 0.58 0.30 -0.62 0.00 0.00 0.00 174.94 175.22 2qwg s ASP 306 N -0.51 5.94 0.00 3.58 -1.08 0.76 -1.67 116.67 123.68 2qwg s ASP 306 Ca 0.07 -1.16 0.31 0.00 -0.52 0.00 0.00 52.55 51.25 2qwg s ASP 306 Cb -0.11 -2.10 1.72 0.00 -1.46 0.00 0.00 42.92 40.97 2qwg s ASP 306 CO 0.01 -0.51 2.14 -0.81 0.52 0.00 0.00 175.17 176.52 2qwg n PRO 307 N 5.09 0.87 -0.10 4.34 -0.04 -1.26 0.11 135.00 144.01 2qwg n PRO 307 Ca -0.11 -0.07 -0.19 0.00 -0.04 0.00 0.00 63.50 63.09 2qwg n PRO 307 Cb 0.45 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.32 2qwg n PRO 307 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2qwg n VAL 308 N -1.00 1.51 0.24 0.52 0.31 -1.26 -4.24 118.33 114.40 2qwg n VAL 308 Ca 0.21 -0.03 0.13 0.00 -0.01 0.00 0.00 64.34 64.63 2qwg n VAL 308 Cb 0.17 -2.10 0.42 0.00 -0.91 0.00 0.00 33.84 31.41 2qwg n VAL 308 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qwg h ALA 309 N -0.73 0.98 -5.62 3.52 0.00 -1.98 -3.47 119.26 111.96 2qwg h ALA 309 Ca -0.32 -0.07 -0.32 0.00 0.00 0.00 0.00 54.91 54.20 2qwg h ALA 309 Cb 1.18 -0.01 0.17 0.00 0.00 0.00 0.00 17.79 19.13 2qwg h ALA 309 CO -0.20 0.09 -0.79 -1.33 0.00 0.00 0.00 179.25 177.03 2qwg n MET 310 N -3.15 -5.81 -4.28 0.00 0.00 0.12 -5.02 117.12 98.97 2qwg n MET 310 Ca 0.02 0.85 -0.15 0.00 0.00 0.00 0.00 57.70 58.42 2qwg n MET 310 Cb 0.44 -5.85 -0.10 0.00 0.00 0.00 0.00 33.22 27.71 2qwg n MET 310 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 2qwg s THR 311 N -3.37 0.59 0.29 2.03 -4.23 -1.01 -4.99 115.64 104.96 2qwg s THR 311 Ca 0.08 -1.99 -0.13 0.00 -1.18 0.00 0.00 61.69 58.47 2qwg s THR 311 Cb -0.01 -2.39 0.01 0.00 1.34 0.00 0.00 72.50 71.45 2qwg s THR 311 CO 0.73 -0.23 0.58 -1.38 -0.54 0.00 0.00 174.62 173.78 2qwg s HIS 312 N -3.72 0.34 0.17 3.99 -3.43 -1.26 -0.17 115.29 111.20 2qwg s HIS 312 Ca 0.31 -0.75 -0.01 0.00 -0.80 0.00 0.00 55.06 53.82 2qwg s HIS 312 Cb 0.07 0.35 -0.04 0.00 -1.43 0.00 0.00 32.58 31.53 2qwg s HIS 312 CO 0.09 -1.16 0.09 0.95 -2.00 0.00 0.00 174.74 172.70 2qwg s THR 313 N -3.55 0.14 -0.02 -5.38 -4.23 -0.45 -4.89 115.64 97.26 2qwg s THR 313 Ca 0.20 -1.96 -0.09 0.00 -1.18 0.00 0.00 61.69 58.66 2qwg s THR 313 Cb -0.02 -2.29 0.01 0.00 1.34 0.00 0.00 72.50 71.54 2qwg s THR 313 CO 0.11 -0.23 0.21 -0.94 -0.54 0.00 0.00 174.62 173.23 2qwg s SER 314 N -3.13 -0.10 0.00 3.99 1.04 -1.23 -2.10 113.70 112.18 2qwg s SER 314 Ca 0.32 0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.79 2qwg s SER 314 Cb 0.07 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.49 2qwg s SER 314 CO 0.07 -0.32 0.00 0.00 0.98 0.00 0.00 173.24 173.98 2qwg n GLN 315 N 1.79 0.00 -4.47 4.02 10.64 -0.51 -1.39 117.38 127.46 2qwg n GLN 315 Ca -0.20 0.00 -0.24 0.00 -1.83 0.00 0.00 57.00 54.73 2qwg n GLN 315 Cb 0.56 0.00 -0.10 0.00 -0.86 0.00 0.00 30.24 29.84 2qwg n GLN 315 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 2qwg s TYR 316 N -7.52 2.33 -0.09 2.61 1.51 -0.68 0.25 117.35 115.76 2qwg s TYR 316 Ca 0.00 -0.35 -0.30 0.00 -1.01 0.00 0.00 57.07 55.42 2qwg s TYR 316 Cb 0.00 -1.06 -0.04 0.00 -0.11 0.00 0.00 41.96 40.75 2qwg s TYR 316 CO 0.00 0.70 1.56 0.42 -1.11 0.00 0.00 175.55 177.12 2qwg s ILE 317 N -2.51 3.75 0.34 2.71 1.01 0.09 -4.73 121.20 121.86 2qwg s ILE 317 Ca 0.30 0.91 0.03 0.00 0.00 0.00 0.00 60.65 61.89 2qwg s ILE 317 Cb -0.04 -3.59 0.21 0.00 0.01 0.00 0.00 42.46 39.05 2qwg s ILE 317 CO 0.15 -0.09 1.94 0.00 0.00 0.00 0.00 174.94 176.95 2qwg n SER 319 N -4.36 -0.07 0.00 0.00 2.88 -0.28 -2.79 113.62 109.00 2qwg n SER 319 Ca 0.04 1.15 0.08 0.00 -1.33 0.00 0.00 58.87 58.81 2qwg n SER 319 Cb 0.14 -1.08 0.41 0.00 -0.75 0.00 0.00 64.21 62.93 2qwg n SER 319 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2qwg n PRO 320 N 1.07 0.18 -2.62 -1.46 -0.04 -1.26 -4.43 135.00 126.45 2qwg n PRO 320 Ca 0.15 0.15 -0.42 0.00 -0.04 0.00 0.00 63.50 63.34 2qwg n PRO 320 Cb 0.25 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.19 2qwg n PRO 320 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2qwg s VAL 321 N -2.68 4.08 0.22 0.52 1.01 -1.26 -3.80 120.40 118.49 2qwg s VAL 321 Ca 0.14 -1.03 -0.30 0.00 0.00 0.00 0.00 61.98 60.79 2qwg s VAL 321 Cb 0.11 -5.03 -0.09 0.00 0.00 0.00 0.00 36.38 31.37 2qwg s VAL 321 CO 0.27 -1.88 1.35 -0.76 0.00 0.00 0.00 175.10 174.09 2qwg s LEU 322 N 4.51 4.41 0.00 3.92 1.43 -1.26 -4.96 118.68 126.72 2qwg s LEU 322 Ca 0.45 2.51 0.02 0.00 -1.03 0.00 0.00 54.13 56.07 2qwg s LEU 322 Cb -0.00 -3.62 0.05 0.00 0.03 0.00 0.00 46.19 42.65 2qwg s LEU 322 CO -0.08 -0.59 0.97 0.35 0.23 0.00 0.00 176.35 177.24 2qwg n THR 323 N 2.44 0.86 -2.47 5.49 -2.24 -1.15 -5.00 114.28 112.21 2qwg n THR 323 Ca 0.06 -0.93 -0.25 0.00 -2.27 0.00 0.00 64.05 60.66 2qwg n THR 323 Cb 0.42 0.58 0.13 0.00 -2.10 0.00 0.00 70.33 69.35 2qwg n THR 323 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2qwg s ASP 324 N -0.88 4.05 -0.21 3.42 -1.08 -0.61 -4.68 116.67 116.68 2qwg s ASP 324 Ca 0.04 -0.29 -0.14 0.00 -0.52 0.00 0.00 52.55 51.64 2qwg s ASP 324 Cb 0.02 0.01 0.06 0.00 -1.46 0.00 0.00 42.92 41.55 2qwg s ASP 324 CO 0.03 -2.08 0.53 0.21 0.52 0.00 0.00 175.17 174.38 2qwg s ASN 325 N -4.79 -0.66 0.97 -0.34 3.84 -1.26 -4.41 114.94 108.28 2qwg s ASN 325 Ca 0.68 1.14 -0.11 0.00 0.21 0.00 0.00 52.86 54.78 2qwg s ASN 325 Cb -0.05 1.06 0.17 0.00 -0.55 0.00 0.00 41.25 41.89 2qwg s ASN 325 CO 0.46 -0.21 1.10 -2.16 -2.79 0.00 0.00 177.10 173.50 2qwg s PRO 326 N 1.15 0.63 0.11 0.43 0.04 -1.26 -2.78 135.00 133.32 2qwg s PRO 326 Ca -0.07 1.15 -0.21 0.00 0.04 0.00 0.00 61.00 61.91 2qwg s PRO 326 Cb -0.06 -1.71 0.06 0.00 0.04 0.00 0.00 34.50 32.83 2qwg s PRO 326 CO -0.11 -2.77 0.53 -0.98 0.04 0.00 0.00 177.00 173.71 2qwg s ARG 327 N -4.68 1.15 1.18 4.56 1.70 0.25 -4.84 118.95 118.26 2qwg s ARG 327 Ca 0.66 -0.44 -0.17 0.00 -0.47 0.00 0.00 55.73 55.31 2qwg s ARG 327 Cb -0.22 0.52 0.27 0.00 -0.57 0.00 0.00 34.95 34.96 2qwg s ARG 327 CO 0.59 -0.46 1.06 -2.14 -1.08 0.00 0.00 175.30 173.27 2qwg s PRO 328 N -3.32 -1.01 0.68 3.89 0.02 -1.26 -4.67 135.00 129.33 2qwg s PRO 328 Ca -0.01 0.26 -0.12 0.00 0.02 0.00 0.00 61.00 61.15 2qwg s PRO 328 Cb -0.00 -1.59 0.01 0.00 0.02 0.00 0.00 34.50 32.93 2qwg s PRO 328 CO -0.09 -3.64 1.07 -0.80 -0.33 0.00 0.00 177.00 173.21 2qwg s ASN 329 N -3.44 5.31 0.22 2.53 0.01 -1.26 -4.95 114.94 113.36 2qwg s ASN 329 Ca 0.69 1.71 -0.31 0.00 -0.71 0.00 0.00 52.86 54.24 2qwg s ASN 329 Cb -0.15 -2.51 -0.10 0.00 0.41 0.00 0.00 41.25 38.89 2qwg s ASN 329 CO 0.58 -1.49 1.53 -1.81 -1.51 0.00 0.00 177.10 174.41 2qwg s ASP 330 N -3.47 6.57 0.88 -1.22 1.01 -1.26 -4.99 116.67 114.19 2qwg s ASP 330 Ca 0.60 2.70 -0.01 0.00 0.71 0.00 0.00 52.55 56.55 2qwg s ASP 330 Cb -0.15 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.18 2qwg s ASP 330 CO 0.51 -0.80 0.06 -0.81 0.21 0.00 0.00 175.17 174.33 2qwg n PRO 331 N 3.12 0.07 -0.00 8.23 -0.04 -1.25 -5.02 135.00 140.10 2qwg n PRO 331 Ca 0.11 -0.10 0.08 0.00 -0.04 0.00 0.00 63.50 63.55 2qwg n PRO 331 Cb 0.39 -0.06 -0.11 0.00 -0.04 0.00 0.00 33.50 33.68 2qwg n PRO 331 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2qwg n THR 332 N -1.96 0.00 -3.81 0.52 -2.24 -1.26 -4.78 114.28 100.75 2qwg n THR 332 Ca 0.01 -0.20 -0.14 0.00 -2.27 0.00 0.00 64.05 61.45 2qwg n THR 332 Cb 0.03 0.71 -0.15 0.00 -2.10 0.00 0.00 70.33 68.82 2qwg n THR 332 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2qwg s VAL 333 N -2.78 -0.04 0.00 2.28 0.11 -1.26 -4.55 120.40 114.17 2qwg s VAL 333 Ca 0.02 0.13 0.00 0.00 -2.93 0.00 0.00 61.98 59.20 2qwg s VAL 333 Cb 0.12 -0.05 0.00 0.00 -1.53 0.00 0.00 36.38 34.92 2qwg s VAL 333 CO 0.70 0.05 0.00 0.61 -3.33 0.00 0.00 175.10 173.13 2qwg n GLY 335 N 3.74 1.61 3.07 6.54 0.00 0.78 -4.71 105.19 116.22 2qwg n GLY 335 Ca -0.21 -2.04 -0.26 0.00 0.00 0.00 0.00 46.02 43.51 2qwg n GLY 335 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qwg s LYS 336 N 0.26 1.96 0.02 1.61 1.02 -1.12 -4.91 119.74 118.59 2qwg s LYS 336 Ca 0.00 -0.52 0.11 0.00 0.02 0.00 0.00 55.97 55.58 2qwg s LYS 336 Cb 0.00 -1.59 -0.21 0.00 -0.52 0.00 0.00 37.83 35.51 2qwg s LYS 336 CO 0.00 0.08 0.89 0.00 -0.92 0.00 0.00 175.35 175.40 2qwg n ASN 338 N -3.13 0.79 -3.90 0.00 4.13 -1.26 -1.69 115.26 110.19 2qwg n ASN 338 Ca -0.11 -2.18 -0.09 0.00 1.68 0.00 0.00 54.58 53.88 2qwg n ASN 338 Cb 0.99 -0.23 -0.09 0.00 -1.54 0.00 0.00 39.78 38.92 2qwg n ASN 338 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 2qwg s ASP 339 N -1.40 0.15 0.45 6.41 1.01 -1.26 -4.78 116.67 117.25 2qwg s ASP 339 Ca 0.09 -0.55 -0.25 0.00 0.71 0.00 0.00 52.55 52.55 2qwg s ASP 339 Cb 0.08 0.26 -0.08 0.00 1.01 0.00 0.00 42.92 44.19 2qwg s ASP 339 CO 0.01 -0.57 1.39 -2.16 0.21 0.00 0.00 175.17 174.04 2qwg s PRO 340 N -2.95 3.68 -0.15 8.23 0.04 -1.26 -4.76 135.00 137.83 2qwg s PRO 340 Ca -0.02 2.32 -0.24 0.00 0.04 0.00 0.00 61.00 63.10 2qwg s PRO 340 Cb 0.01 -2.62 -0.02 0.00 0.04 0.00 0.00 34.50 31.90 2qwg s PRO 340 CO -0.06 -0.79 0.77 -0.47 0.04 0.00 0.00 177.00 176.49 2qwg s TYR 341 N -1.24 3.45 0.81 0.56 5.04 -1.26 -4.83 117.35 119.89 2qwg s TYR 341 Ca 0.61 1.21 -0.10 0.00 -2.44 0.00 0.00 57.07 56.35 2qwg s TYR 341 Cb -0.42 -2.93 0.11 0.00 0.35 0.00 0.00 41.96 39.07 2qwg s TYR 341 CO 0.53 -0.15 1.15 -1.25 -1.34 0.00 0.00 175.55 174.49 2qwg s PRO 342 N 1.77 1.68 0.00 4.97 0.04 -1.26 -2.01 135.00 140.20 2qwg s PRO 342 Ca 0.37 -0.23 0.00 0.00 0.04 0.00 0.00 61.00 61.18 2qwg s PRO 342 Cb -0.17 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.35 2qwg s PRO 342 CO 0.14 -1.68 0.00 0.41 0.04 0.00 0.00 177.00 175.91 2qwg n GLY 343 N -3.27 1.14 2.93 0.56 0.00 -1.26 -4.81 105.19 100.49 2qwg n GLY 343 Ca 0.10 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 2qwg n GLY 343 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qwg s ASN 344 N -0.43 -0.05 0.24 1.61 0.01 -1.26 -4.76 114.94 110.31 2qwg s ASN 344 Ca 0.00 0.34 0.10 0.00 -0.71 0.00 0.00 52.86 52.58 2qwg s ASN 344 Cb 0.00 0.23 -0.04 0.00 0.41 0.00 0.00 41.25 41.85 2qwg s ASN 344 CO 0.00 -0.16 -0.05 0.20 -1.51 0.00 0.00 177.10 175.58 2qwg s ASN 345 N 1.31 4.38 -1.44 -1.22 0.01 -1.26 -4.42 114.94 112.30 2qwg s ASN 345 Ca -0.08 -0.66 -0.08 0.00 -0.71 0.00 0.00 52.86 51.33 2qwg s ASN 345 Cb -0.11 -0.76 0.01 0.00 0.41 0.00 0.00 41.25 40.79 2qwg s ASN 345 CO -0.06 0.03 0.25 0.59 -1.51 0.00 0.00 177.10 176.41 2qwg n ASN 346 N -0.60 -0.59 -3.57 -1.22 5.03 0.33 -4.93 115.26 109.70 2qwg n ASN 346 Ca -0.07 -1.22 -0.06 0.00 0.87 0.00 0.00 54.58 54.10 2qwg n ASN 346 Cb 0.58 -1.97 -0.02 0.00 -1.02 0.00 0.00 39.78 37.35 2qwg n ASN 346 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 2qwg s ASN 347 N -4.17 -0.25 0.00 6.41 3.84 -0.07 -4.97 114.94 115.73 2qwg s ASN 347 Ca 0.12 -0.07 0.00 0.00 0.21 0.00 0.00 52.86 53.13 2qwg s ASN 347 Cb -0.06 0.31 0.00 0.00 -0.55 0.00 0.00 41.25 40.95 2qwg s ASN 347 CO 0.97 -0.52 0.00 0.61 -2.79 0.00 0.00 177.10 175.37 2qwg n GLY 348 N -0.25 0.44 3.03 1.21 0.00 -1.21 -4.55 105.19 103.87 2qwg n GLY 348 Ca -0.06 -1.13 -0.17 0.00 0.00 0.00 0.00 46.02 44.67 2qwg n GLY 348 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qwg s VAL 349 N -2.00 0.65 0.24 1.61 0.11 -1.12 -4.85 120.40 115.04 2qwg s VAL 349 Ca 0.00 -0.60 -0.30 0.00 -2.93 0.00 0.00 61.98 58.15 2qwg s VAL 349 Cb 0.00 -0.60 -0.10 0.00 -1.53 0.00 0.00 36.38 34.15 2qwg s VAL 349 CO 0.00 0.01 1.53 -0.75 -3.33 0.00 0.00 175.10 172.56 2qwg s LYS 350 N -0.65 4.21 0.01 1.54 2.20 -1.26 -4.77 119.74 121.03 2qwg s LYS 350 Ca -0.00 2.40 0.00 0.00 -0.36 0.00 0.00 55.97 58.01 2qwg s LYS 350 Cb -0.05 -3.10 -0.00 0.00 -1.51 0.00 0.00 37.83 33.17 2qwg s LYS 350 CO 0.00 -0.54 0.01 0.41 -0.36 0.00 0.00 175.35 174.88 2qwg n GLY 351 N 2.69 3.33 3.66 5.54 0.00 -1.21 -2.17 105.19 117.03 2qwg n GLY 351 Ca 0.09 -1.46 -0.09 0.00 0.00 0.00 0.00 46.02 44.56 2qwg n GLY 351 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2qwg n PHE 352 N -0.02 -2.25 -3.56 1.61 -1.74 -1.26 -4.36 117.46 105.89 2qwg n PHE 352 Ca 0.00 -1.90 -0.07 0.00 -0.56 0.00 0.00 57.45 54.93 2qwg n PHE 352 Cb 0.02 0.87 -0.02 0.00 1.52 0.00 0.00 39.48 41.87 2qwg n PHE 352 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 2qwg s SER 353 N -3.05 -0.30 -0.25 5.98 1.04 -1.26 -3.41 113.70 112.45 2qwg s SER 353 Ca 0.17 -0.08 0.02 0.00 0.48 0.00 0.00 55.95 56.54 2qwg s SER 353 Cb -0.04 0.37 0.05 0.00 0.10 0.00 0.00 66.02 66.50 2qwg s SER 353 CO 0.13 -0.63 -0.11 -0.31 0.98 0.00 0.00 173.24 173.30 2qwg s TYR 354 N -3.07 3.16 -0.48 5.02 2.02 -0.48 -4.84 117.35 118.68 2qwg s TYR 354 Ca 0.07 -2.07 -0.13 0.00 -0.37 0.00 0.00 57.07 54.58 2qwg s TYR 354 Cb -0.01 -1.96 0.10 0.00 -0.40 0.00 0.00 41.96 39.69 2qwg s TYR 354 CO -0.06 -0.84 0.38 -0.51 -1.57 0.00 0.00 175.55 172.94 2qwg s LEU 355 N 1.18 5.69 -0.41 -1.29 1.43 -1.26 -1.51 118.68 122.51 2qwg s LEU 355 Ca -0.05 -1.64 0.09 0.00 -1.03 0.00 0.00 54.13 51.50 2qwg s LEU 355 Cb -0.18 -2.10 0.31 0.00 0.03 0.00 0.00 46.19 44.24 2qwg s LEU 355 CO -0.06 -0.69 0.81 -0.67 0.23 0.00 0.00 176.35 175.97 2qwg n ASP 356 N 5.08 -0.59 0.00 2.29 2.03 -1.25 -4.99 116.55 119.12 2qwg n ASP 356 Ca -0.11 -3.16 0.00 0.00 0.52 0.00 0.00 54.79 52.03 2qwg n ASP 356 Cb 0.42 0.34 0.00 0.00 -0.72 0.00 0.00 41.12 41.16 2qwg n ASP 356 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2qwg n GLY 357 N 0.70 3.60 0.21 0.27 0.00 -1.26 -0.91 105.19 107.81 2qwg n GLY 357 Ca 0.17 -0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.21 2qwg n GLY 357 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2qwg h VAL 358 N 0.00 0.85 -0.19 1.61 -1.51 -1.93 0.57 116.25 115.66 2qwg h VAL 358 Ca 0.00 -1.09 -0.19 0.00 -1.23 0.00 0.00 66.70 64.19 2qwg h VAL 358 Cb 0.00 1.66 -0.07 0.00 -2.13 0.00 0.00 31.29 30.75 2qwg h VAL 358 CO 0.00 0.27 -0.11 -3.20 -1.23 0.00 0.00 177.57 173.30 2qwg n ASN 359 N -3.71 5.54 -4.55 4.19 5.15 -0.08 -4.34 115.26 117.46 2qwg n ASN 359 Ca -0.01 -2.61 -0.36 0.00 -0.60 0.00 0.00 54.58 51.00 2qwg n ASN 359 Cb 0.39 -1.28 -0.11 0.00 -0.53 0.00 0.00 39.78 38.24 2qwg n ASN 359 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2qwg s THR 360 N -0.00 4.70 -0.03 -0.44 2.01 -1.17 -3.78 115.64 116.93 2qwg s THR 360 Ca 0.44 -0.05 0.05 0.00 0.31 0.00 0.00 61.69 62.44 2qwg s THR 360 Cb 0.23 -3.17 -0.01 0.00 0.01 0.00 0.00 72.50 69.56 2qwg s THR 360 CO -0.03 0.37 -0.18 0.26 -0.69 0.00 0.00 174.62 174.35 2qwg s TRP 361 N 1.11 1.70 -0.03 4.92 0.52 -0.57 -1.11 118.94 125.48 2qwg s TRP 361 Ca 0.05 -0.40 0.05 0.00 0.02 0.00 0.00 56.10 55.82 2qwg s TRP 361 Cb -0.14 -1.12 -0.02 0.00 -1.15 0.00 0.00 33.47 31.04 2qwg s TRP 361 CO 0.04 -0.09 -0.18 -0.51 0.02 0.00 0.00 176.95 176.23 2qwg s LEU 362 N -0.23 2.55 0.05 2.99 1.43 0.13 -1.38 118.68 124.22 2qwg s LEU 362 Ca 0.02 -0.28 0.04 0.00 -1.03 0.00 0.00 54.13 52.88 2qwg s LEU 362 Cb -0.09 -1.50 -0.04 0.00 0.03 0.00 0.00 46.19 44.59 2qwg s LEU 362 CO 0.01 0.33 -0.02 -0.83 0.23 0.00 0.00 176.35 176.07 2qwg s GLY 363 N -0.76 1.87 0.01 -3.19 0.00 -1.22 0.05 107.32 104.08 2qwg s GLY 363 Ca 0.11 -1.06 -0.28 0.00 0.00 0.00 0.00 44.72 43.50 2qwg s GLY 363 CO 0.00 -0.98 0.83 1.09 0.00 0.00 0.00 173.10 174.04 2qwg s ARG 364 N -1.93 0.91 0.65 2.90 1.70 -0.86 -4.69 118.95 117.62 2qwg s ARG 364 Ca 0.22 -0.26 -0.14 0.00 -0.47 0.00 0.00 55.73 55.09 2qwg s ARG 364 Cb -0.12 0.42 -0.01 0.00 -0.57 0.00 0.00 34.95 34.68 2qwg s ARG 364 CO 0.14 -0.38 1.08 0.95 -1.08 0.00 0.00 175.30 176.01 2qwg s THR 365 N -2.92 3.61 -0.07 4.99 -4.23 -1.26 -0.99 115.64 114.76 2qwg s THR 365 Ca 0.02 0.69 -0.26 0.00 -1.18 0.00 0.00 61.69 60.96 2qwg s THR 365 Cb -0.01 -3.24 -0.23 0.00 1.34 0.00 0.00 72.50 70.35 2qwg s THR 365 CO -0.08 -0.52 1.01 0.40 -0.54 0.00 0.00 174.62 174.90 2qwg h ILE 366 N -0.04 1.58 -3.84 2.99 2.04 -1.40 -3.45 117.51 115.40 2qwg h ILE 366 Ca -0.46 -1.86 -0.53 0.00 1.00 0.00 0.00 64.86 63.02 2qwg h ILE 366 Cb 1.23 2.80 0.07 0.00 -0.74 0.00 0.00 36.82 40.18 2qwg h ILE 366 CO 0.56 0.49 0.68 -0.55 0.00 0.00 0.00 178.15 179.33 2qwg s SER 367 N -6.12 6.66 0.00 1.72 0.15 -1.03 -4.90 113.70 110.19 2qwg s SER 367 Ca -0.17 2.77 0.25 0.00 0.70 0.00 0.00 55.95 59.50 2qwg s SER 367 Cb -0.00 -2.65 0.44 0.00 -1.71 0.00 0.00 66.02 62.10 2qwg s SER 367 CO 0.71 -0.63 1.37 2.30 1.20 0.00 0.00 173.24 178.18 2qwg n ILE 368 N 0.88 0.00 -0.11 6.45 -5.35 -1.26 -4.27 119.36 115.70 2qwg n ILE 368 Ca 0.01 -0.00 -0.14 0.00 -0.27 0.00 0.00 62.75 62.34 2qwg n ILE 368 Cb 0.41 0.33 -0.13 0.00 -1.74 0.00 0.00 39.64 38.51 2qwg n ILE 368 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2qwg n ALA 369 N -1.47 1.49 -2.30 -1.28 0.00 -1.26 -0.59 120.51 115.10 2qwg n ALA 369 Ca 0.06 -1.14 -0.13 0.00 0.00 0.00 0.00 53.44 52.22 2qwg n ALA 369 Cb 0.34 -0.10 -0.09 0.00 0.00 0.00 0.00 19.45 19.59 2qwg n ALA 369 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2qwg s SER 370 N -6.00 0.44 -1.26 0.00 1.04 -1.26 -4.56 113.70 102.11 2qwg s SER 370 Ca -0.24 -1.43 -0.18 0.00 0.48 0.00 0.00 55.95 54.58 2qwg s SER 370 Cb 0.07 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.63 2qwg s SER 370 CO 0.66 -0.91 1.95 0.54 0.98 0.00 0.00 173.24 176.45 2qwg n ARG 371 N -0.35 2.59 -4.12 4.02 1.74 -1.26 -4.40 116.66 114.88 2qwg n ARG 371 Ca 0.03 -2.74 -0.19 0.00 -0.77 0.00 0.00 57.85 54.18 2qwg n ARG 371 Cb 0.65 -3.39 -0.16 0.00 -1.02 0.00 0.00 32.46 28.54 2qwg n ARG 371 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2qwg s SER 372 N 4.39 0.75 0.31 0.55 0.15 -1.26 -1.67 113.70 116.92 2qwg s SER 372 Ca 0.55 -0.10 0.00 0.00 0.70 0.00 0.00 55.95 57.10 2qwg s SER 372 Cb 0.08 -0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.06 2qwg s SER 372 CO 0.04 -0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.05 2qwg n GLY 373 N 3.87 -2.40 3.64 9.45 0.00 0.44 -1.92 105.19 118.27 2qwg n GLY 373 Ca -0.24 -1.25 -0.08 0.00 0.00 0.00 0.00 46.02 44.45 2qwg n GLY 373 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2qwg s TYR 374 N -2.81 -0.77 0.05 1.61 6.14 -0.03 -3.41 117.35 118.13 2qwg s TYR 374 Ca 0.00 1.67 -0.02 0.00 0.64 0.00 0.00 57.07 59.36 2qwg s TYR 374 Cb 0.00 0.42 -0.03 0.00 0.42 0.00 0.00 41.96 42.78 2qwg s TYR 374 CO 0.00 -0.38 0.01 -1.83 0.64 0.00 0.00 175.55 174.00 2qwg s GLU 375 N 0.95 0.57 -0.11 4.97 -1.05 -0.16 -0.41 118.70 123.46 2qwg s GLU 375 Ca -0.04 -1.00 -0.00 0.00 -0.15 0.00 0.00 54.97 53.77 2qwg s GLU 375 Cb -0.05 0.21 -0.02 0.00 -0.44 0.00 0.00 34.13 33.83 2qwg s GLU 375 CO -0.11 -0.12 -0.10 -1.64 0.95 0.00 0.00 175.26 174.25 2qwg s MET 376 N -3.23 3.17 -0.07 -4.83 -1.94 0.99 -2.02 119.30 111.36 2qwg s MET 376 Ca 0.00 -0.62 0.02 0.00 -1.71 0.00 0.00 55.69 53.38 2qwg s MET 376 Cb 0.03 -2.64 0.01 0.00 2.01 0.00 0.00 34.83 34.24 2qwg s MET 376 CO -0.07 0.39 -0.12 -0.51 -0.01 0.00 0.00 175.02 174.69 2qwg s LEU 377 N -0.08 1.61 -0.37 -0.03 1.43 0.11 -0.47 118.68 120.88 2qwg s LEU 377 Ca -0.01 -0.30 -0.25 0.00 -1.03 0.00 0.00 54.13 52.54 2qwg s LEU 377 Cb -0.14 -0.83 0.01 0.00 0.03 0.00 0.00 46.19 45.27 2qwg s LEU 377 CO 0.03 0.02 0.89 -0.75 0.23 0.00 0.00 176.35 176.78 2qwg s LYS 378 N 0.75 3.80 -0.45 1.70 2.20 -0.37 0.22 119.74 127.60 2qwg s LYS 378 Ca -0.13 0.49 0.03 0.00 -0.36 0.00 0.00 55.97 56.00 2qwg s LYS 378 Cb -0.16 -3.81 0.13 0.00 -1.51 0.00 0.00 37.83 32.48 2qwg s LYS 378 CO 0.03 -0.94 0.22 0.08 -0.36 0.00 0.00 175.35 174.37 2qwg s VAL 379 N 3.41 1.89 0.19 4.02 1.01 -0.27 -0.32 120.40 130.33 2qwg s VAL 379 Ca 0.36 -2.74 -0.33 0.00 0.00 0.00 0.00 61.98 59.28 2qwg s VAL 379 Cb -0.12 -2.33 -0.14 0.00 0.00 0.00 0.00 36.38 33.79 2qwg s VAL 379 CO 0.19 -0.82 1.50 -2.65 0.00 0.00 0.00 175.10 173.32 2qwg n PRO 380 N 3.54 2.06 -2.41 2.72 -0.02 -1.26 -1.65 135.00 137.97 2qwg n PRO 380 Ca 0.06 0.74 -0.19 0.00 -2.02 0.00 0.00 63.50 62.09 2qwg n PRO 380 Cb 0.35 -2.46 -0.01 0.00 -0.02 0.00 0.00 33.50 31.36 2qwg n PRO 380 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2qwg n ASN 381 N 2.87 -5.47 -0.28 2.55 3.02 0.18 -4.80 115.26 113.32 2qwg n ASN 381 Ca 0.15 0.03 0.10 0.00 -0.03 0.00 0.00 54.58 54.83 2qwg n ASN 381 Cb 0.29 -4.57 0.25 0.00 -0.61 0.00 0.00 39.78 35.14 2qwg n ASN 381 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qwg h ALA 382 N 1.00 1.14 -0.86 5.41 0.00 -1.56 -0.08 119.26 124.32 2qwg h ALA 382 Ca -0.45 0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.73 2qwg h ALA 382 Cb 1.33 0.30 -0.06 0.00 0.00 0.00 0.00 17.79 19.37 2qwg h ALA 382 CO 0.53 -0.42 0.54 1.25 0.00 0.00 0.00 179.25 181.15 2qwg h LEU 383 N 0.22 0.85 -0.25 0.00 5.85 -1.90 -0.67 115.31 119.41 2qwg h LEU 383 Ca 0.50 0.01 0.00 0.00 0.84 0.00 0.00 57.88 59.23 2qwg h LEU 383 Cb 0.96 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.82 2qwg h LEU 383 CO -0.62 0.55 -0.42 0.35 -0.34 0.00 0.00 178.44 177.96 2qwg n THR 384 N -4.61 0.00 -3.73 1.05 -2.24 -0.69 -2.37 114.28 101.70 2qwg n THR 384 Ca 0.12 -0.29 -0.38 0.00 -2.27 0.00 0.00 64.05 61.23 2qwg n THR 384 Cb 0.16 1.04 -0.12 0.00 -2.10 0.00 0.00 70.33 69.32 2qwg n THR 384 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2qwg s ASP 385 N -1.85 5.36 0.00 3.42 -1.08 -0.13 -4.94 116.67 117.45 2qwg s ASP 385 Ca 0.06 -1.34 0.04 0.00 -0.52 0.00 0.00 52.55 50.79 2qwg s ASP 385 Cb 0.09 -1.88 0.26 0.00 -1.46 0.00 0.00 42.92 39.93 2qwg s ASP 385 CO 0.40 -0.40 0.82 -0.90 0.52 0.00 0.00 175.17 175.61 2qwg n ASP 386 N 4.80 0.00 0.00 -0.34 5.68 -1.26 -1.65 116.55 123.78 2qwg n ASP 386 Ca -0.11 -1.08 0.00 0.00 -0.50 0.00 0.00 54.79 53.10 2qwg n ASP 386 Cb 0.44 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.42 2qwg n ASP 386 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2qwg n LYS 387 N -0.61 1.20 -1.81 0.11 5.02 -1.26 -0.16 118.16 120.65 2qwg n LYS 387 Ca 0.03 -0.89 -0.42 0.00 -2.02 0.00 0.00 58.31 55.02 2qwg n LYS 387 Cb 0.02 -0.76 -0.03 0.00 -0.02 0.00 0.00 35.03 34.24 2qwg n LYS 387 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2qwg s SER 388 N -0.43 6.46 0.26 4.39 1.04 -0.66 -4.86 113.70 119.89 2qwg s SER 388 Ca 0.00 2.79 0.05 0.00 0.48 0.00 0.00 55.95 59.26 2qwg s SER 388 Cb 0.00 -2.60 -0.06 0.00 0.10 0.00 0.00 66.02 63.46 2qwg s SER 388 CO 0.00 -0.91 -0.02 -0.54 0.98 0.00 0.00 173.24 172.75 2qwg s LYS 389 N 0.97 1.46 0.49 4.02 -0.14 -1.26 -3.98 119.74 121.30 2qwg s LYS 389 Ca 0.72 -1.75 -0.22 0.00 -1.36 0.00 0.00 55.97 53.36 2qwg s LYS 389 Cb -0.47 -0.87 -0.07 0.00 -1.68 0.00 0.00 37.83 34.74 2qwg s LYS 389 CO 0.33 -0.05 1.16 -2.14 -0.76 0.00 0.00 175.35 173.90 2qwg s PRO 390 N -3.81 3.58 -0.00 -1.68 0.02 -1.26 -4.43 135.00 127.42 2qwg s PRO 390 Ca 0.30 1.75 0.02 0.00 0.02 0.00 0.00 61.00 63.08 2qwg s PRO 390 Cb 0.05 -2.26 -0.02 0.00 0.02 0.00 0.00 34.50 32.29 2qwg s PRO 390 CO 0.11 -0.69 0.08 0.25 -0.33 0.00 0.00 177.00 176.41 2qwg n THR 391 N -0.79 0.00 -3.64 0.99 -2.24 0.56 -4.99 114.28 104.17 2qwg n THR 391 Ca 0.09 -0.40 -0.08 0.00 -2.27 0.00 0.00 64.05 61.39 2qwg n THR 391 Cb 0.49 0.92 -0.02 0.00 -2.10 0.00 0.00 70.33 69.62 2qwg n THR 391 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2qwg s GLN 392 N -1.32 1.38 0.23 -0.78 0.74 -1.24 -5.01 119.66 113.67 2qwg s GLN 392 Ca 0.01 -0.66 -0.23 0.00 0.05 0.00 0.00 55.36 54.53 2qwg s GLN 392 Cb 0.01 0.54 0.04 0.00 1.10 0.00 0.00 33.01 34.70 2qwg s GLN 392 CO 0.08 -0.62 0.80 0.20 -0.55 0.00 0.00 175.29 175.20 2qwg s GLY 394 N -2.80 -0.15 -0.23 2.59 0.00 -1.26 -1.23 107.32 104.23 2qwg s GLY 394 Ca 0.07 -0.13 -0.11 0.00 0.00 0.00 0.00 44.72 44.55 2qwg s GLY 394 CO -0.03 -0.05 0.53 1.62 0.00 0.00 0.00 173.10 175.17 2qwg s GLN 395 N -3.68 0.50 0.14 2.90 0.74 0.39 -4.99 119.66 115.65 2qwg s GLN 395 Ca 0.11 1.06 -0.25 0.00 0.05 0.00 0.00 55.36 56.33 2qwg s GLN 395 Cb -0.04 0.22 -0.07 0.00 1.10 0.00 0.00 33.01 34.22 2qwg s GLN 395 CO 0.05 -0.18 0.77 0.99 -0.55 0.00 0.00 175.29 176.37 2qwg s THR 396 N 1.93 4.45 -0.13 -0.34 2.01 -1.26 -0.01 115.64 122.29 2qwg s THR 396 Ca -0.08 1.68 -0.03 0.00 0.31 0.00 0.00 61.69 63.58 2qwg s THR 396 Cb -0.09 -4.13 -0.07 0.00 0.01 0.00 0.00 72.50 68.22 2qwg s THR 396 CO -0.16 0.49 -0.14 -0.38 -0.69 0.00 0.00 174.62 173.74 2qwg n ILE 397 N 1.85 0.73 -4.24 1.82 2.08 0.45 -4.57 119.36 117.49 2qwg n ILE 397 Ca -0.05 -0.24 -0.18 0.00 0.56 0.00 0.00 62.75 62.84 2qwg n ILE 397 Cb 0.49 -1.29 -0.15 0.00 -0.75 0.00 0.00 39.64 37.93 2qwg n ILE 397 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 2qwg s VAL 398 N -2.25 0.57 0.55 1.39 1.01 -0.36 -0.42 120.40 120.89 2qwg s VAL 398 Ca -0.18 -0.25 -0.19 0.00 0.00 0.00 0.00 61.98 61.36 2qwg s VAL 398 Cb 0.06 -0.52 -0.06 0.00 0.00 0.00 0.00 36.38 35.86 2qwg s VAL 398 CO 0.27 0.19 1.13 -0.76 0.00 0.00 0.00 175.10 175.93 2qwg s LEU 399 N 0.23 3.74 0.00 3.92 1.43 -1.26 -0.85 118.68 125.90 2qwg s LEU 399 Ca -0.03 2.19 0.06 0.00 -1.03 0.00 0.00 54.13 55.32 2qwg s LEU 399 Cb -0.07 -4.58 0.31 0.00 0.03 0.00 0.00 46.19 41.88 2qwg s LEU 399 CO -0.00 -1.24 1.06 -3.20 0.23 0.00 0.00 176.35 173.21 2qwg n ASN 400 N -1.32 0.00 -1.67 2.29 4.05 -1.26 -0.63 115.26 116.72 2qwg n ASN 400 Ca 0.12 0.23 0.08 0.00 0.45 0.00 0.00 54.58 55.46 2qwg n ASN 400 Cb 0.51 -0.31 0.37 0.00 1.23 0.00 0.00 39.78 41.58 2qwg n ASN 400 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 177.26 174.56 2qwg n THR 401 N -1.31 2.10 -4.13 -0.44 -2.24 -1.26 -4.40 114.28 102.61 2qwg n THR 401 Ca 0.03 -1.22 -0.15 0.00 -2.27 0.00 0.00 64.05 60.45 2qwg n THR 401 Cb 0.05 -0.04 -0.13 0.00 -2.10 0.00 0.00 70.33 68.11 2qwg n THR 401 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2qwg s ASP 402 N -0.83 0.83 0.26 3.42 1.01 0.20 -5.04 116.67 116.52 2qwg s ASP 402 Ca 0.51 -0.36 -0.29 0.00 0.71 0.00 0.00 52.55 53.11 2qwg s ASP 402 Cb 0.35 -0.02 -0.09 0.00 1.01 0.00 0.00 42.92 44.17 2qwg s ASP 402 CO 0.21 -0.08 1.16 0.26 0.21 0.00 0.00 175.17 176.93 2qwg s TRP 403 N -0.83 3.46 0.00 4.23 0.23 -1.26 -0.42 118.94 124.35 2qwg s TRP 403 Ca -0.04 1.58 0.00 0.00 -2.03 0.00 0.00 56.10 55.60 2qwg s TRP 403 Cb -0.07 -3.38 0.00 0.00 0.03 0.00 0.00 33.47 30.05 2qwg s TRP 403 CO 0.00 -0.93 0.00 -1.13 0.96 0.00 0.00 176.95 175.85 2qwg n SER 404 N 1.54 0.00 0.00 2.95 3.41 -0.67 -4.40 113.62 116.45 2qwg n SER 404 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 2qwg n SER 404 Cb 0.44 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 2qwg n SER 404 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qwg n GLY 405 N 5.00 -0.44 3.71 5.00 0.00 0.01 -1.52 105.19 116.95 2qwg n GLY 405 Ca 0.00 -0.58 -0.33 0.00 0.00 0.00 0.00 46.02 45.11 2qwg n GLY 405 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qwg s TYR 406 N -4.00 1.92 -0.01 1.61 1.51 -1.26 -4.59 117.35 112.53 2qwg s TYR 406 Ca 0.00 1.66 -0.17 0.00 -1.01 0.00 0.00 57.07 57.54 2qwg s TYR 406 Cb 0.00 -3.43 0.03 0.00 -0.11 0.00 0.00 41.96 38.45 2qwg s TYR 406 CO 0.00 -2.69 0.37 -1.54 -1.11 0.00 0.00 175.55 170.58 2qwg s SER 407 N -2.25 -0.26 0.33 2.29 1.04 -0.92 0.48 113.70 114.41 2qwg s SER 407 Ca 0.72 0.14 -0.17 0.00 0.48 0.00 0.00 55.95 57.11 2qwg s SER 407 Cb -0.27 0.36 0.04 0.00 0.10 0.00 0.00 66.02 66.24 2qwg s SER 407 CO 0.50 -0.51 0.74 -0.83 0.98 0.00 0.00 173.24 174.12 2qwg s GLY 408 N -1.44 0.22 0.17 7.32 0.00 -1.10 -3.31 107.32 109.18 2qwg s GLY 408 Ca -0.12 -0.59 0.07 0.00 0.00 0.00 0.00 44.72 44.08 2qwg s GLY 408 CO 0.04 -0.25 0.05 -1.35 0.00 0.00 0.00 173.10 171.59 2qwg s SER 409 N -3.01 5.05 0.08 1.64 1.04 -1.26 -2.03 113.70 115.20 2qwg s SER 409 Ca 0.14 -0.30 -0.26 0.00 0.48 0.00 0.00 55.95 56.01 2qwg s SER 409 Cb -0.05 -1.17 0.08 0.00 0.10 0.00 0.00 66.02 64.98 2qwg s SER 409 CO 0.10 0.08 0.71 0.72 0.98 0.00 0.00 173.24 175.82 2qwg s PHE 410 N -1.76 -0.49 0.06 5.02 -0.71 -1.17 -4.41 117.98 114.51 2qwg s PHE 410 Ca 0.29 0.39 -0.09 0.00 -1.04 0.00 0.00 56.93 56.48 2qwg s PHE 410 Cb -0.09 0.53 0.00 0.00 -1.21 0.00 0.00 43.02 42.25 2qwg s PHE 410 CO 0.20 -0.71 0.20 -1.64 -1.34 0.00 0.00 175.22 171.93 2qwg s MET 411 N -3.19 0.75 -0.64 1.99 -1.94 -1.26 -2.31 119.30 112.70 2qwg s MET 411 Ca 0.01 -0.74 -0.20 0.00 -1.71 0.00 0.00 55.69 53.05 2qwg s MET 411 Cb -0.01 0.31 0.09 0.00 2.01 0.00 0.00 34.83 37.23 2qwg s MET 411 CO -0.09 -0.23 0.83 0.34 -0.01 0.00 0.00 175.02 175.87 2qwg s ASP 412 N -2.35 6.20 0.00 3.03 2.15 -1.26 -4.62 116.67 119.81 2qwg s ASP 412 Ca -0.02 -1.28 0.22 0.00 0.43 0.00 0.00 52.55 51.90 2qwg s ASP 412 Cb 0.01 -2.35 1.19 0.00 -0.30 0.00 0.00 42.92 41.47 2qwg s ASP 412 CO -0.06 -1.25 1.68 -1.22 -0.17 0.00 0.00 175.17 174.15 2qwg n TYR 12 N 6.91 0.00 -1.10 -5.34 4.01 -1.26 -3.03 117.16 117.34 2qwg n TYR 12 Ca -0.06 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.76 2qwg n TYR 12 Cb 0.44 -0.13 0.21 0.00 -0.31 0.00 0.00 39.34 39.54 2qwg n TYR 12 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 2qwg n TRP 12 N -1.13 0.57 -2.02 -0.72 8.01 -1.26 -5.03 117.44 115.85 2qwg n TRP 12 Ca 0.13 -1.03 -0.29 0.00 -1.31 0.00 0.00 57.50 55.01 2qwg n TRP 12 Cb 0.12 -0.27 0.05 0.00 -2.01 0.00 0.00 31.31 29.20 2qwg n TRP 12 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2qwg s ALA 413 N -2.91 2.97 0.93 6.99 0.00 -1.17 -5.01 121.76 123.55 2qwg s ALA 413 Ca 0.39 -0.50 -0.15 0.00 0.00 0.00 0.00 51.96 51.70 2qwg s ALA 413 Cb 0.33 -2.90 0.17 0.00 0.00 0.00 0.00 23.12 20.72 2qwg s ALA 413 CO 0.05 -1.14 1.28 -1.21 0.00 0.00 0.00 175.76 174.74 2qwg s GLU 414 N -5.30 0.93 0.00 0.00 0.41 -1.26 -4.98 118.70 108.51 2qwg s GLU 414 Ca 0.58 -0.27 0.00 0.00 -0.41 0.00 0.00 54.97 54.87 2qwg s GLU 414 Cb -0.11 -1.87 0.00 0.00 -1.78 0.00 0.00 34.13 30.37 2qwg s GLU 414 CO 0.49 -2.24 0.00 0.41 -0.49 0.00 0.00 175.26 173.44 2qwg n GLY 415 N -3.59 0.99 0.60 -1.39 0.00 -1.26 -4.77 105.19 95.77 2qwg n GLY 415 Ca 0.13 -2.11 0.10 0.00 0.00 0.00 0.00 46.02 44.14 2qwg n GLY 415 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qwg n GLU 416 N 0.41 1.62 -4.13 1.61 4.71 -1.26 -5.00 120.64 118.60 2qwg n GLU 416 Ca 0.00 -1.26 -0.09 0.00 -0.01 0.00 0.00 57.16 55.81 2qwg n GLU 416 Cb 0.00 -1.39 -0.10 0.00 -1.01 0.00 0.00 31.44 28.94 2qwg n GLU 416 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2qwg s TYR 418 N -4.01 3.38 -0.45 0.00 2.02 -0.11 -4.76 117.35 113.41 2qwg s TYR 418 Ca 0.20 0.64 -0.26 0.00 -0.37 0.00 0.00 57.07 57.28 2qwg s TYR 418 Cb 0.07 -2.54 0.03 0.00 -0.40 0.00 0.00 41.96 39.12 2qwg s TYR 418 CO -0.01 -0.02 0.93 0.50 -1.57 0.00 0.00 175.55 175.38 2qwg s ARG 419 N 1.34 3.59 0.28 -0.62 3.52 -1.26 -0.97 118.95 124.83 2qwg s ARG 419 Ca 0.20 0.25 -0.30 0.00 -0.13 0.00 0.00 55.73 55.74 2qwg s ARG 419 Cb -0.15 -3.90 -0.12 0.00 -1.56 0.00 0.00 34.95 29.21 2qwg s ARG 419 CO 0.08 -1.18 1.51 0.00 -0.81 0.00 0.00 175.30 174.90 2qwg n ALA 420 N 7.13 1.95 -2.25 6.12 0.00 -1.26 -4.50 120.51 127.70 2qwg n ALA 420 Ca 0.07 0.39 -0.14 0.00 0.00 0.00 0.00 53.44 53.75 2qwg n ALA 420 Cb 0.48 -2.38 -0.10 0.00 0.00 0.00 0.00 19.45 17.45 2qwg n ALA 420 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qwg s PHE 422 N -3.79 -0.43 0.15 0.00 -0.12 -0.18 -3.04 117.98 110.57 2qwg s PHE 422 Ca 0.30 0.16 0.06 0.00 -0.05 0.00 0.00 56.93 57.40 2qwg s PHE 422 Cb 0.07 0.60 -0.04 0.00 -0.63 0.00 0.00 43.02 43.02 2qwg s PHE 422 CO 0.07 -0.93 -0.14 1.52 -0.05 0.00 0.00 175.22 175.70 2qwg s TYR 423 N -3.74 1.49 -0.07 3.49 -0.85 -0.86 -1.60 117.35 115.21 2qwg s TYR 423 Ca 0.04 -0.58 0.03 0.00 -0.52 0.00 0.00 57.07 56.04 2qwg s TYR 423 Cb -0.02 -0.75 0.01 0.00 0.38 0.00 0.00 41.96 41.57 2qwg s TYR 423 CO -0.08 0.20 -0.16 0.08 -1.52 0.00 0.00 175.55 174.07 2qwg s VAL 424 N -2.47 1.43 -0.12 -3.49 1.01 0.43 -2.70 120.40 114.49 2qwg s VAL 424 Ca 0.14 -0.67 -0.25 0.00 0.00 0.00 0.00 61.98 61.20 2qwg s VAL 424 Cb -0.03 -1.27 -0.02 0.00 0.00 0.00 0.00 36.38 35.06 2qwg s VAL 424 CO 0.04 0.42 0.81 -0.70 0.00 0.00 0.00 175.10 175.67 2qwg s GLU 425 N 0.46 4.37 -0.73 2.72 2.12 0.18 -2.52 118.70 125.30 2qwg s GLU 425 Ca -0.14 1.03 -0.10 0.00 0.36 0.00 0.00 54.97 56.13 2qwg s GLU 425 Cb -0.16 -3.52 0.19 0.00 0.26 0.00 0.00 34.13 30.90 2qwg s GLU 425 CO 0.05 -0.17 0.62 -0.51 -0.54 0.00 0.00 175.26 174.71 2qwg s LEU 426 N 1.59 6.14 0.13 2.70 1.43 -0.72 -0.81 118.68 129.15 2qwg s LEU 426 Ca 0.40 -2.69 -0.30 0.00 -1.03 0.00 0.00 54.13 50.50 2qwg s LEU 426 Cb -0.17 -2.07 -0.07 0.00 0.03 0.00 0.00 46.19 43.91 2qwg s LEU 426 CO 0.16 -0.51 1.18 -0.63 0.23 0.00 0.00 176.35 176.78 2qwg s ILE 427 N 0.17 3.81 0.12 -0.59 1.01 -0.58 -1.88 121.20 123.27 2qwg s ILE 427 Ca 0.17 1.44 0.07 0.00 0.00 0.00 0.00 60.65 62.32 2qwg s ILE 427 Cb -0.15 -3.92 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 2qwg s ILE 427 CO -0.06 0.19 -0.16 -0.13 0.00 0.00 0.00 174.94 174.77 2qwg s ARG 428 N 0.25 1.06 1.28 2.79 1.81 0.01 -4.67 118.95 121.48 2qwg s ARG 428 Ca 0.54 -1.22 0.00 0.00 -1.72 0.00 0.00 55.73 53.33 2qwg s ARG 428 Cb -0.31 -1.06 0.00 0.00 -0.45 0.00 0.00 34.95 33.13 2qwg s ARG 428 CO 0.33 0.22 0.00 0.41 -0.68 0.00 0.00 175.30 175.58 2qwg n GLY 429 N 0.68 0.30 3.78 -3.53 0.00 -1.26 -1.17 105.19 103.98 2qwg n GLY 429 Ca -0.16 -1.47 -0.36 0.00 0.00 0.00 0.00 46.02 44.02 2qwg n GLY 429 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qwg s ARG 430 N 0.00 3.88 0.21 1.61 0.52 0.26 -0.09 118.95 125.34 2qwg s ARG 430 Ca 0.00 1.59 0.23 0.00 -0.52 0.00 0.00 55.73 57.03 2qwg s ARG 430 Cb 0.00 -2.37 0.08 0.00 0.52 0.00 0.00 34.95 33.18 2qwg s ARG 430 CO 0.00 -0.40 1.13 -1.00 0.02 0.00 0.00 175.30 175.05 2qwg h PRO 431 N 2.05 0.00 -0.00 3.54 0.13 -1.93 -3.44 132.00 132.36 2qwg h PRO 431 Ca -0.49 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.55 2qwg h PRO 431 Cb 1.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.35 2qwg h PRO 431 CO 0.60 0.00 -0.43 0.87 -0.23 0.00 0.00 178.00 178.81 2qwg h LYS 432 N 0.00 0.01 -3.08 0.86 1.79 -1.96 -3.34 116.57 110.86 2qwg h LYS 432 Ca 0.00 -0.00 -0.62 0.00 -2.18 0.00 0.00 60.65 57.84 2qwg h LYS 432 Cb 0.96 -0.00 -0.42 0.00 -1.58 0.00 0.00 32.23 31.19 2qwg h LYS 432 CO 0.00 0.44 -0.56 0.39 -1.08 0.00 0.00 179.45 178.64 2qwg n GLU 433 N -4.02 1.86 -0.02 3.15 1.02 0.87 -4.95 120.64 118.55 2qwg n GLU 433 Ca -0.02 -4.50 0.08 0.00 -0.02 0.00 0.00 57.16 52.70 2qwg n GLU 433 Cb 0.46 -2.29 0.41 0.00 -0.02 0.00 0.00 31.44 29.99 2qwg n GLU 433 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2qwg n ASP 434 N 1.94 0.34 0.27 1.62 5.68 -1.26 -3.49 116.55 121.64 2qwg n ASP 434 Ca 0.20 -1.60 0.16 0.00 -0.50 0.00 0.00 54.79 53.06 2qwg n ASP 434 Cb 0.35 -0.03 0.65 0.00 -1.14 0.00 0.00 41.12 40.96 2qwg n ASP 434 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 2qwg h LYS 435 N 0.43 0.00 -6.20 0.11 1.57 -1.95 -3.42 116.57 107.12 2qwg h LYS 435 Ca 0.00 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.27 2qwg h LYS 435 Cb 0.09 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.35 2qwg h LYS 435 CO 0.00 0.04 -0.53 0.14 -0.57 0.00 0.00 179.45 178.53 2qwg s VAL 436 N -3.68 4.48 -2.85 0.50 -7.23 -1.23 -4.96 120.40 105.43 2qwg s VAL 436 Ca 0.01 -1.34 0.25 0.00 -1.81 0.00 0.00 61.98 59.09 2qwg s VAL 436 Cb 0.09 -3.40 0.28 0.00 0.56 0.00 0.00 36.38 33.92 2qwg s VAL 436 CO 0.56 -0.31 1.39 0.79 -0.31 0.00 0.00 175.10 177.22 2qwg n TRP 437 N -1.04 0.00 -3.86 2.82 7.02 -1.26 -4.64 117.44 116.49 2qwg n TRP 437 Ca -0.08 0.00 -0.23 0.00 -1.02 0.00 0.00 57.50 56.17 2qwg n TRP 437 Cb 0.57 -0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 29.42 2qwg n TRP 437 CO 0.00 0.00 0.00 1.67 -2.02 0.00 0.00 177.69 177.34 2qwg s TRP 438 N -2.01 2.45 -0.04 -5.99 1.48 -1.26 -1.56 118.94 112.01 2qwg s TRP 438 Ca 0.30 -0.60 -0.01 0.00 -1.06 0.00 0.00 56.10 54.73 2qwg s TRP 438 Cb 0.20 -2.04 0.03 0.00 -1.16 0.00 0.00 33.47 30.51 2qwg s TRP 438 CO 0.31 -0.07 0.07 0.99 -4.06 0.00 0.00 176.95 174.19 2qwg s THR 439 N -2.59 -0.09 0.00 0.66 2.01 -1.26 -0.58 115.64 113.80 2qwg s THR 439 Ca 0.42 0.28 0.00 0.00 0.31 0.00 0.00 61.69 62.70 2qwg s THR 439 Cb -0.00 -0.15 0.00 0.00 0.01 0.00 0.00 72.50 72.36 2qwg s THR 439 CO 0.24 0.11 0.00 -0.24 -0.69 0.00 0.00 174.62 174.05 2qwg n SER 440 N 4.56 0.00 -3.60 3.53 2.88 -0.32 -4.61 113.62 116.05 2qwg n SER 440 Ca -0.20 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.31 2qwg n SER 440 Cb 0.50 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.96 2qwg n SER 440 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2qwg s ASN 441 N 1.44 -0.11 0.41 -3.46 4.22 -1.24 -0.81 114.94 115.39 2qwg s ASN 441 Ca 0.00 -0.50 0.04 0.00 -2.14 0.00 0.00 52.86 50.26 2qwg s ASN 441 Cb 0.00 0.49 -0.03 0.00 1.28 0.00 0.00 41.25 42.99 2qwg s ASN 441 CO 0.00 -0.93 0.11 -0.94 -2.04 0.00 0.00 177.10 173.30 2qwg s SER 442 N -3.09 2.86 0.01 3.54 1.04 -0.79 -4.41 113.70 112.87 2qwg s SER 442 Ca 0.15 -1.65 0.06 0.00 0.48 0.00 0.00 55.95 54.99 2qwg s SER 442 Cb -0.02 0.46 -0.02 0.00 0.10 0.00 0.00 66.02 66.54 2qwg s SER 442 CO 0.03 -0.90 -0.17 -0.63 0.98 0.00 0.00 173.24 172.55 2qwg s ILE 443 N -3.19 1.37 -0.01 -1.02 1.01 -1.26 -1.75 121.20 116.35 2qwg s ILE 443 Ca 0.23 -0.91 0.03 0.00 0.00 0.00 0.00 60.65 60.00 2qwg s ILE 443 Cb 0.03 -1.18 -0.01 0.00 0.01 0.00 0.00 42.46 41.31 2qwg s ILE 443 CO 0.14 0.24 -0.11 0.54 0.00 0.00 0.00 174.94 175.75 2qwg s VAL 444 N -0.61 0.89 0.01 2.92 0.11 -1.05 -2.08 120.40 120.60 2qwg s VAL 444 Ca 0.06 -0.48 -0.03 0.00 -2.93 0.00 0.00 61.98 58.60 2qwg s VAL 444 Cb -0.07 -0.74 -0.01 0.00 -1.53 0.00 0.00 36.38 34.02 2qwg s VAL 444 CO 0.00 0.25 0.05 -0.94 -3.33 0.00 0.00 175.10 171.14 2qwg s SER 445 N -0.23 0.12 0.19 3.54 1.04 0.84 -0.43 113.70 118.77 2qwg s SER 445 Ca 0.04 -0.33 0.03 0.00 0.48 0.00 0.00 55.95 56.17 2qwg s SER 445 Cb -0.05 0.15 -0.05 0.00 0.10 0.00 0.00 66.02 66.18 2qwg s SER 445 CO -0.00 -0.32 -0.02 -0.04 0.98 0.00 0.00 173.24 173.84 2qwg s MET 446 N -1.34 1.20 0.08 4.02 -1.94 -0.63 -0.92 119.30 119.77 2qwg s MET 446 Ca -0.14 -1.58 0.01 0.00 -1.71 0.00 0.00 55.69 52.26 2qwg s MET 446 Cb -0.08 -0.47 -0.04 0.00 2.01 0.00 0.00 34.83 36.25 2qwg s MET 446 CO 0.00 -0.08 -0.05 0.00 -0.01 0.00 0.00 175.02 174.88 2qwg s SER 448 N -2.96 6.35 0.06 0.00 1.04 0.50 -0.28 113.70 118.41 2qwg s SER 448 Ca 0.09 1.64 0.06 0.00 0.48 0.00 0.00 55.95 58.23 2qwg s SER 448 Cb 0.06 -2.51 -0.03 0.00 0.10 0.00 0.00 66.02 63.64 2qwg s SER 448 CO -0.07 -0.77 -0.17 -0.55 0.98 0.00 0.00 173.24 172.66 2qwg s SER 449 N -3.03 2.08 0.00 7.02 0.15 0.55 -4.74 113.70 115.73 2qwg s SER 449 Ca 0.60 -0.57 0.28 0.00 0.70 0.00 0.00 55.95 56.96 2qwg s SER 449 Cb -0.12 -0.12 1.07 0.00 -1.71 0.00 0.00 66.02 65.14 2qwg s SER 449 CO 0.34 0.05 1.78 0.35 1.20 0.00 0.00 173.24 176.95 2qwg n THR 450 N 1.53 0.00 -2.16 6.45 -2.24 -1.26 -1.23 114.28 115.38 2qwg n THR 450 Ca -0.19 -0.04 -0.27 0.00 -2.27 0.00 0.00 64.05 61.28 2qwg n THR 450 Cb 0.54 -0.08 0.07 0.00 -2.10 0.00 0.00 70.33 68.76 2qwg n THR 450 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2qwg s GLU 451 N -2.66 2.29 -0.91 -0.78 0.41 -1.26 -4.66 118.70 111.13 2qwg s GLU 451 Ca 0.23 -0.11 -0.03 0.00 -0.41 0.00 0.00 54.97 54.64 2qwg s GLU 451 Cb 0.19 -2.14 0.23 0.00 -1.78 0.00 0.00 34.13 30.63 2qwg s GLU 451 CO 0.53 -1.22 0.81 -0.06 -0.49 0.00 0.00 175.26 174.83 2qwg s PHE 452 N -3.28 3.92 0.45 1.61 0.40 -1.26 -3.20 117.98 116.62 2qwg s PHE 452 Ca 0.59 -2.95 -0.22 0.00 -0.60 0.00 0.00 56.93 53.76 2qwg s PHE 452 Cb -0.11 -3.34 -0.09 0.00 0.51 0.00 0.00 43.02 40.00 2qwg s PHE 452 CO 0.46 -0.78 1.04 -0.51 0.70 0.00 0.00 175.22 176.13 2qwg s LEU 453 N -1.24 3.98 0.63 -0.37 1.43 -1.26 -5.03 118.68 116.82 2qwg s LEU 453 Ca 0.27 1.97 -0.18 0.00 -1.03 0.00 0.00 54.13 55.16 2qwg s LEU 453 Cb -0.08 -4.40 -0.01 0.00 0.03 0.00 0.00 46.19 41.72 2qwg s LEU 453 CO -0.11 -0.64 1.21 -0.83 0.23 0.00 0.00 176.35 176.21 2qwg s GLY 454 N -1.81 2.64 0.19 -3.19 0.00 -1.26 -4.89 107.32 99.01 2qwg s GLY 454 Ca 0.63 0.99 0.06 0.00 0.00 0.00 0.00 44.72 46.39 2qwg s GLY 454 CO 0.23 1.38 0.16 -0.86 0.00 0.00 0.00 173.10 174.01 2qwg s GLN 455 N -3.50 2.92 0.10 2.90 -2.07 -1.26 -5.01 119.66 113.73 2qwg s GLN 455 Ca 0.77 -0.92 -0.02 0.00 -1.82 0.00 0.00 55.36 53.36 2qwg s GLN 455 Cb -0.31 -2.62 -0.03 0.00 -1.09 0.00 0.00 33.01 28.96 2qwg s GLN 455 CO 0.37 0.46 0.05 -0.46 -1.32 0.00 0.00 175.29 174.39 2qwg s TRP 456 N -1.87 0.61 0.10 9.60 -0.00 -1.26 -5.09 118.94 121.03 2qwg s TRP 456 Ca 0.32 -1.06 0.03 0.00 -0.00 0.00 0.00 56.10 55.38 2qwg s TRP 456 Cb -0.09 -0.37 -0.04 0.00 -0.00 0.00 0.00 33.47 32.97 2qwg s TRP 456 CO 0.24 -0.48 0.16 0.16 -0.00 0.00 0.00 176.95 177.03 2qwg s ASP 457 N -2.97 5.87 -0.58 5.86 -4.77 -1.26 -4.60 116.67 114.23 2qwg s ASP 457 Ca 0.14 0.07 0.05 0.00 -3.30 0.00 0.00 52.55 49.51 2qwg s ASP 457 Cb 0.07 -1.67 0.18 0.00 -1.09 0.00 0.00 42.92 40.41 2qwg s ASP 457 CO -0.05 0.13 0.45 0.79 0.70 0.00 0.00 175.17 177.19 2qwg n TRP 458 N 0.08 1.47 -1.79 2.11 7.02 0.44 -4.99 117.44 121.78 2qwg n TRP 458 Ca -0.07 -3.88 -0.29 0.00 -1.02 0.00 0.00 57.50 52.24 2qwg n TRP 458 Cb 0.52 -0.26 0.10 0.00 -2.42 0.00 0.00 31.31 29.26 2qwg n TRP 458 CO 0.00 0.00 0.00 -1.25 -2.02 0.00 0.00 177.69 174.42 2qwg s PRO 459 N -0.91 1.70 0.13 -0.99 0.04 -1.26 -4.79 135.00 128.91 2qwg s PRO 459 Ca 0.29 0.16 -0.19 0.00 0.04 0.00 0.00 61.00 61.30 2qwg s PRO 459 Cb 0.01 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 32.59 2qwg s PRO 459 CO -0.17 -1.79 1.77 0.22 0.04 0.00 0.00 177.00 177.06 2qwg h ASP 460 N -1.20 0.17 0.00 6.66 3.58 -1.92 -3.47 116.42 120.23 2qwg h ASP 460 Ca -0.47 0.01 0.00 0.00 0.42 0.00 0.00 57.03 56.98 2qwg h ASP 460 Cb 1.33 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 42.35 2qwg h ASP 460 CO 0.65 0.13 0.00 0.61 -2.88 0.00 0.00 179.24 177.74 2qwg n GLY 461 N -1.16 0.77 3.85 -0.78 0.00 -1.26 -4.75 105.19 101.86 2qwg n GLY 461 Ca -0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 2qwg n GLY 461 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qwg s ALA 462 N -2.41 3.33 -0.40 4.61 0.00 -1.26 -4.90 121.76 120.72 2qwg s ALA 462 Ca 0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 51.96 51.82 2qwg s ALA 462 Cb 0.00 -2.75 0.03 0.00 0.00 0.00 0.00 23.12 20.40 2qwg s ALA 462 CO 0.00 0.26 0.27 0.15 0.00 0.00 0.00 175.76 176.44 2qwg s LYS 463 N -3.17 2.89 0.33 0.00 1.02 -1.26 -4.96 119.74 114.60 2qwg s LYS 463 Ca 0.54 -1.09 0.08 0.00 0.02 0.00 0.00 55.97 55.52 2qwg s LYS 463 Cb -0.10 -3.89 0.79 0.00 -0.52 0.00 0.00 37.83 34.11 2qwg s LYS 463 CO 0.20 -0.76 1.82 0.82 -0.92 0.00 0.00 175.35 176.51 2qwg h ILE 464 N 5.76 0.76 -1.04 2.17 1.08 -2.01 -1.35 117.51 122.88 2qwg h ILE 464 Ca -0.26 -0.25 0.26 0.00 -0.39 0.00 0.00 64.86 64.22 2qwg h ILE 464 Cb 1.11 -0.02 -0.09 0.00 -3.07 0.00 0.00 36.82 34.74 2qwg h ILE 464 CO 0.72 0.13 0.66 1.05 -0.69 0.00 0.00 178.15 180.03 2qwg h GLU 465 N 0.72 0.39 0.00 2.37 9.09 -2.01 0.15 114.58 125.29 2qwg h GLU 465 Ca 0.52 -0.02 -0.02 0.00 0.05 0.00 0.00 59.36 59.88 2qwg h GLU 465 Cb 0.86 -0.09 -0.00 0.00 -1.65 0.00 0.00 28.75 27.87 2qwg h GLU 465 CO -0.29 0.26 -0.11 1.88 0.05 0.00 0.00 179.01 180.80 2qwg h TYR 466 N 0.40 0.00 0.00 2.06 0.05 -1.67 -2.46 116.97 115.36 2qwg h TYR 466 Ca 0.60 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.38 2qwg h TYR 466 Cb 1.49 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.23 2qwg h TYR 466 CO -0.00 0.11 -0.15 1.19 -1.05 0.00 0.00 178.16 178.26 2qwg n PHE 467 N -4.19 0.18 1.98 4.88 3.72 0.51 -5.15 117.46 119.40 2qwg n PHE 467 Ca -0.03 0.05 0.16 0.00 -0.05 0.00 0.00 57.45 57.59 2qwg n PHE 467 Cb 0.19 -0.53 0.94 0.00 -0.94 0.00 0.00 39.48 39.14 2qwg n PHE 467 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99