#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gth s ASP 93 N 0.00 6.21 0.25 1.61 3.68 -1.26 -5.06 116.67 122.10 3gth s ASP 93 Ca 0.00 -1.88 -0.04 0.00 2.13 0.00 0.00 52.55 52.76 3gth s ASP 93 Cb 0.00 -2.20 -0.05 0.00 -1.45 0.00 0.00 42.92 39.22 3gth s ASP 93 CO 0.00 -0.82 0.49 0.00 0.13 0.00 0.00 175.17 174.97 3gth s ALA 94 N 1.45 3.70 0.08 3.66 0.00 -1.26 -4.86 121.76 124.52 3gth s ALA 94 Ca 0.05 -0.62 -0.32 0.00 0.00 0.00 0.00 51.96 51.06 3gth s ALA 94 Cb -0.28 -2.20 -0.12 0.00 0.00 0.00 0.00 23.12 20.52 3gth s ALA 94 CO 0.02 0.35 1.80 -2.30 0.00 0.00 0.00 175.76 175.63 3gth n PRO 95 N -0.72 2.53 -4.09 0.00 -0.02 -1.26 -4.86 135.00 126.58 3gth n PRO 95 Ca -0.02 0.92 -0.32 0.00 -2.02 0.00 0.00 63.50 62.05 3gth n PRO 95 Cb 0.54 -2.78 -0.16 0.00 -0.02 0.00 0.00 33.50 31.08 3gth n PRO 95 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3gth s GLY 96 N 2.72 1.50 0.00 -1.23 0.00 -1.26 -5.04 107.32 104.01 3gth s GLY 96 Ca 0.84 -1.47 0.00 0.00 0.00 0.00 0.00 44.72 44.09 3gth s GLY 96 CO 0.41 0.47 0.00 0.61 0.00 0.00 0.00 173.10 174.58 3gth n GLY 97 N 4.54 0.95 3.47 0.20 0.00 -1.26 -4.89 105.19 108.19 3gth n GLY 97 Ca -0.17 -1.90 -0.34 0.00 0.00 0.00 0.00 46.02 43.60 3gth n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gth n ALA 98 N -1.00 -1.86 -3.61 4.61 0.00 -1.26 -4.94 120.51 112.45 3gth n ALA 98 Ca 0.00 -0.44 -0.14 0.00 0.00 0.00 0.00 53.44 52.86 3gth n ALA 98 Cb 0.00 -1.88 -0.07 0.00 0.00 0.00 0.00 19.45 17.50 3gth n ALA 98 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3gth s HIS 99 N -2.18 -0.72 0.02 0.00 5.04 -1.19 -3.52 115.29 112.74 3gth s HIS 99 Ca 0.62 1.65 0.04 0.00 -1.54 0.00 0.00 55.06 55.82 3gth s HIS 99 Cb -0.27 0.31 -0.02 0.00 0.04 0.00 0.00 32.58 32.64 3gth s HIS 99 CO 0.62 -0.41 -0.11 -1.64 -2.34 0.00 0.00 174.74 170.86 3gth s MET 101 N 0.01 0.77 0.67 2.88 -1.94 -1.23 -4.96 119.30 115.50 3gth s MET 101 Ca -0.02 -0.59 -0.16 0.00 -1.71 0.00 0.00 55.69 53.21 3gth s MET 101 Cb -0.04 -0.72 0.01 0.00 2.01 0.00 0.00 34.83 36.08 3gth s MET 101 CO 0.02 0.18 1.19 -0.08 -0.01 0.00 0.00 175.02 176.32 3gth s THR 102 N -0.71 2.57 -0.18 2.05 -1.32 -1.26 -4.85 115.64 111.94 3gth s THR 102 Ca 0.00 0.30 -0.41 0.00 -1.21 0.00 0.00 61.69 60.38 3gth s THR 102 Cb -0.07 -2.94 -0.17 0.00 -1.51 0.00 0.00 72.50 67.81 3gth s THR 102 CO 0.01 -0.13 1.50 0.00 -2.21 0.00 0.00 174.62 173.78 3gth n ALA 103 N -2.28 -1.19 -2.77 11.08 0.00 -1.14 -4.75 120.51 119.46 3gth n ALA 103 Ca 0.13 0.48 -0.37 0.00 0.00 0.00 0.00 53.44 53.68 3gth n ALA 103 Cb 0.50 -2.05 -0.11 0.00 0.00 0.00 0.00 19.45 17.79 3gth n ALA 103 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3gth s GLN 104 N 2.02 3.89 0.42 0.00 -1.52 -1.26 -0.80 119.66 122.42 3gth s GLN 104 Ca 0.95 -0.36 0.07 0.00 -1.95 0.00 0.00 55.36 54.07 3gth s GLN 104 Cb -1.15 -3.48 -0.04 0.00 -0.22 0.00 0.00 33.01 28.12 3gth s GLN 104 CO 0.62 -0.07 0.27 0.95 -0.25 0.00 0.00 175.29 176.80 3gth s THR 105 N 1.39 2.40 -1.49 -0.19 -4.23 -0.62 -3.66 115.64 109.24 3gth s THR 105 Ca 0.06 -1.55 0.11 0.00 -1.18 0.00 0.00 61.69 59.13 3gth s THR 105 Cb -0.15 -2.95 0.20 0.00 1.34 0.00 0.00 72.50 70.94 3gth s THR 105 CO 0.06 0.00 1.22 1.33 -0.54 0.00 0.00 174.62 176.69 3gth n VAL 106 N -1.38 0.66 -0.01 2.29 0.24 0.18 -0.96 118.33 119.35 3gth n VAL 106 Ca 0.01 0.17 0.02 0.00 -2.04 0.00 0.00 64.34 62.49 3gth n VAL 106 Cb 0.63 -0.99 0.05 0.00 -1.47 0.00 0.00 33.84 32.06 3gth n VAL 106 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3gth n THR 107 N -1.25 0.77 0.00 3.34 -2.24 -1.26 -4.74 114.28 108.90 3gth n THR 107 Ca 0.05 -0.89 0.00 0.00 -2.27 0.00 0.00 64.05 60.95 3gth n THR 107 Cb 0.08 0.63 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 3gth n THR 107 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gth n GLY 108 N -0.04 0.84 3.77 3.38 0.00 -0.13 -5.06 105.19 107.95 3gth n GLY 108 Ca 0.04 -2.30 -0.41 0.00 0.00 0.00 0.00 46.02 43.35 3gth n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gth s ALA 109 N -1.07 3.55 -0.01 4.61 0.00 -1.26 -1.58 121.76 125.99 3gth s ALA 109 Ca 0.00 1.43 0.01 0.00 0.00 0.00 0.00 51.96 53.41 3gth s ALA 109 Cb 0.00 -3.56 0.01 0.00 0.00 0.00 0.00 23.12 19.57 3gth s ALA 109 CO 0.00 -0.87 -0.04 0.54 0.00 0.00 0.00 175.76 175.39 3gth s VAL 110 N -1.02 0.38 0.46 0.00 0.11 0.02 -4.92 120.40 115.43 3gth s VAL 110 Ca 0.52 -0.15 -0.24 0.00 -2.93 0.00 0.00 61.98 59.18 3gth s VAL 110 Cb -0.44 -0.36 -0.07 0.00 -1.53 0.00 0.00 36.38 33.99 3gth s VAL 110 CO 0.57 0.13 1.27 0.00 -3.33 0.00 0.00 175.10 173.75 3gth s ALA 111 N 0.22 3.03 0.40 1.54 0.00 -1.26 -3.29 121.76 122.41 3gth s ALA 111 Ca -0.02 1.16 0.14 0.00 0.00 0.00 0.00 51.96 53.24 3gth s ALA 111 Cb -0.06 -3.47 0.99 0.00 0.00 0.00 0.00 23.12 20.58 3gth s ALA 111 CO -0.00 -0.92 1.89 0.00 0.00 0.00 0.00 175.76 176.73 3gth h ALA 112 N 2.11 2.05 0.00 0.00 0.00 -1.88 0.27 119.26 121.81 3gth h ALA 112 Ca -0.50 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3gth h ALA 112 Cb 1.26 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3gth h ALA 112 CO 0.60 -0.29 0.00 0.00 0.00 0.00 0.00 179.25 179.57 3gth h ALA 113 N 1.62 1.00 -0.32 0.00 0.00 -1.90 -2.91 119.26 116.76 3gth h ALA 113 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.33 3gth h ALA 113 Cb 0.88 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.67 3gth h ALA 113 CO -0.16 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.13 3gth n GLN 114 N -2.66 2.25 -0.02 0.00 6.02 0.94 -4.21 117.38 119.70 3gth n GLN 114 Ca 0.01 -1.88 -0.14 0.00 -0.01 0.00 0.00 57.00 54.98 3gth n GLN 114 Cb 0.26 -1.47 -0.02 0.00 1.02 0.00 0.00 30.24 30.03 3gth n GLN 114 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3gth h LEU 115 N 3.69 0.81 0.00 1.08 3.38 -1.52 -3.48 115.31 119.28 3gth h LEU 115 Ca 0.00 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.48 3gth h LEU 115 Cb 0.81 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.33 3gth h LEU 115 CO 0.00 1.27 0.00 0.61 0.09 0.00 0.00 178.44 180.41 3gth n GLY 116 N 0.53 0.35 3.77 0.83 0.00 -1.26 -3.49 105.19 105.92 3gth n GLY 116 Ca -0.05 -0.94 -0.41 0.00 0.00 0.00 0.00 46.02 44.62 3gth n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gth s ALA 117 N -1.75 3.54 0.02 4.61 0.00 -1.26 -4.62 121.76 122.30 3gth s ALA 117 Ca 0.00 1.34 0.02 0.00 0.00 0.00 0.00 51.96 53.32 3gth s ALA 117 Cb 0.00 -3.52 -0.01 0.00 0.00 0.00 0.00 23.12 19.58 3gth s ALA 117 CO 0.00 -0.75 -0.07 0.99 0.00 0.00 0.00 175.76 175.94 3gth s THR 118 N -0.88 0.50 -0.35 0.00 2.01 -0.50 -0.89 115.64 115.54 3gth s THR 118 Ca 0.52 -0.67 -0.09 0.00 0.31 0.00 0.00 61.69 61.77 3gth s THR 118 Cb -0.42 -0.50 0.02 0.00 0.01 0.00 0.00 72.50 71.62 3gth s THR 118 CO 0.53 -0.13 0.15 -0.76 -0.69 0.00 0.00 174.62 173.72 3gth s LEU 119 N -0.86 4.41 0.00 4.42 1.43 -0.31 -4.86 118.68 122.90 3gth s LEU 119 Ca -0.04 -0.94 0.22 0.00 -1.03 0.00 0.00 54.13 52.34 3gth s LEU 119 Cb -0.06 -1.95 1.13 0.00 0.03 0.00 0.00 46.19 45.33 3gth s LEU 119 CO 0.00 -0.32 1.71 -0.81 0.23 0.00 0.00 176.35 177.16 3gth n PRO 120 N 4.92 0.34 -3.22 1.29 -0.04 -1.26 -0.76 135.00 136.27 3gth n PRO 120 Ca -0.13 0.07 -0.02 0.00 -0.04 0.00 0.00 63.50 63.39 3gth n PRO 120 Cb 0.46 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.40 3gth n PRO 120 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3gth s HIS 121 N -2.53 -1.51 0.23 0.54 5.65 -1.23 -4.60 115.29 111.84 3gth s HIS 121 Ca 0.22 0.49 0.00 0.00 0.25 0.00 0.00 55.06 56.02 3gth s HIS 121 Cb 0.15 0.15 -0.03 0.00 -1.18 0.00 0.00 32.58 31.67 3gth s HIS 121 CO 0.33 -1.09 0.19 -1.21 -0.65 0.00 0.00 174.74 172.31 3gth s GLU 122 N 2.34 1.36 -0.19 2.88 0.41 -0.58 -1.61 118.70 123.31 3gth s GLU 122 Ca 0.12 -1.69 -0.04 0.00 -0.41 0.00 0.00 54.97 52.95 3gth s GLU 122 Cb -0.09 0.30 0.06 0.00 -1.78 0.00 0.00 34.13 32.62 3gth s GLU 122 CO -0.19 -0.47 0.06 -1.01 -0.49 0.00 0.00 175.26 173.16 3gth s HIS 123 N -3.97 0.73 0.06 1.61 3.76 -0.25 -1.54 115.29 115.69 3gth s HIS 123 Ca 0.38 -0.68 -0.33 0.00 -0.15 0.00 0.00 55.06 54.28 3gth s HIS 123 Cb 0.05 -0.92 -0.19 0.00 1.11 0.00 0.00 32.58 32.64 3gth s HIS 123 CO 0.15 -0.59 1.57 0.28 -0.85 0.00 0.00 174.74 175.31 3gth h VAL 124 N 6.48 0.28 -3.45 -0.90 2.07 -1.94 -0.90 116.25 117.90 3gth h VAL 124 Ca -0.16 -0.04 -0.50 0.00 0.82 0.00 0.00 66.70 66.82 3gth h VAL 124 Cb 1.13 0.30 -0.18 0.00 -1.52 0.00 0.00 31.29 31.01 3gth h VAL 124 CO 0.33 0.01 -0.78 0.27 0.02 0.00 0.00 177.57 177.41 3gth s ILE 125 N -5.91 1.68 -0.20 4.57 -4.36 -1.26 -1.06 121.20 114.66 3gth s ILE 125 Ca -0.18 -1.82 -0.27 0.00 -0.26 0.00 0.00 60.65 58.12 3gth s ILE 125 Cb 0.03 -1.73 0.09 0.00 1.25 0.00 0.00 42.46 42.10 3gth s ILE 125 CO 0.60 -0.31 0.81 0.12 0.24 0.00 0.00 174.94 176.41 3gth s PHE 126 N -1.96 -0.64 -0.12 1.37 2.19 -0.96 -4.79 117.98 113.07 3gth s PHE 126 Ca 0.13 1.41 -0.09 0.00 0.33 0.00 0.00 56.93 58.70 3gth s PHE 126 Cb -0.06 0.35 0.04 0.00 -1.31 0.00 0.00 43.02 42.03 3gth s PHE 126 CO 0.05 -0.40 0.31 0.20 1.83 0.00 0.00 175.22 177.21 3gth s GLY 127 N -0.22 -0.22 0.44 13.12 0.00 0.33 -0.06 107.32 120.71 3gth s GLY 127 Ca -0.02 0.97 -0.24 0.00 0.00 0.00 0.00 44.72 45.43 3gth s GLY 127 CO 0.02 0.97 1.23 -0.19 0.00 0.00 0.00 173.10 175.12 3gth s TYR 128 N 0.55 2.82 -0.19 1.90 4.12 -1.26 -4.01 117.35 121.29 3gth s TYR 128 Ca -0.03 1.49 -0.36 0.00 0.02 0.00 0.00 57.07 58.18 3gth s TYR 128 Cb -0.05 -3.51 -0.13 0.00 -1.52 0.00 0.00 41.96 36.75 3gth s TYR 128 CO -0.03 -1.80 1.88 -2.30 0.02 0.00 0.00 175.55 173.33 3gth n PRO 129 N -0.28 1.71 0.00 -1.71 -0.02 -1.26 -0.88 135.00 132.55 3gth n PRO 129 Ca 0.06 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 3gth n PRO 129 Cb 0.46 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 3gth n PRO 129 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gth n GLY 130 N 4.63 1.75 0.40 -1.23 0.00 -1.26 -4.97 105.19 104.49 3gth n GLY 130 Ca 0.26 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.50 3gth n GLY 130 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3gth h TYR 131 N 0.00 0.73 -0.24 1.61 -0.00 -1.35 0.20 116.97 117.92 3gth h TYR 131 Ca 0.00 0.03 -0.09 0.00 -0.00 0.00 0.00 58.73 58.66 3gth h TYR 131 Cb 0.00 -0.21 -0.01 0.00 -0.00 0.00 0.00 36.73 36.51 3gth h TYR 131 CO 0.00 0.05 -0.24 0.00 -0.00 0.00 0.00 178.16 177.97 3gth h ALA 132 N 1.64 1.14 0.00 0.10 0.00 -1.94 -1.22 119.26 118.99 3gth h ALA 132 Ca 0.61 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3gth h ALA 132 Cb 1.48 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.16 3gth h ALA 132 CO -0.34 0.54 0.00 0.41 0.00 0.00 0.00 179.25 179.86 3gth n GLY 133 N -0.42 -0.68 1.43 0.00 0.00 0.69 -1.88 105.19 104.34 3gth n GLY 133 Ca -0.00 -0.03 -0.07 0.00 0.00 0.00 0.00 46.02 45.91 3gth n GLY 133 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3gth n ASP 134 N -1.42 3.10 0.08 1.61 2.03 -0.46 -4.70 116.55 116.79 3gth n ASP 134 Ca 0.03 -3.61 0.03 0.00 0.52 0.00 0.00 54.79 51.75 3gth n ASP 134 Cb 0.08 -0.68 0.40 0.00 -0.72 0.00 0.00 41.12 40.20 3gth n ASP 134 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 3gth h VAL 135 N 1.22 1.15 -0.01 5.18 3.04 -1.46 0.26 116.25 125.64 3gth h VAL 135 Ca 0.29 -0.60 0.00 0.00 -1.01 0.00 0.00 66.70 65.39 3gth h VAL 135 Cb 1.96 0.99 -0.00 0.00 -2.01 0.00 0.00 31.29 32.23 3gth h VAL 135 CO 0.56 0.20 0.01 0.74 -1.01 0.00 0.00 177.57 178.06 3gth h THR 136 N 0.34 1.01 0.00 3.17 2.02 -1.86 -2.77 112.91 114.82 3gth h THR 136 Ca 0.08 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.24 3gth h THR 136 Cb 0.24 1.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 3gth h THR 136 CO 0.01 0.01 -1.31 0.18 0.37 0.00 0.00 175.52 174.77 3gth n LEU 137 N -5.08 0.53 -2.90 2.58 4.77 -1.20 -4.52 117.00 111.18 3gth n LEU 137 Ca -0.07 0.13 -0.25 0.00 -0.03 0.00 0.00 56.01 55.80 3gth n LEU 137 Cb 0.03 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.04 3gth n LEU 137 CO 0.33 -0.07 0.08 0.61 -1.33 0.00 0.00 177.39 177.01 3gth n GLY 138 N 1.26 5.19 3.78 -0.72 0.00 0.91 -4.80 105.19 110.82 3gth n GLY 138 Ca -0.01 -2.55 -0.31 0.00 0.00 0.00 0.00 46.02 43.15 3gth n GLY 138 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3gth s PRO 139 N -3.30 2.49 -0.15 1.61 0.04 -1.04 -3.61 135.00 131.03 3gth s PRO 139 Ca 0.47 1.12 -0.27 0.00 0.04 0.00 0.00 61.00 62.36 3gth s PRO 139 Cb 0.32 -1.93 -0.01 0.00 0.04 0.00 0.00 34.50 32.92 3gth s PRO 139 CO -0.13 -1.46 0.89 0.12 0.04 0.00 0.00 177.00 176.46 3gth s PHE 140 N -2.91 3.44 -0.73 0.56 5.99 -1.26 -4.82 117.98 118.25 3gth s PHE 140 Ca 0.61 1.36 -0.17 0.00 0.00 0.00 0.00 56.93 58.72 3gth s PHE 140 Cb -0.16 -3.07 0.15 0.00 0.00 0.00 0.00 43.02 39.94 3gth s PHE 140 CO 0.55 -0.24 0.78 0.34 -0.00 0.00 0.00 175.22 176.65 3gth s ASP 141 N 1.13 6.47 0.29 6.13 -1.08 -1.26 -4.92 116.67 123.44 3gth s ASP 141 Ca 0.41 -2.03 -0.02 0.00 -0.52 0.00 0.00 52.55 50.39 3gth s ASP 141 Cb -0.17 -2.28 0.42 0.00 -1.46 0.00 0.00 42.92 39.43 3gth s ASP 141 CO 0.14 -0.89 1.95 -0.74 0.52 0.00 0.00 175.17 176.15 3gth h HIS 142 N 8.60 1.05 -0.20 -5.34 -0.00 -1.99 -0.26 115.15 117.01 3gth h HIS 142 Ca -0.07 0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.27 3gth h HIS 142 Cb 1.06 -0.35 -0.01 0.00 -0.00 0.00 0.00 27.41 28.11 3gth h HIS 142 CO 0.95 0.68 -0.02 0.00 -0.00 0.00 0.00 177.93 179.54 3gth h ALA 143 N 1.45 0.28 -0.65 5.26 0.00 -1.99 -0.07 119.26 123.55 3gth h ALA 143 Ca 0.30 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 3gth h ALA 143 Cb -0.09 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3gth h ALA 143 CO -0.06 0.02 0.07 0.00 0.00 0.00 0.00 179.25 179.28 3gth h ALA 144 N 0.76 0.86 -0.40 0.00 0.00 -1.93 -1.46 119.26 117.09 3gth h ALA 144 Ca 0.05 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 3gth h ALA 144 Cb 0.44 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3gth h ALA 144 CO 0.01 0.66 0.08 0.00 0.00 0.00 0.00 179.25 180.00 3gth h ALA 145 N 1.03 0.53 -0.83 0.00 0.00 -0.94 -0.70 119.26 118.34 3gth h ALA 145 Ca 0.19 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3gth h ALA 145 Cb 0.48 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 3gth h ALA 145 CO 0.02 0.23 0.40 1.25 0.00 0.00 0.00 179.25 181.14 3gth h LEU 146 N 0.51 1.10 -0.14 0.00 5.85 -0.90 0.35 115.31 122.07 3gth h LEU 146 Ca 0.12 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 3gth h LEU 146 Cb 0.35 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 3gth h LEU 146 CO 0.01 0.93 0.03 0.00 -0.34 0.00 0.00 178.44 179.06 3gth h ALA 147 N 1.24 0.19 -0.24 1.25 0.00 -1.01 -1.52 119.26 119.16 3gth h ALA 147 Ca 0.29 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3gth h ALA 147 Cb 0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3gth h ALA 147 CO -0.04 -0.16 -0.02 1.03 0.00 0.00 0.00 179.25 180.06 3gth h SER 148 N 0.02 0.44 -0.50 0.00 0.87 -0.91 -1.98 113.55 111.49 3gth h SER 148 Ca 0.04 -0.33 -0.04 0.00 -1.23 0.00 0.00 61.79 60.23 3gth h SER 148 Cb 0.28 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.10 3gth h SER 148 CO 0.00 0.67 0.15 0.00 -0.53 0.00 0.00 176.83 177.12 3gth h THR 150 N 0.67 1.24 -0.52 0.00 1.35 -1.29 0.21 112.91 114.57 3gth h THR 150 Ca 0.16 -1.12 -0.04 0.00 -0.55 0.00 0.00 66.41 64.86 3gth h THR 150 Cb 0.28 1.27 -0.02 0.00 -1.73 0.00 0.00 68.15 67.95 3gth h THR 150 CO -0.00 0.36 0.17 -0.08 -0.25 0.00 0.00 175.52 175.71 3gth h GLU 151 N 0.39 0.80 -0.61 4.72 4.81 -0.74 0.22 114.58 124.17 3gth h GLU 151 Ca 0.07 -0.17 -0.04 0.00 -0.13 0.00 0.00 59.36 59.09 3gth h GLU 151 Cb 0.57 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.80 3gth h GLU 151 CO 0.04 0.73 0.23 1.15 -0.73 0.00 0.00 179.01 180.43 3gth h THR 152 N 0.71 1.24 -0.08 0.32 2.02 -0.32 -1.55 112.91 115.25 3gth h THR 152 Ca 0.17 -0.76 0.04 0.00 0.77 0.00 0.00 66.41 66.62 3gth h THR 152 Cb 0.26 0.58 -0.04 0.00 -1.74 0.00 0.00 68.15 67.21 3gth h THR 152 CO -0.01 0.30 -0.18 0.00 0.37 0.00 0.00 175.52 176.00 3gth h ALA 153 N 1.08 -0.15 -0.75 6.16 0.00 -0.00 -1.87 119.26 123.74 3gth h ALA 153 Ca 0.20 0.03 0.10 0.00 0.00 0.00 0.00 54.91 55.24 3gth h ALA 153 Cb 0.23 0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 3gth h ALA 153 CO -0.01 -0.65 0.49 0.00 0.00 0.00 0.00 179.25 179.08 3gth h ARG 154 N -0.25 0.62 -0.00 0.00 3.08 -0.24 -1.39 114.38 116.20 3gth h ARG 154 Ca 0.08 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 59.98 3gth h ARG 154 Cb 0.36 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 3gth h ARG 154 CO -0.22 0.41 -0.53 0.00 -1.07 0.00 0.00 179.97 178.56 3gth h ALA 155 N 1.62 1.11 -0.19 0.04 0.00 -0.64 -1.75 119.26 119.44 3gth h ALA 155 Ca 0.35 -0.49 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 3gth h ALA 155 Cb 0.49 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3gth h ALA 155 CO -0.12 0.67 -0.43 -0.07 0.00 0.00 0.00 179.25 179.30 3gth h LEU 156 N 0.01 0.71 -0.88 0.00 3.38 -0.51 -2.89 115.31 115.13 3gth h LEU 156 Ca -0.00 -0.56 -0.02 0.00 0.09 0.00 0.00 57.88 57.39 3gth h LEU 156 Cb 0.95 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.45 3gth h LEU 156 CO 0.07 1.14 0.47 -0.07 0.09 0.00 0.00 178.44 180.14 3gth h LEU 157 N 0.31 1.11 -2.10 1.67 3.38 -1.22 0.52 115.31 118.98 3gth h LEU 157 Ca 0.00 -0.11 0.09 0.00 0.09 0.00 0.00 57.88 57.95 3gth h LEU 157 Cb 1.03 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 3gth h LEU 157 CO 0.09 0.90 0.28 0.00 0.09 0.00 0.00 178.44 179.81 3gth h ALA 158 N 1.25 2.07 -0.43 1.53 0.00 -1.13 0.89 119.26 123.44 3gth h ALA 158 Ca 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.21 3gth h ALA 158 Cb 0.05 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3gth h ALA 158 CO -0.05 -0.44 0.00 0.54 0.00 0.00 0.00 179.25 179.30 3gth n ARG 159 N -3.99 2.18 -0.72 0.00 1.74 0.07 -4.91 116.66 111.03 3gth n ARG 159 Ca 0.05 -1.81 0.00 0.00 -0.77 0.00 0.00 57.85 55.32 3gth n ARG 159 Cb 0.44 -1.43 0.00 0.00 -1.02 0.00 0.00 32.46 30.46 3gth n ARG 159 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gth n GLY 160 N 1.33 0.78 3.63 -0.13 0.00 0.31 -5.00 105.19 106.11 3gth n GLY 160 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 3gth n GLY 160 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gth s ILE 161 N -2.95 4.55 -0.18 -0.61 1.01 -0.61 -3.98 121.20 118.44 3gth s ILE 161 Ca 0.00 1.57 0.22 0.00 0.00 0.00 0.00 60.65 62.44 3gth s ILE 161 Cb 0.00 -4.37 -0.27 0.00 0.01 0.00 0.00 42.46 37.83 3gth s ILE 161 CO 0.00 -0.47 0.63 0.00 0.00 0.00 0.00 174.94 175.10 3gth n GLN 162 N 6.78 0.57 -3.91 2.79 6.02 -0.07 -3.44 117.38 126.13 3gth n GLN 162 Ca 0.10 -0.12 -0.13 0.00 -0.01 0.00 0.00 57.00 56.84 3gth n GLN 162 Cb 0.47 -1.57 -0.14 0.00 1.02 0.00 0.00 30.24 30.03 3gth n GLN 162 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3gth s THR 163 N -3.43 0.06 -0.02 5.09 2.01 -0.87 -1.36 115.64 117.13 3gth s THR 163 Ca -0.05 -0.02 0.06 0.00 0.31 0.00 0.00 61.69 61.99 3gth s THR 163 Cb 0.14 -0.07 -0.01 0.00 0.01 0.00 0.00 72.50 72.57 3gth s THR 163 CO 0.88 0.02 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.95 3gth s VAL 164 N 0.03 1.55 -0.33 3.82 1.01 -0.12 -1.16 120.40 125.20 3gth s VAL 164 Ca -0.00 -0.83 -0.08 0.00 0.00 0.00 0.00 61.98 61.07 3gth s VAL 164 Cb -0.01 -1.29 0.02 0.00 0.00 0.00 0.00 36.38 35.10 3gth s VAL 164 CO -0.00 0.44 0.12 -0.69 0.00 0.00 0.00 175.10 174.97 3gth s VAL 165 N -0.42 4.10 -0.34 2.92 1.01 0.06 -1.90 120.40 125.82 3gth s VAL 165 Ca 0.06 -0.85 -0.26 0.00 0.00 0.00 0.00 61.98 60.94 3gth s VAL 165 Cb -0.08 -3.21 0.01 0.00 0.00 0.00 0.00 36.38 33.10 3gth s VAL 165 CO -0.00 -0.07 0.91 -0.62 0.00 0.00 0.00 175.10 175.32 3gth s ASP 166 N 1.49 6.72 -0.19 3.32 2.15 0.41 -1.53 116.67 129.05 3gth s ASP 166 Ca 0.01 0.68 0.12 0.00 0.43 0.00 0.00 52.55 53.79 3gth s ASP 166 Cb -0.18 -2.46 0.67 0.00 -0.30 0.00 0.00 42.92 40.65 3gth s ASP 166 CO 0.04 -0.80 1.52 0.00 -0.17 0.00 0.00 175.17 175.77 3gth n ALA 167 N 6.63 3.61 -2.13 3.66 0.00 -0.59 -2.73 120.51 128.97 3gth n ALA 167 Ca 0.07 -1.56 -0.42 0.00 0.00 0.00 0.00 53.44 51.53 3gth n ALA 167 Cb 0.48 -1.10 -0.03 0.00 0.00 0.00 0.00 19.45 18.80 3gth n ALA 167 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3gth s THR 168 N -2.42 3.66 0.64 0.00 2.01 -1.26 -4.93 115.64 113.34 3gth s THR 168 Ca 0.45 0.93 -0.17 0.00 0.31 0.00 0.00 61.69 63.20 3gth s THR 168 Cb 0.34 -3.60 -0.01 0.00 0.01 0.00 0.00 72.50 69.24 3gth s THR 168 CO 0.13 -0.05 1.19 -2.84 -0.69 0.00 0.00 174.62 172.37 3gth s PRO 169 N 3.24 2.70 0.55 4.92 0.02 -1.26 -4.55 135.00 140.62 3gth s PRO 169 Ca 0.68 1.73 0.30 0.00 0.02 0.00 0.00 61.00 63.72 3gth s PRO 169 Cb -0.32 -1.91 1.46 0.00 0.02 0.00 0.00 34.50 33.76 3gth s PRO 169 CO 0.27 -1.39 1.91 -0.91 -0.33 0.00 0.00 177.00 176.54 3gth h ASN 170 N 0.40 0.00 -0.46 2.53 4.21 -0.08 -1.06 115.58 121.12 3gth h ASN 170 Ca -0.49 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.02 3gth h ASN 170 Cb 1.29 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.49 3gth h ASN 170 CO 0.53 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 177.28 3gth n GLY 171 N -1.67 3.32 0.62 2.83 0.00 -1.26 -4.39 105.19 104.64 3gth n GLY 171 Ca 0.15 -0.91 0.05 0.00 0.00 0.00 0.00 46.02 45.31 3gth n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gth n GLY 173 N -1.15 0.76 3.59 0.00 0.00 -1.26 -0.52 105.19 106.61 3gth n GLY 173 Ca 0.21 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.73 3gth n GLY 173 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3gth n ARG 174 N -1.92 1.22 -3.23 1.61 0.63 -1.24 -4.78 116.66 108.95 3gth n ARG 174 Ca 0.00 0.44 -0.18 0.00 -0.92 0.00 0.00 57.85 57.19 3gth n ARG 174 Cb 0.00 -2.04 -0.07 0.00 0.45 0.00 0.00 32.46 30.80 3gth n ARG 174 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 3gth s ASN 175 N 0.35 0.66 0.29 6.15 3.84 -1.26 -5.01 114.94 119.96 3gth s ASN 175 Ca 0.80 -2.25 0.02 0.00 0.21 0.00 0.00 52.86 51.65 3gth s ASN 175 Cb -0.90 0.46 0.59 0.00 -0.55 0.00 0.00 41.25 40.84 3gth s ASN 175 CO 0.48 -0.17 1.83 -0.65 -2.79 0.00 0.00 177.10 175.80 3gth h PRO 176 N 5.96 0.93 -0.52 0.43 0.11 -1.97 -1.72 132.00 135.23 3gth h PRO 176 Ca 0.14 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 66.16 3gth h PRO 176 Cb 1.01 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.88 3gth h PRO 176 CO 0.22 0.62 0.18 0.00 -0.21 0.00 0.00 178.00 178.81 3gth h ALA 177 N 1.56 1.34 -0.14 -0.75 0.00 -1.97 0.29 119.26 119.59 3gth h ALA 177 Ca 0.51 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 55.11 3gth h ALA 177 Cb 0.55 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3gth h ALA 177 CO -0.28 0.48 -0.49 0.35 0.00 0.00 0.00 179.25 179.32 3gth h PHE 178 N 0.75 0.77 -0.78 0.00 3.57 -1.79 -1.95 116.94 117.50 3gth h PHE 178 Ca 0.18 -0.32 0.03 0.00 3.53 0.00 0.00 57.97 61.39 3gth h PHE 178 Cb 0.20 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 38.76 3gth h PHE 178 CO 0.01 1.09 0.52 -0.07 -2.23 0.00 0.00 178.31 177.63 3gth h LEU 179 N 0.23 0.84 -1.01 0.59 3.38 -0.98 0.03 115.31 118.39 3gth h LEU 179 Ca -0.02 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 3gth h LEU 179 Cb 1.11 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 3gth h LEU 179 CO 0.10 0.59 0.03 -0.09 0.09 0.00 0.00 178.44 179.16 3gth h ARG 180 N 0.98 0.74 0.38 1.13 2.43 -0.74 0.47 114.38 119.78 3gth h ARG 180 Ca 0.31 -0.18 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 3gth h ARG 180 Cb 0.01 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.46 3gth h ARG 180 CO -0.09 0.73 -0.21 1.49 -1.51 0.00 0.00 179.97 180.39 3gth h GLU 181 N 0.70 -0.53 -0.49 0.20 4.81 -0.35 0.31 114.58 119.24 3gth h GLU 181 Ca 0.14 0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.44 3gth h GLU 181 Cb 0.39 0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.86 3gth h GLU 181 CO 0.01 -0.35 0.32 0.28 -0.73 0.00 0.00 179.01 178.54 3gth h VAL 182 N -0.55 1.06 0.01 0.32 2.07 -0.54 -1.29 116.25 117.34 3gth h VAL 182 Ca -0.05 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.28 3gth h VAL 182 Cb 0.44 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 3gth h VAL 182 CO 0.06 0.10 -0.01 -1.28 0.02 0.00 0.00 177.57 176.47 3gth h SER 183 N 0.56 -0.01 0.19 0.57 0.87 -0.56 -2.75 113.55 112.42 3gth h SER 183 Ca 0.19 -0.66 -0.04 0.00 -1.23 0.00 0.00 61.79 60.05 3gth h SER 183 Cb 0.08 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.04 3gth h SER 183 CO -0.05 0.66 -0.18 -0.33 -0.53 0.00 0.00 176.83 176.41 3gth h GLU 184 N -0.70 0.00 -0.14 2.24 5.08 -0.20 0.24 114.58 121.10 3gth h GLU 184 Ca -0.00 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.14 3gth h GLU 184 Cb 0.67 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.93 3gth h GLU 184 CO 0.00 0.18 -0.77 0.00 -1.00 0.00 0.00 179.01 177.42 3gth h ALA 185 N 1.82 0.35 0.00 3.43 0.00 -1.29 -3.39 119.26 120.20 3gth h ALA 185 Ca -0.00 -0.60 -0.18 0.00 0.00 0.00 0.00 54.91 54.13 3gth h ALA 185 Cb 0.32 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3gth h ALA 185 CO 0.02 0.70 -1.91 0.25 0.00 0.00 0.00 179.25 178.31 3gth n THR 186 N -3.92 0.68 -0.12 0.00 -2.24 -1.04 -4.99 114.28 102.65 3gth n THR 186 Ca -0.07 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 3gth n THR 186 Cb 0.74 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.60 3gth n THR 186 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gth n GLY 187 N 1.94 0.55 3.73 3.38 0.00 0.84 -4.96 105.19 110.67 3gth n GLY 187 Ca -0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 3gth n GLY 187 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3gth s LEU 188 N 0.00 4.45 -0.05 0.99 2.96 -1.25 -4.98 118.68 120.80 3gth s LEU 188 Ca 0.00 2.10 -0.23 0.00 -0.22 0.00 0.00 54.13 55.77 3gth s LEU 188 Cb 0.00 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 43.05 3gth s LEU 188 CO 0.00 -0.32 0.69 -1.10 -1.32 0.00 0.00 176.35 174.30 3gth s GLN 189 N 0.05 4.43 -0.06 1.98 -0.21 -0.46 -4.40 119.66 120.99 3gth s GLN 189 Ca 0.53 0.88 0.03 0.00 0.02 0.00 0.00 55.36 56.81 3gth s GLN 189 Cb -0.30 -3.42 0.01 0.00 1.00 0.00 0.00 33.01 30.30 3gth s GLN 189 CO 0.34 0.13 -0.13 0.42 -2.12 0.00 0.00 175.29 173.92 3gth s ILE 190 N 0.57 1.19 -0.11 1.08 1.01 -1.26 -0.95 121.20 122.74 3gth s ILE 190 Ca 0.37 -0.53 -0.03 0.00 0.00 0.00 0.00 60.65 60.46 3gth s ILE 190 Cb -0.18 -1.07 -0.03 0.00 0.01 0.00 0.00 42.46 41.18 3gth s ILE 190 CO 0.18 0.36 0.01 -0.76 0.00 0.00 0.00 174.94 174.74 3gth s LEU 191 N 0.54 3.58 0.40 2.97 1.02 -0.80 0.49 118.68 126.87 3gth s LEU 191 Ca -0.13 0.11 0.08 0.00 0.02 0.00 0.00 54.13 54.21 3gth s LEU 191 Cb -0.15 -1.83 -0.04 0.00 0.02 0.00 0.00 46.19 44.18 3gth s LEU 191 CO 0.04 0.33 0.21 0.00 0.02 0.00 0.00 176.35 176.94 3gth s ALA 193 N -2.53 4.02 -0.03 0.00 0.00 -1.11 0.14 121.76 122.25 3gth s ALA 193 Ca 0.42 -1.90 0.01 0.00 0.00 0.00 0.00 51.96 50.48 3gth s ALA 193 Cb 0.01 -0.92 0.02 0.00 0.00 0.00 0.00 23.12 22.23 3gth s ALA 193 CO 0.24 -0.23 -0.03 -0.08 0.00 0.00 0.00 175.76 175.65 3gth s THR 194 N -2.50 0.35 0.00 0.00 -1.32 -0.79 -4.84 115.64 106.54 3gth s THR 194 Ca 0.47 -0.07 0.00 0.00 -1.21 0.00 0.00 61.69 60.87 3gth s THR 194 Cb -0.02 -0.38 0.00 0.00 -1.51 0.00 0.00 72.50 70.59 3gth s THR 194 CO 0.27 0.16 0.00 0.61 -2.21 0.00 0.00 174.62 173.45 3gth n GLY 195 N 3.73 3.45 3.66 6.08 0.00 -1.26 -4.31 105.19 116.54 3gth n GLY 195 Ca -0.22 -1.25 -0.23 0.00 0.00 0.00 0.00 46.02 44.32 3gth n GLY 195 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gth s PHE 196 N -2.00 2.73 0.86 1.61 0.40 -1.26 0.68 117.98 121.00 3gth s PHE 196 Ca 0.00 -0.21 -0.11 0.00 -0.60 0.00 0.00 56.93 56.01 3gth s PHE 196 Cb 0.00 -1.21 0.15 0.00 0.51 0.00 0.00 43.02 42.47 3gth s PHE 196 CO 0.00 0.61 1.19 -0.47 0.70 0.00 0.00 175.22 177.25 3gth s TYR 197 N -2.29 1.96 0.76 0.36 5.04 -1.26 -4.43 117.35 117.48 3gth s TYR 197 Ca 0.31 0.27 -0.14 0.00 -2.44 0.00 0.00 57.07 55.08 3gth s TYR 197 Cb -0.07 -3.68 0.06 0.00 0.35 0.00 0.00 41.96 38.62 3gth s TYR 197 CO 0.20 -2.17 1.18 1.52 -1.34 0.00 0.00 175.55 174.94 3gth s TYR 198 N -3.61 2.06 0.23 4.97 -0.85 -1.26 -4.51 117.35 114.38 3gth s TYR 198 Ca 0.69 1.63 -0.07 0.00 -0.52 0.00 0.00 57.07 58.80 3gth s TYR 198 Cb -0.06 -3.39 0.40 0.00 0.38 0.00 0.00 41.96 39.28 3gth s TYR 198 CO 0.50 -2.51 1.71 1.49 -1.52 0.00 0.00 175.55 175.22 3gth h GLU 199 N -0.62 0.32 0.00 -3.49 4.81 -1.91 0.28 114.58 113.98 3gth h GLU 199 Ca -0.46 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 58.72 3gth h GLU 199 Cb 1.28 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.59 3gth h GLU 199 CO 0.49 0.21 -0.11 0.78 -0.73 0.00 0.00 179.01 179.66 3gth h GLY 200 N 0.33 0.00 -0.08 1.92 0.00 -1.96 -3.31 103.07 99.98 3gth h GLY 200 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 3gth h GLY 200 CO -0.43 0.00 -0.04 0.61 0.00 0.00 0.00 176.54 176.68 3gth n GLY 201 N -1.21 0.64 4.03 4.60 0.00 -0.59 -5.09 105.19 107.57 3gth n GLY 201 Ca -0.03 -0.10 -0.20 0.00 0.00 0.00 0.00 46.02 45.68 3gth n GLY 201 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gth s GLY 202 N -0.78 1.72 -1.21 -0.02 0.00 0.89 -4.51 107.32 103.42 3gth s GLY 202 Ca 0.03 -2.11 -0.11 0.00 0.00 0.00 0.00 44.72 42.53 3gth s GLY 202 CO 0.00 -1.60 1.53 0.00 0.00 0.00 0.00 173.10 173.03 3gth n ALA 203 N -2.39 4.51 0.13 3.20 0.00 -1.26 -4.76 120.51 119.95 3gth n ALA 203 Ca 0.16 -4.38 0.10 0.00 0.00 0.00 0.00 53.44 49.32 3gth n ALA 203 Cb 0.62 -2.88 0.04 0.00 0.00 0.00 0.00 19.45 17.23 3gth n ALA 203 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3gth h THR 204 N 4.11 0.11 -0.63 0.00 1.35 -1.91 -3.38 112.91 112.57 3gth h THR 204 Ca 0.31 -1.19 0.11 0.00 -0.55 0.00 0.00 66.41 65.10 3gth h THR 204 Cb 0.77 1.77 -0.08 0.00 -1.73 0.00 0.00 68.15 68.88 3gth h THR 204 CO 1.34 0.06 0.18 0.74 -0.25 0.00 0.00 175.52 177.60 3gth h THR 205 N 0.00 0.67 0.56 6.82 2.02 -1.97 -1.99 112.91 119.02 3gth h THR 205 Ca -0.02 -0.11 -0.02 0.00 0.77 0.00 0.00 66.41 67.03 3gth h THR 205 Cb 1.09 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 3gth h THR 205 CO 0.01 0.06 -0.48 0.22 0.37 0.00 0.00 175.52 175.70 3gth h TYR 206 N 0.33 -1.31 0.00 3.16 3.20 -2.00 -1.61 116.97 118.73 3gth h TYR 206 Ca 0.33 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.17 3gth h TYR 206 Cb 0.48 0.50 -0.01 0.00 1.54 0.00 0.00 36.73 39.24 3gth h TYR 206 CO -0.21 -0.66 -0.18 0.74 -1.64 0.00 0.00 178.16 176.20 3gth h PHE 207 N -1.01 0.00 -0.19 -3.82 -1.00 -1.81 -1.47 116.94 107.64 3gth h PHE 207 Ca -0.07 0.00 -0.09 0.00 2.81 0.00 0.00 57.97 60.62 3gth h PHE 207 Cb 0.86 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.40 3gth h PHE 207 CO -0.20 0.18 -0.26 0.87 -1.61 0.00 0.00 178.31 177.29 3gth h LYS 208 N 0.00 0.36 0.10 1.51 1.57 -1.17 0.23 116.57 119.17 3gth h LYS 208 Ca -0.00 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 3gth h LYS 208 Cb 0.71 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.99 3gth h LYS 208 CO 0.02 0.60 -0.05 0.35 -0.57 0.00 0.00 179.45 179.80 3gth h PHE 209 N 0.32 -0.12 -0.21 -1.35 3.57 -0.85 -2.80 116.94 115.50 3gth h PHE 209 Ca 0.05 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.55 3gth h PHE 209 Cb 0.63 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 3gth h PHE 209 CO 0.02 0.40 0.14 0.00 -2.23 0.00 0.00 178.31 176.64 3gth h ARG 210 N -0.82 0.26 -0.20 1.11 3.08 -1.19 -0.60 114.38 116.01 3gth h ARG 210 Ca -0.01 -0.02 -0.09 0.00 0.07 0.00 0.00 59.98 59.93 3gth h ARG 210 Cb 0.58 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 3gth h ARG 210 CO 0.02 0.17 -0.28 0.00 -1.07 0.00 0.00 179.97 178.81 3gth h ALA 211 N 1.87 1.16 0.00 0.04 0.00 -0.54 0.71 119.26 122.50 3gth h ALA 211 Ca 0.08 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.57 3gth h ALA 211 Cb -0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3gth h ALA 211 CO -0.02 0.54 -0.38 0.66 0.00 0.00 0.00 179.25 180.05 3gth h SER 212 N 0.33 0.00 0.55 0.00 4.64 -0.85 -3.25 113.55 114.97 3gth h SER 212 Ca 0.05 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.20 3gth h SER 212 Cb 0.67 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.73 3gth h SER 212 CO 0.05 0.38 -1.58 0.18 -0.87 0.00 0.00 176.83 174.98 3gth n LEU 213 N -3.60 0.66 0.00 5.97 4.77 -0.79 -5.06 117.00 118.95 3gth n LEU 213 Ca -0.01 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 3gth n LEU 213 Cb 0.49 0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.70 3gth n LEU 213 CO 0.37 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 3gth n GLY 214 N 1.42 2.73 3.32 -0.72 0.00 0.17 -5.07 105.19 107.04 3gth n GLY 214 Ca -0.12 -0.24 -0.43 0.00 0.00 0.00 0.00 46.02 45.23 3gth n GLY 214 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3gth n ASP 215 N 0.00 5.05 -0.18 1.61 2.03 -1.26 -4.55 116.55 119.24 3gth n ASP 215 Ca 0.00 -2.98 -0.09 0.00 0.52 0.00 0.00 54.79 52.23 3gth n ASP 215 Cb 0.00 -1.60 0.01 0.00 -0.72 0.00 0.00 41.12 38.81 3gth n ASP 215 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3gth h ALA 216 N 6.87 0.71 -0.55 -1.67 0.00 -1.84 -2.52 119.26 120.25 3gth h ALA 216 Ca 0.38 -0.27 0.11 0.00 0.00 0.00 0.00 54.91 55.13 3gth h ALA 216 Cb 0.81 -0.20 -0.11 0.00 0.00 0.00 0.00 17.79 18.30 3gth h ALA 216 CO 1.41 0.49 -0.15 1.49 0.00 0.00 0.00 179.25 182.49 3gth h GLU 217 N 0.78 -0.02 -1.00 0.00 4.81 -1.87 0.54 114.58 117.82 3gth h GLU 217 Ca 0.15 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.41 3gth h GLU 217 Cb 0.48 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.81 3gth h GLU 217 CO 0.02 -0.01 0.66 1.03 -0.73 0.00 0.00 179.01 179.98 3gth h SER 218 N -0.02 1.13 -0.47 1.04 0.87 -1.90 0.44 113.55 114.64 3gth h SER 218 Ca 0.26 -0.02 -0.12 0.00 -1.23 0.00 0.00 61.79 60.69 3gth h SER 218 Cb 0.42 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 3gth h SER 218 CO -0.58 0.79 -0.16 -0.33 -0.53 0.00 0.00 176.83 176.03 3gth h GLU 219 N 1.32 0.94 -0.55 2.24 5.08 -0.09 -1.15 114.58 122.37 3gth h GLU 219 Ca 0.38 -0.38 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 3gth h GLU 219 Cb -0.08 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 3gth h GLU 219 CO -0.10 1.04 0.12 0.82 -1.00 0.00 0.00 179.01 179.89 3gth h ILE 220 N 0.78 1.25 -0.49 3.13 2.04 0.46 -2.26 117.51 122.42 3gth h ILE 220 Ca 0.11 -0.91 0.04 0.00 1.00 0.00 0.00 64.86 65.11 3gth h ILE 220 Cb 0.72 0.78 -0.04 0.00 -0.74 0.00 0.00 36.82 37.53 3gth h ILE 220 CO 0.06 0.33 0.24 0.22 0.00 0.00 0.00 178.15 179.00 3gth h TYR 221 N 0.80 0.45 -0.78 1.37 3.20 0.09 -1.20 116.97 120.90 3gth h TYR 221 Ca 0.17 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.03 3gth h TYR 221 Cb 0.37 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.47 3gth h TYR 221 CO 0.03 0.22 0.36 0.93 -1.64 0.00 0.00 178.16 178.05 3gth h GLU 222 N 0.48 1.13 0.39 1.82 5.08 -0.92 0.76 114.58 123.32 3gth h GLU 222 Ca 0.22 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 3gth h GLU 222 Cb 0.13 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.19 3gth h GLU 222 CO -0.16 0.89 -0.19 1.98 -1.00 0.00 0.00 179.01 180.53 3gth h MET 223 N 1.10 -0.50 -0.36 2.33 4.05 -1.12 -0.01 114.93 120.42 3gth h MET 223 Ca 0.27 0.03 0.02 0.00 -0.28 0.00 0.00 59.70 59.74 3gth h MET 223 Cb 0.14 0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 31.03 3gth h MET 223 CO -0.03 -0.27 0.21 0.52 0.23 0.00 0.00 176.91 177.57 3gth h MET 224 N -0.64 0.41 -0.84 0.39 2.86 -1.08 0.56 114.93 116.59 3gth h MET 224 Ca -0.05 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.55 3gth h MET 224 Cb 0.47 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.99 3gth h MET 224 CO 0.09 0.27 0.49 -0.09 1.06 0.00 0.00 176.91 178.72 3gth h ARG 225 N 0.42 1.15 -0.30 1.72 1.12 -0.82 -0.82 114.38 116.84 3gth h ARG 225 Ca 0.14 -0.12 -0.15 0.00 -1.11 0.00 0.00 59.98 58.74 3gth h ARG 225 Cb 0.01 -0.23 -0.01 0.00 -0.01 0.00 0.00 29.97 29.73 3gth h ARG 225 CO -0.07 0.82 -0.42 1.15 -3.11 0.00 0.00 179.97 178.35 3gth h THR 226 N 1.16 1.29 -0.08 0.20 2.02 -0.48 -1.16 112.91 115.85 3gth h THR 226 Ca 0.30 -1.60 -0.12 0.00 0.77 0.00 0.00 66.41 65.76 3gth h THR 226 Cb -0.01 1.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.88 3gth h THR 226 CO -0.05 0.52 -0.49 -0.33 0.37 0.00 0.00 175.52 175.53 3gth h GLU 227 N 0.60 0.22 0.16 6.66 5.08 -0.52 0.34 114.58 127.12 3gth h GLU 227 Ca 0.05 -0.12 -0.29 0.00 -1.00 0.00 0.00 59.36 57.99 3gth h GLU 227 Cb 0.97 0.01 0.01 0.00 0.50 0.00 0.00 28.75 30.24 3gth h GLU 227 CO 0.09 0.67 -1.31 0.28 -1.00 0.00 0.00 179.01 177.73 3gth h VAL 228 N 0.17 1.43 0.00 3.13 2.07 -1.06 -1.06 116.25 120.94 3gth h VAL 228 Ca 0.01 -2.97 -0.17 0.00 0.82 0.00 0.00 66.70 64.38 3gth h VAL 228 Cb 0.94 2.96 -0.03 0.00 -1.52 0.00 0.00 31.29 33.63 3gth h VAL 228 CO 0.08 0.87 -2.07 0.35 0.02 0.00 0.00 177.57 176.82 3gth n THR 229 N -3.57 0.65 -0.02 2.57 -2.24 -0.45 -4.52 114.28 106.71 3gth n THR 229 Ca -0.11 -0.61 -0.03 0.00 -2.27 0.00 0.00 64.05 61.03 3gth n THR 229 Cb 1.04 -0.25 -0.01 0.00 -2.10 0.00 0.00 70.33 69.01 3gth n THR 229 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3gth n GLU 230 N -2.43 0.07 0.00 -0.78 1.02 1.00 -5.06 120.64 114.45 3gth n GLU 230 Ca -0.17 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 56.99 3gth n GLU 230 Cb 0.81 -0.73 0.00 0.00 -0.02 0.00 0.00 31.44 31.50 3gth n GLU 230 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gth n GLY 231 N 2.95 3.48 3.69 0.62 0.00 -0.03 -4.52 105.19 111.39 3gth n GLY 231 Ca -0.06 -1.16 -0.37 0.00 0.00 0.00 0.00 46.02 44.43 3gth n GLY 231 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gth s ILE 232 N -2.00 5.31 -1.42 -0.61 1.01 0.88 -4.06 121.20 120.32 3gth s ILE 232 Ca 0.00 0.42 -0.12 0.00 0.00 0.00 0.00 60.65 60.95 3gth s ILE 232 Cb 0.00 -3.59 0.09 0.00 0.01 0.00 0.00 42.46 38.97 3gth s ILE 232 CO 0.00 0.34 0.63 0.00 0.00 0.00 0.00 174.94 175.92 3gth n ALA 233 N 4.05 -1.13 -1.04 9.38 0.00 -1.26 -1.15 120.51 129.35 3gth n ALA 233 Ca -0.13 0.09 -0.01 0.00 0.00 0.00 0.00 53.44 53.39 3gth n ALA 233 Cb 0.52 -3.23 -0.01 0.00 0.00 0.00 0.00 19.45 16.73 3gth n ALA 233 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gth n GLY 234 N -1.30 0.43 0.06 0.00 0.00 -1.26 -4.90 105.19 98.21 3gth n GLY 234 Ca 0.01 -0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.03 3gth n GLY 234 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3gth n THR 235 N -2.64 0.30 0.00 2.61 -2.24 -0.30 -4.93 114.28 107.07 3gth n THR 235 Ca -0.01 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 3gth n THR 235 Cb 0.21 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 3gth n THR 235 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gth n GLY 236 N 1.31 2.26 3.67 3.38 0.00 -1.26 -4.97 105.19 109.58 3gth n GLY 236 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 3gth n GLY 236 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gth s ILE 237 N -2.37 4.40 0.27 -0.61 1.01 -1.26 -4.64 121.20 118.00 3gth s ILE 237 Ca 0.00 1.69 -0.00 0.00 0.00 0.00 0.00 60.65 62.34 3gth s ILE 237 Cb 0.00 -4.09 -0.04 0.00 0.01 0.00 0.00 42.46 38.34 3gth s ILE 237 CO 0.00 -0.11 0.46 -0.13 0.00 0.00 0.00 174.94 175.17 3gth s ARG 238 N 3.06 3.51 0.00 2.79 0.52 -1.26 -0.08 118.95 127.49 3gth s ARG 238 Ca 0.52 -0.34 -0.23 0.00 -0.52 0.00 0.00 55.73 55.16 3gth s ARG 238 Cb -0.21 -2.76 -0.05 0.00 0.52 0.00 0.00 34.95 32.46 3gth s ARG 238 CO 0.15 0.29 0.70 0.00 0.02 0.00 0.00 175.30 176.45 3gth s ALA 239 N -2.07 3.40 -1.97 2.13 0.00 -0.40 -4.61 121.76 118.24 3gth s ALA 239 Ca 0.39 0.17 0.25 0.00 0.00 0.00 0.00 51.96 52.77 3gth s ALA 239 Cb -0.10 -2.91 0.41 0.00 0.00 0.00 0.00 23.12 20.52 3gth s ALA 239 CO 0.32 0.06 1.35 0.41 0.00 0.00 0.00 175.76 177.89 3gth n GLY 240 N 2.58 -0.22 3.38 0.00 0.00 0.12 -4.53 105.19 106.52 3gth n GLY 240 Ca -0.04 -0.53 -0.10 0.00 0.00 0.00 0.00 46.02 45.36 3gth n GLY 240 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gth s VAL 241 N -2.44 0.06 0.00 1.61 -7.23 -1.10 -4.20 120.40 107.10 3gth s VAL 241 Ca 0.23 -0.72 0.00 0.00 -1.81 0.00 0.00 61.98 59.68 3gth s VAL 241 Cb 0.19 -1.36 0.00 0.00 0.56 0.00 0.00 36.38 35.77 3gth s VAL 241 CO 0.52 -0.25 0.00 -0.38 -0.31 0.00 0.00 175.10 174.68 3gth n ILE 242 N -0.26 0.00 0.00 -0.62 5.41 -0.80 -1.88 119.36 121.21 3gth n ILE 242 Ca -0.13 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.62 3gth n ILE 242 Cb 0.63 -0.49 0.00 0.00 -0.71 0.00 0.00 39.64 39.07 3gth n ILE 242 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 3gth n LEU 244 N 0.00 0.00 -3.73 1.39 4.77 -0.60 -1.03 117.00 117.80 3gth n LEU 244 Ca 0.00 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 3gth n LEU 244 Cb 0.00 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.00 3gth n LEU 244 CO 0.00 0.00 0.09 0.00 -1.33 0.00 0.00 177.39 176.15 3gth s ALA 245 N -2.00 -0.96 0.24 -1.18 0.00 -1.26 -0.78 121.76 115.82 3gth s ALA 245 Ca 0.00 0.67 0.02 0.00 0.00 0.00 0.00 51.96 52.65 3gth s ALA 245 Cb 0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 23.12 22.93 3gth s ALA 245 CO 0.00 -0.25 0.04 -1.54 0.00 0.00 0.00 175.76 174.01 3gth s SER 246 N -0.89 1.56 0.74 0.00 1.04 -0.93 -4.42 113.70 110.81 3gth s SER 246 Ca -0.10 -1.29 -0.04 0.00 0.48 0.00 0.00 55.95 55.00 3gth s SER 246 Cb -0.04 0.07 0.12 0.00 0.10 0.00 0.00 66.02 66.27 3gth s SER 246 CO 0.04 -0.62 1.03 -0.44 0.98 0.00 0.00 173.24 174.24 3gth s SER 247 N -3.31 4.31 -0.01 7.02 0.01 -1.13 -3.43 113.70 117.16 3gth s SER 247 Ca 0.32 -0.07 -0.24 0.00 1.31 0.00 0.00 55.95 57.27 3gth s SER 247 Cb 0.07 -0.35 -0.17 0.00 0.21 0.00 0.00 66.02 65.78 3gth s SER 247 CO 0.11 -1.89 1.15 -0.09 0.41 0.00 0.00 173.24 172.92 3gth h ARG 248 N -0.67 -0.31 0.00 12.44 2.43 -1.91 -3.32 114.38 123.03 3gth h ARG 248 Ca -0.40 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.79 3gth h ARG 248 Cb 1.27 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.89 3gth h ARG 248 CO 0.45 0.04 0.00 -0.25 -1.51 0.00 0.00 179.97 178.70 3gth n ASP 249 N -5.05 0.64 -3.59 -3.80 8.00 -1.26 -4.53 116.55 106.95 3gth n ASP 249 Ca -0.09 0.59 0.01 0.00 0.71 0.00 0.00 54.79 56.01 3gth n ASP 249 Cb 0.26 -0.75 -0.01 0.00 -0.02 0.00 0.00 41.12 40.60 3gth n ASP 249 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3gth s ALA 250 N -3.14 -2.35 -0.56 2.24 0.00 -1.25 -5.04 121.76 111.66 3gth s ALA 250 Ca 0.09 1.20 -0.21 0.00 0.00 0.00 0.00 51.96 53.04 3gth s ALA 250 Cb 0.12 0.07 0.06 0.00 0.00 0.00 0.00 23.12 23.37 3gth s ALA 250 CO 0.52 -0.89 0.78 0.42 0.00 0.00 0.00 175.76 176.59 3gth s ILE 251 N -2.13 4.64 0.85 0.00 1.01 -1.26 -2.83 121.20 121.46 3gth s ILE 251 Ca 0.14 -0.31 -0.10 0.00 0.00 0.00 0.00 60.65 60.37 3gth s ILE 251 Cb 0.04 -4.46 0.10 0.00 0.01 0.00 0.00 42.46 38.16 3gth s ILE 251 CO -0.05 -1.04 1.13 0.42 0.00 0.00 0.00 174.94 175.39 3gth s THR 252 N 3.26 2.59 0.29 2.92 -4.23 -1.26 -4.67 115.64 114.54 3gth s THR 252 Ca 0.20 0.20 0.03 0.00 -1.18 0.00 0.00 61.69 60.94 3gth s THR 252 Cb -0.18 -2.43 0.29 0.00 1.34 0.00 0.00 72.50 71.53 3gth s THR 252 CO 0.13 -0.25 1.81 -0.65 -0.54 0.00 0.00 174.62 175.13 3gth h PRO 253 N -1.50 0.89 -0.35 3.99 0.11 -1.98 0.38 132.00 133.53 3gth h PRO 253 Ca -0.43 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 3gth h PRO 253 Cb 1.25 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 3gth h PRO 253 CO 0.46 0.59 0.14 -0.92 -0.21 0.00 0.00 178.00 178.05 3gth h TYR 254 N 0.91 0.54 -0.74 0.65 3.20 -2.02 -2.84 116.97 116.67 3gth h TYR 254 Ca 0.53 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 62.32 3gth h TYR 254 Cb 0.64 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.72 3gth h TYR 254 CO -0.00 0.50 0.33 0.93 -1.64 0.00 0.00 178.16 178.28 3gth h GLU 255 N 0.42 1.09 0.00 1.82 5.08 -1.28 -2.70 114.58 119.01 3gth h GLU 255 Ca 0.12 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3gth h GLU 255 Cb 0.19 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.26 3gth h GLU 255 CO -0.01 0.87 -0.02 1.96 -1.00 0.00 0.00 179.01 180.81 3gth h GLN 256 N 1.05 0.00 -0.67 2.33 4.20 -0.16 -0.22 115.11 121.65 3gth h GLN 256 Ca 0.25 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.96 3gth h GLN 256 Cb 0.16 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.91 3gth h GLN 256 CO -0.03 0.02 0.41 -0.07 -0.67 0.00 0.00 178.83 178.49 3gth h LEU 257 N 0.00 0.80 -0.33 1.46 3.38 -1.25 -1.58 115.31 117.80 3gth h LEU 257 Ca -0.00 -0.06 -0.17 0.00 0.09 0.00 0.00 57.88 57.74 3gth h LEU 257 Cb 0.04 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 3gth h LEU 257 CO 0.00 0.62 -0.46 -0.26 0.09 0.00 0.00 178.44 178.44 3gth h PHE 258 N 0.91 1.09 -0.41 1.13 -1.00 -1.16 -1.70 116.94 115.80 3gth h PHE 258 Ca 0.24 -0.36 -0.02 0.00 2.81 0.00 0.00 57.97 60.64 3gth h PHE 258 Cb -0.04 -0.22 -0.02 0.00 3.61 0.00 0.00 35.95 39.29 3gth h PHE 258 CO -0.02 1.18 0.15 0.74 -1.61 0.00 0.00 178.31 178.76 3gth h PHE 259 N 0.68 0.57 0.11 -0.55 -1.00 -1.24 -0.27 116.94 115.24 3gth h PHE 259 Ca 0.04 -0.02 -0.29 0.00 2.81 0.00 0.00 57.97 60.50 3gth h PHE 259 Cb 1.06 -0.18 0.03 0.00 3.61 0.00 0.00 35.95 40.47 3gth h PHE 259 CO 0.07 0.46 -1.20 0.00 -1.61 0.00 0.00 178.31 176.03 3gth h ARG 260 N 0.57 0.61 -0.37 1.51 3.08 -1.21 -2.19 114.38 116.39 3gth h ARG 260 Ca 0.14 -0.81 -0.03 0.00 0.07 0.00 0.00 59.98 59.35 3gth h ARG 260 Cb 0.14 0.27 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 3gth h ARG 260 CO -0.01 1.37 0.12 0.00 -1.07 0.00 0.00 179.97 180.38 3gth h ALA 261 N 0.28 0.49 -0.52 0.04 0.00 -1.11 -2.26 119.26 116.17 3gth h ALA 261 Ca -0.18 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3gth h ALA 261 Cb 1.88 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.50 3gth h ALA 261 CO 0.23 0.12 0.33 0.00 0.00 0.00 0.00 179.25 179.94 3gth h ALA 262 N 0.97 0.67 -0.41 0.00 0.00 -1.11 -0.86 119.26 118.52 3gth h ALA 262 Ca 0.12 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.03 3gth h ALA 262 Cb 0.24 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3gth h ALA 262 CO -0.01 0.13 0.15 0.00 0.00 0.00 0.00 179.25 179.52 3gth h ALA 263 N 1.17 0.49 -0.14 0.00 0.00 -1.28 0.88 119.26 120.38 3gth h ALA 263 Ca 0.19 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 3gth h ALA 263 Cb -0.05 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3gth h ALA 263 CO -0.04 -0.24 0.07 -0.09 0.00 0.00 0.00 179.25 178.96 3gth h ARG 264 N 0.32 0.20 -0.67 0.00 2.43 -1.04 -0.54 114.38 115.08 3gth h ARG 264 Ca 0.19 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.34 3gth h ARG 264 Cb 0.16 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.64 3gth h ARG 264 CO -0.19 0.22 0.44 0.28 -1.51 0.00 0.00 179.97 179.22 3gth h VAL 265 N 0.12 1.17 0.05 0.20 2.07 -0.41 -1.50 116.25 117.96 3gth h VAL 265 Ca 0.05 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.26 3gth h VAL 265 Cb 0.08 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 3gth h VAL 265 CO -0.01 0.17 -0.06 -0.61 0.02 0.00 0.00 177.57 177.08 3gth h GLN 266 N 0.90 -0.12 -0.98 1.57 -0.00 0.14 -0.50 115.11 116.12 3gth h GLN 266 Ca 0.24 0.01 0.03 0.00 -0.00 0.00 0.00 58.65 58.93 3gth h GLN 266 Cb -0.10 0.03 -0.05 0.00 0.00 0.00 0.00 27.48 27.35 3gth h GLN 266 CO -0.05 -0.08 0.65 0.00 0.00 0.00 0.00 178.83 179.34 3gth h ARG 267 N -0.13 1.24 0.00 1.69 3.08 -0.57 0.47 114.38 120.17 3gth h ARG 267 Ca 0.01 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 59.92 3gth h ARG 267 Cb 0.13 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 3gth h ARG 267 CO -0.02 0.82 -0.41 0.93 -1.07 0.00 0.00 179.97 180.22 3gth h GLU 268 N 1.28 0.00 0.00 0.04 5.08 -1.03 -3.38 114.58 116.57 3gth h GLU 268 Ca 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 3gth h GLU 268 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 3gth h GLU 268 CO -0.10 0.24 -0.61 0.25 -1.00 0.00 0.00 179.01 177.79 3gth n THR 269 N -3.10 0.00 -0.45 1.13 -2.24 -0.22 -4.79 114.28 104.61 3gth n THR 269 Ca 0.02 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 3gth n THR 269 Cb 0.65 0.49 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 3gth n THR 269 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gth n GLY 270 N 1.65 1.61 3.54 3.38 0.00 0.16 -3.16 105.19 112.37 3gth n GLY 270 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3gth n GLY 270 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3gth n VAL 271 N -2.00 2.07 -1.34 1.61 3.14 -1.26 -4.87 118.33 115.68 3gth n VAL 271 Ca 0.00 -0.50 -0.31 0.00 -2.96 0.00 0.00 64.34 60.57 3gth n VAL 271 Cb 0.00 -0.82 0.09 0.00 -1.06 0.00 0.00 33.84 32.05 3gth n VAL 271 CO 0.00 0.00 0.00 -2.84 -6.46 0.00 0.00 176.83 167.53 3gth s PRO 272 N -1.68 2.31 -0.06 1.45 0.02 -1.26 -4.77 135.00 131.02 3gth s PRO 272 Ca 0.62 1.06 0.02 0.00 0.02 0.00 0.00 61.00 62.72 3gth s PRO 272 Cb -0.64 -1.91 0.01 0.00 0.02 0.00 0.00 34.50 31.98 3gth s PRO 272 CO 0.58 -1.57 -0.10 0.42 -0.33 0.00 0.00 177.00 175.99 3gth s ILE 273 N -2.95 0.98 0.05 2.83 1.01 0.26 -1.91 121.20 121.47 3gth s ILE 273 Ca 0.61 -0.40 0.07 0.00 0.00 0.00 0.00 60.65 60.93 3gth s ILE 273 Cb -0.16 -0.91 -0.03 0.00 0.01 0.00 0.00 42.46 41.37 3gth s ILE 273 CO 0.56 0.32 -0.21 0.27 0.00 0.00 0.00 174.94 175.88 3gth s ILE 274 N 0.63 1.66 0.33 2.92 -4.36 -0.20 -0.64 121.20 121.54 3gth s ILE 274 Ca -0.12 -1.26 0.03 0.00 -0.26 0.00 0.00 60.65 59.04 3gth s ILE 274 Cb -0.15 -1.46 -0.06 0.00 1.25 0.00 0.00 42.46 42.05 3gth s ILE 274 CO 0.03 0.15 0.07 0.42 0.24 0.00 0.00 174.94 175.85 3gth s THR 275 N -0.87 1.02 -0.12 8.37 -4.23 -0.38 -1.56 115.64 117.87 3gth s THR 275 Ca 0.07 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.60 3gth s THR 275 Cb -0.09 -2.71 -0.01 0.00 1.34 0.00 0.00 72.50 71.03 3gth s THR 275 CO 0.02 0.00 -0.18 -2.28 -0.54 0.00 0.00 174.62 171.65 3gth s HIS 276 N -3.34 2.71 -0.05 3.99 2.46 0.04 -1.96 115.29 119.14 3gth s HIS 276 Ca 0.35 -0.82 0.05 0.00 0.47 0.00 0.00 55.06 55.11 3gth s HIS 276 Cb 0.08 -1.79 -0.02 0.00 -0.13 0.00 0.00 32.58 30.72 3gth s HIS 276 CO 0.15 -0.30 -0.19 0.95 -2.47 0.00 0.00 174.74 172.88 3gth s THR 277 N 0.36 2.61 -0.19 0.89 -4.23 -1.22 -2.18 115.64 111.67 3gth s THR 277 Ca -0.14 -0.89 -0.18 0.00 -1.18 0.00 0.00 61.69 59.30 3gth s THR 277 Cb -0.17 -1.99 -0.03 0.00 1.34 0.00 0.00 72.50 71.65 3gth s THR 277 CO 0.07 0.58 0.51 -1.58 -0.54 0.00 0.00 174.62 173.66 3gth s GLN 278 N -0.57 4.20 -1.38 3.99 2.00 -1.22 -4.51 119.66 122.17 3gth s GLN 278 Ca 0.08 0.41 -0.04 0.00 -2.00 0.00 0.00 55.36 53.81 3gth s GLN 278 Cb -0.11 -3.55 0.00 0.00 0.80 0.00 0.00 33.01 30.15 3gth s GLN 278 CO 0.01 -0.12 0.42 0.39 -0.50 0.00 0.00 175.29 175.48 3gth n GLU 279 N 4.70 -2.56 -1.85 1.67 1.02 -1.26 -2.58 120.64 119.79 3gth n GLU 279 Ca -0.05 0.35 -0.19 0.00 -0.02 0.00 0.00 57.16 57.25 3gth n GLU 279 Cb 0.50 -4.24 -0.05 0.00 -0.02 0.00 0.00 31.44 27.63 3gth n GLU 279 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gth n GLY 280 N -2.04 1.00 3.29 0.62 0.00 -1.25 -4.89 105.19 101.92 3gth n GLY 280 Ca -0.28 -0.11 -0.16 0.00 0.00 0.00 0.00 46.02 45.48 3gth n GLY 280 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gth s GLN 281 N -4.09 1.18 -0.20 1.61 -0.21 -1.06 -4.62 119.66 112.27 3gth s GLN 281 Ca 0.00 -1.54 0.00 0.00 0.02 0.00 0.00 55.36 53.84 3gth s GLN 281 Cb 0.00 -0.71 0.00 0.00 1.00 0.00 0.00 33.01 33.30 3gth s GLN 281 CO 0.00 0.05 0.00 1.04 -2.12 0.00 0.00 175.29 174.26 3gth n GLN 282 N -0.29 -0.60 0.09 2.91 1.13 -1.26 -4.07 117.38 115.28 3gth n GLN 282 Ca -0.08 0.32 -0.13 0.00 -1.94 0.00 0.00 57.00 55.17 3gth n GLN 282 Cb 0.61 -3.90 -0.08 0.00 0.11 0.00 0.00 30.24 26.99 3gth n GLN 282 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 3gth h GLY 283 N 0.00 -0.17 0.98 1.08 0.00 -1.95 -0.25 103.07 102.76 3gth h GLY 283 Ca -0.04 0.06 0.01 0.00 0.00 0.00 0.00 47.33 47.36 3gth h GLY 283 CO 0.06 -0.06 0.32 -2.55 0.00 0.00 0.00 176.54 174.31 3gth h PRO 284 N -0.26 0.64 -0.57 4.80 0.11 -1.89 -1.89 132.00 132.94 3gth h PRO 284 Ca -0.02 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.04 3gth h PRO 284 Cb 0.21 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.15 3gth h PRO 284 CO 0.03 0.42 0.27 1.96 -0.21 0.00 0.00 178.00 180.47 3gth h GLN 285 N 0.66 0.79 -0.41 1.05 7.50 -1.95 0.24 115.11 122.99 3gth h GLN 285 Ca 0.19 -0.10 -0.08 0.00 0.50 0.00 0.00 58.65 59.16 3gth h GLN 285 Cb -0.06 -0.15 -0.01 0.00 0.05 0.00 0.00 27.48 27.31 3gth h GLN 285 CO -0.05 0.62 -0.05 1.96 -1.50 0.00 0.00 178.83 179.81 3gth h GLN 286 N 0.80 0.76 -0.22 1.46 4.20 -0.63 -0.35 115.11 121.12 3gth h GLN 286 Ca 0.20 -0.27 -0.03 0.00 0.06 0.00 0.00 58.65 58.61 3gth h GLN 286 Cb 0.08 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 3gth h GLN 286 CO -0.03 0.87 0.02 0.00 -0.67 0.00 0.00 178.83 179.02 3gth h ALA 287 N 0.87 0.29 0.44 3.87 0.00 -0.71 0.06 119.26 124.08 3gth h ALA 287 Ca 0.11 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 3gth h ALA 287 Cb 0.56 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 3gth h ALA 287 CO 0.03 -0.02 -0.25 1.49 0.00 0.00 0.00 179.25 180.51 3gth h GLU 288 N 0.16 -0.62 -0.36 0.00 4.81 -0.53 -1.62 114.58 116.42 3gth h GLU 288 Ca 0.07 0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.41 3gth h GLU 288 Cb 0.35 0.14 -0.06 0.00 0.63 0.00 0.00 28.75 29.81 3gth h GLU 288 CO 0.01 -0.41 -0.03 1.25 -0.73 0.00 0.00 179.01 179.09 3gth h LEU 289 N -0.65 -0.22 -0.65 1.64 5.85 -1.00 0.32 115.31 120.60 3gth h LEU 289 Ca -0.05 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 3gth h LEU 289 Cb 0.52 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 3gth h LEU 289 CO 0.07 -0.07 0.28 -0.07 -0.34 0.00 0.00 178.44 178.31 3gth h LEU 290 N 0.06 0.88 -0.14 2.25 3.38 -0.86 -1.29 115.31 119.60 3gth h LEU 290 Ca 0.18 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 3gth h LEU 290 Cb 0.26 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 3gth h LEU 290 CO -0.32 0.80 -0.07 0.71 0.09 0.00 0.00 178.44 179.64 3gth h THR 291 N 0.91 1.32 -1.04 0.22 1.35 -0.88 -0.55 112.91 114.24 3gth h THR 291 Ca 0.22 -1.12 0.27 0.00 -0.55 0.00 0.00 66.41 65.23 3gth h THR 291 Cb 0.17 1.76 -0.09 0.00 -1.73 0.00 0.00 68.15 68.26 3gth h THR 291 CO -0.02 0.33 0.68 0.77 -0.25 0.00 0.00 175.52 177.02 3gth h SER 292 N -0.04 0.41 -0.09 5.36 4.64 -0.13 0.76 113.55 124.47 3gth h SER 292 Ca 0.03 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3gth h SER 292 Cb 0.54 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 3gth h SER 292 CO 0.02 0.08 0.00 0.18 -0.87 0.00 0.00 176.83 176.25 3gth n LEU 293 N -4.59 0.75 0.00 5.97 4.77 -0.51 -4.88 117.00 118.52 3gth n LEU 293 Ca 0.25 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 3gth n LEU 293 Cb 0.89 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.92 3gth n LEU 293 CO 0.27 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 3gth n GLY 294 N 0.91 0.80 3.75 -0.72 0.00 0.27 -4.75 105.19 105.44 3gth n GLY 294 Ca 0.13 -0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 3gth n GLY 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gth s ALA 295 N -2.00 3.34 -0.26 4.61 0.00 -0.24 -4.63 121.76 122.57 3gth s ALA 295 Ca 0.00 0.65 -0.29 0.00 0.00 0.00 0.00 51.96 52.32 3gth s ALA 295 Cb 0.00 -3.23 -0.01 0.00 0.00 0.00 0.00 23.12 19.87 3gth s ALA 295 CO 0.00 0.13 1.48 0.34 0.00 0.00 0.00 175.76 177.71 3gth s ASP 296 N -0.97 6.49 0.53 0.00 3.68 -1.26 -4.32 116.67 120.82 3gth s ASP 296 Ca 0.42 1.43 0.36 0.00 2.13 0.00 0.00 52.55 56.89 3gth s ASP 296 Cb -0.26 -2.54 1.89 0.00 -1.45 0.00 0.00 42.92 40.56 3gth s ASP 296 CO 0.33 -1.19 2.09 1.55 0.13 0.00 0.00 175.17 178.07 3gth h PRO 297 N 10.16 0.00 0.00 4.34 0.13 -1.89 0.10 132.00 144.85 3gth h PRO 297 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 3gth h PRO 297 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 3gth h PRO 297 CO 1.02 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.79 3gth n ALA 298 N -1.97 2.35 -1.59 -0.56 0.00 -1.26 -2.68 120.51 114.79 3gth n ALA 298 Ca -0.02 -0.14 0.05 0.00 0.00 0.00 0.00 53.44 53.33 3gth n ALA 298 Cb 0.09 -1.39 0.07 0.00 0.00 0.00 0.00 19.45 18.22 3gth n ALA 298 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3gth n ARG 299 N -1.08 0.65 -4.85 0.00 5.12 0.02 -4.52 116.66 112.01 3gth n ARG 299 Ca 0.16 -1.87 -0.32 0.00 -1.93 0.00 0.00 57.85 53.89 3gth n ARG 299 Cb 0.11 -0.98 -0.17 0.00 -1.16 0.00 0.00 32.46 30.27 3gth n ARG 299 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3gth s ILE 300 N -1.45 2.00 -0.20 0.55 1.01 -1.09 -0.58 121.20 121.44 3gth s ILE 300 Ca 0.18 -0.96 0.01 0.00 0.00 0.00 0.00 60.65 59.89 3gth s ILE 300 Cb 0.16 -1.76 0.04 0.00 0.01 0.00 0.00 42.46 40.91 3gth s ILE 300 CO 0.00 0.54 -0.15 -0.32 0.00 0.00 0.00 174.94 175.01 3gth s MET 301 N 0.66 2.57 -0.28 2.79 1.75 0.18 -1.26 119.30 125.71 3gth s MET 301 Ca -0.11 -0.96 -0.23 0.00 -1.25 0.00 0.00 55.69 53.13 3gth s MET 301 Cb -0.16 -2.60 -0.00 0.00 2.84 0.00 0.00 34.83 34.90 3gth s MET 301 CO 0.02 -0.35 0.78 0.42 -0.65 0.00 0.00 175.02 175.24 3gth s ILE 302 N 1.27 4.84 0.69 10.11 -1.09 -0.14 -1.25 121.20 135.63 3gth s ILE 302 Ca -0.00 1.31 -0.02 0.00 -2.23 0.00 0.00 60.65 59.71 3gth s ILE 302 Cb -0.15 -4.10 0.10 0.00 -1.58 0.00 0.00 42.46 36.72 3gth s ILE 302 CO -0.10 -0.15 0.96 -0.83 -1.23 0.00 0.00 174.94 173.60 3gth s GLY 303 N 1.50 1.77 -0.98 6.18 0.00 -0.83 -1.22 107.32 113.74 3gth s GLY 303 Ca 0.32 -1.48 -0.05 0.00 0.00 0.00 0.00 44.72 43.51 3gth s GLY 303 CO 0.10 -0.99 0.23 1.42 0.00 0.00 0.00 173.10 173.86 3gth n HIS 304 N -2.78 -1.67 0.27 1.90 8.25 -1.20 -3.39 115.22 116.60 3gth n HIS 304 Ca 0.12 0.23 0.17 0.00 -0.26 0.00 0.00 57.72 57.97 3gth n HIS 304 Cb 0.60 -2.46 0.70 0.00 1.12 0.00 0.00 29.99 29.96 3gth n HIS 304 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 3gth h MET 305 N -0.44 0.00 0.00 -0.41 2.86 -1.60 -0.96 114.93 114.37 3gth h MET 305 Ca -0.31 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 3gth h MET 305 Cb 1.21 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.87 3gth h MET 305 CO 0.38 0.04 0.00 -0.40 1.06 0.00 0.00 176.91 177.99 3gth n ASP 306 N -3.17 0.11 0.02 1.22 3.85 -1.25 -2.07 116.55 115.26 3gth n ASP 306 Ca 0.00 0.53 0.08 0.00 -0.71 0.00 0.00 54.79 54.70 3gth n ASP 306 Cb 0.30 -0.56 0.36 0.00 -1.35 0.00 0.00 41.12 39.88 3gth n ASP 306 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3gth n GLY 307 N -0.49 -1.09 3.22 6.12 0.00 -0.37 -4.58 105.19 108.00 3gth n GLY 307 Ca 0.02 -0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 3gth n GLY 307 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3gth s ASN 308 N -3.17 2.87 -0.08 1.61 3.04 -0.88 -3.81 114.94 114.52 3gth s ASN 308 Ca 0.07 -0.49 0.18 0.00 0.04 0.00 0.00 52.86 52.67 3gth s ASN 308 Cb 0.10 -0.93 0.64 0.00 -1.54 0.00 0.00 41.25 39.53 3gth s ASN 308 CO 0.31 0.20 1.55 0.35 -3.04 0.00 0.00 177.10 176.48 3gth n THR 309 N 3.15 1.56 -3.46 -5.21 -2.24 -1.26 -4.86 114.28 101.96 3gth n THR 309 Ca -0.18 -1.17 -0.42 0.00 -2.27 0.00 0.00 64.05 60.00 3gth n THR 309 Cb 0.52 0.24 -0.10 0.00 -2.10 0.00 0.00 70.33 68.89 3gth n THR 309 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3gth s ASP 310 N -1.01 6.11 0.66 3.42 -1.08 -1.26 -4.92 116.67 118.59 3gth s ASP 310 Ca 0.47 -0.74 0.38 0.00 -0.52 0.00 0.00 52.55 52.13 3gth s ASP 310 Cb 0.29 -2.16 2.06 0.00 -1.46 0.00 0.00 42.92 41.64 3gth s ASP 310 CO 0.25 -0.41 2.18 1.55 0.52 0.00 0.00 175.17 179.26 3gth h PRO 311 N 8.60 0.00 -0.69 4.34 0.13 -1.94 0.40 132.00 142.83 3gth h PRO 311 Ca -0.28 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.83 3gth h PRO 311 Cb 1.13 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.23 3gth h PRO 311 CO 0.71 0.00 0.37 0.00 -0.23 0.00 0.00 178.00 178.85 3gth h ALA 312 N 1.73 0.89 -0.51 -0.56 0.00 -1.99 0.15 119.26 118.98 3gth h ALA 312 Ca 0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3gth h ALA 312 Cb 0.30 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3gth h ALA 312 CO -0.00 0.42 0.29 -0.92 0.00 0.00 0.00 179.25 179.04 3gth h TYR 313 N 0.96 0.69 -0.43 0.00 5.03 -1.33 -0.33 116.97 121.55 3gth h TYR 313 Ca 0.24 -0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.50 3gth h TYR 313 Cb 0.06 -0.22 -0.02 0.00 1.55 0.00 0.00 36.73 38.10 3gth h TYR 313 CO -0.00 0.50 0.12 0.45 -1.32 0.00 0.00 178.16 177.91 3gth h HIS 314 N 0.68 0.71 -0.71 -3.82 -0.00 -1.24 -2.47 115.15 108.30 3gth h HIS 314 Ca 0.18 -0.08 -0.06 0.00 -0.00 0.00 0.00 60.37 60.42 3gth h HIS 314 Cb 0.03 -0.20 -0.03 0.00 -0.00 0.00 0.00 27.41 27.20 3gth h HIS 314 CO -0.02 0.65 0.21 0.00 -0.00 0.00 0.00 177.93 178.78 3gth h ARG 315 N 0.56 1.10 -0.12 2.45 3.08 -0.52 0.10 114.38 121.04 3gth h ARG 315 Ca 0.14 -0.23 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 3gth h ARG 315 Cb 0.29 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 3gth h ARG 315 CO -0.00 0.94 0.06 1.49 -1.07 0.00 0.00 179.97 181.39 3gth h GLU 316 N 1.05 0.16 0.10 0.04 4.81 -0.89 0.28 114.58 120.13 3gth h GLU 316 Ca 0.23 -0.01 -0.18 0.00 -0.13 0.00 0.00 59.36 59.27 3gth h GLU 316 Cb 0.31 -0.03 0.02 0.00 0.63 0.00 0.00 28.75 29.67 3gth h GLU 316 CO -0.01 0.12 -0.77 1.15 -0.73 0.00 0.00 179.01 178.77 3gth h THR 317 N 0.16 1.47 0.00 0.32 2.02 -0.78 -3.25 112.91 112.85 3gth h THR 317 Ca 0.04 -2.39 -0.03 0.00 0.77 0.00 0.00 66.41 64.81 3gth h THR 317 Cb 0.01 2.99 -0.00 0.00 -1.74 0.00 0.00 68.15 69.40 3gth h THR 317 CO -0.01 0.68 -0.13 -0.07 0.37 0.00 0.00 175.52 176.37 3gth h LEU 318 N -0.25 0.00 -1.98 2.58 3.38 -0.22 -2.23 115.31 116.58 3gth h LEU 318 Ca -0.12 0.00 0.28 0.00 0.09 0.00 0.00 57.88 58.12 3gth h LEU 318 Cb 1.55 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.26 3gth h LEU 318 CO 0.15 0.13 0.71 -0.09 0.09 0.00 0.00 178.44 179.43 3gth h ARG 319 N 0.00 0.00 0.00 1.13 9.65 -0.49 0.29 114.38 124.97 3gth h ARG 319 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3gth h ARG 319 Cb 0.25 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.83 3gth h ARG 319 CO 0.02 0.00 0.00 0.72 2.80 0.00 0.00 179.97 183.51 3gth n HIS 320 N -4.17 0.00 -0.80 2.20 8.25 -0.84 -4.89 115.22 114.98 3gth n HIS 320 Ca 0.20 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.66 3gth n HIS 320 Cb 1.04 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 32.00 3gth n HIS 320 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3gth n GLY 321 N 0.62 0.88 3.93 -1.41 0.00 0.10 -4.86 105.19 104.46 3gth n GLY 321 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 3gth n GLY 321 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gth s VAL 322 N -3.51 4.19 0.43 1.61 -7.23 -1.26 -4.40 120.40 110.23 3gth s VAL 322 Ca 0.00 -0.13 -0.08 0.00 -1.81 0.00 0.00 61.98 59.96 3gth s VAL 322 Cb 0.00 -3.60 -0.05 0.00 0.56 0.00 0.00 36.38 33.29 3gth s VAL 322 CO 0.00 -0.53 0.75 -0.44 -0.31 0.00 0.00 175.10 174.57 3gth s SER 323 N -4.21 6.40 0.02 4.85 0.01 -0.39 -4.69 113.70 115.70 3gth s SER 323 Ca 0.49 1.00 0.04 0.00 1.31 0.00 0.00 55.95 58.79 3gth s SER 323 Cb -0.10 -2.27 -0.02 0.00 0.21 0.00 0.00 66.02 63.84 3gth s SER 323 CO 0.42 -0.46 -0.12 0.27 0.41 0.00 0.00 173.24 173.77 3gth s ILE 324 N -2.50 0.94 -0.07 1.44 -4.36 0.53 -0.96 121.20 116.21 3gth s ILE 324 Ca 0.49 -0.79 0.05 0.00 -0.26 0.00 0.00 60.65 60.14 3gth s ILE 324 Cb -0.10 -0.84 -0.01 0.00 1.25 0.00 0.00 42.46 42.76 3gth s ILE 324 CO 0.37 0.05 -0.24 0.00 0.24 0.00 0.00 174.94 175.36 3gth s ALA 325 N -0.67 2.19 -0.90 2.27 0.00 -0.36 -1.88 121.76 122.42 3gth s ALA 325 Ca 0.01 -1.02 -0.17 0.00 0.00 0.00 0.00 51.96 50.78 3gth s ALA 325 Cb -0.07 -0.73 0.17 0.00 0.00 0.00 0.00 23.12 22.49 3gth s ALA 325 CO 0.01 0.39 1.00 -0.06 0.00 0.00 0.00 175.76 177.09 3gth s PHE 326 N -0.05 3.37 -0.26 0.00 0.40 -0.55 -1.98 117.98 118.92 3gth s PHE 326 Ca -0.07 -1.63 0.13 0.00 -0.60 0.00 0.00 56.93 54.76 3gth s PHE 326 Cb -0.15 -4.11 0.31 0.00 0.51 0.00 0.00 43.02 39.59 3gth s PHE 326 CO 0.05 -1.30 1.22 -0.40 0.70 0.00 0.00 175.22 175.49 3gth n ASP 327 N 5.55 2.86 -1.67 1.36 3.85 -1.25 -0.33 116.55 126.92 3gth n ASP 327 Ca 0.20 -2.66 -0.10 0.00 -0.71 0.00 0.00 54.79 51.52 3gth n ASP 327 Cb 0.48 -0.35 0.08 0.00 -1.35 0.00 0.00 41.12 39.99 3gth n ASP 327 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3gth n ARG 328 N -0.62 2.52 -2.08 0.11 1.74 -1.10 -1.08 116.66 116.15 3gth n ARG 328 Ca 0.14 -3.67 -0.42 0.00 -0.77 0.00 0.00 57.85 53.12 3gth n ARG 328 Cb 0.60 -1.83 -0.03 0.00 -1.02 0.00 0.00 32.46 30.18 3gth n ARG 328 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3gth s ILE 329 N -3.76 3.38 0.00 0.55 1.01 -0.52 -1.86 121.20 119.99 3gth s ILE 329 Ca 0.43 0.80 0.00 0.00 0.00 0.00 0.00 60.65 61.88 3gth s ILE 329 Cb 0.39 -3.52 0.00 0.00 0.01 0.00 0.00 42.46 39.34 3gth s ILE 329 CO -0.02 -0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.53 3gth n GLY 330 N 3.81 2.15 3.41 6.18 0.00 -1.26 -4.42 105.19 115.05 3gth n GLY 330 Ca 0.14 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.72 3gth n GLY 330 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3gth s LEU 331 N 0.00 5.34 -0.17 0.99 2.96 -0.78 -2.30 118.68 124.72 3gth s LEU 331 Ca 0.00 -1.18 -0.03 0.00 -0.22 0.00 0.00 54.13 52.70 3gth s LEU 331 Cb 0.00 -2.32 -0.02 0.00 0.50 0.00 0.00 46.19 44.35 3gth s LEU 331 CO 0.00 -0.83 -0.06 -1.10 -1.32 0.00 0.00 176.35 173.04 3gth s GLN 332 N 2.22 3.54 -1.48 1.98 -0.21 0.46 -4.63 119.66 121.54 3gth s GLN 332 Ca 0.10 -0.58 -0.12 0.00 0.02 0.00 0.00 55.36 54.78 3gth s GLN 332 Cb -0.22 -2.89 0.07 0.00 1.00 0.00 0.00 33.01 30.97 3gth s GLN 332 CO 0.09 0.12 0.86 0.41 -2.12 0.00 0.00 175.29 174.64 3gth n GLY 333 N 3.87 -0.50 3.18 3.09 0.00 -0.75 -4.24 105.19 109.83 3gth n GLY 333 Ca -0.18 0.17 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 3gth n GLY 333 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3gth s ILE 334 N -3.21 0.04 -1.63 -0.61 2.07 -1.23 -4.85 121.20 111.77 3gth s ILE 334 Ca 0.57 -0.29 -0.01 0.00 -1.41 0.00 0.00 60.65 59.50 3gth s ILE 334 Cb -0.28 -0.47 0.00 0.00 0.13 0.00 0.00 42.46 41.84 3gth s ILE 334 CO 0.70 -0.16 0.18 0.52 -1.91 0.00 0.00 174.94 174.27 3gth n VAL 335 N 2.10 -1.24 0.00 4.00 0.31 -1.26 -1.76 118.33 120.48 3gth n VAL 335 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 3gth n VAL 335 Cb 0.57 -3.01 0.00 0.00 -0.91 0.00 0.00 33.84 30.49 3gth n VAL 335 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3gth n GLY 336 N -1.16 3.19 3.60 2.92 0.00 -1.26 -4.87 105.19 107.60 3gth n GLY 336 Ca -0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 3gth n GLY 336 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3gth n THR 337 N -1.97 2.09 -2.14 2.61 -1.04 -0.72 -4.94 114.28 108.18 3gth n THR 337 Ca 0.00 -0.50 -0.28 0.00 -2.04 0.00 0.00 64.05 61.23 3gth n THR 337 Cb 0.00 -1.06 0.16 0.00 -1.82 0.00 0.00 70.33 67.61 3gth n THR 337 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3gth s PRO 338 N -1.70 0.93 0.60 -2.82 0.04 -1.26 -1.80 135.00 128.98 3gth s PRO 338 Ca 0.60 -0.64 -0.07 0.00 0.04 0.00 0.00 61.00 60.92 3gth s PRO 338 Cb -0.65 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 31.90 3gth s PRO 338 CO 0.59 -2.14 0.93 0.95 0.04 0.00 0.00 177.00 177.37 3gth s THR 339 N -3.67 3.85 0.29 1.26 -4.23 -1.26 -2.56 115.64 109.32 3gth s THR 339 Ca 0.72 0.16 0.02 0.00 -1.18 0.00 0.00 61.69 61.41 3gth s THR 339 Cb -0.04 -3.53 0.11 0.00 1.34 0.00 0.00 72.50 70.37 3gth s THR 339 CO 0.50 -0.58 1.78 0.44 -0.54 0.00 0.00 174.62 176.22 3gth h ASP 340 N -0.21 0.57 -0.49 3.99 3.45 -1.97 -1.47 116.42 120.29 3gth h ASP 340 Ca -0.45 -0.15 0.06 0.00 0.43 0.00 0.00 57.03 56.92 3gth h ASP 340 Cb 1.25 -0.15 -0.05 0.00 -0.56 0.00 0.00 39.33 39.81 3gth h ASP 340 CO 0.61 0.71 0.18 0.00 -1.57 0.00 0.00 179.24 179.18 3gth h ALA 341 N 1.35 0.60 -0.44 3.45 0.00 -1.99 0.12 119.26 122.36 3gth h ALA 341 Ca 0.10 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.08 3gth h ALA 341 Cb 0.50 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3gth h ALA 341 CO 0.03 -0.21 0.28 0.93 0.00 0.00 0.00 179.25 180.28 3gth h GLU 342 N 0.36 0.55 -0.40 0.00 5.08 -1.69 -1.64 114.58 116.86 3gth h GLU 342 Ca 0.23 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.58 3gth h GLU 342 Cb 0.23 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 3gth h GLU 342 CO -0.23 0.37 0.23 0.00 -1.00 0.00 0.00 179.01 178.38 3gth h ARG 343 N 0.57 0.45 -0.26 2.33 3.08 -0.59 -2.42 114.38 117.54 3gth h ARG 343 Ca 0.17 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 3gth h ARG 343 Cb -0.04 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 3gth h ARG 343 CO -0.05 0.30 0.08 -0.07 -1.07 0.00 0.00 179.97 179.16 3gth h LEU 344 N 0.46 0.32 -0.36 3.04 3.38 -0.37 0.43 115.31 122.22 3gth h LEU 344 Ca 0.16 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.05 3gth h LEU 344 Cb 0.02 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3gth h LEU 344 CO -0.08 0.32 0.04 -1.28 0.09 0.00 0.00 178.44 177.52 3gth h SER 345 N 0.36 0.59 -0.38 -0.43 0.87 -0.87 -1.55 113.55 112.13 3gth h SER 345 Ca 0.09 -0.28 -0.13 0.00 -1.23 0.00 0.00 61.79 60.24 3gth h SER 345 Cb 0.11 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 3gth h SER 345 CO -0.01 0.72 -0.27 0.58 -0.53 0.00 0.00 176.83 177.32 3gth h VAL 346 N 0.43 1.28 -0.55 2.23 2.07 -0.98 -2.87 116.25 117.87 3gth h VAL 346 Ca 0.11 -1.43 -0.02 0.00 0.82 0.00 0.00 66.70 66.17 3gth h VAL 346 Cb 0.40 1.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.50 3gth h VAL 346 CO 0.01 0.48 0.27 0.25 0.02 0.00 0.00 177.57 178.60 3gth h LEU 347 N 0.67 0.71 -0.76 2.57 5.85 -0.80 -0.74 115.31 122.81 3gth h LEU 347 Ca 0.07 -0.12 -0.13 0.00 0.84 0.00 0.00 57.88 58.54 3gth h LEU 347 Cb 0.85 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 3gth h LEU 347 CO 0.07 0.64 -0.59 0.71 -0.34 0.00 0.00 178.44 178.93 3gth h THR 348 N 0.74 1.41 0.20 1.05 1.35 -1.33 0.12 112.91 116.46 3gth h THR 348 Ca 0.19 -2.01 -0.01 0.00 -0.55 0.00 0.00 66.41 64.03 3gth h THR 348 Cb 0.10 2.06 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 3gth h THR 348 CO -0.03 0.58 -0.10 0.74 -0.25 0.00 0.00 175.52 176.47 3gth h THR 349 N 0.06 0.86 -0.79 6.82 2.02 -1.21 0.28 112.91 120.97 3gth h THR 349 Ca -0.01 -0.33 -0.00 0.00 0.77 0.00 0.00 66.41 66.84 3gth h THR 349 Cb 1.07 1.06 -0.04 0.00 -1.74 0.00 0.00 68.15 68.50 3gth h THR 349 CO 0.08 0.08 0.48 -0.07 0.37 0.00 0.00 175.52 176.46 3gth h LEU 350 N -0.43 0.93 -0.62 2.58 3.38 -0.93 -0.99 115.31 119.23 3gth h LEU 350 Ca -0.03 -0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 3gth h LEU 350 Cb 0.33 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 3gth h LEU 350 CO 0.05 0.71 -0.07 -0.07 0.09 0.00 0.00 178.44 179.15 3gth h LEU 351 N 1.08 1.01 -0.30 1.67 3.38 -0.60 -2.12 115.31 119.44 3gth h LEU 351 Ca 0.28 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3gth h LEU 351 Cb -0.06 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.42 3gth h LEU 351 CO -0.05 1.09 0.00 0.61 0.09 0.00 0.00 178.44 180.18 3gth n GLY 352 N -0.35 -1.20 1.46 0.83 0.00 0.98 -2.09 105.19 104.81 3gth n GLY 352 Ca 0.02 0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.15 3gth n GLY 352 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3gth n GLU 353 N -1.86 3.19 -0.90 1.61 1.02 -0.54 -4.97 120.64 118.18 3gth n GLU 353 Ca 0.03 -2.77 0.00 0.00 -0.02 0.00 0.00 57.16 54.40 3gth n GLU 353 Cb 0.23 -1.71 0.00 0.00 -0.02 0.00 0.00 31.44 29.93 3gth n GLU 353 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gth n GLY 354 N 1.41 0.49 0.61 0.62 0.00 -0.89 -4.98 105.19 102.46 3gth n GLY 354 Ca 0.25 -0.50 0.05 0.00 0.00 0.00 0.00 46.02 45.82 3gth n GLY 354 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3gth n TYR 355 N -2.90 0.45 -0.32 1.61 4.01 -0.86 -4.52 117.16 114.62 3gth n TYR 355 Ca 0.00 -0.21 0.18 0.00 -0.16 0.00 0.00 57.90 57.71 3gth n TYR 355 Cb 0.00 -0.03 0.38 0.00 -0.31 0.00 0.00 39.34 39.38 3gth n TYR 355 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3gth h ALA 356 N 3.47 1.67 0.00 -0.72 0.00 -1.84 0.27 119.26 122.11 3gth h ALA 356 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3gth h ALA 356 Cb 0.48 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3gth h ALA 356 CO 0.02 -0.43 0.00 -0.25 0.00 0.00 0.00 179.25 178.59 3gth n ASP 357 N -5.05 0.40 0.00 0.00 8.00 -1.26 -2.41 116.55 116.24 3gth n ASP 357 Ca 0.26 0.65 0.00 0.00 0.71 0.00 0.00 54.79 56.41 3gth n ASP 357 Cb 0.80 -0.72 0.00 0.00 -0.02 0.00 0.00 41.12 41.18 3gth n ASP 357 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3gth n ARG 358 N -2.00 1.83 -4.07 -1.24 5.12 0.94 -4.80 116.66 112.44 3gth n ARG 358 Ca 0.00 -1.20 -0.35 0.00 -1.93 0.00 0.00 57.85 54.37 3gth n ARG 358 Cb 0.10 -1.00 -0.11 0.00 -1.16 0.00 0.00 32.46 30.29 3gth n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3gth s LEU 359 N -0.71 3.50 0.22 0.55 1.43 -1.01 -0.35 118.68 122.32 3gth s LEU 359 Ca 0.00 -0.08 0.11 0.00 -1.03 0.00 0.00 54.13 53.13 3gth s LEU 359 Cb 0.00 -1.89 -0.05 0.00 0.03 0.00 0.00 46.19 44.29 3gth s LEU 359 CO 0.00 0.11 -0.22 -0.76 0.23 0.00 0.00 176.35 175.71 3gth s LEU 360 N 0.74 2.49 -0.04 1.79 1.02 -0.79 -4.42 118.68 119.47 3gth s LEU 360 Ca 0.02 -0.92 0.03 0.00 0.02 0.00 0.00 54.13 53.27 3gth s LEU 360 Cb -0.14 -1.12 0.00 0.00 0.02 0.00 0.00 46.19 44.95 3gth s LEU 360 CO 0.02 0.08 -0.14 -0.76 0.02 0.00 0.00 176.35 175.57 3gth s LEU 361 N -2.96 1.82 0.33 1.79 1.43 -1.26 -1.48 118.68 118.35 3gth s LEU 361 Ca 0.24 -0.30 -0.09 0.00 -1.03 0.00 0.00 54.13 52.95 3gth s LEU 361 Cb -0.07 -0.83 0.02 0.00 0.03 0.00 0.00 46.19 45.33 3gth s LEU 361 CO 0.11 0.10 0.57 -0.55 0.23 0.00 0.00 176.35 176.82 3gth s SER 362 N 0.23 0.40 -0.10 2.29 0.15 0.55 -4.25 113.70 112.97 3gth s SER 362 Ca -0.06 -1.24 0.11 0.00 0.70 0.00 0.00 55.95 55.45 3gth s SER 362 Cb -0.12 0.70 -0.15 0.00 -1.71 0.00 0.00 66.02 64.74 3gth s SER 362 CO 0.02 -1.38 0.08 1.41 1.20 0.00 0.00 173.24 174.58 3gth n HIS 363 N -0.51 0.00 -2.45 3.44 -0.00 -1.10 -1.44 115.22 113.15 3gth n HIS 363 Ca -0.02 0.00 -0.15 0.00 -0.00 0.00 0.00 57.72 57.55 3gth n HIS 363 Cb 0.61 -0.52 0.00 0.00 -0.00 0.00 0.00 29.99 30.08 3gth n HIS 363 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 3gth n ASP 364 N -2.34 -4.57 -4.83 0.41 4.64 -0.24 -4.00 116.55 105.61 3gth n ASP 364 Ca -0.16 -0.08 -0.30 0.00 -1.38 0.00 0.00 54.79 52.87 3gth n ASP 364 Cb 0.78 -3.63 0.06 0.00 -1.04 0.00 0.00 41.12 37.30 3gth n ASP 364 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 3gth s SER 365 N -2.49 5.08 -0.17 1.67 1.04 -1.26 -4.79 113.70 112.78 3gth s SER 365 Ca 0.07 1.36 0.01 0.00 0.48 0.00 0.00 55.95 57.87 3gth s SER 365 Cb -0.03 -2.17 0.03 0.00 0.10 0.00 0.00 66.02 63.94 3gth s SER 365 CO 0.09 -1.60 -0.14 -0.63 0.98 0.00 0.00 173.24 171.94 3gth s ILE 366 N -3.17 1.67 0.08 -1.02 1.01 -1.26 -1.09 121.20 117.42 3gth s ILE 366 Ca 0.59 -0.79 -0.14 0.00 0.00 0.00 0.00 60.65 60.31 3gth s ILE 366 Cb -0.13 -1.60 -0.20 0.00 0.01 0.00 0.00 42.46 40.53 3gth s ILE 366 CO 0.54 0.38 1.23 -0.50 0.00 0.00 0.00 174.94 176.59 3gth h TRP 367 N 8.01 1.04 -3.17 3.97 4.06 -0.88 -3.43 115.95 125.55 3gth h TRP 367 Ca -0.36 -0.53 -0.38 0.00 2.06 0.00 0.00 58.89 59.68 3gth h TRP 367 Cb 1.12 -0.13 -0.39 0.00 -1.00 0.00 0.00 29.16 28.76 3gth h TRP 367 CO 0.48 1.36 -0.72 -1.58 -3.56 0.00 0.00 178.44 174.42 3gth s HIS 368 N -3.48 0.04 0.37 0.49 2.46 -0.22 -4.90 115.29 110.06 3gth s HIS 368 Ca -0.10 0.16 -0.25 0.00 0.47 0.00 0.00 55.06 55.34 3gth s HIS 368 Cb 0.07 -0.50 -0.09 0.00 -0.13 0.00 0.00 32.58 31.93 3gth s HIS 368 CO 0.91 -0.31 1.01 -1.58 -2.47 0.00 0.00 174.74 172.30 3gth s TRP 369 N 2.19 3.42 0.07 3.88 0.52 -1.26 -2.28 118.94 125.48 3gth s TRP 369 Ca 0.04 1.69 -0.03 0.00 0.02 0.00 0.00 56.10 57.82 3gth s TRP 369 Cb -0.13 -3.05 -0.05 0.00 -1.15 0.00 0.00 33.47 29.10 3gth s TRP 369 CO -0.05 -0.31 0.27 -0.51 0.02 0.00 0.00 176.95 176.36 3gth s LEU 370 N -2.44 4.34 0.00 2.99 1.43 0.92 -4.86 118.68 121.04 3gth s LEU 370 Ca 0.55 0.42 0.00 0.00 -1.03 0.00 0.00 54.13 54.07 3gth s LEU 370 Cb -0.20 -2.98 0.00 0.00 0.03 0.00 0.00 46.19 43.04 3gth s LEU 370 CO 0.26 0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.61 3gth n GLY 371 N 0.44 -1.80 3.76 -3.19 0.00 -1.24 -4.67 105.19 98.49 3gth n GLY 371 Ca -0.06 -1.81 -0.40 0.00 0.00 0.00 0.00 46.02 43.75 3gth n GLY 371 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gth s ARG 372 N 0.00 4.68 0.19 1.61 0.52 -1.26 -4.67 118.95 120.01 3gth s ARG 372 Ca 0.00 1.61 -0.32 0.00 -0.52 0.00 0.00 55.73 56.50 3gth s ARG 372 Cb 0.00 -3.13 -0.15 0.00 0.52 0.00 0.00 34.95 32.18 3gth s ARG 372 CO 0.00 0.31 1.14 -0.35 0.02 0.00 0.00 175.30 176.42 3gth n PRO 373 N 1.14 1.19 -1.75 3.54 -0.04 -1.26 -4.85 135.00 132.96 3gth n PRO 373 Ca -0.01 0.42 -0.42 0.00 -0.04 0.00 0.00 63.50 63.46 3gth n PRO 373 Cb 0.47 -1.90 -0.01 0.00 -0.04 0.00 0.00 33.50 32.01 3gth n PRO 373 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 3gth n PRO 374 N 1.64 2.71 -3.19 0.54 -0.02 -1.26 -4.95 135.00 130.46 3gth n PRO 374 Ca 0.14 0.96 -0.42 0.00 -2.02 0.00 0.00 63.50 62.16 3gth n PRO 374 Cb 0.25 -2.73 -0.07 0.00 -0.02 0.00 0.00 33.50 30.93 3gth n PRO 374 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gth s ALA 375 N -0.29 3.42 -0.77 3.55 0.00 -1.26 -5.03 121.76 121.38 3gth s ALA 375 Ca 0.61 -1.13 -0.19 0.00 0.00 0.00 0.00 51.96 51.25 3gth s ALA 375 Cb -0.49 -3.13 0.12 0.00 0.00 0.00 0.00 23.12 19.61 3gth s ALA 375 CO 0.52 -1.48 0.95 0.42 0.00 0.00 0.00 175.76 176.18 3gth s ILE 376 N 2.53 4.73 0.16 0.00 1.01 -1.26 -5.04 121.20 123.33 3gth s ILE 376 Ca 0.20 -1.21 -0.34 0.00 0.00 0.00 0.00 60.65 59.30 3gth s ILE 376 Cb -0.15 -4.65 -0.16 0.00 0.01 0.00 0.00 42.46 37.51 3gth s ILE 376 CO 0.15 -1.36 1.24 -0.81 0.00 0.00 0.00 174.94 174.17 3gth n PRO 377 N 6.55 1.28 -0.36 2.79 -0.04 -1.26 -4.77 135.00 139.19 3gth n PRO 377 Ca 0.08 0.46 0.26 0.00 -0.04 0.00 0.00 63.50 64.25 3gth n PRO 377 Cb 0.46 -2.01 0.52 0.00 -0.04 0.00 0.00 33.50 32.43 3gth n PRO 377 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3gth h GLU 378 N 3.81 0.32 0.00 0.54 3.07 -2.02 0.20 114.58 120.50 3gth h GLU 378 Ca -0.44 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.40 3gth h GLU 378 Cb 1.33 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.17 3gth h GLU 378 CO 0.73 0.21 0.00 0.00 -1.40 0.00 0.00 179.01 178.55 3gth h ALA 379 N 1.69 1.00 -0.02 3.43 0.00 -2.04 -1.76 119.26 121.55 3gth h ALA 379 Ca 0.69 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.60 3gth h ALA 379 Cb 1.76 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.55 3gth h ALA 379 CO -0.43 0.00 -0.33 0.00 0.00 0.00 0.00 179.25 178.49 3gth n ALA 380 N -2.05 3.23 -0.19 0.00 0.00 0.71 -4.51 120.51 117.70 3gth n ALA 380 Ca -0.02 -0.63 -0.00 0.00 0.00 0.00 0.00 53.44 52.79 3gth n ALA 380 Cb 0.12 -0.83 0.09 0.00 0.00 0.00 0.00 19.45 18.83 3gth n ALA 380 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3gth h LEU 381 N 2.92 -0.09 -1.17 0.00 3.38 -1.31 -1.64 115.31 117.40 3gth h LEU 381 Ca 0.00 0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 3gth h LEU 381 Cb 0.79 0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 3gth h LEU 381 CO 0.00 -0.03 0.12 1.55 0.09 0.00 0.00 178.44 180.17 3gth h PRO 382 N 0.20 0.70 0.00 1.13 0.13 -1.79 -0.81 132.00 131.56 3gth h PRO 382 Ca 0.30 -0.13 -0.02 0.00 -0.87 0.00 0.00 66.00 65.29 3gth h PRO 382 Cb 0.45 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 31.47 3gth h PRO 382 CO -0.42 0.63 -0.08 0.00 -0.23 0.00 0.00 178.00 177.90 3gth h ALA 383 N 1.46 1.73 -0.11 -0.56 0.00 -1.48 -2.47 119.26 117.84 3gth h ALA 383 Ca 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3gth h ALA 383 Cb 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3gth h ALA 383 CO -0.00 0.10 0.00 1.33 0.00 0.00 0.00 179.25 180.68 3gth n VAL 384 N -4.25 0.27 -0.24 0.00 0.24 -1.05 -0.40 118.33 112.90 3gth n VAL 384 Ca -0.03 -0.64 0.02 0.00 -2.04 0.00 0.00 64.34 61.65 3gth n VAL 384 Cb 0.16 1.04 0.14 0.00 -1.47 0.00 0.00 33.84 33.71 3gth n VAL 384 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 3gth h LYS 385 N 2.19 0.52 -0.56 7.34 3.64 -0.65 -2.17 116.57 126.87 3gth h LYS 385 Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 3gth h LYS 385 Cb 0.55 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 3gth h LYS 385 CO 0.00 0.34 0.00 -0.25 -2.27 0.00 0.00 179.45 177.27 3gth n ASP 386 N -4.91 3.45 -3.89 4.20 8.00 -1.25 -4.77 116.55 117.38 3gth n ASP 386 Ca 0.11 -1.98 -0.42 0.00 0.71 0.00 0.00 54.79 53.20 3gth n ASP 386 Cb 0.29 -0.37 0.00 0.00 -0.02 0.00 0.00 41.12 41.02 3gth n ASP 386 CO 0.00 0.00 0.00 1.87 -0.39 0.00 0.00 177.20 178.68 3gth n TRP 387 N 1.41 3.68 -3.84 1.24 -0.00 -0.82 -4.51 117.44 114.60 3gth n TRP 387 Ca 0.21 -2.95 -0.09 0.00 -0.00 0.00 0.00 57.50 54.67 3gth n TRP 387 Cb 0.57 -2.50 -0.06 0.00 -0.00 0.00 0.00 31.31 29.32 3gth n TRP 387 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 177.69 174.31 3gth s HIS 388 N 3.01 0.14 -2.00 5.87 -3.43 -1.26 -4.82 115.29 112.81 3gth s HIS 388 Ca 0.47 -0.51 0.09 0.00 -0.80 0.00 0.00 55.06 54.31 3gth s HIS 388 Cb 0.12 0.07 0.57 0.00 -1.43 0.00 0.00 32.58 31.90 3gth s HIS 388 CO -0.05 -0.70 1.01 -0.35 -2.00 0.00 0.00 174.74 172.64 3gth n PRO 389 N -0.19 0.48 0.00 -0.38 -0.04 -1.26 -2.73 135.00 130.87 3gth n PRO 389 Ca -0.11 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.43 3gth n PRO 389 Cb 0.63 -1.31 -0.06 0.00 -0.04 0.00 0.00 33.50 32.72 3gth n PRO 389 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3gth n LEU 390 N -0.81 1.17 -0.01 1.53 4.77 -1.26 -4.66 117.00 117.73 3gth n LEU 390 Ca 0.07 -0.60 -0.10 0.00 -0.03 0.00 0.00 56.01 55.36 3gth n LEU 390 Cb 0.03 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.08 3gth n LEU 390 CO 0.05 0.25 0.87 -0.74 -1.33 0.00 0.00 177.39 176.49 3gth h HIS 391 N 0.74 0.00 0.38 -1.77 2.76 -1.76 -0.81 115.15 114.70 3gth h HIS 391 Ca 0.00 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.16 3gth h HIS 391 Cb 0.49 0.02 0.00 0.00 1.55 0.00 0.00 27.41 29.47 3gth h HIS 391 CO 0.00 -0.01 -0.18 0.82 -1.30 0.00 0.00 177.93 177.26 3gth h ILE 392 N 0.05 0.63 -0.84 6.26 2.04 -1.83 0.56 117.51 124.39 3gth h ILE 392 Ca 0.06 -0.13 0.14 0.00 1.00 0.00 0.00 64.86 65.92 3gth h ILE 392 Cb 0.07 0.70 -0.09 0.00 -0.74 0.00 0.00 36.82 36.76 3gth h ILE 392 CO -0.10 0.03 0.43 0.28 0.00 0.00 0.00 178.15 178.80 3gth h SER 393 N -0.59 0.54 0.45 1.72 0.02 -1.84 -0.38 113.55 113.48 3gth h SER 393 Ca -0.05 0.08 -0.27 0.00 -0.84 0.00 0.00 61.79 60.71 3gth h SER 393 Cb 0.44 -0.01 -0.05 0.00 0.14 0.00 0.00 62.40 62.92 3gth h SER 393 CO 0.09 0.25 -1.75 0.47 -1.14 0.00 0.00 176.83 174.74 3gth n ASP 394 N -4.85 0.73 -0.01 3.07 8.00 -0.32 -4.60 116.55 118.57 3gth n ASP 394 Ca 0.16 0.34 -0.02 0.00 0.71 0.00 0.00 54.79 55.98 3gth n ASP 394 Cb 0.40 0.17 -0.01 0.00 -0.02 0.00 0.00 41.12 41.66 3gth n ASP 394 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3gth n ASP 395 N -2.96 3.41 -0.01 -2.24 8.00 0.19 -4.71 116.55 118.23 3gth n ASP 395 Ca -0.18 -0.01 -0.11 0.00 0.71 0.00 0.00 54.79 55.20 3gth n ASP 395 Cb 1.02 -0.05 -0.09 0.00 -0.02 0.00 0.00 41.12 41.98 3gth n ASP 395 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3gth h ILE 396 N -0.01 1.15 0.32 0.53 1.08 -0.78 -2.48 117.51 117.32 3gth h ILE 396 Ca -0.07 -1.52 0.00 0.00 -0.39 0.00 0.00 64.86 62.89 3gth h ILE 396 Cb 1.10 2.03 -0.03 0.00 -3.07 0.00 0.00 36.82 36.85 3gth h ILE 396 CO -0.01 0.34 -0.37 -0.07 -0.69 0.00 0.00 178.15 177.34 3gth h LEU 397 N -0.86 -1.01 -1.42 1.44 3.38 -1.37 0.57 115.31 116.03 3gth h LEU 397 Ca -0.01 0.09 0.21 0.00 0.09 0.00 0.00 57.88 58.26 3gth h LEU 397 Cb 0.62 0.35 -0.08 0.00 0.09 0.00 0.00 40.66 41.64 3gth h LEU 397 CO 0.01 -0.50 0.61 -0.65 0.09 0.00 0.00 178.44 178.01 3gth h PRO 398 N -0.73 0.44 -0.11 1.13 0.11 -1.81 0.16 132.00 131.20 3gth h PRO 398 Ca -0.02 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.94 3gth h PRO 398 Cb 0.67 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.67 3gth h PRO 398 CO -0.09 0.29 -0.50 0.22 -0.21 0.00 0.00 178.00 177.71 3gth h ASP 399 N 0.46 0.32 -0.13 -2.05 -0.00 -0.64 -1.55 116.42 112.83 3gth h ASP 399 Ca 0.50 -0.16 -0.19 0.00 -0.00 0.00 0.00 57.03 57.18 3gth h ASP 399 Cb 1.19 -0.09 0.01 0.00 -0.00 0.00 0.00 39.33 40.43 3gth h ASP 399 CO -0.22 0.77 -0.67 -0.07 -0.00 0.00 0.00 179.24 179.05 3gth h LEU 400 N 0.24 0.81 -0.60 2.28 3.38 0.13 -2.57 115.31 118.99 3gth h LEU 400 Ca 0.01 -0.64 0.03 0.00 0.09 0.00 0.00 57.88 57.37 3gth h LEU 400 Cb 0.97 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.44 3gth h LEU 400 CO 0.08 1.32 0.36 0.03 0.09 0.00 0.00 178.44 180.32 3gth h ARG 401 N 0.36 0.69 0.00 1.13 2.47 -0.88 0.07 114.38 118.23 3gth h ARG 401 Ca -0.05 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.63 3gth h ARG 401 Cb 1.31 -0.16 0.00 0.00 -1.65 0.00 0.00 29.97 29.47 3gth h ARG 401 CO 0.14 0.46 0.00 2.89 0.56 0.00 0.00 179.97 184.01 3gth n ARG 402 N -4.75 0.13 0.00 0.04 1.85 -0.59 -1.42 116.66 111.93 3gth n ARG 402 Ca 0.05 0.32 0.13 0.00 -1.00 0.00 0.00 57.85 57.35 3gth n ARG 402 Cb 0.09 -1.73 0.33 0.00 -1.05 0.00 0.00 32.46 30.10 3gth n ARG 402 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 3gth n ARG 403 N -1.97 0.60 0.00 2.89 1.74 -0.11 -4.93 116.66 114.89 3gth n ARG 403 Ca 0.03 -0.36 0.00 0.00 -0.77 0.00 0.00 57.85 56.75 3gth n ARG 403 Cb 0.24 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.19 3gth n ARG 403 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gth n GLY 404 N 1.39 1.97 3.76 -0.13 0.00 -0.51 -5.06 105.19 106.61 3gth n GLY 404 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 3gth n GLY 404 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gth s ILE 405 N -2.06 2.37 0.30 -0.61 -1.09 -0.51 -4.97 121.20 114.64 3gth s ILE 405 Ca 0.00 0.30 -0.00 0.00 -2.23 0.00 0.00 60.65 58.71 3gth s ILE 405 Cb 0.00 -3.16 -0.04 0.00 -1.58 0.00 0.00 42.46 37.68 3gth s ILE 405 CO 0.00 0.01 0.51 0.42 -1.23 0.00 0.00 174.94 174.65 3gth s THR 406 N -1.33 5.12 0.41 2.92 -4.23 -1.26 -4.17 115.64 113.09 3gth s THR 406 Ca 0.66 -0.38 0.14 0.00 -1.18 0.00 0.00 61.69 60.93 3gth s THR 406 Cb -0.38 -3.81 0.35 0.00 1.34 0.00 0.00 72.50 69.99 3gth s THR 406 CO 0.46 -0.43 1.91 -0.08 -0.54 0.00 0.00 174.62 175.94 3gth h GLU 407 N 1.18 0.47 -0.31 3.99 4.81 -1.98 0.30 114.58 123.04 3gth h GLU 407 Ca -0.49 -0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 58.57 3gth h GLU 407 Cb 1.21 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.47 3gth h GLU 407 CO 0.63 0.31 -0.39 1.49 -0.73 0.00 0.00 179.01 180.32 3gth h GLU 408 N 0.48 0.73 -0.36 1.92 4.81 -1.99 -0.71 114.58 119.46 3gth h GLU 408 Ca 0.39 -0.38 -0.12 0.00 -0.13 0.00 0.00 59.36 59.12 3gth h GLU 408 Cb 0.81 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 3gth h GLU 408 CO -0.14 0.99 -0.24 1.96 -0.73 0.00 0.00 179.01 180.86 3gth h GLN 409 N 0.60 0.81 -0.61 1.92 4.20 -1.41 -1.12 115.11 119.50 3gth h GLN 409 Ca 0.05 -0.38 -0.03 0.00 0.06 0.00 0.00 58.65 58.35 3gth h GLN 409 Cb 0.93 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.68 3gth h GLN 409 CO 0.09 1.01 0.26 0.28 -0.67 0.00 0.00 178.83 179.79 3gth h VAL 410 N 0.60 1.23 0.00 -0.54 2.07 -0.95 -1.37 116.25 117.28 3gth h VAL 410 Ca 0.07 -0.70 -0.04 0.00 0.82 0.00 0.00 66.70 66.86 3gth h VAL 410 Cb 0.80 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 3gth h VAL 410 CO 0.07 0.27 -0.19 1.23 0.02 0.00 0.00 177.57 178.98 3gth h GLY 411 N 0.85 0.00 0.55 2.17 0.00 -0.94 -1.27 103.07 104.44 3gth h GLY 411 Ca 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.51 3gth h GLY 411 CO -0.02 0.00 -0.07 -1.61 0.00 0.00 0.00 176.54 174.84 3gth h GLN 412 N 0.00 0.12 -0.18 4.80 5.75 -0.47 0.17 115.11 125.31 3gth h GLN 412 Ca -0.00 -0.08 -0.01 0.00 -0.15 0.00 0.00 58.65 58.42 3gth h GLN 412 Cb 0.57 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.12 3gth h GLN 412 CO 0.02 0.63 0.08 0.52 -2.65 0.00 0.00 178.83 177.44 3gth h MET 413 N -0.37 0.26 0.00 1.69 2.86 -1.04 0.71 114.93 119.04 3gth h MET 413 Ca 0.00 -0.04 -0.09 0.00 -2.06 0.00 0.00 59.70 57.51 3gth h MET 413 Cb 0.62 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.22 3gth h MET 413 CO 0.02 0.30 -1.05 1.79 1.06 0.00 0.00 176.91 179.03 3gth h THR 414 N 0.16 0.36 0.00 2.22 1.35 -1.31 -3.40 112.91 112.29 3gth h THR 414 Ca 0.06 -1.65 0.00 0.00 -0.55 0.00 0.00 66.41 64.27 3gth h THR 414 Cb 0.13 1.92 0.00 0.00 -1.73 0.00 0.00 68.15 68.47 3gth h THR 414 CO -0.01 0.21 -0.80 0.52 -0.25 0.00 0.00 175.52 175.19 3gth n VAL 415 N -2.89 0.00 0.26 6.82 0.31 0.15 -1.41 118.33 121.57 3gth n VAL 415 Ca -0.04 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.16 3gth n VAL 415 Cb 0.71 -1.23 -0.07 0.00 -0.91 0.00 0.00 33.84 32.34 3gth n VAL 415 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3gth h GLY 416 N 0.00 -1.06 0.32 2.92 0.00 -0.41 -2.01 103.07 102.83 3gth h GLY 416 Ca 0.00 0.46 0.11 0.00 0.00 0.00 0.00 47.33 47.90 3gth h GLY 416 CO 0.00 -0.35 0.28 3.43 0.00 0.00 0.00 176.54 179.90 3gth h ASN 417 N -0.78 0.29 -0.56 0.19 2.35 0.21 -2.26 115.58 115.01 3gth h ASN 417 Ca -0.06 0.09 -0.08 0.00 -0.55 0.00 0.00 56.30 55.69 3gth h ASN 417 Cb 0.65 0.05 -0.02 0.00 0.05 0.00 0.00 38.32 39.05 3gth h ASN 417 CO 0.03 0.15 0.03 -0.65 -1.65 0.00 0.00 177.43 175.34 3gth h PRO 418 N 0.46 0.97 -0.82 0.81 0.11 -1.76 -0.80 132.00 130.98 3gth h PRO 418 Ca 0.35 -0.30 0.11 0.00 0.11 0.00 0.00 66.00 66.27 3gth h PRO 418 Cb 0.46 -0.10 -0.08 0.00 0.11 0.00 0.00 31.00 31.40 3gth h PRO 418 CO -0.33 0.96 0.45 0.00 -0.21 0.00 0.00 178.00 178.87 3gth h ALA 419 N 0.98 1.18 0.16 -0.75 0.00 -0.79 -0.41 119.26 119.62 3gth h ALA 419 Ca 0.16 0.05 -0.22 0.00 0.00 0.00 0.00 54.91 54.90 3gth h ALA 419 Cb 0.50 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 18.22 3gth h ALA 419 CO 0.02 0.04 -0.95 -0.09 0.00 0.00 0.00 179.25 178.28 3gth h ARG 420 N 0.73 0.36 -0.48 0.00 1.12 -1.32 -1.16 114.38 113.64 3gth h ARG 420 Ca 0.41 -0.60 -0.06 0.00 -1.11 0.00 0.00 59.98 58.62 3gth h ARG 420 Cb 0.43 0.22 -0.02 0.00 -0.01 0.00 0.00 29.97 30.59 3gth h ARG 420 CO -0.27 1.28 0.06 1.25 -3.11 0.00 0.00 179.97 179.18 3gth h LEU 421 N -0.25 0.78 0.00 3.80 6.46 -0.93 -3.35 115.31 121.81 3gth h LEU 421 Ca -0.16 -0.27 0.00 0.00 -0.12 0.00 0.00 57.88 57.32 3gth h LEU 421 Cb 1.74 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 41.47 3gth h LEU 421 CO 0.18 0.85 -1.61 0.49 -0.62 0.00 0.00 178.44 177.74 3gth n PHE 422 N -4.41 0.00 1.99 1.25 3.01 -0.18 -4.56 117.46 114.55 3gth n PHE 422 Ca 0.01 0.00 0.16 0.00 1.01 0.00 0.00 57.45 58.63 3gth n PHE 422 Cb 0.26 -0.31 0.94 0.00 -0.01 0.00 0.00 39.48 40.37 3gth n PHE 422 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18