#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gti s LEU 94 N 0.00 4.20 0.02 0.99 2.96 -1.26 -5.05 118.68 120.53 3gti s LEU 94 Ca 0.00 0.20 -0.01 0.00 -0.22 0.00 0.00 54.13 54.10 3gti s LEU 94 Cb 0.00 -2.94 -0.04 0.00 0.50 0.00 0.00 46.19 43.71 3gti s LEU 94 CO 0.00 -0.73 0.14 0.54 -1.32 0.00 0.00 176.35 174.98 3gti s VAL 95 N 3.01 5.04 0.30 1.68 0.11 -1.26 -4.95 120.40 124.34 3gti s VAL 95 Ca 0.29 -0.37 -0.29 0.00 -2.93 0.00 0.00 61.98 58.68 3gti s VAL 95 Cb -0.13 -3.37 -0.13 0.00 -1.53 0.00 0.00 36.38 31.22 3gti s VAL 95 CO 0.17 0.28 1.22 -2.65 -3.33 0.00 0.00 175.10 170.79 3gti n PRO 96 N 0.86 1.84 -4.05 1.54 -0.02 -1.26 -4.92 135.00 128.99 3gti n PRO 96 Ca -0.10 0.65 -0.25 0.00 -2.02 0.00 0.00 63.50 61.77 3gti n PRO 96 Cb 0.52 -2.17 -0.17 0.00 -0.02 0.00 0.00 33.50 31.66 3gti n PRO 96 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3gti s ARG 97 N -1.49 1.38 0.00 -0.52 0.52 -1.26 -5.07 118.95 112.51 3gti s ARG 97 Ca 0.59 -0.22 0.00 0.00 -0.52 0.00 0.00 55.73 55.58 3gti s ARG 97 Cb -0.63 -1.40 0.00 0.00 0.52 0.00 0.00 34.95 33.43 3gti s ARG 97 CO 0.59 -0.20 0.00 0.41 0.02 0.00 0.00 175.30 176.12 3gti n GLY 98 N 4.66 0.72 3.71 -3.53 0.00 -1.26 -4.93 105.19 104.57 3gti n GLY 98 Ca -0.15 -2.06 -0.36 0.00 0.00 0.00 0.00 46.02 43.44 3gti n GLY 98 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3gti n SER 99 N 1.27 1.76 -3.67 1.61 3.41 -1.26 -4.99 113.62 111.75 3gti n SER 99 Ca 0.00 0.78 -0.14 0.00 -0.26 0.00 0.00 58.87 59.25 3gti n SER 99 Cb 0.00 -1.53 -0.08 0.00 -0.26 0.00 0.00 64.21 62.33 3gti n SER 99 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 3gti s HIS 100 N -1.53 -0.60 0.00 7.33 5.04 -1.19 -3.39 115.29 120.95 3gti s HIS 100 Ca 0.81 1.41 0.00 0.00 -1.54 0.00 0.00 55.06 55.74 3gti s HIS 100 Cb -0.37 0.22 0.00 0.00 0.04 0.00 0.00 32.58 32.48 3gti s HIS 100 CO 0.43 -0.33 0.00 -1.33 -2.34 0.00 0.00 174.74 171.16 3gti n MET 101 N 2.51 0.00 -3.61 2.88 2.81 -1.24 -5.01 117.12 115.46 3gti n MET 101 Ca -0.15 0.00 -0.09 0.00 -1.81 0.00 0.00 57.70 55.65 3gti n MET 101 Cb 0.56 0.00 -0.06 0.00 -0.71 0.00 0.00 33.22 33.01 3gti n MET 101 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 3gti s THR 102 N 1.42 0.00 -0.23 2.03 2.01 -1.26 -5.09 115.64 114.52 3gti s THR 102 Ca 0.00 0.00 -0.36 0.00 0.31 0.00 0.00 61.69 61.64 3gti s THR 102 Cb 0.00 -1.00 -0.13 0.00 0.01 0.00 0.00 72.50 71.38 3gti s THR 102 CO 0.00 0.00 1.93 0.00 -0.69 0.00 0.00 174.62 175.86 3gti n ALA 103 N 1.46 0.61 -3.34 7.40 0.00 -1.22 -4.79 120.51 120.63 3gti n ALA 103 Ca -0.11 0.21 -0.46 0.00 0.00 0.00 0.00 53.44 53.09 3gti n ALA 103 Cb 0.57 -2.43 -0.04 0.00 0.00 0.00 0.00 19.45 17.55 3gti n ALA 103 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3gti s GLN 104 N 4.55 3.23 0.82 0.00 -1.52 -1.26 -0.29 119.66 125.19 3gti s GLN 104 Ca 0.99 -2.08 -0.12 0.00 -1.95 0.00 0.00 55.36 52.21 3gti s GLN 104 Cb -0.85 -4.32 0.10 0.00 -0.22 0.00 0.00 33.01 27.72 3gti s GLN 104 CO 0.55 -1.30 1.17 0.95 -0.25 0.00 0.00 175.29 176.42 3gti s THR 105 N 0.88 2.05 -1.98 -0.19 -4.23 0.21 -3.59 115.64 108.80 3gti s THR 105 Ca 0.10 -0.07 0.11 0.00 -1.18 0.00 0.00 61.69 60.66 3gti s THR 105 Cb -0.20 -2.99 0.31 0.00 1.34 0.00 0.00 72.50 70.96 3gti s THR 105 CO -0.03 0.00 1.11 1.33 -0.54 0.00 0.00 174.62 176.50 3gti n VAL 106 N -3.33 0.03 -0.18 2.29 0.24 0.53 -1.56 118.33 116.35 3gti n VAL 106 Ca 0.10 0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.40 3gti n VAL 106 Cb 0.61 -0.83 0.00 0.00 -1.47 0.00 0.00 33.84 32.14 3gti n VAL 106 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3gti n THR 107 N -1.01 0.58 0.00 3.34 -2.24 -1.26 -4.73 114.28 108.95 3gti n THR 107 Ca 0.08 -0.70 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 3gti n THR 107 Cb 0.04 0.77 0.00 0.00 -2.10 0.00 0.00 70.33 69.04 3gti n THR 107 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gti n GLY 108 N -0.29 1.97 3.79 3.38 0.00 -0.60 -5.09 105.19 108.35 3gti n GLY 108 Ca 0.00 -1.95 -0.34 0.00 0.00 0.00 0.00 46.02 43.73 3gti n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gti s ALA 109 N -1.48 2.74 -0.07 4.61 0.00 -1.26 -0.62 121.76 125.69 3gti s ALA 109 Ca 0.00 0.57 -0.06 0.00 0.00 0.00 0.00 51.96 52.47 3gti s ALA 109 Cb 0.00 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.87 3gti s ALA 109 CO 0.00 -0.70 0.18 0.54 0.00 0.00 0.00 175.76 175.78 3gti s VAL 110 N -2.15 -0.01 0.49 0.00 0.11 0.60 -4.87 120.40 114.57 3gti s VAL 110 Ca 0.67 0.03 -0.22 0.00 -2.93 0.00 0.00 61.98 59.53 3gti s VAL 110 Cb -0.18 -0.26 -0.07 0.00 -1.53 0.00 0.00 36.38 34.34 3gti s VAL 110 CO 0.30 0.01 1.20 0.00 -3.33 0.00 0.00 175.10 173.28 3gti s ALA 111 N 0.28 2.89 0.30 1.54 0.00 -1.26 -3.39 121.76 122.11 3gti s ALA 111 Ca -0.02 0.99 0.05 0.00 0.00 0.00 0.00 51.96 52.99 3gti s ALA 111 Cb -0.03 -3.42 0.72 0.00 0.00 0.00 0.00 23.12 20.40 3gti s ALA 111 CO -0.01 -0.82 1.77 0.00 0.00 0.00 0.00 175.76 176.69 3gti h ALA 112 N 1.77 1.61 0.00 0.00 0.00 -1.87 0.14 119.26 120.91 3gti h ALA 112 Ca -0.50 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 3gti h ALA 112 Cb 1.26 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 3gti h ALA 112 CO 0.59 -0.09 -0.02 0.00 0.00 0.00 0.00 179.25 179.73 3gti h ALA 113 N 1.65 1.21 -0.01 0.00 0.00 -1.91 -2.19 119.26 118.01 3gti h ALA 113 Ca 0.57 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.46 3gti h ALA 113 Cb 0.90 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 3gti h ALA 113 CO -0.40 0.03 -0.07 1.04 0.00 0.00 0.00 179.25 179.85 3gti n GLN 114 N -3.41 1.52 -0.04 0.00 1.13 0.49 -4.18 117.38 112.90 3gti n GLN 114 Ca -0.02 -0.93 -0.10 0.00 -1.94 0.00 0.00 57.00 54.00 3gti n GLN 114 Cb 0.12 -1.48 0.04 0.00 0.11 0.00 0.00 30.24 29.04 3gti n GLN 114 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 3gti h LEU 115 N 2.27 0.74 0.00 1.08 3.38 -1.39 -3.48 115.31 117.91 3gti h LEU 115 Ca 0.00 -0.36 0.02 0.00 0.09 0.00 0.00 57.88 57.63 3gti h LEU 115 Cb 0.54 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 3gti h LEU 115 CO 0.00 1.09 -0.02 0.61 0.09 0.00 0.00 178.44 180.20 3gti n GLY 116 N 0.13 -1.21 3.70 0.83 0.00 -1.26 -3.51 105.19 103.87 3gti n GLY 116 Ca -0.02 -1.09 -0.43 0.00 0.00 0.00 0.00 46.02 44.47 3gti n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gti n ALA 117 N -0.11 1.67 -2.80 4.61 0.00 -1.26 -4.72 120.51 117.90 3gti n ALA 117 Ca 0.00 0.39 -0.15 0.00 0.00 0.00 0.00 53.44 53.68 3gti n ALA 117 Cb 0.03 -2.34 -0.12 0.00 0.00 0.00 0.00 19.45 17.01 3gti n ALA 117 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3gti s THR 118 N -0.12 0.61 -0.43 0.00 2.01 -0.03 -1.46 115.64 116.21 3gti s THR 118 Ca 0.66 -0.88 -0.10 0.00 0.31 0.00 0.00 61.69 61.67 3gti s THR 118 Cb -0.58 -0.62 0.08 0.00 0.01 0.00 0.00 72.50 71.38 3gti s THR 118 CO 0.50 -0.21 0.29 -0.76 -0.69 0.00 0.00 174.62 173.76 3gti s LEU 119 N -1.19 5.27 0.00 4.42 1.43 -0.60 -4.85 118.68 123.16 3gti s LEU 119 Ca -0.05 -1.50 0.14 0.00 -1.03 0.00 0.00 54.13 51.68 3gti s LEU 119 Cb -0.08 -2.02 0.74 0.00 0.03 0.00 0.00 46.19 44.85 3gti s LEU 119 CO 0.00 -0.57 1.31 -0.81 0.23 0.00 0.00 176.35 176.51 3gti n PRO 120 N 4.97 0.29 -3.15 1.29 -0.04 -1.26 -1.11 135.00 135.99 3gti n PRO 120 Ca -0.10 0.09 0.04 0.00 -0.04 0.00 0.00 63.50 63.49 3gti n PRO 120 Cb 0.43 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.39 3gti n PRO 120 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3gti s HIS 121 N -2.34 -1.57 0.29 0.54 5.65 -1.24 -4.64 115.29 111.99 3gti s HIS 121 Ca 0.16 0.99 -0.01 0.00 0.25 0.00 0.00 55.06 56.45 3gti s HIS 121 Cb 0.09 0.30 -0.02 0.00 -1.18 0.00 0.00 32.58 31.77 3gti s HIS 121 CO 0.19 -0.91 0.35 -1.21 -0.65 0.00 0.00 174.74 172.50 3gti s GLU 122 N 2.86 1.66 -0.24 2.88 0.41 -0.61 -1.34 118.70 124.32 3gti s GLU 122 Ca 0.14 -1.73 -0.04 0.00 -0.41 0.00 0.00 54.97 52.93 3gti s GLU 122 Cb -0.09 0.38 0.09 0.00 -1.78 0.00 0.00 34.13 32.73 3gti s GLU 122 CO -0.25 -0.64 0.16 -1.01 -0.49 0.00 0.00 175.26 173.03 3gti s HIS 123 N -3.54 0.06 0.16 1.61 3.76 -0.29 -1.21 115.29 115.85 3gti s HIS 123 Ca 0.34 -0.41 -0.16 0.00 -0.15 0.00 0.00 55.06 54.68 3gti s HIS 123 Cb 0.02 -0.68 0.06 0.00 1.11 0.00 0.00 32.58 33.09 3gti s HIS 123 CO 0.19 -0.71 1.77 0.28 -0.85 0.00 0.00 174.74 175.42 3gti h VAL 124 N 6.37 0.94 -3.93 -0.90 2.07 -1.95 -1.44 116.25 117.42 3gti h VAL 124 Ca -0.17 -0.12 -0.20 0.00 0.82 0.00 0.00 66.70 67.03 3gti h VAL 124 Cb 1.09 0.57 -0.23 0.00 -1.52 0.00 0.00 31.29 31.20 3gti h VAL 124 CO 0.35 0.06 -0.71 0.27 0.02 0.00 0.00 177.57 177.56 3gti s ILE 125 N -6.15 0.16 0.09 4.57 -4.36 -1.26 -1.90 121.20 112.35 3gti s ILE 125 Ca -0.13 -0.74 -0.14 0.00 -0.26 0.00 0.00 60.65 59.38 3gti s ILE 125 Cb 0.12 -0.27 0.02 0.00 1.25 0.00 0.00 42.46 43.58 3gti s ILE 125 CO 0.72 -0.37 0.32 0.12 0.24 0.00 0.00 174.94 175.97 3gti s PHE 126 N -1.13 -0.08 -0.29 1.37 2.19 -1.13 -4.79 117.98 114.12 3gti s PHE 126 Ca -0.12 -0.22 -0.15 0.00 0.33 0.00 0.00 56.93 56.78 3gti s PHE 126 Cb -0.08 0.13 0.11 0.00 -1.31 0.00 0.00 43.02 41.87 3gti s PHE 126 CO -0.01 -0.61 0.76 0.20 1.83 0.00 0.00 175.22 177.39 3gti s GLY 127 N -2.63 -0.50 0.41 13.12 0.00 -0.74 0.10 107.32 117.08 3gti s GLY 127 Ca 0.02 2.60 -0.26 0.00 0.00 0.00 0.00 44.72 47.08 3gti s GLY 127 CO -0.10 2.59 1.28 -0.19 0.00 0.00 0.00 173.10 176.69 3gti s TYR 128 N 1.82 2.84 -0.17 1.90 4.12 -1.26 -4.13 117.35 122.47 3gti s TYR 128 Ca -0.09 1.43 -0.38 0.00 0.02 0.00 0.00 57.07 58.06 3gti s TYR 128 Cb -0.06 -3.63 -0.15 0.00 -1.52 0.00 0.00 41.96 36.61 3gti s TYR 128 CO -0.19 -1.99 1.74 -2.30 0.02 0.00 0.00 175.55 172.84 3gti n PRO 129 N 0.08 1.50 0.00 -1.71 -0.02 -1.26 -1.27 135.00 132.32 3gti n PRO 129 Ca 0.04 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 3gti n PRO 129 Cb 0.44 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 3gti n PRO 129 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gti n GLY 130 N 4.06 1.63 0.30 -1.23 0.00 -1.26 -4.98 105.19 103.72 3gti n GLY 130 Ca 0.24 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.30 3gti n GLY 130 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3gti h TYR 131 N 0.00 0.50 0.00 1.61 -0.00 -1.51 0.17 116.97 117.74 3gti h TYR 131 Ca 0.00 0.01 -0.03 0.00 -0.00 0.00 0.00 58.73 58.71 3gti h TYR 131 Cb 0.00 -0.17 -0.00 0.00 -0.00 0.00 0.00 36.73 36.56 3gti h TYR 131 CO 0.00 0.33 -0.13 0.00 -0.00 0.00 0.00 178.16 178.36 3gti h ALA 132 N 1.74 1.22 0.00 0.10 0.00 -1.94 -1.27 119.26 119.11 3gti h ALA 132 Ca 0.14 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3gti h ALA 132 Cb -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3gti h ALA 132 CO -0.03 0.16 0.00 0.41 0.00 0.00 0.00 179.25 179.79 3gti n GLY 133 N -0.55 -1.20 1.22 0.00 0.00 0.60 -2.64 105.19 102.63 3gti n GLY 133 Ca -0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 46.02 45.86 3gti n GLY 133 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3gti n ASP 134 N -1.30 3.26 -0.33 1.61 2.03 -0.48 -4.74 116.55 116.60 3gti n ASP 134 Ca 0.12 -3.45 0.08 0.00 0.52 0.00 0.00 54.79 52.06 3gti n ASP 134 Cb 0.22 -0.63 0.27 0.00 -0.72 0.00 0.00 41.12 40.27 3gti n ASP 134 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 3gti h VAL 135 N 1.41 0.93 -0.25 5.18 3.04 -1.57 0.49 116.25 125.48 3gti h VAL 135 Ca 0.18 -0.32 0.00 0.00 -1.01 0.00 0.00 66.70 65.56 3gti h VAL 135 Cb 1.74 -0.08 -0.01 0.00 -2.01 0.00 0.00 31.29 30.93 3gti h VAL 135 CO 0.42 0.17 0.17 0.74 -1.01 0.00 0.00 177.57 178.06 3gti h THR 136 N 0.93 1.06 0.00 3.17 2.02 -1.88 -2.76 112.91 115.45 3gti h THR 136 Ca 0.46 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.53 3gti h THR 136 Cb 0.49 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 3gti h THR 136 CO -0.23 0.06 -1.21 0.18 0.37 0.00 0.00 175.52 174.70 3gti n LEU 137 N -4.91 0.78 -2.76 2.58 4.77 -1.09 -4.52 117.00 111.85 3gti n LEU 137 Ca -0.02 -0.39 -0.22 0.00 -0.03 0.00 0.00 56.01 55.35 3gti n LEU 137 Cb 0.03 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.11 3gti n LEU 137 CO 0.34 0.20 0.05 0.61 -1.33 0.00 0.00 177.39 177.25 3gti n GLY 138 N 1.45 4.60 3.78 -0.72 0.00 0.17 -4.76 105.19 109.71 3gti n GLY 138 Ca 0.02 -2.30 -0.33 0.00 0.00 0.00 0.00 46.02 43.41 3gti n GLY 138 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3gti s PRO 139 N -3.26 3.18 -0.09 1.61 0.04 -1.04 -3.39 135.00 132.04 3gti s PRO 139 Ca 0.43 1.37 -0.30 0.00 0.04 0.00 0.00 61.00 62.54 3gti s PRO 139 Cb 0.37 -2.00 -0.02 0.00 0.04 0.00 0.00 34.50 32.89 3gti s PRO 139 CO -0.11 -0.94 1.13 0.12 0.04 0.00 0.00 177.00 177.23 3gti s PHE 140 N -2.24 3.29 -0.74 0.56 5.99 -1.26 -4.81 117.98 118.77 3gti s PHE 140 Ca 0.67 1.35 -0.13 0.00 0.00 0.00 0.00 56.93 58.82 3gti s PHE 140 Cb -0.19 -3.34 0.19 0.00 0.00 0.00 0.00 43.02 39.68 3gti s PHE 140 CO 0.35 -0.91 0.67 0.34 -0.00 0.00 0.00 175.22 175.67 3gti s ASP 141 N 1.36 6.48 0.13 6.13 -1.08 -1.26 -4.95 116.67 123.48 3gti s ASP 141 Ca 0.52 -2.50 -0.25 0.00 -0.52 0.00 0.00 52.55 49.80 3gti s ASP 141 Cb -0.21 -2.17 -0.03 0.00 -1.46 0.00 0.00 42.92 39.04 3gti s ASP 141 CO 0.19 -0.61 1.64 -0.74 0.52 0.00 0.00 175.17 176.16 3gti h HIS 142 N 7.95 -0.65 -0.09 -5.34 -0.00 -1.98 0.92 115.15 115.97 3gti h HIS 142 Ca 0.01 0.03 0.04 0.00 -0.00 0.00 0.00 60.37 60.44 3gti h HIS 142 Cb 1.05 0.29 -0.04 0.00 -0.00 0.00 0.00 27.41 28.71 3gti h HIS 142 CO 0.93 -0.33 -0.17 0.00 -0.00 0.00 0.00 177.93 178.37 3gti h ALA 143 N 0.55 -0.13 -0.81 5.26 0.00 -1.98 0.69 119.26 122.83 3gti h ALA 143 Ca 0.08 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 3gti h ALA 143 Cb 0.46 0.33 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 3gti h ALA 143 CO -0.26 -0.63 0.42 0.00 0.00 0.00 0.00 179.25 178.78 3gti h ALA 144 N 0.77 1.22 -0.06 0.00 0.00 -1.95 -1.55 119.26 117.68 3gti h ALA 144 Ca 0.08 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 3gti h ALA 144 Cb 0.35 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3gti h ALA 144 CO -0.23 0.62 -0.12 0.00 0.00 0.00 0.00 179.25 179.52 3gti h ALA 145 N 1.32 0.10 -0.08 0.00 0.00 -0.29 -1.48 119.26 118.84 3gti h ALA 145 Ca 0.28 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 3gti h ALA 145 Cb 0.06 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3gti h ALA 145 CO -0.04 -0.02 -0.06 1.25 0.00 0.00 0.00 179.25 180.37 3gti h LEU 146 N -0.30 0.10 0.14 0.00 5.85 0.47 -0.18 115.31 121.40 3gti h LEU 146 Ca 0.00 -0.01 -0.30 0.00 0.84 0.00 0.00 57.88 58.41 3gti h LEU 146 Cb 0.70 -0.03 0.03 0.00 0.37 0.00 0.00 40.66 41.73 3gti h LEU 146 CO 0.03 0.18 -1.29 0.00 -0.34 0.00 0.00 178.44 177.02 3gti h ALA 147 N 1.83 -0.02 -0.10 1.25 0.00 -1.25 -2.76 119.26 118.21 3gti h ALA 147 Ca 0.03 -0.79 -0.02 0.00 0.00 0.00 0.00 54.91 54.12 3gti h ALA 147 Cb 0.19 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 3gti h ALA 147 CO 0.01 0.71 -0.01 1.03 0.00 0.00 0.00 179.25 180.99 3gti h SER 148 N 0.24 0.18 -0.60 0.00 0.87 -0.96 -2.35 113.55 110.94 3gti h SER 148 Ca -0.20 -0.35 -0.07 0.00 -1.23 0.00 0.00 61.79 59.95 3gti h SER 148 Cb 1.96 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 63.85 3gti h SER 148 CO 0.24 0.48 0.12 0.00 -0.53 0.00 0.00 176.83 177.14 3gti h THR 150 N 0.90 1.24 0.56 0.00 1.35 -1.54 0.23 112.91 115.64 3gti h THR 150 Ca 0.19 -1.12 -0.03 0.00 -0.55 0.00 0.00 66.41 64.89 3gti h THR 150 Cb 0.40 1.31 0.01 0.00 -1.73 0.00 0.00 68.15 68.14 3gti h THR 150 CO 0.01 0.35 -0.27 -0.08 -0.25 0.00 0.00 175.52 175.28 3gti h GLU 151 N 0.35 -0.73 -0.44 4.72 4.81 -0.88 0.76 114.58 123.18 3gti h GLU 151 Ca 0.06 0.05 0.06 0.00 -0.13 0.00 0.00 59.36 59.40 3gti h GLU 151 Cb 0.57 0.17 -0.06 0.00 0.63 0.00 0.00 28.75 30.06 3gti h GLU 151 CO 0.04 -0.47 0.12 1.15 -0.73 0.00 0.00 179.01 179.11 3gti h THR 152 N -0.78 0.81 -0.34 0.32 2.02 -0.84 -2.17 112.91 111.93 3gti h THR 152 Ca -0.08 -0.09 0.07 0.00 0.77 0.00 0.00 66.41 67.09 3gti h THR 152 Cb 0.59 0.52 -0.07 0.00 -1.74 0.00 0.00 68.15 67.45 3gti h THR 152 CO 0.13 0.05 -0.17 0.00 0.37 0.00 0.00 175.52 175.90 3gti h ALA 153 N 1.31 0.09 -0.24 6.16 0.00 -0.22 -1.16 119.26 125.20 3gti h ALA 153 Ca 0.21 0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.31 3gti h ALA 153 Cb 0.24 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3gti h ALA 153 CO -0.25 -0.55 0.17 0.00 0.00 0.00 0.00 179.25 178.62 3gti h ARG 154 N -0.11 0.03 -0.03 0.00 3.08 -0.25 -0.52 114.38 116.57 3gti h ARG 154 Ca 0.17 -0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.10 3gti h ARG 154 Cb 0.38 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 3gti h ARG 154 CO -0.41 0.02 -0.55 0.00 -1.07 0.00 0.00 179.97 177.96 3gti h ALA 155 N 1.88 1.02 -0.04 0.04 0.00 -0.66 -1.45 119.26 120.04 3gti h ALA 155 Ca 0.11 -0.51 -0.07 0.00 0.00 0.00 0.00 54.91 54.45 3gti h ALA 155 Cb 0.42 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3gti h ALA 155 CO -0.01 0.69 -0.25 -0.07 0.00 0.00 0.00 179.25 179.62 3gti h LEU 156 N 0.07 0.28 -1.36 0.00 3.38 -0.69 -2.99 115.31 114.00 3gti h LEU 156 Ca -0.00 -0.69 0.05 0.00 0.09 0.00 0.00 57.88 57.33 3gti h LEU 156 Cb 1.00 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.62 3gti h LEU 156 CO 0.08 0.92 0.47 -0.07 0.09 0.00 0.00 178.44 179.93 3gti h LEU 157 N -0.34 0.70 -1.99 1.67 3.38 -1.28 0.25 115.31 117.70 3gti h LEU 157 Ca -0.02 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 3gti h LEU 157 Cb 0.93 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.52 3gti h LEU 157 CO 0.05 0.47 -0.10 0.00 0.09 0.00 0.00 178.44 178.95 3gti h ALA 158 N 1.60 1.39 -0.56 1.53 0.00 -1.22 -1.39 119.26 120.60 3gti h ALA 158 Ca 0.30 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3gti h ALA 158 Cb 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3gti h ALA 158 CO -0.09 0.13 0.00 0.54 0.00 0.00 0.00 179.25 179.83 3gti n ARG 159 N -3.77 4.78 -0.01 0.00 1.74 0.81 -4.92 116.66 115.29 3gti n ARG 159 Ca -0.02 -3.06 0.00 0.00 -0.77 0.00 0.00 57.85 54.00 3gti n ARG 159 Cb 0.21 -2.24 0.00 0.00 -1.02 0.00 0.00 32.46 29.40 3gti n ARG 159 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gti n GLY 160 N 0.62 2.67 3.62 -0.13 0.00 -0.53 -4.98 105.19 106.47 3gti n GLY 160 Ca 0.27 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.86 3gti n GLY 160 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gti s ILE 161 N -2.91 3.91 -0.40 -0.61 1.01 -0.72 -4.23 121.20 117.26 3gti s ILE 161 Ca 0.00 0.99 0.22 0.00 0.00 0.00 0.00 60.65 61.86 3gti s ILE 161 Cb 0.00 -4.04 -0.23 0.00 0.01 0.00 0.00 42.46 38.20 3gti s ILE 161 CO 0.00 -0.53 0.76 0.00 0.00 0.00 0.00 174.94 175.17 3gti n GLN 162 N 7.74 0.42 -3.88 2.79 6.02 -0.54 -3.32 117.38 126.61 3gti n GLN 162 Ca 0.17 -0.08 -0.12 0.00 -0.01 0.00 0.00 57.00 56.96 3gti n GLN 162 Cb 0.47 -1.56 -0.13 0.00 1.02 0.00 0.00 30.24 30.03 3gti n GLN 162 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3gti s THR 163 N -3.32 0.02 -0.02 5.09 2.01 -1.00 -1.79 115.64 116.63 3gti s THR 163 Ca -0.01 -0.14 0.04 0.00 0.31 0.00 0.00 61.69 61.89 3gti s THR 163 Cb 0.14 -0.07 -0.01 0.00 0.01 0.00 0.00 72.50 72.57 3gti s THR 163 CO 0.86 -0.07 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.91 3gti s VAL 164 N -0.21 0.97 -0.32 3.82 1.01 -0.18 -1.55 120.40 123.93 3gti s VAL 164 Ca -0.02 -0.51 -0.11 0.00 0.00 0.00 0.00 61.98 61.34 3gti s VAL 164 Cb -0.02 -0.83 -0.01 0.00 0.00 0.00 0.00 36.38 35.53 3gti s VAL 164 CO -0.00 0.28 0.18 -0.69 0.00 0.00 0.00 175.10 174.87 3gti s VAL 165 N -0.14 4.77 -0.24 2.92 1.01 -0.26 -1.79 120.40 126.67 3gti s VAL 165 Ca 0.02 -0.40 -0.23 0.00 0.00 0.00 0.00 61.98 61.37 3gti s VAL 165 Cb -0.06 -3.45 -0.01 0.00 0.00 0.00 0.00 36.38 32.85 3gti s VAL 165 CO -0.00 0.03 0.76 -0.62 0.00 0.00 0.00 175.10 175.27 3gti s ASP 166 N 1.64 6.75 -0.28 3.32 3.68 0.73 -1.57 116.67 130.94 3gti s ASP 166 Ca 0.05 0.93 0.12 0.00 2.13 0.00 0.00 52.55 55.78 3gti s ASP 166 Cb -0.17 -2.40 0.78 0.00 -1.45 0.00 0.00 42.92 39.68 3gti s ASP 166 CO 0.07 -0.46 1.77 0.00 0.13 0.00 0.00 175.17 176.68 3gti n ALA 167 N 5.87 4.20 -2.08 3.66 0.00 -0.35 -2.65 120.51 129.17 3gti n ALA 167 Ca 0.03 -2.15 -0.43 0.00 0.00 0.00 0.00 53.44 50.90 3gti n ALA 167 Cb 0.48 -1.17 -0.03 0.00 0.00 0.00 0.00 19.45 18.74 3gti n ALA 167 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3gti s THR 168 N -2.89 3.66 0.74 0.00 2.01 -1.26 -4.90 115.64 113.01 3gti s THR 168 Ca 0.55 0.77 -0.15 0.00 0.31 0.00 0.00 61.69 63.17 3gti s THR 168 Cb 0.43 -3.61 0.05 0.00 0.01 0.00 0.00 72.50 69.37 3gti s THR 168 CO 0.15 -0.20 1.24 -2.84 -0.69 0.00 0.00 174.62 172.28 3gti s PRO 169 N 4.45 1.99 0.44 4.92 0.02 -1.26 -4.54 135.00 141.02 3gti s PRO 169 Ca 0.72 1.88 0.22 0.00 0.02 0.00 0.00 61.00 63.84 3gti s PRO 169 Cb -0.28 -1.80 1.19 0.00 0.02 0.00 0.00 34.50 33.63 3gti s PRO 169 CO 0.29 -1.98 1.83 -0.91 -0.33 0.00 0.00 177.00 175.89 3gti h ASN 170 N -0.34 0.32 0.78 2.53 4.21 -0.46 -0.45 115.58 122.18 3gti h ASN 170 Ca -0.48 0.05 0.00 0.00 1.21 0.00 0.00 56.30 57.08 3gti h ASN 170 Cb 1.31 -0.01 0.00 0.00 -1.12 0.00 0.00 38.32 38.50 3gti h ASN 170 CO 0.49 0.10 -0.64 0.61 -1.29 0.00 0.00 177.43 176.69 3gti n GLY 171 N -1.55 -1.38 1.74 2.83 0.00 -1.26 -4.34 105.19 101.23 3gti n GLY 171 Ca 0.22 -0.27 -0.14 0.00 0.00 0.00 0.00 46.02 45.82 3gti n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gti n GLY 173 N -0.47 0.62 3.64 0.00 0.00 -1.26 -1.80 105.19 105.93 3gti n GLY 173 Ca 0.36 0.00 -0.59 0.00 0.00 0.00 0.00 46.02 45.78 3gti n GLY 173 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3gti n ARG 174 N -2.02 0.57 -3.49 1.61 0.63 -1.24 -4.88 116.66 107.84 3gti n ARG 174 Ca 0.00 0.21 -0.29 0.00 -0.92 0.00 0.00 57.85 56.85 3gti n ARG 174 Cb 0.00 -1.79 -0.12 0.00 0.45 0.00 0.00 32.46 31.01 3gti n ARG 174 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 3gti s ASN 175 N 1.82 2.78 0.13 6.15 3.84 -1.26 -5.02 114.94 123.38 3gti s ASN 175 Ca 0.95 -2.44 -0.19 0.00 0.21 0.00 0.00 52.86 51.39 3gti s ASN 175 Cb -1.21 -0.50 -0.02 0.00 -0.55 0.00 0.00 41.25 38.97 3gti s ASN 175 CO 0.63 -0.27 1.73 -0.65 -2.79 0.00 0.00 177.10 175.75 3gti h PRO 176 N 6.69 0.10 -0.62 0.43 0.11 -1.98 -1.62 132.00 135.10 3gti h PRO 176 Ca 0.09 -0.01 0.11 0.00 0.11 0.00 0.00 66.00 66.31 3gti h PRO 176 Cb 0.95 -0.02 -0.08 0.00 0.11 0.00 0.00 31.00 31.95 3gti h PRO 176 CO 0.32 0.06 0.17 0.00 -0.21 0.00 0.00 178.00 178.34 3gti h ALA 177 N 1.17 0.78 0.04 -0.75 0.00 -1.95 0.27 119.26 118.81 3gti h ALA 177 Ca 0.10 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 3gti h ALA 177 Cb 0.11 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3gti h ALA 177 CO -0.15 -0.27 -0.02 0.35 0.00 0.00 0.00 179.25 179.16 3gti h PHE 178 N 0.31 -0.05 -0.75 0.00 3.57 -1.95 -1.44 116.94 116.63 3gti h PHE 178 Ca 0.33 -0.00 0.17 0.00 3.53 0.00 0.00 57.97 61.99 3gti h PHE 178 Cb 0.48 0.02 -0.11 0.00 2.79 0.00 0.00 35.95 39.12 3gti h PHE 178 CO -0.22 0.13 0.17 -0.07 -2.23 0.00 0.00 178.31 176.10 3gti h LEU 179 N -0.23 -0.01 -1.46 0.59 4.07 -0.30 0.71 115.31 118.68 3gti h LEU 179 Ca -0.01 0.15 -0.03 0.00 0.08 0.00 0.00 57.88 58.08 3gti h LEU 179 Cb 0.21 0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 3gti h LEU 179 CO 0.01 -0.05 0.01 -0.09 -1.08 0.00 0.00 178.44 177.24 3gti h ARG 180 N 0.26 0.36 -0.04 1.13 2.43 -0.16 -0.43 114.38 117.93 3gti h ARG 180 Ca 0.43 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.54 3gti h ARG 180 Cb 0.74 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.23 3gti h ARG 180 CO -0.53 0.38 0.02 0.93 -1.51 0.00 0.00 179.97 179.26 3gti h GLU 181 N 0.36 0.06 -0.86 0.20 5.08 0.14 0.99 114.58 120.55 3gti h GLU 181 Ca 0.08 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3gti h GLU 181 Cb 0.22 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.42 3gti h GLU 181 CO 0.00 0.17 0.54 0.28 -1.00 0.00 0.00 179.01 179.01 3gti h VAL 182 N -0.06 1.23 -0.11 3.13 2.07 -0.43 -0.72 116.25 121.37 3gti h VAL 182 Ca 0.02 -0.48 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 3gti h VAL 182 Cb 0.13 -0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.89 3gti h VAL 182 CO -0.00 0.24 0.01 -1.28 0.02 0.00 0.00 177.57 176.56 3gti h SER 183 N 1.18 0.17 0.28 0.57 0.87 -0.89 -2.66 113.55 113.08 3gti h SER 183 Ca 0.31 -0.27 -0.05 0.00 -1.23 0.00 0.00 61.79 60.55 3gti h SER 183 Cb -0.08 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 3gti h SER 183 CO -0.06 0.40 -0.23 -0.33 -0.53 0.00 0.00 176.83 176.08 3gti h GLU 184 N -0.06 0.00 0.04 2.24 5.08 -0.61 0.16 114.58 121.44 3gti h GLU 184 Ca 0.03 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.15 3gti h GLU 184 Cb 0.30 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.56 3gti h GLU 184 CO 0.00 0.23 -1.03 0.00 -1.00 0.00 0.00 179.01 177.21 3gti h ALA 185 N 1.77 0.27 0.00 3.43 0.00 -1.06 -3.39 119.26 120.28 3gti h ALA 185 Ca -0.00 -0.75 -0.31 0.00 0.00 0.00 0.00 54.91 53.85 3gti h ALA 185 Cb 0.43 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 3gti h ALA 185 CO 0.03 0.83 -2.17 0.25 0.00 0.00 0.00 179.25 178.19 3gti n THR 186 N -3.71 1.17 0.00 0.00 -2.24 -1.01 -5.00 114.28 103.49 3gti n THR 186 Ca -0.08 -0.56 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 3gti n THR 186 Cb 0.89 -0.96 0.00 0.00 -2.10 0.00 0.00 70.33 68.15 3gti n THR 186 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gti n GLY 187 N 2.29 0.69 3.74 3.38 0.00 0.56 -4.98 105.19 110.87 3gti n GLY 187 Ca -0.33 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.28 3gti n GLY 187 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3gti s LEU 188 N 0.00 4.48 -0.07 0.99 2.96 -1.23 -5.00 118.68 120.81 3gti s LEU 188 Ca 0.00 2.16 -0.16 0.00 -0.22 0.00 0.00 54.13 55.91 3gti s LEU 188 Cb 0.00 -3.61 -0.05 0.00 0.50 0.00 0.00 46.19 43.03 3gti s LEU 188 CO 0.00 -0.27 0.43 -1.10 -1.32 0.00 0.00 176.35 174.10 3gti s GLN 189 N -0.47 4.16 -0.03 1.98 -0.21 -0.74 -4.41 119.66 119.96 3gti s GLN 189 Ca 0.50 0.41 0.02 0.00 0.02 0.00 0.00 55.36 56.31 3gti s GLN 189 Cb -0.31 -3.34 0.00 0.00 1.00 0.00 0.00 33.01 30.36 3gti s GLN 189 CO 0.36 0.39 -0.09 0.42 -2.12 0.00 0.00 175.29 174.26 3gti s ILE 190 N -0.13 0.78 0.16 1.08 1.01 -1.26 -1.02 121.20 121.83 3gti s ILE 190 Ca 0.24 -0.36 0.07 0.00 0.00 0.00 0.00 60.65 60.61 3gti s ILE 190 Cb -0.16 -0.70 -0.04 0.00 0.01 0.00 0.00 42.46 41.57 3gti s ILE 190 CO 0.11 0.25 -0.02 -0.76 0.00 0.00 0.00 174.94 174.52 3gti s LEU 191 N 0.22 3.27 0.31 2.97 1.02 -0.74 -0.35 118.68 125.38 3gti s LEU 191 Ca -0.04 -0.39 0.07 0.00 0.02 0.00 0.00 54.13 53.80 3gti s LEU 191 Cb -0.09 -1.95 -0.06 0.00 0.02 0.00 0.00 46.19 44.11 3gti s LEU 191 CO 0.01 0.11 -0.05 0.00 0.02 0.00 0.00 176.35 176.43 3gti n ALA 193 N -0.68 0.78 -3.72 0.00 0.00 -1.08 -0.49 120.51 115.32 3gti n ALA 193 Ca -0.05 -1.47 -0.12 0.00 0.00 0.00 0.00 53.44 51.80 3gti n ALA 193 Cb 0.64 0.46 -0.13 0.00 0.00 0.00 0.00 19.45 20.42 3gti n ALA 193 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3gti s THR 194 N -1.59 -0.04 0.00 0.00 -1.32 -0.92 -4.80 115.64 106.98 3gti s THR 194 Ca 0.37 0.14 0.00 0.00 -1.21 0.00 0.00 61.69 60.99 3gti s THR 194 Cb -0.03 -0.40 0.00 0.00 -1.51 0.00 0.00 72.50 70.56 3gti s THR 194 CO 0.23 0.06 0.00 0.61 -2.21 0.00 0.00 174.62 173.31 3gti n GLY 195 N 4.22 3.56 3.72 6.08 0.00 -1.26 -4.43 105.19 117.08 3gti n GLY 195 Ca -0.25 -1.63 -0.23 0.00 0.00 0.00 0.00 46.02 43.91 3gti n GLY 195 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gti s PHE 196 N -2.00 2.67 0.80 1.61 0.40 -1.26 0.34 117.98 120.54 3gti s PHE 196 Ca 0.00 -0.41 -0.10 0.00 -0.60 0.00 0.00 56.93 55.82 3gti s PHE 196 Cb 0.00 -1.64 0.10 0.00 0.51 0.00 0.00 43.02 41.99 3gti s PHE 196 CO 0.00 0.35 1.13 -0.47 0.70 0.00 0.00 175.22 176.93 3gti s TYR 197 N -2.46 2.54 0.83 0.36 5.04 -1.26 -4.32 117.35 118.08 3gti s TYR 197 Ca 0.38 0.46 -0.13 0.00 -2.44 0.00 0.00 57.07 55.34 3gti s TYR 197 Cb -0.01 -3.48 0.09 0.00 0.35 0.00 0.00 41.96 38.90 3gti s TYR 197 CO 0.22 -1.82 1.14 2.48 -1.34 0.00 0.00 175.55 176.22 3gti n TYR 198 N -3.23 1.03 -0.31 4.97 0.18 -1.26 -4.44 117.16 114.09 3gti n TYR 198 Ca 0.10 0.40 0.13 0.00 1.88 0.00 0.00 57.90 60.40 3gti n TYR 198 Cb 0.60 -2.07 0.27 0.00 -0.38 0.00 0.00 39.34 37.76 3gti n TYR 198 CO 0.00 0.00 0.00 1.49 -2.08 0.00 0.00 176.86 176.27 3gti h GLU 199 N -1.05 0.07 0.00 -3.48 4.81 -1.90 -1.49 114.58 111.55 3gti h GLU 199 Ca -0.46 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 3gti h GLU 199 Cb 1.30 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.66 3gti h GLU 199 CO 0.45 0.05 0.00 0.41 -0.73 0.00 0.00 179.01 179.18 3gti n GLY 200 N -1.45 -1.60 0.00 1.92 0.00 -1.26 -4.08 105.19 98.72 3gti n GLY 200 Ca 0.21 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.18 3gti n GLY 200 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gti n GLY 201 N 1.34 -0.47 3.98 -0.02 0.00 -0.75 -5.07 105.19 104.20 3gti n GLY 201 Ca 0.06 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.87 3gti n GLY 201 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gti s GLY 202 N -0.07 1.96 -1.30 -0.02 0.00 -0.63 -4.37 107.32 102.89 3gti s GLY 202 Ca 0.00 -1.84 -0.12 0.00 0.00 0.00 0.00 44.72 42.76 3gti s GLY 202 CO 0.00 -1.73 1.85 0.00 0.00 0.00 0.00 173.10 173.22 3gti n ALA 203 N -2.01 5.00 1.10 3.20 0.00 -1.26 -4.79 120.51 121.75 3gti n ALA 203 Ca 0.09 -4.19 0.13 0.00 0.00 0.00 0.00 53.44 49.48 3gti n ALA 203 Cb 0.62 -3.14 0.48 0.00 0.00 0.00 0.00 19.45 17.40 3gti n ALA 203 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3gti n THR 204 N 4.11 0.00 -0.01 0.00 -2.24 -1.26 -4.28 114.28 110.59 3gti n THR 204 Ca 0.42 -0.02 -0.11 0.00 -2.27 0.00 0.00 64.05 62.08 3gti n THR 204 Cb 0.39 -0.11 -0.05 0.00 -2.10 0.00 0.00 70.33 68.46 3gti n THR 204 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3gti h THR 205 N 0.15 1.01 0.00 4.28 2.02 -1.94 -1.93 112.91 116.50 3gti h THR 205 Ca 0.00 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.13 3gti h THR 205 Cb 0.47 0.84 0.00 0.00 -1.74 0.00 0.00 68.15 67.72 3gti h THR 205 CO 0.00 0.03 0.00 0.00 0.37 0.00 0.00 175.52 175.92 3gti n TYR 206 N -5.02 0.00 0.19 3.16 9.36 -1.26 -0.68 117.16 122.92 3gti n TYR 206 Ca -0.04 0.00 0.06 0.00 3.32 0.00 0.00 57.90 61.23 3gti n TYR 206 Cb 0.04 -0.41 0.38 0.00 -0.63 0.00 0.00 39.34 38.71 3gti n TYR 206 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 3gti h PHE 207 N 0.00 0.00 -0.20 2.98 -1.00 -1.84 -0.51 116.94 116.36 3gti h PHE 207 Ca 0.00 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.74 3gti h PHE 207 Cb 0.00 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.55 3gti h PHE 207 CO -0.59 0.36 -0.06 -0.22 -1.61 0.00 0.00 178.31 176.19 3gti h LYS 208 N 0.00 0.31 0.02 1.51 3.64 -1.10 0.14 116.57 121.10 3gti h LYS 208 Ca -0.00 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3gti h LYS 208 Cb 0.80 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 3gti h LYS 208 CO 0.05 0.39 -0.01 0.35 -2.27 0.00 0.00 179.45 177.96 3gti h PHE 209 N 0.30 -0.03 -0.35 1.91 3.57 -0.35 -3.21 116.94 118.79 3gti h PHE 209 Ca 0.07 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.63 3gti h PHE 209 Cb 0.31 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 3gti h PHE 209 CO 0.01 0.71 0.24 0.00 -2.23 0.00 0.00 178.31 177.03 3gti h ARG 210 N -0.86 0.17 -0.81 1.11 3.08 -0.93 -1.14 114.38 115.01 3gti h ARG 210 Ca -0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3gti h ARG 210 Cb 0.75 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.72 3gti h ARG 210 CO 0.01 0.11 0.52 0.00 -1.07 0.00 0.00 179.97 179.53 3gti h ALA 211 N 1.82 1.03 0.00 0.04 0.00 -0.76 0.76 119.26 122.15 3gti h ALA 211 Ca 0.16 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3gti h ALA 211 Cb 0.41 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3gti h ALA 211 CO -0.02 0.46 -0.20 0.66 0.00 0.00 0.00 179.25 180.15 3gti h SER 212 N 1.10 0.00 0.52 0.00 4.64 -1.21 -3.21 113.55 115.40 3gti h SER 212 Ca 0.29 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.38 3gti h SER 212 Cb -0.09 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 61.96 3gti h SER 212 CO -0.06 0.20 -1.65 0.18 -0.87 0.00 0.00 176.83 174.63 3gti n LEU 213 N -3.56 0.75 0.00 5.97 4.77 -0.58 -5.07 117.00 119.28 3gti n LEU 213 Ca -0.01 0.34 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 3gti n LEU 213 Cb 0.34 0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 3gti n LEU 213 CO 0.32 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 3gti n GLY 214 N 1.49 2.45 3.41 -0.72 0.00 0.16 -5.07 105.19 106.91 3gti n GLY 214 Ca -0.15 -0.49 -0.43 0.00 0.00 0.00 0.00 46.02 44.95 3gti n GLY 214 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3gti n ASP 215 N 0.00 5.00 -0.04 1.61 2.03 -1.26 -4.50 116.55 119.40 3gti n ASP 215 Ca 0.00 -2.96 -0.05 0.00 0.52 0.00 0.00 54.79 52.30 3gti n ASP 215 Cb 0.00 -1.64 0.15 0.00 -0.72 0.00 0.00 41.12 38.91 3gti n ASP 215 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3gti h ALA 216 N 7.11 1.01 -0.50 -1.67 0.00 -1.85 -2.45 119.26 120.91 3gti h ALA 216 Ca 0.40 -0.35 0.07 0.00 0.00 0.00 0.00 54.91 55.03 3gti h ALA 216 Cb 0.83 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.42 3gti h ALA 216 CO 1.41 0.59 0.15 1.49 0.00 0.00 0.00 179.25 182.89 3gti h GLU 217 N 0.55 0.31 -0.69 0.00 4.81 -1.86 0.34 114.58 118.04 3gti h GLU 217 Ca 0.08 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.23 3gti h GLU 217 Cb 0.68 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.96 3gti h GLU 217 CO 0.05 0.20 0.18 1.03 -0.73 0.00 0.00 179.01 179.74 3gti h SER 218 N 0.32 1.04 -0.62 1.04 0.87 -1.87 0.00 113.55 114.33 3gti h SER 218 Ca 0.25 -0.23 -0.01 0.00 -1.23 0.00 0.00 61.79 60.57 3gti h SER 218 Cb 0.29 -0.27 -0.03 0.00 -0.44 0.00 0.00 62.40 61.95 3gti h SER 218 CO -0.27 1.00 0.36 -0.33 -0.53 0.00 0.00 176.83 177.05 3gti h GLU 219 N 1.03 0.85 -0.45 2.24 5.08 -0.63 -1.20 114.58 121.49 3gti h GLU 219 Ca 0.22 -0.09 -0.09 0.00 -1.00 0.00 0.00 59.36 58.40 3gti h GLU 219 Cb 0.36 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 3gti h GLU 219 CO 0.00 0.63 -0.07 0.82 -1.00 0.00 0.00 179.01 179.39 3gti h ILE 220 N 0.84 1.25 -0.69 3.13 2.04 -0.16 -2.21 117.51 121.71 3gti h ILE 220 Ca 0.22 -1.10 -0.03 0.00 1.00 0.00 0.00 64.86 64.94 3gti h ILE 220 Cb 0.01 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 3gti h ILE 220 CO -0.04 0.38 0.30 0.22 0.00 0.00 0.00 178.15 179.01 3gti h TYR 221 N 0.72 1.04 -0.57 1.37 3.20 -0.46 -1.08 116.97 121.19 3gti h TYR 221 Ca 0.13 -0.07 -0.05 0.00 3.14 0.00 0.00 58.73 61.88 3gti h TYR 221 Cb 0.54 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 38.47 3gti h TYR 221 CO 0.03 0.79 0.15 0.93 -1.64 0.00 0.00 178.16 178.42 3gti h GLU 222 N 0.98 0.90 0.08 1.82 5.08 -1.00 0.35 114.58 122.80 3gti h GLU 222 Ca 0.23 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3gti h GLU 222 Cb 0.18 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3gti h GLU 222 CO -0.02 0.83 -0.04 1.98 -1.00 0.00 0.00 179.01 180.76 3gti h MET 223 N 0.81 -0.11 0.15 2.33 4.05 -1.21 -1.47 114.93 119.48 3gti h MET 223 Ca 0.18 0.01 0.01 0.00 -0.28 0.00 0.00 59.70 59.62 3gti h MET 223 Cb 0.33 0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.13 3gti h MET 223 CO -0.00 0.10 -0.19 0.52 0.23 0.00 0.00 176.91 177.57 3gti h MET 224 N -0.30 -0.37 -0.96 0.39 2.86 -1.09 0.18 114.93 115.64 3gti h MET 224 Ca -0.01 0.03 0.09 0.00 -2.06 0.00 0.00 59.70 57.74 3gti h MET 224 Cb 0.25 0.08 -0.07 0.00 0.06 0.00 0.00 31.60 31.93 3gti h MET 224 CO 0.02 -0.25 0.60 -0.09 1.06 0.00 0.00 176.91 178.25 3gti h ARG 225 N -0.39 0.99 -0.06 1.72 2.43 -0.91 -0.86 114.38 117.31 3gti h ARG 225 Ca 0.01 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 3gti h ARG 225 Cb 0.38 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 29.71 3gti h ARG 225 CO -0.08 0.66 -0.03 1.15 -1.51 0.00 0.00 179.97 180.16 3gti h THR 226 N 1.02 1.33 0.00 0.20 2.02 -0.94 -1.72 112.91 114.83 3gti h THR 226 Ca 0.44 -1.06 -0.01 0.00 0.77 0.00 0.00 66.41 66.55 3gti h THR 226 Cb 0.31 1.91 -0.00 0.00 -1.74 0.00 0.00 68.15 68.63 3gti h THR 226 CO -0.22 0.29 -0.05 -0.33 0.37 0.00 0.00 175.52 175.58 3gti h GLU 227 N -0.26 0.00 0.00 6.66 5.08 -0.43 0.35 114.58 125.98 3gti h GLU 227 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3gti h GLU 227 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3gti h GLU 227 CO 0.01 0.05 -1.53 0.28 -1.00 0.00 0.00 179.01 176.82 3gti n VAL 228 N -3.54 0.21 0.05 3.13 0.31 -0.38 0.33 118.33 118.45 3gti n VAL 228 Ca -0.02 -0.46 0.02 0.00 -0.01 0.00 0.00 64.34 63.87 3gti n VAL 228 Cb 0.16 -0.04 -0.03 0.00 -0.91 0.00 0.00 33.84 33.02 3gti n VAL 228 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3gti n THR 229 N -2.32 0.00 0.00 2.52 -2.24 -0.65 -4.62 114.28 106.97 3gti n THR 229 Ca -0.02 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 3gti n THR 229 Cb 0.54 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 69.32 3gti n THR 229 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3gti n GLU 230 N -1.50 0.00 0.00 -0.78 1.02 0.11 -5.06 120.64 114.43 3gti n GLU 230 Ca -0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3gti n GLU 230 Cb 0.10 -0.38 0.00 0.00 -0.02 0.00 0.00 31.44 31.14 3gti n GLU 230 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gti n GLY 231 N 2.63 2.05 3.76 0.62 0.00 -0.46 -4.50 105.19 109.29 3gti n GLY 231 Ca 0.00 -1.53 -0.36 0.00 0.00 0.00 0.00 46.02 44.13 3gti n GLY 231 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gti s ILE 232 N -1.84 4.81 -0.81 -0.61 1.01 0.08 -3.83 121.20 120.00 3gti s ILE 232 Ca 0.00 -0.06 -0.08 0.00 0.00 0.00 0.00 60.65 60.51 3gti s ILE 232 Cb 0.00 -3.06 0.07 0.00 0.01 0.00 0.00 42.46 39.49 3gti s ILE 232 CO 0.00 0.61 0.25 0.00 0.00 0.00 0.00 174.94 175.79 3gti n ALA 233 N 2.10 -1.05 -1.35 9.38 0.00 -1.26 0.61 120.51 128.94 3gti n ALA 233 Ca -0.19 -0.03 -0.12 0.00 0.00 0.00 0.00 53.44 53.10 3gti n ALA 233 Cb 0.54 -1.54 -0.05 0.00 0.00 0.00 0.00 19.45 18.40 3gti n ALA 233 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gti n GLY 234 N -0.80 1.17 0.05 0.00 0.00 -1.26 -4.85 105.19 99.50 3gti n GLY 234 Ca 0.01 -0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.14 3gti n GLY 234 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3gti n THR 235 N -2.26 0.28 -0.11 2.61 -2.24 0.20 -4.90 114.28 107.85 3gti n THR 235 Ca -0.12 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 3gti n THR 235 Cb 0.59 -0.50 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 3gti n THR 235 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gti n GLY 236 N 1.41 1.31 3.60 3.38 0.00 -1.26 -4.97 105.19 108.66 3gti n GLY 236 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 3gti n GLY 236 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gti s ILE 237 N -2.61 4.63 0.35 -0.61 1.01 -1.26 -4.70 121.20 118.01 3gti s ILE 237 Ca 0.00 1.16 -0.06 0.00 0.00 0.00 0.00 60.65 61.75 3gti s ILE 237 Cb 0.00 -4.29 -0.05 0.00 0.01 0.00 0.00 42.46 38.13 3gti s ILE 237 CO 0.00 -0.48 0.64 -0.13 0.00 0.00 0.00 174.94 174.97 3gti s ARG 238 N 3.35 3.64 0.19 2.79 0.52 -1.26 -0.74 118.95 127.44 3gti s ARG 238 Ca 0.36 0.11 -0.22 0.00 -0.52 0.00 0.00 55.73 55.46 3gti s ARG 238 Cb -0.12 -2.55 -0.08 0.00 0.52 0.00 0.00 34.95 32.72 3gti s ARG 238 CO 0.17 0.08 0.73 0.00 0.02 0.00 0.00 175.30 176.31 3gti s ALA 239 N -2.28 3.44 -1.23 2.13 0.00 0.15 -4.64 121.76 119.33 3gti s ALA 239 Ca 0.46 0.22 0.22 0.00 0.00 0.00 0.00 51.96 52.86 3gti s ALA 239 Cb -0.10 -2.85 -0.01 0.00 0.00 0.00 0.00 23.12 20.16 3gti s ALA 239 CO 0.33 0.32 1.06 0.41 0.00 0.00 0.00 175.76 177.88 3gti n GLY 240 N 1.10 -0.84 3.35 0.00 0.00 0.36 -4.56 105.19 104.61 3gti n GLY 240 Ca -0.04 -0.55 -0.11 0.00 0.00 0.00 0.00 46.02 45.31 3gti n GLY 240 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gti s VAL 241 N -2.88 0.04 0.00 1.61 -7.23 -1.18 -4.21 120.40 106.55 3gti s VAL 241 Ca 0.11 -0.37 0.00 0.00 -1.81 0.00 0.00 61.98 59.92 3gti s VAL 241 Cb 0.17 -1.09 0.00 0.00 0.56 0.00 0.00 36.38 36.02 3gti s VAL 241 CO 0.77 -0.20 0.00 -0.38 -0.31 0.00 0.00 175.10 174.98 3gti n ILE 242 N -0.16 0.00 0.00 -0.62 5.41 -0.17 -2.16 119.36 121.65 3gti n ILE 242 Ca -0.17 -0.01 0.00 0.00 1.00 0.00 0.00 62.75 63.57 3gti n ILE 242 Cb 0.64 -0.73 0.00 0.00 -0.71 0.00 0.00 39.64 38.83 3gti n ILE 242 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 3gti n LEU 244 N 0.00 0.00 -3.85 1.39 4.77 -0.71 -1.11 117.00 117.49 3gti n LEU 244 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 3gti n LEU 244 Cb 0.00 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 40.99 3gti n LEU 244 CO 0.00 0.00 -0.17 0.00 -1.33 0.00 0.00 177.39 175.89 3gti s ALA 245 N -2.00 -0.35 0.28 -1.18 0.00 -1.26 0.23 121.76 117.47 3gti s ALA 245 Ca 0.00 0.06 0.03 0.00 0.00 0.00 0.00 51.96 52.05 3gti s ALA 245 Cb 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 23.12 23.05 3gti s ALA 245 CO 0.00 -0.17 0.06 -1.54 0.00 0.00 0.00 175.76 174.11 3gti s SER 246 N -0.90 1.80 0.67 0.00 1.04 -0.91 -4.27 113.70 111.13 3gti s SER 246 Ca -0.10 -1.34 0.00 0.00 0.48 0.00 0.00 55.95 54.99 3gti s SER 246 Cb -0.05 0.03 0.10 0.00 0.10 0.00 0.00 66.02 66.19 3gti s SER 246 CO 0.01 -0.63 0.93 -0.44 0.98 0.00 0.00 173.24 174.09 3gti s SER 247 N -3.38 4.63 0.05 7.02 0.01 -1.13 -3.58 113.70 117.32 3gti s SER 247 Ca 0.35 -0.27 -0.34 0.00 1.31 0.00 0.00 55.95 57.00 3gti s SER 247 Cb 0.08 -0.25 -0.19 0.00 0.21 0.00 0.00 66.02 65.87 3gti s SER 247 CO 0.13 -1.65 1.42 -0.09 0.41 0.00 0.00 173.24 173.47 3gti h ARG 248 N -0.34 -1.16 0.00 12.44 2.43 -1.91 -3.31 114.38 122.53 3gti h ARG 248 Ca -0.38 0.08 0.00 0.00 -0.81 0.00 0.00 59.98 58.87 3gti h ARG 248 Cb 1.28 0.26 0.00 0.00 -0.42 0.00 0.00 29.97 31.09 3gti h ARG 248 CO 0.44 -0.77 0.00 -0.44 -1.51 0.00 0.00 179.97 177.69 3gti h ASP 249 N -1.30 0.00 -5.23 -3.80 3.32 -1.95 -3.41 116.42 104.05 3gti h ASP 249 Ca -0.12 0.00 0.37 0.00 0.02 0.00 0.00 57.03 57.29 3gti h ASP 249 Cb 0.93 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 40.31 3gti h ASP 249 CO 0.20 0.00 0.98 0.00 -1.72 0.00 0.00 179.24 178.70 3gti s ALA 250 N -3.37 -2.38 -0.54 3.45 0.00 -1.25 -5.05 121.76 112.62 3gti s ALA 250 Ca 0.05 1.31 -0.21 0.00 0.00 0.00 0.00 51.96 53.11 3gti s ALA 250 Cb 0.09 -0.00 0.06 0.00 0.00 0.00 0.00 23.12 23.27 3gti s ALA 250 CO 0.53 -0.86 0.76 0.42 0.00 0.00 0.00 175.76 176.60 3gti s ILE 251 N -2.06 4.68 0.96 0.00 1.01 -1.26 -2.82 121.20 121.71 3gti s ILE 251 Ca 0.14 -0.31 -0.11 0.00 0.00 0.00 0.00 60.65 60.36 3gti s ILE 251 Cb 0.04 -4.42 0.17 0.00 0.01 0.00 0.00 42.46 38.25 3gti s ILE 251 CO -0.05 -0.99 1.09 0.42 0.00 0.00 0.00 174.94 175.41 3gti s THR 252 N 3.15 2.39 0.53 2.92 -4.23 -1.26 -4.69 115.64 114.46 3gti s THR 252 Ca 0.20 0.13 0.20 0.00 -1.18 0.00 0.00 61.69 61.03 3gti s THR 252 Cb -0.18 -2.37 0.29 0.00 1.34 0.00 0.00 72.50 71.58 3gti s THR 252 CO 0.13 -0.16 2.17 -0.65 -0.54 0.00 0.00 174.62 175.57 3gti h PRO 253 N -1.88 0.00 0.01 3.99 0.11 -1.98 0.32 132.00 132.56 3gti h PRO 253 Ca -0.50 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.49 3gti h PRO 253 Cb 1.29 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.41 3gti h PRO 253 CO 0.50 0.01 -0.46 -0.92 -0.21 0.00 0.00 178.00 176.91 3gti h TYR 254 N 0.00 0.45 -0.29 0.65 3.20 -2.01 -3.05 116.97 115.91 3gti h TYR 254 Ca -0.00 -0.25 -0.04 0.00 3.14 0.00 0.00 58.73 61.58 3gti h TYR 254 Cb 0.02 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.22 3gti h TYR 254 CO 0.00 1.07 -0.01 0.93 -1.64 0.00 0.00 178.16 178.51 3gti h GLU 255 N -0.30 0.45 0.00 1.82 5.08 -1.57 -2.55 114.58 117.51 3gti h GLU 255 Ca -0.06 -0.09 -0.06 0.00 -1.00 0.00 0.00 59.36 58.16 3gti h GLU 255 Cb 1.20 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 3gti h GLU 255 CO 0.09 0.48 -0.27 1.96 -1.00 0.00 0.00 179.01 180.27 3gti h GLN 256 N 0.43 0.00 -0.91 2.33 4.20 -0.45 -1.57 115.11 119.15 3gti h GLN 256 Ca 0.09 0.00 0.10 0.00 0.06 0.00 0.00 58.65 58.90 3gti h GLN 256 Cb 0.30 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.00 3gti h GLN 256 CO 0.01 0.27 0.56 -0.07 -0.67 0.00 0.00 178.83 178.92 3gti h LEU 257 N 0.00 0.83 -0.36 1.46 3.38 -1.34 -0.76 115.31 118.52 3gti h LEU 257 Ca -0.00 0.04 -0.19 0.00 0.09 0.00 0.00 57.88 57.82 3gti h LEU 257 Cb 0.55 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 3gti h LEU 257 CO 0.03 0.48 -0.66 -0.26 0.09 0.00 0.00 178.44 178.12 3gti h PHE 258 N 0.94 0.81 -0.18 1.13 -1.00 -1.39 -1.64 116.94 115.61 3gti h PHE 258 Ca 0.43 -0.33 -0.09 0.00 2.81 0.00 0.00 57.97 60.80 3gti h PHE 258 Cb 0.35 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 39.76 3gti h PHE 258 CO -0.03 1.11 -0.28 0.74 -1.61 0.00 0.00 178.31 178.24 3gti h PHE 259 N 0.45 0.39 -0.04 -0.55 -1.00 -0.78 -1.05 116.94 114.36 3gti h PHE 259 Ca -0.02 -0.08 -0.21 0.00 2.81 0.00 0.00 57.97 60.47 3gti h PHE 259 Cb 1.25 -0.10 0.02 0.00 3.61 0.00 0.00 35.95 40.73 3gti h PHE 259 CO 0.06 0.60 -0.80 0.00 -1.61 0.00 0.00 178.31 176.56 3gti h ARG 260 N 0.31 0.60 -0.13 1.51 3.08 -1.11 -1.26 114.38 117.38 3gti h ARG 260 Ca 0.05 -0.60 -0.00 0.00 0.07 0.00 0.00 59.98 59.49 3gti h ARG 260 Cb 0.65 0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.85 3gti h ARG 260 CO 0.05 1.21 0.07 0.00 -1.07 0.00 0.00 179.97 180.23 3gti h ALA 261 N 0.41 0.17 -0.29 0.04 0.00 -1.18 -1.63 119.26 116.78 3gti h ALA 261 Ca -0.09 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.83 3gti h ALA 261 Cb 1.46 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 19.15 3gti h ALA 261 CO 0.16 -0.30 -0.03 0.00 0.00 0.00 0.00 179.25 179.08 3gti h ALA 262 N 0.98 0.24 -0.26 0.00 0.00 -1.20 -0.73 119.26 118.28 3gti h ALA 262 Ca 0.05 0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.10 3gti h ALA 262 Cb 0.06 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 3gti h ALA 262 CO -0.01 -0.43 -0.07 0.00 0.00 0.00 0.00 179.25 178.74 3gti h ALA 263 N 1.27 0.16 -0.13 0.00 0.00 -1.05 1.11 119.26 120.63 3gti h ALA 263 Ca 0.14 0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.20 3gti h ALA 263 Cb 0.20 0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 3gti h ALA 263 CO -0.26 -0.48 -0.32 0.00 0.00 0.00 0.00 179.25 178.19 3gti h ARG 264 N -0.01 -0.38 -0.78 0.00 3.08 -0.53 0.16 114.38 115.91 3gti h ARG 264 Ca 0.13 0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.17 3gti h ARG 264 Cb 0.21 0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.31 3gti h ARG 264 CO -0.28 -0.25 0.37 0.28 -1.07 0.00 0.00 179.97 179.01 3gti h VAL 265 N -0.40 1.25 -0.29 2.04 2.07 -0.17 -0.23 116.25 120.53 3gti h VAL 265 Ca 0.09 -0.71 -0.03 0.00 0.82 0.00 0.00 66.70 66.88 3gti h VAL 265 Cb 0.54 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 3gti h VAL 265 CO -0.35 0.30 0.07 -0.61 0.02 0.00 0.00 177.57 177.00 3gti h GLN 266 N 1.12 0.46 -0.44 1.57 -0.00 0.19 0.21 115.11 118.21 3gti h GLN 266 Ca 0.27 -0.11 0.04 0.00 -0.00 0.00 0.00 58.65 58.85 3gti h GLN 266 Cb 0.13 -0.06 -0.04 0.00 0.00 0.00 0.00 27.48 27.50 3gti h GLN 266 CO -0.03 0.54 0.20 0.00 0.00 0.00 0.00 178.83 179.54 3gti h ARG 267 N 0.30 0.38 -0.11 1.69 3.08 -0.37 0.55 114.38 119.91 3gti h ARG 267 Ca 0.09 -0.02 -0.19 0.00 0.07 0.00 0.00 59.98 59.93 3gti h ARG 267 Cb 0.29 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 3gti h ARG 267 CO 0.00 0.25 -0.71 0.93 -1.07 0.00 0.00 179.97 179.38 3gti h GLU 268 N 0.40 0.49 0.00 0.04 5.08 -0.75 -3.40 114.58 116.43 3gti h GLU 268 Ca 0.20 -0.38 -0.13 0.00 -1.00 0.00 0.00 59.36 58.04 3gti h GLU 268 Cb 0.14 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 3gti h GLU 268 CO -0.16 1.01 -1.55 0.25 -1.00 0.00 0.00 179.01 177.56 3gti n THR 269 N -3.87 0.51 -0.28 1.13 -2.24 0.70 -4.83 114.28 105.39 3gti n THR 269 Ca -0.05 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 3gti n THR 269 Cb 0.70 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 68.27 3gti n THR 269 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gti n GLY 270 N 2.43 0.70 3.69 3.38 0.00 0.18 -3.15 105.19 112.43 3gti n GLY 270 Ca -0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 3gti n GLY 270 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3gti n VAL 271 N -2.00 3.36 -1.55 1.61 3.14 -1.26 -4.84 118.33 116.78 3gti n VAL 271 Ca 0.00 -0.50 -0.31 0.00 -2.96 0.00 0.00 64.34 60.57 3gti n VAL 271 Cb 0.00 -1.48 0.05 0.00 -1.06 0.00 0.00 33.84 31.35 3gti n VAL 271 CO 0.00 0.00 0.00 -2.84 -6.46 0.00 0.00 176.83 167.53 3gti s PRO 272 N -2.61 2.85 -0.08 1.45 0.02 -1.26 -4.72 135.00 130.65 3gti s PRO 272 Ca 0.69 0.94 0.01 0.00 0.02 0.00 0.00 61.00 62.67 3gti s PRO 272 Cb -0.45 -1.98 0.02 0.00 0.02 0.00 0.00 34.50 32.10 3gti s PRO 272 CO 0.52 -1.16 -0.11 0.42 -0.33 0.00 0.00 177.00 176.34 3gti s ILE 273 N -3.05 1.11 0.11 2.83 1.01 0.45 -1.00 121.20 122.66 3gti s ILE 273 Ca 0.58 -0.43 0.10 0.00 0.00 0.00 0.00 60.65 60.90 3gti s ILE 273 Cb -0.14 -1.05 -0.04 0.00 0.01 0.00 0.00 42.46 41.24 3gti s ILE 273 CO 0.55 0.36 -0.23 0.27 0.00 0.00 0.00 174.94 175.88 3gti s ILE 274 N 0.97 2.47 0.20 2.92 -4.36 -0.26 -0.83 121.20 122.31 3gti s ILE 274 Ca -0.09 -1.60 0.02 0.00 -0.26 0.00 0.00 60.65 58.73 3gti s ILE 274 Cb -0.15 -2.09 -0.05 0.00 1.25 0.00 0.00 42.46 41.42 3gti s ILE 274 CO 0.00 0.14 0.01 0.42 0.24 0.00 0.00 174.94 175.75 3gti s THR 275 N -1.05 0.80 -0.15 8.37 -4.23 -0.77 -1.74 115.64 116.86 3gti s THR 275 Ca 0.15 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.65 3gti s THR 275 Cb -0.10 -2.26 -0.01 0.00 1.34 0.00 0.00 72.50 71.47 3gti s THR 275 CO 0.07 -0.37 -0.12 -2.28 -0.54 0.00 0.00 174.62 171.38 3gti s HIS 276 N -3.58 2.83 -0.07 3.99 2.46 0.14 -1.78 115.29 119.28 3gti s HIS 276 Ca 0.27 -0.81 -0.02 0.00 0.47 0.00 0.00 55.06 54.97 3gti s HIS 276 Cb 0.06 -1.90 -0.04 0.00 -0.13 0.00 0.00 32.58 30.58 3gti s HIS 276 CO 0.07 -0.34 0.04 0.95 -2.47 0.00 0.00 174.74 172.99 3gti s THR 277 N 0.66 4.59 -0.24 0.89 -4.23 -1.20 -2.15 115.64 113.95 3gti s THR 277 Ca -0.07 -0.23 -0.14 0.00 -1.18 0.00 0.00 61.69 60.08 3gti s THR 277 Cb -0.15 -2.98 -0.04 0.00 1.34 0.00 0.00 72.50 70.66 3gti s THR 277 CO 0.02 0.54 0.31 -1.58 -0.54 0.00 0.00 174.62 173.37 3gti s GLN 278 N -1.13 4.08 -1.51 3.99 2.00 -1.24 -4.49 119.66 121.36 3gti s GLN 278 Ca 0.16 -0.02 -0.06 0.00 -2.00 0.00 0.00 55.36 53.44 3gti s GLN 278 Cb -0.12 -3.59 0.05 0.00 0.80 0.00 0.00 33.01 30.16 3gti s GLN 278 CO 0.05 -0.10 0.53 0.39 -0.50 0.00 0.00 175.29 175.66 3gti n GLU 279 N 4.76 -3.24 -3.61 1.67 1.02 -1.26 -2.82 120.64 117.16 3gti n GLU 279 Ca -0.11 0.39 -0.22 0.00 -0.02 0.00 0.00 57.16 57.21 3gti n GLU 279 Cb 0.51 -4.70 0.06 0.00 -0.02 0.00 0.00 31.44 27.30 3gti n GLU 279 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gti n GLY 280 N -1.83 -0.40 3.27 0.62 0.00 -1.26 -4.92 105.19 100.68 3gti n GLY 280 Ca -0.18 0.15 -0.09 0.00 0.00 0.00 0.00 46.02 45.90 3gti n GLY 280 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gti s GLN 281 N -5.92 0.97 0.00 1.61 -0.21 -1.13 -4.67 119.66 110.32 3gti s GLN 281 Ca 0.22 -0.97 0.00 0.00 0.02 0.00 0.00 55.36 54.63 3gti s GLN 281 Cb -0.10 0.38 0.00 0.00 1.00 0.00 0.00 33.01 34.29 3gti s GLN 281 CO 0.77 -0.34 0.00 1.04 -2.12 0.00 0.00 175.29 174.64 3gti n GLN 282 N -0.13 -0.04 0.08 2.91 1.13 -1.26 -4.04 117.38 116.04 3gti n GLN 282 Ca -0.13 0.01 -0.12 0.00 -1.94 0.00 0.00 57.00 54.82 3gti n GLN 282 Cb 0.63 -2.78 -0.05 0.00 0.11 0.00 0.00 30.24 28.15 3gti n GLN 282 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 3gti h GLY 283 N 0.00 -0.31 1.10 1.08 0.00 -1.94 0.13 103.07 103.13 3gti h GLY 283 Ca 0.00 0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.54 3gti h GLY 283 CO 0.00 -0.18 0.50 -2.55 0.00 0.00 0.00 176.54 174.31 3gti h PRO 284 N -0.34 1.19 -0.48 4.80 0.11 -1.89 -2.63 132.00 132.75 3gti h PRO 284 Ca 0.04 -0.12 -0.00 0.00 0.11 0.00 0.00 66.00 66.03 3gti h PRO 284 Cb 0.38 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.23 3gti h PRO 284 CO -0.13 0.85 0.29 1.96 -0.21 0.00 0.00 178.00 180.76 3gti h GLN 285 N 1.20 0.64 -0.65 1.05 7.50 -1.82 0.35 115.11 123.38 3gti h GLN 285 Ca 0.31 -0.06 -0.06 0.00 0.50 0.00 0.00 58.65 59.35 3gti h GLN 285 Cb -0.01 -0.14 -0.03 0.00 0.05 0.00 0.00 27.48 27.35 3gti h GLN 285 CO -0.05 0.47 0.18 1.96 -1.50 0.00 0.00 178.83 179.88 3gti h GLN 286 N 0.64 1.01 -0.31 1.46 4.20 -0.81 0.25 115.11 121.55 3gti h GLN 286 Ca 0.17 -0.21 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 3gti h GLN 286 Cb -0.02 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.60 3gti h GLN 286 CO -0.03 0.88 0.12 0.00 -0.67 0.00 0.00 178.83 179.12 3gti h ALA 287 N 1.23 0.40 -0.18 3.87 0.00 -1.00 0.24 119.26 123.81 3gti h ALA 287 Ca 0.21 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3gti h ALA 287 Cb 0.30 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3gti h ALA 287 CO -0.00 0.00 0.08 1.49 0.00 0.00 0.00 179.25 180.82 3gti h GLU 288 N 0.35 0.27 0.63 0.00 4.22 0.08 -2.16 114.58 117.96 3gti h GLU 288 Ca 0.10 -0.04 -0.03 0.00 0.08 0.00 0.00 59.36 59.47 3gti h GLU 288 Cb 0.19 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.40 3gti h GLU 288 CO -0.01 0.32 -0.31 1.25 -2.18 0.00 0.00 179.01 178.09 3gti h LEU 289 N 0.15 -0.73 -0.42 1.64 5.85 -0.29 0.54 115.31 122.04 3gti h LEU 289 Ca 0.06 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.82 3gti h LEU 289 Cb 0.15 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 3gti h LEU 289 CO -0.01 -0.52 0.27 -0.07 -0.34 0.00 0.00 178.44 177.77 3gti h LEU 290 N -0.85 0.45 -0.48 2.25 3.38 -0.56 0.14 115.31 119.64 3gti h LEU 290 Ca -0.08 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 3gti h LEU 290 Cb 0.66 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 3gti h LEU 290 CO 0.14 0.32 -0.00 0.71 0.09 0.00 0.00 178.44 179.69 3gti h THR 291 N 0.54 1.26 -0.02 0.22 1.35 -1.40 0.92 112.91 115.78 3gti h THR 291 Ca 0.16 -1.07 -0.03 0.00 -0.55 0.00 0.00 66.41 64.92 3gti h THR 291 Cb -0.03 1.01 -0.00 0.00 -1.73 0.00 0.00 68.15 67.39 3gti h THR 291 CO -0.06 0.37 -0.13 0.77 -0.25 0.00 0.00 175.52 176.23 3gti h SER 292 N 0.70 0.03 -0.01 5.36 4.64 -0.51 0.16 113.55 123.91 3gti h SER 292 Ca 0.13 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3gti h SER 292 Cb 0.51 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 3gti h SER 292 CO 0.03 0.16 0.00 0.18 -0.87 0.00 0.00 176.83 176.33 3gti n LEU 293 N -4.37 0.37 0.00 5.97 4.77 0.46 -4.89 117.00 119.31 3gti n LEU 293 Ca -0.02 -0.13 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 3gti n LEU 293 Cb 0.21 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 3gti n LEU 293 CO 0.36 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 3gti n GLY 294 N 0.99 0.70 3.77 -0.72 0.00 0.56 -4.80 105.19 105.69 3gti n GLY 294 Ca 0.20 -0.20 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 3gti n GLY 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gti s ALA 295 N -2.00 3.23 -0.18 4.61 0.00 0.26 -4.64 121.76 123.03 3gti s ALA 295 Ca 0.00 0.56 -0.29 0.00 0.00 0.00 0.00 51.96 52.23 3gti s ALA 295 Cb 0.00 -3.20 -0.03 0.00 0.00 0.00 0.00 23.12 19.89 3gti s ALA 295 CO 0.00 0.15 1.59 0.34 0.00 0.00 0.00 175.76 177.84 3gti s ASP 296 N -1.51 6.49 0.66 0.00 3.68 -1.26 -4.26 116.67 120.46 3gti s ASP 296 Ca 0.49 1.76 0.40 0.00 2.13 0.00 0.00 52.55 57.33 3gti s ASP 296 Cb -0.20 -2.53 2.22 0.00 -1.45 0.00 0.00 42.92 40.95 3gti s ASP 296 CO 0.26 -1.14 2.27 1.55 0.13 0.00 0.00 175.17 178.24 3gti h PRO 297 N 10.24 0.00 -0.00 4.34 0.13 -1.88 -0.45 132.00 144.38 3gti h PRO 297 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3gti h PRO 297 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3gti h PRO 297 CO 0.99 0.00 -0.01 0.00 -0.23 0.00 0.00 178.00 178.75 3gti n ALA 298 N -2.07 2.66 -1.17 -0.56 0.00 -1.26 -3.01 120.51 115.10 3gti n ALA 298 Ca -0.03 -0.24 0.06 0.00 0.00 0.00 0.00 53.44 53.23 3gti n ALA 298 Cb 0.14 -1.45 0.08 0.00 0.00 0.00 0.00 19.45 18.22 3gti n ALA 298 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3gti n ARG 299 N -0.86 1.09 -5.10 0.00 5.12 -0.19 -4.54 116.66 112.18 3gti n ARG 299 Ca 0.21 -1.91 -0.32 0.00 -1.93 0.00 0.00 57.85 53.91 3gti n ARG 299 Cb 0.18 -1.12 -0.16 0.00 -1.16 0.00 0.00 32.46 30.20 3gti n ARG 299 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3gti s ILE 300 N -1.72 2.39 -0.23 0.55 1.01 -1.16 -0.41 121.20 121.62 3gti s ILE 300 Ca 0.18 -0.92 -0.00 0.00 0.00 0.00 0.00 60.65 59.90 3gti s ILE 300 Cb 0.15 -1.92 0.06 0.00 0.01 0.00 0.00 42.46 40.76 3gti s ILE 300 CO 0.02 0.56 -0.03 -0.32 0.00 0.00 0.00 174.94 175.17 3gti s MET 301 N 0.06 1.39 -0.27 2.79 1.75 -0.01 -1.66 119.30 123.34 3gti s MET 301 Ca -0.09 -0.89 -0.29 0.00 -1.25 0.00 0.00 55.69 53.17 3gti s MET 301 Cb -0.15 -2.48 0.01 0.00 2.84 0.00 0.00 34.83 35.04 3gti s MET 301 CO 0.06 -0.63 1.11 0.42 -0.65 0.00 0.00 175.02 175.32 3gti s ILE 302 N 1.49 4.50 0.66 10.11 -1.09 0.88 -1.84 121.20 135.91 3gti s ILE 302 Ca -0.04 1.77 -0.04 0.00 -2.23 0.00 0.00 60.65 60.11 3gti s ILE 302 Cb -0.18 -4.32 0.05 0.00 -1.58 0.00 0.00 42.46 36.43 3gti s ILE 302 CO -0.07 -0.35 0.94 -0.83 -1.23 0.00 0.00 174.94 173.40 3gti s GLY 303 N 1.65 1.73 -1.51 6.18 0.00 -0.73 -0.80 107.32 113.85 3gti s GLY 303 Ca 0.47 -1.06 -0.14 0.00 0.00 0.00 0.00 44.72 43.99 3gti s GLY 303 CO 0.13 -0.69 0.75 1.42 0.00 0.00 0.00 173.10 174.71 3gti n HIS 304 N -2.74 -1.93 0.36 1.90 8.25 -1.12 -3.25 115.22 116.68 3gti n HIS 304 Ca 0.08 0.72 0.14 0.00 -0.26 0.00 0.00 57.72 58.39 3gti n HIS 304 Cb 0.60 -3.26 0.43 0.00 1.12 0.00 0.00 29.99 28.88 3gti n HIS 304 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 3gti h MET 305 N -1.49 0.00 0.00 -0.41 2.86 -1.50 -2.26 114.93 112.13 3gti h MET 305 Ca -0.53 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.11 3gti h MET 305 Cb 1.35 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.01 3gti h MET 305 CO 0.66 0.00 0.00 -0.40 1.06 0.00 0.00 176.91 178.23 3gti n ASP 306 N -2.76 0.00 0.05 1.22 3.85 -1.25 -2.48 116.55 115.18 3gti n ASP 306 Ca 0.03 0.18 0.09 0.00 -0.71 0.00 0.00 54.79 54.38 3gti n ASP 306 Cb 0.39 -0.36 0.39 0.00 -1.35 0.00 0.00 41.12 40.19 3gti n ASP 306 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3gti n GLY 307 N 0.46 -1.14 3.32 6.12 0.00 -0.85 -4.54 105.19 108.56 3gti n GLY 307 Ca 0.08 -0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 3gti n GLY 307 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3gti s ASN 308 N -3.49 3.20 0.00 1.61 3.04 -1.03 -4.03 114.94 114.25 3gti s ASN 308 Ca 0.06 -0.45 0.18 0.00 0.04 0.00 0.00 52.86 52.70 3gti s ASN 308 Cb 0.10 -0.62 -0.06 0.00 -1.54 0.00 0.00 41.25 39.13 3gti s ASN 308 CO 0.33 0.29 0.89 0.35 -3.04 0.00 0.00 177.10 175.92 3gti n THR 309 N 2.64 0.00 -2.86 -5.21 -2.24 -1.26 -4.88 114.28 100.46 3gti n THR 309 Ca -0.17 -0.24 -0.43 0.00 -2.27 0.00 0.00 64.05 60.95 3gti n THR 309 Cb 0.52 1.16 -0.04 0.00 -2.10 0.00 0.00 70.33 69.86 3gti n THR 309 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3gti s ASP 310 N -2.28 6.60 0.17 3.42 -1.08 -1.26 -4.86 116.67 117.38 3gti s ASP 310 Ca 0.13 0.41 0.17 0.00 -0.52 0.00 0.00 52.55 52.74 3gti s ASP 310 Cb 0.15 -2.44 0.78 0.00 -1.46 0.00 0.00 42.92 39.95 3gti s ASP 310 CO 0.54 -0.85 1.52 -0.81 0.52 0.00 0.00 175.17 176.09 3gti n PRO 311 N 6.72 0.10 -0.19 4.34 -0.04 -1.26 -1.62 135.00 143.06 3gti n PRO 311 Ca 0.05 0.45 -0.06 0.00 -0.04 0.00 0.00 63.50 63.91 3gti n PRO 311 Cb 0.48 -1.75 0.11 0.00 -0.04 0.00 0.00 33.50 32.30 3gti n PRO 311 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3gti h ALA 312 N 2.21 1.04 -0.67 0.55 0.00 -1.99 -0.86 119.26 119.53 3gti h ALA 312 Ca 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 3gti h ALA 312 Cb 0.18 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3gti h ALA 312 CO 0.00 0.62 0.33 -0.92 0.00 0.00 0.00 179.25 179.27 3gti h TYR 313 N 0.93 0.95 -0.08 0.00 5.03 -1.72 -1.66 116.97 120.41 3gti h TYR 313 Ca 0.19 -0.03 -0.11 0.00 2.58 0.00 0.00 58.73 61.36 3gti h TYR 313 Cb 0.39 -0.30 0.00 0.00 1.55 0.00 0.00 36.73 38.38 3gti h TYR 313 CO 0.03 0.69 -0.36 0.45 -1.32 0.00 0.00 178.16 177.64 3gti h HIS 314 N 0.95 0.51 -0.46 -3.82 -0.00 -1.54 -2.74 115.15 108.05 3gti h HIS 314 Ca 0.23 -0.23 0.05 0.00 -0.00 0.00 0.00 60.37 60.43 3gti h HIS 314 Cb 0.09 -0.08 -0.03 0.00 -0.00 0.00 0.00 27.41 27.40 3gti h HIS 314 CO 0.01 0.97 0.31 0.00 -0.00 0.00 0.00 177.93 179.22 3gti h ARG 315 N -0.09 0.43 -0.03 2.45 3.08 -0.94 0.99 114.38 120.27 3gti h ARG 315 Ca -0.02 -0.03 -0.18 0.00 0.07 0.00 0.00 59.98 59.82 3gti h ARG 315 Cb 1.01 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.96 3gti h ARG 315 CO 0.08 0.28 -0.79 1.49 -1.07 0.00 0.00 179.97 179.96 3gti h GLU 316 N 0.44 0.24 -0.09 0.04 4.81 -1.29 -2.42 114.58 116.32 3gti h GLU 316 Ca 0.19 -0.23 -0.12 0.00 -0.13 0.00 0.00 59.36 59.08 3gti h GLU 316 Cb 0.22 0.06 0.01 0.00 0.63 0.00 0.00 28.75 29.66 3gti h GLU 316 CO -0.05 0.91 -0.41 1.15 -0.73 0.00 0.00 179.01 179.88 3gti h THR 317 N 0.15 1.39 0.00 0.32 2.02 -0.88 -3.14 112.91 112.77 3gti h THR 317 Ca -0.03 -1.77 -0.01 0.00 0.77 0.00 0.00 66.41 65.37 3gti h THR 317 Cb 1.38 2.24 -0.00 0.00 -1.74 0.00 0.00 68.15 70.03 3gti h THR 317 CO 0.12 0.52 -0.03 -0.07 0.37 0.00 0.00 175.52 176.44 3gti h LEU 318 N -0.00 0.00 -1.51 2.58 3.38 -0.87 -2.44 115.31 116.45 3gti h LEU 318 Ca -0.03 0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.12 3gti h LEU 318 Cb 1.06 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.75 3gti h LEU 318 CO 0.09 0.03 0.56 0.03 0.09 0.00 0.00 178.44 179.24 3gti h ARG 319 N 0.00 0.43 0.00 1.13 2.47 -1.38 0.19 114.38 117.22 3gti h ARG 319 Ca -0.00 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 3gti h ARG 319 Cb 0.07 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.29 3gti h ARG 319 CO 0.00 0.29 0.00 0.72 0.56 0.00 0.00 179.97 181.54 3gti n HIS 320 N -4.51 0.00 -1.04 3.04 8.25 -0.92 -4.85 115.22 115.19 3gti n HIS 320 Ca 0.17 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.62 3gti n HIS 320 Cb 0.61 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.71 3gti n HIS 320 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3gti n GLY 321 N 0.25 0.38 3.94 -1.41 0.00 0.66 -4.82 105.19 104.20 3gti n GLY 321 Ca 0.03 -0.08 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 3gti n GLY 321 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gti s VAL 322 N -1.62 2.95 0.18 1.61 -7.23 -1.26 -4.45 120.40 110.59 3gti s VAL 322 Ca 0.00 -0.36 -0.06 0.00 -1.81 0.00 0.00 61.98 59.75 3gti s VAL 322 Cb 0.00 -3.17 -0.06 0.00 0.56 0.00 0.00 36.38 33.71 3gti s VAL 322 CO 0.00 -0.15 0.45 -0.44 -0.31 0.00 0.00 175.10 174.64 3gti s SER 323 N -4.40 6.53 0.12 4.85 0.01 -0.66 -4.70 113.70 115.44 3gti s SER 323 Ca 0.56 0.70 0.10 0.00 1.31 0.00 0.00 55.95 58.63 3gti s SER 323 Cb -0.10 -2.14 -0.04 0.00 0.21 0.00 0.00 66.02 63.95 3gti s SER 323 CO 0.42 -0.01 -0.25 0.27 0.41 0.00 0.00 173.24 174.08 3gti s ILE 324 N -1.75 2.10 -0.10 1.44 -4.36 0.62 -0.08 121.20 119.07 3gti s ILE 324 Ca 0.43 -1.68 0.01 0.00 -0.26 0.00 0.00 60.65 59.16 3gti s ILE 324 Cb -0.12 -1.87 0.02 0.00 1.25 0.00 0.00 42.46 41.74 3gti s ILE 324 CO 0.24 0.07 -0.12 0.00 0.24 0.00 0.00 174.94 175.37 3gti s ALA 325 N -1.07 1.45 -1.10 2.27 0.00 0.02 -2.01 121.76 121.33 3gti s ALA 325 Ca 0.12 -0.59 -0.18 0.00 0.00 0.00 0.00 51.96 51.31 3gti s ALA 325 Cb -0.10 -0.81 0.12 0.00 0.00 0.00 0.00 23.12 22.33 3gti s ALA 325 CO 0.05 -0.17 1.39 -0.06 0.00 0.00 0.00 175.76 176.97 3gti s PHE 326 N 1.20 3.06 -0.23 0.00 0.40 -0.65 -1.57 117.98 120.18 3gti s PHE 326 Ca -0.04 -1.56 0.16 0.00 -0.60 0.00 0.00 56.93 54.90 3gti s PHE 326 Cb -0.14 -4.46 0.53 0.00 0.51 0.00 0.00 43.02 39.46 3gti s PHE 326 CO -0.03 -1.60 1.42 -0.40 0.70 0.00 0.00 175.22 175.31 3gti n ASP 327 N 7.04 3.89 -0.20 1.36 3.85 -1.26 -0.98 116.55 130.25 3gti n ASP 327 Ca 0.34 -2.95 0.06 0.00 -0.71 0.00 0.00 54.79 51.53 3gti n ASP 327 Cb 0.47 -0.53 0.09 0.00 -1.35 0.00 0.00 41.12 39.80 3gti n ASP 327 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3gti n ARG 328 N -0.41 0.92 -1.68 0.11 1.74 -1.13 -0.88 116.66 115.33 3gti n ARG 328 Ca 0.21 -2.01 -0.53 0.00 -0.77 0.00 0.00 57.85 54.75 3gti n ARG 328 Cb 0.87 -1.15 -0.06 0.00 -1.02 0.00 0.00 32.46 31.10 3gti n ARG 328 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 3gti n ILE 329 N -0.93 0.29 0.00 0.55 5.41 -0.77 -1.28 119.36 122.63 3gti n ILE 329 Ca 0.10 -0.05 0.00 0.00 1.00 0.00 0.00 62.75 63.80 3gti n ILE 329 Cb 0.64 -1.35 0.00 0.00 -0.71 0.00 0.00 39.64 38.22 3gti n ILE 329 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3gti n GLY 330 N 3.84 1.25 3.50 7.39 0.00 -1.26 -4.51 105.19 115.40 3gti n GLY 330 Ca 0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.82 3gti n GLY 330 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3gti s LEU 331 N 0.00 4.50 -0.28 0.99 2.96 -0.40 -2.68 118.68 123.76 3gti s LEU 331 Ca 0.00 -0.45 0.02 0.00 -0.22 0.00 0.00 54.13 53.48 3gti s LEU 331 Cb 0.00 -2.71 0.06 0.00 0.50 0.00 0.00 46.19 44.04 3gti s LEU 331 CO 0.00 -0.92 -0.07 -1.10 -1.32 0.00 0.00 176.35 172.94 3gti s GLN 332 N 3.07 2.20 0.00 1.98 -0.21 -0.05 -4.64 119.66 122.02 3gti s GLN 332 Ca 0.23 -1.39 0.00 0.00 0.02 0.00 0.00 55.36 54.22 3gti s GLN 332 Cb -0.15 -2.99 0.00 0.00 1.00 0.00 0.00 33.01 30.88 3gti s GLN 332 CO 0.18 -0.62 0.00 0.41 -2.12 0.00 0.00 175.29 173.14 3gti n GLY 333 N 4.45 0.92 3.16 3.09 0.00 -0.72 -4.05 105.19 112.05 3gti n GLY 333 Ca -0.12 -0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 3gti n GLY 333 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gti s LEU 334 N 0.00 2.02 -0.84 0.99 1.02 -1.26 -4.78 118.68 115.83 3gti s LEU 334 Ca 0.00 -0.55 -0.04 0.00 0.02 0.00 0.00 54.13 53.56 3gti s LEU 334 Cb 0.00 -1.36 -0.05 0.00 0.02 0.00 0.00 46.19 44.81 3gti s LEU 334 CO 0.00 0.09 0.75 0.52 0.02 0.00 0.00 176.35 177.73 3gti n VAL 335 N 3.94 -8.27 0.00 -1.59 0.31 -1.26 -3.56 118.33 107.90 3gti n VAL 335 Ca -0.20 -0.95 0.00 0.00 -0.01 0.00 0.00 64.34 63.18 3gti n VAL 335 Cb 0.52 -6.15 0.00 0.00 -0.91 0.00 0.00 33.84 27.30 3gti n VAL 335 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3gti n GLY 336 N -1.36 1.96 0.00 2.92 0.00 -1.26 -4.74 105.19 102.72 3gti n GLY 336 Ca -0.05 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3gti n GLY 336 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3gti n THR 337 N 0.00 0.00 -0.81 2.61 -1.04 -1.23 -4.66 114.28 109.15 3gti n THR 337 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.00 3gti n THR 337 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 3gti n THR 337 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3gti n PRO 338 N 0.32 -0.44 -3.51 -2.82 -0.04 -1.26 -1.75 135.00 125.49 3gti n PRO 338 Ca 0.00 -0.04 -0.24 0.00 -0.04 0.00 0.00 63.50 63.18 3gti n PRO 338 Cb 0.00 -0.03 -0.02 0.00 -0.04 0.00 0.00 33.50 33.41 3gti n PRO 338 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3gti s THR 339 N -1.05 5.14 0.33 0.52 -4.23 -1.26 -3.39 115.64 111.69 3gti s THR 339 Ca 0.02 -0.52 0.03 0.00 -1.18 0.00 0.00 61.69 60.03 3gti s THR 339 Cb -0.00 -3.84 0.16 0.00 1.34 0.00 0.00 72.50 70.16 3gti s THR 339 CO 0.01 -0.47 1.87 0.44 -0.54 0.00 0.00 174.62 175.94 3gti h ASP 340 N 1.00 0.57 -0.84 3.99 3.45 -1.95 0.35 116.42 122.99 3gti h ASP 340 Ca -0.50 -0.10 0.09 0.00 0.43 0.00 0.00 57.03 56.95 3gti h ASP 340 Cb 1.22 -0.15 -0.07 0.00 -0.56 0.00 0.00 39.33 39.77 3gti h ASP 340 CO 0.62 0.60 0.49 0.00 -1.57 0.00 0.00 179.24 179.39 3gti h ALA 341 N 1.47 1.19 -0.25 3.45 0.00 -1.99 0.20 119.26 123.34 3gti h ALA 341 Ca 0.13 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 3gti h ALA 341 Cb 0.29 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3gti h ALA 341 CO 0.00 0.15 -0.11 0.93 0.00 0.00 0.00 179.25 180.21 3gti h GLU 342 N 0.84 0.51 -0.70 0.00 5.08 -1.67 -2.28 114.58 116.37 3gti h GLU 342 Ca 0.39 -0.22 0.03 0.00 -1.00 0.00 0.00 59.36 58.56 3gti h GLU 342 Cb 0.32 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.51 3gti h GLU 342 CO -0.23 0.77 0.44 0.00 -1.00 0.00 0.00 179.01 178.99 3gti h ARG 343 N 0.23 0.84 0.00 2.33 3.08 -0.08 -2.15 114.38 118.64 3gti h ARG 343 Ca 0.06 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 3gti h ARG 343 Cb 0.62 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 3gti h ARG 343 CO 0.04 0.56 -0.29 -0.07 -1.07 0.00 0.00 179.97 179.13 3gti h LEU 344 N 0.87 0.00 0.14 3.04 3.38 -0.57 -1.40 115.31 120.77 3gti h LEU 344 Ca 0.28 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 3gti h LEU 344 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3gti h LEU 344 CO -0.10 0.29 -0.07 -1.28 0.09 0.00 0.00 178.44 177.37 3gti h SER 345 N 0.00 -0.16 0.61 -0.43 0.87 -0.78 -0.86 113.55 112.80 3gti h SER 345 Ca -0.00 -0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.46 3gti h SER 345 Cb 0.60 0.04 0.01 0.00 -0.44 0.00 0.00 62.40 62.61 3gti h SER 345 CO 0.04 -0.04 -0.29 0.58 -0.53 0.00 0.00 176.83 176.59 3gti h VAL 346 N -0.27 0.39 -0.65 2.23 2.07 -1.30 -2.76 116.25 115.96 3gti h VAL 346 Ca -0.02 -0.03 0.14 0.00 0.82 0.00 0.00 66.70 67.60 3gti h VAL 346 Cb 0.21 0.41 -0.12 0.00 -1.52 0.00 0.00 31.29 30.27 3gti h VAL 346 CO 0.03 0.01 -0.07 -0.07 0.02 0.00 0.00 177.57 177.48 3gti h LEU 347 N -0.84 -0.44 -1.70 2.57 3.38 -1.22 0.15 115.31 117.21 3gti h LEU 347 Ca -0.08 0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 3gti h LEU 347 Cb 0.64 0.34 -0.00 0.00 0.09 0.00 0.00 40.66 41.73 3gti h LEU 347 CO 0.14 -0.17 -0.11 0.71 0.09 0.00 0.00 178.44 179.10 3gti h THR 348 N 0.06 0.36 0.00 0.22 1.35 -1.09 0.31 112.91 114.11 3gti h THR 348 Ca 0.33 -0.63 -0.02 0.00 -0.55 0.00 0.00 66.41 65.53 3gti h THR 348 Cb 0.53 1.47 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 3gti h THR 348 CO -0.61 0.10 -0.10 0.74 -0.25 0.00 0.00 175.52 175.41 3gti h THR 349 N 0.00 1.60 -0.80 6.82 2.02 -0.51 -0.31 112.91 121.74 3gti h THR 349 Ca -0.00 -1.91 -0.01 0.00 0.77 0.00 0.00 66.41 65.27 3gti h THR 349 Cb 0.46 2.86 -0.04 0.00 -1.74 0.00 0.00 68.15 69.69 3gti h THR 349 CO 0.01 0.51 0.47 -0.07 0.37 0.00 0.00 175.52 176.81 3gti h LEU 350 N -0.69 0.96 -0.96 2.58 3.38 -0.64 -0.21 115.31 119.74 3gti h LEU 350 Ca -0.01 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 3gti h LEU 350 Cb 0.88 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 3gti h LEU 350 CO 0.02 0.75 -0.07 -0.07 0.09 0.00 0.00 178.44 179.16 3gti h LEU 351 N 1.09 0.66 -1.94 1.67 3.38 -0.48 -1.63 115.31 118.06 3gti h LEU 351 Ca 0.28 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3gti h LEU 351 Cb -0.03 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 3gti h LEU 351 CO -0.05 0.78 -0.07 1.23 0.09 0.00 0.00 178.44 180.41 3gti h GLY 352 N 0.96 0.00 -2.89 0.83 0.00 0.62 -2.54 103.07 100.05 3gti h GLY 352 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 3gti h GLY 352 CO 0.03 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.75 3gti n GLU 353 N -3.34 4.07 -0.95 4.80 1.02 -0.36 -4.96 120.64 120.91 3gti n GLU 353 Ca -0.01 -2.97 0.00 0.00 -0.02 0.00 0.00 57.16 54.15 3gti n GLU 353 Cb 0.24 -2.03 0.00 0.00 -0.02 0.00 0.00 31.44 29.63 3gti n GLU 353 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gti n GLY 354 N 0.52 0.44 0.75 0.62 0.00 -0.96 -4.97 105.19 101.59 3gti n GLY 354 Ca 0.25 -1.00 0.04 0.00 0.00 0.00 0.00 46.02 45.32 3gti n GLY 354 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3gti n TYR 355 N -2.95 0.58 -0.32 1.61 4.01 -0.68 -4.54 117.16 114.87 3gti n TYR 355 Ca 0.00 -0.24 0.17 0.00 -0.16 0.00 0.00 57.90 57.67 3gti n TYR 355 Cb 0.02 -0.10 0.36 0.00 -0.31 0.00 0.00 39.34 39.31 3gti n TYR 355 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3gti h ALA 356 N 3.31 1.64 0.00 -0.72 0.00 -1.84 -0.47 119.26 121.18 3gti h ALA 356 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3gti h ALA 356 Cb 0.66 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3gti h ALA 356 CO 0.07 -0.37 0.00 -0.25 0.00 0.00 0.00 179.25 178.70 3gti n ASP 357 N -5.01 0.00 -0.04 0.00 8.00 -1.26 -3.10 116.55 115.14 3gti n ASP 357 Ca 0.25 -0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.50 3gti n ASP 357 Cb 0.75 -0.19 0.01 0.00 -0.02 0.00 0.00 41.12 41.67 3gti n ASP 357 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3gti n ARG 358 N -1.19 2.00 -4.52 -1.24 5.12 -0.19 -4.86 116.66 111.77 3gti n ARG 358 Ca 0.13 -1.29 -0.33 0.00 -1.93 0.00 0.00 57.85 54.43 3gti n ARG 358 Cb 0.14 -1.02 -0.14 0.00 -1.16 0.00 0.00 32.46 30.29 3gti n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3gti s LEU 359 N -0.76 2.87 0.18 0.55 1.43 -1.17 -0.28 118.68 121.50 3gti s LEU 359 Ca 0.01 -0.29 0.10 0.00 -1.03 0.00 0.00 54.13 52.92 3gti s LEU 359 Cb 0.01 -1.67 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 3gti s LEU 359 CO 0.01 0.13 -0.21 -0.76 0.23 0.00 0.00 176.35 175.75 3gti s LEU 360 N 0.56 2.43 -0.10 1.79 1.02 -0.85 -4.41 118.68 119.11 3gti s LEU 360 Ca -0.06 -0.86 0.01 0.00 0.02 0.00 0.00 54.13 53.25 3gti s LEU 360 Cb -0.15 -1.01 0.02 0.00 0.02 0.00 0.00 46.19 45.07 3gti s LEU 360 CO 0.03 0.05 -0.13 -0.76 0.02 0.00 0.00 176.35 175.56 3gti s LEU 361 N -2.63 1.61 0.00 1.79 1.43 -1.26 -1.64 118.68 117.98 3gti s LEU 361 Ca 0.18 -0.39 0.03 0.00 -1.03 0.00 0.00 54.13 52.92 3gti s LEU 361 Cb -0.07 -1.01 -0.01 0.00 0.03 0.00 0.00 46.19 45.13 3gti s LEU 361 CO 0.08 -0.01 0.26 -1.20 0.23 0.00 0.00 176.35 175.71 3gti n SER 362 N 4.30 -0.69 -0.02 2.29 7.64 -0.15 -4.40 113.62 122.59 3gti n SER 362 Ca -0.18 -2.55 0.00 0.00 1.01 0.00 0.00 58.87 57.15 3gti n SER 362 Cb 0.51 1.46 -0.06 0.00 -1.01 0.00 0.00 64.21 65.11 3gti n SER 362 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 3gti n HIS 363 N -0.46 0.00 -3.82 1.43 8.25 -1.11 -1.84 115.22 117.67 3gti n HIS 363 Ca 0.04 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.22 3gti n HIS 363 Cb 0.44 -0.28 0.04 0.00 1.12 0.00 0.00 29.99 31.31 3gti n HIS 363 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3gti n ASP 364 N -2.03 -5.01 -4.89 0.41 4.64 -0.06 -4.19 116.55 105.43 3gti n ASP 364 Ca -0.07 -0.72 -0.30 0.00 -1.38 0.00 0.00 54.79 52.33 3gti n ASP 364 Cb 0.47 -4.20 0.04 0.00 -1.04 0.00 0.00 41.12 36.39 3gti n ASP 364 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 3gti s SER 365 N -3.38 5.64 -0.14 1.67 1.04 -1.26 -4.83 113.70 112.44 3gti s SER 365 Ca 0.61 1.10 -0.00 0.00 0.48 0.00 0.00 55.95 58.13 3gti s SER 365 Cb -0.29 -1.99 0.03 0.00 0.10 0.00 0.00 66.02 63.86 3gti s SER 365 CO 0.80 -1.18 -0.10 -0.63 0.98 0.00 0.00 173.24 173.11 3gti s ILE 366 N -3.24 1.30 -0.10 -1.02 1.01 -1.25 -1.13 121.20 116.77 3gti s ILE 366 Ca 0.56 -0.52 0.14 0.00 0.00 0.00 0.00 60.65 60.83 3gti s ILE 366 Cb -0.11 -1.30 -0.01 0.00 0.01 0.00 0.00 42.46 41.05 3gti s ILE 366 CO 0.51 0.36 1.33 -0.50 0.00 0.00 0.00 174.94 176.64 3gti h TRP 367 N 8.10 0.00 -1.67 3.97 6.55 -1.12 -3.45 115.95 128.33 3gti h TRP 367 Ca -0.32 0.00 0.01 0.00 0.95 0.00 0.00 58.89 59.53 3gti h TRP 367 Cb 1.13 0.00 -0.23 0.00 -0.86 0.00 0.00 29.16 29.19 3gti h TRP 367 CO 0.47 0.61 -0.29 -1.58 -1.05 0.00 0.00 178.44 176.61 3gti s HIS 368 N -2.90 -1.26 0.40 0.49 2.46 -0.80 -4.84 115.29 108.84 3gti s HIS 368 Ca 0.03 1.68 -0.25 0.00 0.47 0.00 0.00 55.06 56.98 3gti s HIS 368 Cb 0.08 0.48 -0.08 0.00 -0.13 0.00 0.00 32.58 32.93 3gti s HIS 368 CO 0.77 -0.73 1.16 -1.58 -2.47 0.00 0.00 174.74 171.88 3gti s TRP 369 N 2.77 3.08 -0.08 3.88 0.52 -1.26 -2.83 118.94 125.02 3gti s TRP 369 Ca 0.09 1.56 -0.05 0.00 0.02 0.00 0.00 56.10 57.72 3gti s TRP 369 Cb -0.14 -3.37 -0.04 0.00 -1.15 0.00 0.00 33.47 28.78 3gti s TRP 369 CO -0.18 -1.25 0.16 -0.51 0.02 0.00 0.00 176.95 175.18 3gti s LEU 370 N -2.52 4.38 0.00 2.99 1.43 0.29 -4.87 118.68 120.38 3gti s LEU 370 Ca 0.57 0.42 0.00 0.00 -1.03 0.00 0.00 54.13 54.10 3gti s LEU 370 Cb -0.30 -2.29 0.00 0.00 0.03 0.00 0.00 46.19 43.63 3gti s LEU 370 CO 0.37 0.35 0.00 0.61 0.23 0.00 0.00 176.35 177.91 3gti n GLY 371 N 1.56 -1.28 3.70 -3.19 0.00 -1.22 -4.62 105.19 100.14 3gti n GLY 371 Ca -0.16 -1.84 -0.42 0.00 0.00 0.00 0.00 46.02 43.59 3gti n GLY 371 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3gti s ARG 372 N 0.00 4.42 -0.03 1.61 6.06 -1.26 -4.57 118.95 125.18 3gti s ARG 372 Ca 0.00 1.63 -0.37 0.00 -2.50 0.00 0.00 55.73 54.49 3gti s ARG 372 Cb 0.00 -3.48 -0.15 0.00 0.06 0.00 0.00 34.95 31.38 3gti s ARG 372 CO 0.00 -0.31 1.56 -0.35 -2.50 0.00 0.00 175.30 173.70 3gti n PRO 373 N 4.59 1.45 -1.64 5.12 -0.04 -1.26 -4.83 135.00 138.39 3gti n PRO 373 Ca 0.09 0.53 -0.48 0.00 -0.04 0.00 0.00 63.50 63.60 3gti n PRO 373 Cb 0.47 -2.23 -0.04 0.00 -0.04 0.00 0.00 33.50 31.66 3gti n PRO 373 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 3gti n PRO 374 N 3.99 1.72 -2.99 0.54 -0.02 -1.26 -4.94 135.00 132.04 3gti n PRO 374 Ca 0.21 0.62 -0.44 0.00 -2.02 0.00 0.00 63.50 61.86 3gti n PRO 374 Cb 0.20 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.37 3gti n PRO 374 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gti s ALA 375 N 0.37 3.38 -0.62 3.55 0.00 -1.26 -5.00 121.76 122.17 3gti s ALA 375 Ca 0.76 -2.45 -0.27 0.00 0.00 0.00 0.00 51.96 50.00 3gti s ALA 375 Cb -0.76 -3.82 -0.00 0.00 0.00 0.00 0.00 23.12 18.53 3gti s ALA 375 CO 0.45 -2.71 1.65 0.42 0.00 0.00 0.00 175.76 175.57 3gti s ILE 376 N 2.80 3.52 0.16 0.00 1.01 -1.26 -4.98 121.20 122.46 3gti s ILE 376 Ca 0.23 0.34 -0.32 0.00 0.00 0.00 0.00 60.65 60.91 3gti s ILE 376 Cb -0.13 -4.24 -0.11 0.00 0.01 0.00 0.00 42.46 37.99 3gti s ILE 376 CO -0.01 -1.15 1.73 -2.16 0.00 0.00 0.00 174.94 173.35 3gti s PRO 377 N 6.41 4.15 0.02 2.79 0.04 -1.26 -4.83 135.00 142.32 3gti s PRO 377 Ca 0.58 2.54 -0.02 0.00 0.04 0.00 0.00 61.00 64.14 3gti s PRO 377 Cb -0.12 -3.29 0.01 0.00 0.04 0.00 0.00 34.50 31.14 3gti s PRO 377 CO 0.21 -0.76 0.13 -1.91 0.04 0.00 0.00 177.00 174.71 3gti n GLU 378 N 4.64 -0.03 0.21 4.56 4.07 -1.26 0.15 120.64 132.99 3gti n GLU 378 Ca 0.16 0.13 0.15 0.00 -0.06 0.00 0.00 57.16 57.54 3gti n GLU 378 Cb 0.37 -0.19 0.76 0.00 -0.06 0.00 0.00 31.44 32.32 3gti n GLU 378 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3gti h ALA 379 N 0.09 1.00 -0.00 4.31 0.00 -2.03 -2.48 119.26 120.15 3gti h ALA 379 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3gti h ALA 379 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3gti h ALA 379 CO -0.08 0.00 -0.70 0.00 0.00 0.00 0.00 179.25 178.46 3gti n ALA 380 N -1.88 4.08 -0.19 0.00 0.00 0.40 -4.56 120.51 118.36 3gti n ALA 380 Ca -0.01 -0.54 -0.06 0.00 0.00 0.00 0.00 53.44 52.83 3gti n ALA 380 Cb 0.07 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.65 3gti n ALA 380 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3gti h LEU 381 N 0.68 -1.14 -1.40 0.00 -0.00 -1.49 -1.27 115.31 110.70 3gti h LEU 381 Ca 0.00 0.22 0.06 0.00 -0.00 0.00 0.00 57.88 58.16 3gti h LEU 381 Cb 0.56 0.56 -0.04 0.00 -0.00 0.00 0.00 40.66 41.74 3gti h LEU 381 CO 0.00 -0.30 0.46 1.55 -0.00 0.00 0.00 178.44 180.15 3gti h PRO 382 N -0.18 0.71 -0.51 1.13 0.13 -1.83 -1.66 132.00 129.80 3gti h PRO 382 Ca 0.22 -0.04 0.05 0.00 -0.87 0.00 0.00 66.00 65.36 3gti h PRO 382 Cb 0.55 -0.16 -0.03 0.00 0.13 0.00 0.00 31.00 31.49 3gti h PRO 382 CO -0.65 0.47 0.34 0.00 -0.23 0.00 0.00 178.00 177.93 3gti h ALA 383 N 1.62 1.87 -0.11 -0.56 0.00 -1.37 -2.67 119.26 118.03 3gti h ALA 383 Ca 0.30 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3gti h ALA 383 Cb 0.25 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3gti h ALA 383 CO -0.10 0.05 0.00 1.33 0.00 0.00 0.00 179.25 180.53 3gti n VAL 384 N -4.47 0.25 -0.25 0.00 0.24 -0.87 -0.87 118.33 112.36 3gti n VAL 384 Ca 0.07 -0.62 0.02 0.00 -2.04 0.00 0.00 64.34 61.76 3gti n VAL 384 Cb 0.22 1.07 0.15 0.00 -1.47 0.00 0.00 33.84 33.81 3gti n VAL 384 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 3gti h LYS 385 N 2.43 0.57 -0.59 7.34 3.64 -0.96 -1.19 116.57 127.82 3gti h LYS 385 Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 3gti h LYS 385 Cb 0.58 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 3gti h LYS 385 CO 0.00 0.38 0.00 -0.25 -2.27 0.00 0.00 179.45 177.31 3gti n ASP 386 N -4.88 3.14 -3.70 4.20 8.00 -1.25 -4.68 116.55 117.39 3gti n ASP 386 Ca 0.12 -2.01 -0.42 0.00 0.71 0.00 0.00 54.79 53.19 3gti n ASP 386 Cb 0.30 -0.39 -0.00 0.00 -0.02 0.00 0.00 41.12 41.00 3gti n ASP 386 CO 0.00 0.00 0.00 1.87 -0.39 0.00 0.00 177.20 178.68 3gti n TRP 387 N 1.19 2.96 -3.90 1.24 -0.00 -0.45 -4.36 117.44 114.12 3gti n TRP 387 Ca 0.19 -2.88 -0.09 0.00 -0.00 0.00 0.00 57.50 54.73 3gti n TRP 387 Cb 0.50 -2.15 -0.08 0.00 -0.00 0.00 0.00 31.31 29.58 3gti n TRP 387 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 177.69 174.31 3gti s HIS 388 N 1.06 0.22 -1.75 5.87 -3.43 -1.26 -4.77 115.29 111.23 3gti s HIS 388 Ca 0.48 -0.65 0.13 0.00 -0.80 0.00 0.00 55.06 54.22 3gti s HIS 388 Cb 0.13 -0.12 0.71 0.00 -1.43 0.00 0.00 32.58 31.87 3gti s HIS 388 CO -0.04 -0.49 1.25 -0.35 -2.00 0.00 0.00 174.74 173.11 3gti n PRO 389 N 0.08 0.31 0.00 -0.38 -0.04 -1.26 -2.63 135.00 131.08 3gti n PRO 389 Ca -0.15 0.07 0.10 0.00 -0.04 0.00 0.00 63.50 63.48 3gti n PRO 389 Cb 0.62 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.50 3gti n PRO 389 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3gti n LEU 390 N -1.13 1.33 -0.18 1.53 4.77 -1.26 -4.56 117.00 117.49 3gti n LEU 390 Ca 0.08 -0.60 -0.03 0.00 -0.03 0.00 0.00 56.01 55.44 3gti n LEU 390 Cb 0.07 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.23 3gti n LEU 390 CO 0.08 0.29 1.01 -0.74 -1.33 0.00 0.00 177.39 176.70 3gti h HIS 391 N 0.86 0.46 0.10 -1.77 2.76 -1.77 -1.19 115.15 114.59 3gti h HIS 391 Ca 0.00 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.19 3gti h HIS 391 Cb 0.57 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 29.41 3gti h HIS 391 CO 0.00 0.19 -0.05 0.82 -1.30 0.00 0.00 177.93 177.59 3gti h ILE 392 N 0.48 1.11 -0.66 6.26 2.04 -1.82 0.19 117.51 125.10 3gti h ILE 392 Ca 0.26 -0.88 0.09 0.00 1.00 0.00 0.00 64.86 65.33 3gti h ILE 392 Cb 0.23 1.66 -0.07 0.00 -0.74 0.00 0.00 36.82 37.90 3gti h ILE 392 CO -0.21 0.21 0.30 0.28 0.00 0.00 0.00 178.15 178.73 3gti h SER 393 N -0.55 0.37 0.53 1.72 0.02 -1.82 -0.58 113.55 113.24 3gti h SER 393 Ca -0.01 0.06 -0.29 0.00 -0.84 0.00 0.00 61.79 60.71 3gti h SER 393 Cb 0.45 0.01 -0.04 0.00 0.14 0.00 0.00 62.40 62.95 3gti h SER 393 CO 0.02 0.22 -1.63 0.44 -1.14 0.00 0.00 176.83 174.74 3gti h ASP 394 N 0.53 0.05 0.00 3.07 3.32 -1.26 -3.42 116.42 118.71 3gti h ASP 394 Ca 0.33 -0.10 -0.13 0.00 0.02 0.00 0.00 57.03 57.15 3gti h ASP 394 Cb 0.36 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 3gti h ASP 394 CO -0.27 1.09 -1.43 0.47 -1.72 0.00 0.00 179.24 177.37 3gti n ASP 395 N -3.14 1.20 0.31 6.45 8.00 0.63 -4.71 116.55 125.30 3gti n ASP 395 Ca -0.16 0.07 -0.13 0.00 0.71 0.00 0.00 54.79 55.28 3gti n ASP 395 Cb 1.04 -0.20 -0.06 0.00 -0.02 0.00 0.00 41.12 41.87 3gti n ASP 395 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3gti h ILE 396 N -0.22 0.00 -0.57 0.53 1.08 -0.79 -2.77 117.51 114.77 3gti h ILE 396 Ca -0.19 -0.36 0.11 0.00 -0.39 0.00 0.00 64.86 64.03 3gti h ILE 396 Cb 1.19 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 34.86 3gti h ILE 396 CO -0.10 0.00 0.07 -0.07 -0.69 0.00 0.00 178.15 177.36 3gti h LEU 397 N -1.19 -0.10 -1.64 1.44 3.38 -1.37 0.82 115.31 116.65 3gti h LEU 397 Ca -0.08 0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 3gti h LEU 397 Cb 0.64 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 3gti h LEU 397 CO 0.14 -0.03 0.03 -0.65 0.09 0.00 0.00 178.44 178.02 3gti h PRO 398 N 0.19 0.26 -0.26 1.13 0.11 -1.80 -1.43 132.00 130.20 3gti h PRO 398 Ca 0.30 -0.03 -0.15 0.00 0.11 0.00 0.00 66.00 66.22 3gti h PRO 398 Cb 0.45 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 3gti h PRO 398 CO -0.42 0.26 -0.46 0.22 -0.21 0.00 0.00 178.00 177.39 3gti h ASP 399 N 0.26 0.72 0.16 -2.05 -0.00 -0.59 -1.29 116.42 113.62 3gti h ASP 399 Ca 0.06 -0.35 -0.01 0.00 -0.00 0.00 0.00 57.03 56.74 3gti h ASP 399 Cb 0.13 -0.20 0.00 0.00 -0.00 0.00 0.00 39.33 39.26 3gti h ASP 399 CO -0.00 1.07 -0.08 -0.07 -0.00 0.00 0.00 179.24 180.16 3gti h LEU 400 N 0.53 -0.18 -0.15 2.28 3.38 -0.81 -2.89 115.31 117.47 3gti h LEU 400 Ca 0.03 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 57.72 3gti h LEU 400 Cb 1.00 0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.74 3gti h LEU 400 CO 0.09 0.29 -0.27 0.03 0.09 0.00 0.00 178.44 178.67 3gti h ARG 401 N -0.71 -0.32 0.00 1.13 2.47 -1.28 0.31 114.38 115.97 3gti h ARG 401 Ca -0.02 0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 3gti h ARG 401 Cb 0.51 0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.90 3gti h ARG 401 CO 0.04 -0.22 0.00 2.89 0.56 0.00 0.00 179.97 183.24 3gti n ARG 402 N -5.39 0.15 -0.00 0.04 1.85 -0.49 -1.04 116.66 111.78 3gti n ARG 402 Ca -0.03 0.15 0.11 0.00 -1.00 0.00 0.00 57.85 57.08 3gti n ARG 402 Cb 0.30 -1.50 -0.14 0.00 -1.05 0.00 0.00 32.46 30.07 3gti n ARG 402 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 3gti n ARG 403 N -1.20 0.37 0.00 2.89 1.74 0.10 -4.96 116.66 115.60 3gti n ARG 403 Ca 0.04 -0.11 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 3gti n ARG 403 Cb 0.05 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 29.97 3gti n ARG 403 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gti n GLY 404 N 1.37 1.18 3.77 -0.13 0.00 -0.20 -5.09 105.19 106.08 3gti n GLY 404 Ca -0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 3gti n GLY 404 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gti s ILE 405 N -0.64 2.24 0.59 -0.61 -1.09 -0.87 -4.97 121.20 115.86 3gti s ILE 405 Ca 0.00 0.23 -0.04 0.00 -2.23 0.00 0.00 60.65 58.62 3gti s ILE 405 Cb 0.00 -3.15 0.03 0.00 -1.58 0.00 0.00 42.46 37.76 3gti s ILE 405 CO 0.00 0.05 0.87 0.42 -1.23 0.00 0.00 174.94 175.05 3gti s THR 406 N -1.16 3.13 0.37 2.92 -4.23 -1.26 -4.14 115.64 111.26 3gti s THR 406 Ca 0.55 -0.29 0.16 0.00 -1.18 0.00 0.00 61.69 60.92 3gti s THR 406 Cb -0.44 -3.24 0.14 0.00 1.34 0.00 0.00 72.50 70.31 3gti s THR 406 CO 0.58 -0.22 1.89 -0.08 -0.54 0.00 0.00 174.62 176.24 3gti h GLU 407 N -0.15 0.00 -0.10 3.99 4.81 -1.97 -1.89 114.58 119.27 3gti h GLU 407 Ca -0.45 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 58.58 3gti h GLU 407 Cb 1.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.66 3gti h GLU 407 CO 0.58 0.30 -0.76 1.49 -0.73 0.00 0.00 179.01 179.89 3gti h GLU 408 N 0.00 0.55 -0.08 1.92 4.81 -1.98 -0.68 114.58 119.11 3gti h GLU 408 Ca -0.00 -0.45 -0.01 0.00 -0.13 0.00 0.00 59.36 58.76 3gti h GLU 408 Cb 0.57 0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.05 3gti h GLU 408 CO 0.04 1.08 0.01 1.96 -0.73 0.00 0.00 179.01 181.37 3gti h GLN 409 N 0.37 0.14 -0.64 1.92 4.20 -1.82 -0.02 115.11 119.26 3gti h GLN 409 Ca -0.04 -0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.68 3gti h GLN 409 Cb 1.36 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 29.07 3gti h GLN 409 CO 0.14 0.36 0.36 0.28 -0.67 0.00 0.00 178.83 179.30 3gti h VAL 410 N -0.10 0.99 -0.10 -0.54 2.07 -1.36 -0.57 116.25 116.63 3gti h VAL 410 Ca 0.03 -0.23 -0.04 0.00 0.82 0.00 0.00 66.70 67.28 3gti h VAL 410 Cb 0.29 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 3gti h VAL 410 CO 0.00 0.12 -0.10 1.23 0.02 0.00 0.00 177.57 178.85 3gti h GLY 411 N 0.68 0.17 1.25 2.17 0.00 -0.88 -1.19 103.07 105.28 3gti h GLY 411 Ca 0.28 -0.09 -0.24 0.00 0.00 0.00 0.00 47.33 47.28 3gti h GLY 411 CO -0.16 0.09 -0.92 -1.61 0.00 0.00 0.00 176.54 173.93 3gti h GLN 412 N 0.15 0.70 -0.14 4.80 4.15 0.52 0.12 115.11 125.40 3gti h GLN 412 Ca 0.03 -0.67 -0.06 0.00 0.77 0.00 0.00 58.65 58.72 3gti h GLN 412 Cb 0.28 0.17 -0.00 0.00 0.21 0.00 0.00 27.48 28.13 3gti h GLN 412 CO 0.02 1.26 -0.15 0.52 -1.93 0.00 0.00 178.83 178.55 3gti h MET 413 N 0.43 0.35 0.00 1.69 2.86 -1.07 0.99 114.93 120.18 3gti h MET 413 Ca -0.09 -0.19 -0.00 0.00 -2.06 0.00 0.00 59.70 57.35 3gti h MET 413 Cb 1.56 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 33.23 3gti h MET 413 CO 0.18 0.75 -0.71 1.79 1.06 0.00 0.00 176.91 179.99 3gti h THR 414 N -0.03 0.01 0.00 2.22 1.35 -1.31 -3.39 112.91 111.76 3gti h THR 414 Ca 0.02 -1.02 0.00 0.00 -0.55 0.00 0.00 66.41 64.86 3gti h THR 414 Cb 0.69 1.66 0.00 0.00 -1.73 0.00 0.00 68.15 68.77 3gti h THR 414 CO 0.04 0.01 -0.45 0.52 -0.25 0.00 0.00 175.52 175.38 3gti n VAL 415 N -2.81 0.21 0.21 6.82 0.31 -0.29 -0.85 118.33 121.93 3gti n VAL 415 Ca 0.01 0.07 -0.13 0.00 -0.01 0.00 0.00 64.34 64.28 3gti n VAL 415 Cb 0.55 -1.14 -0.07 0.00 -0.91 0.00 0.00 33.84 32.27 3gti n VAL 415 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3gti h GLY 416 N 0.00 -1.11 0.29 2.92 0.00 -0.87 -2.39 103.07 101.91 3gti h GLY 416 Ca 0.00 0.51 0.07 0.00 0.00 0.00 0.00 47.33 47.91 3gti h GLY 416 CO 0.00 -0.34 -0.09 3.43 0.00 0.00 0.00 176.54 179.54 3gti h ASN 417 N -0.71 -0.33 0.07 0.19 2.35 0.83 -1.37 115.58 116.61 3gti h ASN 417 Ca -0.04 0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 3gti h ASN 417 Cb 0.62 0.22 -0.00 0.00 0.05 0.00 0.00 38.32 39.21 3gti h ASN 417 CO -0.05 -0.12 -0.07 -0.65 -1.65 0.00 0.00 177.43 174.90 3gti h PRO 418 N -0.00 0.00 -0.04 0.81 0.11 -1.75 -1.37 132.00 129.76 3gti h PRO 418 Ca 0.17 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.28 3gti h PRO 418 Cb 0.26 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.37 3gti h PRO 418 CO -0.36 0.07 0.02 0.00 -0.21 0.00 0.00 178.00 177.52 3gti h ALA 419 N 1.93 0.05 -0.02 -0.75 0.00 -0.72 -0.50 119.26 119.25 3gti h ALA 419 Ca -0.00 -0.06 -0.25 0.00 0.00 0.00 0.00 54.91 54.60 3gti h ALA 419 Cb 0.12 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 17.92 3gti h ALA 419 CO 0.01 -0.39 -0.95 -0.09 0.00 0.00 0.00 179.25 177.82 3gti h ARG 420 N -0.05 0.68 -0.30 0.00 2.43 -1.24 -0.35 114.38 115.56 3gti h ARG 420 Ca 0.01 -0.71 -0.10 0.00 -0.81 0.00 0.00 59.98 58.37 3gti h ARG 420 Cb 0.11 0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 3gti h ARG 420 CO -0.00 1.29 -0.22 1.25 -1.51 0.00 0.00 179.97 180.78 3gti h LEU 421 N 0.36 0.71 0.00 3.80 5.85 -1.25 -3.35 115.31 121.43 3gti h LEU 421 Ca -0.11 -0.44 0.00 0.00 0.84 0.00 0.00 57.88 58.17 3gti h LEU 421 Cb 1.61 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.44 3gti h LEU 421 CO 0.19 1.00 -1.68 0.49 -0.34 0.00 0.00 178.44 178.10 3gti n PHE 422 N -4.32 0.00 0.49 1.25 3.01 -0.20 -4.67 117.46 113.03 3gti n PHE 422 Ca -0.03 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.47 3gti n PHE 422 Cb 0.43 -0.35 0.23 0.00 -0.01 0.00 0.00 39.48 39.78 3gti n PHE 422 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18