#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ss2 n ALA 93 N 0.00 0.00 -3.41 4.31 0.00 -1.26 -4.94 120.51 115.21 1ss2 n ALA 93 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 1ss2 n ALA 93 Cb 0.00 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.54 1ss2 n ALA 93 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1ss2 n GLU 94 N 0.00 -6.56 -1.28 0.00 1.02 -1.26 -4.66 120.64 107.90 1ss2 n GLU 94 Ca 0.00 0.84 0.00 0.00 -0.02 0.00 0.00 57.16 57.98 1ss2 n GLU 94 Cb 0.00 -5.82 0.00 0.00 -0.02 0.00 0.00 31.44 25.60 1ss2 n GLU 94 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1ss2 n PHE 95 N -4.11 -3.46 -2.65 -0.32 3.01 -1.26 -5.03 117.46 103.65 1ss2 n PHE 95 Ca -0.28 1.83 -0.04 0.00 1.01 0.00 0.00 57.45 59.97 1ss2 n PHE 95 Cb 0.66 -3.01 0.07 0.00 -0.01 0.00 0.00 39.48 37.19 1ss2 n PHE 95 CO 0.00 0.00 0.00 1.55 1.01 0.00 0.00 176.76 179.32 1ss2 n VAL 96 N -0.51 0.00 -1.26 -4.37 3.14 -1.26 -5.09 118.33 108.98 1ss2 n VAL 96 Ca 0.00 -0.93 0.00 0.00 -2.96 0.00 0.00 64.34 60.45 1ss2 n VAL 96 Cb 0.00 0.81 0.00 0.00 -1.06 0.00 0.00 33.84 33.59 1ss2 n VAL 96 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1ss2 n ARG 97 N -0.72 -3.56 -3.74 1.45 1.74 -1.26 -5.07 116.66 105.50 1ss2 n ARG 97 Ca -0.13 2.60 -0.12 0.00 -0.77 0.00 0.00 57.85 59.43 1ss2 n ARG 97 Cb 0.75 -2.89 -0.12 0.00 -1.02 0.00 0.00 32.46 29.18 1ss2 n ARG 97 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 1ss2 s ILE 98 N -2.30 -0.02 0.31 0.55 -0.00 -1.26 -4.94 121.20 113.54 1ss2 s ILE 98 Ca 0.00 0.07 -0.28 0.00 -0.00 0.00 0.00 60.65 60.43 1ss2 s ILE 98 Cb 0.00 -0.45 -0.13 0.00 -0.00 0.00 0.00 42.46 41.88 1ss2 s ILE 98 CO 0.00 0.03 1.19 0.00 -0.00 0.00 0.00 174.94 176.16 1ss2 n SER 100 N 1.11 1.74 -0.25 0.00 7.64 -1.21 -4.84 113.62 117.81 1ss2 n SER 100 Ca 0.07 1.11 0.10 0.00 1.01 0.00 0.00 58.87 61.17 1ss2 n SER 100 Cb 0.34 -1.17 0.50 0.00 -1.01 0.00 0.00 64.21 62.87 1ss2 n SER 100 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1ss2 n LYS 101 N 3.04 1.34 -0.24 1.43 2.85 -1.26 -3.90 118.16 121.42 1ss2 n LYS 101 Ca 0.20 -0.50 -0.05 0.00 -1.05 0.00 0.00 58.31 56.91 1ss2 n LYS 101 Cb 0.18 -1.36 0.11 0.00 -0.65 0.00 0.00 35.03 33.31 1ss2 n LYS 101 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 1ss2 h SER 102 N 1.04 1.00 -0.92 -5.58 0.87 -1.93 -2.63 113.55 105.41 1ss2 h SER 102 Ca 0.00 -0.16 0.12 0.00 -1.23 0.00 0.00 61.79 60.52 1ss2 h SER 102 Cb 0.23 -0.26 -0.07 0.00 -0.44 0.00 0.00 62.40 61.86 1ss2 h SER 102 CO 0.00 0.90 0.59 1.88 -0.53 0.00 0.00 176.83 179.67 1ss2 h TYR 103 N 1.06 0.95 -0.74 2.24 -1.99 -1.97 -0.61 116.97 115.90 1ss2 h TYR 103 Ca 0.24 0.03 0.14 0.00 2.00 0.00 0.00 58.73 61.14 1ss2 h TYR 103 Cb 0.23 -0.30 -0.05 0.00 2.00 0.00 0.00 36.73 38.61 1ss2 h TYR 103 CO 0.02 0.39 0.50 -0.07 -0.00 0.00 0.00 178.16 179.00 1ss2 h LEU 104 N 0.84 0.40 -9.30 3.88 4.07 -1.74 -3.40 115.31 110.06 1ss2 h LEU 104 Ca 0.45 0.02 -0.58 0.00 0.08 0.00 0.00 57.88 57.85 1ss2 h LEU 104 Cb 0.54 -0.06 -0.08 0.00 1.08 0.00 0.00 40.66 42.14 1ss2 h LEU 104 CO -0.21 0.21 -0.15 0.42 -1.08 0.00 0.00 178.44 177.63 1ss2 s THR 105 N -5.42 5.20 -0.08 0.22 -4.23 -0.24 -4.26 115.64 106.83 1ss2 s THR 105 Ca -0.08 0.91 -0.05 0.00 -1.18 0.00 0.00 61.69 61.28 1ss2 s THR 105 Cb 0.21 -3.80 0.03 0.00 1.34 0.00 0.00 72.50 70.29 1ss2 s THR 105 CO 0.77 0.32 0.21 -0.22 -0.54 0.00 0.00 174.62 175.15 1ss2 s LEU 106 N 0.70 0.79 0.10 4.79 2.96 -1.26 -4.97 118.68 121.80 1ss2 s LEU 106 Ca 0.25 0.43 -0.30 0.00 -0.22 0.00 0.00 54.13 54.28 1ss2 s LEU 106 Cb -0.15 0.63 -0.06 0.00 0.50 0.00 0.00 46.19 47.11 1ss2 s LEU 106 CO 0.09 -0.13 1.16 -1.83 -1.32 0.00 0.00 176.35 174.33 1ss2 s GLU 107 N 0.80 4.49 -1.47 1.98 1.03 -1.26 -3.17 118.70 121.11 1ss2 s GLU 107 Ca -0.06 1.75 -0.11 0.00 0.03 0.00 0.00 54.97 56.58 1ss2 s GLU 107 Cb -0.07 -3.32 0.05 0.00 -0.80 0.00 0.00 34.13 29.99 1ss2 s GLU 107 CO -0.05 -0.13 0.99 0.09 -1.33 0.00 0.00 175.26 174.83 1ss2 n ASN 108 N 3.33 -5.43 -3.60 0.83 3.02 -1.26 -4.90 115.26 107.25 1ss2 n ASN 108 Ca 0.06 -0.63 -0.07 0.00 -0.03 0.00 0.00 54.58 53.92 1ss2 n ASN 108 Cb 0.46 -4.32 -0.04 0.00 -0.61 0.00 0.00 39.78 35.27 1ss2 n ASN 108 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1ss2 s GLY 109 N -3.21 -0.17 -0.02 7.41 0.00 -1.19 -2.64 107.32 107.50 1ss2 s GLY 109 Ca 0.59 2.20 0.03 0.00 0.00 0.00 0.00 44.72 47.55 1ss2 s GLY 109 CO 0.73 0.99 -0.11 0.54 0.00 0.00 0.00 173.10 175.25 1ss2 s LYS 110 N -1.27 2.52 -0.11 2.90 1.02 0.80 -4.22 119.74 121.39 1ss2 s LYS 110 Ca 0.03 -0.71 -0.03 0.00 0.02 0.00 0.00 55.97 55.28 1ss2 s LYS 110 Cb -0.01 -2.44 -0.03 0.00 -0.52 0.00 0.00 37.83 34.83 1ss2 s LYS 110 CO -0.02 0.61 0.00 0.08 -0.92 0.00 0.00 175.35 175.10 1ss2 s VAL 111 N -0.86 4.29 -0.06 3.17 1.01 -1.26 -1.88 120.40 124.80 1ss2 s VAL 111 Ca 0.14 -0.25 -0.02 0.00 0.00 0.00 0.00 61.98 61.85 1ss2 s VAL 111 Cb -0.11 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 1ss2 s VAL 111 CO 0.04 0.57 0.06 -0.36 0.00 0.00 0.00 175.10 175.41 1ss2 s PHE 112 N -0.57 3.29 -0.13 5.22 0.40 -0.28 -4.97 117.98 120.93 1ss2 s PHE 112 Ca 0.10 0.26 -0.30 0.00 -0.60 0.00 0.00 56.93 56.38 1ss2 s PHE 112 Cb -0.12 -1.80 0.11 0.00 0.51 0.00 0.00 43.02 41.73 1ss2 s PHE 112 CO 0.02 0.55 0.92 -0.48 0.70 0.00 0.00 175.22 176.93 1ss2 s LEU 113 N -1.24 -0.43 -0.28 -0.37 0.05 -1.26 0.17 118.68 115.32 1ss2 s LEU 113 Ca 0.17 0.44 -0.21 0.00 0.05 0.00 0.00 54.13 54.59 1ss2 s LEU 113 Cb -0.12 2.02 0.08 0.00 -2.05 0.00 0.00 46.19 46.12 1ss2 s LEU 113 CO 0.07 -0.42 0.72 -0.89 -0.55 0.00 0.00 176.35 175.28 1ss2 s THR 114 N -1.26 0.00 0.00 5.48 2.01 -0.87 -5.02 115.64 115.99 1ss2 s THR 114 Ca -0.03 0.00 0.00 0.00 0.31 0.00 0.00 61.69 61.97 1ss2 s THR 114 Cb -0.00 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.51 1ss2 s THR 114 CO 0.03 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.57 1ss2 n GLY 115 N 3.48 4.32 1.06 4.40 0.00 -1.26 -2.71 105.19 114.48 1ss2 n GLY 115 Ca -0.17 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.77 1ss2 n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ss2 n GLY 116 N -0.76 -4.02 0.38 -0.02 0.00 -1.26 -4.27 105.19 95.25 1ss2 n GLY 116 Ca 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1ss2 n GLY 116 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ss2 n ASP 117 N -1.15 1.42 -3.92 1.61 8.00 -1.26 -4.26 116.55 116.99 1ss2 n ASP 117 Ca 0.00 0.00 -0.25 0.00 0.71 0.00 0.00 54.79 55.25 1ss2 n ASP 117 Cb 0.05 0.00 -0.17 0.00 -0.02 0.00 0.00 41.12 40.99 1ss2 n ASP 117 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 1ss2 s LEU 118 N -4.33 1.25 -0.04 0.64 -0.00 -1.26 -0.35 118.68 114.59 1ss2 s LEU 118 Ca 0.00 -0.27 0.00 0.00 -0.00 0.00 0.00 54.13 53.86 1ss2 s LEU 118 Cb 0.00 -0.77 0.05 0.00 -0.00 0.00 0.00 46.19 45.47 1ss2 s LEU 118 CO 0.00 -0.09 1.41 -0.81 -0.00 0.00 0.00 176.35 176.86 1ss2 n PRO 119 N 4.64 1.12 -1.11 1.48 -0.04 -1.26 -4.94 135.00 134.89 1ss2 n PRO 119 Ca -0.15 -0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.04 1ss2 n PRO 119 Cb 0.50 -1.10 0.00 0.00 -0.04 0.00 0.00 33.50 32.86 1ss2 n PRO 119 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ss2 n ALA 120 N 0.70 -1.61 -2.92 0.55 0.00 0.53 -4.83 120.51 112.93 1ss2 n ALA 120 Ca 0.05 0.33 -0.20 0.00 0.00 0.00 0.00 53.44 53.63 1ss2 n ALA 120 Cb 0.57 -1.17 0.03 0.00 0.00 0.00 0.00 19.45 18.88 1ss2 n ALA 120 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ss2 n LEU 121 N -1.84 -2.56 -2.22 0.00 4.32 -1.26 -4.85 117.00 108.59 1ss2 n LEU 121 Ca 0.00 -0.25 -0.12 0.00 -0.02 0.00 0.00 56.01 55.62 1ss2 n LEU 121 Cb 0.23 -2.70 -0.12 0.00 -1.62 0.00 0.00 43.42 39.21 1ss2 n LEU 121 CO 0.00 0.20 1.55 -0.67 -1.22 0.00 0.00 177.39 177.25 1ss2 n ASP 122 N -2.01 4.47 -1.88 -1.43 2.03 -1.26 -4.31 116.55 112.16 1ss2 n ASP 122 Ca -0.10 -2.30 -0.10 0.00 0.52 0.00 0.00 54.79 52.81 1ss2 n ASP 122 Cb 0.61 -1.15 0.04 0.00 -0.72 0.00 0.00 41.12 39.89 1ss2 n ASP 122 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ss2 n GLY 123 N 2.71 0.26 0.00 0.27 0.00 -1.26 -4.84 105.19 102.33 1ss2 n GLY 123 Ca 0.37 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1ss2 n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ss2 n ALA 124 N -3.29 0.00 -2.57 4.61 0.00 -1.26 -4.57 120.51 113.43 1ss2 n ALA 124 Ca -0.03 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.10 1ss2 n ALA 124 Cb 0.54 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.88 1ss2 n ALA 124 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ss2 s ARG 125 N -1.08 2.35 -0.03 0.00 0.52 -1.10 -1.92 118.95 117.70 1ss2 s ARG 125 Ca 0.00 -0.86 -0.02 0.00 -0.52 0.00 0.00 55.73 54.33 1ss2 s ARG 125 Cb 0.00 -2.39 0.01 0.00 0.52 0.00 0.00 34.95 33.09 1ss2 s ARG 125 CO 0.00 0.56 0.07 0.54 0.02 0.00 0.00 175.30 176.49 1ss2 s VAL 126 N -1.06 -0.01 -0.18 3.52 0.11 -0.92 -2.05 120.40 119.80 1ss2 s VAL 126 Ca 0.18 0.03 -0.02 0.00 -2.93 0.00 0.00 61.98 59.24 1ss2 s VAL 126 Cb -0.11 -0.11 0.05 0.00 -1.53 0.00 0.00 36.38 34.68 1ss2 s VAL 126 CO 0.09 0.01 0.01 -1.61 -3.33 0.00 0.00 175.10 170.27 1ss2 s GLU 127 N 0.19 0.90 0.64 1.54 2.02 0.13 -2.40 118.70 121.72 1ss2 s GLU 127 Ca -0.01 -0.47 -0.16 0.00 0.02 0.00 0.00 54.97 54.35 1ss2 s GLU 127 Cb -0.02 -2.06 -0.01 0.00 0.10 0.00 0.00 34.13 32.13 1ss2 s GLU 127 CO -0.01 -0.57 1.12 -0.06 0.02 0.00 0.00 175.26 175.76 1ss2 s PHE 128 N 1.77 2.59 -0.28 1.61 0.40 -0.36 -1.13 117.98 122.58 1ss2 s PHE 128 Ca -0.01 1.55 -0.16 0.00 -0.60 0.00 0.00 56.93 57.72 1ss2 s PHE 128 Cb -0.17 -3.22 0.09 0.00 0.51 0.00 0.00 43.02 40.23 1ss2 s PHE 128 CO -0.07 -1.73 0.71 0.50 0.70 0.00 0.00 175.22 175.32 1ss2 s ARG 129 N -3.89 0.68 0.15 0.44 6.06 -0.79 -4.88 118.95 116.73 1ss2 s ARG 129 Ca 0.69 1.20 -0.16 0.00 -2.50 0.00 0.00 55.73 54.96 1ss2 s ARG 129 Cb -0.22 0.17 -0.07 0.00 0.06 0.00 0.00 34.95 34.89 1ss2 s ARG 129 CO 0.38 -0.15 0.59 0.00 -2.50 0.00 0.00 175.30 173.62 1ss2 n ASP 131 N 0.98 -0.02 -4.19 0.00 8.00 -1.08 -4.67 116.55 115.56 1ss2 n ASP 131 Ca -0.06 0.74 -0.15 0.00 0.71 0.00 0.00 54.79 56.02 1ss2 n ASP 131 Cb 0.51 -1.31 -0.08 0.00 -0.02 0.00 0.00 41.12 40.22 1ss2 n ASP 131 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1ss2 n PRO 132 N -0.86 0.04 0.00 -0.24 -0.02 -1.26 -1.57 135.00 131.10 1ss2 n PRO 132 Ca 0.13 -1.02 0.00 0.00 -2.02 0.00 0.00 63.50 60.58 1ss2 n PRO 132 Cb 0.48 -2.73 0.00 0.00 -0.02 0.00 0.00 33.50 31.23 1ss2 n PRO 132 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1ss2 n ASP 133 N 12.90 0.00 -4.66 2.55 2.03 -1.26 -5.13 116.55 122.98 1ss2 n ASP 133 Ca 0.29 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 55.26 1ss2 n ASP 133 Cb 0.45 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.75 1ss2 n ASP 133 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1ss2 s PHE 134 N 0.00 3.06 -0.17 -0.67 0.40 -0.61 -3.42 117.98 116.56 1ss2 s PHE 134 Ca 0.00 0.09 -0.09 0.00 -0.60 0.00 0.00 56.93 56.34 1ss2 s PHE 134 Cb 0.00 -1.71 -0.05 0.00 0.51 0.00 0.00 43.02 41.78 1ss2 s PHE 134 CO 0.00 0.43 0.12 -3.38 0.70 0.00 0.00 175.22 173.09 1ss2 s HIS 135 N -0.97 3.42 -0.08 0.36 -3.43 -0.36 -4.48 115.29 109.75 1ss2 s HIS 135 Ca 0.16 0.33 -0.30 0.00 -0.80 0.00 0.00 55.06 54.46 1ss2 s HIS 135 Cb -0.11 -2.08 -0.02 0.00 -1.43 0.00 0.00 32.58 28.93 1ss2 s HIS 135 CO 0.06 0.38 1.14 -1.17 -2.00 0.00 0.00 174.74 173.15 1ss2 s LEU 136 N -0.01 4.25 -0.43 5.38 0.20 -1.26 -2.69 118.68 124.12 1ss2 s LEU 136 Ca 0.09 1.71 0.10 0.00 0.69 0.00 0.00 54.13 56.71 1ss2 s LEU 136 Cb -0.11 -3.56 0.33 0.00 -0.43 0.00 0.00 46.19 42.42 1ss2 s LEU 136 CO -0.00 -0.56 0.75 0.52 -0.29 0.00 0.00 176.35 176.76 1ss2 n VAL 137 N 4.68 0.57 0.00 1.68 0.31 -1.20 -5.00 118.33 119.36 1ss2 n VAL 137 Ca 0.11 -4.75 0.00 0.00 -0.01 0.00 0.00 64.34 59.69 1ss2 n VAL 137 Cb 0.47 -0.84 0.00 0.00 -0.91 0.00 0.00 33.84 32.55 1ss2 n VAL 137 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ss2 n GLY 138 N 0.36 2.44 2.32 2.92 0.00 -1.26 -4.66 105.19 107.30 1ss2 n GLY 138 Ca 0.26 0.06 -0.19 0.00 0.00 0.00 0.00 46.02 46.15 1ss2 n GLY 138 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ss2 n SER 139 N 0.00 5.12 -0.29 1.61 7.64 -1.26 -4.61 113.62 121.84 1ss2 n SER 139 Ca 0.00 -2.32 0.07 0.00 1.01 0.00 0.00 58.87 57.64 1ss2 n SER 139 Cb 0.00 -1.15 0.23 0.00 -1.01 0.00 0.00 64.21 62.27 1ss2 n SER 139 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 1ss2 h SER 140 N 4.83 0.43 -3.20 6.43 0.87 -1.91 -3.40 113.55 117.60 1ss2 h SER 140 Ca 0.39 0.11 -0.61 0.00 -1.23 0.00 0.00 61.79 60.45 1ss2 h SER 140 Cb 0.65 0.05 -0.11 0.00 -0.44 0.00 0.00 62.40 62.55 1ss2 h SER 140 CO 0.95 0.16 -0.47 -0.60 -0.53 0.00 0.00 176.83 176.34 1ss2 s ARG 141 N -5.97 4.12 0.03 2.24 3.52 -1.26 -1.23 118.95 120.39 1ss2 s ARG 141 Ca -0.12 -0.17 -0.15 0.00 -0.13 0.00 0.00 55.73 55.16 1ss2 s ARG 141 Cb 0.22 -3.39 0.02 0.00 -1.56 0.00 0.00 34.95 30.24 1ss2 s ARG 141 CO 0.77 0.35 0.34 -1.12 -0.81 0.00 0.00 175.30 174.83 1ss2 s SER 142 N 0.21 -0.18 -0.02 -2.12 0.01 -1.01 -4.50 113.70 106.10 1ss2 s SER 142 Ca 0.10 -0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.30 1ss2 s SER 142 Cb -0.11 0.36 0.02 0.00 0.21 0.00 0.00 66.02 66.49 1ss2 s SER 142 CO -0.01 -0.58 -0.01 0.54 0.41 0.00 0.00 173.24 173.60 1ss2 s VAL 143 N -2.19 0.15 0.55 3.43 0.11 -1.26 -2.17 120.40 119.01 1ss2 s VAL 143 Ca -0.07 0.02 -0.18 0.00 -2.93 0.00 0.00 61.98 58.82 1ss2 s VAL 143 Cb -0.02 -0.20 -0.06 0.00 -1.53 0.00 0.00 36.38 34.58 1ss2 s VAL 143 CO -0.01 0.10 1.06 0.00 -3.33 0.00 0.00 175.10 172.91 1ss2 n SER 145 N -1.56 2.37 -0.33 0.00 3.41 -1.26 -4.14 113.62 112.11 1ss2 n SER 145 Ca 0.09 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.81 1ss2 n SER 145 Cb 0.53 0.00 0.31 0.00 -0.26 0.00 0.00 64.21 64.79 1ss2 n SER 145 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1ss2 h GLN 146 N 0.00 0.80 0.00 4.33 4.20 -1.95 -3.39 115.11 119.09 1ss2 h GLN 146 Ca 0.00 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1ss2 h GLN 146 Cb 0.00 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 27.60 1ss2 h GLN 146 CO 0.00 0.53 0.00 0.41 -0.67 0.00 0.00 178.83 179.10 1ss2 n GLY 147 N -1.38 -0.19 3.80 3.46 0.00 -1.26 -4.25 105.19 105.37 1ss2 n GLY 147 Ca 0.20 0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.86 1ss2 n GLY 147 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ss2 s GLN 148 N -1.91 4.40 0.38 1.61 2.00 -1.26 -3.28 119.66 121.60 1ss2 s GLN 148 Ca 0.00 1.01 -0.16 0.00 -2.00 0.00 0.00 55.36 54.21 1ss2 s GLN 148 Cb 0.00 -3.07 -0.09 0.00 0.80 0.00 0.00 33.01 30.66 1ss2 s GLN 148 CO 0.00 0.48 0.81 -1.58 -0.50 0.00 0.00 175.29 174.50 1ss2 s TRP 149 N -1.34 3.38 0.16 1.67 0.52 -1.26 -4.14 118.94 117.94 1ss2 s TRP 149 Ca 0.39 1.29 -0.27 0.00 0.02 0.00 0.00 56.10 57.54 1ss2 s TRP 149 Cb -0.20 -2.61 0.01 0.00 -1.15 0.00 0.00 33.47 29.53 1ss2 s TRP 149 CO 0.23 -0.02 1.56 1.03 0.02 0.00 0.00 176.95 179.77 1ss2 h SER 150 N 1.89 -1.57 -4.26 2.95 0.87 -1.75 -3.41 113.55 108.27 1ss2 h SER 150 Ca -0.48 0.25 -0.66 0.00 -1.23 0.00 0.00 61.79 59.67 1ss2 h SER 150 Cb 1.18 0.70 -0.26 0.00 -0.44 0.00 0.00 62.40 63.58 1ss2 h SER 150 CO 0.64 -0.34 -0.87 0.42 -0.53 0.00 0.00 176.83 176.15 1ss2 s THR 151 N -5.80 2.03 0.00 2.23 -4.23 -1.26 -4.99 115.64 103.62 1ss2 s THR 151 Ca -0.14 -1.38 0.00 0.00 -1.18 0.00 0.00 61.69 58.99 1ss2 s THR 151 Cb 0.12 -1.75 0.00 0.00 1.34 0.00 0.00 72.50 72.22 1ss2 s THR 151 CO 0.65 0.29 0.00 -2.65 -0.54 0.00 0.00 174.62 172.38 1ss2 n PRO 152 N 1.70 0.77 -3.39 3.99 -0.02 -1.26 -4.85 135.00 131.94 1ss2 n PRO 152 Ca -0.17 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 60.93 1ss2 n PRO 152 Cb 0.52 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 33.93 1ss2 n PRO 152 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1ss2 s LYS 153 N -0.45 4.20 0.00 -0.52 2.20 -1.26 -4.67 119.74 119.24 1ss2 s LYS 153 Ca 0.00 0.23 0.00 0.00 -0.36 0.00 0.00 55.97 55.84 1ss2 s LYS 153 Cb 0.00 -3.52 0.00 0.00 -1.51 0.00 0.00 37.83 32.80 1ss2 s LYS 153 CO 0.00 0.00 0.00 -0.35 -0.36 0.00 0.00 175.35 174.64 1ss2 n PRO 154 N 4.33 1.75 -3.70 4.03 -0.04 -1.26 -4.78 135.00 135.32 1ss2 n PRO 154 Ca -0.08 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.24 1ss2 n PRO 154 Cb 0.51 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.88 1ss2 n PRO 154 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1ss2 s HIS 155 N 0.00 -0.50 -0.16 0.54 -3.43 -1.26 -4.92 115.29 105.55 1ss2 s HIS 155 Ca 0.00 1.16 -0.11 0.00 -0.80 0.00 0.00 55.06 55.31 1ss2 s HIS 155 Cb 0.00 0.19 -0.05 0.00 -1.43 0.00 0.00 32.58 31.30 1ss2 s HIS 155 CO 0.00 -0.31 0.19 0.00 -2.00 0.00 0.00 174.74 172.62 1ss2 s GLN 157 N 0.02 2.29 0.07 0.00 0.74 -1.10 -4.93 119.66 116.75 1ss2 s GLN 157 Ca 0.12 -0.83 -0.30 0.00 0.05 0.00 0.00 55.36 54.41 1ss2 s GLN 157 Cb -0.12 -2.24 -0.05 0.00 1.10 0.00 0.00 33.01 31.71 1ss2 s GLN 157 CO 0.01 0.59 1.00 0.54 -0.55 0.00 0.00 175.29 176.89 1ss2 s VAL 158 N -0.73 4.55 -2.00 1.34 0.11 -1.26 -1.23 120.40 121.17 1ss2 s VAL 158 Ca 0.12 1.97 0.10 0.00 -2.93 0.00 0.00 61.98 61.23 1ss2 s VAL 158 Cb -0.10 -4.26 0.28 0.00 -1.53 0.00 0.00 36.38 30.77 1ss2 s VAL 158 CO 0.01 0.23 1.04 -0.46 -3.33 0.00 0.00 175.10 172.59