#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ss2 h ALA 93 N 0.00 0.91 -2.67 0.62 0.00 -2.08 -3.42 119.26 112.62 1ss2 h ALA 93 Ca 0.00 -0.06 -0.52 0.00 0.00 0.00 0.00 54.91 54.33 1ss2 h ALA 93 Cb 0.00 -0.29 0.06 0.00 0.00 0.00 0.00 17.79 17.55 1ss2 h ALA 93 CO 0.00 0.35 0.90 -1.21 0.00 0.00 0.00 179.25 179.29 1ss2 s GLU 94 N -6.10 4.18 0.13 0.00 8.01 -1.26 -4.91 118.70 118.75 1ss2 s GLU 94 Ca -0.13 2.46 -0.14 0.00 0.01 0.00 0.00 54.97 57.17 1ss2 s GLU 94 Cb 0.15 -3.10 -0.01 0.00 -4.31 0.00 0.00 34.13 26.85 1ss2 s GLU 94 CO 0.78 -0.63 1.59 0.74 0.01 0.00 0.00 175.26 177.75 1ss2 h PHE 95 N 6.25 0.81 -2.70 1.61 -1.00 -2.05 -3.49 116.94 116.37 1ss2 h PHE 95 Ca -0.44 -0.13 0.00 0.00 2.81 0.00 0.00 57.97 60.21 1ss2 h PHE 95 Cb 1.21 -0.21 0.00 0.00 3.61 0.00 0.00 35.95 40.55 1ss2 h PHE 95 CO 0.63 0.80 -0.66 0.28 -1.61 0.00 0.00 178.31 177.74 1ss2 n VAL 96 N -4.43 -4.16 -1.59 -0.55 0.31 -1.26 -4.82 118.33 101.84 1ss2 n VAL 96 Ca -0.00 1.75 -0.47 0.00 -0.01 0.00 0.00 64.34 65.61 1ss2 n VAL 96 Cb 0.28 -2.42 -0.03 0.00 -0.91 0.00 0.00 33.84 30.77 1ss2 n VAL 96 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1ss2 n ARG 97 N -0.91 1.33 -4.04 5.55 3.00 -1.26 -4.98 116.66 115.34 1ss2 n ARG 97 Ca 0.00 0.47 -0.13 0.00 -0.00 0.00 0.00 57.85 58.19 1ss2 n ARG 97 Cb 0.00 -1.95 -0.13 0.00 0.00 0.00 0.00 32.46 30.39 1ss2 n ARG 97 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.63 178.59 1ss2 s ILE 98 N -0.43 0.33 0.31 5.15 -4.36 -1.26 -5.00 121.20 115.94 1ss2 s ILE 98 Ca 0.68 -0.64 -0.28 0.00 -0.26 0.00 0.00 60.65 60.15 1ss2 s ILE 98 Cb -0.78 -0.37 -0.13 0.00 1.25 0.00 0.00 42.46 42.42 1ss2 s ILE 98 CO 0.54 -0.21 1.08 0.00 0.24 0.00 0.00 174.94 176.59 1ss2 n SER 100 N 1.08 1.57 0.06 0.00 2.88 -1.26 -4.88 113.62 113.06 1ss2 n SER 100 Ca 0.08 1.12 -0.04 0.00 -1.33 0.00 0.00 58.87 58.70 1ss2 n SER 100 Cb 0.33 -1.18 -0.09 0.00 -0.75 0.00 0.00 64.21 62.52 1ss2 n SER 100 CO 0.00 0.00 0.00 0.07 -1.23 0.00 0.00 175.04 173.88 1ss2 h LYS 101 N 4.43 0.00 -1.94 -1.46 2.10 -2.03 -3.36 116.57 114.32 1ss2 h LYS 101 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1ss2 h LYS 101 Cb 1.34 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.67 1ss2 h LYS 101 CO 0.77 0.71 0.00 0.43 -2.00 0.00 0.00 179.45 179.36 1ss2 n SER 102 N -3.21 2.23 0.00 7.07 7.64 -1.26 -3.02 113.62 123.07 1ss2 n SER 102 Ca -0.04 -1.52 0.00 0.00 1.01 0.00 0.00 58.87 58.32 1ss2 n SER 102 Cb 0.91 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 1ss2 n SER 102 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1ss2 n TYR 103 N 1.64 0.00 -0.14 1.43 4.02 -1.26 -4.77 117.16 118.07 1ss2 n TYR 103 Ca 0.00 0.00 0.21 0.00 -0.01 0.00 0.00 57.90 58.10 1ss2 n TYR 103 Cb 0.22 0.13 0.62 0.00 -0.02 0.00 0.00 39.34 40.29 1ss2 n TYR 103 CO 0.00 0.00 0.00 1.37 -1.01 0.00 0.00 176.86 177.22 1ss2 h LEU 104 N 0.00 0.18 -9.49 7.72 8.10 -1.81 -3.39 115.31 116.61 1ss2 h LEU 104 Ca 0.00 0.02 -0.61 0.00 0.11 0.00 0.00 57.88 57.39 1ss2 h LEU 104 Cb 0.64 -0.02 -0.08 0.00 -0.44 0.00 0.00 40.66 40.76 1ss2 h LEU 104 CO 0.00 0.08 -0.33 0.42 -4.11 0.00 0.00 178.44 174.50 1ss2 s THR 105 N -5.19 5.27 -0.09 0.15 -4.23 -1.26 -4.23 115.64 106.07 1ss2 s THR 105 Ca -0.06 0.55 -0.05 0.00 -1.18 0.00 0.00 61.69 60.95 1ss2 s THR 105 Cb 0.21 -3.60 0.04 0.00 1.34 0.00 0.00 72.50 70.49 1ss2 s THR 105 CO 0.76 0.50 0.21 -0.22 -0.54 0.00 0.00 174.62 175.33 1ss2 s LEU 106 N -0.35 0.61 0.15 4.79 2.96 -1.26 -4.99 118.68 120.60 1ss2 s LEU 106 Ca 0.18 0.44 -0.31 0.00 -0.22 0.00 0.00 54.13 54.22 1ss2 s LEU 106 Cb -0.14 0.61 -0.08 0.00 0.50 0.00 0.00 46.19 47.07 1ss2 s LEU 106 CO 0.07 -0.15 1.37 -1.83 -1.32 0.00 0.00 176.35 174.48 1ss2 s GLU 107 N 1.10 4.34 -1.48 1.98 -1.05 -1.26 -2.84 118.70 119.49 1ss2 s GLU 107 Ca -0.08 2.08 -0.11 0.00 -0.15 0.00 0.00 54.97 56.71 1ss2 s GLU 107 Cb -0.10 -3.22 0.06 0.00 -0.44 0.00 0.00 34.13 30.44 1ss2 s GLU 107 CO -0.07 -0.38 0.96 0.09 0.95 0.00 0.00 175.26 176.82 1ss2 n ASN 108 N 3.42 -4.36 -3.62 0.83 3.02 -1.26 -4.91 115.26 108.38 1ss2 n ASN 108 Ca 0.09 -0.76 -0.05 0.00 -0.03 0.00 0.00 54.58 53.84 1ss2 n ASN 108 Cb 0.42 -4.04 -0.05 0.00 -0.61 0.00 0.00 39.78 35.51 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 -3.49 0.01 0.10 7.41 0.00 -1.13 -2.42 107.32 107.80 1ss2 s GLY 109 Ca 0.54 2.67 0.03 0.00 0.00 0.00 0.00 44.72 47.97 1ss2 s GLY 109 CO 0.82 1.20 0.14 1.25 0.00 0.00 0.00 173.10 176.51 1ss2 s LYS 110 N -0.88 3.03 0.00 2.90 2.47 0.13 -4.06 119.74 123.33 1ss2 s LYS 110 Ca 0.05 -0.69 0.05 0.00 -1.56 0.00 0.00 55.97 53.83 1ss2 s LYS 110 Cb -0.01 -2.78 -0.01 0.00 -1.46 0.00 0.00 37.83 33.56 1ss2 s LYS 110 CO -0.06 0.55 -0.16 0.08 0.16 0.00 0.00 175.35 175.92 1ss2 s VAL 111 N -1.54 1.23 -0.14 4.02 1.01 -1.26 -1.68 120.40 122.06 1ss2 s VAL 111 Ca 0.31 -0.76 -0.05 0.00 0.00 0.00 0.00 61.98 61.49 1ss2 s VAL 111 Cb -0.12 -1.05 -0.03 0.00 0.00 0.00 0.00 36.38 35.18 1ss2 s VAL 111 CO 0.24 0.27 0.02 -0.36 0.00 0.00 0.00 175.10 175.28 1ss2 s PHE 112 N -0.48 3.19 -0.14 5.22 0.40 0.01 -4.97 117.98 121.20 1ss2 s PHE 112 Ca 0.05 0.07 -0.03 0.00 -0.60 0.00 0.00 56.93 56.42 1ss2 s PHE 112 Cb -0.06 -1.94 -0.03 0.00 0.51 0.00 0.00 43.02 41.50 1ss2 s PHE 112 CO -0.00 0.27 -0.04 -1.17 0.70 0.00 0.00 175.22 174.98 1ss2 s LEU 113 N -0.19 3.25 -0.26 -0.37 1.98 -1.26 -1.64 118.68 120.19 1ss2 s LEU 113 Ca 0.06 -0.10 -0.12 0.00 -2.89 0.00 0.00 54.13 51.08 1ss2 s LEU 113 Cb -0.12 -1.77 0.10 0.00 0.66 0.00 0.00 46.19 45.05 1ss2 s LEU 113 CO 0.02 0.21 0.59 -0.89 -1.89 0.00 0.00 176.35 174.39 1ss2 s THR 114 N 0.14 -0.44 0.00 3.68 2.01 -1.24 -5.03 115.64 114.77 1ss2 s THR 114 Ca -0.01 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.03 1ss2 s THR 114 Cb -0.14 -0.89 0.00 0.00 0.01 0.00 0.00 72.50 71.48 1ss2 s THR 114 CO 0.03 0.02 0.00 0.61 -0.69 0.00 0.00 174.62 174.58 1ss2 n GLY 115 N 4.86 -0.41 0.00 4.40 0.00 -1.26 -1.67 105.19 111.11 1ss2 n GLY 115 Ca -0.16 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 0.00 -1.28 3.64 -0.02 0.00 -1.24 -4.98 105.19 101.32 1ss2 n GLY 116 Ca 0.00 -0.70 -0.03 0.00 0.00 0.00 0.00 46.02 45.29 1ss2 n GLY 116 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ss2 s ASP 117 N -1.51 -1.07 0.25 1.61 1.01 -0.45 -4.86 116.67 111.66 1ss2 s ASP 117 Ca 0.00 1.55 -0.30 0.00 0.71 0.00 0.00 52.55 54.50 1ss2 s ASP 117 Cb 0.00 1.99 -0.14 0.00 1.01 0.00 0.00 42.92 45.78 1ss2 s ASP 117 CO 0.00 -0.22 1.29 0.00 0.21 0.00 0.00 175.17 176.45 1ss2 n LEU 118 N 5.06 2.76 -3.60 1.23 -0.00 -1.26 0.13 117.00 121.31 1ss2 n LEU 118 Ca -0.15 1.16 -0.41 0.00 -0.00 0.00 0.00 56.01 56.61 1ss2 n LEU 118 Cb 0.52 -1.39 -0.00 0.00 -0.00 0.00 0.00 43.42 42.56 1ss2 n LEU 118 CO -0.03 -0.74 2.25 -0.81 -0.00 0.00 0.00 177.39 178.05 1ss2 n PRO 119 N 1.53 4.32 -2.79 1.47 -0.04 -1.26 -4.98 135.00 133.24 1ss2 n PRO 119 Ca 0.11 -3.50 -0.10 0.00 -0.04 0.00 0.00 63.50 59.96 1ss2 n PRO 119 Cb 0.31 -2.71 0.07 0.00 -0.04 0.00 0.00 33.50 31.13 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 2.33 0.37 -0.69 0.55 0.00 0.35 -4.99 120.51 118.44 1ss2 n ALA 120 Ca 0.55 -1.85 -0.06 0.00 0.00 0.00 0.00 53.44 52.08 1ss2 n ALA 120 Cb 0.28 -1.07 -0.09 0.00 0.00 0.00 0.00 19.45 18.57 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 0.11 4.57 -4.73 0.00 4.32 -1.26 -1.34 117.00 118.68 1ss2 n LEU 121 Ca 0.07 -2.51 -0.42 0.00 -0.02 0.00 0.00 56.01 53.13 1ss2 n LEU 121 Cb 0.73 -1.12 -0.03 0.00 -1.62 0.00 0.00 43.42 41.38 1ss2 n LEU 121 CO 0.06 1.18 1.30 -1.81 -1.22 0.00 0.00 177.39 176.89 1ss2 s ASP 122 N 2.08 6.45 -1.35 -1.43 1.11 -1.26 -2.30 116.67 119.97 1ss2 s ASP 122 Ca 0.34 2.81 -0.08 0.00 0.18 0.00 0.00 52.55 55.79 1ss2 s ASP 122 Cb 0.16 -2.61 0.06 0.00 1.07 0.00 0.00 42.92 41.60 1ss2 s ASP 122 CO 0.00 -0.91 0.52 0.61 1.18 0.00 0.00 175.17 176.58 1ss2 n GLY 123 N 3.47 -0.49 3.79 0.21 0.00 -1.26 -3.61 105.19 107.30 1ss2 n GLY 123 Ca 0.13 0.10 -0.38 0.00 0.00 0.00 0.00 46.02 45.87 1ss2 n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ss2 s ALA 124 N -2.99 3.57 -0.06 4.61 0.00 -0.97 -4.73 121.76 121.19 1ss2 s ALA 124 Ca 0.38 -0.07 0.02 0.00 0.00 0.00 0.00 51.96 52.30 1ss2 s ALA 124 Cb -0.20 -2.61 0.02 0.00 0.00 0.00 0.00 23.12 20.33 1ss2 s ALA 124 CO 0.47 0.29 -0.10 -0.98 0.00 0.00 0.00 175.76 175.44 1ss2 s ARG 125 N -0.56 1.41 -0.12 0.00 1.70 -0.67 -1.15 118.95 119.56 1ss2 s ARG 125 Ca 0.28 -0.32 -0.07 0.00 -0.47 0.00 0.00 55.73 55.15 1ss2 s ARG 125 Cb -0.18 -1.21 -0.04 0.00 -0.57 0.00 0.00 34.95 32.95 1ss2 s ARG 125 CO 0.16 0.00 0.13 0.14 -1.08 0.00 0.00 175.30 174.65 1ss2 s VAL 126 N 0.70 5.46 -0.23 4.99 -7.23 0.15 -3.60 120.40 120.64 1ss2 s VAL 126 Ca -0.13 0.19 -0.09 0.00 -1.81 0.00 0.00 61.98 60.14 1ss2 s VAL 126 Cb -0.15 -3.38 -0.04 0.00 0.56 0.00 0.00 36.38 33.37 1ss2 s VAL 126 CO 0.03 0.62 0.11 -1.61 -0.31 0.00 0.00 175.10 173.93 1ss2 s GLU 127 N -1.00 3.89 0.09 4.82 8.01 -0.65 -2.32 118.70 131.54 1ss2 s GLU 127 Ca 0.15 -0.36 -0.15 0.00 0.01 0.00 0.00 54.97 54.62 1ss2 s GLU 127 Cb -0.12 -3.41 -0.06 0.00 -4.31 0.00 0.00 34.13 26.23 1ss2 s GLU 127 CO 0.04 -0.00 0.50 -0.06 0.01 0.00 0.00 175.26 175.75 1ss2 s PHE 128 N 1.17 3.67 -0.19 1.61 0.40 -0.76 -0.81 117.98 123.07 1ss2 s PHE 128 Ca 0.06 1.04 -0.09 0.00 -0.60 0.00 0.00 56.93 57.35 1ss2 s PHE 128 Cb -0.14 -2.34 0.08 0.00 0.51 0.00 0.00 43.02 41.12 1ss2 s PHE 128 CO 0.04 0.52 0.44 1.03 0.70 0.00 0.00 175.22 177.95 1ss2 s ARG 129 N -1.61 0.38 0.51 0.44 0.52 -0.67 -4.84 118.95 113.68 1ss2 s ARG 129 Ca 0.33 0.95 -0.03 0.00 -0.52 0.00 0.00 55.73 56.45 1ss2 s ARG 129 Cb -0.16 0.18 -0.00 0.00 0.52 0.00 0.00 34.95 35.48 1ss2 s ARG 129 CO 0.18 -0.20 0.79 0.00 0.02 0.00 0.00 175.30 176.08 1ss2 n ASP 131 N -2.32 -1.31 -2.44 0.00 5.68 -1.01 -4.73 116.55 110.41 1ss2 n ASP 131 Ca 0.02 0.48 -0.11 0.00 -0.50 0.00 0.00 54.79 54.68 1ss2 n ASP 131 Cb 0.57 -1.25 -0.08 0.00 -1.14 0.00 0.00 41.12 39.22 1ss2 n ASP 131 CO 0.00 0.00 0.00 -2.65 -1.33 0.00 0.00 177.20 173.22 1ss2 n PRO 132 N -1.45 1.46 0.00 0.11 -0.02 -1.26 -2.65 135.00 131.19 1ss2 n PRO 132 Ca 0.09 -0.83 0.00 0.00 -2.02 0.00 0.00 63.50 60.74 1ss2 n PRO 132 Cb 0.52 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 1ss2 n PRO 132 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1ss2 n ASP 133 N 3.05 0.00 -4.68 2.55 8.00 -1.26 -5.12 116.55 119.09 1ss2 n ASP 133 Ca 0.31 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.50 1ss2 n ASP 133 Cb 0.45 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.47 1ss2 n ASP 133 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1ss2 s PHE 134 N -1.00 3.04 -0.18 1.24 0.40 -1.08 -4.40 117.98 115.99 1ss2 s PHE 134 Ca 0.00 0.04 -0.09 0.00 -0.60 0.00 0.00 56.93 56.28 1ss2 s PHE 134 Cb 0.00 -1.62 -0.05 0.00 0.51 0.00 0.00 43.02 41.86 1ss2 s PHE 134 CO 0.00 0.46 0.13 -3.38 0.70 0.00 0.00 175.22 173.13 1ss2 s HIS 135 N -1.16 3.46 0.04 0.36 -3.43 -0.78 -4.42 115.29 109.36 1ss2 s HIS 135 Ca 0.22 0.38 -0.30 0.00 -0.80 0.00 0.00 55.06 54.56 1ss2 s HIS 135 Cb -0.12 -2.09 -0.05 0.00 -1.43 0.00 0.00 32.58 28.89 1ss2 s HIS 135 CO 0.13 0.42 1.24 -1.17 -2.00 0.00 0.00 174.74 173.37 1ss2 s LEU 136 N -0.05 4.35 -0.43 5.38 2.96 -1.26 -2.68 118.68 126.94 1ss2 s LEU 136 Ca 0.10 2.02 0.09 0.00 -0.22 0.00 0.00 54.13 56.12 1ss2 s LEU 136 Cb -0.11 -3.57 0.31 0.00 0.50 0.00 0.00 46.19 43.31 1ss2 s LEU 136 CO -0.00 -0.54 0.70 0.52 -1.32 0.00 0.00 176.35 175.71 1ss2 n VAL 137 N 4.15 0.41 0.00 1.68 0.31 -1.24 -4.98 118.33 118.67 1ss2 n VAL 137 Ca 0.10 -4.63 0.00 0.00 -0.01 0.00 0.00 64.34 59.80 1ss2 n VAL 137 Cb 0.46 -1.14 0.00 0.00 -0.91 0.00 0.00 33.84 32.25 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 0.60 0.89 2.31 2.92 0.00 -1.26 -4.69 105.19 105.96 1ss2 n GLY 138 Ca 0.25 0.39 -0.10 0.00 0.00 0.00 0.00 46.02 46.56 1ss2 n GLY 138 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ss2 n SER 139 N 0.00 3.38 0.16 1.61 2.88 -1.26 -4.50 113.62 115.89 1ss2 n SER 139 Ca 0.00 -2.11 0.18 0.00 -1.33 0.00 0.00 58.87 55.61 1ss2 n SER 139 Cb 0.00 -0.86 0.79 0.00 -0.75 0.00 0.00 64.21 63.39 1ss2 n SER 139 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1ss2 h SER 140 N 4.78 0.00 -3.44 -3.46 0.87 -1.93 -3.39 113.55 106.98 1ss2 h SER 140 Ca 0.19 0.00 -0.44 0.00 -1.23 0.00 0.00 61.79 60.32 1ss2 h SER 140 Cb 0.69 0.00 -0.34 0.00 -0.44 0.00 0.00 62.40 62.31 1ss2 h SER 140 CO 0.60 0.00 -0.78 -0.13 -0.53 0.00 0.00 176.83 175.99 1ss2 s ARG 141 N -4.70 1.06 0.01 2.24 1.81 -1.26 -1.82 118.95 116.29 1ss2 s ARG 141 Ca -0.05 -0.18 -0.03 0.00 -1.72 0.00 0.00 55.73 53.76 1ss2 s ARG 141 Cb 0.16 -1.00 -0.01 0.00 -0.45 0.00 0.00 34.95 33.65 1ss2 s ARG 141 CO 0.57 -0.07 0.04 0.45 -0.68 0.00 0.00 175.30 175.62 1ss2 s SER 142 N 0.91 0.13 -0.07 0.23 0.15 -0.98 -4.52 113.70 109.54 1ss2 s SER 142 Ca -0.11 -0.32 -0.03 0.00 0.70 0.00 0.00 55.95 56.19 1ss2 s SER 142 Cb -0.15 0.14 0.04 0.00 -1.71 0.00 0.00 66.02 64.34 1ss2 s SER 142 CO 0.01 -0.28 0.16 0.54 1.20 0.00 0.00 173.24 174.86 1ss2 s VAL 143 N -1.23 -0.04 0.42 4.45 0.11 -1.26 -0.68 120.40 122.17 1ss2 s VAL 143 Ca -0.13 0.15 -0.25 0.00 -2.93 0.00 0.00 61.98 58.82 1ss2 s VAL 143 Cb -0.08 -0.26 -0.08 0.00 -1.53 0.00 0.00 36.38 34.43 1ss2 s VAL 143 CO -0.00 0.06 1.22 0.00 -3.33 0.00 0.00 175.10 173.05 1ss2 s SER 145 N -1.04 -0.35 -1.38 0.00 0.15 0.31 -4.60 113.70 106.80 1ss2 s SER 145 Ca 0.59 0.55 -0.07 0.00 0.70 0.00 0.00 55.95 57.72 1ss2 s SER 145 Cb -0.33 1.16 0.03 0.00 -1.71 0.00 0.00 66.02 65.17 1ss2 s SER 145 CO 0.41 -0.09 0.99 0.00 1.20 0.00 0.00 173.24 175.75 1ss2 n GLN 146 N 3.55 -6.33 -3.68 5.44 3.00 -1.26 -1.97 117.38 116.13 1ss2 n GLN 146 Ca -0.18 0.72 -0.24 0.00 -0.01 0.00 0.00 57.00 57.29 1ss2 n GLN 146 Cb 0.57 -5.61 0.06 0.00 0.00 0.00 0.00 30.24 25.26 1ss2 n GLN 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1ss2 n GLY 147 N -1.67 -0.47 3.64 1.08 0.00 -1.26 -4.97 105.19 101.54 1ss2 n GLY 147 Ca -0.10 0.20 -0.05 0.00 0.00 0.00 0.00 46.02 46.07 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 -6.22 0.24 0.18 1.61 2.00 -0.83 -4.75 119.66 111.88 1ss2 s GLN 148 Ca 0.45 0.28 -0.24 0.00 -2.00 0.00 0.00 55.36 53.85 1ss2 s GLN 148 Cb -0.21 0.12 -0.08 0.00 0.80 0.00 0.00 33.01 33.64 1ss2 s GLN 148 CO 0.77 -0.03 0.77 -1.58 -0.50 0.00 0.00 175.29 174.72 1ss2 s TRP 149 N 0.09 3.86 0.08 1.67 0.52 -1.26 -0.53 118.94 123.37 1ss2 s TRP 149 Ca 0.06 1.60 -0.34 0.00 0.02 0.00 0.00 56.10 57.44 1ss2 s TRP 149 Cb -0.05 -2.75 -0.16 0.00 -1.15 0.00 0.00 33.47 29.36 1ss2 s TRP 149 CO -0.12 0.48 1.53 0.77 0.02 0.00 0.00 176.95 179.63 1ss2 h SER 150 N 4.15 -1.36 -3.34 2.95 0.02 -1.64 -3.41 113.55 110.92 1ss2 h SER 150 Ca -0.47 0.12 -0.59 0.00 -0.84 0.00 0.00 61.79 60.01 1ss2 h SER 150 Cb 1.20 0.46 -0.10 0.00 0.14 0.00 0.00 62.40 64.11 1ss2 h SER 150 CO 0.66 -0.61 -0.24 0.42 -1.14 0.00 0.00 176.83 175.92 1ss2 s THR 151 N -5.66 5.25 0.45 -2.27 -4.23 -1.26 -5.02 115.64 102.89 1ss2 s THR 151 Ca -0.17 0.72 -0.21 0.00 -1.18 0.00 0.00 61.69 60.85 1ss2 s THR 151 Cb 0.04 -3.72 -0.09 0.00 1.34 0.00 0.00 72.50 70.08 1ss2 s THR 151 CO 0.57 0.34 1.03 -2.16 -0.54 0.00 0.00 174.62 173.85 1ss2 s PRO 152 N 0.69 3.98 -0.12 3.99 0.04 -1.26 -4.85 135.00 137.46 1ss2 s PRO 152 Ca 0.20 1.36 -0.41 0.00 0.04 0.00 0.00 61.00 62.19 1ss2 s PRO 152 Cb -0.14 -2.24 -0.20 0.00 0.04 0.00 0.00 34.50 31.97 1ss2 s PRO 152 CO 0.07 -0.28 1.24 1.63 0.04 0.00 0.00 177.00 179.70 1ss2 n LYS 153 N -0.65 0.12 0.00 4.56 4.76 -1.26 -4.18 118.16 121.50 1ss2 n LYS 153 Ca 0.08 0.04 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 1ss2 n LYS 153 Cb 0.52 -1.56 0.00 0.00 -1.84 0.00 0.00 35.03 32.15 1ss2 n LYS 153 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 1ss2 n PRO 154 N 2.30 3.25 -3.66 1.97 -0.04 -1.26 -4.84 135.00 132.71 1ss2 n PRO 154 Ca 0.23 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.54 1ss2 n PRO 154 Cb 0.06 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.44 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 0.60 -0.37 -0.18 0.54 -3.43 -1.26 -4.97 115.29 106.22 1ss2 s HIS 155 Ca 0.00 0.61 -0.15 0.00 -0.80 0.00 0.00 55.06 54.71 1ss2 s HIS 155 Cb 0.00 0.22 -0.04 0.00 -1.43 0.00 0.00 32.58 31.33 1ss2 s HIS 155 CO 0.00 -0.48 0.36 0.00 -2.00 0.00 0.00 174.74 172.62 1ss2 s GLN 157 N 0.90 3.44 -0.04 0.00 0.74 -1.09 -4.95 119.66 118.66 1ss2 s GLN 157 Ca 0.18 -0.29 -0.23 0.00 0.05 0.00 0.00 55.36 55.07 1ss2 s GLN 157 Cb -0.14 -3.06 -0.04 0.00 1.10 0.00 0.00 33.01 30.87 1ss2 s GLN 157 CO 0.07 0.61 0.70 0.54 -0.55 0.00 0.00 175.29 176.65 1ss2 s VAL 158 N -0.57 4.98 -2.00 1.34 0.11 -1.26 -1.87 120.40 121.13 1ss2 s VAL 158 Ca 0.11 1.44 0.07 0.00 -2.93 0.00 0.00 61.98 60.68 1ss2 s VAL 158 Cb -0.12 -4.04 0.21 0.00 -1.53 0.00 0.00 36.38 30.91 1ss2 s VAL 158 CO 0.02 0.29 0.90 0.59 -3.33 0.00 0.00 175.10 173.58