#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 1.39 -2.02 0.62 0.00 -1.26 -4.90 120.51 114.34 1ss2 n ALA 93 Ca 0.00 0.44 -0.42 0.00 0.00 0.00 0.00 53.44 53.46 1ss2 n ALA 93 Cb 0.00 -2.35 -0.03 0.00 0.00 0.00 0.00 19.45 17.07 1ss2 n ALA 93 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1ss2 s GLU 94 N 0.78 4.26 0.00 0.00 2.02 -1.26 -5.02 118.70 119.49 1ss2 s GLU 94 Ca 0.78 2.25 0.00 0.00 0.02 0.00 0.00 54.97 58.02 1ss2 s GLU 94 Cb -0.67 -3.19 0.00 0.00 0.10 0.00 0.00 34.13 30.37 1ss2 s GLU 94 CO 0.39 -0.54 0.00 1.97 0.02 0.00 0.00 175.26 177.10 1ss2 n PHE 95 N 3.92 0.00 -3.65 1.61 1.16 -1.26 -5.11 117.46 114.13 1ss2 n PHE 95 Ca 0.13 0.00 -0.02 0.00 -1.87 0.00 0.00 57.45 55.69 1ss2 n PHE 95 Cb 0.40 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.20 1ss2 n PHE 95 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 1ss2 s VAL 96 N 0.00 0.00 -0.08 1.97 0.11 -1.26 -5.13 120.40 116.01 1ss2 s VAL 96 Ca 0.00 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 58.75 1ss2 s VAL 96 Cb 0.00 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.80 1ss2 s VAL 96 CO 0.00 0.00 1.66 -0.13 -3.33 0.00 0.00 175.10 173.30 1ss2 s ARG 97 N 0.65 4.10 0.26 1.54 1.81 -1.26 -4.99 118.95 121.06 1ss2 s ARG 97 Ca -0.02 2.11 -0.21 0.00 -1.72 0.00 0.00 55.73 55.89 1ss2 s ARG 97 Cb -0.04 -4.00 -0.09 0.00 -0.45 0.00 0.00 34.95 30.37 1ss2 s ARG 97 CO -0.12 -0.95 0.79 0.96 -0.68 0.00 0.00 175.30 175.30 1ss2 s ILE 98 N 4.33 4.48 0.34 1.52 -4.36 -1.26 -4.26 121.20 121.98 1ss2 s ILE 98 Ca 0.74 1.40 -0.28 0.00 -0.26 0.00 0.00 60.65 62.25 1ss2 s ILE 98 Cb -0.32 -3.87 -0.12 0.00 1.25 0.00 0.00 42.46 39.40 1ss2 s ILE 98 CO 0.30 0.14 1.19 0.00 0.24 0.00 0.00 174.94 176.80 1ss2 n SER 100 N 0.83 1.67 -0.17 0.00 7.64 -1.26 -4.82 113.62 117.51 1ss2 n SER 100 Ca 0.06 1.12 0.01 0.00 1.01 0.00 0.00 58.87 61.07 1ss2 n SER 100 Cb 0.35 -1.18 0.02 0.00 -1.01 0.00 0.00 64.21 62.39 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 2.71 1.14 -0.15 1.43 2.85 -1.26 -3.77 118.16 121.11 1ss2 n LYS 101 Ca 0.19 -0.18 -0.11 0.00 -1.05 0.00 0.00 58.31 57.15 1ss2 n LYS 101 Cb 0.18 -1.11 0.00 0.00 -0.65 0.00 0.00 35.03 33.45 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 0.28 1.01 -0.23 -5.58 0.87 -1.94 -2.98 113.55 104.98 1ss2 h SER 102 Ca 0.00 -0.40 -0.02 0.00 -1.23 0.00 0.00 61.79 60.14 1ss2 h SER 102 Cb 0.14 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.81 1ss2 h SER 102 CO 0.00 1.19 0.10 1.88 -0.53 0.00 0.00 176.83 179.48 1ss2 h TYR 103 N 0.83 0.40 -0.85 2.24 -1.99 -1.97 -2.90 116.97 112.74 1ss2 h TYR 103 Ca 0.10 -0.01 0.22 0.00 2.00 0.00 0.00 58.73 61.04 1ss2 h TYR 103 Cb 0.83 -0.13 -0.14 0.00 2.00 0.00 0.00 36.73 39.30 1ss2 h TYR 103 CO 0.05 0.34 0.17 -0.07 -0.00 0.00 0.00 178.16 178.65 1ss2 h LEU 104 N 0.41 -0.11 -9.63 3.88 3.38 -1.78 -3.38 115.31 108.08 1ss2 h LEU 104 Ca 0.10 0.20 -0.60 0.00 0.09 0.00 0.00 57.88 57.67 1ss2 h LEU 104 Cb 0.12 0.29 -0.06 0.00 0.09 0.00 0.00 40.66 41.10 1ss2 h LEU 104 CO -0.01 -0.17 -0.17 0.28 0.09 0.00 0.00 178.44 178.47 1ss2 s THR 105 N -5.99 5.01 -0.10 0.22 -1.32 -1.10 -4.01 115.64 108.35 1ss2 s THR 105 Ca -0.12 0.91 -0.04 0.00 -1.21 0.00 0.00 61.69 61.22 1ss2 s THR 105 Cb 0.25 -3.75 0.05 0.00 -1.51 0.00 0.00 72.50 67.54 1ss2 s THR 105 CO 0.77 0.54 0.21 -0.22 -2.21 0.00 0.00 174.62 173.71 1ss2 s LEU 106 N -0.84 0.11 0.12 9.08 0.20 -1.26 -4.98 118.68 121.11 1ss2 s LEU 106 Ca 0.25 0.47 -0.31 0.00 0.69 0.00 0.00 54.13 55.22 1ss2 s LEU 106 Cb -0.17 0.55 -0.10 0.00 -0.43 0.00 0.00 46.19 46.05 1ss2 s LEU 106 CO 0.14 -0.21 1.78 -1.83 -0.29 0.00 0.00 176.35 175.94 1ss2 s GLU 107 N 1.87 4.15 -1.45 1.98 -1.05 -1.26 -1.72 118.70 121.21 1ss2 s GLU 107 Ca -0.03 2.53 -0.11 0.00 -0.15 0.00 0.00 54.97 57.21 1ss2 s GLU 107 Cb -0.11 -3.55 0.05 0.00 -0.44 0.00 0.00 34.13 30.08 1ss2 s GLU 107 CO -0.07 -0.81 1.07 0.09 0.95 0.00 0.00 175.26 176.49 1ss2 n ASN 108 N 5.49 -5.61 -3.38 0.83 3.02 -1.26 -4.82 115.26 109.54 1ss2 n ASN 108 Ca 0.17 -0.65 -0.07 0.00 -0.03 0.00 0.00 54.58 54.00 1ss2 n ASN 108 Cb 0.38 -4.44 0.00 0.00 -0.61 0.00 0.00 39.78 35.12 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 -3.29 0.12 -0.03 7.41 0.00 -0.70 -2.59 107.32 108.24 1ss2 s GLY 109 Ca 0.62 -0.46 -0.02 0.00 0.00 0.00 0.00 44.72 44.86 1ss2 s GLY 109 CO 0.77 0.12 0.08 0.54 0.00 0.00 0.00 173.10 174.60 1ss2 s LYS 110 N -2.93 0.07 -0.13 2.90 1.02 -0.45 -4.44 119.74 115.78 1ss2 s LYS 110 Ca 0.14 0.15 -0.02 0.00 0.02 0.00 0.00 55.97 56.26 1ss2 s LYS 110 Cb -0.05 -0.02 -0.03 0.00 -0.52 0.00 0.00 37.83 37.22 1ss2 s LYS 110 CO 0.08 -0.05 -0.05 0.08 -0.92 0.00 0.00 175.35 174.49 1ss2 s VAL 111 N 0.31 3.79 -0.12 3.17 1.01 -1.26 -2.80 120.40 124.51 1ss2 s VAL 111 Ca -0.02 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 1ss2 s VAL 111 Cb -0.03 -2.63 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 1ss2 s VAL 111 CO -0.01 0.52 -0.09 -0.36 0.00 0.00 0.00 175.10 175.16 1ss2 s PHE 112 N 0.06 2.89 -0.14 5.22 0.40 -0.81 -4.97 117.98 120.64 1ss2 s PHE 112 Ca -0.01 -0.34 -0.03 0.00 -0.60 0.00 0.00 56.93 55.95 1ss2 s PHE 112 Cb -0.14 -1.83 -0.03 0.00 0.51 0.00 0.00 43.02 41.54 1ss2 s PHE 112 CO 0.03 0.00 -0.03 -0.51 0.70 0.00 0.00 175.22 175.41 1ss2 s LEU 113 N -0.01 3.34 -0.28 -0.37 1.02 -1.26 -0.88 118.68 120.25 1ss2 s LEU 113 Ca -0.02 -0.06 -0.16 0.00 0.02 0.00 0.00 54.13 53.92 1ss2 s LEU 113 Cb -0.14 -1.79 0.10 0.00 0.02 0.00 0.00 46.19 44.37 1ss2 s LEU 113 CO 0.03 0.22 0.75 0.28 0.02 0.00 0.00 176.35 177.66 1ss2 s THR 114 N 0.04 -0.05 0.00 5.49 -1.32 -1.19 -5.00 115.64 113.60 1ss2 s THR 114 Ca 0.01 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.49 1ss2 s THR 114 Cb -0.13 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.86 1ss2 s THR 114 CO 0.02 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.04 1ss2 n GLY 115 N 4.25 2.33 0.00 6.08 0.00 -1.26 -2.55 105.19 114.04 1ss2 n GLY 115 Ca -0.19 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 2.41 3.65 -0.02 0.00 -1.00 -4.66 105.19 105.56 1ss2 n GLY 116 Ca 0.00 0.14 -0.02 0.00 0.00 0.00 0.00 46.02 46.15 1ss2 n GLY 116 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ss2 s ASP 117 N 2.00 -0.23 0.25 1.61 2.15 -1.26 -5.04 116.67 116.15 1ss2 s ASP 117 Ca 0.00 0.39 -0.27 0.00 0.43 0.00 0.00 52.55 53.09 1ss2 s ASP 117 Cb 0.00 0.84 -0.16 0.00 -0.30 0.00 0.00 42.92 43.30 1ss2 s ASP 117 CO 0.00 -0.06 0.65 0.00 -0.17 0.00 0.00 175.17 175.59 1ss2 n LEU 118 N 2.78 -0.35 -2.11 -1.34 -0.00 -1.26 -0.51 117.00 114.21 1ss2 n LEU 118 Ca -0.15 1.12 -0.19 0.00 -0.00 0.00 0.00 56.01 56.79 1ss2 n LEU 118 Cb 0.57 -1.06 -0.03 0.00 -0.00 0.00 0.00 43.42 42.90 1ss2 n LEU 118 CO 0.04 -2.56 1.40 -0.81 -0.00 0.00 0.00 177.39 175.45 1ss2 n PRO 119 N 0.91 2.00 -2.02 1.47 -0.04 -1.26 -5.12 135.00 130.94 1ss2 n PRO 119 Ca 0.15 -1.67 -0.37 0.00 -0.04 0.00 0.00 63.50 61.56 1ss2 n PRO 119 Cb 0.28 -1.82 0.02 0.00 -0.04 0.00 0.00 33.50 31.94 1ss2 n PRO 119 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ss2 s ALA 120 N -1.27 2.86 0.06 0.55 0.00 0.33 -4.92 121.76 119.38 1ss2 s ALA 120 Ca 0.44 1.12 0.00 0.00 0.00 0.00 0.00 51.96 53.52 1ss2 s ALA 120 Cb 0.29 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.94 1ss2 s ALA 120 CO -0.09 -1.03 0.00 -0.11 0.00 0.00 0.00 175.76 174.53 1ss2 n LEU 121 N -0.85 -0.05 -1.85 0.00 -0.00 -1.26 -4.84 117.00 108.14 1ss2 n LEU 121 Ca 0.09 0.10 -0.05 0.00 -0.00 0.00 0.00 56.01 56.16 1ss2 n LEU 121 Cb 0.47 0.11 -0.07 0.00 -0.00 0.00 0.00 43.42 43.93 1ss2 n LEU 121 CO 0.50 -0.56 1.10 0.47 -0.00 0.00 0.00 177.39 178.90 1ss2 n ASP 122 N -2.70 4.23 0.00 1.96 9.92 -1.26 -3.88 116.55 124.81 1ss2 n ASP 122 Ca 0.00 -2.20 0.00 0.00 -0.53 0.00 0.00 54.79 52.06 1ss2 n ASP 122 Cb 0.00 -1.02 0.00 0.00 -0.64 0.00 0.00 41.12 39.46 1ss2 n ASP 122 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ss2 n GLY 123 N 2.10 -1.80 3.63 0.44 0.00 -1.26 -5.12 105.19 103.17 1ss2 n GLY 123 Ca 0.17 0.75 -0.05 0.00 0.00 0.00 0.00 46.02 46.89 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 0.00 -1.92 -0.05 4.61 0.00 -1.25 -2.37 121.76 120.78 1ss2 s ALA 124 Ca 0.00 2.36 0.01 0.00 0.00 0.00 0.00 51.96 54.33 1ss2 s ALA 124 Cb 0.00 -1.56 0.02 0.00 0.00 0.00 0.00 23.12 21.58 1ss2 s ALA 124 CO 0.00 -0.62 -0.06 1.03 0.00 0.00 0.00 175.76 176.12 1ss2 s ARG 125 N 2.18 0.95 -0.15 0.00 0.52 -1.06 -2.35 118.95 119.04 1ss2 s ARG 125 Ca -0.08 -0.15 -0.12 0.00 -0.52 0.00 0.00 55.73 54.86 1ss2 s ARG 125 Cb -0.08 -0.91 -0.05 0.00 0.52 0.00 0.00 34.95 34.43 1ss2 s ARG 125 CO -0.19 -0.06 0.23 0.14 0.02 0.00 0.00 175.30 175.43 1ss2 s VAL 126 N 0.86 5.35 -0.23 3.52 -7.23 -0.93 -3.19 120.40 118.55 1ss2 s VAL 126 Ca -0.12 0.41 -0.12 0.00 -1.81 0.00 0.00 61.98 60.34 1ss2 s VAL 126 Cb -0.15 -3.55 -0.05 0.00 0.56 0.00 0.00 36.38 33.20 1ss2 s VAL 126 CO 0.01 0.46 0.24 -0.70 -0.31 0.00 0.00 175.10 174.80 1ss2 s GLU 127 N 0.04 4.10 0.07 4.82 2.12 -0.06 -2.79 118.70 127.01 1ss2 s GLU 127 Ca 0.14 -0.12 -0.12 0.00 0.36 0.00 0.00 54.97 55.24 1ss2 s GLU 127 Cb -0.13 -3.54 -0.06 0.00 0.26 0.00 0.00 34.13 30.66 1ss2 s GLU 127 CO 0.03 0.02 0.43 -0.06 -0.54 0.00 0.00 175.26 175.14 1ss2 s PHE 128 N 1.16 3.62 -0.27 5.30 0.40 0.72 -1.92 117.98 126.98 1ss2 s PHE 128 Ca 0.11 0.89 -0.14 0.00 -0.60 0.00 0.00 56.93 57.19 1ss2 s PHE 128 Cb -0.14 -2.23 0.09 0.00 0.51 0.00 0.00 43.02 41.25 1ss2 s PHE 128 CO 0.06 0.53 0.65 -0.98 0.70 0.00 0.00 175.22 176.17 1ss2 s ARG 129 N -1.73 0.64 0.16 0.44 1.70 -1.12 -4.82 118.95 114.22 1ss2 s ARG 129 Ca 0.32 1.23 -0.15 0.00 -0.47 0.00 0.00 55.73 56.66 1ss2 s ARG 129 Cb -0.15 0.29 -0.07 0.00 -0.57 0.00 0.00 34.95 34.45 1ss2 s ARG 129 CO 0.17 -0.17 0.59 0.00 -1.08 0.00 0.00 175.30 174.82 1ss2 n ASP 131 N 0.77 -0.39 -4.29 0.00 9.92 -1.07 -4.82 116.55 116.67 1ss2 n ASP 131 Ca -0.05 0.68 -0.36 0.00 -0.53 0.00 0.00 54.79 54.54 1ss2 n ASP 131 Cb 0.52 -1.29 0.07 0.00 -0.64 0.00 0.00 41.12 39.78 1ss2 n ASP 131 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 1ss2 n PRO 132 N -0.92 0.02 0.00 -0.24 -0.04 -1.26 -1.93 135.00 130.62 1ss2 n PRO 132 Ca 0.12 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 1ss2 n PRO 132 Cb 0.49 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 1ss2 n PRO 132 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1ss2 n ASP 133 N 0.95 0.00 -4.59 3.54 2.03 -1.26 -4.91 116.55 112.31 1ss2 n ASP 133 Ca 0.05 0.00 -0.34 0.00 0.52 0.00 0.00 54.79 55.02 1ss2 n ASP 133 Cb 0.52 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.81 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 -0.10 -0.67 0.40 -0.81 -3.94 117.98 115.92 1ss2 s PHE 134 Ca 0.00 -0.04 0.01 0.00 -0.60 0.00 0.00 56.93 56.29 1ss2 s PHE 134 Cb 0.00 -1.85 -0.02 0.00 0.51 0.00 0.00 43.02 41.65 1ss2 s PHE 134 CO 0.00 0.23 -0.11 -3.38 0.70 0.00 0.00 175.22 172.65 1ss2 s HIS 135 N -0.31 2.83 0.08 0.36 -3.43 -1.06 -4.26 115.29 109.49 1ss2 s HIS 135 Ca 0.06 -0.38 -0.30 0.00 -0.80 0.00 0.00 55.06 53.64 1ss2 s HIS 135 Cb -0.12 -1.78 -0.05 0.00 -1.43 0.00 0.00 32.58 29.19 1ss2 s HIS 135 CO 0.02 -0.01 1.00 -1.17 -2.00 0.00 0.00 174.74 172.59 1ss2 s LEU 136 N -0.10 4.45 -0.57 5.38 0.20 -1.26 -2.15 118.68 124.63 1ss2 s LEU 136 Ca -0.01 1.80 0.05 0.00 0.69 0.00 0.00 54.13 56.66 1ss2 s LEU 136 Cb -0.14 -3.58 0.19 0.00 -0.43 0.00 0.00 46.19 42.23 1ss2 s LEU 136 CO 0.03 -0.18 0.48 0.52 -0.29 0.00 0.00 176.35 176.91 1ss2 n VAL 137 N 3.19 0.55 0.00 1.68 0.31 -1.19 -4.96 118.33 117.91 1ss2 n VAL 137 Ca 0.04 -4.35 0.00 0.00 -0.01 0.00 0.00 64.34 60.02 1ss2 n VAL 137 Cb 0.49 -1.97 0.00 0.00 -0.91 0.00 0.00 33.84 31.45 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 2.07 -0.36 2.63 2.92 0.00 -1.26 -4.61 105.19 106.58 1ss2 n GLY 138 Ca 0.25 0.35 -0.23 0.00 0.00 0.00 0.00 46.02 46.39 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 4.86 0.27 1.61 2.88 -1.26 -4.59 113.62 117.40 1ss2 n SER 139 Ca 0.00 -2.33 0.18 0.00 -1.33 0.00 0.00 58.87 55.38 1ss2 n SER 139 Cb 0.00 -1.10 0.94 0.00 -0.75 0.00 0.00 64.21 63.30 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 6.37 0.00 -3.73 -3.46 0.87 -1.93 -3.41 113.55 108.25 1ss2 h SER 140 Ca 0.49 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.83 1ss2 h SER 140 Cb 0.18 0.00 -0.28 0.00 -0.44 0.00 0.00 62.40 61.86 1ss2 h SER 140 CO 1.46 0.00 -0.69 0.00 -0.53 0.00 0.00 176.83 177.07 1ss2 s ARG 141 N -4.48 0.03 -0.08 2.24 1.70 -1.26 -0.20 118.95 116.90 1ss2 s ARG 141 Ca -0.05 0.04 -0.04 0.00 -0.47 0.00 0.00 55.73 55.21 1ss2 s ARG 141 Cb 0.14 0.01 0.04 0.00 -0.57 0.00 0.00 34.95 34.57 1ss2 s ARG 141 CO 0.49 -0.01 0.18 -1.12 -1.08 0.00 0.00 175.30 173.76 1ss2 s SER 142 N 0.04 -0.16 -0.15 -2.89 0.01 -1.12 -4.45 113.70 104.98 1ss2 s SER 142 Ca -0.00 0.37 -0.12 0.00 1.31 0.00 0.00 55.95 57.52 1ss2 s SER 142 Cb -0.00 0.26 -0.05 0.00 0.21 0.00 0.00 66.02 66.44 1ss2 s SER 142 CO -0.00 -0.15 0.23 -0.69 0.41 0.00 0.00 173.24 173.04 1ss2 s VAL 143 N 1.17 5.34 -0.16 3.43 1.01 -1.26 -2.18 120.40 127.76 1ss2 s VAL 143 Ca -0.09 0.42 -0.06 0.00 0.00 0.00 0.00 61.98 62.25 1ss2 s VAL 143 Cb -0.11 -3.55 -0.24 0.00 0.00 0.00 0.00 36.38 32.48 1ss2 s VAL 143 CO -0.07 0.47 3.53 0.00 0.00 0.00 0.00 175.10 179.03 1ss2 s SER 145 N 1.94 7.49 -1.44 0.00 0.01 -0.52 -3.92 113.70 117.26 1ss2 s SER 145 Ca 0.67 1.78 -0.05 0.00 1.31 0.00 0.00 55.95 59.66 1ss2 s SER 145 Cb 0.31 -2.58 0.04 0.00 0.21 0.00 0.00 66.02 63.99 1ss2 s SER 145 CO -0.01 -0.05 0.65 1.67 0.41 0.00 0.00 173.24 175.90 1ss2 n GLN 146 N 2.73 -4.17 -3.90 12.44 7.27 -1.26 -1.39 117.38 129.11 1ss2 n GLN 146 Ca 0.02 0.50 -0.28 0.00 0.07 0.00 0.00 57.00 57.31 1ss2 n GLN 146 Cb 0.49 -4.97 0.01 0.00 2.41 0.00 0.00 30.24 28.19 1ss2 n GLN 146 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1ss2 n GLY 147 N -1.74 -0.39 3.61 1.69 0.00 -1.25 -4.96 105.19 102.16 1ss2 n GLY 147 Ca -0.20 0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.87 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 -6.46 0.65 0.16 1.61 0.74 -0.48 -4.38 119.66 111.50 1ss2 s GLN 148 Ca 0.38 0.58 -0.25 0.00 0.05 0.00 0.00 55.36 56.11 1ss2 s GLN 148 Cb -0.19 0.32 -0.08 0.00 1.10 0.00 0.00 33.01 34.15 1ss2 s GLN 148 CO 0.85 -0.12 0.77 -1.58 -0.55 0.00 0.00 175.29 174.66 1ss2 s TRP 149 N -0.12 3.90 0.12 1.67 0.52 -1.25 -1.44 118.94 122.35 1ss2 s TRP 149 Ca 0.00 1.63 -0.23 0.00 0.02 0.00 0.00 56.10 57.52 1ss2 s TRP 149 Cb -0.04 -2.76 -0.07 0.00 -1.15 0.00 0.00 33.47 29.45 1ss2 s TRP 149 CO -0.01 0.51 1.68 1.03 0.02 0.00 0.00 176.95 180.18 1ss2 h SER 150 N 4.35 -0.36 -3.83 2.95 0.87 -1.66 -3.42 113.55 112.45 1ss2 h SER 150 Ca -0.47 0.06 -0.69 0.00 -1.23 0.00 0.00 61.79 59.46 1ss2 h SER 150 Cb 1.21 0.16 -0.30 0.00 -0.44 0.00 0.00 62.40 63.02 1ss2 h SER 150 CO 0.66 -0.17 -0.86 0.42 -0.53 0.00 0.00 176.83 176.35 1ss2 s THR 151 N -6.15 2.25 0.47 2.23 -4.23 -1.26 -4.99 115.64 103.95 1ss2 s THR 151 Ca -0.14 -0.99 -0.23 0.00 -1.18 0.00 0.00 61.69 59.15 1ss2 s THR 151 Cb 0.09 -1.84 -0.07 0.00 1.34 0.00 0.00 72.50 72.01 1ss2 s THR 151 CO 0.67 0.57 1.25 -2.16 -0.54 0.00 0.00 174.62 174.40 1ss2 s PRO 152 N -0.08 3.67 -0.03 3.99 0.04 -1.26 -4.80 135.00 136.52 1ss2 s PRO 152 Ca -0.06 1.99 -0.38 0.00 0.04 0.00 0.00 61.00 62.59 1ss2 s PRO 152 Cb -0.14 -2.47 -0.17 0.00 0.04 0.00 0.00 34.50 31.76 1ss2 s PRO 152 CO 0.04 -0.69 1.41 1.17 0.04 0.00 0.00 177.00 178.98 1ss2 n LYS 153 N -0.45 0.95 0.00 4.56 4.81 -1.26 -4.32 118.16 122.46 1ss2 n LYS 153 Ca 0.07 0.35 0.00 0.00 -0.87 0.00 0.00 58.31 57.86 1ss2 n LYS 153 Cb 0.46 -1.97 0.00 0.00 0.02 0.00 0.00 35.03 33.54 1ss2 n LYS 153 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 1ss2 n PRO 154 N 3.10 3.53 -3.68 1.64 -0.04 -1.26 -4.91 135.00 133.38 1ss2 n PRO 154 Ca 0.21 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.52 1ss2 n PRO 154 Cb 0.15 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.53 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 2.20 -0.43 -0.14 0.54 -3.43 -1.26 -5.00 115.29 107.77 1ss2 s HIS 155 Ca 0.00 0.85 -0.12 0.00 -0.80 0.00 0.00 55.06 54.99 1ss2 s HIS 155 Cb 0.00 0.21 -0.05 0.00 -1.43 0.00 0.00 32.58 31.31 1ss2 s HIS 155 CO 0.00 -0.41 0.24 0.00 -2.00 0.00 0.00 174.74 172.58 1ss2 s GLN 157 N -0.01 3.47 -0.04 0.00 0.74 -0.91 -4.95 119.66 117.96 1ss2 s GLN 157 Ca 0.15 -0.27 -0.21 0.00 0.05 0.00 0.00 55.36 55.08 1ss2 s GLN 157 Cb -0.13 -3.08 -0.05 0.00 1.10 0.00 0.00 33.01 30.85 1ss2 s GLN 157 CO 0.04 0.61 0.60 0.54 -0.55 0.00 0.00 175.29 176.52 1ss2 s VAL 158 N -0.57 4.99 -2.00 1.34 0.11 -1.26 -2.58 120.40 120.43 1ss2 s VAL 158 Ca 0.11 1.24 0.15 0.00 -2.93 0.00 0.00 61.98 60.55 1ss2 s VAL 158 Cb -0.12 -3.93 0.44 0.00 -1.53 0.00 0.00 36.38 31.23 1ss2 s VAL 158 CO 0.02 0.37 1.33 0.59 -3.33 0.00 0.00 175.10 174.08