#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k48 s HIS 106 N 0.00 1.78 0.26 5.58 3.76 -1.26 -4.98 115.29 120.43 3k48 s HIS 106 Ca 0.00 -0.00 -0.31 0.00 -0.15 0.00 0.00 55.06 54.60 3k48 s HIS 106 Cb 0.00 -4.02 -0.13 0.00 1.11 0.00 0.00 32.58 29.55 3k48 s HIS 106 CO 0.00 -4.38 1.51 0.43 -0.85 0.00 0.00 174.74 171.45 3k48 n SER 107 N 7.21 3.30 -4.10 1.40 7.64 -1.26 -4.78 113.62 123.03 3k48 n SER 107 Ca 0.18 1.14 -0.09 0.00 1.01 0.00 0.00 58.87 61.11 3k48 n SER 107 Cb 0.42 -1.51 -0.10 0.00 -1.01 0.00 0.00 64.21 62.02 3k48 n SER 107 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 3k48 s VAL 108 N 0.00 0.14 -0.24 0.44 -7.23 0.08 -1.53 120.40 112.07 3k48 s VAL 108 Ca 0.66 -1.80 -0.18 0.00 -1.81 0.00 0.00 61.98 58.85 3k48 s VAL 108 Cb -0.57 -1.81 0.07 0.00 0.56 0.00 0.00 36.38 34.62 3k48 s VAL 108 CO 0.49 -0.65 0.61 -0.22 -0.31 0.00 0.00 175.10 175.01 3k48 s LEU 109 N -2.99 -0.48 -0.04 1.32 2.96 -0.73 -1.61 118.68 117.12 3k48 s LEU 109 Ca 0.17 1.27 0.02 0.00 -0.22 0.00 0.00 54.13 55.37 3k48 s LEU 109 Cb 0.07 2.08 0.01 0.00 0.50 0.00 0.00 46.19 48.85 3k48 s LEU 109 CO -0.03 -0.22 -0.10 -2.28 -1.32 0.00 0.00 176.35 172.41 3k48 s HIS 110 N 0.85 1.12 0.05 5.38 5.65 -1.05 -0.41 115.29 126.87 3k48 s HIS 110 Ca -0.04 -0.34 0.07 0.00 0.25 0.00 0.00 55.06 54.99 3k48 s HIS 110 Cb -0.05 -0.83 -0.03 0.00 -1.18 0.00 0.00 32.58 30.49 3k48 s HIS 110 CO -0.07 -0.18 -0.19 -0.51 -0.65 0.00 0.00 174.74 173.14 3k48 s LEU 111 N 0.50 2.19 0.14 8.88 1.43 0.22 -1.43 118.68 130.60 3k48 s LEU 111 Ca -0.09 -0.53 0.05 0.00 -1.03 0.00 0.00 54.13 52.53 3k48 s LEU 111 Cb -0.13 -0.88 -0.04 0.00 0.03 0.00 0.00 46.19 45.18 3k48 s LEU 111 CO 0.02 0.12 -0.12 0.68 0.23 0.00 0.00 176.35 177.27 3k48 s VAL 112 N -0.86 1.26 0.21 -1.59 -7.23 -0.08 -2.82 120.40 109.29 3k48 s VAL 112 Ca 0.06 -1.92 -0.30 0.00 -1.81 0.00 0.00 61.98 58.01 3k48 s VAL 112 Cb -0.09 -1.71 -0.09 0.00 0.56 0.00 0.00 36.38 35.05 3k48 s VAL 112 CO 0.02 -0.60 1.33 -2.84 -0.31 0.00 0.00 175.10 172.69 3k48 s PRO 113 N -3.28 4.37 -0.10 4.82 0.02 -1.26 -1.17 135.00 138.40 3k48 s PRO 113 Ca 0.14 2.09 0.20 0.00 0.02 0.00 0.00 61.00 63.45 3k48 s PRO 113 Cb -0.01 -3.18 -0.29 0.00 0.02 0.00 0.00 34.50 31.04 3k48 s PRO 113 CO 0.02 -0.27 0.29 1.55 -0.33 0.00 0.00 177.00 178.26 3k48 n VAL 114 N 2.49 0.59 -3.60 3.83 3.14 0.32 -4.85 118.33 120.26 3k48 n VAL 114 Ca 0.06 -0.64 -0.05 0.00 -2.96 0.00 0.00 64.34 60.75 3k48 n VAL 114 Cb 0.42 -0.20 -0.03 0.00 -1.06 0.00 0.00 33.84 32.97 3k48 n VAL 114 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 3k48 s ASN 115 N -4.86 -0.17 0.16 6.55 2.47 -1.20 -5.04 114.94 112.84 3k48 s ASN 115 Ca -0.09 0.09 0.11 0.00 0.42 0.00 0.00 52.86 53.39 3k48 s ASN 115 Cb 0.10 0.16 -0.04 0.00 -1.45 0.00 0.00 41.25 40.02 3k48 s ASN 115 CO 0.85 -0.22 -0.24 -0.51 -3.72 0.00 0.00 177.10 173.25 3k48 s ILE 116 N -1.86 2.22 -0.14 -5.21 2.07 -1.26 -1.36 121.20 115.67 3k48 s ILE 116 Ca 0.07 -1.89 -0.14 0.00 -1.41 0.00 0.00 60.65 57.28 3k48 s ILE 116 Cb -0.01 -2.01 0.04 0.00 0.13 0.00 0.00 42.46 40.61 3k48 s ILE 116 CO -0.04 -0.05 0.40 0.28 -1.91 0.00 0.00 174.94 173.61 3k48 s THR 117 N -1.44 0.01 -0.49 4.00 -1.32 -1.05 -4.95 115.64 110.40 3k48 s THR 117 Ca 0.17 -0.04 0.05 0.00 -1.21 0.00 0.00 61.69 60.66 3k48 s THR 117 Cb -0.09 -0.57 0.19 0.00 -1.51 0.00 0.00 72.50 70.52 3k48 s THR 117 CO 0.08 -0.02 0.77 -0.55 -2.21 0.00 0.00 174.62 172.68 3k48 s SER 118 N 0.05 -1.32 0.34 8.08 0.15 -1.26 -0.76 113.70 118.97 3k48 s SER 118 Ca -0.01 -1.51 -0.27 0.00 0.70 0.00 0.00 55.95 54.86 3k48 s SER 118 Cb -0.03 1.72 -0.13 0.00 -1.71 0.00 0.00 66.02 65.88 3k48 s SER 118 CO 0.01 -0.05 1.03 0.29 1.20 0.00 0.00 173.24 175.71 3k48 n LYS 119 N 3.00 1.42 -1.42 5.44 5.02 -1.26 -4.74 118.16 125.61 3k48 n LYS 119 Ca 0.17 0.50 -0.36 0.00 -2.02 0.00 0.00 58.31 56.59 3k48 n LYS 119 Cb 0.57 -1.95 0.07 0.00 -0.02 0.00 0.00 35.03 33.71 3k48 n LYS 119 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k48 n ALA 120 N 0.00 -0.43 -3.09 7.82 0.00 -1.26 -3.12 120.51 120.43 3k48 n ALA 120 Ca 0.09 -0.13 -0.23 0.00 0.00 0.00 0.00 53.44 53.17 3k48 n ALA 120 Cb 0.35 -2.04 0.03 0.00 0.00 0.00 0.00 19.45 17.78 3k48 n ALA 120 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3k48 n ASP 121 N -1.00 -5.63 -4.04 0.00 2.03 -1.26 -5.00 116.55 101.65 3k48 n ASP 121 Ca 0.13 -0.31 -0.07 0.00 0.52 0.00 0.00 54.79 55.05 3k48 n ASP 121 Cb 0.49 -4.56 -0.09 0.00 -0.72 0.00 0.00 41.12 36.23 3k48 n ASP 121 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 3k48 s SER 122 N -2.71 0.40 -0.64 1.67 1.04 -1.18 -5.08 113.70 107.20 3k48 s SER 122 Ca 0.33 -0.91 0.03 0.00 0.48 0.00 0.00 55.95 55.87 3k48 s SER 122 Cb -0.15 0.23 0.38 0.00 0.10 0.00 0.00 66.02 66.57 3k48 s SER 122 CO 0.40 -0.62 1.40 0.47 0.98 0.00 0.00 173.24 175.87 3k48 n ASP 123 N 0.12 5.70 -3.85 7.02 8.00 -1.26 -4.45 116.55 127.83 3k48 n ASP 123 Ca -0.15 -3.74 -0.12 0.00 0.71 0.00 0.00 54.79 51.49 3k48 n ASP 123 Cb 0.61 -0.72 -0.13 0.00 -0.02 0.00 0.00 41.12 40.86 3k48 n ASP 123 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3k48 s VAL 124 N -5.08 0.00 -0.10 2.53 1.01 -1.22 -2.77 120.40 114.77 3k48 s VAL 124 Ca 0.48 -0.02 0.03 0.00 0.00 0.00 0.00 61.98 62.47 3k48 s VAL 124 Cb 0.36 -0.11 -0.01 0.00 0.00 0.00 0.00 36.38 36.62 3k48 s VAL 124 CO -0.23 -0.01 -0.20 -0.89 0.00 0.00 0.00 175.10 173.77 3k48 s THR 125 N 0.00 2.43 0.38 3.92 2.01 0.39 -4.46 115.64 120.31 3k48 s THR 125 Ca -0.00 -0.89 0.08 0.00 0.31 0.00 0.00 61.69 61.18 3k48 s THR 125 Cb -0.01 -1.96 -0.04 0.00 0.01 0.00 0.00 72.50 70.50 3k48 s THR 125 CO 0.00 0.55 0.18 -1.61 -0.69 0.00 0.00 174.62 173.05 3k48 s GLU 126 N 0.23 2.32 -0.06 4.92 2.02 0.06 0.53 118.70 128.71 3k48 s GLU 126 Ca -0.13 -1.68 0.02 0.00 0.02 0.00 0.00 54.97 53.20 3k48 s GLU 126 Cb -0.16 -2.11 -0.03 0.00 0.10 0.00 0.00 34.13 31.93 3k48 s GLU 126 CO 0.07 -0.02 -0.11 0.08 0.02 0.00 0.00 175.26 175.29 3k48 s VAL 127 N -2.51 3.30 -0.23 2.63 1.01 -1.24 -2.53 120.40 120.83 3k48 s VAL 127 Ca 0.40 -0.63 -0.16 0.00 0.00 0.00 0.00 61.98 61.59 3k48 s VAL 127 Cb 0.00 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 3k48 s VAL 127 CO 0.23 0.59 0.43 -0.04 0.00 0.00 0.00 175.10 176.31 3k48 s MET 128 N -0.71 4.12 0.17 2.72 -1.94 -0.46 -4.33 119.30 118.87 3k48 s MET 128 Ca 0.11 0.22 0.04 0.00 -1.71 0.00 0.00 55.69 54.35 3k48 s MET 128 Cb -0.11 -3.59 -0.04 0.00 2.01 0.00 0.00 34.83 33.11 3k48 s MET 128 CO 0.01 -0.17 0.18 -1.58 -0.01 0.00 0.00 175.02 173.46 3k48 s TRP 129 N 1.71 3.24 -0.02 -0.03 0.52 0.02 -0.52 118.94 123.87 3k48 s TRP 129 Ca 0.19 0.01 -0.01 0.00 0.02 0.00 0.00 56.10 56.31 3k48 s TRP 129 Cb -0.15 -1.55 0.02 0.00 -1.15 0.00 0.00 33.47 30.64 3k48 s TRP 129 CO 0.09 0.52 0.05 1.14 0.02 0.00 0.00 176.95 178.76 3k48 s GLN 130 N -3.20 0.02 0.20 4.98 -2.07 -0.32 -4.59 119.66 114.68 3k48 s GLN 130 Ca 0.32 0.13 -0.30 0.00 -1.82 0.00 0.00 55.36 53.69 3k48 s GLN 130 Cb -0.10 -0.08 -0.08 0.00 -1.09 0.00 0.00 33.01 31.66 3k48 s GLN 130 CO 0.25 -0.07 1.15 -1.25 -1.32 0.00 0.00 175.29 174.05 3k48 s PRO 131 N 0.46 4.55 -0.01 9.60 0.04 -1.26 -0.91 135.00 147.47 3k48 s PRO 131 Ca -0.04 1.81 0.07 0.00 0.04 0.00 0.00 61.00 62.89 3k48 s PRO 131 Cb -0.05 -3.25 -0.11 0.00 0.04 0.00 0.00 34.50 31.13 3k48 s PRO 131 CO -0.02 0.01 0.16 1.33 0.04 0.00 0.00 177.00 178.53 3k48 n VAL 132 N 2.27 0.00 -4.40 -0.36 0.24 -0.52 -4.93 118.33 110.63 3k48 n VAL 132 Ca 0.03 -0.17 -0.19 0.00 -2.04 0.00 0.00 64.34 61.96 3k48 n VAL 132 Cb 0.45 0.35 -0.14 0.00 -1.47 0.00 0.00 33.84 33.03 3k48 n VAL 132 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 3k48 s LEU 133 N -3.49 2.08 -0.19 1.34 2.96 -1.19 -5.00 118.68 115.20 3k48 s LEU 133 Ca -0.03 -0.30 -0.12 0.00 -0.22 0.00 0.00 54.13 53.47 3k48 s LEU 133 Cb 0.05 -0.54 0.06 0.00 0.50 0.00 0.00 46.19 46.25 3k48 s LEU 133 CO 0.30 0.08 0.46 -0.60 -1.32 0.00 0.00 176.35 175.28 3k48 s ARG 134 N -0.61 0.47 -0.06 1.98 3.52 -1.26 -2.54 118.95 120.45 3k48 s ARG 134 Ca 0.02 0.81 -0.05 0.00 -0.13 0.00 0.00 55.73 56.38 3k48 s ARG 134 Cb -0.06 0.07 0.02 0.00 -1.56 0.00 0.00 34.95 33.42 3k48 s ARG 134 CO 0.00 -0.13 0.16 0.50 -0.81 0.00 0.00 175.30 175.02 3k48 s ARG 135 N 1.14 0.18 0.30 5.12 3.52 -0.63 -4.95 118.95 123.63 3k48 s ARG 135 Ca -0.07 0.25 0.00 0.00 -0.13 0.00 0.00 55.73 55.77 3k48 s ARG 135 Cb -0.07 0.06 0.00 0.00 -1.56 0.00 0.00 34.95 33.38 3k48 s ARG 135 CO -0.10 -0.04 0.00 0.41 -0.81 0.00 0.00 175.30 174.76 3k48 n GLY 136 N 3.15 -2.15 0.06 8.12 0.00 -1.26 -0.75 105.19 112.36 3k48 n GLY 136 Ca -0.14 -1.45 0.01 0.00 0.00 0.00 0.00 46.02 44.44 3k48 n GLY 136 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k48 n ARG 137 N -1.25 1.30 0.00 1.61 1.74 -1.26 -4.82 116.66 113.98 3k48 n ARG 137 Ca 0.00 -1.14 0.13 0.00 -0.77 0.00 0.00 57.85 56.07 3k48 n ARG 137 Cb 0.08 -0.79 0.68 0.00 -1.02 0.00 0.00 32.46 31.41 3k48 n ARG 137 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k48 n GLY 138 N -0.33 -1.04 3.13 -0.13 0.00 -1.26 -4.71 105.19 100.85 3k48 n GLY 138 Ca 0.02 -0.13 -0.09 0.00 0.00 0.00 0.00 46.02 45.81 3k48 n GLY 138 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k48 s LEU 139 N -2.41 2.50 -0.24 0.99 1.43 -1.26 -0.20 118.68 119.50 3k48 s LEU 139 Ca 0.28 -1.00 -0.13 0.00 -1.03 0.00 0.00 54.13 52.26 3k48 s LEU 139 Cb 0.17 0.06 0.07 0.00 0.03 0.00 0.00 46.19 46.53 3k48 s LEU 139 CO 0.36 -0.53 0.57 -0.70 0.23 0.00 0.00 176.35 176.28 3k48 s GLU 140 N -3.86 0.57 0.14 1.70 2.12 -0.21 -4.89 118.70 114.27 3k48 s GLU 140 Ca 0.09 1.06 -0.30 0.00 0.36 0.00 0.00 54.97 56.18 3k48 s GLU 140 Cb 0.06 0.12 -0.07 0.00 0.26 0.00 0.00 34.13 34.50 3k48 s GLU 140 CO -0.07 -0.16 1.15 0.00 -0.54 0.00 0.00 175.26 175.64 3k48 s ALA 141 N 1.64 3.39 -0.37 6.30 0.00 -1.26 -0.40 121.76 131.06 3k48 s ALA 141 Ca -0.09 0.86 0.02 0.00 0.00 0.00 0.00 51.96 52.74 3k48 s ALA 141 Cb -0.07 -3.40 0.15 0.00 0.00 0.00 0.00 23.12 19.81 3k48 s ALA 141 CO -0.17 -0.32 0.30 -1.14 0.00 0.00 0.00 175.76 174.43 3k48 s GLN 142 N 0.12 0.66 4.81 0.00 2.00 0.56 -4.93 119.66 122.87 3k48 s GLN 142 Ca 0.53 -1.32 0.00 0.00 -2.00 0.00 0.00 55.36 52.57 3k48 s GLN 142 Cb -0.30 -1.09 0.00 0.00 0.80 0.00 0.00 33.01 32.42 3k48 s GLN 142 CO 0.34 -1.24 0.00 0.41 -0.50 0.00 0.00 175.29 174.29 3k48 n GLY 143 N 3.84 2.52 0.00 2.59 0.00 -1.26 -1.99 105.19 110.89 3k48 n GLY 143 Ca 0.15 0.35 0.15 0.00 0.00 0.00 0.00 46.02 46.67 3k48 n GLY 143 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3k48 n ASP 144 N 8.29 0.00 -4.03 1.61 5.68 -1.26 -0.80 116.55 126.05 3k48 n ASP 144 Ca 0.00 -0.10 -0.10 0.00 -0.50 0.00 0.00 54.79 54.09 3k48 n ASP 144 Cb 0.00 -0.30 -0.11 0.00 -1.14 0.00 0.00 41.12 39.57 3k48 n ASP 144 CO 0.00 0.00 0.00 0.27 -1.33 0.00 0.00 177.20 176.14 3k48 s ILE 145 N -2.60 0.27 -0.18 2.12 -5.25 -0.84 -4.61 121.20 110.11 3k48 s ILE 145 Ca 0.27 -1.15 -0.00 0.00 -0.99 0.00 0.00 60.65 58.78 3k48 s ILE 145 Cb 0.20 -0.62 0.01 0.00 2.95 0.00 0.00 42.46 45.00 3k48 s ILE 145 CO 0.47 -0.57 -0.16 -0.69 -1.79 0.00 0.00 174.94 172.20 3k48 s VAL 146 N -1.94 2.50 0.11 8.37 1.01 -0.76 -0.32 120.40 129.37 3k48 s VAL 146 Ca -0.09 -0.80 -0.16 0.00 0.00 0.00 0.00 61.98 60.92 3k48 s VAL 146 Cb -0.06 -2.07 -0.07 0.00 0.00 0.00 0.00 36.38 34.18 3k48 s VAL 146 CO -0.02 0.51 0.55 -0.13 0.00 0.00 0.00 175.10 176.01 3k48 s ARG 147 N 1.13 4.06 -0.22 2.72 0.52 0.47 -0.42 118.95 127.20 3k48 s ARG 147 Ca 0.01 0.58 -0.10 0.00 -0.52 0.00 0.00 55.73 55.70 3k48 s ARG 147 Cb -0.14 -3.06 -0.05 0.00 0.52 0.00 0.00 34.95 32.23 3k48 s ARG 147 CO -0.06 0.55 0.13 0.08 0.02 0.00 0.00 175.30 176.02 3k48 s VAL 148 N -1.32 5.15 -0.24 3.52 1.01 0.19 -1.04 120.40 127.67 3k48 s VAL 148 Ca 0.34 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.42 3k48 s VAL 148 Cb -0.17 -3.38 -0.18 0.00 0.00 0.00 0.00 36.38 32.65 3k48 s VAL 148 CO 0.19 0.38 -0.15 1.87 0.00 0.00 0.00 175.10 177.38 3k48 n TRP 149 N 4.11 0.18 -3.68 5.22 -0.00 0.72 -1.09 117.44 122.90 3k48 n TRP 149 Ca -0.16 0.04 -0.37 0.00 -0.00 0.00 0.00 57.50 57.01 3k48 n TRP 149 Cb 0.52 -1.02 -0.11 0.00 -0.00 0.00 0.00 31.31 30.69 3k48 n TRP 149 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 177.69 177.18 3k48 s ASP 150 N -6.63 5.71 0.48 5.87 1.01 -1.02 -4.51 116.67 117.58 3k48 s ASP 150 Ca -0.33 -0.05 -0.23 0.00 0.71 0.00 0.00 52.55 52.64 3k48 s ASP 150 Cb 0.09 -2.04 -0.08 0.00 1.01 0.00 0.00 42.92 41.90 3k48 s ASP 150 CO 0.62 -0.01 1.18 0.41 0.21 0.00 0.00 175.17 177.57 3k48 n THR 151 N 4.81 3.03 0.00 -1.27 -1.04 -1.26 -4.53 114.28 114.03 3k48 n THR 151 Ca -0.15 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.36 3k48 n THR 151 Cb 0.52 -1.42 0.00 0.00 -1.82 0.00 0.00 70.33 67.61 3k48 n THR 151 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3k48 n GLY 152 N 0.97 1.63 3.68 3.41 0.00 -0.15 -4.94 105.19 109.80 3k48 n GLY 152 Ca 0.09 -1.26 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 3k48 n GLY 152 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k48 s ILE 153 N -1.96 4.84 -0.00 -0.61 -1.09 -1.26 -0.87 121.20 120.24 3k48 s ILE 153 Ca 0.00 1.85 0.06 0.00 -2.23 0.00 0.00 60.65 60.34 3k48 s ILE 153 Cb 0.00 -4.23 -0.02 0.00 -1.58 0.00 0.00 42.46 36.63 3k48 s ILE 153 CO 0.00 0.03 -0.20 -0.31 -1.23 0.00 0.00 174.94 173.23 3k48 s TYR 154 N 1.97 1.82 -0.08 3.97 1.51 0.20 -1.36 117.35 125.38 3k48 s TYR 154 Ca 0.44 -0.35 -0.30 0.00 -1.01 0.00 0.00 57.07 55.85 3k48 s TYR 154 Cb -0.18 -1.15 -0.02 0.00 -0.11 0.00 0.00 41.96 40.51 3k48 s TYR 154 CO 0.16 -0.00 1.05 -1.17 -1.11 0.00 0.00 175.55 174.48 3k48 s LEU 155 N -0.64 4.27 -0.15 -1.29 2.96 0.67 -0.73 118.68 123.77 3k48 s LEU 155 Ca 0.08 1.62 0.01 0.00 -0.22 0.00 0.00 54.13 55.62 3k48 s LEU 155 Cb -0.08 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 43.07 3k48 s LEU 155 CO -0.00 -0.46 -0.18 -0.22 -1.32 0.00 0.00 176.35 174.16 3k48 s LEU 156 N 1.94 1.94 0.01 -0.68 2.96 0.11 -1.34 118.68 123.62 3k48 s LEU 156 Ca 0.51 -0.56 0.03 0.00 -0.22 0.00 0.00 54.13 53.89 3k48 s LEU 156 Cb -0.20 -1.33 -0.01 0.00 0.50 0.00 0.00 46.19 45.15 3k48 s LEU 156 CO 0.20 0.02 -0.09 -0.72 -1.32 0.00 0.00 176.35 174.44 3k48 s TYR 157 N 1.12 0.78 -0.10 5.38 1.13 -0.32 -0.86 117.35 124.48 3k48 s TYR 157 Ca -0.01 -0.22 -0.04 0.00 -1.41 0.00 0.00 57.07 55.38 3k48 s TYR 157 Cb -0.14 -0.49 0.05 0.00 -1.10 0.00 0.00 41.96 40.28 3k48 s TYR 157 CO -0.07 -0.02 0.21 0.45 -2.51 0.00 0.00 175.55 173.62 3k48 s SER 158 N -0.56 0.09 -0.04 -0.18 0.15 -0.82 -0.54 113.70 111.82 3k48 s SER 158 Ca 0.01 0.45 0.06 0.00 0.70 0.00 0.00 55.95 57.17 3k48 s SER 158 Cb -0.05 0.39 -0.01 0.00 -1.71 0.00 0.00 66.02 64.64 3k48 s SER 158 CO 0.00 -0.19 -0.22 -1.58 1.20 0.00 0.00 173.24 172.45 3k48 s GLN 159 N 1.68 2.03 -0.02 5.44 0.74 0.66 -2.27 119.66 127.92 3k48 s GLN 159 Ca -0.05 -0.78 0.03 0.00 0.05 0.00 0.00 55.36 54.62 3k48 s GLN 159 Cb -0.11 -1.82 -0.00 0.00 1.10 0.00 0.00 33.01 32.18 3k48 s GLN 159 CO -0.07 0.38 -0.12 0.08 -0.55 0.00 0.00 175.29 175.01 3k48 s VAL 160 N -0.25 0.94 -0.27 1.34 1.01 -1.05 0.24 120.40 122.35 3k48 s VAL 160 Ca 0.01 -0.48 -0.07 0.00 0.00 0.00 0.00 61.98 61.44 3k48 s VAL 160 Cb -0.11 -0.81 -0.01 0.00 0.00 0.00 0.00 36.38 35.45 3k48 s VAL 160 CO 0.01 0.28 0.06 -0.22 0.00 0.00 0.00 175.10 175.23 3k48 s LEU 161 N -0.08 3.57 0.24 3.92 2.96 -1.21 -0.82 118.68 127.26 3k48 s LEU 161 Ca 0.01 -0.48 0.06 0.00 -0.22 0.00 0.00 54.13 53.50 3k48 s LEU 161 Cb -0.07 -1.88 -0.03 0.00 0.50 0.00 0.00 46.19 44.71 3k48 s LEU 161 CO 0.00 -0.11 0.24 -0.36 -1.32 0.00 0.00 176.35 174.80 3k48 s PHE 162 N 1.54 3.21 0.00 5.38 0.40 -0.42 -0.40 117.98 127.69 3k48 s PHE 162 Ca 0.04 -0.08 0.00 0.00 -0.60 0.00 0.00 56.93 56.29 3k48 s PHE 162 Cb -0.16 -1.45 0.00 0.00 0.51 0.00 0.00 43.02 41.92 3k48 s PHE 162 CO 0.02 0.50 0.13 1.58 0.70 0.00 0.00 175.22 178.15 3k48 n HIS 163 N -1.21 0.00 -1.86 0.36 -0.00 -0.92 -2.82 115.22 108.76 3k48 n HIS 163 Ca -0.08 -0.01 -0.34 0.00 0.46 0.00 0.00 57.72 57.75 3k48 n HIS 163 Cb 0.58 -0.00 0.04 0.00 -0.12 0.00 0.00 29.99 30.48 3k48 n HIS 163 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 3k48 s ASP 164 N -0.02 5.17 0.00 0.26 1.11 -1.26 -4.79 116.67 117.14 3k48 s ASP 164 Ca 0.00 2.10 0.24 0.00 0.18 0.00 0.00 52.55 55.07 3k48 s ASP 164 Cb 0.00 -2.56 0.34 0.00 1.07 0.00 0.00 42.92 41.77 3k48 s ASP 164 CO 0.00 -1.59 1.30 0.55 1.18 0.00 0.00 175.17 176.61 3k48 n VAL 165 N -2.13 0.00 -2.13 -1.27 3.14 -1.26 -4.79 118.33 109.89 3k48 n VAL 165 Ca 0.11 -0.11 -0.38 0.00 -2.96 0.00 0.00 64.34 61.00 3k48 n VAL 165 Cb 0.51 0.67 -0.03 0.00 -1.06 0.00 0.00 33.84 33.93 3k48 n VAL 165 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 3k48 s THR 166 N -2.70 3.42 0.00 1.55 -1.32 -1.26 -4.62 115.64 110.71 3k48 s THR 166 Ca 0.17 0.20 0.00 0.00 -1.21 0.00 0.00 61.69 60.85 3k48 s THR 166 Cb 0.18 -4.11 0.00 0.00 -1.51 0.00 0.00 72.50 67.06 3k48 s THR 166 CO 0.64 -1.07 0.00 2.22 -2.21 0.00 0.00 174.62 174.19 3k48 n PHE 167 N 12.24 0.00 -3.43 9.09 1.16 -1.26 -4.20 117.46 131.07 3k48 n PHE 167 Ca 0.19 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.63 3k48 n PHE 167 Cb 0.51 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.28 3k48 n PHE 167 CO 0.00 0.00 0.00 -0.08 -1.87 0.00 0.00 176.76 174.81 3k48 s THR 168 N 0.00 -0.47 0.53 1.97 -1.32 -1.26 -1.73 115.64 113.36 3k48 s THR 168 Ca 0.00 -0.08 0.08 0.00 -1.21 0.00 0.00 61.69 60.48 3k48 s THR 168 Cb 0.00 -0.74 0.05 0.00 -1.51 0.00 0.00 72.50 70.30 3k48 s THR 168 CO 0.00 -0.15 0.56 -0.04 -2.21 0.00 0.00 174.62 172.78 3k48 s MET 169 N 2.45 2.35 0.00 7.08 1.00 0.17 -4.91 119.30 127.44 3k48 s MET 169 Ca 0.10 -1.75 0.00 0.00 0.00 0.00 0.00 55.69 54.04 3k48 s MET 169 Cb -0.15 -2.39 0.00 0.00 0.00 0.00 0.00 34.83 32.28 3k48 s MET 169 CO -0.14 -0.62 0.00 0.41 0.00 0.00 0.00 175.02 174.67 3k48 n GLY 170 N -1.92 -1.85 3.22 -0.03 0.00 -1.26 0.20 105.19 103.56 3k48 n GLY 170 Ca 0.06 -1.39 -0.14 0.00 0.00 0.00 0.00 46.02 44.55 3k48 n GLY 170 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3k48 s GLN 171 N -1.90 0.97 -0.23 1.61 0.00 -0.80 -4.25 119.66 115.05 3k48 s GLN 171 Ca 0.00 -1.32 0.02 0.00 -0.00 0.00 0.00 55.36 54.06 3k48 s GLN 171 Cb 0.00 -0.60 0.05 0.00 0.00 0.00 0.00 33.01 32.46 3k48 s GLN 171 CO 0.00 0.08 -0.14 0.08 0.00 0.00 0.00 175.29 175.31 3k48 s VAL 172 N -2.92 2.13 -0.14 3.63 1.01 -0.20 -1.52 120.40 122.38 3k48 s VAL 172 Ca 0.12 -1.38 -0.15 0.00 0.00 0.00 0.00 61.98 60.57 3k48 s VAL 172 Cb 0.00 -2.12 -0.05 0.00 0.00 0.00 0.00 36.38 34.21 3k48 s VAL 172 CO 0.00 0.18 0.34 -0.69 0.00 0.00 0.00 175.10 174.94 3k48 s VAL 173 N 1.17 5.26 0.10 2.92 1.01 -0.28 -1.84 120.40 128.74 3k48 s VAL 173 Ca -0.04 0.67 -0.00 0.00 0.00 0.00 0.00 61.98 62.60 3k48 s VAL 173 Cb -0.17 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 3k48 s VAL 173 CO -0.08 0.39 0.00 -0.44 0.00 0.00 0.00 175.10 174.97 3k48 s SER 174 N 0.40 0.58 0.17 3.32 0.01 -0.92 -0.99 113.70 116.27 3k48 s SER 174 Ca 0.19 -1.10 0.11 0.00 1.31 0.00 0.00 55.95 56.46 3k48 s SER 174 Cb -0.14 0.21 -0.04 0.00 0.21 0.00 0.00 66.02 66.26 3k48 s SER 174 CO 0.06 -0.63 -0.23 0.00 0.41 0.00 0.00 173.24 172.85 3k48 s ARG 175 N -3.96 1.56 -0.04 12.44 1.70 -0.63 -2.10 118.95 127.93 3k48 s ARG 175 Ca 0.16 -1.42 -0.01 0.00 -0.47 0.00 0.00 55.73 53.99 3k48 s ARG 175 Cb 0.07 -1.92 0.03 0.00 -0.57 0.00 0.00 34.95 32.56 3k48 s ARG 175 CO -0.03 0.42 0.04 -1.21 -1.08 0.00 0.00 175.30 173.44 3k48 s GLU 176 N -2.46 0.08 -0.29 3.89 2.02 -0.45 -1.13 118.70 120.36 3k48 s GLU 176 Ca 0.19 0.26 -0.16 0.00 0.02 0.00 0.00 54.97 55.28 3k48 s GLU 176 Cb -0.09 -0.52 0.15 0.00 0.10 0.00 0.00 34.13 33.78 3k48 s GLU 176 CO 0.09 -0.26 1.01 0.20 0.02 0.00 0.00 175.26 176.32 3k48 s GLY 177 N 1.75 0.05 -0.50 -1.39 0.00 -0.92 -1.88 107.32 104.42 3k48 s GLY 177 Ca -0.00 3.21 -0.02 0.00 0.00 0.00 0.00 44.72 47.91 3k48 s GLY 177 CO -0.03 2.68 0.21 -1.06 0.00 0.00 0.00 173.10 174.90 3k48 n GLN 178 N 3.77 -1.67 -1.00 2.90 6.02 -1.26 -3.11 117.38 123.03 3k48 n GLN 178 Ca -0.17 0.29 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 3k48 n GLN 178 Cb 0.57 -3.87 0.00 0.00 1.02 0.00 0.00 30.24 27.96 3k48 n GLN 178 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3k48 n GLY 179 N -1.00 0.59 3.86 1.08 0.00 -1.26 -5.03 105.19 103.44 3k48 n GLY 179 Ca -0.03 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.71 3k48 n GLY 179 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k48 s ARG 180 N -0.04 2.24 0.04 1.61 0.52 -1.18 -5.16 118.95 116.98 3k48 s ARG 180 Ca 0.00 -2.10 -0.16 0.00 -0.52 0.00 0.00 55.73 52.94 3k48 s ARG 180 Cb 0.00 -1.96 0.03 0.00 0.52 0.00 0.00 34.95 33.54 3k48 s ARG 180 CO 0.00 -0.53 0.37 0.50 0.02 0.00 0.00 175.30 175.66 3k48 s ARG 181 N -4.17 0.87 -0.25 3.54 3.52 -1.26 -2.18 118.95 119.02 3k48 s ARG 181 Ca 0.27 -0.40 -0.05 0.00 -0.13 0.00 0.00 55.73 55.43 3k48 s ARG 181 Cb -0.01 0.38 0.13 0.00 -1.56 0.00 0.00 34.95 33.89 3k48 s ARG 181 CO 0.17 -0.29 0.48 -2.00 -0.81 0.00 0.00 175.30 172.85 3k48 s GLU 182 N -2.41 0.43 -0.08 5.12 2.12 -0.28 -4.98 118.70 118.62 3k48 s GLU 182 Ca -0.06 0.93 -0.29 0.00 0.36 0.00 0.00 54.97 55.91 3k48 s GLU 182 Cb -0.01 0.21 -0.06 0.00 0.26 0.00 0.00 34.13 34.53 3k48 s GLU 182 CO -0.02 -0.45 1.75 0.99 -0.54 0.00 0.00 175.26 176.98 3k48 s THR 183 N 2.69 3.45 -0.13 -1.70 2.01 -1.26 -1.60 115.64 119.10 3k48 s THR 183 Ca 0.07 0.54 -0.16 0.00 0.31 0.00 0.00 61.69 62.45 3k48 s THR 183 Cb -0.14 -3.38 -0.14 0.00 0.01 0.00 0.00 72.50 68.85 3k48 s THR 183 CO -0.17 -0.09 0.34 -0.07 -0.69 0.00 0.00 174.62 173.94 3k48 h LEU 184 N 10.91 0.00 -7.23 4.42 3.38 -1.40 -3.49 115.31 121.91 3k48 h LEU 184 Ca -0.40 -0.49 -0.05 0.00 0.09 0.00 0.00 57.88 57.03 3k48 h LEU 184 Cb 1.19 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.80 3k48 h LEU 184 CO 0.96 0.86 0.04 0.72 0.09 0.00 0.00 178.44 181.11 3k48 s PHE 185 N -2.00 -0.37 0.28 1.13 -0.12 -1.12 -5.04 117.98 110.74 3k48 s PHE 185 Ca -0.13 0.20 0.12 0.00 -0.05 0.00 0.00 56.93 57.07 3k48 s PHE 185 Cb -0.00 0.37 -0.05 0.00 -0.63 0.00 0.00 43.02 42.70 3k48 s PHE 185 CO 0.39 -0.72 -0.19 1.03 -0.05 0.00 0.00 175.22 175.68 3k48 s ARG 186 N -3.32 1.68 -0.12 1.99 0.52 -1.26 -1.13 118.95 117.32 3k48 s ARG 186 Ca -0.00 -1.78 -0.00 0.00 -0.52 0.00 0.00 55.73 53.42 3k48 s ARG 186 Cb 0.00 -1.74 0.02 0.00 0.52 0.00 0.00 34.95 33.76 3k48 s ARG 186 CO -0.09 0.31 -0.08 0.00 0.02 0.00 0.00 175.30 175.46 3k48 s ILE 188 N 1.68 2.99 -0.15 0.00 1.09 -1.26 -1.91 121.20 123.63 3k48 s ILE 188 Ca 0.05 -0.66 0.01 0.00 -1.10 0.00 0.00 60.65 58.95 3k48 s ILE 188 Cb -0.13 -2.36 0.00 0.00 -1.06 0.00 0.00 42.46 38.92 3k48 s ILE 188 CO -0.08 0.43 -0.17 -0.13 -0.10 0.00 0.00 174.94 174.89 3k48 s ARG 189 N 1.42 3.17 -0.02 2.79 1.81 0.13 -4.99 118.95 123.26 3k48 s ARG 189 Ca 0.05 -0.77 -0.30 0.00 -1.72 0.00 0.00 55.73 52.99 3k48 s ARG 189 Cb -0.14 -2.57 -0.03 0.00 -0.45 0.00 0.00 34.95 31.75 3k48 s ARG 189 CO -0.06 0.02 1.09 0.45 -0.68 0.00 0.00 175.30 176.12 3k48 s SER 190 N 0.78 7.20 0.01 0.23 0.15 -1.26 0.45 113.70 121.26 3k48 s SER 190 Ca -0.06 1.75 -0.07 0.00 0.70 0.00 0.00 55.95 58.26 3k48 s SER 190 Cb -0.15 -2.57 -0.05 0.00 -1.71 0.00 0.00 66.02 61.54 3k48 s SER 190 CO 0.00 -0.43 0.29 -0.04 1.20 0.00 0.00 173.24 174.26 3k48 s MET 191 N 1.53 3.61 1.01 5.44 1.00 -0.70 -4.94 119.30 126.25 3k48 s MET 191 Ca 0.54 -0.02 -0.16 0.00 0.00 0.00 0.00 55.69 56.05 3k48 s MET 191 Cb -0.23 -3.08 0.20 0.00 0.00 0.00 0.00 34.83 31.72 3k48 s MET 191 CO 0.25 0.65 1.23 -1.25 0.00 0.00 0.00 175.02 175.89 3k48 s PRO 192 N -1.70 0.33 0.03 2.03 0.04 -1.26 -4.47 135.00 129.99 3k48 s PRO 192 Ca 0.27 -0.17 0.07 0.00 0.04 0.00 0.00 61.00 61.21 3k48 s PRO 192 Cb -0.13 -1.79 -0.23 0.00 0.04 0.00 0.00 34.50 32.39 3k48 s PRO 192 CO 0.16 -2.66 0.94 0.66 0.04 0.00 0.00 177.00 176.13 3k48 h SER 193 N -1.82 0.09 -3.02 6.66 4.64 -1.97 -3.42 113.55 114.71 3k48 h SER 193 Ca -0.46 -0.13 -0.57 0.00 -0.47 0.00 0.00 61.79 60.16 3k48 h SER 193 Cb 1.27 -0.03 -0.05 0.00 -0.31 0.00 0.00 62.40 63.28 3k48 h SER 193 CO 0.43 1.11 0.87 -0.62 -0.87 0.00 0.00 176.83 177.74 3k48 s ASP 194 N -6.53 6.98 0.57 4.97 2.15 -1.26 -4.94 116.67 118.61 3k48 s ASP 194 Ca -0.04 1.50 0.27 0.00 0.43 0.00 0.00 52.55 54.71 3k48 s ASP 194 Cb 0.08 -2.54 1.54 0.00 -0.30 0.00 0.00 42.92 41.71 3k48 s ASP 194 CO 0.83 -0.76 2.04 -0.65 -0.17 0.00 0.00 175.17 176.46 3k48 h PRO 195 N 8.00 0.00 0.00 4.34 0.11 -1.96 -2.11 132.00 140.38 3k48 h PRO 195 Ca -0.23 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.69 3k48 h PRO 195 Cb 1.08 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.17 3k48 h PRO 195 CO 0.98 0.00 -0.94 -0.44 -0.21 0.00 0.00 178.00 177.39 3k48 h ASP 196 N 0.00 0.00 0.35 -2.05 3.32 -1.97 -3.19 116.42 112.88 3k48 h ASP 196 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 3k48 h ASP 196 Cb 0.72 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.27 3k48 h ASP 196 CO -0.00 0.83 -0.18 0.54 -1.72 0.00 0.00 179.24 178.72 3k48 n ARG 197 N -3.26 0.67 -1.56 3.56 1.74 -0.85 -4.71 116.66 112.26 3k48 n ARG 197 Ca -0.01 -0.30 -0.34 0.00 -0.77 0.00 0.00 57.85 56.43 3k48 n ARG 197 Cb 0.89 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.79 3k48 n ARG 197 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3k48 n ALA 198 N -0.90 6.94 -3.62 7.54 0.00 -0.89 -4.79 120.51 124.79 3k48 n ALA 198 Ca 0.13 -3.44 -0.28 0.00 0.00 0.00 0.00 53.44 49.85 3k48 n ALA 198 Cb 0.31 -2.80 -0.17 0.00 0.00 0.00 0.00 19.45 16.79 3k48 n ALA 198 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3k48 s TYR 199 N 0.10 1.88 -0.16 0.00 1.51 -1.26 -4.08 117.35 115.33 3k48 s TYR 199 Ca 0.62 -0.85 -0.10 0.00 -1.01 0.00 0.00 57.07 55.72 3k48 s TYR 199 Cb 0.23 -1.36 0.05 0.00 -0.11 0.00 0.00 41.96 40.77 3k48 s TYR 199 CO -0.09 -0.44 0.40 -0.80 -1.11 0.00 0.00 175.55 173.51 3k48 s ASN 200 N 0.95 -0.49 0.35 2.29 0.01 -1.13 -5.03 114.94 111.90 3k48 s ASN 200 Ca -0.08 0.86 -0.13 0.00 -0.71 0.00 0.00 52.86 52.81 3k48 s ASN 200 Cb -0.15 0.77 -0.08 0.00 0.41 0.00 0.00 41.25 42.21 3k48 s ASN 200 CO -0.01 -0.18 0.74 -0.94 -1.51 0.00 0.00 177.10 175.20 3k48 s SER 201 N 1.11 6.65 -0.21 -1.22 1.04 -1.26 -1.30 113.70 118.52 3k48 s SER 201 Ca -0.07 1.19 -0.02 0.00 0.48 0.00 0.00 55.95 57.53 3k48 s SER 201 Cb -0.07 -2.34 0.06 0.00 0.10 0.00 0.00 66.02 63.77 3k48 s SER 201 CO -0.09 -0.28 0.01 0.00 0.98 0.00 0.00 173.24 173.85 3k48 s TYR 203 N 1.72 2.97 0.07 0.00 6.14 -1.26 -2.54 117.35 124.44 3k48 s TYR 203 Ca -0.02 -0.29 -0.09 0.00 0.64 0.00 0.00 57.07 57.31 3k48 s TYR 203 Cb -0.18 -1.88 -0.00 0.00 0.42 0.00 0.00 41.96 40.32 3k48 s TYR 203 CO -0.07 0.02 0.19 0.45 0.64 0.00 0.00 175.55 176.77 3k48 s SER 204 N 0.09 0.09 0.10 4.32 0.15 -0.96 -4.99 113.70 112.50 3k48 s SER 204 Ca -0.02 -0.54 -0.26 0.00 0.70 0.00 0.00 55.95 55.83 3k48 s SER 204 Cb -0.14 0.32 0.08 0.00 -1.71 0.00 0.00 66.02 64.56 3k48 s SER 204 CO 0.03 -0.66 0.86 0.00 1.20 0.00 0.00 173.24 174.68 3k48 s ALA 205 N -3.33 -1.67 0.06 5.45 0.00 -1.26 -1.94 121.76 119.06 3k48 s ALA 205 Ca 0.01 0.48 -0.26 0.00 0.00 0.00 0.00 51.96 52.19 3k48 s ALA 205 Cb 0.03 0.61 0.09 0.00 0.00 0.00 0.00 23.12 23.84 3k48 s ALA 205 CO -0.08 -0.87 1.18 0.20 0.00 0.00 0.00 175.76 176.19 3k48 s GLY 206 N -2.73 -0.12 -0.22 0.00 0.00 -0.04 -5.00 107.32 99.20 3k48 s GLY 206 Ca 0.08 0.07 -0.04 0.00 0.00 0.00 0.00 44.72 44.82 3k48 s GLY 206 CO -0.04 2.87 -0.03 0.14 0.00 0.00 0.00 173.10 176.05 3k48 s VAL 207 N -2.27 3.50 -0.01 1.40 1.01 -1.26 0.06 120.40 122.84 3k48 s VAL 207 Ca 0.22 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 61.77 3k48 s VAL 207 Cb -0.00 -2.59 -0.01 0.00 0.00 0.00 0.00 36.38 33.78 3k48 s VAL 207 CO 0.01 0.42 -0.07 -0.36 0.00 0.00 0.00 175.10 175.09 3k48 s PHE 208 N 1.40 0.65 -0.33 5.22 0.08 0.09 -4.94 117.98 120.16 3k48 s PHE 208 Ca 0.05 -0.12 -0.28 0.00 0.12 0.00 0.00 56.93 56.69 3k48 s PHE 208 Cb -0.14 -0.42 -0.02 0.00 -0.57 0.00 0.00 43.02 41.87 3k48 s PHE 208 CO -0.02 -0.01 1.75 -1.58 -0.10 0.00 0.00 175.22 175.26 3k48 s HIS 209 N -0.17 1.88 -0.08 0.36 5.65 -1.26 -0.63 115.29 121.04 3k48 s HIS 209 Ca 0.03 0.62 0.00 0.00 0.25 0.00 0.00 55.06 55.96 3k48 s HIS 209 Cb -0.03 -4.15 -0.03 0.00 -1.18 0.00 0.00 32.58 27.19 3k48 s HIS 209 CO -0.00 -2.86 -0.07 -0.51 -0.65 0.00 0.00 174.74 170.65 3k48 s LEU 210 N 6.65 3.17 0.08 8.88 1.43 -0.05 -4.97 118.68 133.87 3k48 s LEU 210 Ca 0.78 -0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.85 3k48 s LEU 210 Cb -0.22 -1.70 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 3k48 s LEU 210 CO 0.34 0.34 0.18 -1.00 0.23 0.00 0.00 176.35 176.44 3k48 s HIS 211 N -0.66 3.41 0.25 0.29 3.76 -1.26 -0.97 115.29 120.10 3k48 s HIS 211 Ca 0.10 0.18 -0.31 0.00 -0.15 0.00 0.00 55.06 54.87 3k48 s HIS 211 Cb -0.11 -1.70 -0.12 0.00 1.11 0.00 0.00 32.58 31.76 3k48 s HIS 211 CO 0.02 0.56 1.66 0.94 -0.85 0.00 0.00 174.74 177.07 3k48 n GLN 212 N 0.19 2.74 0.00 1.40 7.27 -1.26 -2.04 117.38 125.68 3k48 n GLN 212 Ca -0.06 0.98 0.00 0.00 0.07 0.00 0.00 57.00 57.99 3k48 n GLN 212 Cb 0.52 -2.80 0.00 0.00 2.41 0.00 0.00 30.24 30.37 3k48 n GLN 212 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3k48 n GLY 213 N 3.10 0.04 3.72 1.69 0.00 -0.25 -4.97 105.19 108.52 3k48 n GLY 213 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3k48 n GLY 213 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3k48 s ASP 214 N -2.02 7.27 -0.20 1.61 1.11 -0.87 -4.79 116.67 118.78 3k48 s ASP 214 Ca 0.00 1.89 -0.11 0.00 0.18 0.00 0.00 52.55 54.51 3k48 s ASP 214 Cb 0.00 -2.58 -0.05 0.00 1.07 0.00 0.00 42.92 41.36 3k48 s ASP 214 CO 0.00 -0.30 0.15 -0.63 1.18 0.00 0.00 175.17 175.58 3k48 s ILE 215 N 0.63 5.39 -0.14 0.77 1.01 -0.79 -0.64 121.20 127.43 3k48 s ILE 215 Ca 0.53 0.23 -0.04 0.00 0.00 0.00 0.00 60.65 61.37 3k48 s ILE 215 Cb -0.26 -3.49 -0.03 0.00 0.01 0.00 0.00 42.46 38.68 3k48 s ILE 215 CO 0.30 0.41 0.01 -0.63 0.00 0.00 0.00 174.94 175.03 3k48 s ILE 216 N 0.53 4.34 0.14 2.92 -1.09 0.43 -1.35 121.20 127.13 3k48 s ILE 216 Ca 0.09 -0.21 0.05 0.00 -2.23 0.00 0.00 60.65 58.35 3k48 s ILE 216 Cb -0.12 -2.89 -0.04 0.00 -1.58 0.00 0.00 42.46 37.83 3k48 s ILE 216 CO -0.00 0.53 -0.12 0.42 -1.23 0.00 0.00 174.94 174.54 3k48 s THR 217 N -0.13 1.27 -0.20 2.92 -4.23 -0.89 -1.83 115.64 112.56 3k48 s THR 217 Ca 0.05 -1.90 -0.02 0.00 -1.18 0.00 0.00 61.69 58.63 3k48 s THR 217 Cb -0.13 -1.70 0.06 0.00 1.34 0.00 0.00 72.50 72.08 3k48 s THR 217 CO 0.02 -0.58 0.02 -0.69 -0.54 0.00 0.00 174.62 172.84 3k48 s VAL 218 N -2.73 0.69 -0.07 2.29 1.01 -1.26 -2.17 120.40 118.16 3k48 s VAL 218 Ca 0.13 -0.65 0.05 0.00 0.00 0.00 0.00 61.98 61.51 3k48 s VAL 218 Cb -0.01 -1.15 -0.01 0.00 0.00 0.00 0.00 36.38 35.21 3k48 s VAL 218 CO 0.02 -0.17 -0.24 -0.54 0.00 0.00 0.00 175.10 174.17 3k48 s LYS 219 N 1.78 2.58 -0.33 2.72 1.02 -0.77 -3.71 119.74 123.04 3k48 s LYS 219 Ca -0.02 -0.86 -0.15 0.00 0.02 0.00 0.00 55.97 54.96 3k48 s LYS 219 Cb -0.17 -2.12 -0.02 0.00 -0.52 0.00 0.00 37.83 35.00 3k48 s LYS 219 CO -0.08 0.31 0.36 0.42 -0.92 0.00 0.00 175.35 175.45 3k48 s ILE 220 N -0.00 5.17 0.00 2.17 1.09 0.19 -1.03 121.20 128.78 3k48 s ILE 220 Ca -0.08 0.13 0.00 0.00 -1.10 0.00 0.00 60.65 59.60 3k48 s ILE 220 Cb -0.15 -3.80 0.00 0.00 -1.06 0.00 0.00 42.46 37.45 3k48 s ILE 220 CO 0.05 -0.05 0.37 -2.65 -0.10 0.00 0.00 174.94 172.55 3k48 n PRO 221 N 5.38 0.32 -4.14 2.79 -0.02 -1.26 -0.47 135.00 137.60 3k48 n PRO 221 Ca -0.09 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.25 3k48 n PRO 221 Cb 0.50 -1.34 -0.11 0.00 -0.02 0.00 0.00 33.50 32.52 3k48 n PRO 221 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3k48 s ARG 222 N 0.79 0.74 0.21 -0.52 3.00 -1.12 -4.67 118.95 117.39 3k48 s ARG 222 Ca 0.00 -1.02 -0.30 0.00 0.00 0.00 0.00 55.73 54.41 3k48 s ARG 222 Cb 0.00 -0.47 -0.08 0.00 0.00 0.00 0.00 34.95 34.39 3k48 s ARG 222 CO 0.00 0.08 1.10 0.00 0.00 0.00 0.00 175.30 176.48 3k48 s ALA 223 N -2.04 3.39 -1.27 2.13 0.00 -1.26 -1.68 121.76 121.03 3k48 s ALA 223 Ca 0.00 0.85 -0.21 0.00 0.00 0.00 0.00 51.96 52.59 3k48 s ALA 223 Cb -0.05 -3.34 0.02 0.00 0.00 0.00 0.00 23.12 19.74 3k48 s ALA 223 CO 0.00 -0.19 0.58 0.09 0.00 0.00 0.00 175.76 176.24 3k48 n ASN 224 N 1.95 -3.22 -4.73 0.00 3.02 -1.26 -4.90 115.26 106.13 3k48 n ASN 224 Ca 0.01 -1.18 -0.42 0.00 -0.03 0.00 0.00 54.58 52.97 3k48 n ASN 224 Cb 0.46 -2.35 -0.03 0.00 -0.61 0.00 0.00 39.78 37.24 3k48 n ASN 224 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k48 s ALA 225 N -3.69 3.52 -0.66 5.41 0.00 -1.26 -4.96 121.76 120.12 3k48 s ALA 225 Ca 0.35 1.06 -0.27 0.00 0.00 0.00 0.00 51.96 53.09 3k48 s ALA 225 Cb -0.17 -3.49 0.02 0.00 0.00 0.00 0.00 23.12 19.49 3k48 s ALA 225 CO 0.93 -0.53 1.35 0.15 0.00 0.00 0.00 175.76 177.67 3k48 s LYS 226 N 0.41 3.22 0.07 0.00 1.02 -1.26 -4.99 119.74 118.21 3k48 s LYS 226 Ca 0.59 0.09 0.04 0.00 0.02 0.00 0.00 55.97 56.70 3k48 s LYS 226 Cb -0.35 -4.16 -0.03 0.00 -0.52 0.00 0.00 37.83 32.77 3k48 s LYS 226 CO 0.34 -2.08 -0.11 -0.48 -0.92 0.00 0.00 175.35 172.11 3k48 s LEU 227 N 6.00 2.33 0.25 3.17 0.05 -1.26 -2.17 118.68 127.05 3k48 s LEU 227 Ca 0.44 -0.68 -0.30 0.00 0.05 0.00 0.00 54.13 53.64 3k48 s LEU 227 Cb -0.09 -0.32 -0.09 0.00 -2.05 0.00 0.00 46.19 43.64 3k48 s LEU 227 CO 0.20 -0.19 1.09 -0.55 -0.55 0.00 0.00 176.35 176.34 3k48 s SER 228 N -1.99 7.30 0.00 1.48 0.15 0.46 -4.93 113.70 116.17 3k48 s SER 228 Ca -0.01 2.19 0.26 0.00 0.70 0.00 0.00 55.95 59.09 3k48 s SER 228 Cb -0.07 -2.62 0.60 0.00 -1.71 0.00 0.00 66.02 62.22 3k48 s SER 228 CO 0.01 -0.14 1.47 0.18 1.20 0.00 0.00 173.24 175.96 3k48 n LEU 229 N 1.56 0.73 -4.65 3.45 4.77 -1.26 -4.43 117.00 117.17 3k48 n LEU 229 Ca -0.00 -0.12 -0.48 0.00 -0.03 0.00 0.00 56.01 55.38 3k48 n LEU 229 Cb 0.45 -0.19 -0.04 0.00 -2.33 0.00 0.00 43.42 41.31 3k48 n LEU 229 CO 0.54 0.16 1.08 -0.24 -1.33 0.00 0.00 177.39 177.59 3k48 n SER 230 N -1.14 2.62 0.29 -1.43 2.88 -1.26 -4.29 113.62 111.28 3k48 n SER 230 Ca 0.08 1.10 0.15 0.00 -1.33 0.00 0.00 58.87 58.87 3k48 n SER 230 Cb 0.34 -1.36 0.88 0.00 -0.75 0.00 0.00 64.21 63.33 3k48 n SER 230 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3k48 h PRO 231 N 5.31 0.00 -0.40 -1.46 0.13 -1.90 -0.43 132.00 133.25 3k48 h PRO 231 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3k48 h PRO 231 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 3k48 h PRO 231 CO 0.84 0.04 0.00 -2.39 -0.23 0.00 0.00 178.00 176.26 3k48 n HIS 232 N -3.72 0.52 -0.09 1.56 1.44 -1.26 -4.50 115.22 109.16 3k48 n HIS 232 Ca -0.03 -0.29 -0.13 0.00 -2.01 0.00 0.00 57.72 55.27 3k48 n HIS 232 Cb 0.13 -0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.15 3k48 n HIS 232 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3k48 n GLY 233 N 1.35 -0.28 2.90 -1.39 0.00 -0.24 -4.99 105.19 102.54 3k48 n GLY 233 Ca 0.18 -0.13 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 3k48 n GLY 233 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k48 s THR 234 N -2.38 0.92 0.21 2.61 2.01 -0.77 -3.36 115.64 114.88 3k48 s THR 234 Ca -0.25 -0.24 -0.15 0.00 0.31 0.00 0.00 61.69 61.36 3k48 s THR 234 Cb 0.06 -0.95 0.01 0.00 0.01 0.00 0.00 72.50 71.64 3k48 s THR 234 CO 0.44 0.34 0.47 0.72 -0.69 0.00 0.00 174.62 175.91 3k48 s PHE 235 N 1.59 0.11 -0.09 4.92 -0.12 0.14 -4.22 117.98 120.32 3k48 s PHE 235 Ca 0.02 -0.47 -0.08 0.00 -0.05 0.00 0.00 56.93 56.35 3k48 s PHE 235 Cb -0.13 0.26 0.02 0.00 -0.63 0.00 0.00 43.02 42.55 3k48 s PHE 235 CO -0.06 -0.91 0.23 -1.17 -0.05 0.00 0.00 175.22 173.26 3k48 s LEU 236 N -2.93 1.09 0.14 -1.99 2.96 -1.13 -0.25 118.68 116.58 3k48 s LEU 236 Ca 0.14 0.47 -0.22 0.00 -0.22 0.00 0.00 54.13 54.30 3k48 s LEU 236 Cb -0.00 0.79 0.06 0.00 0.50 0.00 0.00 46.19 47.54 3k48 s LEU 236 CO 0.01 -0.08 0.56 -0.83 -1.32 0.00 0.00 176.35 174.69 3k48 s GLY 237 N 0.16 -0.54 -0.02 7.98 0.00 0.30 -0.61 107.32 114.59 3k48 s GLY 237 Ca -0.00 0.41 0.02 0.00 0.00 0.00 0.00 44.72 45.14 3k48 s GLY 237 CO 0.00 0.09 -0.06 -1.36 0.00 0.00 0.00 173.10 171.77 3k48 s PHE 238 N -3.65 0.70 -0.11 1.90 0.40 0.45 -1.18 117.98 116.49 3k48 s PHE 238 Ca 0.01 -0.15 -0.01 0.00 -0.60 0.00 0.00 56.93 56.17 3k48 s PHE 238 Cb -0.00 -0.51 0.03 0.00 0.51 0.00 0.00 43.02 43.05 3k48 s PHE 238 CO -0.12 -0.07 -0.02 0.08 0.70 0.00 0.00 175.22 175.78 3k48 s VAL 239 N 0.20 0.69 0.21 -0.44 1.01 -0.45 -1.77 120.40 119.85 3k48 s VAL 239 Ca -0.02 -0.19 -0.30 0.00 0.00 0.00 0.00 61.98 61.46 3k48 s VAL 239 Cb -0.07 -0.86 -0.08 0.00 0.00 0.00 0.00 36.38 35.37 3k48 s VAL 239 CO -0.00 0.21 1.08 -0.75 0.00 0.00 0.00 175.10 175.64 3k48 s LYS 240 N 1.83 4.64 0.00 2.72 2.20 -0.58 -0.24 119.74 130.31 3k48 s LYS 240 Ca 0.04 1.71 0.06 0.00 -0.36 0.00 0.00 55.97 57.42 3k48 s LYS 240 Cb -0.13 -3.25 0.05 0.00 -1.51 0.00 0.00 37.83 32.98 3k48 s LYS 240 CO -0.07 0.17 0.69 1.28 -0.36 0.00 0.00 175.35 177.06