#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xk5 n TYR 98 N 0.00 0.35 -2.57 1.57 4.01 -1.26 -4.94 117.16 114.32 1xk5 n TYR 98 Ca 0.00 -0.18 -0.24 0.00 -0.16 0.00 0.00 57.90 57.32 1xk5 n TYR 98 Cb 0.00 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.06 1xk5 n TYR 98 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1xk5 s ALA 99 N -1.65 3.52 -1.07 -0.72 0.00 -1.26 -4.22 121.76 116.37 1xk5 s ALA 99 Ca 0.34 -0.97 -0.21 0.00 0.00 0.00 0.00 51.96 51.12 1xk5 s ALA 99 Cb 0.19 -2.37 0.02 0.00 0.00 0.00 0.00 23.12 20.96 1xk5 s ALA 99 CO 0.27 -0.77 0.68 0.09 0.00 0.00 0.00 175.76 176.03 1xk5 n ASN 100 N -2.46 -4.71 0.00 0.00 5.03 -1.23 -4.88 115.26 107.00 1xk5 n ASN 100 Ca 0.05 -1.11 0.00 0.00 0.87 0.00 0.00 54.58 54.39 1xk5 n ASN 100 Cb 0.59 -2.12 0.00 0.00 -1.02 0.00 0.00 39.78 37.23 1xk5 n ASN 100 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1xk5 n GLN 101 N -4.08 5.58 -4.00 3.52 1.13 -1.26 -4.76 117.38 113.51 1xk5 n GLN 101 Ca -0.16 0.00 -0.36 0.00 -1.94 0.00 0.00 57.00 54.54 1xk5 n GLN 101 Cb 0.60 -0.49 -0.08 0.00 0.11 0.00 0.00 30.24 30.38 1xk5 n GLN 101 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1xk5 s LEU 102 N -1.85 4.05 0.06 1.08 1.43 -1.26 -4.57 118.68 117.61 1xk5 s LEU 102 Ca 0.00 0.28 -0.31 0.00 -1.03 0.00 0.00 54.13 53.07 1xk5 s LEU 102 Cb 0.00 -1.99 -0.05 0.00 0.03 0.00 0.00 46.19 44.17 1xk5 s LEU 102 CO 0.00 0.32 1.19 -0.32 0.23 0.00 0.00 176.35 177.77 1xk5 s MET 103 N -0.51 4.44 0.01 1.70 -2.45 -1.26 -1.42 119.30 119.81 1xk5 s MET 103 Ca 0.11 1.75 0.03 0.00 -1.25 0.00 0.00 55.69 56.33 1xk5 s MET 103 Cb -0.12 -3.35 -0.03 0.00 1.25 0.00 0.00 34.83 32.57 1xk5 s MET 103 CO 0.02 -0.25 -0.06 -0.51 1.05 0.00 0.00 175.02 175.27 1xk5 s LEU 104 N 1.07 3.21 0.79 4.11 1.02 0.64 -4.81 118.68 124.70 1xk5 s LEU 104 Ca 0.58 -0.14 -0.06 0.00 0.02 0.00 0.00 54.13 54.53 1xk5 s LEU 104 Cb -0.29 -1.84 0.14 0.00 0.02 0.00 0.00 46.19 44.22 1xk5 s LEU 104 CO 0.29 0.28 1.09 -0.94 0.02 0.00 0.00 176.35 177.09 1xk5 s SER 105 N -1.48 4.05 0.11 2.29 1.04 -1.26 -0.55 113.70 117.89 1xk5 s SER 105 Ca 0.18 -0.09 0.02 0.00 0.48 0.00 0.00 55.95 56.54 1xk5 s SER 105 Cb -0.11 -0.23 -0.04 0.00 0.10 0.00 0.00 66.02 65.74 1xk5 s SER 105 CO 0.08 -2.08 -0.07 -1.61 0.98 0.00 0.00 173.24 170.54 1xk5 s GLU 106 N -5.37 0.86 0.33 4.02 0.41 -0.71 -4.62 118.70 113.62 1xk5 s GLU 106 Ca 0.68 -1.35 -0.29 0.00 -0.41 0.00 0.00 54.97 53.60 1xk5 s GLU 106 Cb -0.05 -0.25 -0.11 0.00 -1.78 0.00 0.00 34.13 31.93 1xk5 s GLU 106 CO 0.47 -0.01 1.45 -1.58 -0.49 0.00 0.00 175.26 175.10 1xk5 s TRP 107 N -3.59 2.81 -0.62 1.61 0.52 -1.26 -0.15 118.94 118.26 1xk5 s TRP 107 Ca 0.13 1.15 -0.22 0.00 0.02 0.00 0.00 56.10 57.17 1xk5 s TRP 107 Cb 0.05 -3.91 0.07 0.00 -1.15 0.00 0.00 33.47 28.53 1xk5 s TRP 107 CO -0.04 -2.73 0.89 -1.17 0.02 0.00 0.00 176.95 173.91 1xk5 s LEU 108 N -1.46 4.56 -0.23 2.99 2.96 -0.42 -4.67 118.68 122.40 1xk5 s LEU 108 Ca 0.55 -0.96 -0.11 0.00 -0.22 0.00 0.00 54.13 53.39 1xk5 s LEU 108 Cb -0.44 -2.46 -0.10 0.00 0.50 0.00 0.00 46.19 43.68 1xk5 s LEU 108 CO 0.55 -1.30 -0.29 -0.38 -1.32 0.00 0.00 176.35 173.60 1xk5 n ILE 109 N 5.87 1.28 -2.75 6.68 -0.00 -1.26 -4.92 119.36 124.26 1xk5 n ILE 109 Ca -0.04 -0.33 -0.41 0.00 -0.00 0.00 0.00 62.75 61.96 1xk5 n ILE 109 Cb 0.45 -1.79 -0.04 0.00 -0.00 0.00 0.00 39.64 38.27 1xk5 n ILE 109 CO 0.00 0.00 0.00 -1.81 -0.00 0.00 0.00 176.55 174.74 1xk5 s ASP 110 N -7.04 7.40 -0.27 4.38 -0.00 -1.26 -4.99 116.67 114.90 1xk5 s ASP 110 Ca -0.32 1.69 -0.14 0.00 -0.00 0.00 0.00 52.55 53.77 1xk5 s ASP 110 Cb 0.12 -2.57 -0.04 0.00 -0.00 0.00 0.00 42.92 40.44 1xk5 s ASP 110 CO 0.41 -0.15 0.34 0.68 -0.00 0.00 0.00 175.17 176.45 1xk5 s VAL 111 N 0.50 5.20 0.32 -1.27 -7.23 -1.26 -5.04 120.40 111.62 1xk5 s VAL 111 Ca 0.48 0.50 -0.29 0.00 -1.81 0.00 0.00 61.98 60.87 1xk5 s VAL 111 Cb -0.22 -3.67 -0.11 0.00 0.56 0.00 0.00 36.38 32.94 1xk5 s VAL 111 CO 0.28 0.17 1.52 -2.84 -0.31 0.00 0.00 175.10 173.92 1xk5 s PRO 112 N 2.01 4.15 0.15 4.82 0.02 -1.26 -4.91 135.00 139.98 1xk5 s PRO 112 Ca 0.14 2.52 -0.14 0.00 0.02 0.00 0.00 61.00 63.54 1xk5 s PRO 112 Cb -0.16 -3.01 0.04 0.00 0.02 0.00 0.00 34.50 31.39 1xk5 s PRO 112 CO 0.10 -0.54 1.70 0.77 -0.33 0.00 0.00 177.00 178.70 1xk5 h SER 113 N 4.02 0.70 -0.16 2.53 0.02 -2.06 -2.39 113.55 116.21 1xk5 h SER 113 Ca -0.49 -0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 60.27 1xk5 h SER 113 Cb 1.23 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.57 1xk5 h SER 113 CO 0.72 0.69 0.03 -0.90 -1.14 0.00 0.00 176.83 176.22 1xk5 n ASP 114 N -4.54 2.34 -0.04 3.07 3.85 -1.26 -4.55 116.55 115.42 1xk5 n ASP 114 Ca 0.02 -2.26 -0.08 0.00 -0.71 0.00 0.00 54.79 51.76 1xk5 n ASP 114 Cb 0.16 -0.55 -0.05 0.00 -1.35 0.00 0.00 41.12 39.33 1xk5 n ASP 114 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 1xk5 h LEU 115 N 0.98 -0.94 -2.46 -2.12 7.12 -1.80 0.68 115.31 116.76 1xk5 h LEU 115 Ca 0.03 0.12 0.02 0.00 0.13 0.00 0.00 57.88 58.17 1xk5 h LEU 115 Cb 0.97 0.38 -0.00 0.00 -0.53 0.00 0.00 40.66 41.47 1xk5 h LEU 115 CO 0.15 -0.23 0.07 1.23 -0.13 0.00 0.00 178.44 179.53 1xk5 h GLY 116 N -0.26 0.00 0.00 3.75 0.00 -1.80 -1.37 103.07 103.39 1xk5 h GLY 116 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1xk5 h GLY 116 CO -0.27 0.00 -1.55 -1.06 0.00 0.00 0.00 176.54 173.66 1xk5 n GLN 117 N -3.69 0.75 0.00 4.80 3.00 -0.80 -4.28 117.38 117.16 1xk5 n GLN 117 Ca -0.02 -0.12 0.00 0.00 -0.01 0.00 0.00 57.00 56.85 1xk5 n GLN 117 Cb 0.16 -1.37 0.00 0.00 0.00 0.00 0.00 30.24 29.03 1xk5 n GLN 117 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 1xk5 n GLU 118 N -1.93 0.92 -4.27 -1.09 4.07 0.23 -5.05 120.64 113.52 1xk5 n GLU 118 Ca -0.02 -0.88 -0.17 0.00 -0.06 0.00 0.00 57.16 56.03 1xk5 n GLU 118 Cb 0.40 -0.89 -0.11 0.00 -0.06 0.00 0.00 31.44 30.78 1xk5 n GLU 118 CO 0.00 0.00 0.00 -1.58 -0.06 0.00 0.00 177.13 175.49 1xk5 s TRP 119 N -0.43 1.44 0.05 4.31 0.52 -0.53 -1.03 118.94 123.28 1xk5 s TRP 119 Ca 0.00 -0.61 0.04 0.00 0.02 0.00 0.00 56.10 55.55 1xk5 s TRP 119 Cb 0.00 -0.72 -0.02 0.00 -1.15 0.00 0.00 33.47 31.57 1xk5 s TRP 119 CO 0.00 0.18 -0.12 0.96 0.02 0.00 0.00 176.95 177.99 1xk5 s ILE 120 N -2.66 0.92 -0.01 2.03 -4.36 -0.03 -3.54 121.20 113.54 1xk5 s ILE 120 Ca 0.14 -1.11 0.05 0.00 -0.26 0.00 0.00 60.65 59.48 1xk5 s ILE 120 Cb -0.02 -0.89 -0.03 0.00 1.25 0.00 0.00 42.46 42.77 1xk5 s ILE 120 CO 0.03 -0.19 -0.16 0.54 0.24 0.00 0.00 174.94 175.40 1xk5 s VAL 121 N -1.13 2.90 -0.11 8.37 0.11 0.48 -0.23 120.40 130.78 1xk5 s VAL 121 Ca -0.03 -0.92 0.03 0.00 -2.93 0.00 0.00 61.98 58.14 1xk5 s VAL 121 Cb -0.09 -2.16 0.00 0.00 -1.53 0.00 0.00 36.38 32.61 1xk5 s VAL 121 CO 0.01 0.50 -0.23 -0.69 -3.33 0.00 0.00 175.10 171.36 1xk5 s VAL 122 N -0.79 2.03 -0.13 2.04 1.01 0.62 -0.67 120.40 124.51 1xk5 s VAL 122 Ca 0.13 -0.99 -0.21 0.00 0.00 0.00 0.00 61.98 60.90 1xk5 s VAL 122 Cb -0.11 -1.77 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 1xk5 s VAL 122 CO 0.02 0.55 0.63 0.68 0.00 0.00 0.00 175.10 176.98 1xk5 s VAL 123 N 0.51 5.07 -0.12 2.92 -7.23 -1.26 -0.26 120.40 120.02 1xk5 s VAL 123 Ca -0.15 1.25 -0.05 0.00 -1.81 0.00 0.00 61.98 61.22 1xk5 s VAL 123 Cb -0.17 -3.96 -0.04 0.00 0.56 0.00 0.00 36.38 32.77 1xk5 s VAL 123 CO 0.05 0.21 0.08 0.00 -0.31 0.00 0.00 175.10 175.14 1xk5 s PRO 125 N -0.72 3.10 0.39 0.00 0.04 -1.26 0.51 135.00 137.05 1xk5 s PRO 125 Ca 0.12 0.73 -0.25 0.00 0.04 0.00 0.00 61.00 61.64 1xk5 s PRO 125 Cb -0.12 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.31 1xk5 s PRO 125 CO 0.03 -0.93 1.14 0.08 0.04 0.00 0.00 177.00 177.36 1xk5 s VAL 126 N -3.18 3.30 -5.00 -0.36 1.01 0.97 -4.36 120.40 112.78 1xk5 s VAL 126 Ca 0.57 1.09 0.00 0.00 0.00 0.00 0.00 61.98 63.64 1xk5 s VAL 126 Cb -0.12 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.65 1xk5 s VAL 126 CO 0.54 0.10 0.00 0.61 0.00 0.00 0.00 175.10 176.34 1xk5 n GLY 127 N 0.62 -0.97 3.45 4.51 0.00 -1.26 -4.56 105.19 106.98 1xk5 n GLY 127 Ca 0.04 -1.23 -0.34 0.00 0.00 0.00 0.00 46.02 44.49 1xk5 n GLY 127 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xk5 s LYS 128 N -2.00 3.59 0.34 1.61 -0.14 -0.05 -4.85 119.74 118.24 1xk5 s LYS 128 Ca 0.00 -0.55 -0.29 0.00 -1.36 0.00 0.00 55.97 53.77 1xk5 s LYS 128 Cb 0.00 -2.94 -0.11 0.00 -1.68 0.00 0.00 37.83 33.10 1xk5 s LYS 128 CO 0.00 0.12 1.55 -2.13 -0.76 0.00 0.00 175.35 174.13 1xk5 n ARG 129 N 3.87 2.72 -3.73 1.68 0.00 -1.26 -0.06 116.66 119.88 1xk5 n ARG 129 Ca -0.17 0.96 -0.12 0.00 -0.00 0.00 0.00 57.85 58.51 1xk5 n ARG 129 Cb 0.52 -2.72 -0.11 0.00 0.00 0.00 0.00 32.46 30.15 1xk5 n ARG 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1xk5 s ALA 130 N -0.63 -0.95 -0.18 5.13 0.00 0.14 -4.26 121.76 121.00 1xk5 s ALA 130 Ca 0.58 1.18 -0.22 0.00 0.00 0.00 0.00 51.96 53.50 1xk5 s ALA 130 Cb -0.48 -0.70 -0.02 0.00 0.00 0.00 0.00 23.12 21.92 1xk5 s ALA 130 CO 0.57 -0.20 0.67 -1.17 0.00 0.00 0.00 175.76 175.63 1xk5 s LEU 131 N 0.54 4.17 -0.12 0.00 0.20 -0.77 -1.15 118.68 121.55 1xk5 s LEU 131 Ca -0.03 0.93 -0.02 0.00 0.69 0.00 0.00 54.13 55.70 1xk5 s LEU 131 Cb -0.04 -2.97 -0.03 0.00 -0.43 0.00 0.00 46.19 42.72 1xk5 s LEU 131 CO -0.03 -0.28 -0.03 -0.63 -0.29 0.00 0.00 176.35 175.09 1xk5 s ILE 132 N 1.85 4.03 -0.20 6.68 -1.09 -0.70 -0.97 121.20 130.80 1xk5 s ILE 132 Ca 0.31 -0.33 -0.03 0.00 -2.23 0.00 0.00 60.65 58.37 1xk5 s ILE 132 Cb -0.16 -2.72 0.06 0.00 -1.58 0.00 0.00 42.46 38.06 1xk5 s ILE 132 CO 0.11 0.55 0.03 -0.69 -1.23 0.00 0.00 174.94 173.71 1xk5 s VAL 133 N -0.24 0.54 -0.33 2.92 1.01 -0.50 -1.16 120.40 122.65 1xk5 s VAL 133 Ca 0.05 -0.57 -0.11 0.00 0.00 0.00 0.00 61.98 61.34 1xk5 s VAL 133 Cb -0.13 -1.05 -0.01 0.00 0.00 0.00 0.00 36.38 35.20 1xk5 s VAL 133 CO 0.02 -0.21 0.20 0.00 0.00 0.00 0.00 175.10 175.11 1xk5 s ALA 134 N 1.85 3.38 -0.11 5.51 0.00 0.59 -1.12 121.76 131.86 1xk5 s ALA 134 Ca -0.01 -1.41 -0.05 0.00 0.00 0.00 0.00 51.96 50.49 1xk5 s ALA 134 Cb -0.17 -2.53 0.05 0.00 0.00 0.00 0.00 23.12 20.47 1xk5 s ALA 134 CO -0.08 -0.97 0.25 0.45 0.00 0.00 0.00 175.76 175.40 1xk5 s SER 135 N 1.66 -0.13 -0.22 0.00 0.15 -0.62 0.20 113.70 114.74 1xk5 s SER 135 Ca 0.05 0.53 -0.10 0.00 0.70 0.00 0.00 55.95 57.13 1xk5 s SER 135 Cb -0.17 0.45 0.02 0.00 -1.71 0.00 0.00 66.02 64.61 1xk5 s SER 135 CO 0.08 -0.18 0.25 -2.11 1.20 0.00 0.00 173.24 172.48 1xk5 n ARG 136 N 4.46 -0.68 0.00 5.44 1.85 -1.23 -3.04 116.66 123.45 1xk5 n ARG 136 Ca -0.21 0.45 0.00 0.00 -1.00 0.00 0.00 57.85 57.09 1xk5 n ARG 136 Cb 0.52 -0.78 0.00 0.00 -1.05 0.00 0.00 32.46 31.15 1xk5 n ARG 136 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1xk5 n GLY 137 N -0.35 3.11 3.39 2.89 0.00 -1.24 -4.83 105.19 108.16 1xk5 n GLY 137 Ca -0.06 -0.99 -0.11 0.00 0.00 0.00 0.00 46.02 44.86 1xk5 n GLY 137 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xk5 s SER 138 N 0.00 0.15 -0.07 1.61 1.04 -1.17 0.16 113.70 115.42 1xk5 s SER 138 Ca 0.00 -1.21 0.04 0.00 0.48 0.00 0.00 55.95 55.26 1xk5 s SER 138 Cb 0.00 0.49 -0.02 0.00 0.10 0.00 0.00 66.02 66.60 1xk5 s SER 138 CO 0.00 -1.01 -0.20 -0.89 0.98 0.00 0.00 173.24 172.13 1xk5 s THR 139 N -4.00 2.54 0.02 2.02 2.01 0.84 -1.59 115.64 117.49 1xk5 s THR 139 Ca 0.31 -0.89 0.07 0.00 0.31 0.00 0.00 61.69 61.50 1xk5 s THR 139 Cb 0.03 -1.98 -0.02 0.00 0.01 0.00 0.00 72.50 70.54 1xk5 s THR 139 CO 0.12 0.57 -0.21 -0.44 -0.69 0.00 0.00 174.62 173.96 1xk5 s SER 140 N -0.23 2.53 -0.18 3.53 0.01 -0.28 -0.46 113.70 118.63 1xk5 s SER 140 Ca -0.01 -0.48 -0.03 0.00 1.31 0.00 0.00 55.95 56.75 1xk5 s SER 140 Cb -0.13 -0.24 -0.02 0.00 0.21 0.00 0.00 66.02 65.84 1xk5 s SER 140 CO 0.03 0.21 -0.06 0.00 0.41 0.00 0.00 173.24 173.82 1xk5 s ALA 141 N -0.69 2.83 0.19 1.44 0.00 0.39 -1.41 121.76 124.51 1xk5 s ALA 141 Ca 0.08 -0.98 0.08 0.00 0.00 0.00 0.00 51.96 51.14 1xk5 s ALA 141 Cb -0.09 -1.54 -0.04 0.00 0.00 0.00 0.00 23.12 21.46 1xk5 s ALA 141 CO 0.01 -0.05 -0.06 0.71 0.00 0.00 0.00 175.76 176.37 1xk5 s TYR 142 N 0.83 2.71 0.77 0.00 1.51 -0.15 0.65 117.35 123.67 1xk5 s TYR 142 Ca -0.02 -0.19 -0.10 0.00 -1.01 0.00 0.00 57.07 55.75 1xk5 s TYR 142 Cb -0.15 -1.31 0.08 0.00 -0.11 0.00 0.00 41.96 40.48 1xk5 s TYR 142 CO 0.01 0.52 1.11 0.95 -1.11 0.00 0.00 175.55 177.04 1xk5 s THR 143 N -1.77 2.13 0.35 -0.71 -4.23 -0.69 -1.85 115.64 108.87 1xk5 s THR 143 Ca 0.26 -0.14 0.06 0.00 -1.18 0.00 0.00 61.69 60.69 1xk5 s THR 143 Cb -0.09 -2.99 0.16 0.00 1.34 0.00 0.00 72.50 70.93 1xk5 s THR 143 CO 0.17 0.00 1.89 0.50 -0.54 0.00 0.00 174.62 176.64 1xk5 h LYS 144 N -0.88 0.45 0.00 3.99 3.64 -1.92 -0.62 116.57 121.23 1xk5 h LYS 144 Ca -0.45 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 58.84 1xk5 h LYS 144 Cb 1.31 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1xk5 h LYS 144 CO 0.61 0.50 0.00 -1.13 -2.27 0.00 0.00 179.45 177.15 1xk5 n SER 145 N -4.29 0.00 0.00 4.20 3.41 -1.26 -3.57 113.62 112.11 1xk5 n SER 145 Ca 0.01 -1.21 0.00 0.00 -0.26 0.00 0.00 58.87 57.41 1xk5 n SER 145 Cb 0.24 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 1xk5 n SER 145 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xk5 n GLY 146 N 0.49 1.22 3.69 5.00 0.00 -0.24 -4.70 105.19 110.65 1xk5 n GLY 146 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 1xk5 n GLY 146 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xk5 s TYR 147 N -2.35 3.08 0.02 1.61 1.13 -1.26 -4.21 117.35 115.36 1xk5 s TYR 147 Ca 0.00 0.08 -0.35 0.00 -1.41 0.00 0.00 57.07 55.39 1xk5 s TYR 147 Cb 0.00 -1.66 -0.13 0.00 -1.10 0.00 0.00 41.96 39.06 1xk5 s TYR 147 CO 0.00 0.47 1.71 0.00 -2.51 0.00 0.00 175.55 175.21 1xk5 n VAL 149 N 4.19 0.00 -3.63 0.00 3.14 0.21 -4.93 118.33 117.31 1xk5 n VAL 149 Ca 0.20 -0.33 -0.04 0.00 -2.96 0.00 0.00 64.34 61.21 1xk5 n VAL 149 Cb 0.27 1.10 -0.04 0.00 -1.06 0.00 0.00 33.84 34.11 1xk5 n VAL 149 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 1xk5 s ASN 150 N -1.69 -0.12 -0.10 6.55 3.84 -1.17 -4.96 114.94 117.29 1xk5 s ASN 150 Ca 0.08 0.13 -0.03 0.00 0.21 0.00 0.00 52.86 53.25 1xk5 s ASN 150 Cb 0.09 0.10 0.04 0.00 -0.55 0.00 0.00 41.25 40.94 1xk5 s ASN 150 CO 0.35 -0.10 0.07 -0.60 -2.79 0.00 0.00 177.10 174.03 1xk5 s ARG 151 N -1.00 -0.01 0.00 0.43 3.52 -1.26 -0.46 118.95 120.17 1xk5 s ARG 151 Ca 0.06 0.16 0.00 0.00 -0.13 0.00 0.00 55.73 55.82 1xk5 s ARG 151 Cb -0.01 -1.14 0.00 0.00 -1.56 0.00 0.00 34.95 32.24 1xk5 s ARG 151 CO -0.06 -0.49 0.00 1.97 -0.81 0.00 0.00 175.30 175.91 1xk5 n PHE 152 N 5.29 -0.41 -4.02 5.12 -1.74 0.39 -4.98 117.46 117.12 1xk5 n PHE 152 Ca -0.05 0.00 -0.33 0.00 -0.56 0.00 0.00 57.45 56.51 1xk5 n PHE 152 Cb 0.50 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.43 1xk5 n PHE 152 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 1xk5 s SER 153 N -0.75 5.96 0.05 5.98 0.15 -1.26 -0.11 113.70 123.72 1xk5 s SER 153 Ca 0.00 0.23 -0.15 0.00 0.70 0.00 0.00 55.95 56.72 1xk5 s SER 153 Cb 0.00 -1.78 0.03 0.00 -1.71 0.00 0.00 66.02 62.55 1xk5 s SER 153 CO 0.00 0.27 0.35 -0.94 1.20 0.00 0.00 173.24 174.11 1xk5 s SER 154 N -1.83 -0.18 0.00 5.45 1.04 -0.97 -4.03 113.70 113.19 1xk5 s SER 154 Ca 0.25 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.52 1xk5 s SER 154 Cb -0.12 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.39 1xk5 s SER 154 CO 0.16 -0.66 0.86 0.18 0.98 0.00 0.00 173.24 174.76 1xk5 n LEU 155 N 0.44 2.49 -4.86 2.42 4.77 -1.26 -4.53 117.00 116.47 1xk5 n LEU 155 Ca -0.18 -1.25 -0.34 0.00 -0.03 0.00 0.00 56.01 54.21 1xk5 n LEU 155 Cb 0.60 -0.47 -0.06 0.00 -2.33 0.00 0.00 43.42 41.17 1xk5 n LEU 155 CO 0.20 0.43 0.19 -0.76 -1.33 0.00 0.00 177.39 176.12 1xk5 s LEU 156 N 0.00 4.29 0.36 2.23 1.43 -1.26 -4.81 118.68 120.92 1xk5 s LEU 156 Ca 0.00 0.95 0.12 0.00 -1.03 0.00 0.00 54.13 54.17 1xk5 s LEU 156 Cb 0.00 -3.32 0.91 0.00 0.03 0.00 0.00 46.19 43.81 1xk5 s LEU 156 CO 0.00 0.07 1.82 -0.65 0.23 0.00 0.00 176.35 177.81 1xk5 h PRO 157 N 3.29 0.58 0.00 1.29 0.11 -1.87 -3.35 132.00 132.04 1xk5 h PRO 157 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1xk5 h PRO 157 Cb 1.19 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1xk5 h PRO 157 CO 0.67 0.38 0.00 0.41 -0.21 0.00 0.00 178.00 179.25 1xk5 n GLY 158 N -1.42 -1.06 3.83 -0.55 0.00 -1.19 -4.34 105.19 100.46 1xk5 n GLY 158 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.89 1xk5 n GLY 158 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xk5 s GLY 159 N 0.00 2.50 0.00 -0.02 0.00 -1.18 -3.57 107.32 105.05 1xk5 s GLY 159 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 44.72 44.79 1xk5 s GLY 159 CO 0.00 0.37 0.00 -2.01 0.00 0.00 0.00 173.10 171.46 1xk5 n ASN 160 N 0.39 0.00 0.22 1.64 2.85 0.42 -4.17 115.26 116.61 1xk5 n ASN 160 Ca -0.01 0.00 -0.09 0.00 -0.11 0.00 0.00 54.58 54.37 1xk5 n ASN 160 Cb 0.52 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.49 1xk5 n ASN 160 CO 0.00 0.00 0.00 0.03 -2.11 0.00 0.00 177.26 175.18 1xk5 h ARG 161 N 0.00 -0.59 -0.05 1.20 3.08 -1.92 -3.30 114.38 112.80 1xk5 h ARG 161 Ca 0.00 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1xk5 h ARG 161 Cb 0.00 0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.18 1xk5 h ARG 161 CO 0.00 -0.39 0.02 0.00 -1.07 0.00 0.00 179.97 178.53 1xk5 h ARG 162 N -1.06 0.05 -4.24 0.04 2.47 -1.97 -3.40 114.38 106.28 1xk5 h ARG 162 Ca -0.06 -0.00 -0.73 0.00 -1.26 0.00 0.00 59.98 57.93 1xk5 h ARG 162 Cb 0.47 -0.01 -0.30 0.00 -1.65 0.00 0.00 29.97 28.48 1xk5 h ARG 162 CO 0.10 0.03 -0.37 1.21 0.56 0.00 0.00 179.97 181.51 1xk5 s ASN 163 N -5.22 5.73 0.01 7.04 3.04 -1.26 -5.05 114.94 119.23 1xk5 s ASN 163 Ca -0.13 -1.99 -0.22 0.00 0.04 0.00 0.00 52.86 50.56 1xk5 s ASN 163 Cb 0.07 -2.01 0.05 0.00 -1.54 0.00 0.00 41.25 37.81 1xk5 s ASN 163 CO 0.67 -0.68 0.49 -0.55 -3.04 0.00 0.00 177.10 173.99 1xk5 s SER 164 N 2.57 -0.41 0.29 -4.21 0.15 -1.26 -3.98 113.70 106.85 1xk5 s SER 164 Ca 0.07 0.26 -0.19 0.00 0.70 0.00 0.00 55.95 56.78 1xk5 s SER 164 Cb -0.25 0.45 0.06 0.00 -1.71 0.00 0.00 66.02 64.57 1xk5 s SER 164 CO -0.01 -0.62 0.87 -0.89 1.20 0.00 0.00 173.24 173.78 1xk5 s THR 165 N -1.91 0.00 0.01 6.45 2.01 -1.26 -5.03 115.64 115.91 1xk5 s THR 165 Ca -0.08 -0.85 -0.30 0.00 0.31 0.00 0.00 61.69 60.76 1xk5 s THR 165 Cb -0.01 -2.70 -0.04 0.00 0.01 0.00 0.00 72.50 69.76 1xk5 s THR 165 CO 0.02 0.00 1.03 0.00 -0.69 0.00 0.00 174.62 174.98 1xk5 s ALA 166 N -2.55 3.22 -1.82 7.40 0.00 -1.26 -3.07 121.76 123.68 1xk5 s ALA 166 Ca 0.16 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.73 1xk5 s ALA 166 Cb -0.04 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.71 1xk5 s ALA 166 CO 0.08 -0.29 0.00 1.17 0.00 0.00 0.00 175.76 176.72 1xk5 n LYS 167 N 3.96 -1.63 -0.32 0.00 4.81 -1.26 -4.81 118.16 118.90 1xk5 n LYS 167 Ca 0.07 1.02 0.07 0.00 -0.87 0.00 0.00 58.31 58.60 1xk5 n LYS 167 Cb 0.50 -5.56 0.22 0.00 0.02 0.00 0.00 35.03 30.21 1xk5 n LYS 167 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1xk5 n ASP 168 N -1.66 2.92 -4.76 3.14 -0.08 -1.18 -2.64 116.55 112.29 1xk5 n ASP 168 Ca -0.22 -2.13 -0.39 0.00 -1.51 0.00 0.00 54.79 50.54 1xk5 n ASP 168 Cb 0.66 -0.39 0.01 0.00 2.34 0.00 0.00 41.12 43.75 1xk5 n ASP 168 CO 0.00 0.00 0.00 -0.72 0.12 0.00 0.00 177.20 176.60 1xk5 s TYR 169 N -1.53 2.55 -0.04 -0.67 -0.00 -1.26 -3.18 117.35 113.22 1xk5 s TYR 169 Ca 0.33 1.35 0.04 0.00 -0.00 0.00 0.00 57.07 58.80 1xk5 s TYR 169 Cb 0.19 -3.78 -0.00 0.00 -0.00 0.00 0.00 41.96 38.37 1xk5 s TYR 169 CO 0.19 -2.58 -0.18 0.99 -0.00 0.00 0.00 175.55 173.98 1xk5 s THR 170 N -1.27 1.46 -0.10 -3.49 2.01 0.13 -1.73 115.64 112.65 1xk5 s THR 170 Ca 0.63 -0.74 0.03 0.00 0.31 0.00 0.00 61.69 61.92 1xk5 s THR 170 Cb -0.40 -1.25 0.01 0.00 0.01 0.00 0.00 72.50 70.87 1xk5 s THR 170 CO 0.50 0.42 -0.19 -0.63 -0.69 0.00 0.00 174.62 174.03 1xk5 s ILE 171 N -0.00 1.69 0.25 1.82 1.01 0.20 -0.30 121.20 125.88 1xk5 s ILE 171 Ca -0.03 -0.79 0.08 0.00 0.00 0.00 0.00 60.65 59.91 1xk5 s ILE 171 Cb -0.11 -1.50 -0.05 0.00 0.01 0.00 0.00 42.46 40.81 1xk5 s ILE 171 CO 0.02 0.48 -0.12 -0.76 0.00 0.00 0.00 174.94 174.56 1xk5 s LEU 172 N 0.60 2.55 -0.29 2.97 1.02 -0.31 -1.41 118.68 123.81 1xk5 s LEU 172 Ca -0.14 -1.09 -0.02 0.00 0.02 0.00 0.00 54.13 52.90 1xk5 s LEU 172 Cb -0.17 -0.77 0.05 0.00 0.02 0.00 0.00 46.19 45.33 1xk5 s LEU 172 CO 0.04 -0.19 -0.01 -0.62 0.02 0.00 0.00 176.35 175.59 1xk5 s ASP 173 N -3.42 4.81 0.29 2.29 -1.08 0.60 -1.72 116.67 118.45 1xk5 s ASP 173 Ca 0.27 -1.22 0.04 0.00 -0.52 0.00 0.00 52.55 51.12 1xk5 s ASP 173 Cb 0.00 -1.70 -0.06 0.00 -1.46 0.00 0.00 42.92 39.70 1xk5 s ASP 173 CO 0.11 -0.24 0.04 0.00 0.52 0.00 0.00 175.17 175.59 1xk5 s ILE 175 N -3.35 1.33 -0.06 0.00 1.01 -0.32 0.27 121.20 120.10 1xk5 s ILE 175 Ca 0.34 -0.69 -0.28 0.00 0.00 0.00 0.00 60.65 60.02 1xk5 s ILE 175 Cb 0.08 -1.41 -0.02 0.00 0.01 0.00 0.00 42.46 41.11 1xk5 s ILE 175 CO 0.14 0.24 0.93 -0.47 0.00 0.00 0.00 174.94 175.77 1xk5 s TYR 176 N 1.55 3.58 -0.41 3.97 5.04 0.91 -1.18 117.35 130.81 1xk5 s TYR 176 Ca 0.02 1.56 -0.05 0.00 -2.44 0.00 0.00 57.07 56.15 1xk5 s TYR 176 Cb -0.15 -3.08 0.10 0.00 0.35 0.00 0.00 41.96 39.18 1xk5 s TYR 176 CO -0.08 -0.08 0.21 1.21 -1.34 0.00 0.00 175.55 175.47 1xk5 s ASN 177 N 1.01 5.36 0.14 4.32 3.84 0.77 -0.87 114.94 129.51 1xk5 s ASN 177 Ca 0.47 -1.81 -0.28 0.00 0.21 0.00 0.00 52.86 51.46 1xk5 s ASN 177 Cb -0.19 -1.88 -0.04 0.00 -0.55 0.00 0.00 41.25 38.59 1xk5 s ASN 177 CO 0.22 -0.53 1.59 -0.08 -2.79 0.00 0.00 177.10 175.51 1xk5 h GLU 178 N 8.18 -0.43 0.00 0.43 4.57 -1.86 -0.45 114.58 125.02 1xk5 h GLU 178 Ca -0.17 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.04 1xk5 h GLU 178 Cb 1.06 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 1xk5 h GLU 178 CO 0.71 -0.29 0.23 -0.39 -1.18 0.00 0.00 179.01 178.10 1xk5 h VAL 179 N -0.45 0.00 0.00 0.32 -1.51 -1.95 -0.79 116.25 111.87 1xk5 h VAL 179 Ca 0.09 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.56 1xk5 h VAL 179 Cb 0.60 0.46 0.00 0.00 -2.13 0.00 0.00 31.29 30.23 1xk5 h VAL 179 CO -0.40 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 176.53 1xk5 n ASN 180 N -2.37 1.39 -4.19 4.19 3.02 -0.69 -4.99 115.26 111.62 1xk5 n ASN 180 Ca -0.01 -1.52 -0.31 0.00 -0.03 0.00 0.00 54.58 52.71 1xk5 n ASN 180 Cb 0.27 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.38 1xk5 n ASN 180 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xk5 n GLN 181 N -0.26 -2.05 -4.50 3.52 3.00 -0.26 -4.85 117.38 111.98 1xk5 n GLN 181 Ca 0.00 0.24 -0.22 0.00 -0.01 0.00 0.00 57.00 57.01 1xk5 n GLN 181 Cb 0.18 -4.21 -0.16 0.00 0.00 0.00 0.00 30.24 26.05 1xk5 n GLN 181 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1xk5 s THR 182 N -4.00 0.95 -0.61 5.09 2.01 -1.00 -2.66 115.64 115.42 1xk5 s THR 182 Ca 0.16 -0.44 -0.18 0.00 0.31 0.00 0.00 61.69 61.54 1xk5 s THR 182 Cb -0.09 -0.84 0.12 0.00 0.01 0.00 0.00 72.50 71.70 1xk5 s THR 182 CO 0.95 0.29 0.68 -0.31 -0.69 0.00 0.00 174.62 175.55 1xk5 s TYR 183 N 0.21 3.11 -0.18 4.92 2.02 0.21 -0.16 117.35 127.49 1xk5 s TYR 183 Ca -0.04 -1.13 -0.29 0.00 -0.37 0.00 0.00 57.07 55.23 1xk5 s TYR 183 Cb -0.10 -3.97 -0.01 0.00 -0.40 0.00 0.00 41.96 37.49 1xk5 s TYR 183 CO 0.01 -1.22 1.20 0.71 -1.57 0.00 0.00 175.55 174.68 1xk5 s TYR 184 N 2.26 2.98 -0.12 2.71 2.02 -0.33 -2.15 117.35 124.71 1xk5 s TYR 184 Ca 0.11 1.13 -0.29 0.00 -0.37 0.00 0.00 57.07 57.65 1xk5 s TYR 184 Cb -0.24 -3.44 -0.01 0.00 -0.40 0.00 0.00 41.96 37.87 1xk5 s TYR 184 CO 0.04 -1.37 0.99 0.08 -1.57 0.00 0.00 175.55 173.71 1xk5 s VAL 185 N 3.43 4.79 -0.23 0.71 1.01 -0.09 -1.17 120.40 128.84 1xk5 s VAL 185 Ca 0.52 2.00 0.02 0.00 0.00 0.00 0.00 61.98 64.51 1xk5 s VAL 185 Cb -0.20 -4.29 -0.15 0.00 0.00 0.00 0.00 36.38 31.74 1xk5 s VAL 185 CO 0.12 -0.01 -0.21 -0.11 0.00 0.00 0.00 175.10 174.90 1xk5 n LEU 186 N 5.13 2.98 -3.76 3.92 0.00 0.12 -1.04 117.00 124.34 1xk5 n LEU 186 Ca 0.08 -0.12 -0.10 0.00 0.00 0.00 0.00 56.01 55.88 1xk5 n LEU 186 Cb 0.49 -0.81 -0.04 0.00 0.00 0.00 0.00 43.42 43.05 1xk5 n LEU 186 CO 0.52 0.89 0.21 -0.62 0.00 0.00 0.00 177.39 178.39 1xk5 s ASP 187 N -6.26 -0.21 -0.09 1.96 -1.08 -0.42 -4.93 116.67 105.65 1xk5 s ASP 187 Ca -0.31 -0.53 0.00 0.00 -0.52 0.00 0.00 52.55 51.19 1xk5 s ASP 187 Cb 0.08 0.54 0.02 0.00 -1.46 0.00 0.00 42.92 42.11 1xk5 s ASP 187 CO 0.54 -1.00 -0.06 0.54 0.52 0.00 0.00 175.17 175.70 1xk5 s VAL 188 N -3.88 0.84 -0.12 1.11 0.11 -1.26 -0.29 120.40 116.90 1xk5 s VAL 188 Ca 0.10 -0.21 0.20 0.00 -2.93 0.00 0.00 61.98 59.13 1xk5 s VAL 188 Cb 0.00 -0.87 -0.27 0.00 -1.53 0.00 0.00 36.38 33.70 1xk5 s VAL 188 CO -0.03 0.32 0.31 1.15 -3.33 0.00 0.00 175.10 173.52 1xk5 n MET 189 N 4.68 0.67 -3.64 1.54 0.00 -0.50 -4.75 117.12 115.12 1xk5 n MET 189 Ca -0.15 -0.06 -0.08 0.00 0.00 0.00 0.00 57.70 57.40 1xk5 n MET 189 Cb 0.50 -1.55 -0.07 0.00 0.00 0.00 0.00 33.22 32.10 1xk5 n MET 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1xk5 s TRP 191 N 1.39 0.68 -0.83 0.00 -0.11 0.10 0.63 118.94 120.79 1xk5 s TRP 191 Ca -0.08 -0.17 -0.01 0.00 1.22 0.00 0.00 56.10 57.06 1xk5 s TRP 191 Cb -0.05 -0.59 0.01 0.00 -1.50 0.00 0.00 33.47 31.34 1xk5 s TRP 191 CO -0.16 -0.15 0.07 0.54 -4.62 0.00 0.00 176.95 172.63 1xk5 n ARG 192 N 3.86 -2.56 0.00 5.86 1.74 -1.18 0.43 116.66 124.82 1xk5 n ARG 192 Ca -0.24 0.43 0.00 0.00 -0.77 0.00 0.00 57.85 57.27 1xk5 n ARG 192 Cb 0.52 -5.02 0.00 0.00 -1.02 0.00 0.00 32.46 26.94 1xk5 n ARG 192 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xk5 n GLY 193 N -0.78 1.68 3.60 -0.13 0.00 -0.70 -4.59 105.19 104.26 1xk5 n GLY 193 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 1xk5 n GLY 193 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1xk5 s HIS 194 N -2.36 3.10 0.34 1.61 3.76 0.17 -5.02 115.29 116.89 1xk5 s HIS 194 Ca 0.00 0.73 -0.26 0.00 -0.15 0.00 0.00 55.06 55.38 1xk5 s HIS 194 Cb 0.00 -3.54 -0.09 0.00 1.11 0.00 0.00 32.58 30.05 1xk5 s HIS 194 CO 0.00 -0.78 1.01 -1.25 -0.85 0.00 0.00 174.74 172.87 1xk5 s PRO 195 N 3.33 4.44 -0.09 8.40 0.04 -1.26 -0.72 135.00 149.14 1xk5 s PRO 195 Ca 0.36 1.48 0.13 0.00 0.04 0.00 0.00 61.00 63.01 1xk5 s PRO 195 Cb -0.12 -2.78 0.19 0.00 0.04 0.00 0.00 34.50 31.82 1xk5 s PRO 195 CO 0.17 0.12 1.09 1.19 0.04 0.00 0.00 177.00 179.61 1xk5 n PHE 196 N 0.46 0.00 -0.23 0.56 0.99 0.40 -4.80 117.46 114.83 1xk5 n PHE 196 Ca 0.02 -0.70 -0.04 0.00 -0.00 0.00 0.00 57.45 56.74 1xk5 n PHE 196 Cb 0.49 -0.11 0.13 0.00 -1.00 0.00 0.00 39.48 38.98 1xk5 n PHE 196 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 176.76 178.64 1xk5 h TYR 197 N 0.00 1.06 -0.24 1.38 -1.99 -1.86 -2.75 116.97 112.59 1xk5 h TYR 197 Ca 0.00 -0.08 0.00 0.00 2.00 0.00 0.00 58.73 60.65 1xk5 h TYR 197 Cb 1.06 -0.32 0.00 0.00 2.00 0.00 0.00 36.73 39.47 1xk5 h TYR 197 CO 0.02 0.82 0.00 -0.25 -0.00 0.00 0.00 178.16 178.75 1xk5 n ASP 198 N -4.29 1.28 -4.88 3.88 8.00 -1.26 -0.55 116.55 118.73 1xk5 n ASP 198 Ca 0.06 -2.00 -0.35 0.00 0.71 0.00 0.00 54.79 53.21 1xk5 n ASP 198 Cb 0.19 -0.16 -0.05 0.00 -0.02 0.00 0.00 41.12 41.07 1xk5 n ASP 198 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xk5 s GLN 200 N -1.63 3.40 0.36 0.00 -2.07 -1.26 -4.05 119.66 114.41 1xk5 s GLN 200 Ca 0.25 2.09 0.04 0.00 -1.82 0.00 0.00 55.36 55.93 1xk5 s GLN 200 Cb -0.13 -2.34 0.70 0.00 -1.09 0.00 0.00 33.01 30.15 1xk5 s GLN 200 CO 0.14 -0.94 1.98 0.00 -1.32 0.00 0.00 175.29 175.16 1xk5 h THR 201 N 1.66 1.08 0.00 3.63 1.03 0.37 -1.67 112.91 119.01 1xk5 h THR 201 Ca -0.50 -0.27 -0.00 0.00 -0.01 0.00 0.00 66.41 65.62 1xk5 h THR 201 Cb 1.28 0.21 -0.00 0.00 -1.07 0.00 0.00 68.15 68.57 1xk5 h THR 201 CO 0.59 0.15 -0.01 -2.24 -0.01 0.00 0.00 175.52 173.99 1xk5 h ASP 202 N 0.80 0.00 0.02 0.00 2.03 -1.71 0.30 116.42 117.86 1xk5 h ASP 202 Ca 0.28 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.55 1xk5 h ASP 202 Cb 0.11 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.61 1xk5 h ASP 202 CO -0.08 0.01 -0.12 0.15 -1.03 0.00 0.00 179.24 178.17 1xk5 h PHE 203 N 0.00 0.08 -0.26 4.15 3.57 -1.58 -2.72 116.94 120.18 1xk5 h PHE 203 Ca -0.00 -0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.49 1xk5 h PHE 203 Cb 0.23 -0.00 -0.05 0.00 2.79 0.00 0.00 35.95 38.91 1xk5 h PHE 203 CO 0.00 1.03 -0.07 0.00 -2.23 0.00 0.00 178.31 177.04 1xk5 h ARG 204 N -0.89 -0.01 -0.58 1.11 3.08 -1.01 0.34 114.38 116.42 1xk5 h ARG 204 Ca -0.02 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 1xk5 h ARG 204 Cb 1.08 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.10 1xk5 h ARG 204 CO 0.02 -0.01 0.33 0.74 -1.07 0.00 0.00 179.97 179.98 1xk5 h PHE 205 N -0.01 0.77 0.03 3.04 0.05 -0.55 -2.33 116.94 117.94 1xk5 h PHE 205 Ca 0.13 -0.00 -0.23 0.00 3.82 0.00 0.00 57.97 61.68 1xk5 h PHE 205 Cb 0.21 -0.25 0.00 0.00 2.00 0.00 0.00 35.95 37.91 1xk5 h PHE 205 CO -0.27 0.53 -1.00 -0.92 -0.18 0.00 0.00 178.31 176.48 1xk5 h TYR 206 N 0.80 0.53 0.00 -0.55 5.03 -1.03 -2.50 116.97 119.26 1xk5 h TYR 206 Ca 0.21 -0.31 -0.02 0.00 2.58 0.00 0.00 58.73 61.19 1xk5 h TYR 206 Cb 0.00 -0.05 -0.00 0.00 1.55 0.00 0.00 36.73 38.23 1xk5 h TYR 206 CO 0.00 1.15 -0.09 2.35 -1.32 0.00 0.00 178.16 180.25 1xk5 h TRP 207 N 0.17 0.00 0.00 -3.82 7.01 0.14 -2.03 115.95 117.42 1xk5 h TRP 207 Ca -0.09 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.91 1xk5 h TRP 207 Cb 1.65 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.71 1xk5 h TRP 207 CO 0.06 0.09 -1.36 0.00 -2.79 0.00 0.00 178.44 174.44 1xk5 n MET 208 N -3.53 0.32 0.24 2.65 0.00 -0.92 -2.44 117.12 113.46 1xk5 n MET 208 Ca -0.02 -0.07 0.11 0.00 0.00 0.00 0.00 57.70 57.73 1xk5 n MET 208 Cb 0.23 -1.54 0.61 0.00 0.00 0.00 0.00 33.22 32.51 1xk5 n MET 208 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 175.97 177.22 1xk5 h HIS 209 N 0.00 0.00 0.00 3.17 -0.00 -0.89 -3.10 115.15 114.33 1xk5 h HIS 209 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 60.37 60.29 1xk5 h HIS 209 Cb 0.75 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.15 1xk5 h HIS 209 CO 0.00 0.17 -1.30 -1.13 -0.00 0.00 0.00 177.93 175.67 1xk5 n SER 210 N -3.53 3.89 0.08 3.26 3.41 -1.16 -4.70 113.62 114.88 1xk5 n SER 210 Ca -0.01 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.57 1xk5 n SER 210 Cb 0.33 0.66 -0.07 0.00 -0.26 0.00 0.00 64.21 64.87 1xk5 n SER 210 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1xk5 h LYS 211 N 0.00 0.00 -0.17 4.33 1.79 -1.58 -3.27 116.57 117.67 1xk5 h LYS 211 Ca -0.11 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.33 1xk5 h LYS 211 Cb 1.20 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.84 1xk5 h LYS 211 CO 0.01 0.73 -0.01 -0.07 -1.08 0.00 0.00 179.45 179.03 1xk5 h LEU 212 N 0.00 0.30 -2.16 2.94 3.38 -1.78 -2.96 115.31 115.03 1xk5 h LEU 212 Ca -0.04 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.59 1xk5 h LEU 212 Cb 1.64 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 42.30 1xk5 h LEU 212 CO 0.10 0.56 -0.07 -0.65 0.09 0.00 0.00 178.44 178.47 1xk5 h PRO 213 N 0.03 0.00 0.00 1.13 0.11 -1.81 -2.22 132.00 129.24 1xk5 h PRO 213 Ca 0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1xk5 h PRO 213 Cb 0.41 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.52 1xk5 h PRO 213 CO 0.01 0.07 0.00 0.39 -0.21 0.00 0.00 178.00 178.26 1xk5 n GLU 214 N -3.81 0.14 -3.28 1.05 1.02 -1.12 -4.54 120.64 110.10 1xk5 n GLU 214 Ca -0.02 0.19 -0.40 0.00 -0.02 0.00 0.00 57.16 56.90 1xk5 n GLU 214 Cb 0.16 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.00 1xk5 n GLU 214 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1xk5 s GLU 215 N -2.65 3.79 0.00 3.49 8.01 -0.84 -5.03 118.70 125.47 1xk5 s GLU 215 Ca 0.11 -0.04 0.00 0.00 0.01 0.00 0.00 54.97 55.05 1xk5 s GLU 215 Cb 0.08 -3.74 0.00 0.00 -4.31 0.00 0.00 34.13 26.16 1xk5 s GLU 215 CO 0.20 -0.49 0.00 -0.85 0.01 0.00 0.00 175.26 174.12 1xk5 n GLU 216 N 5.58 0.00 -1.26 1.61 0.28 -1.26 -2.82 120.64 122.77 1xk5 n GLU 216 Ca -0.06 0.00 -0.19 0.00 -0.16 0.00 0.00 57.16 56.75 1xk5 n GLU 216 Cb 0.49 -0.08 0.13 0.00 1.43 0.00 0.00 31.44 33.42 1xk5 n GLU 216 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1xk5 n GLY 217 N -0.03 5.40 0.34 -1.84 0.00 -1.26 -4.69 105.19 103.11 1xk5 n GLY 217 Ca 0.00 -1.77 0.12 0.00 0.00 0.00 0.00 46.02 44.37 1xk5 n GLY 217 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1xk5 h LEU 218 N 1.49 0.28 -0.70 0.99 5.85 -1.83 -1.18 115.31 120.20 1xk5 h LEU 218 Ca 0.42 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.14 1xk5 h LEU 218 Cb 1.62 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.60 1xk5 h LEU 218 CO 0.88 0.17 0.00 0.61 -0.34 0.00 0.00 178.44 179.77 1xk5 n GLY 219 N -1.54 -0.15 3.17 3.75 0.00 -1.26 -1.77 105.19 107.40 1xk5 n GLY 219 Ca 0.07 -0.27 -0.18 0.00 0.00 0.00 0.00 46.02 45.65 1xk5 n GLY 219 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1xk5 s GLU 220 N -1.81 0.82 0.07 1.61 -1.05 -0.45 -4.77 118.70 113.12 1xk5 s GLU 220 Ca 0.24 -0.99 -0.31 0.00 -0.15 0.00 0.00 54.97 53.76 1xk5 s GLU 220 Cb 0.12 -0.77 -0.06 0.00 -0.44 0.00 0.00 34.13 32.98 1xk5 s GLU 220 CO 0.18 0.16 1.30 0.21 0.95 0.00 0.00 175.26 178.07 1xk5 s LYS 221 N -1.91 4.36 0.15 -4.83 2.20 -1.26 -4.66 119.74 113.79 1xk5 s LYS 221 Ca -0.01 1.92 -0.19 0.00 -0.36 0.00 0.00 55.97 57.33 1xk5 s LYS 221 Cb -0.09 -3.34 0.05 0.00 -1.51 0.00 0.00 37.83 32.94 1xk5 s LYS 221 CO 0.02 -0.38 0.51 0.99 -0.36 0.00 0.00 175.35 176.13 1xk5 s THR 222 N 1.27 0.03 0.33 3.43 2.01 0.20 -4.96 115.64 117.96 1xk5 s THR 222 Ca 0.62 -0.37 0.11 0.00 0.31 0.00 0.00 61.69 62.36 1xk5 s THR 222 Cb -0.33 -1.17 0.36 0.00 0.01 0.00 0.00 72.50 71.37 1xk5 s THR 222 CO 0.29 -0.15 1.60 0.07 -0.69 0.00 0.00 174.62 175.74 1xk5 h LYS 223 N 2.18 0.08 0.00 4.92 5.09 -1.98 0.43 116.57 127.28 1xk5 h LYS 223 Ca -0.33 -0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.41 1xk5 h LYS 223 Cb 1.28 -0.02 0.00 0.00 0.10 0.00 0.00 32.23 33.59 1xk5 h LYS 223 CO 0.41 0.05 -0.98 1.28 -2.09 0.00 0.00 179.45 178.12 1xk5 n LEU 224 N -5.30 0.63 -3.42 7.07 4.77 -1.26 -4.55 117.00 114.94 1xk5 n LEU 224 Ca 0.30 -0.04 -0.26 0.00 -0.03 0.00 0.00 56.01 55.97 1xk5 n LEU 224 Cb 0.99 -0.10 -0.09 0.00 -2.33 0.00 0.00 43.42 41.88 1xk5 n LEU 224 CO 0.01 0.06 -0.20 -3.20 -1.33 0.00 0.00 177.39 172.72 1xk5 n ASN 225 N -1.90 0.97 0.24 -1.43 5.15 0.14 -2.28 115.26 116.15 1xk5 n ASN 225 Ca 0.02 -2.78 0.09 0.00 -0.60 0.00 0.00 54.58 51.31 1xk5 n ASN 225 Cb 0.42 -0.63 0.62 0.00 -0.53 0.00 0.00 39.78 39.66 1xk5 n ASN 225 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1xk5 h PRO 226 N 4.86 0.00 -5.27 1.20 0.13 -1.42 0.56 132.00 132.07 1xk5 h PRO 226 Ca 0.18 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.65 1xk5 h PRO 226 Cb 0.84 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 31.69 1xk5 h PRO 226 CO 0.53 0.15 -0.76 -0.06 -0.23 0.00 0.00 178.00 177.63 1xk5 s PHE 227 N -4.43 2.83 0.43 1.56 0.40 -1.26 -4.63 117.98 112.87 1xk5 s PHE 227 Ca -0.03 -0.73 -0.23 0.00 -0.60 0.00 0.00 56.93 55.34 1xk5 s PHE 227 Cb 0.15 -1.88 -0.09 0.00 0.51 0.00 0.00 43.02 41.71 1xk5 s PHE 227 CO 0.64 -0.28 1.06 0.15 0.70 0.00 0.00 175.22 177.49 1xk5 s LYS 228 N 0.53 4.02 -0.19 0.44 1.02 -1.09 -4.86 119.74 119.62 1xk5 s LYS 228 Ca -0.08 1.51 0.01 0.00 0.02 0.00 0.00 55.97 57.42 1xk5 s LYS 228 Cb -0.16 -2.41 0.04 0.00 -0.52 0.00 0.00 37.83 34.78 1xk5 s LYS 228 CO 0.04 -0.27 -0.12 -0.06 -0.92 0.00 0.00 175.35 174.02 1xk5 s PHE 229 N -1.73 2.43 -0.13 3.18 0.08 -0.73 0.67 117.98 121.75 1xk5 s PHE 229 Ca 0.61 -1.53 0.00 0.00 0.12 0.00 0.00 56.93 56.13 1xk5 s PHE 229 Cb -0.21 -1.67 0.02 0.00 -0.57 0.00 0.00 43.02 40.59 1xk5 s PHE 229 CO 0.26 -0.74 -0.12 0.08 -0.10 0.00 0.00 175.22 174.61 1xk5 s VAL 230 N 1.40 1.36 0.29 -0.44 1.01 -0.92 -4.06 120.40 119.03 1xk5 s VAL 230 Ca 0.01 -0.50 -0.29 0.00 0.00 0.00 0.00 61.98 61.20 1xk5 s VAL 230 Cb -0.15 -1.31 -0.10 0.00 0.00 0.00 0.00 36.38 34.82 1xk5 s VAL 230 CO -0.09 0.42 1.31 -0.83 0.00 0.00 0.00 175.10 175.91 1xk5 s GLY 231 N 1.56 2.79 0.27 4.51 0.00 -1.26 -0.91 107.32 114.27 1xk5 s GLY 231 Ca 0.05 1.21 -0.24 0.00 0.00 0.00 0.00 44.72 45.74 1xk5 s GLY 231 CO -0.10 1.97 0.85 1.08 0.00 0.00 0.00 173.10 176.90 1xk5 s LEU 232 N -1.19 4.39 0.25 0.66 1.43 -0.21 -4.83 118.68 119.18 1xk5 s LEU 232 Ca 0.52 1.68 -0.20 0.00 -1.03 0.00 0.00 54.13 55.10 1xk5 s LEU 232 Cb -0.39 -3.76 -0.09 0.00 0.03 0.00 0.00 46.19 41.99 1xk5 s LEU 232 CO 0.47 0.01 0.76 -0.54 0.23 0.00 0.00 176.35 177.28 1xk5 s LYS 233 N -1.87 4.27 0.14 1.70 1.02 -1.26 -4.97 119.74 118.77 1xk5 s LYS 233 Ca 0.45 0.91 0.11 0.00 0.02 0.00 0.00 55.97 57.46 1xk5 s LYS 233 Cb -0.19 -2.81 -0.04 0.00 -0.52 0.00 0.00 37.83 34.27 1xk5 s LYS 233 CO 0.24 0.35 -0.24 0.54 -0.92 0.00 0.00 175.35 175.32 1xk5 s ASN 234 N -1.72 3.51 0.21 2.83 2.20 -1.26 -4.13 114.94 116.59 1xk5 s ASN 234 Ca 0.45 -0.73 0.01 0.00 -0.94 0.00 0.00 52.86 51.66 1xk5 s ASN 234 Cb -0.16 -0.32 -0.05 0.00 -2.00 0.00 0.00 41.25 38.72 1xk5 s ASN 234 CO 0.21 0.16 0.05 -0.36 -2.94 0.00 0.00 177.10 174.22 1xk5 s PHE 235 N -1.25 1.36 0.83 1.54 0.40 0.16 -4.94 117.98 116.08 1xk5 s PHE 235 Ca 0.17 -1.11 -0.11 0.00 -0.60 0.00 0.00 56.93 55.28 1xk5 s PHE 235 Cb -0.10 -0.78 0.09 0.00 0.51 0.00 0.00 43.02 42.74 1xk5 s PHE 235 CO 0.08 -0.28 1.09 -2.14 0.70 0.00 0.00 175.22 174.67 1xk5 s PRO 236 N -3.98 1.83 -0.26 0.24 0.02 -1.26 -0.39 135.00 131.20 1xk5 s PRO 236 Ca 0.31 0.81 0.12 0.00 0.02 0.00 0.00 61.00 62.26 1xk5 s PRO 236 Cb 0.07 -1.87 0.59 0.00 0.02 0.00 0.00 34.50 33.31 1xk5 s PRO 236 CO 0.09 -1.84 1.56 0.00 -0.33 0.00 0.00 177.00 176.48 1xk5 s THR 238 N -3.01 3.52 0.22 0.00 -4.23 -1.26 -4.16 115.64 106.72 1xk5 s THR 238 Ca 0.47 0.58 -0.09 0.00 -1.18 0.00 0.00 61.69 61.48 1xk5 s THR 238 Cb 0.39 -3.14 0.17 0.00 1.34 0.00 0.00 72.50 71.27 1xk5 s THR 238 CO 0.08 -0.56 1.72 -0.65 -0.54 0.00 0.00 174.62 174.67 1xk5 h PRO 239 N -0.49 0.33 -0.58 3.99 0.11 -1.96 0.20 132.00 133.61 1xk5 h PRO 239 Ca -0.45 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.61 1xk5 h PRO 239 Cb 1.23 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.24 1xk5 h PRO 239 CO 0.54 0.22 0.25 0.93 -0.21 0.00 0.00 178.00 179.73 1xk5 h GLU 240 N 0.34 0.85 0.22 1.05 3.07 -1.96 -1.88 114.58 116.27 1xk5 h GLU 240 Ca 0.33 -0.14 -0.01 0.00 -0.50 0.00 0.00 59.36 59.04 1xk5 h GLU 240 Cb 0.47 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.24 1xk5 h GLU 240 CO -0.37 0.71 -0.11 1.03 -1.40 0.00 0.00 179.01 178.87 1xk5 h SER 241 N 0.79 -0.25 -1.00 1.42 0.87 -1.67 -0.10 113.55 113.61 1xk5 h SER 241 Ca 0.20 -0.09 0.23 0.00 -1.23 0.00 0.00 61.79 60.90 1xk5 h SER 241 Cb 0.16 0.06 -0.10 0.00 -0.44 0.00 0.00 62.40 62.09 1xk5 h SER 241 CO -0.02 -0.07 0.63 -0.07 -0.53 0.00 0.00 176.83 176.77 1xk5 h LEU 242 N -0.43 0.57 -0.33 2.23 4.07 -0.87 0.41 115.31 120.95 1xk5 h LEU 242 Ca -0.03 0.09 -0.17 0.00 0.08 0.00 0.00 57.88 57.84 1xk5 h LEU 242 Cb 0.32 -0.01 -0.00 0.00 1.08 0.00 0.00 40.66 42.05 1xk5 h LEU 242 CO 0.05 0.16 -0.46 0.00 -1.08 0.00 0.00 178.44 177.11 1xk5 h ASP 244 N 0.70 -1.05 -0.57 0.00 3.45 0.16 -2.57 116.42 116.54 1xk5 h ASP 244 Ca 0.04 0.06 0.04 0.00 0.43 0.00 0.00 57.03 57.59 1xk5 h ASP 244 Cb 1.07 0.30 -0.04 0.00 -0.56 0.00 0.00 39.33 40.09 1xk5 h ASP 244 CO 0.11 -0.66 0.32 -0.37 -1.57 0.00 0.00 179.24 177.07 1xk5 h VAL 245 N -1.06 1.00 0.00 -1.35 -1.51 -0.93 -1.00 116.25 111.39 1xk5 h VAL 245 Ca -0.09 -0.21 0.00 0.00 -1.23 0.00 0.00 66.70 65.17 1xk5 h VAL 245 Cb 0.85 0.33 0.00 0.00 -2.13 0.00 0.00 31.29 30.34 1xk5 h VAL 245 CO 0.10 0.11 0.00 0.18 -1.23 0.00 0.00 177.57 176.74 1xk5 n LEU 246 N -4.81 0.00 -0.37 4.19 4.77 -0.66 -0.69 117.00 119.43 1xk5 n LEU 246 Ca 0.06 0.50 0.04 0.00 -0.03 0.00 0.00 56.01 56.57 1xk5 n LEU 246 Cb 0.12 -0.50 0.07 0.00 -2.33 0.00 0.00 43.42 40.79 1xk5 n LEU 246 CO 0.30 -0.43 0.50 -1.54 -1.33 0.00 0.00 177.39 174.90 1xk5 n SER 247 N -1.50 2.21 -4.89 -1.43 3.41 -0.42 -4.69 113.62 106.31 1xk5 n SER 247 Ca 0.01 -1.73 -0.29 0.00 -0.26 0.00 0.00 58.87 56.61 1xk5 n SER 247 Cb 0.05 -0.09 0.01 0.00 -0.26 0.00 0.00 64.21 63.92 1xk5 n SER 247 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1xk5 s MET 248 N -0.85 3.40 -0.15 4.33 -1.94 0.13 -5.07 119.30 119.16 1xk5 s MET 248 Ca 0.13 0.37 -0.03 0.00 -1.71 0.00 0.00 55.69 54.45 1xk5 s MET 248 Cb 0.07 -2.23 -0.03 0.00 2.01 0.00 0.00 34.83 34.66 1xk5 s MET 248 CO 0.10 -0.48 -0.04 -0.51 -0.01 0.00 0.00 175.02 174.08 1xk5 s ASP 249 N -4.19 4.81 0.14 3.03 1.01 -1.26 -5.03 116.67 115.19 1xk5 s ASP 249 Ca 0.52 -0.11 0.08 0.00 0.71 0.00 0.00 52.55 53.76 1xk5 s ASP 249 Cb -0.11 -1.73 -0.04 0.00 1.01 0.00 0.00 42.92 42.05 1xk5 s ASP 249 CO 0.49 0.19 -0.12 -0.36 0.21 0.00 0.00 175.17 175.58 1xk5 s PHE 250 N 0.22 2.63 -0.92 4.23 0.40 -1.26 -5.01 117.98 118.28 1xk5 s PHE 250 Ca -0.02 -0.22 0.00 0.00 -0.60 0.00 0.00 56.93 56.09 1xk5 s PHE 250 Cb -0.14 -1.34 0.00 0.00 0.51 0.00 0.00 43.02 42.05 1xk5 s PHE 250 CO 0.03 0.45 0.51 -0.35 0.70 0.00 0.00 175.22 176.56 1xk5 n PRO 251 N 0.43 0.95 -3.73 0.24 -0.04 -1.26 -4.79 135.00 126.80 1xk5 n PRO 251 Ca -0.13 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.23 1xk5 n PRO 251 Cb 0.54 -1.44 -0.04 0.00 -0.04 0.00 0.00 33.50 32.52 1xk5 n PRO 251 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1xk5 s PHE 252 N -0.92 -0.11 -0.40 0.54 -0.71 -1.26 -5.04 117.98 110.09 1xk5 s PHE 252 Ca 0.00 -0.23 -0.29 0.00 -1.04 0.00 0.00 56.93 55.37 1xk5 s PHE 252 Cb 0.00 0.35 0.02 0.00 -1.21 0.00 0.00 43.02 42.18 1xk5 s PHE 252 CO 0.00 -0.88 1.23 -2.00 -1.34 0.00 0.00 175.22 172.23 1xk5 s GLU 253 N -3.87 3.79 0.21 1.99 2.12 -1.26 -4.95 118.70 116.74 1xk5 s GLU 253 Ca 0.09 0.88 -0.31 0.00 0.36 0.00 0.00 54.97 55.99 1xk5 s GLU 253 Cb -0.00 -3.90 -0.10 0.00 0.26 0.00 0.00 34.13 30.38 1xk5 s GLU 253 CO -0.04 -1.29 1.55 0.54 -0.54 0.00 0.00 175.26 175.48 1xk5 s VAL 254 N 4.53 2.49 -0.26 3.70 0.11 -1.26 -0.02 120.40 129.69 1xk5 s VAL 254 Ca 0.52 0.38 -0.13 0.00 -2.93 0.00 0.00 61.98 59.82 1xk5 s VAL 254 Cb -0.11 -3.24 -0.14 0.00 -1.53 0.00 0.00 36.38 31.35 1xk5 s VAL 254 CO 0.27 0.04 -0.25 -0.67 -3.33 0.00 0.00 175.10 171.17 1xk5 n ASP 255 N 3.19 1.95 -2.17 3.54 4.64 0.18 -4.70 116.55 123.19 1xk5 n ASP 255 Ca 0.11 0.30 -0.01 0.00 -1.38 0.00 0.00 54.79 53.81 1xk5 n ASP 255 Cb 0.39 -0.80 0.01 0.00 -1.04 0.00 0.00 41.12 39.68 1xk5 n ASP 255 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1xk5 n GLY 256 N 1.40 0.86 3.26 0.27 0.00 -1.13 -4.61 105.19 105.23 1xk5 n GLY 256 Ca -0.50 -1.01 -0.32 0.00 0.00 0.00 0.00 46.02 44.19 1xk5 n GLY 256 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xk5 s LEU 257 N 0.00 2.14 -0.12 0.99 1.43 -0.39 0.87 118.68 123.60 1xk5 s LEU 257 Ca 0.12 -0.51 -0.03 0.00 -1.03 0.00 0.00 54.13 52.67 1xk5 s LEU 257 Cb -0.01 -1.41 -0.03 0.00 0.03 0.00 0.00 46.19 44.77 1xk5 s LEU 257 CO 0.02 0.20 0.01 -0.76 0.23 0.00 0.00 176.35 176.06 1xk5 s LEU 258 N 0.08 3.60 -0.27 1.79 1.43 0.64 -2.15 118.68 123.80 1xk5 s LEU 258 Ca -0.11 0.10 -0.04 0.00 -1.03 0.00 0.00 54.13 53.06 1xk5 s LEU 258 Cb -0.16 -1.85 0.02 0.00 0.03 0.00 0.00 46.19 44.23 1xk5 s LEU 258 CO 0.06 0.30 -0.00 -0.36 0.23 0.00 0.00 176.35 176.58 1xk5 s PHE 259 N -0.43 3.11 0.04 0.29 0.08 0.14 -0.28 117.98 120.93 1xk5 s PHE 259 Ca 0.08 -1.34 0.02 0.00 0.12 0.00 0.00 56.93 55.80 1xk5 s PHE 259 Cb -0.12 -2.14 -0.04 0.00 -0.57 0.00 0.00 43.02 40.16 1xk5 s PHE 259 CO 0.02 -0.67 0.05 0.71 -0.10 0.00 0.00 175.22 175.23 1xk5 s TYR 260 N 1.39 3.17 -0.06 0.36 2.02 0.68 -0.17 117.35 124.74 1xk5 s TYR 260 Ca 0.01 0.11 -0.19 0.00 -0.37 0.00 0.00 57.07 56.63 1xk5 s TYR 260 Cb -0.17 -1.66 -0.05 0.00 -0.40 0.00 0.00 41.96 39.68 1xk5 s TYR 260 CO -0.02 0.51 0.51 -1.58 -1.57 0.00 0.00 175.55 173.41 1xk5 s HIS 261 N -1.25 3.61 0.40 2.71 5.65 -1.14 -0.85 115.29 124.42 1xk5 s HIS 261 Ca 0.25 1.03 0.10 0.00 0.25 0.00 0.00 55.06 56.68 1xk5 s HIS 261 Cb -0.12 -2.54 0.90 0.00 -1.18 0.00 0.00 32.58 29.64 1xk5 s HIS 261 CO 0.17 0.31 1.98 0.87 -0.65 0.00 0.00 174.74 177.42 1xk5 h LYS 262 N 6.00 0.54 0.00 2.88 1.57 -1.44 -3.17 116.57 122.96 1xk5 h LYS 262 Ca -0.44 -0.03 -0.20 0.00 -1.87 0.00 0.00 60.65 58.10 1xk5 h LYS 262 Cb 1.19 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 33.35 1xk5 h LYS 262 CO 0.71 0.36 -0.99 1.96 -0.57 0.00 0.00 179.45 180.92 1xk5 h GLN 263 N 0.56 0.00 -7.00 3.15 7.50 -1.93 -2.32 115.11 115.07 1xk5 h GLN 263 Ca 0.27 0.00 -0.56 0.00 0.50 0.00 0.00 58.65 58.86 1xk5 h GLN 263 Cb 0.35 0.00 0.14 0.00 0.05 0.00 0.00 27.48 28.02 1xk5 h GLN 263 CO -0.08 0.94 0.52 -2.37 -1.50 0.00 0.00 178.83 176.33 1xk5 n THR 264 N -3.33 3.86 -2.04 -0.54 5.66 -1.20 -4.27 114.28 112.42 1xk5 n THR 264 Ca -0.01 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.49 1xk5 n THR 264 Cb 0.93 -1.57 0.00 0.00 -1.55 0.00 0.00 70.33 68.14 1xk5 n THR 264 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1xk5 n HIS 265 N -1.16 -2.33 -3.63 1.09 1.44 -1.26 0.31 115.22 109.68 1xk5 n HIS 265 Ca 0.11 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.43 1xk5 n HIS 265 Cb 0.45 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.44 1xk5 n HIS 265 CO 0.00 0.00 0.00 -0.47 -2.81 0.00 0.00 176.34 173.06 1xk5 s TYR 266 N 0.64 3.22 -0.08 -1.40 6.14 0.29 -4.81 117.35 121.36 1xk5 s TYR 266 Ca 0.00 -0.89 0.01 0.00 0.64 0.00 0.00 57.07 56.83 1xk5 s TYR 266 Cb 0.00 -2.40 0.02 0.00 0.42 0.00 0.00 41.96 40.00 1xk5 s TYR 266 CO 0.00 -0.60 -0.09 -1.54 0.64 0.00 0.00 175.55 173.96 1xk5 s SER 267 N 1.56 1.80 0.35 4.32 1.04 -1.26 -4.76 113.70 116.75 1xk5 s SER 267 Ca 0.02 -0.27 -0.28 0.00 0.48 0.00 0.00 55.95 55.90 1xk5 s SER 267 Cb -0.18 -0.77 -0.12 0.00 0.10 0.00 0.00 66.02 65.05 1xk5 s SER 267 CO 0.06 -0.04 1.38 -2.65 0.98 0.00 0.00 173.24 172.97 1xk5 n PRO 268 N 4.28 2.35 0.00 4.02 -0.02 -1.26 -4.22 135.00 140.16 1xk5 n PRO 268 Ca -0.19 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1xk5 n PRO 268 Cb 0.51 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1xk5 n PRO 268 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xk5 n GLY 269 N 0.79 1.03 3.79 -1.23 0.00 -0.51 -4.86 105.19 104.21 1xk5 n GLY 269 Ca 0.04 -2.19 -0.34 0.00 0.00 0.00 0.00 46.02 43.53 1xk5 n GLY 269 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xk5 s SER 270 N 0.00 6.36 -0.09 1.61 1.04 -1.25 0.24 113.70 121.61 1xk5 s SER 270 Ca 0.00 1.96 -0.21 0.00 0.48 0.00 0.00 55.95 58.18 1xk5 s SER 270 Cb 0.00 -2.56 0.05 0.00 0.10 0.00 0.00 66.02 63.60 1xk5 s SER 270 CO 0.00 -0.77 0.49 0.28 0.98 0.00 0.00 173.24 174.22 1xk5 s THR 271 N -1.92 0.02 -0.68 2.02 -1.32 0.29 -4.81 115.64 109.24 1xk5 s THR 271 Ca 0.66 -0.17 0.25 0.00 -1.21 0.00 0.00 61.69 61.23 1xk5 s THR 271 Cb -0.18 -0.76 0.27 0.00 -1.51 0.00 0.00 72.50 70.32 1xk5 s THR 271 CO 0.21 -0.09 1.76 -0.81 -2.21 0.00 0.00 174.62 173.48 1xk5 n PRO 272 N 1.72 0.23 0.00 7.08 -0.04 -1.26 -3.10 135.00 139.63 1xk5 n PRO 272 Ca -0.18 0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1xk5 n PRO 272 Cb 0.56 -1.81 0.02 0.00 -0.04 0.00 0.00 33.50 32.24 1xk5 n PRO 272 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1xk5 n LEU 273 N -2.21 0.00 -3.63 1.53 4.32 -1.26 -4.53 117.00 111.22 1xk5 n LEU 273 Ca 0.05 0.00 -0.22 0.00 -0.02 0.00 0.00 56.01 55.82 1xk5 n LEU 273 Cb 0.37 0.00 -0.17 0.00 -1.62 0.00 0.00 43.42 42.00 1xk5 n LEU 273 CO 0.27 0.00 -0.32 -0.69 -1.22 0.00 0.00 177.39 175.43 1xk5 s VAL 274 N -2.00 -0.13 0.20 4.08 1.01 -1.18 -2.88 120.40 119.51 1xk5 s VAL 274 Ca 0.01 0.14 0.05 0.00 0.00 0.00 0.00 61.98 62.19 1xk5 s VAL 274 Cb 0.00 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.98 1xk5 s VAL 274 CO 0.01 -0.04 0.20 -0.83 0.00 0.00 0.00 175.10 174.44 1xk5 s GLY 275 N 2.18 1.54 -0.01 4.51 0.00 0.75 -1.75 107.32 114.55 1xk5 s GLY 275 Ca 0.04 -1.27 0.02 0.00 0.00 0.00 0.00 44.72 43.51 1xk5 s GLY 275 CO -0.06 -1.29 -0.06 0.86 0.00 0.00 0.00 173.10 172.55 1xk5 s TRP 276 N -1.91 0.56 -0.17 1.90 -0.11 0.79 0.28 118.94 120.28 1xk5 s TRP 276 Ca 0.32 -0.11 -0.21 0.00 1.22 0.00 0.00 56.10 57.32 1xk5 s TRP 276 Cb -0.09 -0.39 0.05 0.00 -1.50 0.00 0.00 33.47 31.54 1xk5 s TRP 276 CO 0.25 -0.03 0.56 -0.51 -4.62 0.00 0.00 176.95 172.60 1xk5 s LEU 277 N 0.02 -0.15 0.50 5.86 1.43 -0.92 -1.30 118.68 124.12 1xk5 s LEU 277 Ca 0.00 0.97 -0.20 0.00 -1.03 0.00 0.00 54.13 53.87 1xk5 s LEU 277 Cb -0.04 1.98 -0.08 0.00 0.03 0.00 0.00 46.19 48.08 1xk5 s LEU 277 CO -0.00 -0.29 1.06 -0.13 0.23 0.00 0.00 176.35 177.22 1xk5 s ARG 278 N -0.10 3.69 0.17 1.70 1.81 -1.26 -1.26 118.95 123.69 1xk5 s ARG 278 Ca -0.03 1.40 -0.14 0.00 -1.72 0.00 0.00 55.73 55.23 1xk5 s ARG 278 Cb -0.03 -2.07 0.14 0.00 -0.45 0.00 0.00 34.95 32.53 1xk5 s ARG 278 CO 0.03 -0.53 1.72 -1.00 -0.68 0.00 0.00 175.30 174.83 1xk5 h PRO 279 N 1.43 0.20 -0.27 3.54 0.13 -1.82 -1.55 132.00 133.67 1xk5 h PRO 279 Ca -0.49 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1xk5 h PRO 279 Cb 1.23 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1xk5 h PRO 279 CO 0.58 0.13 0.00 2.48 -0.23 0.00 0.00 178.00 180.96 1xk5 n TYR 280 N -5.12 0.00 -0.03 1.56 0.18 -0.91 -2.72 117.16 110.12 1xk5 n TYR 280 Ca 0.04 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.82 1xk5 n TYR 280 Cb 0.21 -0.03 -0.07 0.00 -0.38 0.00 0.00 39.34 39.07 1xk5 n TYR 280 CO 0.00 0.00 0.00 -1.33 -2.08 0.00 0.00 176.86 173.45 1xk5 n MET 281 N -0.09 1.46 -0.29 -3.48 2.81 -0.58 -4.72 117.12 112.23 1xk5 n MET 281 Ca 0.00 -0.04 0.10 0.00 -1.81 0.00 0.00 57.70 55.95 1xk5 n MET 281 Cb 0.07 -1.23 0.26 0.00 -0.71 0.00 0.00 33.22 31.60 1xk5 n MET 281 CO 0.00 0.00 0.00 -0.39 1.51 0.00 0.00 175.97 177.09 1xk5 h VAL 282 N 0.00 0.50 -0.18 2.03 -1.51 -1.61 -2.62 116.25 112.85 1xk5 h VAL 282 Ca -0.13 -0.12 0.03 0.00 -1.23 0.00 0.00 66.70 65.25 1xk5 h VAL 282 Cb 1.02 0.10 -0.07 0.00 -2.13 0.00 0.00 31.29 30.22 1xk5 h VAL 282 CO 0.01 0.07 -0.53 0.28 -1.23 0.00 0.00 177.57 176.17 1xk5 h SER 283 N 0.36 -1.69 0.46 4.19 0.02 -1.83 0.52 113.55 115.58 1xk5 h SER 283 Ca 0.50 0.20 -0.02 0.00 -0.84 0.00 0.00 61.79 61.63 1xk5 h SER 283 Cb 0.91 0.67 0.00 0.00 0.14 0.00 0.00 62.40 64.12 1xk5 h SER 283 CO -0.52 -0.45 -0.22 0.44 -1.14 0.00 0.00 176.83 174.94 1xk5 h ASP 284 N -0.53 -0.52 -0.47 3.07 5.19 -1.78 0.17 116.42 121.55 1xk5 h ASP 284 Ca 0.04 0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.46 1xk5 h ASP 284 Cb 0.64 0.13 -0.02 0.00 0.18 0.00 0.00 39.33 40.26 1xk5 h ASP 284 CO -0.45 -0.36 0.28 1.62 -3.12 0.00 0.00 179.24 177.21 1xk5 h VAL 285 N -0.64 1.14 -0.12 -1.35 3.04 -1.52 -2.71 116.25 114.09 1xk5 h VAL 285 Ca -0.06 -0.33 0.00 0.00 -1.01 0.00 0.00 66.70 65.30 1xk5 h VAL 285 Cb 0.47 0.47 0.00 0.00 -2.01 0.00 0.00 31.29 30.22 1xk5 h VAL 285 CO 0.10 0.15 0.00 0.18 -1.01 0.00 0.00 177.57 176.99 1xk5 n LEU 286 N -4.43 3.12 -3.93 3.16 4.32 0.18 -4.78 117.00 114.64 1xk5 n LEU 286 Ca 0.04 -1.13 -0.40 0.00 -0.02 0.00 0.00 56.01 54.50 1xk5 n LEU 286 Cb 0.08 -0.07 0.02 0.00 -1.62 0.00 0.00 43.42 41.84 1xk5 n LEU 286 CO 0.36 0.56 -0.15 0.61 -1.22 0.00 0.00 177.39 177.56 1xk5 n GLY 287 N 1.39 -0.95 3.17 -0.72 0.00 0.59 -4.96 105.19 103.71 1xk5 n GLY 287 Ca 0.15 0.40 -0.08 0.00 0.00 0.00 0.00 46.02 46.49 1xk5 n GLY 287 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xk5 s VAL 288 N -3.43 0.16 0.42 1.61 -7.23 -1.11 -5.06 120.40 105.77 1xk5 s VAL 288 Ca 0.41 -1.45 -0.22 0.00 -1.81 0.00 0.00 61.98 58.91 1xk5 s VAL 288 Cb -0.21 -1.47 -0.10 0.00 0.56 0.00 0.00 36.38 35.16 1xk5 s VAL 288 CO 0.93 -0.74 0.99 0.00 -0.31 0.00 0.00 175.10 175.98 1xk5 s ALA 289 N -3.90 3.03 -0.05 1.32 0.00 -1.26 -4.44 121.76 116.47 1xk5 s ALA 289 Ca 0.08 0.54 -0.08 0.00 0.00 0.00 0.00 51.96 52.49 1xk5 s ALA 289 Cb 0.06 -3.21 0.01 0.00 0.00 0.00 0.00 23.12 19.99 1xk5 s ALA 289 CO -0.09 -0.05 0.20 0.14 0.00 0.00 0.00 175.76 175.96 1xk5 s VAL 290 N -1.93 0.03 0.10 0.00 -7.23 -1.26 -4.78 120.40 105.34 1xk5 s VAL 290 Ca 0.61 -0.27 -0.31 0.00 -1.81 0.00 0.00 61.98 60.19 1xk5 s VAL 290 Cb -0.15 -0.38 -0.10 0.00 0.56 0.00 0.00 36.38 36.31 1xk5 s VAL 290 CO 0.20 -0.15 1.77 -2.84 -0.31 0.00 0.00 175.10 173.76 1xk5 s PRO 291 N -0.53 4.16 0.54 4.82 0.02 -1.26 -4.97 135.00 137.79 1xk5 s PRO 291 Ca -0.06 2.50 -0.21 0.00 0.02 0.00 0.00 61.00 63.25 1xk5 s PRO 291 Cb -0.04 -3.61 -0.05 0.00 0.02 0.00 0.00 34.50 30.82 1xk5 s PRO 291 CO 0.01 -0.81 1.30 0.00 -0.33 0.00 0.00 177.00 177.17 1xk5 s ALA 292 N 2.75 2.78 0.00 -1.55 0.00 -1.26 -4.59 121.76 119.89 1xk5 s ALA 292 Ca 0.79 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.95 1xk5 s ALA 292 Cb -0.44 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.17 1xk5 s ALA 292 CO 0.35 -1.22 0.00 0.41 0.00 0.00 0.00 175.76 175.30 1xk5 n GLY 293 N 0.66 0.69 0.38 0.00 0.00 -1.26 -4.94 105.19 100.71 1xk5 n GLY 293 Ca 0.11 -1.49 -0.02 0.00 0.00 0.00 0.00 46.02 44.62 1xk5 n GLY 293 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1xk5 n PRO 294 N -1.37 -0.24 0.28 1.61 -0.02 -1.26 -1.22 135.00 132.77 1xk5 n PRO 294 Ca 0.00 1.50 0.15 0.00 -2.02 0.00 0.00 63.50 63.13 1xk5 n PRO 294 Cb 0.00 -2.22 0.79 0.00 -0.02 0.00 0.00 33.50 32.05 1xk5 n PRO 294 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1xk5 h LEU 295 N 0.00 0.00 -0.88 2.45 3.38 -1.93 -3.03 115.31 115.31 1xk5 h LEU 295 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1xk5 h LEU 295 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1xk5 h LEU 295 CO -0.96 0.08 -0.27 1.07 0.09 0.00 0.00 178.44 178.45 1xk5 n THR 296 N -3.43 0.00 -2.10 0.22 5.66 -0.36 -2.14 114.28 112.13 1xk5 n THR 296 Ca -0.01 -0.37 -0.43 0.00 -3.05 0.00 0.00 64.05 60.19 1xk5 n THR 296 Cb 0.23 1.17 -0.03 0.00 -1.55 0.00 0.00 70.33 70.16 1xk5 n THR 296 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1xk5 s THR 297 N -1.66 3.69 0.49 1.09 2.01 -0.51 -4.60 115.64 116.16 1xk5 s THR 297 Ca 0.12 0.79 -0.17 0.00 0.31 0.00 0.00 61.69 62.74 1xk5 s THR 297 Cb 0.11 -3.66 -0.09 0.00 0.01 0.00 0.00 72.50 68.87 1xk5 s THR 297 CO 0.34 -0.24 0.97 -0.54 -0.69 0.00 0.00 174.62 174.46 1xk5 s LYS 298 N 4.52 4.01 -0.02 4.92 1.02 -1.26 -4.78 119.74 128.15 1xk5 s LYS 298 Ca 0.71 0.98 -0.22 0.00 0.02 0.00 0.00 55.97 57.46 1xk5 s LYS 298 Cb -0.26 -2.15 -0.05 0.00 -0.52 0.00 0.00 37.83 34.85 1xk5 s LYS 298 CO 0.29 -0.21 0.66 -1.25 -0.92 0.00 0.00 175.35 173.91 1xk5 s PRO 299 N -3.87 4.40 0.00 -1.68 0.04 -1.26 -5.17 135.00 127.46 1xk5 s PRO 299 Ca 0.59 0.84 0.00 0.00 0.04 0.00 0.00 61.00 62.47 1xk5 s PRO 299 Cb -0.10 -3.39 0.00 0.00 0.04 0.00 0.00 34.50 31.06 1xk5 s PRO 299 CO 0.27 0.24 0.30 -3.47 0.04 0.00 0.00 177.00 174.38