#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s79 s ARG 101 N 0.00 1.39 -0.35 1.61 6.06 -1.26 -5.10 118.95 121.31 1s79 s ARG 101 Ca 0.00 -1.09 -0.29 0.00 -2.50 0.00 0.00 55.73 51.85 1s79 s ARG 101 Cb 0.00 0.47 -0.01 0.00 0.06 0.00 0.00 34.95 35.47 1s79 s ARG 101 CO 0.00 -0.57 1.65 -1.58 -2.50 0.00 0.00 175.30 172.30 1s79 s TRP 102 N -3.95 2.03 -0.27 5.12 0.52 -1.26 -4.97 118.94 116.16 1s79 s TRP 102 Ca 0.16 0.63 -0.14 0.00 0.02 0.00 0.00 56.10 56.77 1s79 s TRP 102 Cb 0.00 -4.18 -0.04 0.00 -1.15 0.00 0.00 33.47 28.10 1s79 s TRP 102 CO 0.03 -2.63 0.35 0.42 0.02 0.00 0.00 176.95 175.14 1s79 s ILE 103 N 6.25 5.19 0.09 2.03 1.01 -1.26 -4.87 121.20 129.63 1s79 s ILE 103 Ca 0.73 0.52 0.00 0.00 0.00 0.00 0.00 60.65 61.89 1s79 s ILE 103 Cb -0.20 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 38.59 1s79 s ILE 103 CO 0.33 0.17 0.00 -0.11 0.00 0.00 0.00 174.94 175.33 1s79 n LEU 104 N 5.30 -0.18 -0.25 2.97 0.00 -1.26 -4.94 117.00 118.64 1s79 n LEU 104 Ca -0.09 0.15 0.02 0.00 0.00 0.00 0.00 56.01 56.09 1s79 n LEU 104 Cb 0.51 0.27 0.05 0.00 0.00 0.00 0.00 43.42 44.25 1s79 n LEU 104 CO 0.37 -0.55 0.51 2.29 0.00 0.00 0.00 177.39 180.01 1s79 n LYS 105 N -2.77 2.38 -2.91 1.96 2.85 -1.26 -4.97 118.16 113.44 1s79 n LYS 105 Ca 0.00 -1.56 -0.42 0.00 -1.05 0.00 0.00 58.31 55.28 1s79 n LYS 105 Cb 0.00 -1.11 -0.05 0.00 -0.65 0.00 0.00 35.03 33.23 1s79 n LYS 105 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 1s79 s ASN 106 N -0.89 6.70 -0.12 -5.58 3.04 -1.26 -5.03 114.94 111.79 1s79 s ASN 106 Ca 0.09 0.73 -0.11 0.00 0.04 0.00 0.00 52.86 53.61 1s79 s ASN 106 Cb 0.05 -2.42 -0.05 0.00 -1.54 0.00 0.00 41.25 37.29 1s79 s ASN 106 CO 0.06 -0.63 0.24 -1.81 -3.04 0.00 0.00 177.10 171.92 1s79 s ASP 107 N 1.60 6.46 0.29 -4.21 1.01 -1.26 -4.98 116.67 115.58 1s79 s ASP 107 Ca 0.34 0.54 0.13 0.00 0.71 0.00 0.00 52.55 54.27 1s79 s ASP 107 Cb -0.14 -2.14 0.41 0.00 1.01 0.00 0.00 42.92 42.05 1s79 s ASP 107 CO 0.12 0.26 1.62 0.58 0.21 0.00 0.00 175.17 177.96 1s79 h VAL 108 N 4.26 1.28 -0.62 -1.27 2.07 -1.96 -3.11 116.25 116.90 1s79 h VAL 108 Ca -0.48 -2.02 -0.06 0.00 0.82 0.00 0.00 66.70 64.96 1s79 h VAL 108 Cb 1.19 2.13 -0.03 0.00 -1.52 0.00 0.00 31.29 33.07 1s79 h VAL 108 CO 0.67 0.55 0.17 0.50 0.02 0.00 0.00 177.57 179.49 1s79 h LYS 109 N 0.00 0.98 0.00 1.57 3.64 -1.93 -0.09 116.57 120.74 1s79 h LYS 109 Ca -0.01 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 1s79 h LYS 109 Cb 1.09 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 1s79 h LYS 109 CO 0.07 0.88 0.00 0.09 -2.27 0.00 0.00 179.45 178.22 1s79 n ASN 110 N -4.36 0.00 -2.58 4.20 3.02 -1.18 -2.54 115.26 111.83 1s79 n ASN 110 Ca 0.04 0.12 -0.06 0.00 -0.03 0.00 0.00 54.58 54.65 1s79 n ASN 110 Cb 0.23 -0.28 0.04 0.00 -0.61 0.00 0.00 39.78 39.16 1s79 n ASN 110 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 1s79 n ARG 111 N -1.28 2.18 -4.14 3.52 1.85 -0.13 -4.51 116.66 114.15 1s79 n ARG 111 Ca 0.05 -3.65 -0.17 0.00 -1.00 0.00 0.00 57.85 53.08 1s79 n ARG 111 Cb 0.09 -1.75 -0.15 0.00 -1.05 0.00 0.00 32.46 29.60 1s79 n ARG 111 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1s79 s SER 112 N -3.71 0.69 -0.02 2.89 0.15 -0.72 -1.29 113.70 111.70 1s79 s SER 112 Ca 0.34 -0.10 0.04 0.00 0.70 0.00 0.00 55.95 56.93 1s79 s SER 112 Cb 0.35 -0.19 -0.01 0.00 -1.71 0.00 0.00 66.02 64.45 1s79 s SER 112 CO -0.02 0.01 -0.15 -0.69 1.20 0.00 0.00 173.24 173.59 1s79 s VAL 113 N 0.30 1.18 -0.15 4.45 1.01 0.40 -4.46 120.40 123.13 1s79 s VAL 113 Ca -0.03 -0.62 -0.06 0.00 0.00 0.00 0.00 61.98 61.27 1s79 s VAL 113 Cb -0.07 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 1s79 s VAL 113 CO -0.00 0.34 0.03 -0.47 0.00 0.00 0.00 175.10 175.00 1s79 s TYR 114 N -0.21 3.21 -0.06 5.22 5.04 -0.53 0.11 117.35 130.13 1s79 s TYR 114 Ca 0.03 0.05 0.06 0.00 -2.44 0.00 0.00 57.07 54.76 1s79 s TYR 114 Cb -0.07 -1.99 -0.01 0.00 0.35 0.00 0.00 41.96 40.24 1s79 s TYR 114 CO 0.00 0.21 -0.24 0.42 -1.34 0.00 0.00 175.55 174.61 1s79 s ILE 115 N 0.04 2.17 -0.05 3.14 1.01 -1.06 0.34 121.20 126.79 1s79 s ILE 115 Ca 0.04 -1.03 0.04 0.00 0.00 0.00 0.00 60.65 59.70 1s79 s ILE 115 Cb -0.12 -1.79 0.00 0.00 0.01 0.00 0.00 42.46 40.55 1s79 s ILE 115 CO 0.01 0.57 -0.16 -0.75 0.00 0.00 0.00 174.94 174.61 1s79 s LYS 116 N -0.22 1.85 0.00 2.79 2.47 0.91 -3.10 119.74 124.44 1s79 s LYS 116 Ca -0.02 -0.58 0.00 0.00 -1.56 0.00 0.00 55.97 53.81 1s79 s LYS 116 Cb -0.13 -1.56 0.00 0.00 -1.46 0.00 0.00 37.83 34.67 1s79 s LYS 116 CO 0.03 0.19 0.00 0.41 0.16 0.00 0.00 175.35 176.14 1s79 n GLY 117 N 3.33 0.23 3.53 5.54 0.00 -1.25 -1.04 105.19 115.53 1s79 n GLY 117 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 1s79 n GLY 117 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1s79 n PHE 118 N 0.00 -0.39 -0.35 1.61 3.72 -1.21 -3.96 117.46 116.88 1s79 n PHE 118 Ca 0.00 0.32 -0.29 0.00 -0.05 0.00 0.00 57.45 57.43 1s79 n PHE 118 Cb 0.00 -1.90 0.27 0.00 -0.94 0.00 0.00 39.48 36.90 1s79 n PHE 118 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1s79 n PRO 119 N -2.41 -3.80 0.00 -1.08 -0.02 -1.26 -4.84 135.00 121.59 1s79 n PRO 119 Ca 0.09 -1.12 0.06 0.00 -2.02 0.00 0.00 63.50 60.52 1s79 n PRO 119 Cb 0.52 -1.94 0.35 0.00 -0.02 0.00 0.00 33.50 32.42 1s79 n PRO 119 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 1s79 n THR 120 N -5.41 0.00 -2.46 3.45 5.66 -1.26 -3.15 114.28 111.11 1s79 n THR 120 Ca 0.09 0.00 0.03 0.00 -3.05 0.00 0.00 64.05 61.12 1s79 n THR 120 Cb 0.56 -0.25 0.01 0.00 -1.55 0.00 0.00 70.33 69.10 1s79 n THR 120 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1s79 n ASP 121 N -0.70 0.84 -3.44 1.09 9.92 -1.26 -4.99 116.55 118.00 1s79 n ASP 121 Ca 0.09 -2.00 -0.38 0.00 -0.53 0.00 0.00 54.79 51.96 1s79 n ASP 121 Cb 0.04 -0.25 -0.09 0.00 -0.64 0.00 0.00 41.12 40.18 1s79 n ASP 121 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1s79 n ALA 122 N 0.44 1.24 -1.42 2.24 0.00 -1.19 -4.75 120.51 117.07 1s79 n ALA 122 Ca 0.03 -2.40 -0.30 0.00 0.00 0.00 0.00 53.44 50.77 1s79 n ALA 122 Cb 1.11 -3.56 0.22 0.00 0.00 0.00 0.00 19.45 17.22 1s79 n ALA 122 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1s79 s THR 123 N 6.42 1.74 0.31 0.00 2.01 -1.26 -4.47 115.64 120.39 1s79 s THR 123 Ca 0.58 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.61 1s79 s THR 123 Cb 0.13 -2.69 0.29 0.00 0.01 0.00 0.00 72.50 70.24 1s79 s THR 123 CO 0.27 0.00 1.88 0.25 -0.69 0.00 0.00 174.62 176.33 1s79 h LEU 124 N -2.25 0.83 -0.29 4.42 7.12 -1.99 0.16 115.31 123.32 1s79 h LEU 124 Ca -0.44 0.03 -0.13 0.00 0.13 0.00 0.00 57.88 57.47 1s79 h LEU 124 Cb 1.27 -0.14 -0.00 0.00 -0.53 0.00 0.00 40.66 41.25 1s79 h LEU 124 CO 0.34 0.48 -0.33 0.44 -0.13 0.00 0.00 178.44 179.24 1s79 h ASP 125 N 0.91 0.79 -0.11 1.25 3.32 -1.95 -1.74 116.42 118.90 1s79 h ASP 125 Ca 0.43 -0.48 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 1s79 h ASP 125 Cb 0.43 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.76 1s79 h ASP 125 CO -0.20 1.11 -0.03 -0.78 -1.72 0.00 0.00 179.24 177.63 1s79 h ASP 126 N 0.48 0.21 -0.42 6.45 1.82 -1.62 -2.65 116.42 120.70 1s79 h ASP 126 Ca 0.04 -0.38 -0.02 0.00 -0.39 0.00 0.00 57.03 56.28 1s79 h ASP 126 Cb 0.91 -0.06 -0.02 0.00 0.68 0.00 0.00 39.33 40.84 1s79 h ASP 126 CO 0.08 0.54 0.21 0.40 -1.61 0.00 0.00 179.24 178.86 1s79 h ILE 127 N -0.12 1.16 0.00 2.25 2.04 -0.76 -1.27 117.51 120.81 1s79 h ILE 127 Ca 0.03 -0.47 -0.03 0.00 1.00 0.00 0.00 64.86 65.38 1s79 h ILE 127 Cb 0.45 0.59 -0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1s79 h ILE 127 CO 0.01 0.19 -0.16 0.50 0.00 0.00 0.00 178.15 178.69 1s79 h LYS 128 N 0.64 0.00 -0.18 2.37 3.64 -1.18 -2.08 116.57 119.79 1s79 h LYS 128 Ca 0.16 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.46 1s79 h LYS 128 Cb 0.09 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1s79 h LYS 128 CO -0.02 0.16 -0.21 1.49 -2.27 0.00 0.00 179.45 178.61 1s79 h GLU 129 N 0.00 0.45 -0.18 1.90 4.81 -0.86 0.27 114.58 120.98 1s79 h GLU 129 Ca -0.00 -0.25 -0.20 0.00 -0.13 0.00 0.00 59.36 58.78 1s79 h GLU 129 Cb 0.54 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1s79 h GLU 129 CO 0.02 0.83 -0.68 2.35 -0.73 0.00 0.00 179.01 180.80 1s79 h TRP 130 N 0.10 0.91 -0.10 0.92 7.01 -1.46 -2.96 115.95 120.37 1s79 h TRP 130 Ca 0.02 -0.37 -0.05 0.00 2.11 0.00 0.00 58.89 60.61 1s79 h TRP 130 Cb 0.76 -0.15 -0.00 0.00 -2.10 0.00 0.00 29.16 27.67 1s79 h TRP 130 CO 0.09 1.17 -0.12 -0.07 -2.79 0.00 0.00 178.44 176.72 1s79 h LEU 131 N 0.50 0.28 -2.31 0.65 4.07 -1.40 -2.97 115.31 114.14 1s79 h LEU 131 Ca -0.02 -0.50 0.03 0.00 0.08 0.00 0.00 57.88 57.47 1s79 h LEU 131 Cb 1.28 -0.08 -0.00 0.00 1.08 0.00 0.00 40.66 42.93 1s79 h LEU 131 CO 0.14 0.73 0.12 -0.08 -1.08 0.00 0.00 178.44 178.27 1s79 h GLU 132 N -0.15 0.00 -0.51 1.13 4.81 -0.99 0.14 114.58 119.00 1s79 h GLU 132 Ca 0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1s79 h GLU 132 Cb 0.66 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.04 1s79 h GLU 132 CO 0.03 0.00 0.00 -0.25 -0.73 0.00 0.00 179.01 178.06 1s79 n ASP 133 N -3.85 1.87 0.00 1.04 9.92 -1.12 -4.70 116.55 119.72 1s79 n ASP 133 Ca -0.00 -2.13 0.00 0.00 -0.53 0.00 0.00 54.79 52.12 1s79 n ASP 133 Cb 0.23 -0.33 0.00 0.00 -0.64 0.00 0.00 41.12 40.37 1s79 n ASP 133 CO 0.00 0.00 0.00 2.29 0.13 0.00 0.00 177.20 179.62 1s79 n LYS 134 N 0.22 0.00 0.00 -1.24 2.85 0.47 -5.07 118.16 115.39 1s79 n LYS 134 Ca 0.09 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.35 1s79 n LYS 134 Cb 0.36 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.74 1s79 n LYS 134 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1s79 n GLY 135 N 0.00 -2.66 3.35 2.58 0.00 -1.24 -4.67 105.19 102.54 1s79 n GLY 135 Ca 0.00 -1.26 -0.33 0.00 0.00 0.00 0.00 46.02 44.43 1s79 n GLY 135 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1s79 s GLN 136 N -4.89 3.36 -0.21 1.61 -2.07 -1.26 -4.18 119.66 112.01 1s79 s GLN 136 Ca 0.00 -0.68 -0.04 0.00 -1.82 0.00 0.00 55.36 52.81 1s79 s GLN 136 Cb 0.00 -2.69 -0.02 0.00 -1.09 0.00 0.00 33.01 29.22 1s79 s GLN 136 CO 0.00 0.12 -0.03 0.14 -1.32 0.00 0.00 175.29 174.21 1s79 s VAL 137 N 0.59 3.61 -0.25 3.63 -7.23 -1.26 -3.98 120.40 115.51 1s79 s VAL 137 Ca -0.07 -0.42 0.19 0.00 -1.81 0.00 0.00 61.98 59.86 1s79 s VAL 137 Cb -0.15 -2.63 0.10 0.00 0.56 0.00 0.00 36.38 34.25 1s79 s VAL 137 CO 0.03 0.43 1.33 -0.07 -0.31 0.00 0.00 175.10 176.51 1s79 h LEU 138 N 7.79 0.00 -7.74 1.32 3.38 -1.42 -3.45 115.31 115.19 1s79 h LEU 138 Ca -0.38 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.23 1s79 h LEU 138 Cb 1.17 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 41.60 1s79 h LEU 138 CO 0.60 0.29 -0.76 0.21 0.09 0.00 0.00 178.44 178.87 1s79 s ASN 139 N -6.10 0.66 -0.05 -0.43 2.47 -1.23 -5.01 114.94 105.26 1s79 s ASN 139 Ca 0.03 -0.08 0.01 0.00 0.42 0.00 0.00 52.86 53.24 1s79 s ASN 139 Cb 0.07 -0.27 0.02 0.00 -1.45 0.00 0.00 41.25 39.62 1s79 s ASN 139 CO 0.74 -0.04 -0.06 -0.51 -3.72 0.00 0.00 177.10 173.51 1s79 s ILE 140 N 0.67 0.67 -0.27 -5.21 2.07 -1.26 -0.21 121.20 117.67 1s79 s ILE 140 Ca -0.08 -0.20 -0.07 0.00 -1.41 0.00 0.00 60.65 58.89 1s79 s ILE 140 Cb -0.11 -0.67 -0.01 0.00 0.13 0.00 0.00 42.46 41.80 1s79 s ILE 140 CO -0.00 0.26 0.07 -1.10 -1.91 0.00 0.00 174.94 172.25 1s79 s GLN 141 N 0.87 3.38 -0.25 3.50 -0.21 0.15 -4.88 119.66 122.23 1s79 s GLN 141 Ca -0.12 -0.66 -0.29 0.00 0.02 0.00 0.00 55.36 54.32 1s79 s GLN 141 Cb -0.15 -3.33 0.01 0.00 1.00 0.00 0.00 33.01 30.54 1s79 s GLN 141 CO 0.01 -0.31 1.03 0.00 -2.12 0.00 0.00 175.29 173.91 1s79 s MET 142 N 1.56 4.21 -0.33 2.91 0.23 -1.26 0.14 119.30 126.75 1s79 s MET 142 Ca 0.05 1.26 -0.19 0.00 -1.03 0.00 0.00 55.69 55.77 1s79 s MET 142 Cb -0.16 -3.66 -0.00 0.00 -1.53 0.00 0.00 34.83 29.47 1s79 s MET 142 CO 0.03 -0.69 0.59 1.03 -2.03 0.00 0.00 175.02 173.95 1s79 s ARG 143 N 3.28 3.76 0.42 3.16 1.81 0.51 -4.95 118.95 126.95 1s79 s ARG 143 Ca 0.44 0.08 0.08 0.00 -1.72 0.00 0.00 55.73 54.60 1s79 s ARG 143 Cb -0.14 -3.77 -0.02 0.00 -0.45 0.00 0.00 34.95 30.56 1s79 s ARG 143 CO 0.08 -0.63 0.34 1.03 -0.68 0.00 0.00 175.30 175.44 1s79 s ARG 144 N 2.56 2.46 0.15 3.54 1.81 -1.26 -3.13 118.95 125.08 1s79 s ARG 144 Ca 0.23 -1.62 0.02 0.00 -1.72 0.00 0.00 55.73 52.64 1s79 s ARG 144 Cb -0.15 -2.29 -0.04 0.00 -0.45 0.00 0.00 34.95 32.02 1s79 s ARG 144 CO 0.13 -0.20 -0.04 0.99 -0.68 0.00 0.00 175.30 175.50 1s79 s THR 145 N -2.51 0.81 0.54 0.02 2.01 -1.26 -4.89 115.64 110.36 1s79 s THR 145 Ca 0.46 -1.99 -0.18 0.00 0.31 0.00 0.00 61.69 60.30 1s79 s THR 145 Cb -0.02 -1.95 -0.12 0.00 0.01 0.00 0.00 72.50 70.42 1s79 s THR 145 CO 0.27 -0.64 0.12 0.18 -0.69 0.00 0.00 174.62 173.86 1s79 n LEU 146 N -0.19 -1.94 -0.18 4.42 4.32 -1.26 -4.58 117.00 117.60 1s79 n LEU 146 Ca -0.09 0.68 0.23 0.00 -0.02 0.00 0.00 56.01 56.81 1s79 n LEU 146 Cb 0.62 -0.98 0.63 0.00 -1.62 0.00 0.00 43.42 42.07 1s79 n LEU 146 CO 0.32 -4.12 1.23 0.45 -1.22 0.00 0.00 177.39 174.06 1s79 h HIS 147 N 0.06 0.23 -0.51 -1.77 3.86 -2.03 2.10 115.15 117.10 1s79 h HIS 147 Ca -0.43 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 58.79 1s79 h HIS 147 Cb 1.43 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 29.83 1s79 h HIS 147 CO 0.26 0.06 0.00 0.36 0.86 0.00 0.00 177.93 179.47 1s79 n LYS 148 N -4.39 3.70 -4.36 2.45 2.85 -1.26 -4.89 118.16 112.26 1s79 n LYS 148 Ca 0.17 -2.47 -0.24 0.00 -1.05 0.00 0.00 58.31 54.72 1s79 n LYS 148 Cb 0.79 -1.95 -0.08 0.00 -0.65 0.00 0.00 35.03 33.14 1s79 n LYS 148 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1s79 s ALA 149 N -2.09 3.08 -0.22 0.58 0.00 0.71 -5.12 121.76 118.70 1s79 s ALA 149 Ca 0.44 -1.85 -0.06 0.00 0.00 0.00 0.00 51.96 50.49 1s79 s ALA 149 Cb 0.30 -0.46 -0.02 0.00 0.00 0.00 0.00 23.12 22.94 1s79 s ALA 149 CO 0.17 0.18 0.02 -0.06 0.00 0.00 0.00 175.76 176.07 1s79 s PHE 150 N -2.46 3.05 0.00 0.00 0.08 -1.26 -4.61 117.98 112.78 1s79 s PHE 150 Ca 0.33 -0.50 0.00 0.00 0.12 0.00 0.00 56.93 56.88 1s79 s PHE 150 Cb -0.03 -2.14 0.00 0.00 -0.57 0.00 0.00 43.02 40.28 1s79 s PHE 150 CO 0.18 -0.31 0.00 0.36 -0.10 0.00 0.00 175.22 175.35 1s79 n LYS 151 N 4.54 2.76 0.00 0.44 2.85 -1.26 -4.72 118.16 122.77 1s79 n LYS 151 Ca -0.17 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.09 1s79 n LYS 151 Cb 0.52 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.90 1s79 n LYS 151 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1s79 n GLY 152 N 5.00 1.43 3.59 2.58 0.00 -1.24 -4.94 105.19 111.61 1s79 n GLY 152 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1s79 n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1s79 s SER 153 N -2.00 4.58 -0.11 1.61 0.01 -1.18 -3.36 113.70 113.24 1s79 s SER 153 Ca 0.00 -0.18 -0.07 0.00 1.31 0.00 0.00 55.95 57.01 1s79 s SER 153 Cb 0.00 -1.04 0.04 0.00 0.21 0.00 0.00 66.02 65.23 1s79 s SER 153 CO 0.00 0.27 0.27 0.27 0.41 0.00 0.00 173.24 174.46 1s79 s ILE 154 N -1.02 -0.02 -0.12 1.44 -4.36 -1.18 0.19 121.20 116.13 1s79 s ILE 154 Ca 0.18 0.09 -0.19 0.00 -0.26 0.00 0.00 60.65 60.47 1s79 s ILE 154 Cb -0.11 -0.40 -0.04 0.00 1.25 0.00 0.00 42.46 43.16 1s79 s ILE 154 CO 0.08 0.04 0.52 -0.36 0.24 0.00 0.00 174.94 175.45 1s79 s PHE 155 N 0.87 3.50 -0.04 1.37 0.40 0.38 -2.56 117.98 121.90 1s79 s PHE 155 Ca -0.06 0.93 0.01 0.00 -0.60 0.00 0.00 56.93 57.20 1s79 s PHE 155 Cb -0.07 -2.60 -0.03 0.00 0.51 0.00 0.00 43.02 40.82 1s79 s PHE 155 CO -0.06 0.12 -0.02 0.08 0.70 0.00 0.00 175.22 176.04 1s79 s VAL 156 N 0.79 4.03 -0.20 -0.44 1.01 0.30 0.35 120.40 126.23 1s79 s VAL 156 Ca 0.27 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 61.76 1s79 s VAL 156 Cb -0.15 -2.73 0.04 0.00 0.00 0.00 0.00 36.38 33.53 1s79 s VAL 156 CO 0.11 0.49 -0.14 -0.69 0.00 0.00 0.00 175.10 174.87 1s79 s VAL 157 N -0.96 1.90 0.49 2.92 1.01 0.71 0.15 120.40 126.63 1s79 s VAL 157 Ca 0.16 -1.08 -0.10 0.00 0.00 0.00 0.00 61.98 60.95 1s79 s VAL 157 Cb -0.11 -1.87 -0.05 0.00 0.00 0.00 0.00 36.38 34.35 1s79 s VAL 157 CO 0.06 0.29 0.87 -0.36 0.00 0.00 0.00 175.10 175.96 1s79 s PHE 158 N 1.30 3.53 0.27 5.22 0.08 -0.41 -1.09 117.98 126.88 1s79 s PHE 158 Ca -0.00 1.12 0.04 0.00 0.12 0.00 0.00 56.93 58.21 1s79 s PHE 158 Cb -0.16 -2.53 0.36 0.00 -0.57 0.00 0.00 43.02 40.13 1s79 s PHE 158 CO -0.09 -0.33 1.65 0.38 -0.10 0.00 0.00 175.22 176.73 1s79 h ASP 159 N 0.59 0.34 -3.48 1.36 2.03 -1.89 -3.43 116.42 111.94 1s79 h ASP 159 Ca -0.46 -0.15 -0.66 0.00 -0.73 0.00 0.00 57.03 55.02 1s79 h ASP 159 Cb 1.19 -0.09 -0.21 0.00 -0.83 0.00 0.00 39.33 39.39 1s79 h ASP 159 CO 0.62 0.74 -0.69 -0.94 -1.03 0.00 0.00 179.24 177.94 1s79 s SER 160 N -6.87 4.61 0.13 4.15 1.04 -1.26 -5.01 113.70 110.48 1s79 s SER 160 Ca -0.05 -0.11 -0.14 0.00 0.48 0.00 0.00 55.95 56.14 1s79 s SER 160 Cb 0.13 -1.46 -0.02 0.00 0.10 0.00 0.00 66.02 64.77 1s79 s SER 160 CO 0.79 0.26 1.55 0.40 0.98 0.00 0.00 173.24 177.22 1s79 h ILE 161 N 4.75 1.27 -0.78 -1.02 2.04 -1.83 -2.81 117.51 119.13 1s79 h ILE 161 Ca -0.39 -1.16 -0.01 0.00 1.00 0.00 0.00 64.86 64.30 1s79 h ILE 161 Cb 1.19 1.17 -0.04 0.00 -0.74 0.00 0.00 36.82 38.40 1s79 h ILE 161 CO 0.57 0.39 0.44 1.05 0.00 0.00 0.00 178.15 180.60 1s79 h GLU 162 N 0.61 1.07 0.00 2.37 -0.00 -1.95 -1.61 114.58 115.07 1s79 h GLU 162 Ca 0.11 -0.11 -0.05 0.00 -0.00 0.00 0.00 59.36 59.31 1s79 h GLU 162 Cb 0.59 -0.22 -0.01 0.00 -0.00 0.00 0.00 28.75 29.12 1s79 h GLU 162 CO 0.04 0.77 -0.23 0.66 -0.00 0.00 0.00 179.01 180.25 1s79 h SER 163 N 1.08 0.00 -0.24 3.06 4.64 -1.90 -2.51 113.55 117.68 1s79 h SER 163 Ca 0.28 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.41 1s79 h SER 163 Cb 0.01 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1s79 h SER 163 CO -0.05 0.23 -0.55 0.00 -0.87 0.00 0.00 176.83 175.60 1s79 h ALA 164 N 1.77 0.50 -0.10 5.18 0.00 -1.05 -3.00 119.26 122.55 1s79 h ALA 164 Ca -0.00 -0.51 -0.13 0.00 0.00 0.00 0.00 54.91 54.26 1s79 h ALA 164 Cb 0.48 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1s79 h ALA 164 CO 0.03 0.68 -0.52 0.87 0.00 0.00 0.00 179.25 180.31 1s79 h LYS 165 N 0.64 0.29 0.00 0.00 1.57 -1.26 -2.91 116.57 114.91 1s79 h LYS 165 Ca 0.01 -0.17 -0.06 0.00 -1.87 0.00 0.00 60.65 58.56 1s79 h LYS 165 Cb 1.15 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.47 1s79 h LYS 165 CO 0.12 0.74 -0.29 0.87 -0.57 0.00 0.00 179.45 180.32 1s79 h LYS 166 N 0.23 0.00 -0.09 3.15 1.79 -1.40 -2.04 116.57 118.21 1s79 h LYS 166 Ca 0.01 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.42 1s79 h LYS 166 Cb 0.99 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.64 1s79 h LYS 166 CO 0.08 0.29 -0.16 0.35 -1.08 0.00 0.00 179.45 178.93 1s79 h PHE 167 N 0.00 0.33 0.00 -1.35 3.04 -1.37 -3.12 116.94 114.47 1s79 h PHE 167 Ca -0.00 -0.12 -0.06 0.00 3.98 0.00 0.00 57.97 61.77 1s79 h PHE 167 Cb 0.52 -0.06 -0.01 0.00 2.56 0.00 0.00 35.95 38.96 1s79 h PHE 167 CO 0.00 0.76 -0.27 0.28 -2.02 0.00 0.00 178.31 177.06 1s79 h VAL 168 N -0.19 1.17 0.00 1.41 2.07 -1.46 -1.38 116.25 117.87 1s79 h VAL 168 Ca 0.00 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.58 1s79 h VAL 168 Cb 0.74 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 1s79 h VAL 168 CO 0.04 0.27 0.00 -0.62 0.02 0.00 0.00 177.57 177.27 1s79 n GLU 169 N -4.17 0.77 -2.84 1.57 -0.58 -0.78 -4.78 120.64 109.83 1s79 n GLU 169 Ca -0.02 0.00 -0.37 0.00 -0.42 0.00 0.00 57.16 56.35 1s79 n GLU 169 Cb 0.33 -1.46 -0.06 0.00 -0.57 0.00 0.00 31.44 29.67 1s79 n GLU 169 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1s79 s THR 170 N -2.00 4.28 0.96 2.62 2.01 -0.52 -5.00 115.64 117.98 1s79 s THR 170 Ca 0.34 1.72 -0.15 0.00 0.31 0.00 0.00 61.69 63.92 1s79 s THR 170 Cb 0.16 -3.97 -0.04 0.00 0.01 0.00 0.00 72.50 68.65 1s79 s THR 170 CO 0.26 0.14 -0.09 -0.81 -0.69 0.00 0.00 174.62 173.44 1s79 n PRO 171 N 0.56 -0.15 -1.51 4.92 -0.04 -1.26 -4.68 135.00 132.84 1s79 n PRO 171 Ca 0.01 -0.02 -0.57 0.00 -0.04 0.00 0.00 63.50 62.88 1s79 n PRO 171 Cb 0.50 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.39 1s79 n PRO 171 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1s79 n GLY 172 N 2.33 -0.24 3.07 0.55 0.00 -1.26 -4.92 105.19 104.71 1s79 n GLY 172 Ca 0.03 0.73 -0.32 0.00 0.00 0.00 0.00 46.02 46.46 1s79 n GLY 172 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1s79 s GLN 173 N 0.01 2.35 -0.03 1.61 2.00 -1.26 -5.11 119.66 119.24 1s79 s GLN 173 Ca 0.88 -1.16 0.07 0.00 -2.00 0.00 0.00 55.36 53.16 1s79 s GLN 173 Cb -1.20 -2.75 -0.02 0.00 0.80 0.00 0.00 33.01 29.84 1s79 s GLN 173 CO 0.55 -0.47 -0.26 -1.59 -0.50 0.00 0.00 175.29 173.02 1s79 s LYS 174 N 1.19 2.22 -0.16 1.67 0.00 -1.25 -4.18 119.74 119.23 1s79 s LYS 174 Ca -0.05 -0.92 -0.13 0.00 0.00 0.00 0.00 55.97 54.87 1s79 s LYS 174 Cb -0.18 -2.07 -0.05 0.00 0.00 0.00 0.00 37.83 35.54 1s79 s LYS 174 CO -0.07 0.51 0.27 -0.47 0.00 0.00 0.00 175.35 175.59 1s79 s TYR 175 N -0.49 3.47 0.00 1.78 5.04 -1.16 -4.81 117.35 121.18 1s79 s TYR 175 Ca 0.06 0.57 0.00 0.00 -2.44 0.00 0.00 57.07 55.26 1s79 s TYR 175 Cb -0.11 -2.31 0.00 0.00 0.35 0.00 0.00 41.96 39.90 1s79 s TYR 175 CO 0.00 0.27 0.00 1.17 -1.34 0.00 0.00 175.55 175.65 1s79 n LYS 176 N 3.47 0.66 0.00 4.97 3.00 -1.26 -3.16 118.16 125.85 1s79 n LYS 176 Ca -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.18 1s79 n LYS 176 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.55 1s79 n LYS 176 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1s79 n GLU 177 N -0.61 0.00 -2.75 1.64 1.02 -1.26 -4.02 120.64 114.66 1s79 n GLU 177 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.72 1s79 n GLU 177 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.39 1s79 n GLU 177 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1s79 s THR 178 N 0.00 4.77 -0.31 2.62 2.01 -1.26 -4.95 115.64 118.53 1s79 s THR 178 Ca 0.00 1.89 -0.27 0.00 0.31 0.00 0.00 61.69 63.61 1s79 s THR 178 Cb 0.00 -4.25 -0.05 0.00 0.01 0.00 0.00 72.50 68.21 1s79 s THR 178 CO 0.00 -0.07 2.27 -0.62 -0.69 0.00 0.00 174.62 175.51 1s79 s ASP 179 N 1.18 5.12 -0.24 3.53 2.15 -1.24 -4.32 116.67 122.86 1s79 s ASP 179 Ca 0.43 1.60 -0.13 0.00 0.43 0.00 0.00 52.55 54.88 1s79 s ASP 179 Cb -0.16 -2.51 -0.04 0.00 -0.30 0.00 0.00 42.92 39.90 1s79 s ASP 179 CO 0.11 -2.26 0.26 -0.22 -0.17 0.00 0.00 175.17 172.89 1s79 s LEU 180 N 9.57 4.10 -0.09 -1.34 1.98 -1.19 -4.15 118.68 127.57 1s79 s LEU 180 Ca 0.99 0.23 0.04 0.00 -2.89 0.00 0.00 54.13 52.50 1s79 s LEU 180 Cb -0.27 -2.27 0.00 0.00 0.66 0.00 0.00 46.19 44.31 1s79 s LEU 180 CO 0.32 -0.03 -0.21 -0.22 -1.89 0.00 0.00 176.35 174.32 1s79 s LEU 181 N 1.38 1.99 -0.25 -0.68 2.96 -0.21 -2.98 118.68 120.89 1s79 s LEU 181 Ca 0.12 -0.49 -0.10 0.00 -0.22 0.00 0.00 54.13 53.43 1s79 s LEU 181 Cb -0.15 -1.27 -0.05 0.00 0.50 0.00 0.00 46.19 45.23 1s79 s LEU 181 CO 0.07 0.14 0.15 -0.63 -1.32 0.00 0.00 176.35 174.77 1s79 s ILE 182 N 0.34 5.16 0.05 6.68 1.01 -1.26 -0.06 121.20 133.11 1s79 s ILE 182 Ca -0.16 0.12 0.09 0.00 0.00 0.00 0.00 60.65 60.69 1s79 s ILE 182 Cb -0.17 -3.42 -0.03 0.00 0.01 0.00 0.00 42.46 38.85 1s79 s ILE 182 CO 0.07 0.32 -0.24 -0.22 0.00 0.00 0.00 174.94 174.87 1s79 s LEU 183 N 1.33 2.17 0.57 2.97 2.96 0.15 -4.96 118.68 123.87 1s79 s LEU 183 Ca 0.07 -0.57 -0.04 0.00 -0.22 0.00 0.00 54.13 53.37 1s79 s LEU 183 Cb -0.15 -1.15 0.01 0.00 0.50 0.00 0.00 46.19 45.41 1s79 s LEU 183 CO 0.06 0.21 0.85 0.12 -1.32 0.00 0.00 176.35 176.27 1s79 s PHE 184 N -0.82 3.18 0.14 5.38 5.36 -1.26 -1.45 117.98 128.52 1s79 s PHE 184 Ca 0.10 0.47 -0.17 0.00 -0.96 0.00 0.00 56.93 56.37 1s79 s PHE 184 Cb -0.09 -2.68 -0.01 0.00 -0.34 0.00 0.00 43.02 39.89 1s79 s PHE 184 CO 0.02 -0.77 1.80 0.87 -1.46 0.00 0.00 175.22 175.68 1s79 h LYS 185 N -0.06 0.47 -0.54 10.12 6.56 -1.93 -0.44 116.57 130.75 1s79 h LYS 185 Ca -0.45 -0.03 0.04 0.00 -1.06 0.00 0.00 60.65 59.14 1s79 h LYS 185 Cb 1.26 -0.10 -0.03 0.00 -0.57 0.00 0.00 32.23 32.79 1s79 h LYS 185 CO 0.59 0.31 0.36 -0.44 -2.06 0.00 0.00 179.45 178.22 1s79 h ASP 186 N 0.48 0.52 -0.03 0.86 5.19 -1.95 0.56 116.42 122.05 1s79 h ASP 186 Ca 0.13 -0.01 -0.06 0.00 -0.62 0.00 0.00 57.03 56.47 1s79 h ASP 186 Cb -0.05 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 39.35 1s79 h ASP 186 CO -0.03 0.36 -0.22 0.44 -3.12 0.00 0.00 179.24 176.67 1s79 h ASP 187 N 0.61 0.24 -0.08 6.45 3.32 -1.75 0.24 116.42 125.44 1s79 h ASP 187 Ca 0.22 -0.70 0.01 0.00 0.02 0.00 0.00 57.03 56.57 1s79 h ASP 187 Cb 0.12 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1s79 h ASP 187 CO -0.06 0.90 0.04 0.22 -1.72 0.00 0.00 179.24 178.62 1s79 h TYR 188 N -0.41 0.07 -0.16 4.55 5.03 -0.74 0.80 116.97 126.10 1s79 h TYR 188 Ca -0.02 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.27 1s79 h TYR 188 Cb 0.91 -0.02 -0.01 0.00 1.55 0.00 0.00 36.73 39.17 1s79 h TYR 188 CO 0.16 0.04 -0.01 0.74 -1.32 0.00 0.00 178.16 177.77 1s79 h PHE 189 N 0.08 0.23 -0.01 -3.82 -1.00 -0.96 0.92 116.94 112.38 1s79 h PHE 189 Ca 0.03 -0.01 -0.02 0.00 2.81 0.00 0.00 57.97 60.79 1s79 h PHE 189 Cb 0.01 -0.07 0.00 0.00 3.61 0.00 0.00 35.95 39.50 1s79 h PHE 189 CO -0.09 0.26 -0.05 0.00 -1.61 0.00 0.00 178.31 176.81 1s79 h ALA 190 N 1.77 0.02 -0.05 2.45 0.00 0.47 -2.05 119.26 121.87 1s79 h ALA 190 Ca 0.06 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1s79 h ALA 190 Cb 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1s79 h ALA 190 CO 0.00 -0.11 -0.14 0.87 0.00 0.00 0.00 179.25 179.88 1s79 h LYS 191 N -0.58 0.18 -0.69 0.00 1.57 0.85 -3.24 116.57 114.67 1s79 h LYS 191 Ca -0.00 -0.13 0.07 0.00 -1.87 0.00 0.00 60.65 58.72 1s79 h LYS 191 Cb 0.72 0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.99 1s79 h LYS 191 CO 0.01 0.75 0.37 -0.22 -0.57 0.00 0.00 179.45 179.79 1s79 h LYS 192 N -0.35 0.64 -0.72 3.15 1.63 0.75 0.31 116.57 121.97 1s79 h LYS 192 Ca -0.00 -0.04 0.21 0.00 -0.85 0.00 0.00 60.65 59.97 1s79 h LYS 192 Cb 0.76 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 32.22 1s79 h LYS 192 CO 0.03 0.42 0.57 -0.91 -3.45 0.00 0.00 179.45 176.11 1s79 h ASN 193 N 0.66 0.00 0.00 4.20 -0.26 -1.39 -3.43 115.58 115.36 1s79 h ASN 193 Ca 0.32 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.06 1s79 h ASN 193 Cb 0.26 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.52 1s79 h ASN 193 CO -0.22 0.00 0.00 -0.62 -1.06 0.00 0.00 177.43 175.53 1s79 n GLU 194 N -4.13 0.00 -3.64 0.81 1.02 0.09 -4.45 120.64 110.34 1s79 n GLU 194 Ca 0.14 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.16 1s79 n GLU 194 Cb 0.83 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 32.20 1s79 n GLU 194 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1s79 s GLU 195 N 0.00 0.97 0.00 3.49 -6.30 -1.26 -5.04 118.70 110.56 1s79 s GLU 195 Ca 0.00 -0.39 0.00 0.00 -2.50 0.00 0.00 54.97 52.08 1s79 s GLU 195 Cb 0.00 0.43 0.00 0.00 0.00 0.00 0.00 34.13 34.56 1s79 s GLU 195 CO 0.00 -0.34 0.00 0.54 0.02 0.00 0.00 175.26 175.48 1s79 n ARG 196 N 0.38 0.00 -0.02 4.30 1.74 -1.26 -4.97 116.66 116.83 1s79 n ARG 196 Ca -0.18 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 56.91 1s79 n ARG 196 Cb 0.60 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.98 1s79 n ARG 196 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1s79 n LYS 197 N -2.42 1.28 -2.58 5.56 0.00 -1.26 -5.00 118.16 113.74 1s79 n LYS 197 Ca 0.00 -0.05 -0.38 0.00 0.00 0.00 0.00 58.31 57.88 1s79 n LYS 197 Cb 0.00 -1.22 -0.05 0.00 0.00 0.00 0.00 35.03 33.77 1s79 n LYS 197 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.40 176.26 1s79 s GLN 198 N -2.45 4.41 -0.61 1.64 0.74 -1.26 -4.98 119.66 117.15 1s79 s GLN 198 Ca -0.04 1.55 -0.24 0.00 0.05 0.00 0.00 55.36 56.69 1s79 s GLN 198 Cb 0.04 -2.81 0.05 0.00 1.10 0.00 0.00 33.01 31.40 1s79 s GLN 198 CO 0.36 0.07 0.99 -0.80 -0.55 0.00 0.00 175.29 175.37 1s79 s ASN 199 N -1.37 6.25 0.28 6.67 0.01 -1.26 -4.96 114.94 120.57 1s79 s ASN 199 Ca 0.52 -0.61 0.00 0.00 -0.71 0.00 0.00 52.86 52.06 1s79 s ASN 199 Cb -0.24 -2.44 0.00 0.00 0.41 0.00 0.00 41.25 38.97 1s79 s ASN 199 CO 0.31 -1.38 0.00 0.29 -1.51 0.00 0.00 177.10 174.80 1s79 n LYS 200 N 7.78 0.42 -3.34 -0.60 5.02 -1.26 -4.98 118.16 121.21 1s79 n LYS 200 Ca -0.00 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.91 1s79 n LYS 200 Cb 0.47 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.42 1s79 n LYS 200 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1s79 s VAL 201 N -0.28 5.02 -2.30 -0.18 1.01 -1.26 -5.24 120.40 117.17 1s79 s VAL 201 Ca 0.00 1.03 0.30 0.00 0.00 0.00 0.00 61.98 63.30 1s79 s VAL 201 Cb 0.00 -3.83 0.70 0.00 0.00 0.00 0.00 36.38 33.25 1s79 s VAL 201 CO 0.00 0.45 1.94 -0.62 0.00 0.00 0.00 175.10 176.87