#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s4z h MET 103 N 0.00 0.73 -6.88 -0.41 2.86 -2.07 -3.42 114.93 105.74 1s4z h MET 103 Ca 0.00 -0.05 -0.53 0.00 -2.06 0.00 0.00 59.70 57.06 1s4z h MET 103 Cb 0.00 -0.16 0.09 0.00 0.06 0.00 0.00 31.60 31.59 1s4z h MET 103 CO 0.00 0.50 0.78 -1.59 1.06 0.00 0.00 176.91 177.66 1s4z s LYS 104 N -6.10 4.17 -0.28 1.72 -2.85 -1.26 -4.91 119.74 110.23 1s4z s LYS 104 Ca -0.13 2.49 0.06 0.00 -1.00 0.00 0.00 55.97 57.39 1s4z s LYS 104 Cb 0.12 -3.01 0.21 0.00 -2.06 0.00 0.00 37.83 33.09 1s4z s LYS 104 CO 0.75 -0.50 1.14 -1.91 0.10 0.00 0.00 175.35 174.93 1s4z n GLU 105 N 1.17 0.67 -2.18 1.78 4.07 -1.26 -5.14 120.64 119.75 1s4z n GLU 105 Ca 0.03 -0.97 -0.41 0.00 -0.06 0.00 0.00 57.16 55.75 1s4z n GLU 105 Cb 0.39 0.08 -0.03 0.00 -0.06 0.00 0.00 31.44 31.82 1s4z n GLU 105 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 1s4z s GLU 106 N 0.09 4.38 0.56 5.31 2.02 -1.26 -4.97 118.70 124.84 1s4z s GLU 106 Ca 0.09 2.11 -0.21 0.00 0.02 0.00 0.00 54.97 56.99 1s4z s GLU 106 Cb 0.22 -3.15 -0.05 0.00 0.10 0.00 0.00 34.13 31.26 1s4z s GLU 106 CO -0.06 -0.21 1.24 0.45 0.02 0.00 0.00 175.26 176.70 1s4z n SER 107 N 1.91 2.08 -2.77 -0.19 2.88 -1.26 -3.40 113.62 112.87 1s4z n SER 107 Ca 0.04 0.93 -0.12 0.00 -1.33 0.00 0.00 58.87 58.38 1s4z n SER 107 Cb 0.42 -1.51 0.06 0.00 -0.75 0.00 0.00 64.21 62.43 1s4z n SER 107 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1s4z n GLU 108 N -1.02 -4.45 -1.88 -1.46 1.02 -1.26 -4.95 120.64 106.65 1s4z n GLU 108 Ca 0.12 0.62 -0.41 0.00 -0.02 0.00 0.00 57.16 57.46 1s4z n GLU 108 Cb 0.45 -4.92 -0.02 0.00 -0.02 0.00 0.00 31.44 26.93 1s4z n GLU 108 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1s4z s LYS 109 N -4.87 4.18 0.00 3.49 1.02 -1.22 -5.02 119.74 117.32 1s4z s LYS 109 Ca 0.04 2.46 0.00 0.00 0.02 0.00 0.00 55.97 58.49 1s4z s LYS 109 Cb -0.01 -3.06 0.00 0.00 -0.52 0.00 0.00 37.83 34.25 1s4z s LYS 109 CO 0.53 -0.54 0.00 -2.30 -0.92 0.00 0.00 175.35 172.12 1s4z n PRO 110 N 2.20 2.33 -3.64 -1.68 -0.02 -1.26 -5.10 135.00 127.83 1s4z n PRO 110 Ca 0.07 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.47 1s4z n PRO 110 Cb 0.39 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 33.80 1s4z n PRO 110 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1s4z s ARG 111 N 0.00 0.44 5.99 -0.52 3.03 -1.26 -5.06 118.95 121.57 1s4z s ARG 111 Ca 0.00 0.53 0.00 0.00 2.03 0.00 0.00 55.73 58.29 1s4z s ARG 111 Cb 0.00 0.21 0.00 0.00 -1.03 0.00 0.00 34.95 34.13 1s4z s ARG 111 CO 0.00 -0.05 0.00 0.41 -1.13 0.00 0.00 175.30 174.53 1s4z n GLY 112 N 2.20 0.94 2.80 3.88 0.00 -1.26 -4.24 105.19 109.51 1s4z n GLY 112 Ca -0.12 -0.63 -0.36 0.00 0.00 0.00 0.00 46.02 44.90 1s4z n GLY 112 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1s4z n PHE 113 N 12.41 2.09 0.00 1.61 3.01 -1.26 -4.75 117.46 130.56 1s4z n PHE 113 Ca 0.00 -2.21 0.00 0.00 1.01 0.00 0.00 57.45 56.25 1s4z n PHE 113 Cb 0.00 -1.94 0.00 0.00 -0.01 0.00 0.00 39.48 37.53 1s4z n PHE 113 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1s4z n ALA 114 N 5.84 0.00 -0.35 4.37 0.00 -1.26 -4.62 120.51 124.49 1s4z n ALA 114 Ca 0.52 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.94 1s4z n ALA 114 Cb 0.30 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.87 1s4z n ALA 114 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1s4z h ARG 115 N 0.00 1.17 0.00 0.00 0.11 -1.97 -3.44 114.38 110.25 1s4z h ARG 115 Ca 0.00 -0.07 0.00 0.00 0.10 0.00 0.00 59.98 60.01 1s4z h ARG 115 Cb 0.00 -0.26 0.00 0.00 1.11 0.00 0.00 29.97 30.82 1s4z h ARG 115 CO 0.00 0.77 0.00 0.41 0.10 0.00 0.00 179.97 181.25 1s4z n GLY 116 N -1.35 0.00 3.75 0.08 0.00 -1.26 -5.14 105.19 101.26 1s4z n GLY 116 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1s4z n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s4z s LEU 117 N 0.00 4.38 0.03 0.99 1.43 -1.26 -4.98 118.68 119.27 1s4z s LEU 117 Ca 0.00 2.72 -0.30 0.00 -1.03 0.00 0.00 54.13 55.52 1s4z s LEU 117 Cb 0.00 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 1s4z s LEU 117 CO 0.00 -0.73 0.96 -1.61 0.23 0.00 0.00 176.35 175.20 1s4z s GLU 118 N -0.50 4.59 -0.04 1.70 0.41 -1.26 -4.93 118.70 118.66 1s4z s GLU 118 Ca 0.59 1.40 -0.30 0.00 -0.41 0.00 0.00 54.97 56.25 1s4z s GLU 118 Cb -0.43 -3.44 -0.05 0.00 -1.78 0.00 0.00 34.13 28.44 1s4z s GLU 118 CO 0.45 0.03 1.56 -2.14 -0.49 0.00 0.00 175.26 174.67 1s4z s PRO 119 N 0.71 4.21 -0.08 0.39 0.02 -1.26 -4.21 135.00 134.77 1s4z s PRO 119 Ca 0.50 2.10 -0.23 0.00 0.02 0.00 0.00 61.00 63.39 1s4z s PRO 119 Cb -0.21 -3.84 -0.19 0.00 0.02 0.00 0.00 34.50 30.27 1s4z s PRO 119 CO 0.28 -0.77 0.84 1.49 -0.33 0.00 0.00 177.00 178.51 1s4z h GLU 120 N 8.93 -0.07 -1.19 5.54 4.81 -1.83 -3.48 114.58 127.28 1s4z h GLU 120 Ca -0.38 0.00 0.18 0.00 -0.13 0.00 0.00 59.36 59.04 1s4z h GLU 120 Cb 1.17 0.02 -0.32 0.00 0.63 0.00 0.00 28.75 30.25 1s4z h GLU 120 CO 0.94 0.54 0.66 -0.98 -0.73 0.00 0.00 179.01 179.45 1s4z s ARG 121 N -2.98 0.14 0.21 1.92 1.70 -1.26 -5.07 118.95 113.60 1s4z s ARG 121 Ca -0.15 0.23 -0.30 0.00 -0.47 0.00 0.00 55.73 55.05 1s4z s ARG 121 Cb -0.01 0.03 -0.08 0.00 -0.57 0.00 0.00 34.95 34.32 1s4z s ARG 121 CO 0.55 -0.03 1.19 0.42 -1.08 0.00 0.00 175.30 176.35 1s4z s ILE 122 N 1.04 3.49 0.00 4.99 1.01 -1.26 -3.82 121.20 126.65 1s4z s ILE 122 Ca -0.07 1.31 0.14 0.00 0.00 0.00 0.00 60.65 62.02 1s4z s ILE 122 Cb -0.03 -3.83 0.23 0.00 0.01 0.00 0.00 42.46 38.84 1s4z s ILE 122 CO -0.11 0.23 1.09 2.30 0.00 0.00 0.00 174.94 178.45 1s4z n ILE 123 N 2.15 0.00 -3.74 2.92 -6.64 -1.24 -5.01 119.36 107.79 1s4z n ILE 123 Ca 0.03 -0.55 -0.14 0.00 -1.77 0.00 0.00 62.75 60.33 1s4z n ILE 123 Cb 0.44 0.77 -0.09 0.00 -1.44 0.00 0.00 39.64 39.32 1s4z n ILE 123 CO 0.00 0.00 0.00 -0.83 -1.77 0.00 0.00 176.55 173.95 1s4z s GLY 124 N -1.53 -0.22 0.00 3.28 0.00 -1.25 -4.86 107.32 102.73 1s4z s GLY 124 Ca 0.19 0.62 0.00 0.00 0.00 0.00 0.00 44.72 45.53 1s4z s GLY 124 CO -0.09 0.42 0.00 0.00 0.00 0.00 0.00 173.10 173.43 1s4z n ALA 125 N 1.72 0.00 -3.62 3.20 0.00 -1.02 -2.20 120.51 118.59 1s4z n ALA 125 Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.15 1s4z n ALA 125 Cb 0.56 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.92 1s4z n ALA 125 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1s4z s THR 126 N 0.00 -0.01 -0.90 0.00 -1.32 -1.10 -4.82 115.64 107.49 1s4z s THR 126 Ca 0.00 0.05 -0.25 0.00 -1.21 0.00 0.00 61.69 60.29 1s4z s THR 126 Cb 0.00 -0.72 0.03 0.00 -1.51 0.00 0.00 72.50 70.30 1s4z s THR 126 CO 0.00 0.02 1.46 -0.62 -2.21 0.00 0.00 174.62 173.27 1s4z s ASP 127 N 1.21 6.20 0.00 8.08 2.15 -1.26 -1.49 116.67 131.57 1s4z s ASP 127 Ca -0.08 -0.96 0.00 0.00 0.43 0.00 0.00 52.55 51.94 1s4z s ASP 127 Cb -0.07 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 39.99 1s4z s ASP 127 CO -0.12 -1.77 0.00 -1.54 -0.17 0.00 0.00 175.17 171.57 1s4z n SER 128 N 9.71 0.00 -0.34 -0.34 3.41 -0.64 -4.70 113.62 120.72 1s4z n SER 128 Ca 0.23 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.95 1s4z n SER 128 Cb 0.50 0.00 0.31 0.00 -0.26 0.00 0.00 64.21 64.76 1s4z n SER 128 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1s4z h SER 129 N 0.00 0.81 0.00 4.04 0.87 -2.00 -3.39 113.55 113.88 1s4z h SER 129 Ca 0.00 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 1s4z h SER 129 Cb 0.00 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 61.88 1s4z h SER 129 CO 0.00 0.36 0.00 0.61 -0.53 0.00 0.00 176.83 177.27 1s4z n GLY 130 N -1.36 0.00 3.63 5.77 0.00 -1.26 -5.15 105.19 106.81 1s4z n GLY 130 Ca 0.21 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.11 1s4z n GLY 130 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1s4z s GLU 131 N 0.00 0.68 0.77 1.61 -1.05 -1.26 -5.13 118.70 114.32 1s4z s GLU 131 Ca 0.00 0.74 -0.13 0.00 -0.15 0.00 0.00 54.97 55.43 1s4z s GLU 131 Cb 0.00 0.33 0.06 0.00 -0.44 0.00 0.00 34.13 34.08 1s4z s GLU 131 CO 0.00 -0.10 1.16 -0.51 0.95 0.00 0.00 175.26 176.76 1s4z s LEU 132 N 0.18 3.17 -0.31 1.83 1.43 -1.26 -1.62 118.68 122.09 1s4z s LEU 132 Ca 0.01 2.18 -0.02 0.00 -1.03 0.00 0.00 54.13 55.27 1s4z s LEU 132 Cb -0.05 -4.57 0.11 0.00 0.03 0.00 0.00 46.19 41.71 1s4z s LEU 132 CO -0.02 -2.35 0.13 -0.04 0.23 0.00 0.00 176.35 174.31 1s4z s MET 133 N -4.28 0.47 -0.19 1.70 -1.94 -0.55 -0.63 119.30 113.89 1s4z s MET 133 Ca 0.69 -0.90 -0.29 0.00 -1.71 0.00 0.00 55.69 53.48 1s4z s MET 133 Cb -0.24 -1.53 -0.00 0.00 2.01 0.00 0.00 34.83 35.07 1s4z s MET 133 CO 0.50 -1.04 1.13 -0.06 -0.01 0.00 0.00 175.02 175.53 1s4z s PHE 134 N 1.71 3.17 -1.05 -0.03 0.40 0.30 -2.42 117.98 120.06 1s4z s PHE 134 Ca 0.11 1.30 -0.18 0.00 -0.60 0.00 0.00 56.93 57.55 1s4z s PHE 134 Cb -0.18 -3.36 0.12 0.00 0.51 0.00 0.00 43.02 40.12 1s4z s PHE 134 CO -0.26 -0.95 1.31 -1.17 0.70 0.00 0.00 175.22 174.85 1s4z s LEU 135 N 3.16 4.69 0.05 -0.37 2.96 -0.94 -1.07 118.68 127.16 1s4z s LEU 135 Ca 0.49 -2.23 -0.30 0.00 -0.22 0.00 0.00 54.13 51.86 1s4z s LEU 135 Cb -0.18 -2.44 -0.08 0.00 0.50 0.00 0.00 46.19 43.99 1s4z s LEU 135 CO 0.11 -1.06 1.66 -0.04 -1.32 0.00 0.00 176.35 175.70 1s4z s MET 136 N 2.91 4.19 0.18 1.98 -1.94 -1.01 -3.69 119.30 121.92 1s4z s MET 136 Ca 0.39 2.32 -0.16 0.00 -1.71 0.00 0.00 55.69 56.53 1s4z s MET 136 Cb -0.03 -3.69 -0.07 0.00 2.01 0.00 0.00 34.83 33.05 1s4z s MET 136 CO -0.06 -0.76 0.62 0.21 -0.01 0.00 0.00 175.02 175.03 1s4z s LYS 137 N 2.94 4.08 -0.06 2.03 2.20 -1.25 -3.73 119.74 125.95 1s4z s LYS 137 Ca 0.74 0.64 0.04 0.00 -0.36 0.00 0.00 55.97 57.03 1s4z s LYS 137 Cb -0.39 -2.89 0.00 0.00 -1.51 0.00 0.00 37.83 33.05 1s4z s LYS 137 CO 0.32 0.43 -0.17 -1.58 -0.36 0.00 0.00 175.35 174.00 1s4z s TRP 138 N -1.51 1.77 -0.01 4.03 0.52 -1.26 -2.39 118.94 120.09 1s4z s TRP 138 Ca 0.41 -0.60 -0.25 0.00 0.02 0.00 0.00 56.10 55.68 1s4z s TRP 138 Cb -0.15 -1.22 -0.18 0.00 -1.15 0.00 0.00 33.47 30.76 1s4z s TRP 138 CO 0.20 -0.25 1.25 1.57 0.02 0.00 0.00 176.95 179.74 1s4z h LYS 139 N 6.57 -0.16 -0.02 4.98 2.10 -1.95 -3.34 116.57 124.76 1s4z h LYS 139 Ca -0.30 0.01 -0.02 0.00 -2.00 0.00 0.00 60.65 58.34 1s4z h LYS 139 Cb 1.19 0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1s4z h LYS 139 CO 0.48 0.23 -0.09 -0.91 -2.00 0.00 0.00 179.45 177.16 1s4z h ASN 140 N -0.58 0.11 -2.93 7.07 -0.26 -1.96 -3.43 115.58 113.59 1s4z h ASN 140 Ca -0.02 -0.67 -0.55 0.00 -0.56 0.00 0.00 56.30 54.50 1s4z h ASN 140 Cb 0.46 -0.03 -0.02 0.00 -1.06 0.00 0.00 38.32 37.66 1s4z h ASN 140 CO 0.03 0.76 0.84 -0.55 -1.06 0.00 0.00 177.43 177.45 1s4z s SER 141 N -6.02 6.92 -0.31 5.81 0.15 -1.25 -4.65 113.70 114.35 1s4z s SER 141 Ca -0.16 1.91 -0.00 0.00 0.70 0.00 0.00 55.95 58.39 1s4z s SER 141 Cb 0.01 -2.55 0.25 0.00 -1.71 0.00 0.00 66.02 62.02 1s4z s SER 141 CO 0.71 -0.72 1.89 0.47 1.20 0.00 0.00 173.24 176.79 1s4z n ASP 142 N 5.90 5.80 -3.70 5.45 9.92 -1.26 -4.41 116.55 134.25 1s4z n ASP 142 Ca 0.13 -3.03 -0.11 0.00 -0.53 0.00 0.00 54.79 51.25 1s4z n ASP 142 Cb 0.45 -0.97 -0.12 0.00 -0.64 0.00 0.00 41.12 39.84 1s4z n ASP 142 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 1s4z s GLU 143 N -1.85 0.29 0.55 -1.24 2.12 -1.26 -5.15 118.70 112.15 1s4z s GLU 143 Ca 0.32 0.70 -0.18 0.00 0.36 0.00 0.00 54.97 56.16 1s4z s GLU 143 Cb 0.25 -0.04 -0.06 0.00 0.26 0.00 0.00 34.13 34.54 1s4z s GLU 143 CO 0.01 -0.18 1.07 0.00 -0.54 0.00 0.00 175.26 175.62 1s4z s ALA 144 N 1.53 2.76 -0.11 6.30 0.00 -1.26 -4.74 121.76 126.24 1s4z s ALA 144 Ca -0.08 0.57 -0.05 0.00 0.00 0.00 0.00 51.96 52.41 1s4z s ALA 144 Cb -0.10 -3.27 0.06 0.00 0.00 0.00 0.00 23.12 19.81 1s4z s ALA 144 CO -0.11 -0.64 0.24 -0.51 0.00 0.00 0.00 175.76 174.75 1s4z s ASP 145 N -2.25 0.19 0.14 0.00 1.01 -1.24 -4.96 116.67 109.55 1s4z s ASP 145 Ca 0.67 0.53 -0.23 0.00 0.71 0.00 0.00 52.55 54.23 1s4z s ASP 145 Cb -0.18 0.54 -0.08 0.00 1.01 0.00 0.00 42.92 44.21 1s4z s ASP 145 CO 0.29 -0.21 0.72 -0.22 0.21 0.00 0.00 175.17 175.95 1s4z s LEU 146 N 2.00 4.57 -0.02 1.23 2.96 -1.26 -2.40 118.68 125.75 1s4z s LEU 146 Ca -0.02 1.53 0.00 0.00 -0.22 0.00 0.00 54.13 55.42 1s4z s LEU 146 Cb -0.11 -3.20 0.02 0.00 0.50 0.00 0.00 46.19 43.40 1s4z s LEU 146 CO -0.08 0.22 0.00 -0.69 -1.32 0.00 0.00 176.35 174.48 1s4z s VAL 147 N -1.16 0.13 0.44 1.68 1.01 -0.24 -4.96 120.40 117.30 1s4z s VAL 147 Ca 0.34 0.07 -0.25 0.00 0.00 0.00 0.00 61.98 62.14 1s4z s VAL 147 Cb -0.22 -0.21 -0.09 0.00 0.00 0.00 0.00 36.38 35.86 1s4z s VAL 147 CO 0.24 0.11 1.31 -0.81 0.00 0.00 0.00 175.10 175.95 1s4z n PRO 148 N 3.90 1.99 -0.22 2.72 -0.04 -1.26 -0.54 135.00 141.56 1s4z n PRO 148 Ca -0.24 0.71 -0.04 0.00 -0.04 0.00 0.00 63.50 63.89 1s4z n PRO 148 Cb 0.52 -2.45 0.07 0.00 -0.04 0.00 0.00 33.50 31.60 1s4z n PRO 148 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1s4z h ALA 149 N 2.09 0.82 -0.96 0.55 0.00 -1.20 0.13 119.26 120.69 1s4z h ALA 149 Ca -0.49 -0.01 0.15 0.00 0.00 0.00 0.00 54.91 54.56 1s4z h ALA 149 Cb 1.29 -0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.83 1s4z h ALA 149 CO 0.60 0.10 0.61 0.87 0.00 0.00 0.00 179.25 181.43 1s4z h LYS 150 N 0.72 0.79 0.10 0.00 1.79 -1.91 -0.13 116.57 117.93 1s4z h LYS 150 Ca 0.26 -0.05 -0.25 0.00 -2.18 0.00 0.00 60.65 58.43 1s4z h LYS 150 Cb 0.06 -0.18 0.02 0.00 -1.58 0.00 0.00 32.23 30.56 1s4z h LYS 150 CO -0.12 0.52 -1.03 1.49 -1.08 0.00 0.00 179.45 179.22 1s4z h GLU 151 N 0.81 0.53 -0.40 3.15 4.81 -1.69 -3.29 114.58 118.50 1s4z h GLU 151 Ca 0.50 -0.70 0.05 0.00 -0.13 0.00 0.00 59.36 59.08 1s4z h GLU 151 Cb 0.70 0.23 -0.02 0.00 0.63 0.00 0.00 28.75 30.29 1s4z h GLU 151 CO -0.27 1.30 0.27 0.00 -0.73 0.00 0.00 179.01 179.58 1s4z h ALA 152 N 0.25 1.93 -0.86 2.92 0.00 0.32 -2.62 119.26 121.20 1s4z h ALA 152 Ca -0.16 -0.02 0.21 0.00 0.00 0.00 0.00 54.91 54.94 1s4z h ALA 152 Cb 1.74 -0.09 -0.12 0.00 0.00 0.00 0.00 17.79 19.32 1s4z h ALA 152 CO 0.20 0.00 0.33 -0.91 0.00 0.00 0.00 179.25 178.87 1s4z h ASN 153 N 0.36 0.23 0.71 0.00 2.35 -1.13 -0.15 115.58 117.95 1s4z h ASN 153 Ca 0.17 0.16 -0.26 0.00 -0.55 0.00 0.00 56.30 55.82 1s4z h ASN 153 Cb 0.24 0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.74 1s4z h ASN 153 CO -0.04 -0.02 -1.32 -0.37 -1.65 0.00 0.00 177.43 174.03 1s4z h VAL 154 N 0.36 1.35 -0.14 2.81 -1.51 -1.67 -3.10 116.25 114.35 1s4z h VAL 154 Ca 0.53 -3.07 0.04 0.00 -1.23 0.00 0.00 66.70 62.97 1s4z h VAL 154 Cb 0.98 2.73 -0.05 0.00 -2.13 0.00 0.00 31.29 32.82 1s4z h VAL 154 CO -0.54 0.81 -0.17 0.11 -1.23 0.00 0.00 177.57 176.56 1s4z h LYS 155 N 0.02 -0.20 -0.35 5.19 1.79 -0.87 -3.42 116.57 118.73 1s4z h LYS 155 Ca -0.14 0.01 0.01 0.00 -2.18 0.00 0.00 60.65 58.35 1s4z h LYS 155 Cb 1.91 0.05 -0.16 0.00 -1.58 0.00 0.00 32.23 32.44 1s4z h LYS 155 CO 0.13 -0.13 -0.19 0.00 -1.08 0.00 0.00 179.45 178.18 1s4z h PRO 157 N 4.73 1.07 -0.90 0.00 0.13 -1.69 -2.51 132.00 132.82 1s4z h PRO 157 Ca -0.00 -0.09 0.10 0.00 -0.87 0.00 0.00 66.00 65.14 1s4z h PRO 157 Cb 1.18 -0.23 -0.07 0.00 0.13 0.00 0.00 31.00 32.01 1s4z h PRO 157 CO -0.07 0.75 0.58 -0.56 -0.23 0.00 0.00 178.00 178.46 1s4z h GLN 158 N 1.08 0.86 0.02 0.86 3.07 -1.95 0.87 115.11 119.93 1s4z h GLN 158 Ca 0.29 -0.05 -0.00 0.00 0.09 0.00 0.00 58.65 58.97 1s4z h GLN 158 Cb -0.05 -0.19 0.00 0.00 0.08 0.00 0.00 27.48 27.31 1s4z h GLN 158 CO -0.05 0.57 -0.01 0.28 0.09 0.00 0.00 178.83 179.70 1s4z h VAL 159 N 0.88 1.32 -0.44 1.86 2.07 -1.88 -2.74 116.25 117.32 1s4z h VAL 159 Ca 0.42 -1.09 -0.03 0.00 0.82 0.00 0.00 66.70 66.82 1s4z h VAL 159 Cb 0.43 2.05 -0.02 0.00 -1.52 0.00 0.00 31.29 32.23 1s4z h VAL 159 CO -0.18 0.28 0.16 -0.37 0.02 0.00 0.00 177.57 177.47 1s4z h VAL 160 N -0.51 1.21 -0.96 2.57 -1.51 -1.18 -2.09 116.25 113.78 1s4z h VAL 160 Ca -0.00 -0.68 0.07 0.00 -1.23 0.00 0.00 66.70 64.86 1s4z h VAL 160 Cb 0.48 0.83 -0.07 0.00 -2.13 0.00 0.00 31.29 30.40 1s4z h VAL 160 CO 0.01 0.25 0.61 0.40 -1.23 0.00 0.00 177.57 177.61 1s4z h ILE 161 N 0.57 1.05 -0.62 7.19 2.04 -0.91 -1.71 117.51 125.13 1s4z h ILE 161 Ca 0.14 -0.38 -0.09 0.00 1.00 0.00 0.00 64.86 65.54 1s4z h ILE 161 Cb 0.23 -0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.15 1s4z h ILE 161 CO -0.01 0.20 0.04 0.28 0.00 0.00 0.00 178.15 178.66 1s4z h SER 162 N 1.09 1.03 -0.40 1.72 0.02 -1.22 -3.03 113.55 112.77 1s4z h SER 162 Ca 0.43 -0.29 0.08 0.00 -0.84 0.00 0.00 61.79 61.17 1s4z h SER 162 Cb 0.21 -0.28 -0.07 0.00 0.14 0.00 0.00 62.40 62.41 1s4z h SER 162 CO -0.19 1.06 -0.05 0.15 -1.14 0.00 0.00 176.83 176.66 1s4z h PHE 163 N 0.97 -0.12 -0.95 3.45 3.57 -0.61 -1.40 116.94 121.84 1s4z h PHE 163 Ca 0.18 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.71 1s4z h PHE 163 Cb 0.51 0.12 -0.05 0.00 2.79 0.00 0.00 35.95 39.32 1s4z h PHE 163 CO 0.04 -0.13 0.60 1.88 -2.23 0.00 0.00 178.31 178.47 1s4z h TYR 164 N 0.05 1.23 -0.61 0.41 -1.99 -1.46 -2.63 116.97 111.97 1s4z h TYR 164 Ca 0.19 0.01 0.09 0.00 2.00 0.00 0.00 58.73 61.02 1s4z h TYR 164 Cb 0.29 -0.41 -0.07 0.00 2.00 0.00 0.00 36.73 38.54 1s4z h TYR 164 CO -0.31 0.80 0.24 1.49 -0.00 0.00 0.00 178.16 180.38 1s4z h GLU 165 N 1.31 0.43 -0.15 4.88 4.81 -1.15 -2.28 114.58 122.42 1s4z h GLU 165 Ca 0.35 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.53 1s4z h GLU 165 Cb -0.10 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 1s4z h GLU 165 CO -0.07 0.28 0.04 0.93 -0.73 0.00 0.00 179.01 179.46 1s4z h GLU 166 N 0.44 0.25 -1.64 1.92 5.08 -1.12 -2.89 114.58 116.61 1s4z h GLU 166 Ca 0.30 -0.06 -0.13 0.00 -1.00 0.00 0.00 59.36 58.47 1s4z h GLU 166 Cb 0.35 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.51 1s4z h GLU 166 CO -0.29 0.40 0.17 0.54 -1.00 0.00 0.00 179.01 178.83 1s4z n ARG 167 N -4.82 1.33 -3.43 2.33 5.12 -0.90 -4.89 116.66 111.40 1s4z n ARG 167 Ca -0.05 -0.66 -0.38 0.00 -1.93 0.00 0.00 57.85 54.83 1s4z n ARG 167 Cb 0.16 -1.26 -0.06 0.00 -1.16 0.00 0.00 32.46 30.14 1s4z n ARG 167 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 1s4z s LEU 168 N -0.76 4.47 0.00 0.55 2.96 -0.94 -4.97 118.68 120.00 1s4z s LEU 168 Ca 0.13 1.05 0.00 0.00 -0.22 0.00 0.00 54.13 55.09 1s4z s LEU 168 Cb 0.10 -2.77 0.00 0.00 0.50 0.00 0.00 46.19 44.03 1s4z s LEU 168 CO 0.00 0.28 0.00 1.07 -1.32 0.00 0.00 176.35 176.38 1s4z n THR 169 N 1.63 0.00 -0.98 3.68 5.66 -1.26 -5.09 114.28 117.91 1s4z n THR 169 Ca -0.12 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.88 1s4z n THR 169 Cb 0.52 -0.25 0.00 0.00 -1.55 0.00 0.00 70.33 69.05 1s4z n THR 169 CO 0.00 0.00 0.00 0.79 -3.05 0.00 0.00 175.07 172.81 1s4z n TRP 170 N -1.18 -2.69 0.00 1.09 7.02 -1.26 -4.97 117.44 115.45 1s4z n TRP 170 Ca 0.00 1.43 0.00 0.00 -1.02 0.00 0.00 57.50 57.91 1s4z n TRP 170 Cb 0.18 -2.57 0.00 0.00 -2.42 0.00 0.00 31.31 26.50 1s4z n TRP 170 CO 0.00 0.00 0.00 1.58 -2.02 0.00 0.00 177.69 177.25 1s4z n HIS 171 N -0.79 0.00 -3.64 -5.99 -0.00 -1.26 -5.04 115.22 98.50 1s4z n HIS 171 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 57.69 1s4z n HIS 171 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 29.99 29.92 1s4z n HIS 171 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1s4z s SER 172 N -1.88 -0.32 -0.03 0.26 0.15 -1.26 -5.13 113.70 105.48 1s4z s SER 172 Ca 0.00 0.55 -0.30 0.00 0.70 0.00 0.00 55.95 56.91 1s4z s SER 172 Cb 0.00 0.89 -0.07 0.00 -1.71 0.00 0.00 66.02 65.14 1s4z s SER 172 CO 0.00 -0.09 1.78 -0.47 1.20 0.00 0.00 173.24 175.66 1s4z s TYR 173 N 0.78 1.72 -0.07 3.44 5.04 -1.26 -4.91 117.35 122.09 1s4z s TYR 173 Ca -0.03 -0.01 -0.24 0.00 -2.44 0.00 0.00 57.07 54.35 1s4z s TYR 173 Cb -0.04 -4.03 -0.26 0.00 0.35 0.00 0.00 41.96 37.98 1s4z s TYR 173 CO -0.12 -4.42 0.95 -1.00 -1.34 0.00 0.00 175.55 169.62 1s4z h PRO 174 N 10.11 0.18 -6.37 4.97 0.13 -2.07 -3.47 132.00 135.48 1s4z h PRO 174 Ca -0.43 -0.24 -0.48 0.00 -0.87 0.00 0.00 66.00 63.98 1s4z h PRO 174 Cb 1.20 0.08 -0.05 0.00 0.13 0.00 0.00 31.00 32.36 1s4z h PRO 174 CO 0.95 1.03 -0.82 -1.13 -0.23 0.00 0.00 178.00 177.80 1s4z n SER 175 N -4.41 -2.49 0.00 1.44 3.41 -1.26 -5.36 113.62 104.94 1s4z n SER 175 Ca -0.11 -0.89 0.01 0.00 -0.26 0.00 0.00 58.87 57.62 1s4z n SER 175 Cb 0.59 -3.53 0.04 0.00 -0.26 0.00 0.00 64.21 61.05 1s4z n SER 175 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21