#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jfi n ASP 110 N 0.00 3.55 -4.75 -2.24 9.92 -1.26 -5.01 116.55 116.77 1jfi n ASP 110 Ca 0.00 -3.72 -0.40 0.00 -0.53 0.00 0.00 54.79 50.13 1jfi n ASP 110 Cb 0.00 -0.74 -0.05 0.00 -0.64 0.00 0.00 41.12 39.70 1jfi n ASP 110 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1jfi s LEU 111 N -3.34 4.55 0.01 0.64 1.43 -1.26 -5.04 118.68 115.67 1jfi s LEU 111 Ca 0.52 2.14 -0.13 0.00 -1.03 0.00 0.00 54.13 55.63 1jfi s LEU 111 Cb 0.45 -3.62 0.02 0.00 0.03 0.00 0.00 46.19 43.07 1jfi s LEU 111 CO 0.04 -0.10 0.27 0.42 0.23 0.00 0.00 176.35 177.21 1jfi s THR 112 N -0.85 0.08 0.38 5.49 -4.23 -1.26 -4.97 115.64 110.27 1jfi s THR 112 Ca 0.45 -0.63 -0.28 0.00 -1.18 0.00 0.00 61.69 60.06 1jfi s THR 112 Cb -0.30 -0.74 -0.10 0.00 1.34 0.00 0.00 72.50 72.71 1jfi s THR 112 CO 0.37 -0.35 1.39 -0.63 -0.54 0.00 0.00 174.62 174.86 1jfi s ILE 113 N -1.89 2.37 0.10 2.99 1.09 -1.26 -4.87 121.20 119.73 1jfi s ILE 113 Ca -0.10 0.36 -0.36 0.00 -1.10 0.00 0.00 60.65 59.45 1jfi s ILE 113 Cb -0.04 -3.22 -0.16 0.00 -1.06 0.00 0.00 42.46 37.98 1jfi s ILE 113 CO 0.00 0.08 1.34 -2.65 -0.10 0.00 0.00 174.94 173.61 1jfi n PRO 114 N 0.43 1.23 -0.28 2.79 -0.02 -1.26 -4.87 135.00 133.02 1jfi n PRO 114 Ca 0.02 0.44 0.10 0.00 -2.02 0.00 0.00 63.50 62.04 1jfi n PRO 114 Cb 0.41 -2.08 0.25 0.00 -0.02 0.00 0.00 33.50 32.06 1jfi n PRO 114 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1jfi h ARG 115 N 4.52 0.30 -0.96 -0.52 1.12 -2.00 0.92 114.38 117.77 1jfi h ARG 115 Ca -0.47 -0.02 0.08 0.00 -1.11 0.00 0.00 59.98 58.46 1jfi h ARG 115 Cb 1.33 -0.07 -0.07 0.00 -0.01 0.00 0.00 29.97 31.16 1jfi h ARG 115 CO 0.78 0.20 0.62 0.00 -3.11 0.00 0.00 179.97 178.45 1jfi h ALA 116 N 1.68 1.48 -0.55 2.80 0.00 -1.99 -0.63 119.26 122.06 1jfi h ALA 116 Ca 0.50 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.37 1jfi h ALA 116 Cb 0.91 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1jfi h ALA 116 CO -0.55 0.36 0.25 0.00 0.00 0.00 0.00 179.25 179.31 1jfi h ALA 117 N 1.50 0.71 -0.39 0.00 0.00 -1.17 -0.56 119.26 119.35 1jfi h ALA 117 Ca 0.42 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 55.11 1jfi h ALA 117 Cb 0.24 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1jfi h ALA 117 CO -0.17 0.28 -0.11 0.82 0.00 0.00 0.00 179.25 180.06 1jfi h ILE 118 N 0.74 1.25 -0.13 0.00 5.03 -1.22 -1.95 117.51 121.23 1jfi h ILE 118 Ca 0.19 -1.12 -0.14 0.00 -0.12 0.00 0.00 64.86 63.67 1jfi h ILE 118 Cb 0.14 1.08 -0.01 0.00 -3.03 0.00 0.00 36.82 34.99 1jfi h ILE 118 CO -0.02 0.38 -0.51 0.78 -0.68 0.00 0.00 178.15 178.10 1jfi h ASN 119 N 0.63 0.39 0.10 1.72 2.35 -0.66 -0.05 115.58 120.05 1jfi h ASN 119 Ca 0.11 -0.19 -0.13 0.00 -0.55 0.00 0.00 56.30 55.54 1jfi h ASN 119 Cb 0.56 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.81 1jfi h ASN 119 CO 0.03 0.83 -0.45 0.50 -1.65 0.00 0.00 177.43 176.69 1jfi h LYS 120 N 0.28 0.42 -0.09 0.81 3.64 -0.92 -1.70 116.57 119.01 1jfi h LYS 120 Ca 0.01 -0.23 -0.02 0.00 -1.27 0.00 0.00 60.65 59.14 1jfi h LYS 120 Cb 0.99 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.82 1jfi h LYS 120 CO 0.09 0.79 -0.03 1.98 -2.27 0.00 0.00 179.45 180.01 1jfi h MET 121 N 0.34 0.19 -0.51 1.90 4.05 -0.92 -1.41 114.93 118.56 1jfi h MET 121 Ca 0.02 -0.07 0.03 0.00 -0.28 0.00 0.00 59.70 59.41 1jfi h MET 121 Cb 0.93 -0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.68 1jfi h MET 121 CO 0.08 0.51 0.28 0.82 0.23 0.00 0.00 176.91 178.83 1jfi h ILE 122 N -0.15 1.00 -0.40 1.77 2.04 -0.92 0.29 117.51 121.14 1jfi h ILE 122 Ca 0.02 -0.19 -0.00 0.00 1.00 0.00 0.00 64.86 65.69 1jfi h ILE 122 Cb 0.44 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1jfi h ILE 122 CO 0.01 0.10 0.24 0.50 0.00 0.00 0.00 178.15 179.00 1jfi h LYS 123 N 0.55 0.55 0.00 2.37 1.63 -1.26 0.51 116.57 120.92 1jfi h LYS 123 Ca 0.22 -0.06 -0.08 0.00 -0.85 0.00 0.00 60.65 59.88 1jfi h LYS 123 Cb 0.08 -0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 31.59 1jfi h LYS 123 CO -0.13 0.43 -0.39 0.93 -3.45 0.00 0.00 179.45 176.84 1jfi h GLU 124 N 0.53 0.00 0.04 1.90 5.08 -0.89 -3.19 114.58 118.05 1jfi h GLU 124 Ca 0.14 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.17 1jfi h GLU 124 Cb 0.02 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 1jfi h GLU 124 CO -0.03 0.39 -1.86 2.41 -1.00 0.00 0.00 179.01 178.92 1jfi n THR 125 N -3.85 1.61 -3.34 1.13 -1.04 0.06 -4.64 114.28 104.21 1jfi n THR 125 Ca -0.01 -0.36 -0.34 0.00 -2.04 0.00 0.00 64.05 61.30 1jfi n THR 125 Cb 0.45 -1.84 -0.05 0.00 -1.82 0.00 0.00 70.33 67.07 1jfi n THR 125 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1jfi n LEU 126 N -3.95 4.71 -4.67 -4.42 4.77 0.18 -5.05 117.00 108.57 1jfi n LEU 126 Ca -0.38 -5.30 -0.42 0.00 -0.03 0.00 0.00 56.01 49.88 1jfi n LEU 126 Cb 0.87 -0.96 -0.03 0.00 -2.33 0.00 0.00 43.42 40.98 1jfi n LEU 126 CO 0.25 1.83 1.51 -2.84 -1.33 0.00 0.00 177.39 176.80 1jfi s PRO 127 N -2.33 4.16 -0.34 3.23 0.02 -1.20 -2.98 135.00 135.56 1jfi s PRO 127 Ca 0.34 2.48 -0.01 0.00 0.02 0.00 0.00 61.00 63.83 1jfi s PRO 127 Cb 0.07 -4.00 -0.01 0.00 0.02 0.00 0.00 34.50 30.57 1jfi s PRO 127 CO -0.00 -0.90 0.29 0.09 -0.33 0.00 0.00 177.00 176.15 1jfi n ASN 128 N 7.06 -2.78 -3.51 2.53 4.13 -1.26 -5.07 115.26 116.35 1jfi n ASN 128 Ca 0.19 -0.20 -0.20 0.00 1.68 0.00 0.00 54.58 56.05 1jfi n ASN 128 Cb 0.41 -1.91 -0.14 0.00 -1.54 0.00 0.00 39.78 36.61 1jfi n ASN 128 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1jfi s VAL 129 N -3.11 -0.28 0.05 2.41 1.01 -1.16 -5.12 120.40 114.21 1jfi s VAL 129 Ca 0.08 -0.13 -0.31 0.00 0.00 0.00 0.00 61.98 61.62 1jfi s VAL 129 Cb -0.01 -0.66 -0.07 0.00 0.00 0.00 0.00 36.38 35.64 1jfi s VAL 129 CO 0.22 -0.22 1.53 -0.13 0.00 0.00 0.00 175.10 176.50 1jfi s ARG 130 N 2.29 4.24 -0.18 2.72 0.52 -1.26 -4.99 118.95 122.29 1jfi s ARG 130 Ca 0.06 2.17 0.01 0.00 -0.52 0.00 0.00 55.73 57.45 1jfi s ARG 130 Cb -0.16 -3.54 0.02 0.00 0.52 0.00 0.00 34.95 31.80 1jfi s ARG 130 CO -0.12 -0.64 -0.20 0.08 0.02 0.00 0.00 175.30 174.44 1jfi s VAL 131 N 2.34 2.05 0.31 3.52 1.01 -1.26 -5.10 120.40 123.27 1jfi s VAL 131 Ca 0.69 -0.94 -0.28 0.00 0.00 0.00 0.00 61.98 61.46 1jfi s VAL 131 Cb -0.37 -1.85 -0.13 0.00 0.00 0.00 0.00 36.38 34.03 1jfi s VAL 131 CO 0.30 0.54 1.06 0.00 0.00 0.00 0.00 175.10 176.99 1jfi n ALA 132 N 4.59 0.07 0.26 5.51 0.00 -1.26 -4.78 120.51 124.91 1jfi n ALA 132 Ca -0.21 0.37 0.09 0.00 0.00 0.00 0.00 53.44 53.69 1jfi n ALA 132 Cb 0.50 -2.06 0.67 0.00 0.00 0.00 0.00 19.45 18.56 1jfi n ALA 132 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1jfi h ASN 133 N 2.06 0.00 -0.20 0.00 -0.73 -1.99 -0.61 115.58 114.12 1jfi h ASN 133 Ca -0.41 0.00 -0.03 0.00 1.87 0.00 0.00 56.30 57.73 1jfi h ASN 133 Cb 1.33 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.91 1jfi h ASN 133 CO 0.61 0.00 0.02 -0.78 -0.37 0.00 0.00 177.43 176.91 1jfi h ASP 134 N 0.00 0.32 -0.22 1.15 -0.00 -2.00 -2.48 116.42 113.19 1jfi h ASP 134 Ca 0.00 -0.28 -0.08 0.00 -0.00 0.00 0.00 57.03 56.67 1jfi h ASP 134 Cb 0.01 -0.09 -0.02 0.00 -0.00 0.00 0.00 39.33 39.24 1jfi h ASP 134 CO -0.00 0.52 -0.12 0.00 -0.00 0.00 0.00 179.24 179.64 1jfi h ALA 135 N 0.81 1.13 -0.37 -0.78 0.00 -1.64 -1.99 119.26 116.43 1jfi h ALA 135 Ca 0.06 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1jfi h ALA 135 Cb 0.34 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1jfi h ALA 135 CO 0.01 0.55 0.13 0.00 0.00 0.00 0.00 179.25 179.94 1jfi h ARG 136 N 0.56 0.52 -0.10 0.00 3.08 -0.99 -1.05 114.38 116.41 1jfi h ARG 136 Ca 0.10 -0.07 -0.11 0.00 0.07 0.00 0.00 59.98 59.97 1jfi h ARG 136 Cb 0.54 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 1jfi h ARG 136 CO 0.03 0.45 -0.45 0.93 -1.07 0.00 0.00 179.97 179.86 1jfi h GLU 137 N 0.52 0.24 -0.18 0.04 4.39 -0.91 -2.41 114.58 116.27 1jfi h GLU 137 Ca 0.13 -0.12 -0.16 0.00 0.34 0.00 0.00 59.36 59.55 1jfi h GLU 137 Cb 0.13 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1jfi h GLU 137 CO -0.01 0.65 -0.54 1.25 -1.16 0.00 0.00 179.01 179.19 1jfi h LEU 138 N 0.20 0.60 -0.25 1.33 5.85 -0.82 -2.48 115.31 119.75 1jfi h LEU 138 Ca 0.01 -0.32 -0.07 0.00 0.84 0.00 0.00 57.88 58.34 1jfi h LEU 138 Cb 0.87 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 1jfi h LEU 138 CO 0.07 1.03 -0.12 0.58 -0.34 0.00 0.00 178.44 179.65 1jfi h VAL 139 N 0.42 1.30 -0.90 1.05 2.07 -1.23 0.13 116.25 119.09 1jfi h VAL 139 Ca 0.01 -1.21 0.12 0.00 0.82 0.00 0.00 66.70 66.44 1jfi h VAL 139 Cb 1.08 1.57 -0.07 0.00 -1.52 0.00 0.00 31.29 32.35 1jfi h VAL 139 CO 0.10 0.38 0.58 0.58 0.02 0.00 0.00 177.57 179.23 1jfi h VAL 140 N 0.24 0.89 0.05 2.57 2.07 -1.38 -1.29 116.25 119.40 1jfi h VAL 140 Ca 0.05 -0.27 -0.23 0.00 0.82 0.00 0.00 66.70 67.07 1jfi h VAL 140 Cb 0.63 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1jfi h VAL 140 CO 0.04 0.15 -1.08 0.78 0.02 0.00 0.00 177.57 177.47 1jfi h ASN 141 N 0.80 0.20 -0.73 0.57 -0.26 -1.15 -3.15 115.58 111.86 1jfi h ASN 141 Ca 0.44 -0.20 -0.01 0.00 -0.56 0.00 0.00 56.30 55.97 1jfi h ASN 141 Cb 0.58 -0.06 -0.04 0.00 -1.06 0.00 0.00 38.32 37.74 1jfi h ASN 141 CO -0.20 1.14 0.43 0.00 -1.06 0.00 0.00 177.43 177.74 1jfi h THR 144 N -0.28 1.20 -0.33 0.00 1.03 -1.51 -1.66 112.91 111.34 1jfi h THR 144 Ca 0.12 -0.87 -0.04 0.00 -0.01 0.00 0.00 66.41 65.61 1jfi h THR 144 Cb 0.46 1.18 -0.01 0.00 -1.07 0.00 0.00 68.15 68.71 1jfi h THR 144 CO -0.34 0.28 0.05 -0.08 -0.01 0.00 0.00 175.52 175.41 1jfi h GLU 145 N 0.31 0.56 -0.10 0.00 4.81 -0.58 -2.07 114.58 117.50 1jfi h GLU 145 Ca 0.06 -0.15 0.01 0.00 -0.13 0.00 0.00 59.36 59.15 1jfi h GLU 145 Cb 0.41 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1jfi h GLU 145 CO 0.02 0.65 0.02 0.35 -0.73 0.00 0.00 179.01 179.32 1jfi h PHE 146 N 0.39 0.03 -0.55 0.92 3.04 -0.49 0.11 116.94 120.39 1jfi h PHE 146 Ca 0.10 0.01 0.10 0.00 3.98 0.00 0.00 57.97 62.16 1jfi h PHE 146 Cb 0.37 0.00 -0.08 0.00 2.56 0.00 0.00 35.95 38.79 1jfi h PHE 146 CO 0.03 0.01 0.07 0.82 -2.02 0.00 0.00 178.31 177.21 1jfi h ILE 147 N 0.06 0.63 -0.74 1.41 2.04 -1.18 0.13 117.51 119.87 1jfi h ILE 147 Ca 0.05 -0.07 -0.04 0.00 1.00 0.00 0.00 64.86 65.80 1jfi h ILE 147 Cb 0.04 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 1jfi h ILE 147 CO -0.06 0.03 0.30 0.45 0.00 0.00 0.00 178.15 178.87 1jfi h HIS 148 N 0.19 1.11 0.52 1.37 3.86 -0.86 -0.43 115.15 120.92 1jfi h HIS 148 Ca 0.28 -0.08 -0.03 0.00 -1.16 0.00 0.00 60.37 59.38 1jfi h HIS 148 Cb 0.42 -0.33 0.00 0.00 1.06 0.00 0.00 27.41 28.56 1jfi h HIS 148 CO -0.28 0.85 -0.25 1.25 0.86 0.00 0.00 177.93 180.36 1jfi h LEU 149 N 1.06 -0.60 -0.21 2.43 5.85 0.70 -0.69 115.31 123.83 1jfi h LEU 149 Ca 0.25 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.99 1jfi h LEU 149 Cb 0.20 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 1jfi h LEU 149 CO -0.02 -0.43 0.13 0.40 -0.34 0.00 0.00 178.44 178.18 1jfi h ILE 150 N -0.71 1.04 -0.26 4.05 1.08 -0.75 -2.58 117.51 119.39 1jfi h ILE 150 Ca -0.07 -0.09 0.03 0.00 -0.39 0.00 0.00 64.86 64.34 1jfi h ILE 150 Cb 0.54 0.74 -0.03 0.00 -3.07 0.00 0.00 36.82 35.00 1jfi h ILE 150 CO 0.12 0.05 0.05 0.28 -0.69 0.00 0.00 178.15 177.96 1jfi h SER 151 N 0.28 0.01 -0.16 1.72 0.02 -1.02 0.44 113.55 114.83 1jfi h SER 151 Ca 0.08 0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.08 1jfi h SER 151 Cb -0.02 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 1jfi h SER 151 CO -0.03 0.04 0.08 0.28 -1.14 0.00 0.00 176.83 176.06 1jfi h SER 152 N 0.15 0.11 -0.80 3.07 0.02 -1.05 0.38 113.55 115.43 1jfi h SER 152 Ca 0.12 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.03 1jfi h SER 152 Cb 0.12 -0.01 -0.04 0.00 0.14 0.00 0.00 62.40 62.61 1jfi h SER 152 CO -0.16 0.09 0.33 -0.08 -1.14 0.00 0.00 176.83 175.87 1jfi h GLU 153 N 0.17 1.20 -0.51 3.45 4.57 -1.27 -2.39 114.58 119.79 1jfi h GLU 153 Ca 0.07 -0.21 -0.12 0.00 -1.18 0.00 0.00 59.36 57.91 1jfi h GLU 153 Cb 0.02 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.39 1jfi h GLU 153 CO -0.05 0.96 -0.16 0.00 -1.18 0.00 0.00 179.01 178.59 1jfi h ALA 154 N 1.19 0.71 0.00 2.92 0.00 -0.53 -1.69 119.26 121.85 1jfi h ALA 154 Ca 0.27 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1jfi h ALA 154 Cb 0.21 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1jfi h ALA 154 CO -0.02 0.66 -0.10 -0.97 0.00 0.00 0.00 179.25 178.82 1jfi h ASN 155 N 0.88 0.00 0.00 0.00 -1.24 0.11 -0.06 115.58 115.27 1jfi h ASN 155 Ca 0.13 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.13 1jfi h ASN 155 Cb 0.73 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.78 1jfi h ASN 155 CO 0.06 0.10 -0.06 -0.33 -1.29 0.00 0.00 177.43 175.91 1jfi h GLU 156 N 0.00 0.00 -0.50 6.67 5.08 -1.18 -2.64 114.58 122.01 1jfi h GLU 156 Ca -0.00 0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.51 1jfi h GLU 156 Cb 0.19 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1jfi h GLU 156 CO 0.01 0.93 0.49 0.82 -1.00 0.00 0.00 179.01 180.26 1jfi h ILE 157 N -1.00 0.41 0.14 3.13 2.04 -1.03 -1.76 117.51 119.44 1jfi h ILE 157 Ca -0.02 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 1jfi h ILE 157 Cb 0.94 0.62 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 1jfi h ILE 157 CO -0.01 0.00 -0.07 0.00 0.00 0.00 0.00 178.15 178.07 1jfi h ASN 159 N -0.91 -0.22 -0.74 0.00 -0.26 -0.95 0.15 115.58 112.65 1jfi h ASN 159 Ca -0.02 0.16 0.04 0.00 -0.56 0.00 0.00 56.30 55.92 1jfi h ASN 159 Cb 0.51 0.27 -0.05 0.00 -1.06 0.00 0.00 38.32 37.99 1jfi h ASN 159 CO 0.03 -0.11 0.46 0.11 -1.06 0.00 0.00 177.43 176.86 1jfi h LYS 160 N 0.15 0.84 -0.82 0.81 1.57 -1.52 -2.47 116.57 115.14 1jfi h LYS 160 Ca 0.37 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 1jfi h LYS 160 Cb 0.62 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1jfi h LYS 160 CO -0.56 0.56 0.00 -1.13 -0.57 0.00 0.00 179.45 177.75 1jfi n SER 161 N -4.67 0.83 -1.73 0.86 3.41 0.52 -4.77 113.62 108.07 1jfi n SER 161 Ca 0.09 -1.02 -0.02 0.00 -0.26 0.00 0.00 58.87 57.66 1jfi n SER 161 Cb 0.12 -0.25 -0.00 0.00 -0.26 0.00 0.00 64.21 63.81 1jfi n SER 161 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1jfi n GLU 162 N 0.40 -1.92 -3.67 4.33 -0.00 -0.93 -4.89 120.64 113.97 1jfi n GLU 162 Ca 0.00 0.09 -0.22 0.00 -0.00 0.00 0.00 57.16 57.03 1jfi n GLU 162 Cb 0.17 -4.35 -0.04 0.00 -0.00 0.00 0.00 31.44 27.22 1jfi n GLU 162 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 1jfi s LYS 163 N -3.49 2.47 -0.12 3.44 1.02 -1.23 -5.07 119.74 116.75 1jfi s LYS 163 Ca 0.00 -1.61 0.10 0.00 0.02 0.00 0.00 55.97 54.48 1jfi s LYS 163 Cb 0.00 -2.30 -0.14 0.00 -0.52 0.00 0.00 37.83 34.87 1jfi s LYS 163 CO 0.00 -0.20 0.03 1.17 -0.92 0.00 0.00 175.35 175.43 1jfi n LYS 164 N -1.50 1.94 -4.45 1.68 4.81 -1.26 -4.57 118.16 114.81 1jfi n LYS 164 Ca 0.03 0.00 -0.34 0.00 -0.87 0.00 0.00 58.31 57.13 1jfi n LYS 164 Cb 0.62 -1.31 -0.14 0.00 0.02 0.00 0.00 35.03 34.23 1jfi n LYS 164 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1jfi s THR 165 N -2.29 3.14 -0.29 3.15 2.01 -1.26 -5.05 115.64 115.06 1jfi s THR 165 Ca -0.07 -0.61 -0.32 0.00 0.31 0.00 0.00 61.69 61.01 1jfi s THR 165 Cb 0.04 -2.36 -0.08 0.00 0.01 0.00 0.00 72.50 70.10 1jfi s THR 165 CO 0.48 0.49 2.21 -0.38 -0.69 0.00 0.00 174.62 176.73 1jfi n ILE 166 N 3.97 0.26 -3.20 1.82 5.41 -1.26 -4.94 119.36 121.42 1jfi n ILE 166 Ca -0.18 -0.36 -0.22 0.00 1.00 0.00 0.00 62.75 62.99 1jfi n ILE 166 Cb 0.52 -2.11 0.00 0.00 -0.71 0.00 0.00 39.64 37.35 1jfi n ILE 166 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1jfi s SER 167 N 7.87 5.92 0.32 4.38 1.04 -1.26 -4.96 113.70 127.01 1jfi s SER 167 Ca 1.05 0.13 0.19 0.00 0.48 0.00 0.00 55.95 57.81 1jfi s SER 167 Cb -0.60 -1.47 1.04 0.00 0.10 0.00 0.00 66.02 65.09 1jfi s SER 167 CO 0.42 -0.57 1.56 -2.65 0.98 0.00 0.00 173.24 172.98 1jfi n PRO 168 N -1.90 0.13 0.01 4.02 -0.02 -1.26 -1.25 135.00 134.73 1jfi n PRO 168 Ca 0.00 0.62 -0.19 0.00 -2.02 0.00 0.00 63.50 61.91 1jfi n PRO 168 Cb 0.58 -2.00 -0.14 0.00 -0.02 0.00 0.00 33.50 31.92 1jfi n PRO 168 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1jfi h GLU 169 N 0.00 0.20 -0.58 -0.52 4.57 -1.98 -2.90 114.58 113.36 1jfi h GLU 169 Ca 0.00 -0.34 0.07 0.00 -1.18 0.00 0.00 59.36 57.90 1jfi h GLU 169 Cb 0.17 0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.85 1jfi h GLU 169 CO 0.00 1.16 0.39 0.45 -1.18 0.00 0.00 179.01 179.83 1jfi h HIS 170 N -0.56 0.53 -0.06 0.92 3.86 -1.54 -0.01 115.15 118.29 1jfi h HIS 170 Ca -0.12 0.01 -0.17 0.00 -1.16 0.00 0.00 60.37 58.93 1jfi h HIS 170 Cb 1.46 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 29.75 1jfi h HIS 170 CO 0.21 0.28 -0.71 0.28 0.86 0.00 0.00 177.93 178.85 1jfi h VAL 171 N 0.53 1.41 -0.31 2.45 2.07 -1.55 -1.59 116.25 119.26 1jfi h VAL 171 Ca 0.25 -2.17 -0.13 0.00 0.82 0.00 0.00 66.70 65.47 1jfi h VAL 171 Cb 0.32 2.14 -0.00 0.00 -1.52 0.00 0.00 31.29 32.22 1jfi h VAL 171 CO -0.07 0.64 -0.31 0.40 0.02 0.00 0.00 177.57 178.25 1jfi h ILE 172 N 0.20 1.29 -0.29 4.57 2.04 -0.93 -2.40 117.51 121.99 1jfi h ILE 172 Ca -0.02 -1.48 -0.10 0.00 1.00 0.00 0.00 64.86 64.26 1jfi h ILE 172 Cb 1.27 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 38.87 1jfi h ILE 172 CO 0.11 0.48 -0.22 1.56 0.00 0.00 0.00 178.15 180.08 1jfi h GLN 173 N 0.52 0.56 -0.41 2.37 4.20 -1.03 -2.47 115.11 118.85 1jfi h GLN 173 Ca 0.05 -0.21 -0.10 0.00 0.06 0.00 0.00 58.65 58.46 1jfi h GLN 173 Cb 0.89 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.61 1jfi h GLN 173 CO 0.08 0.74 -0.14 0.00 -0.67 0.00 0.00 178.83 178.85 1jfi h ALA 174 N 1.27 0.99 0.17 3.87 0.00 -1.22 -0.10 119.26 124.23 1jfi h ALA 174 Ca 0.07 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1jfi h ALA 174 Cb 0.66 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1jfi h ALA 174 CO 0.05 0.60 -0.08 -0.07 0.00 0.00 0.00 179.25 179.75 1jfi h LEU 175 N 0.67 -0.19 0.68 0.00 4.07 -1.07 0.51 115.31 119.98 1jfi h LEU 175 Ca 0.11 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.05 1jfi h LEU 175 Cb 0.61 0.05 -0.00 0.00 1.08 0.00 0.00 40.66 42.40 1jfi h LEU 175 CO 0.04 -0.13 -0.41 -0.08 -1.08 0.00 0.00 178.44 176.78 1jfi h GLU 176 N -0.23 -0.98 -1.00 1.13 4.57 -1.33 0.62 114.58 117.36 1jfi h GLU 176 Ca -0.02 0.07 0.20 0.00 -1.18 0.00 0.00 59.36 58.43 1jfi h GLU 176 Cb 0.17 0.22 -0.11 0.00 -0.16 0.00 0.00 28.75 28.88 1jfi h GLU 176 CO 0.04 -0.65 0.61 1.03 -1.18 0.00 0.00 179.01 178.86 1jfi h SER 177 N -1.02 0.75 1.45 1.04 0.87 -0.88 -0.61 113.55 115.16 1jfi h SER 177 Ca -0.09 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1jfi h SER 177 Cb 0.82 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.75 1jfi h SER 177 CO 0.09 0.24 0.00 -0.07 -0.53 0.00 0.00 176.83 176.56 1jfi h LEU 178 N 0.72 0.00 0.00 2.23 4.07 0.21 -3.47 115.31 119.07 1jfi h LEU 178 Ca 0.59 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.55 1jfi h LEU 178 Cb 0.98 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.72 1jfi h LEU 178 CO -0.40 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.57 1jfi n GLY 179 N 0.95 1.48 0.55 0.83 0.00 -0.24 -4.99 105.19 103.78 1jfi n GLY 179 Ca 0.04 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.14 1jfi n GLY 179 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1jfi n PHE 180 N -1.24 0.49 -0.44 1.61 0.99 0.21 -4.79 117.46 114.29 1jfi n PHE 180 Ca 0.00 -1.07 0.38 0.00 -0.00 0.00 0.00 57.45 56.76 1jfi n PHE 180 Cb 0.00 -0.26 0.71 0.00 -1.00 0.00 0.00 39.48 38.93 1jfi n PHE 180 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 1jfi h GLY 181 N 0.88 0.49 0.78 1.37 0.00 -1.71 -0.45 103.07 104.43 1jfi h GLY 181 Ca 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.30 1jfi h GLY 181 CO 0.13 -0.11 0.00 -1.14 0.00 0.00 0.00 176.54 175.42 1jfi n SER 182 N -4.31 0.00 -0.06 0.19 3.41 -1.26 -2.34 113.62 109.25 1jfi n SER 182 Ca 0.33 -0.66 -0.05 0.00 -0.26 0.00 0.00 58.87 58.22 1jfi n SER 182 Cb 1.41 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 65.21 1jfi n SER 182 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1jfi n TYR 183 N -0.89 0.22 0.28 7.33 0.53 -0.18 -4.45 117.16 119.99 1jfi n TYR 183 Ca 0.10 0.08 0.07 0.00 -1.02 0.00 0.00 57.90 57.13 1jfi n TYR 183 Cb 0.05 -0.94 0.37 0.00 -1.03 0.00 0.00 39.34 37.78 1jfi n TYR 183 CO 0.00 0.00 0.00 0.82 -1.02 0.00 0.00 176.86 176.66 1jfi h ILE 184 N 0.00 0.00 0.09 -0.72 2.04 -1.61 -0.94 117.51 116.37 1jfi h ILE 184 Ca -0.38 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.47 1jfi h ILE 184 Cb 1.94 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 38.32 1jfi h ILE 184 CO 0.03 0.00 -0.04 -1.28 0.00 0.00 0.00 178.15 176.86 1jfi h SER 185 N 0.00 -0.10 0.40 1.72 0.87 -1.80 -2.63 113.55 112.01 1jfi h SER 185 Ca 0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1jfi h SER 185 Cb 1.16 0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 63.14 1jfi h SER 185 CO 0.00 0.00 -0.01 -0.33 -0.53 0.00 0.00 176.83 175.96 1jfi h GLU 186 N -0.26 0.00 0.02 2.24 5.08 -1.65 -2.00 114.58 118.00 1jfi h GLU 186 Ca -0.01 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.12 1jfi h GLU 186 Cb 0.09 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1jfi h GLU 186 CO 0.02 0.01 -1.09 0.28 -1.00 0.00 0.00 179.01 177.22 1jfi h VAL 187 N 0.00 1.62 -0.54 3.13 2.07 -1.30 -3.09 116.25 118.14 1jfi h VAL 187 Ca -0.00 -3.32 -0.12 0.00 0.82 0.00 0.00 66.70 64.09 1jfi h VAL 187 Cb 0.21 2.83 -0.02 0.00 -1.52 0.00 0.00 31.29 32.80 1jfi h VAL 187 CO 0.00 0.93 -0.13 0.11 0.02 0.00 0.00 177.57 178.51 1jfi h LYS 188 N 0.01 1.03 -0.18 1.57 1.57 -0.97 -1.86 116.57 117.75 1jfi h LYS 188 Ca -0.05 -0.39 0.02 0.00 -1.87 0.00 0.00 60.65 58.35 1jfi h LYS 188 Cb 1.82 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 34.05 1jfi h LYS 188 CO 0.14 1.08 0.06 0.93 -0.57 0.00 0.00 179.45 181.09 1jfi h GLU 189 N 0.91 0.14 -0.86 3.15 5.08 -1.54 -1.11 114.58 120.36 1jfi h GLU 189 Ca 0.14 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1jfi h GLU 189 Cb 0.70 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.88 1jfi h GLU 189 CO 0.05 0.09 0.47 0.28 -1.00 0.00 0.00 179.01 178.90 1jfi h VAL 190 N 0.14 1.25 -0.29 3.13 2.07 -1.44 -0.94 116.25 120.17 1jfi h VAL 190 Ca 0.08 -0.61 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 1jfi h VAL 190 Cb 0.05 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.90 1jfi h VAL 190 CO -0.08 0.28 0.15 0.25 0.02 0.00 0.00 177.57 178.19 1jfi h LEU 191 N 1.19 0.34 0.48 2.57 5.85 -0.89 -1.57 115.31 123.28 1jfi h LEU 191 Ca 0.30 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.98 1jfi h LEU 191 Cb 0.02 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 40.97 1jfi h LEU 191 CO -0.05 0.28 -0.23 -0.61 -0.34 0.00 0.00 178.44 177.49 1jfi h GLN 192 N 0.39 -0.62 -1.12 1.25 5.75 0.08 -2.26 115.11 118.59 1jfi h GLN 192 Ca 0.10 0.04 0.31 0.00 -0.15 0.00 0.00 58.65 58.96 1jfi h GLN 192 Cb 0.02 0.14 -0.07 0.00 1.07 0.00 0.00 27.48 28.64 1jfi h GLN 192 CO -0.02 -0.41 0.77 1.05 -2.65 0.00 0.00 178.83 177.57 1jfi h GLU 193 N -0.80 0.14 -0.64 1.69 4.11 -1.17 0.69 114.58 118.61 1jfi h GLU 193 Ca -0.07 -0.01 -0.09 0.00 0.07 0.00 0.00 59.36 59.27 1jfi h GLU 193 Cb 0.49 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1jfi h GLU 193 CO 0.11 0.09 0.06 0.00 0.07 0.00 0.00 179.01 179.34 1jfi h LYS 195 N 0.99 0.75 -0.23 0.00 1.57 0.88 -1.97 116.57 118.57 1jfi h LYS 195 Ca 0.19 -0.48 -0.01 0.00 -1.87 0.00 0.00 60.65 58.48 1jfi h LYS 195 Cb 0.49 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 1jfi h LYS 195 CO 0.02 1.11 0.11 1.15 -0.57 0.00 0.00 179.45 181.27 1jfi h THR 196 N 0.49 1.15 -0.37 -0.16 2.02 -0.69 0.16 112.91 115.51 1jfi h THR 196 Ca 0.01 -0.42 0.04 0.00 0.77 0.00 0.00 66.41 66.81 1jfi h THR 196 Cb 1.08 1.00 -0.04 0.00 -1.74 0.00 0.00 68.15 68.45 1jfi h THR 196 CO 0.11 0.14 0.13 0.58 0.37 0.00 0.00 175.52 176.85 1jfi h VAL 197 N 0.24 0.89 -0.47 3.16 2.07 -0.17 0.15 116.25 122.12 1jfi h VAL 197 Ca 0.08 -0.10 -0.05 0.00 0.82 0.00 0.00 66.70 67.45 1jfi h VAL 197 Cb 0.13 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 1jfi h VAL 197 CO -0.01 0.05 0.09 0.00 0.02 0.00 0.00 177.57 177.72 1jfi h ALA 198 N 1.24 1.27 -0.09 1.67 0.00 -1.09 -1.39 119.26 120.87 1jfi h ALA 198 Ca 0.17 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1jfi h ALA 198 Cb 0.14 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1jfi h ALA 198 CO -0.17 0.50 -0.05 1.25 0.00 0.00 0.00 179.25 180.78 1jfi h LEU 199 N 0.70 0.19 -0.89 0.00 5.85 0.22 -1.92 115.31 119.47 1jfi h LEU 199 Ca 0.15 -0.44 0.02 0.00 0.84 0.00 0.00 57.88 58.46 1jfi h LEU 199 Cb 0.30 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.23 1jfi h LEU 199 CO 0.00 0.59 0.58 0.11 -0.34 0.00 0.00 178.44 179.39 1jfi h LYS 200 N -0.20 1.13 -0.25 1.25 1.57 -0.56 -1.47 116.57 118.04 1jfi h LYS 200 Ca 0.02 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 1jfi h LYS 200 Cb 0.52 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1jfi h LYS 200 CO 0.01 0.75 -0.13 -0.09 -0.57 0.00 0.00 179.45 179.42 1jfi h ARG 201 N 1.17 0.41 -0.12 3.15 2.43 -1.22 0.23 114.38 120.43 1jfi h ARG 201 Ca 0.34 -0.11 -0.03 0.00 -0.81 0.00 0.00 59.98 59.37 1jfi h ARG 201 Cb -0.07 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.43 1jfi h ARG 201 CO -0.09 0.55 -0.04 0.00 -1.51 0.00 0.00 179.97 178.87 1jfi h ARG 202 N 0.38 0.24 -0.20 0.20 3.08 -0.52 -2.60 114.38 114.97 1jfi h ARG 202 Ca 0.07 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 1jfi h ARG 202 Cb 0.47 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 1jfi h ARG 202 CO 0.03 0.56 -0.18 0.87 -1.07 0.00 0.00 179.97 180.18 1jfi h LYS 203 N -0.09 0.33 -0.60 0.04 1.57 -1.03 -1.56 116.57 115.23 1jfi h LYS 203 Ca 0.03 -0.10 -0.10 0.00 -1.87 0.00 0.00 60.65 58.61 1jfi h LYS 203 Cb 0.48 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.73 1jfi h LYS 203 CO 0.01 0.51 -0.03 0.00 -0.57 0.00 0.00 179.45 179.38 1jfi h ALA 204 N 1.51 0.82 -0.51 3.86 0.00 -0.88 -2.12 119.26 121.94 1jfi h ALA 204 Ca 0.06 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.54 1jfi h ALA 204 Cb 0.49 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1jfi h ALA 204 CO 0.03 0.67 -0.09 0.77 0.00 0.00 0.00 179.25 180.63 1jfi h SER 205 N 0.97 0.96 -0.78 0.00 0.02 -1.13 -1.24 113.55 112.36 1jfi h SER 205 Ca 0.17 -0.35 0.07 0.00 -0.84 0.00 0.00 61.79 60.84 1jfi h SER 205 Cb 0.59 -0.26 -0.06 0.00 0.14 0.00 0.00 62.40 62.81 1jfi h SER 205 CO 0.04 1.09 0.45 -1.28 -1.14 0.00 0.00 176.83 175.98 1jfi h SER 206 N 0.82 0.67 -0.20 3.07 0.87 -1.04 -1.19 113.55 116.55 1jfi h SER 206 Ca 0.13 0.03 -0.21 0.00 -1.23 0.00 0.00 61.79 60.52 1jfi h SER 206 Cb 0.65 -0.10 0.01 0.00 -0.44 0.00 0.00 62.40 62.51 1jfi h SER 206 CO 0.04 0.42 -0.68 0.03 -0.53 0.00 0.00 176.83 176.12 1jfi h ARG 207 N 0.80 0.83 -0.94 2.24 3.08 -1.23 -0.12 114.38 119.04 1jfi h ARG 207 Ca 0.35 -0.61 0.03 0.00 0.07 0.00 0.00 59.98 59.83 1jfi h ARG 207 Cb 0.24 0.10 -0.05 0.00 0.08 0.00 0.00 29.97 30.34 1jfi h ARG 207 CO -0.20 1.22 0.61 1.25 -1.07 0.00 0.00 179.97 181.78 1jfi h LEU 208 N 0.60 1.02 0.00 3.04 5.85 -0.69 0.26 115.31 125.39 1jfi h LEU 208 Ca -0.02 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1jfi h LEU 208 Cb 1.30 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.09 1jfi h LEU 208 CO 0.14 0.70 -0.48 -0.62 -0.34 0.00 0.00 178.44 177.85 1jfi n GLU 209 N -4.49 0.08 0.00 1.25 1.02 -0.50 -4.23 120.64 113.77 1jfi n GLU 209 Ca 0.12 0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 1jfi n GLU 209 Cb 0.09 -1.55 0.00 0.00 -0.02 0.00 0.00 31.44 29.96 1jfi n GLU 209 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1jfi n ASN 210 N -1.66 1.77 -0.07 1.62 3.02 -0.06 -4.86 115.26 115.01 1jfi n ASN 210 Ca 0.05 -0.09 0.03 0.00 -0.03 0.00 0.00 54.58 54.54 1jfi n ASN 210 Cb 0.36 0.54 0.05 0.00 -0.61 0.00 0.00 39.78 40.12 1jfi n ASN 210 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1jfi n LEU 211 N -0.72 1.67 -4.96 3.41 4.77 0.86 -5.01 117.00 117.02 1jfi n LEU 211 Ca 0.00 -2.02 -0.25 0.00 -0.03 0.00 0.00 56.01 53.70 1jfi n LEU 211 Cb 0.00 -0.15 0.11 0.00 -2.33 0.00 0.00 43.42 41.05 1jfi n LEU 211 CO 0.00 0.48 0.63 -0.83 -1.33 0.00 0.00 177.39 176.34 1jfi s GLY 212 N -1.51 1.75 -0.01 -0.72 0.00 -1.14 -4.97 107.32 100.71 1jfi s GLY 212 Ca 0.11 -1.32 -0.36 0.00 0.00 0.00 0.00 44.72 43.15 1jfi s GLY 212 CO 0.01 -0.78 1.66 1.39 0.00 0.00 0.00 173.10 175.38 1jfi n ILE 213 N -3.03 0.24 -1.52 0.90 5.41 -1.26 -4.79 119.36 115.31 1jfi n ILE 213 Ca 0.12 -0.04 -0.51 0.00 1.00 0.00 0.00 62.75 63.32 1jfi n ILE 213 Cb 0.60 -1.46 -0.05 0.00 -0.71 0.00 0.00 39.64 38.03 1jfi n ILE 213 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 1jfi n PRO 214 N 4.65 0.58 -0.33 0.38 -0.04 -1.26 -4.65 135.00 134.33 1jfi n PRO 214 Ca 0.21 0.21 0.23 0.00 -0.04 0.00 0.00 63.50 64.11 1jfi n PRO 214 Cb 0.24 -1.58 0.46 0.00 -0.04 0.00 0.00 33.50 32.58 1jfi n PRO 214 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1jfi h GLU 215 N 2.68 0.25 -0.42 0.54 4.81 -1.99 -1.57 114.58 118.87 1jfi h GLU 215 Ca -0.42 -0.01 0.07 0.00 -0.13 0.00 0.00 59.36 58.87 1jfi h GLU 215 Cb 1.39 -0.06 -0.09 0.00 0.63 0.00 0.00 28.75 30.62 1jfi h GLU 215 CO 0.65 0.16 -0.42 1.49 -0.73 0.00 0.00 179.01 180.17 1jfi h GLU 216 N 0.25 -0.30 0.00 1.92 4.81 -2.00 0.42 114.58 119.69 1jfi h GLU 216 Ca 0.72 0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.85 1jfi h GLU 216 Cb 1.66 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 31.09 1jfi h GLU 216 CO -0.65 -0.20 -0.57 1.49 -0.73 0.00 0.00 179.01 178.36 1jfi h GLU 217 N -0.31 0.00 -0.30 1.92 4.57 -1.63 -2.01 114.58 116.82 1jfi h GLU 217 Ca 0.14 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.29 1jfi h GLU 217 Cb 0.58 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.16 1jfi h GLU 217 CO -0.58 0.57 0.04 -0.07 -1.18 0.00 0.00 179.01 177.79 1jfi h LEU 218 N 0.00 0.48 -0.20 1.64 3.38 -0.97 0.13 115.31 119.78 1jfi h LEU 218 Ca -0.01 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.73 1jfi h LEU 218 Cb 1.01 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 1jfi h LEU 218 CO 0.07 0.63 0.01 0.25 0.09 0.00 0.00 178.44 179.49 1jfi h LEU 219 N 0.32 -0.05 -0.25 1.67 5.85 0.00 -0.88 115.31 121.97 1jfi h LEU 219 Ca 0.09 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.89 1jfi h LEU 219 Cb 0.35 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.41 1jfi h LEU 219 CO 0.01 0.00 0.03 -0.09 -0.34 0.00 0.00 178.44 178.05 1jfi h ARG 220 N 0.08 0.12 -0.02 1.25 2.43 -1.14 0.25 114.38 117.34 1jfi h ARG 220 Ca 0.09 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.29 1jfi h ARG 220 Cb 0.11 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.58 1jfi h ARG 220 CO -0.14 0.08 -0.25 1.96 -1.51 0.00 0.00 179.97 180.10 1jfi h GLN 221 N 0.12 -0.36 -0.94 0.20 4.20 -0.63 -0.45 115.11 117.25 1jfi h GLN 221 Ca 0.12 0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.87 1jfi h GLN 221 Cb 0.13 0.08 -0.05 0.00 0.30 0.00 0.00 27.48 27.95 1jfi h GLN 221 CO -0.17 -0.24 0.62 0.37 -0.67 0.00 0.00 178.83 178.73 1jfi h GLN 222 N -0.37 1.20 0.00 1.46 4.15 -0.60 -1.58 115.11 119.37 1jfi h GLN 222 Ca 0.07 -0.07 -0.07 0.00 0.77 0.00 0.00 58.65 59.34 1jfi h GLN 222 Cb 0.47 -0.27 -0.01 0.00 0.21 0.00 0.00 27.48 27.88 1jfi h GLN 222 CO -0.24 0.79 -0.35 1.96 -1.93 0.00 0.00 178.83 179.07 1jfi h GLN 223 N 1.24 0.00 -0.11 1.69 4.20 -0.06 -1.79 115.11 120.27 1jfi h GLN 223 Ca 0.36 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.06 1jfi h GLN 223 Cb -0.09 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 1jfi h GLN 223 CO -0.09 0.35 0.06 1.49 -0.67 0.00 0.00 178.83 179.97 1jfi h GLU 224 N 0.00 0.16 -0.96 1.46 4.81 -0.09 0.20 114.58 120.16 1jfi h GLU 224 Ca -0.00 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1jfi h GLU 224 Cb 0.64 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.94 1jfi h GLU 224 CO 0.05 0.20 0.64 -0.07 -0.73 0.00 0.00 179.01 179.10 1jfi h LEU 225 N 0.08 1.10 0.12 1.64 3.38 -1.19 -0.13 115.31 120.31 1jfi h LEU 225 Ca 0.04 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1jfi h LEU 225 Cb 0.09 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.57 1jfi h LEU 225 CO -0.01 0.80 -0.06 -0.26 0.09 0.00 0.00 178.44 179.00 1jfi h PHE 226 N 1.30 -0.15 -0.66 1.13 0.04 -0.67 -1.70 116.94 116.23 1jfi h PHE 226 Ca 0.35 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 61.12 1jfi h PHE 226 Cb -0.15 0.05 -0.03 0.00 2.20 0.00 0.00 35.95 38.02 1jfi h PHE 226 CO -0.00 0.19 0.40 0.00 -0.60 0.00 0.00 178.31 178.30 1jfi h ALA 227 N 0.32 0.84 -0.92 2.45 0.00 -0.51 -1.57 119.26 119.88 1jfi h ALA 227 Ca -0.02 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1jfi h ALA 227 Cb 0.41 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 1jfi h ALA 227 CO 0.03 0.31 0.61 -0.22 0.00 0.00 0.00 179.25 179.98 1jfi h LYS 228 N 0.90 1.19 -0.16 0.00 3.64 -1.02 -0.59 116.57 120.53 1jfi h LYS 228 Ca 0.24 -0.07 -0.13 0.00 -1.27 0.00 0.00 60.65 59.42 1jfi h LYS 228 Cb -0.04 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.50 1jfi h LYS 228 CO -0.05 0.79 -0.45 0.00 -2.27 0.00 0.00 179.45 177.47 1jfi h ALA 229 N 1.34 0.93 -0.63 5.00 0.00 -0.88 -1.80 119.26 123.22 1jfi h ALA 229 Ca 0.34 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 1jfi h ALA 229 Cb -0.13 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1jfi h ALA 229 CO -0.08 0.64 0.10 0.00 0.00 0.00 0.00 179.25 179.91 1jfi h ARG 230 N 0.32 1.03 0.27 0.00 3.08 -0.54 -1.96 114.38 116.58 1jfi h ARG 230 Ca 0.02 -0.27 -0.01 0.00 0.07 0.00 0.00 59.98 59.79 1jfi h ARG 230 Cb 0.92 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.85 1jfi h ARG 230 CO 0.08 0.95 -0.13 1.96 -1.07 0.00 0.00 179.97 181.76 1jfi h GLN 231 N 0.97 -0.34 0.39 0.04 4.20 -0.74 -0.27 115.11 119.36 1jfi h GLN 231 Ca 0.19 0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.92 1jfi h GLN 231 Cb 0.42 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.26 1jfi h GLN 231 CO 0.01 -0.22 -0.41 0.37 -0.67 0.00 0.00 178.83 177.92 1jfi h GLN 232 N -0.37 -0.79 0.00 1.46 4.15 -1.14 -0.55 115.11 117.86 1jfi h GLN 232 Ca -0.04 0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.44 1jfi h GLN 232 Cb 0.28 0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.15 1jfi h GLN 232 CO 0.06 -0.53 0.00 1.04 -1.93 0.00 0.00 178.83 177.47 1jfi n GLN 233 N -5.50 0.12 -0.04 1.69 3.00 -0.75 -0.88 117.38 115.02 1jfi n GLN 233 Ca -0.10 0.50 -0.14 0.00 -0.01 0.00 0.00 57.00 57.25 1jfi n GLN 233 Cb 0.40 -1.81 -0.11 0.00 0.00 0.00 0.00 30.24 28.72 1jfi n GLN 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1jfi h ALA 234 N 2.15 0.02 0.55 -1.58 0.00 0.48 -2.70 119.26 118.17 1jfi h ALA 234 Ca 0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 1jfi h ALA 234 Cb 0.15 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.95 1jfi h ALA 234 CO 0.00 -0.07 -0.26 0.93 0.00 0.00 0.00 179.25 179.85 1jfi h GLU 235 N -0.65 -0.71 -0.83 0.00 5.08 -0.32 -0.31 114.58 116.84 1jfi h GLU 235 Ca -0.01 0.05 0.24 0.00 -1.00 0.00 0.00 59.36 58.64 1jfi h GLU 235 Cb 0.80 0.16 -0.03 0.00 0.50 0.00 0.00 28.75 30.18 1jfi h GLU 235 CO 0.01 -0.44 0.82 1.25 -1.00 0.00 0.00 179.01 179.65 1jfi h LEU 236 N -1.16 0.00 0.00 1.33 6.46 -1.17 0.44 115.31 121.21 1jfi h LEU 236 Ca -0.07 0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.63 1jfi h LEU 236 Cb 0.59 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.51 1jfi h LEU 236 CO 0.12 0.00 -0.44 0.00 -0.62 0.00 0.00 178.44 177.51 1jfi h ALA 237 N 1.14 0.06 -0.88 1.25 0.00 -1.37 -3.21 119.26 116.25 1jfi h ALA 237 Ca 0.39 -0.52 0.07 0.00 0.00 0.00 0.00 54.91 54.85 1jfi h ALA 237 Cb 2.04 0.32 -0.06 0.00 0.00 0.00 0.00 17.79 20.09 1jfi h ALA 237 CO -0.00 0.31 0.57 1.96 0.00 0.00 0.00 179.25 182.09 1jfi h GLN 238 N -1.00 0.93 -0.06 0.00 4.20 0.44 -0.37 115.11 119.24 1jfi h GLN 238 Ca -0.08 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 1jfi h GLN 238 Cb 0.64 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 28.21 1jfi h GLN 238 CO -0.05 0.62 0.02 1.96 -0.67 0.00 0.00 178.83 180.71 1jfi h GLN 239 N 0.96 0.10 0.00 1.46 4.20 -0.37 -1.76 115.11 119.70 1jfi h GLN 239 Ca 0.38 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 59.06 1jfi h GLN 239 Cb 0.25 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.02 1jfi h GLN 239 CO -0.15 0.27 -0.05 0.93 -0.67 0.00 0.00 178.83 179.16 1jfi h GLU 240 N -0.09 0.00 0.00 1.46 5.08 -1.45 0.18 114.58 119.76 1jfi h GLU 240 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1jfi h GLU 240 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1jfi h GLU 240 CO -0.00 0.05 -0.11 0.91 -1.00 0.00 0.00 179.01 178.86 1jfi n TRP 241 N -3.35 0.01 -0.50 4.33 8.01 -0.19 -3.33 117.44 122.43 1jfi n TRP 241 Ca -0.02 0.00 -0.03 0.00 -1.31 0.00 0.00 57.50 56.14 1jfi n TRP 241 Cb 0.21 -0.45 0.24 0.00 -2.01 0.00 0.00 31.31 29.29 1jfi n TRP 241 CO 0.00 0.00 0.00 1.47 -1.01 0.00 0.00 177.69 178.15 1jfi n LEU 242 N -1.51 4.99 -0.06 -0.99 -0.00 0.05 -5.05 117.00 114.44 1jfi n LEU 242 Ca 0.07 -2.58 0.01 0.00 -0.00 0.00 0.00 56.01 53.50 1jfi n LEU 242 Cb 0.34 -0.68 0.01 0.00 -0.00 0.00 0.00 43.42 43.08 1jfi n LEU 242 CO 0.29 0.67 0.27 0.00 -0.00 0.00 0.00 177.39 178.62