#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kai s ASP 95 N 0.00 6.97 0.00 0.00 3.68 -1.26 -4.97 116.67 121.09 2kai s ASP 95 Ca 0.00 -2.76 0.00 0.00 2.13 0.00 0.00 52.55 51.92 2kai s ASP 95 Cb 0.00 -2.42 0.00 0.00 -1.45 0.00 0.00 42.92 39.05 2kai s ASP 95 CO 0.00 -0.84 0.00 0.61 0.13 0.00 0.00 175.17 175.07 2kai n GLY 96 N 4.49 0.00 2.44 2.66 0.00 -1.26 -2.04 105.19 111.48 2kai n GLY 96 Ca 0.35 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.21 2kai n GLY 96 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2kai n LYS 97 N 0.00 1.43 -3.97 1.61 2.85 -1.26 -5.10 118.16 113.72 2kai n LYS 97 Ca 0.00 -3.57 -0.35 0.00 -1.05 0.00 0.00 58.31 53.34 2kai n LYS 97 Cb 0.00 -1.65 -0.09 0.00 -0.65 0.00 0.00 35.03 32.64 2kai n LYS 97 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2kai s ASP 98 N -2.84 5.79 -0.17 -5.58 3.68 -0.86 -4.26 116.67 112.43 2kai s ASP 98 Ca 0.37 0.16 -0.02 0.00 2.13 0.00 0.00 52.55 55.19 2kai s ASP 98 Cb 0.38 -1.96 0.01 0.00 -1.45 0.00 0.00 42.92 39.90 2kai s ASP 98 CO -0.05 0.22 2.52 -1.22 0.13 0.00 0.00 175.17 176.76 2kai n TYR 99 N 3.26 0.71 -4.08 -5.34 4.02 -1.26 -4.91 117.16 109.56 2kai n TYR 99 Ca -0.17 -1.55 -0.28 0.00 -0.01 0.00 0.00 57.90 55.89 2kai n TYR 99 Cb 0.53 -1.04 -0.06 0.00 -0.02 0.00 0.00 39.34 38.75 2kai n TYR 99 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2kai s SER 100 N 1.20 5.48 -1.17 7.72 0.15 -1.26 -4.40 113.70 121.42 2kai s SER 100 Ca 0.35 -0.11 -0.07 0.00 0.70 0.00 0.00 55.95 56.82 2kai s SER 100 Cb 0.21 -1.43 0.01 0.00 -1.71 0.00 0.00 66.02 63.10 2kai s SER 100 CO -0.04 0.10 0.94 1.41 1.20 0.00 0.00 173.24 176.85 2kai n HIS 101 N -0.08 -2.34 -2.96 3.44 8.25 -1.26 -4.92 115.22 115.35 2kai n HIS 101 Ca -0.08 0.80 -0.44 0.00 -0.26 0.00 0.00 57.72 57.74 2kai n HIS 101 Cb 0.54 -4.36 -0.01 0.00 1.12 0.00 0.00 29.99 27.27 2kai n HIS 101 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2kai s ASP 102 N -3.20 6.96 -0.28 0.41 -1.08 -1.26 -4.90 116.67 113.31 2kai s ASP 102 Ca 0.47 -2.75 -0.17 0.00 -0.52 0.00 0.00 52.55 49.57 2kai s ASP 102 Cb -0.21 -2.39 0.10 0.00 -1.46 0.00 0.00 42.92 38.96 2kai s ASP 102 CO 0.58 -0.82 0.80 -0.22 0.52 0.00 0.00 175.17 176.03 2kai s LEU 103 N 1.79 -0.77 -0.17 -1.34 2.96 -1.26 -4.86 118.68 115.02 2kai s LEU 103 Ca 0.39 1.26 -0.11 0.00 -0.22 0.00 0.00 54.13 55.45 2kai s LEU 103 Cb -0.04 2.17 0.06 0.00 0.50 0.00 0.00 46.19 48.88 2kai s LEU 103 CO -0.03 -0.20 0.43 -0.32 -1.32 0.00 0.00 176.35 174.91 2kai s MET 104 N 1.36 0.44 -0.11 1.98 -2.45 -1.26 -5.15 119.30 114.11 2kai s MET 104 Ca -0.08 0.76 -0.09 0.00 -1.25 0.00 0.00 55.69 55.03 2kai s MET 104 Cb -0.05 0.06 -0.04 0.00 1.25 0.00 0.00 34.83 36.05 2kai s MET 104 CO -0.16 -0.13 0.19 -0.51 1.05 0.00 0.00 175.02 175.46 2kai s LEU 105 N 1.07 4.39 -0.24 4.11 1.43 -1.26 -5.09 118.68 123.08 2kai s LEU 105 Ca -0.07 0.53 -0.02 0.00 -1.03 0.00 0.00 54.13 53.54 2kai s LEU 105 Cb -0.07 -2.16 0.02 0.00 0.03 0.00 0.00 46.19 44.01 2kai s LEU 105 CO -0.09 0.37 -0.06 -0.76 0.23 0.00 0.00 176.35 176.04 2kai s LEU 106 N -0.89 3.14 -0.48 1.79 1.02 -1.26 -5.09 118.68 116.92 2kai s LEU 106 Ca 0.16 -0.79 -0.24 0.00 0.02 0.00 0.00 54.13 53.28 2kai s LEU 106 Cb -0.13 -1.68 0.03 0.00 0.02 0.00 0.00 46.19 44.44 2kai s LEU 106 CO 0.05 -0.11 0.88 -0.60 0.02 0.00 0.00 176.35 176.59 2kai s ARG 107 N 1.35 3.43 0.20 1.70 3.52 -1.26 -5.01 118.95 122.89 2kai s ARG 107 Ca 0.01 -0.04 -0.32 0.00 -0.13 0.00 0.00 55.73 55.25 2kai s ARG 107 Cb -0.16 -3.96 -0.15 0.00 -1.56 0.00 0.00 34.95 29.12 2kai s ARG 107 CO -0.04 -1.25 1.27 1.28 -0.81 0.00 0.00 175.30 175.75 2kai n LEU 108 N 7.07 2.22 -0.30 -0.88 4.77 -1.26 -4.91 117.00 123.71 2kai n LEU 108 Ca 0.04 1.14 -0.01 0.00 -0.03 0.00 0.00 56.01 57.15 2kai n LEU 108 Cb 0.48 -1.31 0.03 0.00 -2.33 0.00 0.00 43.42 40.29 2kai n LEU 108 CO 0.62 -0.95 0.46 1.67 -1.33 0.00 0.00 177.39 177.86 2kai n GLN 109 N 1.88 -0.19 -4.01 3.23 7.27 -1.26 -4.54 117.38 119.76 2kai n GLN 109 Ca 0.13 1.21 -0.10 0.00 0.07 0.00 0.00 57.00 58.32 2kai n GLN 109 Cb 0.28 -1.79 -0.11 0.00 2.41 0.00 0.00 30.24 31.02 2kai n GLN 109 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2kai s SER 110 N -5.28 0.42 0.69 1.69 0.15 -1.26 -5.15 113.70 104.95 2kai s SER 110 Ca -0.11 -0.56 -0.16 0.00 0.70 0.00 0.00 55.95 55.82 2kai s SER 110 Cb 0.16 0.09 0.01 0.00 -1.71 0.00 0.00 66.02 64.58 2kai s SER 110 CO 0.56 -0.31 1.22 -2.16 1.20 0.00 0.00 173.24 173.75 2kai s PRO 111 N -1.73 2.40 0.56 5.44 0.04 -1.26 -5.00 135.00 135.44 2kai s PRO 111 Ca -0.12 1.80 -0.17 0.00 0.04 0.00 0.00 61.00 62.55 2kai s PRO 111 Cb -0.08 -1.86 -0.05 0.00 0.04 0.00 0.00 34.50 32.55 2kai s PRO 111 CO -0.01 -1.65 1.06 0.00 0.04 0.00 0.00 177.00 176.44 2kai s ALA 112 N -1.83 2.76 -0.53 8.56 0.00 -1.26 -5.01 121.76 124.45 2kai s ALA 112 Ca 0.76 0.51 -0.16 0.00 0.00 0.00 0.00 51.96 53.06 2kai s ALA 112 Cb -0.30 -3.26 0.11 0.00 0.00 0.00 0.00 23.12 19.67 2kai s ALA 112 CO 0.42 -0.69 0.52 0.21 0.00 0.00 0.00 175.76 176.22 2kai s LYS 113 N -3.75 3.00 -0.08 0.00 2.20 -1.26 -5.01 119.74 114.84 2kai s LYS 113 Ca 0.66 -1.54 -0.29 0.00 -0.36 0.00 0.00 55.97 54.44 2kai s LYS 113 Cb -0.17 -4.25 -0.07 0.00 -1.51 0.00 0.00 37.83 31.82 2kai s LYS 113 CO 0.31 -1.30 2.08 0.42 -0.36 0.00 0.00 175.35 176.50 2kai s ILE 114 N 1.83 3.01 0.00 5.43 -1.09 -1.26 -4.74 121.20 124.38 2kai s ILE 114 Ca 0.05 0.01 0.00 0.00 -2.23 0.00 0.00 60.65 58.48 2kai s ILE 114 Cb -0.27 -3.01 0.00 0.00 -1.58 0.00 0.00 42.46 37.59 2kai s ILE 114 CO 0.05 -0.00 0.00 0.35 -1.23 0.00 0.00 174.94 174.10 2kai n THR 115 N 6.52 0.00 0.85 2.92 -2.24 -0.47 -4.95 114.28 116.91 2kai n THR 115 Ca 0.24 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 62.16 2kai n THR 115 Cb 0.43 0.00 0.53 0.00 -2.10 0.00 0.00 70.33 69.19 2kai n THR 115 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2kai n ASP 116 N -1.17 0.33 -0.01 3.42 10.43 -1.26 -3.32 116.55 124.98 2kai n ASP 116 Ca 0.00 0.53 0.08 0.00 2.57 0.00 0.00 54.79 57.97 2kai n ASP 116 Cb 0.00 -0.62 -0.11 0.00 1.84 0.00 0.00 41.12 42.23 2kai n ASP 116 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2kai n ALA 117 N -1.62 2.81 -3.83 2.24 0.00 -1.26 -4.85 120.51 114.00 2kai n ALA 117 Ca 0.06 -0.37 -0.30 0.00 0.00 0.00 0.00 53.44 52.83 2kai n ALA 117 Cb 0.38 -0.53 -0.14 0.00 0.00 0.00 0.00 19.45 19.16 2kai n ALA 117 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2kai s VAL 118 N -2.94 1.66 0.31 0.00 1.01 -1.21 -5.09 120.40 114.13 2kai s VAL 118 Ca -0.04 -2.31 0.11 0.00 0.00 0.00 0.00 61.98 59.74 2kai s VAL 118 Cb 0.10 -2.20 -0.06 0.00 0.00 0.00 0.00 36.38 34.23 2kai s VAL 118 CO 0.63 -0.75 -0.13 -0.54 0.00 0.00 0.00 175.10 174.31 2kai s LYS 119 N 0.72 1.81 -0.04 2.72 1.02 -1.26 -1.37 119.74 123.34 2kai s LYS 119 Ca 0.14 -1.81 -0.12 0.00 0.02 0.00 0.00 55.97 54.19 2kai s LYS 119 Cb -0.21 -1.78 -0.05 0.00 -0.52 0.00 0.00 37.83 35.26 2kai s LYS 119 CO -0.09 0.24 0.33 0.08 -0.92 0.00 0.00 175.35 174.99 2kai s VAL 120 N -2.54 5.18 -0.25 3.17 1.01 -1.26 -5.07 120.40 120.64 2kai s VAL 120 Ca 0.31 0.65 -0.15 0.00 0.00 0.00 0.00 61.98 62.79 2kai s VAL 120 Cb -0.02 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 2kai s VAL 120 CO 0.16 0.59 0.40 -0.22 0.00 0.00 0.00 175.10 176.03 2kai s LEU 121 N -1.03 4.07 0.23 3.92 0.20 -1.26 -5.06 118.68 119.75 2kai s LEU 121 Ca 0.21 0.38 -0.24 0.00 0.69 0.00 0.00 54.13 55.17 2kai s LEU 121 Cb -0.15 -2.48 -0.09 0.00 -0.43 0.00 0.00 46.19 43.04 2kai s LEU 121 CO 0.10 -0.16 0.81 -1.61 -0.29 0.00 0.00 176.35 175.20 2kai s GLU 122 N 1.86 4.48 0.62 1.98 2.02 -1.26 -5.02 118.70 123.39 2kai s GLU 122 Ca 0.17 1.12 -0.19 0.00 0.02 0.00 0.00 54.97 56.09 2kai s GLU 122 Cb -0.15 -3.01 -0.03 0.00 0.10 0.00 0.00 34.13 31.04 2kai s GLU 122 CO 0.09 0.43 1.22 1.28 0.02 0.00 0.00 175.26 178.30 2kai n LEU 123 N 1.02 5.38 -4.76 1.80 4.32 -1.26 -4.42 117.00 119.08 2kai n LEU 123 Ca -0.02 0.84 -0.36 0.00 -0.02 0.00 0.00 56.01 56.45 2kai n LEU 123 Cb 0.50 -1.52 0.01 0.00 -1.62 0.00 0.00 43.42 40.80 2kai n LEU 123 CO 0.45 -1.16 0.81 -2.16 -1.22 0.00 0.00 177.39 174.11 2kai s PRO 124 N -3.15 3.22 0.00 3.23 0.04 -1.23 -4.89 135.00 132.22 2kai s PRO 124 Ca 0.80 1.72 0.00 0.00 0.04 0.00 0.00 61.00 63.56 2kai s PRO 124 Cb -0.40 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.14 2kai s PRO 124 CO 0.43 -0.98 0.00 0.25 0.04 0.00 0.00 177.00 176.74 2kai n THR 125 N -1.36 0.00 -4.76 1.26 -2.24 -1.26 -4.93 114.28 101.00 2kai n THR 125 Ca 0.12 -0.33 -0.26 0.00 -2.27 0.00 0.00 64.05 61.31 2kai n THR 125 Cb 0.50 0.88 -0.15 0.00 -2.10 0.00 0.00 70.33 69.46 2kai n THR 125 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2kai s GLN 127 N -1.02 1.46 0.41 -0.78 -0.21 -1.26 -5.13 119.66 113.13 2kai s GLN 127 Ca 0.00 -0.86 -0.25 0.00 0.02 0.00 0.00 55.36 54.27 2kai s GLN 127 Cb 0.00 -1.52 -0.08 0.00 1.00 0.00 0.00 33.01 32.41 2kai s GLN 127 CO 0.00 0.40 1.20 -2.00 -2.12 0.00 0.00 175.29 172.77 2kai s GLU 128 N -0.93 3.98 0.58 2.91 2.56 -1.26 -4.97 118.70 121.57 2kai s GLU 128 Ca 0.07 1.92 -0.13 0.00 0.00 0.00 0.00 54.97 56.83 2kai s GLU 128 Cb -0.08 -2.66 -0.06 0.00 2.00 0.00 0.00 34.13 33.33 2kai s GLU 128 CO 0.01 -0.40 1.01 -1.25 -0.56 0.00 0.00 175.26 174.07 2kai s PRO 129 N -2.34 3.74 0.08 4.30 0.04 -1.26 -5.04 135.00 134.53 2kai s PRO 129 Ca 0.58 0.84 -0.27 0.00 0.04 0.00 0.00 61.00 62.19 2kai s PRO 129 Cb -0.32 -2.10 -0.06 0.00 0.04 0.00 0.00 34.50 32.05 2kai s PRO 129 CO 0.41 -0.45 0.83 -1.21 0.04 0.00 0.00 177.00 176.62 2kai s GLU 130 N -4.71 4.57 0.47 4.56 2.02 -1.26 -5.01 118.70 119.34 2kai s GLU 130 Ca 0.57 1.20 -0.24 0.00 0.02 0.00 0.00 54.97 56.52 2kai s GLU 130 Cb -0.11 -3.35 -0.07 0.00 0.10 0.00 0.00 34.13 30.70 2kai s GLU 130 CO 0.44 0.30 1.32 -0.51 0.02 0.00 0.00 175.26 176.84 2kai s LEU 132 N -0.18 4.03 0.00 1.80 1.43 -1.26 -1.11 118.68 123.39 2kai s LEU 132 Ca 0.41 2.69 0.00 0.00 -1.03 0.00 0.00 54.13 56.20 2kai s LEU 132 Cb -0.22 -4.10 0.00 0.00 0.03 0.00 0.00 46.19 41.90 2kai s LEU 132 CO 0.25 -1.19 0.00 0.61 0.23 0.00 0.00 176.35 176.26 2kai n GLY 133 N 0.63 1.39 3.62 -3.19 0.00 0.14 -5.00 105.19 102.78 2kai n GLY 133 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 2kai n GLY 133 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2kai n SER 134 N 0.00 0.38 -4.47 1.61 7.64 -0.27 -4.71 113.62 113.80 2kai n SER 134 Ca 0.00 0.59 -0.43 0.00 1.01 0.00 0.00 58.87 60.04 2kai n SER 134 Cb 0.00 -1.42 -0.08 0.00 -1.01 0.00 0.00 64.21 61.70 2kai n SER 134 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2kai s THR 135 N -2.02 5.07 0.34 0.44 2.01 -1.26 -1.02 115.64 119.20 2kai s THR 135 Ca 0.71 -0.45 0.04 0.00 0.31 0.00 0.00 61.69 62.30 2kai s THR 135 Cb -0.31 -4.09 -0.02 0.00 0.01 0.00 0.00 72.50 68.10 2kai s THR 135 CO 0.53 -0.50 0.51 0.00 -0.69 0.00 0.00 174.62 174.46 2kai s GLU 137 N -4.25 2.51 0.15 0.00 2.12 0.41 0.36 118.70 120.01 2kai s GLU 137 Ca 0.43 -0.76 0.05 0.00 0.36 0.00 0.00 54.97 55.05 2kai s GLU 137 Cb -0.10 -1.99 -0.04 0.00 0.26 0.00 0.00 34.13 32.26 2kai s GLU 137 CO 0.33 0.20 0.13 0.00 -0.54 0.00 0.00 175.26 175.38 2kai s ALA 138 N 0.26 3.57 0.19 6.30 0.00 0.24 -1.46 121.76 130.86 2kai s ALA 138 Ca -0.13 -1.18 -0.01 0.00 0.00 0.00 0.00 51.96 50.64 2kai s ALA 138 Cb -0.16 -1.38 -0.04 0.00 0.00 0.00 0.00 23.12 21.54 2kai s ALA 138 CO 0.06 0.54 0.12 -1.54 0.00 0.00 0.00 175.76 174.94 2kai s SER 139 N -3.00 0.22 0.00 0.00 1.04 -1.26 -0.90 113.70 109.82 2kai s SER 139 Ca 0.31 -1.36 0.00 0.00 0.48 0.00 0.00 55.95 55.37 2kai s SER 139 Cb -0.10 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.37 2kai s SER 139 CO 0.23 -0.82 0.00 0.61 0.98 0.00 0.00 173.24 174.24 2kai n GLY 140 N -0.25 1.80 0.89 7.32 0.00 -0.62 -4.66 105.19 109.66 2kai n GLY 140 Ca 0.01 -1.55 0.08 0.00 0.00 0.00 0.00 46.02 44.56 2kai n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2kai n TRP 141 N -1.58 0.59 -0.91 1.61 8.01 -1.26 -2.20 117.44 121.69 2kai n TRP 141 Ca 0.00 -0.44 -0.28 0.00 -1.31 0.00 0.00 57.50 55.47 2kai n TRP 141 Cb 0.00 -0.01 0.22 0.00 -2.01 0.00 0.00 31.31 29.50 2kai n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 2kai s GLY 142 N -1.04 1.55 0.03 6.99 0.00 -1.24 -4.01 107.32 109.59 2kai s GLY 142 Ca 0.32 -0.37 -0.39 0.00 0.00 0.00 0.00 44.72 44.29 2kai s GLY 142 CO 0.23 0.33 1.06 -1.26 0.00 0.00 0.00 173.10 173.45 2kai n SER 143 N -4.57 0.09 -0.53 1.64 2.88 0.20 -4.47 113.62 108.86 2kai n SER 143 Ca 0.05 1.15 0.10 0.00 -1.33 0.00 0.00 58.87 58.84 2kai n SER 143 Cb 0.57 -0.95 0.36 0.00 -0.75 0.00 0.00 64.21 63.43 2kai n SER 143 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 2kai n ILE 144 N 1.49 0.22 -5.25 2.46 -5.35 0.65 -4.68 119.36 108.90 2kai n ILE 144 Ca 0.20 -0.34 -0.31 0.00 -0.27 0.00 0.00 62.75 62.03 2kai n ILE 144 Cb 0.11 0.32 -0.16 0.00 -1.74 0.00 0.00 39.64 38.17 2kai n ILE 144 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2kai s GLU 145 N -1.78 2.06 0.56 6.28 0.41 -1.25 -4.94 118.70 120.03 2kai s GLU 145 Ca 0.31 -0.95 0.24 0.00 -0.41 0.00 0.00 54.97 54.16 2kai s GLU 145 Cb 0.17 -2.02 1.60 0.00 -1.78 0.00 0.00 34.13 32.10 2kai s GLU 145 CO 0.25 0.55 2.21 -1.35 -0.49 0.00 0.00 175.26 176.43 2kai h PRO 146 N 5.40 0.00 0.00 0.39 0.11 -1.82 -3.42 132.00 132.66 2kai h PRO 146 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2kai h PRO 146 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2kai h PRO 146 CO 0.47 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.67 2kai n GLY 147 N -1.40 -1.21 1.14 -0.55 0.00 -1.26 -1.76 105.19 100.15 2kai n GLY 147 Ca -0.03 -1.25 -0.01 0.00 0.00 0.00 0.00 46.02 44.74 2kai n GLY 147 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2kai n PRO 147 N -0.05 1.03 -1.06 1.61 -0.04 -1.26 -4.69 135.00 130.54 2kai n PRO 147 Ca 0.00 -0.07 -0.17 0.00 -0.04 0.00 0.00 63.50 63.23 2kai n PRO 147 Cb 0.00 -1.03 -0.16 0.00 -0.04 0.00 0.00 33.50 32.28 2kai n PRO 147 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2kai n ASP 148 N 0.69 -0.94 -4.83 3.54 10.43 -1.26 -5.11 116.55 119.08 2kai n ASP 148 Ca 0.01 -0.34 -0.33 0.00 2.57 0.00 0.00 54.79 56.70 2kai n ASP 148 Cb 0.52 -0.40 -0.06 0.00 1.84 0.00 0.00 41.12 43.02 2kai n ASP 148 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 2kai s PHE 149 N 0.54 3.34 -0.13 1.24 0.08 -1.26 -4.62 117.98 117.16 2kai s PHE 149 Ca 0.93 1.55 -0.04 0.00 0.12 0.00 0.00 56.93 59.49 2kai s PHE 149 Cb -0.62 -2.82 0.07 0.00 -0.57 0.00 0.00 43.02 39.08 2kai s PHE 149 CO 0.40 -0.15 0.22 -2.00 -0.10 0.00 0.00 175.22 173.59 2kai s GLU 150 N -3.34 0.12 -0.24 0.44 2.12 -1.26 -4.95 118.70 111.58 2kai s GLU 150 Ca 0.61 0.55 -0.13 0.00 0.36 0.00 0.00 54.97 56.36 2kai s GLU 150 Cb -0.09 -0.41 -0.04 0.00 0.26 0.00 0.00 34.13 33.85 2kai s GLU 150 CO 0.17 -0.39 0.27 -0.06 -0.54 0.00 0.00 175.26 174.71 2kai s PHE 151 N 2.35 3.30 0.68 5.30 0.08 -1.26 -0.25 117.98 128.18 2kai s PHE 151 Ca 0.03 0.34 -0.11 0.00 0.12 0.00 0.00 56.93 57.31 2kai s PHE 151 Cb -0.13 -2.41 -0.00 0.00 -0.57 0.00 0.00 43.02 39.90 2kai s PHE 151 CO -0.08 -0.05 1.05 -1.25 -0.10 0.00 0.00 175.22 174.79 2kai s PRO 152 N 1.45 3.11 -0.16 0.24 0.04 -1.26 -4.98 135.00 133.45 2kai s PRO 152 Ca 0.12 0.83 -0.20 0.00 0.04 0.00 0.00 61.00 61.78 2kai s PRO 152 Cb -0.15 -2.02 -0.23 0.00 0.04 0.00 0.00 34.50 32.14 2kai s PRO 152 CO 0.08 -0.94 0.43 -0.44 0.04 0.00 0.00 177.00 176.17 2kai h ASP 153 N -0.60 0.14 -3.27 6.66 3.45 -1.98 -3.46 116.42 117.36 2kai h ASP 153 Ca -0.44 -0.73 -0.58 0.00 0.43 0.00 0.00 57.03 55.71 2kai h ASP 153 Cb 1.21 -0.05 -0.07 0.00 -0.56 0.00 0.00 39.33 39.87 2kai h ASP 153 CO 0.59 1.46 -0.11 -1.83 -1.57 0.00 0.00 179.24 177.78 2kai s GLU 154 N -2.38 4.26 -0.16 3.56 1.03 -1.26 -5.01 118.70 118.75 2kai s GLU 154 Ca -0.24 0.54 -0.32 0.00 0.03 0.00 0.00 54.97 54.99 2kai s GLU 154 Cb 0.04 -3.37 -0.09 0.00 -0.80 0.00 0.00 34.13 29.91 2kai s GLU 154 CO 0.67 0.31 2.06 1.51 -1.33 0.00 0.00 175.26 178.49 2kai n ILE 155 N 3.05 0.47 -3.45 1.83 3.06 -1.26 -4.94 119.36 118.12 2kai n ILE 155 Ca -0.08 -0.25 -0.31 0.00 -2.50 0.00 0.00 62.75 59.60 2kai n ILE 155 Cb 0.52 -2.13 -0.05 0.00 0.54 0.00 0.00 39.64 38.51 2kai n ILE 155 CO 0.00 0.00 0.00 -1.10 -2.50 0.00 0.00 176.55 172.95 2kai s GLN 156 N 5.26 3.75 -0.04 9.51 1.11 -0.94 -4.90 119.66 133.42 2kai s GLN 156 Ca 0.98 0.18 0.04 0.00 0.01 0.00 0.00 55.36 56.56 2kai s GLN 156 Cb -0.56 -2.68 -0.00 0.00 -1.01 0.00 0.00 33.01 28.75 2kai s GLN 156 CO 0.44 0.33 -0.15 0.00 0.01 0.00 0.00 175.29 175.93 2kai s VAL 158 N 0.08 1.96 -0.23 0.00 0.11 -0.07 -4.99 120.40 117.26 2kai s VAL 158 Ca -0.03 -2.00 -0.01 0.00 -2.93 0.00 0.00 61.98 57.01 2kai s VAL 158 Cb -0.11 -1.94 0.02 0.00 -1.53 0.00 0.00 36.38 32.82 2kai s VAL 158 CO 0.02 -0.31 -0.10 -1.58 -3.33 0.00 0.00 175.10 169.80 2kai s GLN 159 N -2.89 2.89 0.43 1.54 0.74 -1.26 -0.60 119.66 120.52 2kai s GLN 159 Ca 0.18 -0.92 0.07 0.00 0.05 0.00 0.00 55.36 54.74 2kai s GLN 159 Cb -0.06 -2.87 -0.04 0.00 1.10 0.00 0.00 33.01 31.14 2kai s GLN 159 CO 0.08 -0.34 0.20 -0.51 -0.55 0.00 0.00 175.29 174.17 2kai s LEU 160 N 1.32 3.07 -0.08 3.68 1.43 0.16 -4.91 118.68 123.34 2kai s LEU 160 Ca 0.01 -1.10 0.03 0.00 -1.03 0.00 0.00 54.13 52.05 2kai s LEU 160 Cb -0.16 -1.42 -0.02 0.00 0.03 0.00 0.00 46.19 44.62 2kai s LEU 160 CO -0.07 -0.60 -0.17 -0.89 0.23 0.00 0.00 176.35 174.85 2kai s THR 161 N -2.62 2.73 -0.77 5.49 2.01 -0.16 -0.54 115.64 121.79 2kai s THR 161 Ca 0.39 -0.81 -0.26 0.00 0.31 0.00 0.00 61.69 61.32 2kai s THR 161 Cb 0.03 -2.08 0.02 0.00 0.01 0.00 0.00 72.50 70.49 2kai s THR 161 CO 0.22 0.56 1.43 -0.22 -0.69 0.00 0.00 174.62 175.92 2kai s LEU 162 N -0.19 3.23 0.59 4.42 2.96 -0.19 -0.52 118.68 128.98 2kai s LEU 162 Ca -0.01 -0.49 -0.07 0.00 -0.22 0.00 0.00 54.13 53.34 2kai s LEU 162 Cb -0.13 -2.56 -0.00 0.00 0.50 0.00 0.00 46.19 44.00 2kai s LEU 162 CO 0.03 -1.91 0.92 -0.76 -1.32 0.00 0.00 176.35 173.31 2kai s LEU 163 N 6.32 3.25 0.03 -0.68 1.43 0.06 0.23 118.68 129.33 2kai s LEU 163 Ca 0.43 0.85 -0.29 0.00 -1.03 0.00 0.00 54.13 54.10 2kai s LEU 163 Cb -0.07 -3.71 -0.04 0.00 0.03 0.00 0.00 46.19 42.39 2kai s LEU 163 CO 0.11 -1.01 0.91 0.00 0.23 0.00 0.00 176.35 176.60 2kai s GLN 164 N -5.01 4.58 0.27 1.70 -2.07 -1.26 -4.17 119.66 113.69 2kai s GLN 164 Ca 0.53 1.32 0.23 0.00 -1.82 0.00 0.00 55.36 55.62 2kai s GLN 164 Cb -0.11 -3.42 0.86 0.00 -1.09 0.00 0.00 33.01 29.25 2kai s GLN 164 CO 0.47 0.08 0.81 0.09 -1.32 0.00 0.00 175.29 175.42 2kai n ASN 165 N 3.43 0.04 0.01 12.60 5.03 -1.26 -0.66 115.26 134.44 2kai n ASN 165 Ca 0.03 0.59 0.20 0.00 0.87 0.00 0.00 54.58 56.28 2kai n ASN 165 Cb 0.50 -0.30 0.69 0.00 -1.02 0.00 0.00 39.78 39.66 2kai n ASN 165 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2kai h THR 166 N 0.00 0.73 0.00 3.41 1.03 -1.96 -1.13 112.91 114.99 2kai h THR 166 Ca 0.48 0.00 -0.01 0.00 -0.01 0.00 0.00 66.41 66.87 2kai h THR 166 Cb 1.79 0.74 -0.00 0.00 -1.07 0.00 0.00 68.15 69.61 2kai h THR 166 CO -0.09 0.00 -0.03 -0.26 -0.01 0.00 0.00 175.52 175.12 2kai h PHE 167 N 0.00 0.00 -0.09 0.00 -1.00 -1.26 -1.98 116.94 112.60 2kai h PHE 167 Ca 0.25 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.03 2kai h PHE 167 Cb 1.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.56 2kai h PHE 167 CO 0.00 0.03 0.00 0.00 -1.61 0.00 0.00 178.31 176.73 2kai h ALA 169 N 3.95 -0.00 0.00 0.00 0.00 -1.09 -3.46 119.26 118.67 2kai h ALA 169 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2kai h ALA 169 Cb 0.85 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2kai h ALA 169 CO 0.00 -0.27 0.00 -3.47 0.00 0.00 0.00 179.25 175.51 2kai n ASP 170 N -4.87 0.00 0.07 0.00 4.64 -1.26 -2.18 116.55 112.95 2kai n ASP 170 Ca -0.08 0.00 -0.22 0.00 -1.38 0.00 0.00 54.79 53.10 2kai n ASP 170 Cb 0.24 0.00 -0.15 0.00 -1.04 0.00 0.00 41.12 40.17 2kai n ASP 170 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2kai h ALA 171 N 0.00 0.03 0.00 -1.67 0.00 -1.95 -3.50 119.26 112.18 2kai h ALA 171 Ca 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 54.91 53.95 2kai h ALA 171 Cb 0.00 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2kai h ALA 171 CO 0.00 0.74 0.00 0.72 0.00 0.00 0.00 179.25 180.71 2kai n HIS 172 N -3.83 0.00 0.80 0.00 8.25 -0.93 -4.95 115.22 114.56 2kai n HIS 172 Ca -0.21 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.25 2kai n HIS 172 Cb 0.98 -0.78 0.00 0.00 1.12 0.00 0.00 29.99 31.31 2kai n HIS 172 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2kai n PRO 173 N -1.04 0.40 -3.38 -0.41 -0.04 -1.26 -4.45 135.00 124.82 2kai n PRO 173 Ca 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 2kai n PRO 173 Cb 0.38 -1.00 -0.09 0.00 -0.04 0.00 0.00 33.50 32.75 2kai n PRO 173 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 2kai s ASP 174 N -1.58 0.48 0.02 3.54 1.47 -1.26 -4.95 116.67 114.39 2kai s ASP 174 Ca 0.00 0.11 -0.30 0.00 1.18 0.00 0.00 52.55 53.54 2kai s ASP 174 Cb 0.00 0.97 -0.04 0.00 -0.34 0.00 0.00 42.92 43.51 2kai s ASP 174 CO 0.00 -0.31 1.14 -0.75 0.68 0.00 0.00 175.17 175.93 2kai s LYS 175 N 2.50 4.45 -0.63 2.11 2.20 -1.26 -4.97 119.74 124.14 2kai s LYS 175 Ca 0.11 1.65 -0.09 0.00 -0.36 0.00 0.00 55.97 57.29 2kai s LYS 175 Cb -0.15 -3.42 0.16 0.00 -1.51 0.00 0.00 37.83 32.91 2kai s LYS 175 CO -0.16 -0.25 0.50 0.54 -0.36 0.00 0.00 175.35 175.63 2kai s VAL 176 N 1.32 4.47 0.64 4.02 0.11 -1.26 -4.68 120.40 125.01 2kai s VAL 176 Ca 0.56 -2.39 -0.03 0.00 -2.93 0.00 0.00 61.98 57.19 2kai s VAL 176 Cb -0.26 -3.87 0.06 0.00 -1.53 0.00 0.00 36.38 30.78 2kai s VAL 176 CO 0.27 -0.89 0.91 0.42 -3.33 0.00 0.00 175.10 172.49 2kai s THR 177 N 0.52 2.43 0.54 5.04 -4.23 -1.26 -4.99 115.64 113.69 2kai s THR 177 Ca 0.13 -0.46 0.31 0.00 -1.18 0.00 0.00 61.69 60.49 2kai s THR 177 Cb -0.20 -2.97 0.48 0.00 1.34 0.00 0.00 72.50 71.16 2kai s THR 177 CO -0.04 0.00 1.90 -0.33 -0.54 0.00 0.00 174.62 175.61 2kai h GLU 178 N -0.32 0.00 -0.59 3.99 5.08 -2.03 1.00 114.58 121.71 2kai h GLU 178 Ca -0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2kai h GLU 178 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 2kai h GLU 178 CO 0.55 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 177.43 2kai n SER 179 N -4.26 1.91 -4.32 1.42 3.41 -1.26 -4.90 113.62 105.62 2kai n SER 179 Ca 0.18 -2.16 -0.29 0.00 -0.26 0.00 0.00 58.87 56.33 2kai n SER 179 Cb 0.93 -0.38 -0.15 0.00 -0.26 0.00 0.00 64.21 64.36 2kai n SER 179 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2kai s MET 180 N -1.61 1.76 0.26 4.33 -1.94 0.34 -0.88 119.30 121.56 2kai s MET 180 Ca 0.16 -1.06 -0.04 0.00 -1.71 0.00 0.00 55.69 53.05 2kai s MET 180 Cb 0.11 -1.90 -0.05 0.00 2.01 0.00 0.00 34.83 35.00 2kai s MET 180 CO 0.07 0.49 0.51 -0.51 -0.01 0.00 0.00 175.02 175.57 2kai s LEU 181 N -1.15 4.11 -0.27 -0.03 1.43 0.26 -4.76 118.68 118.26 2kai s LEU 181 Ca 0.11 0.63 -0.05 0.00 -1.03 0.00 0.00 54.13 53.78 2kai s LEU 181 Cb -0.10 -3.43 0.00 0.00 0.03 0.00 0.00 46.19 42.70 2kai s LEU 181 CO 0.02 -0.15 0.03 0.00 0.23 0.00 0.00 176.35 176.48 2kai s ALA 183 N 1.48 0.56 -0.04 0.00 0.00 -0.79 -0.76 121.76 122.21 2kai s ALA 183 Ca 0.03 -0.39 -0.17 0.00 0.00 0.00 0.00 51.96 51.43 2kai s ALA 183 Cb -0.16 -0.10 0.06 0.00 0.00 0.00 0.00 23.12 22.91 2kai s ALA 183 CO 0.00 0.11 0.77 0.41 0.00 0.00 0.00 175.76 177.05 2kai n GLY 184 N 2.61 0.28 2.90 0.00 0.00 0.32 -1.94 105.19 109.36 2kai n GLY 184 Ca -0.15 -0.93 -0.30 0.00 0.00 0.00 0.00 46.02 44.63 2kai n GLY 184 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2kai s TYR 184 N -2.18 2.75 0.36 1.61 6.04 -1.26 -0.98 117.35 123.68 2kai s TYR 184 Ca 0.18 -2.31 0.06 0.00 0.04 0.00 0.00 57.07 55.05 2kai s TYR 184 Cb -0.00 -2.23 0.74 0.00 -1.04 0.00 0.00 41.96 39.43 2kai s TYR 184 CO -0.01 -0.89 1.94 -0.07 -1.54 0.00 0.00 175.55 174.97 2kai h LEU 185 N 7.85 0.68 -1.38 6.97 3.38 -1.93 -2.80 115.31 128.08 2kai h LEU 185 Ca -0.10 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2kai h LEU 185 Cb 1.03 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.64 2kai h LEU 185 CO 0.48 0.42 0.00 -0.65 0.09 0.00 0.00 178.44 178.79 2kai h PRO 186 N 0.77 0.00 0.00 1.13 0.11 -1.96 0.11 132.00 132.16 2kai h PRO 186 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 2kai h PRO 186 Cb 0.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.45 2kai h PRO 186 CO -0.12 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.08 2kai n GLY 187 N -0.78 1.18 0.00 -0.55 0.00 -1.06 -4.66 105.19 99.32 2kai n GLY 187 Ca -0.00 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.28 2kai n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kai n GLY 188 N 1.19 1.19 2.82 -0.02 0.00 -1.05 -4.93 105.19 104.39 2kai n GLY 188 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2kai n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kai s LYS 188 N -0.15 1.07 0.36 1.61 1.02 -1.26 -4.99 119.74 117.39 2kai s LYS 188 Ca 0.00 -0.83 -0.14 0.00 0.02 0.00 0.00 55.97 55.02 2kai s LYS 188 Cb 0.00 -2.31 0.04 0.00 -0.52 0.00 0.00 37.83 35.04 2kai s LYS 188 CO 0.00 -0.71 0.72 0.34 -0.92 0.00 0.00 175.35 174.78 2kai s ASP 189 N 1.60 0.13 0.34 2.83 3.68 -1.26 -4.13 116.67 119.85 2kai s ASP 189 Ca -0.00 -1.14 0.07 0.00 2.13 0.00 0.00 52.55 53.61 2kai s ASP 189 Cb -0.18 0.80 -0.02 0.00 -1.45 0.00 0.00 42.92 42.07 2kai s ASP 189 CO -0.11 -1.57 0.38 0.42 0.13 0.00 0.00 175.17 174.42 2kai s THR 190 N -2.68 3.73 0.38 1.71 -4.23 -1.26 -4.96 115.64 108.33 2kai s THR 190 Ca 0.18 -1.20 -0.12 0.00 -1.18 0.00 0.00 61.69 59.36 2kai s THR 190 Cb -0.04 -3.27 0.04 0.00 1.34 0.00 0.00 72.50 70.57 2kai s THR 190 CO 0.12 -0.16 0.72 0.00 -0.54 0.00 0.00 174.62 174.77 2kai n MET 192 N -0.54 0.84 0.00 0.00 2.81 -1.26 -0.08 117.12 118.89 2kai n MET 192 Ca -0.06 0.27 0.00 0.00 -1.81 0.00 0.00 57.70 56.09 2kai n MET 192 Cb 0.60 -2.10 0.00 0.00 -0.71 0.00 0.00 33.22 31.01 2kai n MET 192 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2kai n GLY 193 N 5.84 1.39 0.00 3.03 0.00 -1.26 -0.63 105.19 113.56 2kai n GLY 193 Ca 0.39 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.52 2kai n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2kai n ASP 194 N 0.00 0.61 -4.59 1.61 10.43 0.88 -3.72 116.55 121.78 2kai n ASP 194 Ca 0.00 -0.40 -0.48 0.00 2.57 0.00 0.00 54.79 56.48 2kai n ASP 194 Cb 0.00 0.43 -0.04 0.00 1.84 0.00 0.00 41.12 43.35 2kai n ASP 194 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 2kai n SER 195 N -1.53 1.46 0.00 -2.24 7.64 -1.26 -1.29 113.62 116.39 2kai n SER 195 Ca 0.05 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.08 2kai n SER 195 Cb 0.34 -1.24 0.00 0.00 -1.01 0.00 0.00 64.21 62.30 2kai n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kai n GLY 196 N 1.95 1.12 3.78 0.23 0.00 -0.43 -4.93 105.19 106.91 2kai n GLY 196 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 2kai n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2kai s GLY 197 N -1.75 2.07 0.46 -0.02 0.00 -0.42 -4.74 107.32 102.92 2kai s GLY 197 Ca 0.00 0.46 -0.23 0.00 0.00 0.00 0.00 44.72 44.95 2kai s GLY 197 CO 0.00 0.80 1.20 2.56 0.00 0.00 0.00 173.10 177.66 2kai s PRO 198 N -4.23 3.74 -0.44 2.90 0.04 -1.26 -1.82 135.00 133.93 2kai s PRO 198 Ca 0.65 1.87 -0.01 0.00 0.04 0.00 0.00 61.00 63.55 2kai s PRO 198 Cb -0.19 -2.45 0.12 0.00 0.04 0.00 0.00 34.50 32.02 2kai s PRO 198 CO 0.43 -0.59 0.23 -1.17 0.04 0.00 0.00 177.00 175.93 2kai s LEU 199 N -2.97 5.13 -0.31 -3.56 0.20 0.11 -3.99 118.68 113.29 2kai s LEU 199 Ca 0.63 -2.26 -0.10 0.00 0.69 0.00 0.00 54.13 53.09 2kai s LEU 199 Cb -0.31 -1.79 -0.01 0.00 -0.43 0.00 0.00 46.19 43.65 2kai s LEU 199 CO 0.38 -0.47 0.16 -0.63 -0.29 0.00 0.00 176.35 175.50 2kai s ILE 200 N 0.80 4.71 -0.16 6.68 1.01 -0.53 -0.65 121.20 133.06 2kai s ILE 200 Ca 0.11 -0.36 -0.05 0.00 0.00 0.00 0.00 60.65 60.35 2kai s ILE 200 Cb -0.22 -3.39 -0.03 0.00 0.01 0.00 0.00 42.46 38.83 2kai s ILE 200 CO -0.04 0.07 -0.01 0.00 0.00 0.00 0.00 174.94 174.96 2kai n ASN 202 N 3.50 -3.57 0.00 0.00 5.15 -1.16 -0.74 115.26 118.44 2kai n ASN 202 Ca -0.17 -0.93 0.00 0.00 -0.60 0.00 0.00 54.58 52.88 2kai n ASN 202 Cb 0.52 -3.21 0.00 0.00 -0.53 0.00 0.00 39.78 36.57 2kai n ASN 202 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2kai n GLY 203 N -1.55 2.89 3.38 8.20 0.00 -1.26 -5.03 105.19 111.82 2kai n GLY 203 Ca 0.03 -0.33 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 2kai n GLY 203 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2kai s MET 208 N 0.00 3.43 -0.16 1.61 0.00 0.08 -5.07 119.30 119.20 2kai s MET 208 Ca 0.00 -0.64 -0.29 0.00 0.00 0.00 0.00 55.69 54.76 2kai s MET 208 Cb 0.00 -2.77 -0.04 0.00 0.00 0.00 0.00 34.83 32.02 2kai s MET 208 CO 0.00 0.12 1.73 -0.46 0.00 0.00 0.00 175.02 176.41 2kai s TRP 209 N 0.62 1.89 -0.00 4.11 -0.00 -1.26 -0.81 118.94 123.48 2kai s TRP 209 Ca -0.06 0.37 0.01 0.00 -0.00 0.00 0.00 56.10 56.42 2kai s TRP 209 Cb -0.15 -3.99 -0.02 0.00 -0.00 0.00 0.00 33.47 29.31 2kai s TRP 209 CO 0.03 -3.53 0.02 0.94 -0.00 0.00 0.00 176.95 174.40 2kai n GLN 210 N 7.66 0.99 -4.10 5.86 -0.06 0.18 -3.54 117.38 124.38 2kai n GLN 210 Ca 0.20 -0.01 -0.12 0.00 -2.00 0.00 0.00 57.00 55.07 2kai n GLN 210 Cb 0.44 -1.03 -0.06 0.00 -4.06 0.00 0.00 30.24 25.53 2kai n GLN 210 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 2kai s GLY 211 N -2.38 1.20 -0.05 1.69 0.00 -0.78 -2.02 107.32 104.98 2kai s GLY 211 Ca -0.00 -1.39 0.00 0.00 0.00 0.00 0.00 44.72 43.33 2kai s GLY 211 CO 0.04 -1.02 -0.03 -0.42 0.00 0.00 0.00 173.10 171.67 2kai s ILE 212 N -3.73 0.51 0.09 0.90 1.01 -0.96 -0.71 121.20 118.31 2kai s ILE 212 Ca 0.31 -0.07 -0.31 0.00 0.00 0.00 0.00 60.65 60.58 2kai s ILE 212 Cb 0.02 -0.57 -0.10 0.00 0.01 0.00 0.00 42.46 41.82 2kai s ILE 212 CO 0.14 0.24 1.88 -0.89 0.00 0.00 0.00 174.94 176.31 2kai s THR 213 N 1.19 2.69 0.00 2.92 2.01 -0.76 -0.18 115.64 123.51 2kai s THR 213 Ca -0.07 0.03 0.00 0.00 0.31 0.00 0.00 61.69 61.96 2kai s THR 213 Cb -0.14 -3.02 0.00 0.00 0.01 0.00 0.00 72.50 69.35 2kai s THR 213 CO -0.01 -0.00 0.00 -0.24 -0.69 0.00 0.00 174.62 173.67 2kai n SER 214 N 6.34 0.00 -4.37 3.53 2.88 -1.22 -1.32 113.62 119.47 2kai n SER 214 Ca 0.19 0.00 -0.18 0.00 -1.33 0.00 0.00 58.87 57.54 2kai n SER 214 Cb 0.39 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.75 2kai n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2kai s TRP 215 N 0.00 1.69 0.00 0.66 1.48 -1.20 -4.84 118.94 116.73 2kai s TRP 215 Ca 0.00 -0.98 0.00 0.00 -1.06 0.00 0.00 56.10 54.06 2kai s TRP 215 Cb 0.00 -1.02 0.00 0.00 -1.16 0.00 0.00 33.47 31.29 2kai s TRP 215 CO 0.00 -0.07 0.00 0.41 -4.06 0.00 0.00 176.95 173.23 2kai n GLY 216 N -0.51 2.78 3.65 3.67 0.00 -1.26 -1.15 105.19 112.36 2kai n GLY 216 Ca -0.03 -0.23 -0.33 0.00 0.00 0.00 0.00 46.02 45.42 2kai n GLY 216 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2kai s HIS 217 N -0.32 3.04 -0.13 1.61 2.46 -1.26 -5.03 115.29 115.66 2kai s HIS 217 Ca 0.00 0.08 0.02 0.00 0.47 0.00 0.00 55.06 55.63 2kai s HIS 217 Cb 0.00 -1.70 -0.00 0.00 -0.13 0.00 0.00 32.58 30.74 2kai s HIS 217 CO 0.00 0.42 -0.19 -0.08 -2.47 0.00 0.00 174.74 172.43 2kai s THR 218 N -0.95 2.48 0.22 0.89 -1.32 -1.26 -3.14 115.64 112.55 2kai s THR 218 Ca 0.16 -0.86 -0.30 0.00 -1.21 0.00 0.00 61.69 59.48 2kai s THR 218 Cb -0.11 -2.01 -0.09 0.00 -1.51 0.00 0.00 72.50 68.78 2kai s THR 218 CO 0.06 0.54 1.40 -2.16 -2.21 0.00 0.00 174.62 172.24 2kai s PRO 219 N 0.54 4.31 0.14 7.08 0.04 -1.26 -4.91 135.00 140.93 2kai s PRO 219 Ca -0.12 2.20 -0.31 0.00 0.04 0.00 0.00 61.00 62.81 2kai s PRO 219 Cb -0.16 -3.15 -0.10 0.00 0.04 0.00 0.00 34.50 31.12 2kai s PRO 219 CO 0.04 -0.37 1.77 0.00 0.04 0.00 0.00 177.00 178.48 2kai n GLY 221 N 4.13 0.85 3.77 0.00 0.00 -1.26 -4.46 105.19 108.21 2kai n GLY 221 Ca 0.17 -0.61 -0.39 0.00 0.00 0.00 0.00 46.02 45.18 2kai n GLY 221 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kai s SER 221 N -2.78 6.88 0.29 1.61 0.01 -1.18 -2.52 113.70 116.00 2kai s SER 221 Ca 0.00 2.38 -0.29 0.00 1.31 0.00 0.00 55.95 59.34 2kai s SER 221 Cb 0.00 -2.63 -0.10 0.00 0.21 0.00 0.00 66.02 63.50 2kai s SER 221 CO 0.00 -0.43 1.35 0.00 0.41 0.00 0.00 173.24 174.57 2kai s ALA 222 N -1.27 3.54 -1.43 1.44 0.00 -1.26 -1.73 121.76 121.04 2kai s ALA 222 Ca 0.50 1.26 -0.02 0.00 0.00 0.00 0.00 51.96 53.70 2kai s ALA 222 Cb -0.33 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.29 2kai s ALA 222 CO 0.42 -0.66 0.32 0.09 0.00 0.00 0.00 175.76 175.93 2kai n ASN 223 N 1.46 -5.44 -3.52 0.00 4.13 0.37 -4.95 115.26 107.31 2kai n ASN 223 Ca 0.03 -0.16 -0.27 0.00 1.68 0.00 0.00 54.58 55.86 2kai n ASN 223 Cb 0.41 -4.37 -0.10 0.00 -1.54 0.00 0.00 39.78 34.19 2kai n ASN 223 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2kai n LYS 224 N -3.26 1.28 -0.64 3.52 4.76 -0.71 -5.06 118.16 118.06 2kai n LYS 224 Ca -0.15 -3.91 -0.31 0.00 -2.87 0.00 0.00 58.31 51.08 2kai n LYS 224 Cb 0.63 -1.90 0.19 0.00 -1.84 0.00 0.00 35.03 32.10 2kai n LYS 224 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2kai n PRO 225 N 1.88 -0.88 -4.13 1.97 -0.04 -1.26 -4.57 135.00 127.97 2kai n PRO 225 Ca 0.25 -0.20 -0.24 0.00 -0.04 0.00 0.00 63.50 63.27 2kai n PRO 225 Cb 0.43 -2.31 -0.05 0.00 -0.04 0.00 0.00 33.50 31.53 2kai n PRO 225 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2kai s SER 226 N -2.56 5.33 -0.25 3.54 0.01 -0.82 -4.62 113.70 114.34 2kai s SER 226 Ca 0.67 -0.26 -0.09 0.00 1.31 0.00 0.00 55.95 57.58 2kai s SER 226 Cb -0.23 -1.32 -0.04 0.00 0.21 0.00 0.00 66.02 64.64 2kai s SER 226 CO 0.60 0.02 0.12 -0.63 0.41 0.00 0.00 173.24 173.76 2kai s ILE 227 N -1.95 4.84 -0.06 1.44 1.09 -0.30 -1.88 121.20 124.37 2kai s ILE 227 Ca 0.31 0.01 -0.02 0.00 -1.10 0.00 0.00 60.65 59.84 2kai s ILE 227 Cb -0.09 -3.27 -0.04 0.00 -1.06 0.00 0.00 42.46 38.01 2kai s ILE 227 CO 0.23 0.33 0.06 -0.31 -0.10 0.00 0.00 174.94 175.14 2kai s TYR 228 N 1.42 3.29 0.11 3.97 2.02 0.90 -3.28 117.35 125.79 2kai s TYR 228 Ca 0.06 0.27 -0.31 0.00 -0.37 0.00 0.00 57.07 56.72 2kai s TYR 228 Cb -0.15 -1.80 -0.09 0.00 -0.40 0.00 0.00 41.96 39.52 2kai s TYR 228 CO 0.06 0.55 1.55 0.99 -1.57 0.00 0.00 175.55 177.13 2kai s THR 229 N -1.02 2.98 -0.87 -0.71 2.01 0.74 0.89 115.64 119.67 2kai s THR 229 Ca 0.17 0.61 -0.25 0.00 0.31 0.00 0.00 61.69 62.53 2kai s THR 229 Cb -0.12 -3.39 0.04 0.00 0.01 0.00 0.00 72.50 69.04 2kai s THR 229 CO 0.07 0.03 1.34 -0.75 -0.69 0.00 0.00 174.62 174.61 2kai s LYS 230 N 1.73 3.38 0.30 4.92 2.20 -0.06 -2.25 119.74 129.94 2kai s LYS 230 Ca 0.70 -0.69 0.05 0.00 -0.36 0.00 0.00 55.97 55.66 2kai s LYS 230 Cb -0.40 -4.73 0.74 0.00 -1.51 0.00 0.00 37.83 31.94 2kai s LYS 230 CO 0.31 -2.15 1.73 1.25 -0.36 0.00 0.00 175.35 176.12 2kai h LEU 231 N 12.79 0.53 -0.86 5.43 5.85 -1.72 -1.97 115.31 135.36 2kai h LEU 231 Ca -0.06 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2kai h LEU 231 Cb 1.03 0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.12 2kai h LEU 231 CO 1.34 0.10 0.00 0.00 -0.34 0.00 0.00 178.44 179.54 2kai n ILE 232 N -4.93 0.86 0.19 4.05 3.06 -1.26 -0.99 119.36 120.33 2kai n ILE 232 Ca 0.23 0.32 0.06 0.00 -2.50 0.00 0.00 62.75 60.86 2kai n ILE 232 Cb 0.63 -1.27 0.30 0.00 0.54 0.00 0.00 39.64 39.84 2kai n ILE 232 CO 0.00 0.00 0.00 0.15 -2.50 0.00 0.00 176.55 174.20 2kai h PHE 233 N 0.00 0.00 -0.41 9.51 3.57 -1.73 -3.26 116.94 124.62 2kai h PHE 233 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2kai h PHE 233 Cb 0.30 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.04 2kai h PHE 233 CO 0.00 0.36 0.00 0.66 -2.23 0.00 0.00 178.31 177.10 2kai n TYR 234 N -3.43 0.54 -0.28 0.41 4.01 -0.16 -4.59 117.16 113.65 2kai n TYR 234 Ca 0.00 -0.38 0.09 0.00 -0.16 0.00 0.00 57.90 57.46 2kai n TYR 234 Cb 0.54 -0.01 0.23 0.00 -0.31 0.00 0.00 39.34 39.78 2kai n TYR 234 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 2kai h LEU 235 N 3.21 -0.20 0.82 7.72 3.38 -1.58 -1.30 115.31 127.37 2kai h LEU 235 Ca 0.00 0.20 -0.04 0.00 0.09 0.00 0.00 57.88 58.13 2kai h LEU 235 Cb 0.83 0.32 0.01 0.00 0.09 0.00 0.00 40.66 41.91 2kai h LEU 235 CO 0.00 -0.18 -0.40 -0.78 0.09 0.00 0.00 178.44 177.17 2kai h ASP 236 N 0.14 -0.94 -0.72 -0.43 -0.00 -1.87 -1.58 116.42 111.02 2kai h ASP 236 Ca 0.49 0.03 0.16 0.00 -0.00 0.00 0.00 57.03 57.71 2kai h ASP 236 Cb 0.94 0.24 -0.12 0.00 -0.00 0.00 0.00 39.33 40.39 2kai h ASP 236 CO -0.68 -0.58 0.06 -0.25 -0.00 0.00 0.00 179.24 177.79 2kai h TRP 237 N -1.29 0.06 -0.94 0.28 7.01 -1.85 0.96 115.95 120.17 2kai h TRP 237 Ca -0.11 0.05 -0.00 0.00 2.11 0.00 0.00 58.89 60.94 2kai h TRP 237 Cb 0.85 0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 27.95 2kai h TRP 237 CO 0.00 -0.18 0.59 0.82 -2.79 0.00 0.00 178.44 176.88 2kai h ILE 238 N 0.16 1.25 0.13 2.65 2.04 -1.17 0.59 117.51 123.15 2kai h ILE 238 Ca 0.40 -0.52 -0.29 0.00 1.00 0.00 0.00 64.86 65.44 2kai h ILE 238 Cb 0.69 -0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.67 2kai h ILE 238 CO -0.59 0.26 -1.41 0.44 0.00 0.00 0.00 178.15 176.85 2kai h ASP 239 N 1.29 0.43 -0.56 1.72 3.45 -0.15 -1.99 116.42 120.61 2kai h ASP 239 Ca 0.34 -0.52 -0.05 0.00 0.43 0.00 0.00 57.03 57.23 2kai h ASP 239 Cb -0.09 -0.14 -0.03 0.00 -0.56 0.00 0.00 39.33 38.52 2kai h ASP 239 CO -0.07 1.42 0.18 0.44 -1.57 0.00 0.00 179.24 179.65 2kai h ASP 240 N 0.07 0.85 -0.47 6.45 3.45 -0.65 -1.51 116.42 124.62 2kai h ASP 240 Ca -0.20 -0.14 -0.13 0.00 0.43 0.00 0.00 57.03 56.99 2kai h ASP 240 Cb 2.01 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 40.54 2kai h ASP 240 CO 0.18 0.81 -0.21 0.74 -1.57 0.00 0.00 179.24 179.19 2kai h THR 241 N 0.89 1.27 0.00 0.35 2.02 -0.88 0.25 112.91 116.80 2kai h THR 241 Ca 0.20 -1.38 0.00 0.00 0.77 0.00 0.00 66.41 66.00 2kai h THR 241 Cb 0.27 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 2kai h THR 241 CO -0.01 0.47 0.00 -0.38 0.37 0.00 0.00 175.52 175.98 2kai n ILE 242 N -4.13 0.83 -0.03 3.11 5.41 -0.75 -3.35 119.36 120.45 2kai n ILE 242 Ca -0.00 0.21 -0.03 0.00 1.00 0.00 0.00 62.75 63.92 2kai n ILE 242 Cb 0.46 -0.94 -0.04 0.00 -0.71 0.00 0.00 39.64 38.40 2kai n ILE 242 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 2kai n THR 243 N -1.45 0.40 1.69 1.39 -1.04 -0.61 -4.41 114.28 110.26 2kai n THR 243 Ca 0.05 -0.22 0.06 0.00 -2.04 0.00 0.00 64.05 61.89 2kai n THR 243 Cb 0.17 -0.83 0.28 0.00 -1.82 0.00 0.00 70.33 68.14 2kai n THR 243 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2kai n GLU 244 N -2.33 1.25 -1.20 -2.82 1.02 0.80 -4.69 120.64 112.67 2kai n GLU 244 Ca -0.10 -0.38 0.00 0.00 -0.02 0.00 0.00 57.16 56.66 2kai n GLU 244 Cb 0.67 -1.21 0.00 0.00 -0.02 0.00 0.00 31.44 30.88 2kai n GLU 244 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2kai n ASN 245 N -0.30 1.70 0.00 1.62 4.13 -1.21 -5.07 115.26 116.13 2kai n ASN 245 Ca 0.09 -0.65 0.10 0.00 1.68 0.00 0.00 54.58 55.81 2kai n ASN 245 Cb 0.12 0.00 0.61 0.00 -1.54 0.00 0.00 39.78 38.97 2kai n ASN 245 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73