#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kd2 s PRO 87 N 0.00 4.32 -0.09 1.61 0.04 -1.26 -4.93 135.00 134.69 2kd2 s PRO 87 Ca 0.00 2.03 -0.07 0.00 0.04 0.00 0.00 61.00 63.00 2kd2 s PRO 87 Cb 0.00 -3.34 -0.04 0.00 0.04 0.00 0.00 34.50 31.16 2kd2 s PRO 87 CO 0.00 -0.46 -0.16 1.28 0.04 0.00 0.00 177.00 177.70 2kd2 n LEU 88 N 4.30 1.11 0.00 -3.56 4.77 -1.26 -5.13 117.00 117.23 2kd2 n LEU 88 Ca 0.12 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 2kd2 n LEU 88 Cb 0.43 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2kd2 n LEU 88 CO 0.58 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 2kd2 n GLY 89 N 2.34 3.62 3.72 -0.72 0.00 -1.26 -5.10 105.19 107.80 2kd2 n GLY 89 Ca -0.18 -0.74 -0.41 0.00 0.00 0.00 0.00 46.02 44.68 2kd2 n GLY 89 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2kd2 n SER 90 N 0.00 2.93 -4.81 1.61 7.64 -1.26 -5.01 113.62 114.71 2kd2 n SER 90 Ca 0.00 1.17 -0.25 0.00 1.01 0.00 0.00 58.87 60.80 2kd2 n SER 90 Cb 0.00 -1.53 -0.05 0.00 -1.01 0.00 0.00 64.21 61.63 2kd2 n SER 90 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2kd2 s GLU 91 N -2.09 2.29 0.21 1.43 2.56 -1.26 -5.15 118.70 116.70 2kd2 s GLU 91 Ca 0.57 -1.88 0.07 0.00 0.00 0.00 0.00 54.97 53.73 2kd2 s GLU 91 Cb -0.52 -2.05 -0.04 0.00 2.00 0.00 0.00 34.13 33.52 2kd2 s GLU 91 CO 0.61 -0.29 0.13 -0.80 -0.56 0.00 0.00 175.26 174.34 2kd2 s ASN 92 N -4.05 5.33 -0.54 -1.70 0.01 -1.26 -5.09 114.94 107.64 2kd2 s ASN 92 Ca 0.38 -0.27 0.04 0.00 -0.71 0.00 0.00 52.86 52.30 2kd2 s ASN 92 Cb 0.01 -1.31 0.16 0.00 0.41 0.00 0.00 41.25 40.52 2kd2 s ASN 92 CO 0.22 0.02 0.39 -0.60 -1.51 0.00 0.00 177.10 175.61 2kd2 s ARG 93 N -3.46 1.62 -0.11 -0.60 6.06 -1.26 -5.08 118.95 116.12 2kd2 s ARG 93 Ca 0.31 -2.62 -0.21 0.00 -2.50 0.00 0.00 55.73 50.72 2kd2 s ARG 93 Cb -0.09 -2.40 0.05 0.00 0.06 0.00 0.00 34.95 32.57 2kd2 s ARG 93 CO 0.23 -1.31 0.52 0.45 -2.50 0.00 0.00 175.30 172.69 2kd2 s SER 94 N -0.54 -0.50 -0.62 -2.12 0.15 -1.26 -5.11 113.70 103.70 2kd2 s SER 94 Ca 0.27 0.73 0.04 0.00 0.70 0.00 0.00 55.95 57.70 2kd2 s SER 94 Cb -0.04 0.75 0.16 0.00 -1.71 0.00 0.00 66.02 65.18 2kd2 s SER 94 CO -0.15 -0.37 0.41 -0.54 1.20 0.00 0.00 173.24 173.79 2kd2 s LYS 95 N -0.52 2.18 0.36 5.44 1.02 -1.26 -5.09 119.74 121.86 2kd2 s LYS 95 Ca -0.06 -3.01 -0.27 0.00 0.02 0.00 0.00 55.97 52.64 2kd2 s LYS 95 Cb -0.03 -3.21 -0.09 0.00 -0.52 0.00 0.00 37.83 33.98 2kd2 s LYS 95 CO 0.04 -1.24 1.24 0.99 -0.92 0.00 0.00 175.35 175.46 2kd2 s THR 96 N -0.96 2.92 -0.28 2.17 2.01 -1.26 -5.01 115.64 115.22 2kd2 s THR 96 Ca 0.23 0.86 -0.14 0.00 0.31 0.00 0.00 61.69 62.95 2kd2 s THR 96 Cb -0.11 -3.52 0.09 0.00 0.01 0.00 0.00 72.50 68.97 2kd2 s THR 96 CO -0.12 0.16 0.67 0.42 -0.69 0.00 0.00 174.62 175.06 2kd2 s THR 97 N -1.24 -0.22 0.15 -0.82 -4.23 -1.26 -2.64 115.64 105.38 2kd2 s THR 97 Ca 0.52 0.01 0.05 0.00 -1.18 0.00 0.00 61.69 61.09 2kd2 s THR 97 Cb -0.36 -0.98 -0.04 0.00 1.34 0.00 0.00 72.50 72.46 2kd2 s THR 97 CO 0.46 0.00 0.11 -0.44 -0.54 0.00 0.00 174.62 174.21 2kd2 s SER 98 N 1.90 5.41 0.05 3.99 0.01 -0.75 -4.95 113.70 119.37 2kd2 s SER 98 Ca -0.09 -0.14 -0.03 0.00 1.31 0.00 0.00 55.95 56.99 2kd2 s SER 98 Cb -0.07 -1.39 -0.02 0.00 0.21 0.00 0.00 66.02 64.75 2kd2 s SER 98 CO -0.19 0.09 0.04 0.42 0.41 0.00 0.00 173.24 174.01 2kd2 s THR 99 N -1.68 0.16 -0.17 1.44 -4.23 -1.26 -0.24 115.64 109.67 2kd2 s THR 99 Ca 0.30 -1.34 -0.09 0.00 -1.18 0.00 0.00 61.69 59.38 2kd2 s THR 99 Cb -0.10 -1.08 0.06 0.00 1.34 0.00 0.00 72.50 72.72 2kd2 s THR 99 CO 0.22 -0.74 0.41 0.26 -0.54 0.00 0.00 174.62 174.23 2kd2 s TRP 100 N -3.05 -0.59 -0.28 3.99 0.51 1.00 -2.09 118.94 118.42 2kd2 s TRP 100 Ca -0.01 1.27 -0.05 0.00 -2.12 0.00 0.00 56.10 55.19 2kd2 s TRP 100 Cb 0.02 0.26 0.01 0.00 -0.81 0.00 0.00 33.47 32.95 2kd2 s TRP 100 CO -0.07 -0.33 0.04 0.08 -0.51 0.00 0.00 176.95 176.16 2kd2 s VAL 101 N 1.33 3.66 0.01 4.03 1.01 -1.26 -0.25 120.40 128.92 2kd2 s VAL 101 Ca -0.09 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.07 2kd2 s VAL 101 Cb -0.08 -2.89 -0.01 0.00 0.00 0.00 0.00 36.38 33.40 2kd2 s VAL 101 CO -0.12 0.10 0.03 -1.48 0.00 0.00 0.00 175.10 173.64 2kd2 s LEU 102 N 1.45 1.96 -0.88 3.92 2.34 -0.58 -4.92 118.68 121.96 2kd2 s LEU 102 Ca 0.02 -0.31 -0.25 0.00 0.06 0.00 0.00 54.13 53.65 2kd2 s LEU 102 Cb -0.17 0.29 0.00 0.00 -0.56 0.00 0.00 46.19 45.75 2kd2 s LEU 102 CO 0.01 -0.28 1.67 -0.13 -1.06 0.00 0.00 176.35 176.56 2kd2 s ARG 103 N -1.20 3.01 0.15 1.48 0.52 -1.26 0.07 118.95 121.72 2kd2 s ARG 103 Ca -0.13 -0.44 0.10 0.00 -0.52 0.00 0.00 55.73 54.74 2kd2 s ARG 103 Cb -0.08 -4.95 -0.04 0.00 0.52 0.00 0.00 34.95 30.40 2kd2 s ARG 103 CO -0.00 -2.71 -0.24 -1.17 0.02 0.00 0.00 175.30 171.20 2kd2 s LEU 104 N 7.57 2.37 -0.86 2.53 0.20 0.11 -4.65 118.68 125.95 2kd2 s LEU 104 Ca 0.56 -0.79 0.00 0.00 0.69 0.00 0.00 54.13 54.60 2kd2 s LEU 104 Cb -0.05 -1.08 0.00 0.00 -0.43 0.00 0.00 46.19 44.63 2kd2 s LEU 104 CO 0.01 0.11 0.00 -0.67 -0.29 0.00 0.00 176.35 175.51 2kd2 n ASP 105 N 0.66 -5.11 0.00 3.68 -0.08 -1.26 -1.26 116.55 113.18 2kd2 n ASP 105 Ca -0.16 0.20 0.00 0.00 -1.51 0.00 0.00 54.79 53.32 2kd2 n ASP 105 Cb 0.55 -3.32 0.00 0.00 2.34 0.00 0.00 41.12 40.68 2kd2 n ASP 105 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2kd2 n GLY 106 N -0.48 0.77 3.23 0.27 0.00 -1.26 -5.02 105.19 102.70 2kd2 n GLY 106 Ca -0.08 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.80 2kd2 n GLY 106 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kd2 s GLU 107 N -0.45 1.37 -0.90 1.61 2.02 -0.39 -5.07 118.70 116.90 2kd2 s GLU 107 Ca 0.00 -1.75 -0.25 0.00 0.02 0.00 0.00 54.97 52.99 2kd2 s GLU 107 Cb 0.00 0.27 -0.06 0.00 0.10 0.00 0.00 34.13 34.44 2kd2 s GLU 107 CO 0.00 -0.46 2.00 0.16 0.02 0.00 0.00 175.26 176.98 2kd2 s ASP 108 N -3.23 4.98 -0.02 -0.19 -4.77 -1.26 0.06 116.67 112.25 2kd2 s ASP 108 Ca 0.39 -0.62 -0.30 0.00 -3.30 0.00 0.00 52.55 48.72 2kd2 s ASP 108 Cb 0.06 -2.56 -0.03 0.00 -1.09 0.00 0.00 42.92 39.30 2kd2 s ASP 108 CO 0.17 -2.90 1.03 -0.22 0.70 0.00 0.00 175.17 173.95 2kd2 s LEU 109 N 10.70 4.33 -0.25 2.11 2.96 0.11 -4.89 118.68 133.76 2kd2 s LEU 109 Ca 0.73 1.69 -0.07 0.00 -0.22 0.00 0.00 54.13 56.25 2kd2 s LEU 109 Cb -0.07 -3.57 -0.02 0.00 0.50 0.00 0.00 46.19 43.03 2kd2 s LEU 109 CO 0.01 -0.35 0.06 -0.60 -1.32 0.00 0.00 176.35 174.14 2kd2 s ARG 110 N 1.34 3.60 -0.04 1.98 3.52 -1.26 -1.52 118.95 126.56 2kd2 s ARG 110 Ca 0.52 -0.51 -0.00 0.00 -0.13 0.00 0.00 55.73 55.61 2kd2 s ARG 110 Cb -0.22 -3.30 -0.03 0.00 -1.56 0.00 0.00 34.95 29.84 2kd2 s ARG 110 CO 0.25 -0.21 0.01 0.08 -0.81 0.00 0.00 175.30 174.63 2kd2 s VAL 111 N 1.60 4.28 0.03 7.11 1.01 0.65 -2.96 120.40 132.11 2kd2 s VAL 111 Ca 0.06 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.64 2kd2 s VAL 111 Cb -0.15 -2.86 -0.02 0.00 0.00 0.00 0.00 36.38 33.35 2kd2 s VAL 111 CO 0.03 0.48 -0.07 -0.69 0.00 0.00 0.00 175.10 174.85 2kd2 s VAL 112 N -1.00 0.52 -0.31 2.92 1.01 -0.31 -0.00 120.40 123.23 2kd2 s VAL 112 Ca 0.17 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.35 2kd2 s VAL 112 Cb -0.11 -0.54 0.10 0.00 0.00 0.00 0.00 36.38 35.82 2kd2 s VAL 112 CO 0.07 -0.21 0.07 -0.22 0.00 0.00 0.00 175.10 174.81 2kd2 s LEU 113 N -1.11 2.89 -0.14 3.92 2.96 0.67 -0.04 118.68 127.83 2kd2 s LEU 113 Ca -0.06 -1.70 -0.29 0.00 -0.22 0.00 0.00 54.13 51.85 2kd2 s LEU 113 Cb -0.07 -1.08 -0.01 0.00 0.50 0.00 0.00 46.19 45.52 2kd2 s LEU 113 CO 0.00 -0.39 1.11 -0.70 -1.32 0.00 0.00 176.35 175.05 2kd2 s GLU 114 N 1.42 4.32 0.37 1.98 2.12 -0.90 -1.81 118.70 126.21 2kd2 s GLU 114 Ca 0.08 1.49 0.26 0.00 0.36 0.00 0.00 54.97 57.17 2kd2 s GLU 114 Cb -0.18 -3.62 1.33 0.00 0.26 0.00 0.00 34.13 31.92 2kd2 s GLU 114 CO -0.19 -0.51 1.81 1.57 -0.54 0.00 0.00 175.26 177.40 2kd2 h LYS 115 N 7.49 0.00 -0.08 4.30 5.09 -1.84 0.32 116.57 131.85 2kd2 h LYS 115 Ca -0.27 0.00 0.04 0.00 0.09 0.00 0.00 60.65 60.51 2kd2 h LYS 115 Cb 1.12 0.00 -0.06 0.00 0.10 0.00 0.00 32.23 33.39 2kd2 h LYS 115 CO 0.92 0.00 -0.36 -0.44 -2.09 0.00 0.00 179.45 177.48 2kd2 h ASP 116 N 0.00 -1.11 0.00 7.07 5.19 -1.90 -3.32 116.42 122.34 2kd2 h ASP 116 Ca 0.00 0.15 0.00 0.00 -0.62 0.00 0.00 57.03 56.56 2kd2 h ASP 116 Cb 0.14 0.46 0.00 0.00 0.18 0.00 0.00 39.33 40.10 2kd2 h ASP 116 CO 0.00 -0.40 -0.24 0.35 -3.12 0.00 0.00 179.24 175.83 2kd2 n THR 117 N -5.43 0.50 -1.95 0.35 -2.24 -1.15 -4.98 114.28 99.38 2kd2 n THR 117 Ca -0.04 -0.58 -0.19 0.00 -2.27 0.00 0.00 64.05 60.97 2kd2 n THR 117 Cb 0.34 0.45 -0.05 0.00 -2.10 0.00 0.00 70.33 68.97 2kd2 n THR 117 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2kd2 n MET 118 N -0.35 -1.59 -2.59 -0.78 2.81 0.11 -4.94 117.12 109.80 2kd2 n MET 118 Ca 0.03 1.05 -0.37 0.00 -1.81 0.00 0.00 57.70 56.60 2kd2 n MET 118 Cb 0.60 -5.55 -0.05 0.00 -0.71 0.00 0.00 33.22 27.52 2kd2 n MET 118 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2kd2 s ASP 119 N -2.37 6.98 -0.27 7.83 -1.08 -1.18 -4.81 116.67 121.77 2kd2 s ASP 119 Ca 0.00 2.03 -0.08 0.00 -0.52 0.00 0.00 52.55 53.98 2kd2 s ASP 119 Cb 0.00 -2.59 -0.02 0.00 -1.46 0.00 0.00 42.92 38.85 2kd2 s ASP 119 CO 0.00 -0.33 0.11 -0.69 0.52 0.00 0.00 175.17 174.78 2kd2 s VAL 120 N -1.56 4.48 -0.14 1.11 1.01 -1.26 -2.11 120.40 121.93 2kd2 s VAL 120 Ca 0.54 -0.25 -0.10 0.00 0.00 0.00 0.00 61.98 62.16 2kd2 s VAL 120 Cb -0.23 -3.18 -0.05 0.00 0.00 0.00 0.00 36.38 32.93 2kd2 s VAL 120 CO 0.29 0.23 0.20 0.86 0.00 0.00 0.00 175.10 176.68 2kd2 s TRP 121 N 1.62 3.53 -0.28 5.22 -0.00 0.95 -1.75 118.94 128.22 2kd2 s TRP 121 Ca 0.06 0.54 -0.01 0.00 -0.00 0.00 0.00 56.10 56.69 2kd2 s TRP 121 Cb -0.16 -2.14 0.09 0.00 -0.00 0.00 0.00 33.47 31.26 2kd2 s TRP 121 CO 0.05 0.48 0.07 0.00 -0.00 0.00 0.00 176.95 177.55 2kd2 n ASN 123 N 4.84 -5.57 -4.12 0.00 3.02 -1.16 -1.33 115.26 110.94 2kd2 n ASN 123 Ca -0.04 -0.75 -0.34 0.00 -0.03 0.00 0.00 54.58 53.42 2kd2 n ASN 123 Cb 0.43 -2.60 -0.01 0.00 -0.61 0.00 0.00 39.78 36.99 2kd2 n ASN 123 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2kd2 n GLY 124 N -1.69 -0.44 3.02 7.41 0.00 -1.26 -4.94 105.19 107.29 2kd2 n GLY 124 Ca -0.24 0.15 -0.11 0.00 0.00 0.00 0.00 46.02 45.83 2kd2 n GLY 124 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2kd2 s GLN 125 N -6.81 0.28 0.99 1.61 0.74 -0.44 -5.15 119.66 110.87 2kd2 s GLN 125 Ca 0.66 0.70 -0.13 0.00 0.05 0.00 0.00 55.36 56.63 2kd2 s GLN 125 Cb -0.35 -0.22 0.07 0.00 1.10 0.00 0.00 33.01 33.61 2kd2 s GLN 125 CO 0.90 -0.44 0.44 1.63 -0.55 0.00 0.00 175.29 177.27 2kd2 n LYS 126 N 5.36 -0.66 -4.43 1.67 4.01 -1.26 -0.87 118.16 121.98 2kd2 n LYS 126 Ca -0.06 -0.15 -0.21 0.00 -0.51 0.00 0.00 58.31 57.38 2kd2 n LYS 126 Cb 0.50 -1.90 -0.10 0.00 -0.51 0.00 0.00 35.03 33.01 2kd2 n LYS 126 CO 0.00 0.00 0.00 -1.64 -1.11 0.00 0.00 177.40 174.65 2kd2 s MET 127 N -3.75 1.58 -0.29 1.97 -1.94 -0.72 -4.72 119.30 111.42 2kd2 s MET 127 Ca 0.58 -1.83 0.03 0.00 -1.71 0.00 0.00 55.69 52.76 2kd2 s MET 127 Cb -0.20 -1.05 0.07 0.00 2.01 0.00 0.00 34.83 35.66 2kd2 s MET 127 CO 0.66 -0.04 -0.04 -1.21 -0.01 0.00 0.00 175.02 174.38 2kd2 s GLU 128 N -3.78 2.00 0.35 2.03 2.02 -1.26 -4.74 118.70 115.32 2kd2 s GLU 128 Ca 0.31 -1.53 0.02 0.00 0.02 0.00 0.00 54.97 53.80 2kd2 s GLU 128 Cb 0.06 -3.05 0.07 0.00 0.10 0.00 0.00 34.13 31.31 2kd2 s GLU 128 CO 0.13 -0.71 0.49 0.25 0.02 0.00 0.00 175.26 175.43 2kd2 n THR 129 N 4.40 0.00 -0.04 3.63 -2.24 -1.26 -3.88 114.28 114.88 2kd2 n THR 129 Ca -0.08 -0.92 -0.16 0.00 -2.27 0.00 0.00 64.05 60.62 2kd2 n THR 129 Cb 0.42 -0.95 -0.14 0.00 -2.10 0.00 0.00 70.33 67.56 2kd2 n THR 129 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2kd2 n ALA 130 N -2.81 1.24 -2.81 6.98 0.00 -0.36 -4.81 120.51 117.93 2kd2 n ALA 130 Ca -0.08 -0.83 -0.07 0.00 0.00 0.00 0.00 53.44 52.45 2kd2 n ALA 130 Cb 0.32 -0.56 0.02 0.00 0.00 0.00 0.00 19.45 19.23 2kd2 n ALA 130 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kd2 n GLY 131 N 1.88 0.48 3.68 0.00 0.00 -1.26 -4.96 105.19 105.02 2kd2 n GLY 131 Ca -0.30 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 44.92 2kd2 n GLY 131 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kd2 s GLU 132 N -5.35 4.32 -0.16 1.61 2.02 -1.20 -4.99 118.70 114.96 2kd2 s GLU 132 Ca 0.17 0.89 -0.01 0.00 0.02 0.00 0.00 54.97 56.04 2kd2 s GLU 132 Cb -0.08 -3.53 -0.01 0.00 0.10 0.00 0.00 34.13 30.61 2kd2 s GLU 132 CO 0.22 -0.19 -0.10 -0.59 0.02 0.00 0.00 175.26 174.63 2kd2 s PHE 133 N 1.67 2.87 0.57 1.61 -0.71 -1.26 -1.07 117.98 121.67 2kd2 s PHE 133 Ca 0.36 -0.72 0.06 0.00 -1.04 0.00 0.00 56.93 55.60 2kd2 s PHE 133 Cb -0.17 -1.93 0.06 0.00 -1.21 0.00 0.00 43.02 39.77 2kd2 s PHE 133 CO 0.14 -0.30 0.49 0.14 -1.34 0.00 0.00 175.22 174.35 2kd2 s VAL 134 N 0.67 1.61 0.54 -2.49 -7.23 -0.89 -4.99 120.40 107.61 2kd2 s VAL 134 Ca -0.05 -1.40 0.28 0.00 -1.81 0.00 0.00 61.98 58.99 2kd2 s VAL 134 Cb -0.15 -2.01 0.43 0.00 0.56 0.00 0.00 36.38 35.21 2kd2 s VAL 134 CO 0.02 0.00 1.95 0.44 -0.31 0.00 0.00 175.10 177.20 2kd2 h ASP 135 N 0.58 0.00 -1.15 4.85 5.19 -2.05 -3.35 116.42 120.48 2kd2 h ASP 135 Ca -0.35 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 55.98 2kd2 h ASP 135 Cb 1.31 0.00 -0.21 0.00 0.18 0.00 0.00 39.33 40.60 2kd2 h ASP 135 CO 0.53 0.00 -0.47 -1.81 -3.12 0.00 0.00 179.24 174.38 2kd2 s ASP 136 N -5.94 -1.13 0.00 6.45 1.01 -1.26 -5.14 116.67 110.66 2kd2 s ASP 136 Ca -0.05 -0.66 0.00 0.00 0.71 0.00 0.00 52.55 52.56 2kd2 s ASP 136 Cb 0.20 1.77 0.00 0.00 1.01 0.00 0.00 42.92 45.90 2kd2 s ASP 136 CO 0.74 -0.22 0.00 0.61 0.21 0.00 0.00 175.17 176.51 2kd2 n GLY 137 N 4.66 2.34 2.89 0.21 0.00 -1.26 -4.49 105.19 109.54 2kd2 n GLY 137 Ca 0.09 -2.02 -0.19 0.00 0.00 0.00 0.00 46.02 43.91 2kd2 n GLY 137 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kd2 s THR 138 N -1.73 0.47 -0.58 2.61 2.01 -1.23 -2.10 115.64 115.09 2kd2 s THR 138 Ca 0.00 -0.10 -0.11 0.00 0.31 0.00 0.00 61.69 61.79 2kd2 s THR 138 Cb 0.00 -0.50 0.15 0.00 0.01 0.00 0.00 72.50 72.16 2kd2 s THR 138 CO 0.00 0.20 0.48 -1.61 -0.69 0.00 0.00 174.62 173.00 2kd2 s GLU 139 N 0.81 2.82 -0.46 4.92 2.02 -0.23 -2.27 118.70 126.32 2kd2 s GLU 139 Ca -0.10 -2.01 -0.25 0.00 0.02 0.00 0.00 54.97 52.63 2kd2 s GLU 139 Cb -0.13 -4.08 0.03 0.00 0.10 0.00 0.00 34.13 30.05 2kd2 s GLU 139 CO -0.00 -1.24 0.91 0.95 0.02 0.00 0.00 175.26 175.90 2kd2 s THR 140 N 0.96 4.49 -0.38 3.63 -4.23 -1.07 -3.22 115.64 115.82 2kd2 s THR 140 Ca 0.09 0.73 -0.06 0.00 -1.18 0.00 0.00 61.69 61.27 2kd2 s THR 140 Cb -0.23 -4.42 0.07 0.00 1.34 0.00 0.00 72.50 69.26 2kd2 s THR 140 CO -0.02 -0.81 0.17 -1.00 -0.54 0.00 0.00 174.62 172.42 2kd2 s HIS 141 N 3.70 3.35 0.04 3.99 3.76 -1.26 -0.06 115.29 128.80 2kd2 s HIS 141 Ca 0.36 -1.68 0.07 0.00 -0.15 0.00 0.00 55.06 53.67 2kd2 s HIS 141 Cb -0.10 -2.69 -0.02 0.00 1.11 0.00 0.00 32.58 30.87 2kd2 s HIS 141 CO 0.26 -0.83 -0.21 -0.59 -0.85 0.00 0.00 174.74 172.52 2kd2 s PHE 142 N 1.35 1.82 0.07 1.40 -0.12 -1.02 -1.22 117.98 120.26 2kd2 s PHE 142 Ca 0.02 -0.37 -0.16 0.00 -0.05 0.00 0.00 56.93 56.36 2kd2 s PHE 142 Cb -0.21 -1.09 -0.06 0.00 -0.63 0.00 0.00 43.02 41.02 2kd2 s PHE 142 CO 0.01 0.09 0.50 -1.54 -0.05 0.00 0.00 175.22 174.22 2kd2 s SER 143 N -1.15 6.89 -0.25 1.98 1.04 -1.25 -2.70 113.70 118.25 2kd2 s SER 143 Ca 0.07 1.08 -0.04 0.00 0.48 0.00 0.00 55.95 57.54 2kd2 s SER 143 Cb -0.09 -2.29 0.09 0.00 0.10 0.00 0.00 66.02 63.83 2kd2 s SER 143 CO 0.02 0.24 0.11 -0.69 0.98 0.00 0.00 173.24 173.90 2kd2 s VAL 144 N -1.21 0.05 -1.28 5.02 1.01 -1.26 -4.84 120.40 117.90 2kd2 s VAL 144 Ca 0.30 -0.64 -0.02 0.00 0.00 0.00 0.00 61.98 61.62 2kd2 s VAL 144 Cb -0.17 -0.93 0.01 0.00 0.00 0.00 0.00 36.38 35.29 2kd2 s VAL 144 CO 0.17 -0.56 0.14 0.61 0.00 0.00 0.00 175.10 175.46 2kd2 n GLY 145 N 5.21 -0.50 2.41 4.51 0.00 -1.26 -0.09 105.19 115.47 2kd2 n GLY 145 Ca -0.06 0.03 -0.17 0.00 0.00 0.00 0.00 46.02 45.81 2kd2 n GLY 145 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2kd2 n ASN 146 N -2.00 -5.12 0.01 1.61 4.05 -1.26 -4.86 115.26 107.70 2kd2 n ASN 146 Ca -0.14 0.19 0.11 0.00 0.45 0.00 0.00 54.58 55.19 2kd2 n ASN 146 Cb 0.62 -4.18 0.09 0.00 1.23 0.00 0.00 39.78 37.53 2kd2 n ASN 146 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 177.26 175.62 2kd2 n HIS 147 N -3.31 0.12 -2.25 1.20 8.25 0.87 -5.05 115.22 115.05 2kd2 n HIS 147 Ca -0.19 0.04 -0.02 0.00 -0.26 0.00 0.00 57.72 57.28 2kd2 n HIS 147 Cb 0.62 -0.29 -0.02 0.00 1.12 0.00 0.00 29.99 31.42 2kd2 n HIS 147 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2kd2 n ASP 148 N -1.70 -4.29 -4.22 0.41 -0.08 -1.26 -3.51 116.55 101.90 2kd2 n ASP 148 Ca 0.04 1.31 -0.13 0.00 -1.51 0.00 0.00 54.79 54.50 2kd2 n ASP 148 Cb 0.38 -4.47 -0.10 0.00 2.34 0.00 0.00 41.12 39.26 2kd2 n ASP 148 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2kd2 s TYR 150 N -3.96 -0.21 -0.40 0.00 1.13 -0.07 -2.44 117.35 111.41 2kd2 s TYR 150 Ca 0.32 0.48 -0.16 0.00 -1.41 0.00 0.00 57.07 56.31 2kd2 s TYR 150 Cb 0.07 0.45 0.01 0.00 -1.10 0.00 0.00 41.96 41.39 2kd2 s TYR 150 CO 0.08 -0.12 0.35 0.42 -2.51 0.00 0.00 175.55 173.76 2kd2 s ILE 151 N -0.22 5.20 -0.63 -3.49 1.01 0.91 -0.36 121.20 123.61 2kd2 s ILE 151 Ca 0.05 -0.42 -0.28 0.00 0.00 0.00 0.00 60.65 60.01 2kd2 s ILE 151 Cb -0.04 -3.93 0.03 0.00 0.01 0.00 0.00 42.46 38.54 2kd2 s ILE 151 CO -0.10 -0.28 1.22 -0.75 0.00 0.00 0.00 174.94 175.03 2kd2 s LYS 152 N 1.88 3.40 0.02 2.79 2.20 0.11 -2.60 119.74 127.53 2kd2 s LYS 152 Ca 0.08 0.07 -0.03 0.00 -0.36 0.00 0.00 55.97 55.73 2kd2 s LYS 152 Cb -0.18 -4.07 -0.04 0.00 -1.51 0.00 0.00 37.83 32.03 2kd2 s LYS 152 CO 0.11 -1.84 0.22 0.00 -0.36 0.00 0.00 175.35 173.49 2kd2 s ALA 153 N 5.21 3.93 -0.10 3.13 0.00 -0.96 -0.43 121.76 132.54 2kd2 s ALA 153 Ca 0.40 -0.71 -0.04 0.00 0.00 0.00 0.00 51.96 51.61 2kd2 s ALA 153 Cb -0.08 -1.94 0.05 0.00 0.00 0.00 0.00 23.12 21.15 2kd2 s ALA 153 CO 0.22 0.73 0.20 0.08 0.00 0.00 0.00 175.76 176.99 2kd2 s VAL 154 N -1.37 -0.21 -0.14 0.00 1.01 -0.09 -3.47 120.40 116.14 2kd2 s VAL 154 Ca 0.30 0.26 -0.17 0.00 0.00 0.00 0.00 61.98 62.37 2kd2 s VAL 154 Cb -0.13 -0.34 -0.04 0.00 0.00 0.00 0.00 36.38 35.87 2kd2 s VAL 154 CO 0.20 0.11 0.42 -0.94 0.00 0.00 0.00 175.10 174.88 2kd2 s SER 155 N 1.86 6.59 0.10 3.32 1.04 -1.26 -1.35 113.70 124.00 2kd2 s SER 155 Ca -0.03 0.70 0.05 0.00 0.48 0.00 0.00 55.95 57.16 2kd2 s SER 155 Cb -0.12 -2.25 -0.04 0.00 0.10 0.00 0.00 66.02 63.72 2kd2 s SER 155 CO -0.07 0.02 -0.14 -0.94 0.98 0.00 0.00 173.24 173.10 2kd2 s SER 156 N 0.62 1.84 0.00 7.02 1.04 0.16 -4.84 113.70 119.53 2kd2 s SER 156 Ca 0.23 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 55.90 2kd2 s SER 156 Cb -0.14 -0.05 0.00 0.00 0.10 0.00 0.00 66.02 65.92 2kd2 s SER 156 CO 0.08 -0.14 0.00 0.61 0.98 0.00 0.00 173.24 174.77 2kd2 n GLY 157 N 0.74 -2.39 6.93 7.32 0.00 -1.26 -0.99 105.19 115.53 2kd2 n GLY 157 Ca -0.17 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2kd2 n GLY 157 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2kd2 n LYS 158 N 0.00 -0.04 -0.15 1.61 4.81 -1.26 -2.73 118.16 120.41 2kd2 n LYS 158 Ca 0.00 0.02 0.21 0.00 -0.87 0.00 0.00 58.31 57.67 2kd2 n LYS 158 Cb 0.00 -0.04 0.61 0.00 0.02 0.00 0.00 35.03 35.61 2kd2 n LYS 158 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2kd2 h ARG 159 N 0.00 0.20 -0.93 1.64 3.08 -1.98 -3.42 114.38 112.97 2kd2 h ARG 159 Ca 0.00 -0.01 0.19 0.00 0.07 0.00 0.00 59.98 60.22 2kd2 h ARG 159 Cb 0.02 -0.05 -0.27 0.00 0.08 0.00 0.00 29.97 29.75 2kd2 h ARG 159 CO 0.00 0.13 0.43 -1.59 -1.07 0.00 0.00 179.97 177.87 2kd2 s LYS 160 N -5.21 0.21 0.19 0.04 -2.85 -1.21 -4.97 119.74 105.94 2kd2 s LYS 160 Ca -0.07 0.45 0.00 0.00 -1.00 0.00 0.00 55.97 55.35 2kd2 s LYS 160 Cb 0.21 0.19 0.00 0.00 -2.06 0.00 0.00 37.83 36.17 2kd2 s LYS 160 CO 0.76 -0.06 0.00 -1.91 0.10 0.00 0.00 175.35 174.25 2kd2 n GLU 161 N 4.25 0.00 -3.86 1.78 2.13 -1.10 -5.01 120.64 118.82 2kd2 n GLU 161 Ca -0.12 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.40 2kd2 n GLU 161 Cb 0.55 0.00 -0.15 0.00 0.27 0.00 0.00 31.44 32.11 2kd2 n GLU 161 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2kd2 s GLY 162 N -2.21 1.22 -0.14 8.31 0.00 -0.16 -5.02 107.32 109.32 2kd2 s GLY 162 Ca 0.00 -1.49 -0.06 0.00 0.00 0.00 0.00 44.72 43.17 2kd2 s GLY 162 CO 0.00 1.20 0.06 -0.42 0.00 0.00 0.00 173.10 173.94 2kd2 s ILE 163 N 1.46 4.79 -0.07 0.90 1.01 -1.26 -0.67 121.20 127.37 2kd2 s ILE 163 Ca 0.01 -0.05 0.05 0.00 0.00 0.00 0.00 60.65 60.67 2kd2 s ILE 163 Cb -0.18 -3.11 -0.01 0.00 0.01 0.00 0.00 42.46 39.18 2kd2 s ILE 163 CO -0.12 0.53 -0.23 -0.63 0.00 0.00 0.00 174.94 174.49 2kd2 s ILE 164 N -0.26 1.95 -0.09 2.92 1.01 -0.46 -4.96 121.20 121.30 2kd2 s ILE 164 Ca 0.08 -0.99 -0.01 0.00 0.00 0.00 0.00 60.65 59.73 2kd2 s ILE 164 Cb -0.12 -1.67 -0.03 0.00 0.01 0.00 0.00 42.46 40.65 2kd2 s ILE 164 CO 0.02 0.54 -0.04 -1.00 0.00 0.00 0.00 174.94 174.46 2kd2 s HIS 165 N 0.06 3.03 -0.28 3.97 3.76 -1.26 -0.91 115.29 123.66 2kd2 s HIS 165 Ca -0.09 0.02 -0.01 0.00 -0.15 0.00 0.00 55.06 54.83 2kd2 s HIS 165 Cb -0.15 -1.79 0.09 0.00 1.11 0.00 0.00 32.58 31.84 2kd2 s HIS 165 CO 0.05 0.30 0.06 0.95 -0.85 0.00 0.00 174.74 175.25 2kd2 s THR 166 N -0.60 1.01 0.30 1.30 -4.23 0.43 -4.95 115.64 108.91 2kd2 s THR 166 Ca 0.09 -1.27 -0.29 0.00 -1.18 0.00 0.00 61.69 59.05 2kd2 s THR 166 Cb -0.12 -1.63 -0.10 0.00 1.34 0.00 0.00 72.50 71.99 2kd2 s THR 166 CO 0.02 -0.48 1.35 -0.22 -0.54 0.00 0.00 174.62 174.75 2kd2 s LEU 167 N 1.58 4.41 -0.07 4.79 2.96 -1.26 0.06 118.68 131.15 2kd2 s LEU 167 Ca 0.05 2.68 -0.01 0.00 -0.22 0.00 0.00 54.13 56.63 2kd2 s LEU 167 Cb -0.18 -3.64 0.03 0.00 0.50 0.00 0.00 46.19 42.90 2kd2 s LEU 167 CO -0.18 -0.59 0.01 -0.63 -1.32 0.00 0.00 176.35 173.64 2kd2 s ILE 168 N -0.76 0.33 -0.06 6.68 1.01 0.51 -0.51 121.20 128.39 2kd2 s ILE 168 Ca 0.52 0.12 0.05 0.00 0.00 0.00 0.00 60.65 61.35 2kd2 s ILE 168 Cb -0.40 -0.52 -0.01 0.00 0.01 0.00 0.00 42.46 41.54 2kd2 s ILE 168 CO 0.50 0.23 -0.22 -0.69 0.00 0.00 0.00 174.94 174.76 2kd2 s VAL 169 N 1.99 2.31 -1.44 2.92 1.01 -0.56 -0.89 120.40 125.73 2kd2 s VAL 169 Ca 0.05 -0.97 -0.09 0.00 0.00 0.00 0.00 61.98 60.96 2kd2 s VAL 169 Cb -0.12 -1.86 0.06 0.00 0.00 0.00 0.00 36.38 34.45 2kd2 s VAL 169 CO -0.05 0.57 0.71 -0.67 0.00 0.00 0.00 175.10 175.66 2kd2 n ASP 170 N 2.91 -4.87 -3.06 3.32 2.03 -0.45 -1.16 116.55 115.27 2kd2 n ASP 170 Ca -0.17 -0.49 -0.18 0.00 0.52 0.00 0.00 54.79 54.47 2kd2 n ASP 170 Cb 0.52 -3.94 0.07 0.00 -0.72 0.00 0.00 41.12 37.05 2kd2 n ASP 170 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2kd2 n ASN 171 N -2.56 -4.60 -3.76 1.67 5.15 -1.26 -5.02 115.26 104.88 2kd2 n ASN 171 Ca -0.02 -0.47 -0.14 0.00 -0.60 0.00 0.00 54.58 53.35 2kd2 n ASN 171 Cb 0.56 -4.30 -0.15 0.00 -0.53 0.00 0.00 39.78 35.36 2kd2 n ASN 171 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2kd2 s ARG 172 N -5.81 0.02 0.53 1.20 0.52 -0.31 -5.14 118.95 109.95 2kd2 s ARG 172 Ca 0.35 0.26 -0.22 0.00 -0.52 0.00 0.00 55.73 55.59 2kd2 s ARG 172 Cb -0.15 -0.21 -0.05 0.00 0.52 0.00 0.00 34.95 35.05 2kd2 s ARG 172 CO 0.61 -0.16 1.31 -2.00 0.02 0.00 0.00 175.30 175.08 2kd2 s GLU 173 N 1.07 3.28 -0.08 3.54 2.12 -1.26 -1.50 118.70 125.87 2kd2 s GLU 173 Ca -0.09 2.12 0.04 0.00 0.36 0.00 0.00 54.97 57.40 2kd2 s GLU 173 Cb -0.12 -2.29 0.00 0.00 0.26 0.00 0.00 34.13 31.99 2kd2 s GLU 173 CO -0.04 -1.04 -0.20 0.42 -0.54 0.00 0.00 175.26 173.85 2kd2 s ILE 174 N -1.36 1.74 0.23 -3.70 -1.09 0.34 -4.87 121.20 112.49 2kd2 s ILE 174 Ca 0.70 -0.85 -0.30 0.00 -2.23 0.00 0.00 60.65 57.97 2kd2 s ILE 174 Cb -0.37 -1.52 -0.09 0.00 -1.58 0.00 0.00 42.46 38.90 2kd2 s ILE 174 CO 0.44 0.49 1.28 -2.16 -1.23 0.00 0.00 174.94 173.77 2kd2 s PRO 175 N 0.34 4.41 0.32 2.79 0.04 -1.26 -4.31 135.00 137.33 2kd2 s PRO 175 Ca -0.15 2.05 -0.08 0.00 0.04 0.00 0.00 61.00 62.87 2kd2 s PRO 175 Cb -0.16 -3.17 -0.06 0.00 0.04 0.00 0.00 34.50 31.14 2kd2 s PRO 175 CO 0.06 -0.19 0.63 -2.00 0.04 0.00 0.00 177.00 175.54 2kd2 s GLU 176 N -0.53 3.71 0.37 4.56 2.12 -1.26 -4.29 118.70 123.39 2kd2 s GLU 176 Ca 0.54 0.22 0.13 0.00 0.36 0.00 0.00 54.97 56.21 2kd2 s GLU 176 Cb -0.36 -2.55 0.94 0.00 0.26 0.00 0.00 34.13 32.42 2kd2 s GLU 176 CO 0.41 0.14 1.82 1.25 -0.54 0.00 0.00 175.26 178.34 2kd2 h LEU 177 N 1.66 0.56 -9.65 2.70 7.12 -1.82 -3.42 115.31 112.46 2kd2 h LEU 177 Ca -0.47 0.06 -0.58 0.00 0.13 0.00 0.00 57.88 57.02 2kd2 h LEU 177 Cb 1.19 -0.04 0.17 0.00 -0.53 0.00 0.00 40.66 41.44 2kd2 h LEU 177 CO 0.66 0.22 -0.16 0.35 -0.13 0.00 0.00 178.44 179.37 2kd2 n THR 178 N -4.60 2.93 1.32 1.05 -2.24 -1.26 -5.10 114.28 106.38 2kd2 n THR 178 Ca 0.21 -0.50 0.11 0.00 -2.27 0.00 0.00 64.05 61.59 2kd2 n THR 178 Cb 0.65 -0.89 0.63 0.00 -2.10 0.00 0.00 70.33 68.62 2kd2 n THR 178 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50