#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 4.40 0.00 1.61 0.04 -1.26 -4.95 135.00 134.85 2kd2 s PRO 87 Ca 0.00 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.07 2kd2 s PRO 87 Cb 0.00 -3.05 0.00 0.00 0.04 0.00 0.00 34.50 31.49 2kd2 s PRO 87 CO 0.00 -0.08 0.00 -0.11 0.04 0.00 0.00 177.00 176.85 2kd2 n LEU 88 N 0.82 1.08 0.00 -3.56 0.00 -1.26 -5.06 117.00 109.02 2kd2 n LEU 88 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 2kd2 n LEU 88 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.85 2kd2 n LEU 88 CO 0.56 0.13 0.00 0.61 0.00 0.00 0.00 177.39 178.70 2kd2 n GLY 89 N 2.93 3.16 2.40 -3.96 0.00 -1.26 -4.75 105.19 103.71 2kd2 n GLY 89 Ca 0.00 -0.90 -0.17 0.00 0.00 0.00 0.00 46.02 44.95 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 0.93 -4.87 -3.82 1.61 7.64 -1.26 -4.89 113.62 108.97 2kd2 n SER 90 Ca 0.00 0.15 -0.40 0.00 1.01 0.00 0.00 58.87 59.63 2kd2 n SER 90 Cb 0.00 -4.14 -0.00 0.00 -1.01 0.00 0.00 64.21 59.06 2kd2 n SER 90 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2kd2 n GLU 91 N -2.77 4.35 0.00 1.43 1.02 -1.26 -4.70 120.64 118.71 2kd2 n GLU 91 Ca -0.19 -4.61 -0.01 0.00 -0.02 0.00 0.00 57.16 52.33 2kd2 n GLU 91 Cb 0.63 -2.46 -0.00 0.00 -0.02 0.00 0.00 31.44 29.59 2kd2 n GLU 91 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2kd2 n ASN 92 N 0.94 0.48 -4.40 1.62 4.13 -1.26 -5.04 115.26 111.73 2kd2 n ASN 92 Ca 0.30 0.07 -0.33 0.00 1.68 0.00 0.00 54.58 56.30 2kd2 n ASN 92 Cb 0.33 -0.28 -0.14 0.00 -1.54 0.00 0.00 39.78 38.15 2kd2 n ASN 92 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 2kd2 s ARG 93 N -1.45 3.43 0.84 3.52 6.06 -1.26 -5.11 118.95 124.98 2kd2 s ARG 93 Ca -0.03 -0.65 -0.11 0.00 -2.50 0.00 0.00 55.73 52.44 2kd2 s ARG 93 Cb 0.00 -2.68 0.10 0.00 0.06 0.00 0.00 34.95 32.43 2kd2 s ARG 93 CO 0.05 0.23 1.10 -1.12 -2.50 0.00 0.00 175.30 173.06 2kd2 s SER 94 N 0.32 3.82 -0.17 -2.12 0.01 -1.26 -4.98 113.70 109.32 2kd2 s SER 94 Ca -0.09 1.85 -0.24 0.00 1.31 0.00 0.00 55.95 58.78 2kd2 s SER 94 Cb -0.15 -2.47 -0.02 0.00 0.21 0.00 0.00 66.02 63.59 2kd2 s SER 94 CO 0.05 -2.48 0.76 -0.54 0.41 0.00 0.00 173.24 171.44 2kd2 s LYS 95 N -4.83 4.28 -0.15 12.44 -0.14 -1.26 -4.93 119.74 125.14 2kd2 s LYS 95 Ca 0.63 0.88 0.14 0.00 -1.36 0.00 0.00 55.97 56.26 2kd2 s LYS 95 Cb -0.19 -3.56 -0.24 0.00 -1.68 0.00 0.00 37.83 32.16 2kd2 s LYS 95 CO 0.57 -0.27 0.24 0.25 -0.76 0.00 0.00 175.35 175.39 2kd2 n THR 96 N 4.64 1.48 -3.64 2.17 -2.24 -1.26 -4.83 114.28 110.59 2kd2 n THR 96 Ca 0.02 -0.81 -0.06 0.00 -2.27 0.00 0.00 64.05 60.93 2kd2 n THR 96 Cb 0.49 -0.75 -0.07 0.00 -2.10 0.00 0.00 70.33 67.91 2kd2 n THR 96 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2kd2 s THR 97 N -2.53 -0.16 0.13 4.28 -4.23 -1.26 -2.73 115.64 109.13 2kd2 s THR 97 Ca -0.11 0.01 0.04 0.00 -1.18 0.00 0.00 61.69 60.45 2kd2 s THR 97 Cb 0.07 -0.98 -0.04 0.00 1.34 0.00 0.00 72.50 72.89 2kd2 s THR 97 CO 0.81 0.00 0.11 -0.44 -0.54 0.00 0.00 174.62 174.56 2kd2 s SER 98 N 1.84 5.49 -0.11 3.99 0.01 -0.13 -4.96 113.70 119.83 2kd2 s SER 98 Ca -0.09 -0.09 -0.09 0.00 1.31 0.00 0.00 55.95 56.99 2kd2 s SER 98 Cb -0.06 -1.44 0.03 0.00 0.21 0.00 0.00 66.02 64.76 2kd2 s SER 98 CO -0.19 0.11 0.27 -0.89 0.41 0.00 0.00 173.24 172.95 2kd2 s THR 99 N -1.59 -0.01 0.13 1.44 2.01 -1.26 -0.08 115.64 116.28 2kd2 s THR 99 Ca 0.30 0.04 0.05 0.00 0.31 0.00 0.00 61.69 62.39 2kd2 s THR 99 Cb -0.11 -0.39 -0.04 0.00 0.01 0.00 0.00 72.50 71.97 2kd2 s THR 99 CO 0.23 0.01 -0.12 0.26 -0.69 0.00 0.00 174.62 174.31 2kd2 s TRP 100 N 0.44 1.34 -0.17 4.92 0.51 0.86 -0.67 118.94 126.17 2kd2 s TRP 100 Ca -0.02 -0.63 -0.00 0.00 -2.12 0.00 0.00 56.10 53.32 2kd2 s TRP 100 Cb -0.04 -0.69 0.04 0.00 -0.81 0.00 0.00 33.47 31.97 2kd2 s TRP 100 CO -0.02 0.13 -0.05 0.08 -0.51 0.00 0.00 176.95 176.58 2kd2 s VAL 101 N -2.62 1.12 0.01 4.03 1.01 -1.26 -1.03 120.40 121.66 2kd2 s VAL 101 Ca 0.12 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 61.42 2kd2 s VAL 101 Cb -0.02 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 35.04 2kd2 s VAL 101 CO 0.02 0.11 0.02 -1.48 0.00 0.00 0.00 175.10 173.78 2kd2 s LEU 102 N 1.62 1.99 -0.88 3.92 2.34 -0.58 -4.92 118.68 122.17 2kd2 s LEU 102 Ca 0.00 -0.29 -0.25 0.00 0.06 0.00 0.00 54.13 53.66 2kd2 s LEU 102 Cb -0.15 0.24 -0.00 0.00 -0.56 0.00 0.00 46.19 45.71 2kd2 s LEU 102 CO -0.08 -0.25 1.68 -0.60 -1.06 0.00 0.00 176.35 176.05 2kd2 s ARG 103 N -1.08 3.00 0.15 1.48 6.06 -1.26 0.11 118.95 127.41 2kd2 s ARG 103 Ca -0.12 -0.43 0.10 0.00 -2.50 0.00 0.00 55.73 52.78 2kd2 s ARG 103 Cb -0.07 -4.95 -0.04 0.00 0.06 0.00 0.00 34.95 29.95 2kd2 s ARG 103 CO -0.00 -2.73 -0.23 -1.17 -2.50 0.00 0.00 175.30 168.67 2kd2 s LEU 104 N 7.65 2.38 -0.80 -0.88 0.20 0.11 -4.65 118.68 122.69 2kd2 s LEU 104 Ca 0.57 -0.80 0.00 0.00 0.69 0.00 0.00 54.13 54.59 2kd2 s LEU 104 Cb -0.05 -1.05 0.00 0.00 -0.43 0.00 0.00 46.19 44.66 2kd2 s LEU 104 CO 0.01 0.09 0.00 0.47 -0.29 0.00 0.00 176.35 176.63 2kd2 n ASP 105 N 0.58 -5.09 0.00 3.68 8.00 -1.26 -1.27 116.55 121.18 2kd2 n ASP 105 Ca -0.15 0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.53 2kd2 n ASP 105 Cb 0.55 -3.26 0.00 0.00 -0.02 0.00 0.00 41.12 38.39 2kd2 n ASP 105 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2kd2 n GLY 106 N -0.49 0.77 3.23 0.44 0.00 -1.26 -5.02 105.19 102.86 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 -1.83 0.00 0.00 0.00 173.32 171.49 2kd2 s GLU 107 N -0.45 1.37 -0.90 1.61 -1.05 -0.40 -5.07 118.70 113.81 2kd2 s GLU 107 Ca 0.00 -1.75 -0.25 0.00 -0.15 0.00 0.00 54.97 52.82 2kd2 s GLU 107 Cb 0.00 0.28 -0.06 0.00 -0.44 0.00 0.00 34.13 33.91 2kd2 s GLU 107 CO 0.00 -0.47 2.01 -0.51 0.95 0.00 0.00 175.26 177.25 2kd2 s ASP 108 N -3.23 4.94 -0.03 0.83 1.01 -1.26 0.05 116.67 118.97 2kd2 s ASP 108 Ca 0.39 -0.62 -0.30 0.00 0.71 0.00 0.00 52.55 52.73 2kd2 s ASP 108 Cb 0.06 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.39 2kd2 s ASP 108 CO 0.17 -2.95 1.10 -0.22 0.21 0.00 0.00 175.17 173.48 2kd2 s LEU 109 N 10.88 4.31 -0.30 1.23 2.96 0.12 -4.89 118.68 132.99 2kd2 s LEU 109 Ca 0.73 1.75 -0.08 0.00 -0.22 0.00 0.00 54.13 56.31 2kd2 s LEU 109 Cb -0.07 -3.56 -0.00 0.00 0.50 0.00 0.00 46.19 43.05 2kd2 s LEU 109 CO 0.01 -0.46 0.11 -0.60 -1.32 0.00 0.00 176.35 174.10 2kd2 s ARG 110 N 1.67 3.29 -0.08 1.98 3.52 -1.26 -1.53 118.95 126.55 2kd2 s ARG 110 Ca 0.54 -0.73 -0.04 0.00 -0.13 0.00 0.00 55.73 55.36 2kd2 s ARG 110 Cb -0.23 -3.46 -0.04 0.00 -1.56 0.00 0.00 34.95 29.66 2kd2 s ARG 110 CO 0.24 -0.39 0.12 0.08 -0.81 0.00 0.00 175.30 174.53 2kd2 s VAL 111 N 1.57 5.18 -0.05 7.11 1.01 -0.20 -3.20 120.40 131.82 2kd2 s VAL 111 Ca 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.99 2kd2 s VAL 111 Cb -0.17 -3.29 0.03 0.00 0.00 0.00 0.00 36.38 32.95 2kd2 s VAL 111 CO 0.04 0.52 -0.01 -0.69 0.00 0.00 0.00 175.10 174.96 2kd2 s VAL 112 N -1.09 0.36 -0.31 2.92 1.01 -0.34 -0.10 120.40 122.85 2kd2 s VAL 112 Ca 0.18 0.03 -0.05 0.00 0.00 0.00 0.00 61.98 62.14 2kd2 s VAL 112 Cb -0.12 -0.45 0.03 0.00 0.00 0.00 0.00 36.38 35.84 2kd2 s VAL 112 CO 0.08 0.21 0.07 -0.22 0.00 0.00 0.00 175.10 175.24 2kd2 s LEU 113 N 1.30 4.01 0.04 3.92 2.96 0.89 -0.06 118.68 131.74 2kd2 s LEU 113 Ca -0.05 -1.01 -0.23 0.00 -0.22 0.00 0.00 54.13 52.62 2kd2 s LEU 113 Cb -0.13 -1.83 -0.06 0.00 0.50 0.00 0.00 46.19 44.67 2kd2 s LEU 113 CO -0.02 -0.26 0.70 -0.70 -1.32 0.00 0.00 176.35 174.75 2kd2 s GLU 114 N 1.40 4.43 0.32 1.98 2.12 -0.85 -0.95 118.70 127.16 2kd2 s GLU 114 Ca -0.01 0.95 0.26 0.00 0.36 0.00 0.00 54.97 56.53 2kd2 s GLU 114 Cb -0.19 -3.34 0.97 0.00 0.26 0.00 0.00 34.13 31.83 2kd2 s GLU 114 CO 0.01 0.34 1.78 1.57 -0.54 0.00 0.00 175.26 178.42 2kd2 h LYS 115 N 5.53 0.00 -0.06 4.30 5.09 -1.83 0.27 116.57 129.86 2kd2 h LYS 115 Ca -0.45 0.00 0.04 0.00 0.09 0.00 0.00 60.65 60.33 2kd2 h LYS 115 Cb 1.20 0.00 -0.06 0.00 0.10 0.00 0.00 32.23 33.48 2kd2 h LYS 115 CO 0.70 0.00 -0.35 0.22 -2.09 0.00 0.00 179.45 177.92 2kd2 h ASP 116 N 0.00 -1.08 0.00 7.07 1.82 -1.93 -3.33 116.42 118.97 2kd2 h ASP 116 Ca 0.00 0.14 0.00 0.00 -0.39 0.00 0.00 57.03 56.78 2kd2 h ASP 116 Cb 0.53 0.44 0.00 0.00 0.68 0.00 0.00 39.33 40.99 2kd2 h ASP 116 CO 0.00 -0.40 -0.29 0.35 -1.61 0.00 0.00 179.24 177.29 2kd2 n THR 117 N -5.42 0.31 -2.35 2.25 -2.24 -1.23 -4.99 114.28 100.60 2kd2 n THR 117 Ca -0.04 -0.36 -0.19 0.00 -2.27 0.00 0.00 64.05 61.19 2kd2 n THR 117 Cb 0.34 0.52 -0.01 0.00 -2.10 0.00 0.00 70.33 69.08 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 -0.22 -1.78 -2.72 -0.78 2.81 0.96 -4.95 117.12 110.44 2kd2 n MET 118 Ca 0.02 0.94 -0.36 0.00 -1.81 0.00 0.00 57.70 56.49 2kd2 n MET 118 Cb 0.62 -5.57 -0.06 0.00 -0.71 0.00 0.00 33.22 27.50 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 -2.08 7.09 -0.23 7.83 -1.08 -1.18 -4.80 116.67 122.22 2kd2 s ASP 119 Ca 0.00 1.86 -0.07 0.00 -0.52 0.00 0.00 52.55 53.82 2kd2 s ASP 119 Cb 0.00 -2.57 -0.03 0.00 -1.46 0.00 0.00 42.92 38.85 2kd2 s ASP 119 CO 0.00 -0.25 0.07 -0.69 0.52 0.00 0.00 175.17 174.82 2kd2 s VAL 120 N -1.75 4.52 -0.16 1.11 1.01 -1.26 -2.00 120.40 121.87 2kd2 s VAL 120 Ca 0.55 -0.11 -0.06 0.00 0.00 0.00 0.00 61.98 62.36 2kd2 s VAL 120 Cb -0.17 -3.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 2kd2 s VAL 120 CO 0.22 0.37 0.03 0.86 0.00 0.00 0.00 175.10 176.59 2kd2 s TRP 121 N 1.19 3.20 -0.29 5.22 -0.00 0.92 -1.24 118.94 127.94 2kd2 s TRP 121 Ca 0.05 0.02 0.00 0.00 -0.00 0.00 0.00 56.10 56.17 2kd2 s TRP 121 Cb -0.14 -2.01 0.09 0.00 -0.00 0.00 0.00 33.47 31.41 2kd2 s TRP 121 CO 0.04 0.17 0.05 0.00 -0.00 0.00 0.00 176.95 177.20 2kd2 n ASN 123 N 4.70 -5.65 -4.14 0.00 3.02 -1.19 -1.34 115.26 110.66 2kd2 n ASN 123 Ca -0.04 -0.69 -0.35 0.00 -0.03 0.00 0.00 54.58 53.47 2kd2 n ASN 123 Cb 0.43 -2.63 -0.01 0.00 -0.61 0.00 0.00 39.78 36.96 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 -1.60 -0.46 2.70 7.41 0.00 -1.26 -4.93 105.19 107.04 2kd2 n GLY 124 Ca -0.23 0.15 -0.21 0.00 0.00 0.00 0.00 46.02 45.74 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 -6.84 0.19 0.69 1.61 0.74 -0.45 -5.14 119.66 110.45 2kd2 s GLN 125 Ca 0.72 0.01 -0.17 0.00 0.05 0.00 0.00 55.36 55.98 2kd2 s GLN 125 Cb -0.38 -1.22 -0.03 0.00 1.10 0.00 0.00 33.01 32.48 2kd2 s GLN 125 CO 0.90 -0.76 0.75 1.63 -0.55 0.00 0.00 175.29 177.26 2kd2 n LYS 126 N 5.30 0.47 -4.46 1.67 5.02 -1.26 -1.43 118.16 123.47 2kd2 n LYS 126 Ca -0.05 0.21 -0.23 0.00 -2.02 0.00 0.00 58.31 56.22 2kd2 n LYS 126 Cb 0.48 -2.00 -0.10 0.00 -0.02 0.00 0.00 35.03 33.38 2kd2 n LYS 126 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2kd2 s MET 127 N -2.90 1.64 -0.27 1.97 -1.94 -0.37 -4.82 119.30 112.61 2kd2 s MET 127 Ca 0.70 -1.83 0.02 0.00 -1.71 0.00 0.00 55.69 52.87 2kd2 s MET 127 Cb -0.37 -1.33 0.06 0.00 2.01 0.00 0.00 34.83 35.20 2kd2 s MET 127 CO 0.53 0.07 -0.09 -1.21 -0.01 0.00 0.00 175.02 174.31 2kd2 s GLU 128 N -3.69 2.29 0.58 2.03 2.02 -1.26 -4.58 118.70 116.10 2kd2 s GLU 128 Ca 0.30 -1.33 0.04 0.00 0.02 0.00 0.00 54.97 54.01 2kd2 s GLU 128 Cb 0.03 -2.94 0.07 0.00 0.10 0.00 0.00 34.13 31.39 2kd2 s GLU 128 CO 0.13 -0.57 0.81 0.95 0.02 0.00 0.00 175.26 176.60 2kd2 s THR 129 N 1.13 2.44 0.00 3.63 -4.23 -1.26 -3.82 115.64 113.54 2kd2 s THR 129 Ca -0.08 -0.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.65 2kd2 s THR 129 Cb -0.20 -2.66 0.00 0.00 1.34 0.00 0.00 72.50 70.98 2kd2 s THR 129 CO -0.04 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.04 2kd2 n ALA 130 N -2.38 0.00 0.00 3.99 0.00 0.67 -4.84 120.51 117.95 2kd2 n ALA 130 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2kd2 n ALA 130 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 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 0.00 1.16 3.83 0.00 0.00 -1.26 -0.72 105.19 108.20 2kd2 n GLY 131 Ca 0.00 -1.07 0.03 0.00 0.00 0.00 0.00 46.02 44.98 2kd2 n GLY 131 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kd2 s GLU 132 N 0.00 0.25 0.02 1.61 2.12 -1.26 -5.09 118.70 116.36 2kd2 s GLU 132 Ca 0.00 -0.16 0.04 0.00 0.36 0.00 0.00 54.97 55.21 2kd2 s GLU 132 Cb 0.00 0.08 -0.03 0.00 0.26 0.00 0.00 34.13 34.43 2kd2 s GLU 132 CO 0.00 -0.12 -0.06 -0.59 -0.54 0.00 0.00 175.26 173.95 2kd2 s PHE 133 N -2.11 2.89 0.56 5.30 -0.71 -1.26 -2.60 117.98 120.05 2kd2 s PHE 133 Ca 0.24 -0.04 0.06 0.00 -1.04 0.00 0.00 56.93 56.14 2kd2 s PHE 133 Cb 0.02 -1.59 0.06 0.00 -1.21 0.00 0.00 43.02 40.30 2kd2 s PHE 133 CO -0.03 0.39 0.47 1.33 -1.34 0.00 0.00 175.22 176.04 2kd2 n VAL 134 N 1.42 0.00 -0.07 -2.49 0.24 -0.36 -4.99 118.33 112.07 2kd2 n VAL 134 Ca -0.15 -2.16 0.24 0.00 -2.04 0.00 0.00 64.34 60.24 2kd2 n VAL 134 Cb 0.52 -0.09 0.71 0.00 -1.47 0.00 0.00 33.84 33.51 2kd2 n VAL 134 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 2kd2 h ASP 135 N 0.57 0.00 -1.72 -1.34 5.19 -2.01 -3.34 116.42 113.76 2kd2 h ASP 135 Ca -0.34 0.00 -0.22 0.00 -0.62 0.00 0.00 57.03 55.85 2kd2 h ASP 135 Cb 1.28 0.00 -0.28 0.00 0.18 0.00 0.00 39.33 40.50 2kd2 h ASP 135 CO 0.53 0.00 -0.57 1.51 -3.12 0.00 0.00 179.24 177.59 2kd2 s ASP 136 N -5.79 0.47 0.00 6.45 1.47 -1.26 -5.05 116.67 112.96 2kd2 s ASP 136 Ca -0.05 -0.68 0.00 0.00 1.18 0.00 0.00 52.55 53.00 2kd2 s ASP 136 Cb 0.20 1.03 0.00 0.00 -0.34 0.00 0.00 42.92 43.81 2kd2 s ASP 136 CO 0.72 -0.32 0.00 0.61 0.68 0.00 0.00 175.17 176.86 2kd2 n GLY 137 N 5.06 2.09 2.89 2.12 0.00 -1.26 -3.45 105.19 112.65 2kd2 n GLY 137 Ca 0.03 -2.08 -0.19 0.00 0.00 0.00 0.00 46.02 43.79 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 -2.08 0.49 -0.77 2.61 2.01 -1.14 -1.23 115.64 115.55 2kd2 s THR 138 Ca 0.00 -0.12 -0.22 0.00 0.31 0.00 0.00 61.69 61.67 2kd2 s THR 138 Cb 0.00 -0.52 0.08 0.00 0.01 0.00 0.00 72.50 72.08 2kd2 s THR 138 CO 0.00 0.21 1.07 -1.61 -0.69 0.00 0.00 174.62 173.59 2kd2 s GLU 139 N 0.81 3.29 -0.47 4.92 2.02 -1.07 -2.50 118.70 125.69 2kd2 s GLU 139 Ca -0.11 -1.07 -0.29 0.00 0.02 0.00 0.00 54.97 53.52 2kd2 s GLU 139 Cb -0.13 -4.50 0.03 0.00 0.10 0.00 0.00 34.13 29.62 2kd2 s GLU 139 CO 0.00 -1.86 1.14 0.95 0.02 0.00 0.00 175.26 175.52 2kd2 s THR 140 N 3.87 4.20 -0.33 3.63 -4.23 -0.91 -4.04 115.64 117.83 2kd2 s THR 140 Ca 0.28 1.23 -0.07 0.00 -1.18 0.00 0.00 61.69 61.94 2kd2 s THR 140 Cb -0.12 -4.60 0.03 0.00 1.34 0.00 0.00 72.50 69.15 2kd2 s THR 140 CO 0.04 -1.00 0.11 -1.00 -0.54 0.00 0.00 174.62 172.22 2kd2 s HIS 141 N 4.46 3.21 -0.05 3.99 3.76 0.10 -0.64 115.29 130.12 2kd2 s HIS 141 Ca 0.48 -1.18 0.04 0.00 -0.15 0.00 0.00 55.06 54.26 2kd2 s HIS 141 Cb -0.07 -2.29 -0.00 0.00 1.11 0.00 0.00 32.58 31.33 2kd2 s HIS 141 CO 0.32 -0.66 -0.18 -0.59 -0.85 0.00 0.00 174.74 172.78 2kd2 s PHE 142 N 1.46 1.80 0.23 1.40 -0.12 -1.18 -0.24 117.98 121.34 2kd2 s PHE 142 Ca 0.01 -0.56 -0.30 0.00 -0.05 0.00 0.00 56.93 56.02 2kd2 s PHE 142 Cb -0.19 -1.22 -0.09 0.00 -0.63 0.00 0.00 43.02 40.90 2kd2 s PHE 142 CO 0.03 -0.21 0.98 -1.54 -0.05 0.00 0.00 175.22 174.44 2kd2 s SER 143 N 0.15 7.54 -0.34 1.98 1.04 -1.25 -3.64 113.70 119.18 2kd2 s SER 143 Ca -0.07 2.01 0.00 0.00 0.48 0.00 0.00 55.95 58.37 2kd2 s SER 143 Cb -0.13 -2.61 0.11 0.00 0.10 0.00 0.00 66.02 63.49 2kd2 s SER 143 CO 0.03 0.05 0.12 -0.69 0.98 0.00 0.00 173.24 173.74 2kd2 s VAL 144 N -1.00 1.05 0.00 5.02 1.01 -1.25 -4.80 120.40 120.43 2kd2 s VAL 144 Ca 0.43 -1.67 0.00 0.00 0.00 0.00 0.00 61.98 60.74 2kd2 s VAL 144 Cb -0.27 -1.78 0.00 0.00 0.00 0.00 0.00 36.38 34.32 2kd2 s VAL 144 CO 0.34 -0.72 0.00 0.61 0.00 0.00 0.00 175.10 175.33 2kd2 n GLY 145 N 4.56 3.35 1.81 4.51 0.00 -1.26 -0.16 105.19 118.00 2kd2 n GLY 145 Ca 0.01 0.11 -0.07 0.00 0.00 0.00 0.00 46.02 46.06 2kd2 n GLY 145 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2kd2 n ASN 146 N 4.97 4.17 -1.92 1.61 5.03 -1.26 -4.92 115.26 122.95 2kd2 n ASN 146 Ca 0.00 -3.03 0.00 0.00 0.87 0.00 0.00 54.58 52.42 2kd2 n ASN 146 Cb 0.00 -0.71 0.00 0.00 -1.02 0.00 0.00 39.78 38.05 2kd2 n ASN 146 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 2kd2 n HIS 147 N -0.19 0.00 -3.12 3.10 8.25 0.77 -5.13 115.22 118.91 2kd2 n HIS 147 Ca 0.36 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.66 2kd2 n HIS 147 Cb 1.23 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 32.30 2kd2 n HIS 147 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2kd2 s ASP 148 N -1.00 0.11 0.42 0.41 1.11 -1.26 -3.86 116.67 112.60 2kd2 s ASP 148 Ca 0.00 -2.28 0.03 0.00 0.18 0.00 0.00 52.55 50.48 2kd2 s ASP 148 Cb 0.00 0.72 0.00 0.00 1.07 0.00 0.00 42.92 44.71 2kd2 s ASP 148 CO 0.00 -0.13 0.60 0.00 1.18 0.00 0.00 175.17 176.82 2kd2 s TYR 150 N -2.43 -0.47 -0.40 0.00 1.13 -0.38 -3.09 117.35 111.72 2kd2 s TYR 150 Ca 0.49 1.00 -0.15 0.00 -1.41 0.00 0.00 57.07 57.00 2kd2 s TYR 150 Cb -0.10 0.39 0.01 0.00 -1.10 0.00 0.00 41.96 41.17 2kd2 s TYR 150 CO 0.35 -0.31 0.31 0.42 -2.51 0.00 0.00 175.55 173.81 2kd2 s ILE 151 N -0.37 5.24 -0.65 -3.49 1.01 0.18 -0.44 121.20 122.68 2kd2 s ILE 151 Ca 0.00 -0.51 -0.27 0.00 0.00 0.00 0.00 60.65 59.87 2kd2 s ILE 151 Cb -0.03 -3.90 0.03 0.00 0.01 0.00 0.00 42.46 38.57 2kd2 s ILE 151 CO -0.02 -0.26 1.21 -0.75 0.00 0.00 0.00 174.94 175.13 2kd2 s LYS 152 N 1.76 3.34 0.02 2.79 2.20 0.99 -2.15 119.74 128.69 2kd2 s LYS 152 Ca 0.06 -0.03 -0.10 0.00 -0.36 0.00 0.00 55.97 55.54 2kd2 s LYS 152 Cb -0.18 -4.10 -0.05 0.00 -1.51 0.00 0.00 37.83 31.98 2kd2 s LYS 152 CO 0.11 -1.89 0.35 0.00 -0.36 0.00 0.00 175.35 173.55 2kd2 s ALA 153 N 5.24 3.76 -0.06 3.13 0.00 -1.04 -0.47 121.76 132.32 2kd2 s ALA 153 Ca 0.38 -0.40 -0.01 0.00 0.00 0.00 0.00 51.96 51.92 2kd2 s ALA 153 Cb -0.08 -2.23 0.03 0.00 0.00 0.00 0.00 23.12 20.84 2kd2 s ALA 153 CO 0.20 0.57 0.01 0.08 0.00 0.00 0.00 175.76 176.62 2kd2 s VAL 154 N -1.25 0.26 -0.06 0.00 1.01 -0.22 -2.87 120.40 117.27 2kd2 s VAL 154 Ca 0.27 0.18 -0.19 0.00 0.00 0.00 0.00 61.98 62.25 2kd2 s VAL 154 Cb -0.14 -0.44 -0.05 0.00 0.00 0.00 0.00 36.38 35.75 2kd2 s VAL 154 CO 0.15 0.24 0.52 -0.94 0.00 0.00 0.00 175.10 175.07 2kd2 s SER 155 N 1.95 6.81 -0.02 3.32 1.04 -1.22 -1.34 113.70 124.23 2kd2 s SER 155 Ca 0.04 0.97 0.06 0.00 0.48 0.00 0.00 55.95 57.49 2kd2 s SER 155 Cb -0.12 -2.31 -0.01 0.00 0.10 0.00 0.00 66.02 63.67 2kd2 s SER 155 CO -0.04 0.07 -0.20 -0.94 0.98 0.00 0.00 173.24 173.10 2kd2 s SER 156 N 0.16 2.39 0.00 7.02 1.04 0.20 -4.52 113.70 119.99 2kd2 s SER 156 Ca 0.28 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 56.33 2kd2 s SER 156 Cb -0.16 -0.38 0.00 0.00 0.10 0.00 0.00 66.02 65.57 2kd2 s SER 156 CO 0.13 0.23 0.00 0.61 0.98 0.00 0.00 173.24 175.19 2kd2 n GLY 157 N 2.73 1.07 1.23 7.32 0.00 -1.26 -1.30 105.19 114.97 2kd2 n GLY 157 Ca -0.16 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.29 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 0.00 0.00 1.61 4.81 -1.26 -5.01 118.16 118.31 2kd2 n LYS 158 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2kd2 n LYS 158 Cb 0.00 -0.17 0.00 0.00 0.02 0.00 0.00 35.03 34.88 2kd2 n LYS 158 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 2kd2 n ARG 159 N -2.11 0.00 -2.69 1.64 0.63 -1.26 -5.01 116.66 107.85 2kd2 n ARG 159 Ca 0.00 0.00 -0.06 0.00 -0.92 0.00 0.00 57.85 56.87 2kd2 n ARG 159 Cb 0.00 -0.28 0.08 0.00 0.45 0.00 0.00 32.46 32.71 2kd2 n ARG 159 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 2kd2 n LYS 160 N -2.18 0.67 -0.03 -0.14 4.81 -1.26 -5.00 118.16 115.02 2kd2 n LYS 160 Ca 0.00 -1.34 -0.01 0.00 -0.87 0.00 0.00 58.31 56.09 2kd2 n LYS 160 Cb 0.07 -0.36 -0.00 0.00 0.02 0.00 0.00 35.03 34.75 2kd2 n LYS 160 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2kd2 h GLU 161 N 2.17 0.00 -3.58 1.64 5.08 -1.95 -3.47 114.58 114.48 2kd2 h GLU 161 Ca -0.30 0.00 -0.48 0.00 -1.00 0.00 0.00 59.36 57.58 2kd2 h GLU 161 Cb 1.21 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 30.06 2kd2 h GLU 161 CO -0.02 0.00 -0.76 0.20 -1.00 0.00 0.00 179.01 177.42 2kd2 s GLY 162 N -2.99 0.58 -0.09 -3.84 0.00 -0.42 -4.78 107.32 95.77 2kd2 s GLY 162 Ca -0.02 -0.43 -0.03 0.00 0.00 0.00 0.00 44.72 44.24 2kd2 s GLY 162 CO 0.03 1.33 0.02 -0.42 0.00 0.00 0.00 173.10 174.06 2kd2 s ILE 163 N 1.93 4.47 -0.12 0.90 1.01 -1.26 -0.63 121.20 127.50 2kd2 s ILE 163 Ca 0.02 -0.18 0.01 0.00 0.00 0.00 0.00 60.65 60.49 2kd2 s ILE 163 Cb -0.15 -2.90 0.02 0.00 0.01 0.00 0.00 42.46 39.44 2kd2 s ILE 163 CO -0.07 0.60 -0.13 -0.63 0.00 0.00 0.00 174.94 174.72 2kd2 s ILE 164 N -0.85 1.37 -0.08 2.92 1.01 -0.45 -4.34 121.20 120.77 2kd2 s ILE 164 Ca 0.13 -0.53 -0.11 0.00 0.00 0.00 0.00 60.65 60.13 2kd2 s ILE 164 Cb -0.11 -1.29 -0.05 0.00 0.01 0.00 0.00 42.46 41.02 2kd2 s ILE 164 CO 0.02 0.42 0.27 -1.00 0.00 0.00 0.00 174.94 174.66 2kd2 s HIS 165 N 1.29 3.62 -0.27 3.97 3.76 -1.26 -1.05 115.29 125.34 2kd2 s HIS 165 Ca -0.01 0.72 -0.00 0.00 -0.15 0.00 0.00 55.06 55.62 2kd2 s HIS 165 Cb -0.14 -2.16 0.08 0.00 1.11 0.00 0.00 32.58 31.48 2kd2 s HIS 165 CO -0.06 0.59 0.05 0.95 -0.85 0.00 0.00 174.74 175.42 2kd2 s THR 166 N -0.72 1.10 0.33 1.30 -4.23 0.38 -4.95 115.64 108.86 2kd2 s THR 166 Ca 0.18 -1.29 -0.29 0.00 -1.18 0.00 0.00 61.69 59.12 2kd2 s THR 166 Cb -0.14 -1.68 -0.11 0.00 1.34 0.00 0.00 72.50 71.92 2kd2 s THR 166 CO 0.07 -0.45 1.41 -0.22 -0.54 0.00 0.00 174.62 174.90 2kd2 s LEU 167 N 1.54 4.37 -0.05 4.79 2.96 -1.26 -0.01 118.68 131.02 2kd2 s LEU 167 Ca 0.04 2.84 -0.02 0.00 -0.22 0.00 0.00 54.13 56.78 2kd2 s LEU 167 Cb -0.18 -3.65 0.03 0.00 0.50 0.00 0.00 46.19 42.89 2kd2 s LEU 167 CO -0.16 -0.71 0.03 -0.63 -1.32 0.00 0.00 176.35 173.56 2kd2 s ILE 168 N -0.90 0.14 -0.09 6.68 1.01 0.41 -0.34 121.20 128.11 2kd2 s ILE 168 Ca 0.53 0.26 0.04 0.00 0.00 0.00 0.00 60.65 61.48 2kd2 s ILE 168 Cb -0.43 -0.34 0.00 0.00 0.01 0.00 0.00 42.46 41.70 2kd2 s ILE 168 CO 0.55 0.21 -0.22 -0.69 0.00 0.00 0.00 174.94 174.79 2kd2 s VAL 169 N 1.99 1.92 -1.48 2.92 1.01 -0.68 -1.25 120.40 124.82 2kd2 s VAL 169 Ca 0.04 -0.95 -0.07 0.00 0.00 0.00 0.00 61.98 61.00 2kd2 s VAL 169 Cb -0.12 -1.66 0.02 0.00 0.00 0.00 0.00 36.38 34.61 2kd2 s VAL 169 CO -0.04 0.53 0.80 0.47 0.00 0.00 0.00 175.10 176.86 2kd2 n ASP 170 N 3.47 -5.99 -3.06 3.32 8.00 -1.26 -1.90 116.55 119.13 2kd2 n ASP 170 Ca -0.19 -0.40 -0.18 0.00 0.71 0.00 0.00 54.79 54.73 2kd2 n ASP 170 Cb 0.53 -4.80 0.07 0.00 -0.02 0.00 0.00 41.12 36.90 2kd2 n ASP 170 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2kd2 n ASN 171 N -2.68 -4.56 -3.75 -2.24 5.15 -1.26 -5.02 115.26 100.91 2kd2 n ASN 171 Ca -0.06 -0.47 -0.15 0.00 -0.60 0.00 0.00 54.58 53.30 2kd2 n ASN 171 Cb 0.59 -4.30 -0.16 0.00 -0.53 0.00 0.00 39.78 35.38 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 -5.80 -0.00 0.53 1.20 0.52 -0.80 -5.14 118.95 109.46 2kd2 s ARG 172 Ca 0.34 0.27 -0.22 0.00 -0.52 0.00 0.00 55.73 55.60 2kd2 s ARG 172 Cb -0.15 -0.25 -0.05 0.00 0.52 0.00 0.00 34.95 35.01 2kd2 s ARG 172 CO 0.61 -0.19 1.31 -2.00 0.02 0.00 0.00 175.30 175.05 2kd2 s GLU 173 N 1.25 3.26 -0.08 3.54 2.12 -1.26 -1.69 118.70 125.83 2kd2 s GLU 173 Ca -0.07 2.13 0.04 0.00 0.36 0.00 0.00 54.97 57.42 2kd2 s GLU 173 Cb -0.12 -2.28 0.00 0.00 0.26 0.00 0.00 34.13 31.99 2kd2 s GLU 173 CO -0.04 -1.06 -0.19 0.42 -0.54 0.00 0.00 175.26 173.84 2kd2 s ILE 174 N -1.36 1.66 0.21 -3.70 -1.09 0.54 -4.88 121.20 112.58 2kd2 s ILE 174 Ca 0.70 -0.80 -0.30 0.00 -2.23 0.00 0.00 60.65 58.02 2kd2 s ILE 174 Cb -0.38 -1.45 -0.09 0.00 -1.58 0.00 0.00 42.46 38.97 2kd2 s ILE 174 CO 0.45 0.47 1.29 -2.16 -1.23 0.00 0.00 174.94 173.76 2kd2 s PRO 175 N 0.35 4.40 0.25 2.79 0.04 -1.26 -4.24 135.00 137.32 2kd2 s PRO 175 Ca -0.14 2.05 -0.09 0.00 0.04 0.00 0.00 61.00 62.87 2kd2 s PRO 175 Cb -0.16 -3.19 -0.07 0.00 0.04 0.00 0.00 34.50 31.13 2kd2 s PRO 175 CO 0.06 -0.22 0.55 -2.00 0.04 0.00 0.00 177.00 175.43 2kd2 s GLU 176 N -0.33 3.76 -0.53 4.56 -6.30 -1.26 -4.32 118.70 114.28 2kd2 s GLU 176 Ca 0.55 0.22 -0.27 0.00 -2.50 0.00 0.00 54.97 52.97 2kd2 s GLU 176 Cb -0.36 -2.64 -0.03 0.00 0.00 0.00 0.00 34.13 31.10 2kd2 s GLU 176 CO 0.40 0.28 1.91 -1.17 0.02 0.00 0.00 175.26 176.70 2kd2 s LEU 177 N -3.00 3.36 -0.12 2.70 2.96 0.16 -4.73 118.68 120.00 2kd2 s LEU 177 Ca 0.47 0.66 -0.01 0.00 -0.22 0.00 0.00 54.13 55.03 2kd2 s LEU 177 Cb -0.11 -2.77 -0.07 0.00 0.50 0.00 0.00 46.19 43.74 2kd2 s LEU 177 CO 0.23 -2.27 -0.11 0.35 -1.32 0.00 0.00 176.35 173.23 2kd2 n THR 178 N 7.35 0.66 0.21 3.68 -2.24 -1.26 -4.81 114.28 117.86 2kd2 n THR 178 Ca 0.23 -0.23 0.03 0.00 -2.27 0.00 0.00 64.05 61.80 2kd2 n THR 178 Cb 0.51 -1.06 0.02 0.00 -2.10 0.00 0.00 70.33 67.70 2kd2 n THR 178 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50