#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 2.83 -0.01 1.61 0.04 -1.26 -5.07 135.00 133.14 2kd2 s PRO 87 Ca 0.00 1.40 -0.07 0.00 0.04 0.00 0.00 61.00 62.37 2kd2 s PRO 87 Cb 0.00 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.59 2kd2 s PRO 87 CO 0.00 -1.23 0.15 -0.51 0.04 0.00 0.00 177.00 175.45 2kd2 s LEU 88 N -4.81 1.49 0.00 -3.56 1.43 -1.26 -5.10 118.68 106.88 2kd2 s LEU 88 Ca 0.67 -0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.68 2kd2 s LEU 88 Cb -0.21 0.68 0.00 0.00 0.03 0.00 0.00 46.19 46.69 2kd2 s LEU 88 CO 0.41 -0.31 0.00 0.61 0.23 0.00 0.00 176.35 177.28 2kd2 n GLY 89 N 1.73 1.05 3.91 -3.19 0.00 -1.26 -4.97 105.19 102.47 2kd2 n GLY 89 Ca -0.21 -1.55 -0.27 0.00 0.00 0.00 0.00 46.02 43.99 2kd2 n GLY 89 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kd2 s SER 90 N -4.00 5.77 -0.34 1.61 0.01 -1.26 -5.02 113.70 110.47 2kd2 s SER 90 Ca 0.00 0.85 0.06 0.00 1.31 0.00 0.00 55.95 58.17 2kd2 s SER 90 Cb 0.00 -1.90 0.45 0.00 0.21 0.00 0.00 66.02 64.79 2kd2 s SER 90 CO 0.00 -0.97 1.23 -1.84 0.41 0.00 0.00 173.24 172.07 2kd2 n GLU 91 N -2.57 3.53 -0.26 12.44 0.28 -1.26 -5.09 120.64 127.72 2kd2 n GLU 91 Ca 0.04 -4.17 0.04 0.00 -0.16 0.00 0.00 57.16 52.91 2kd2 n GLU 91 Cb 0.57 -2.28 -0.01 0.00 1.43 0.00 0.00 31.44 31.15 2kd2 n GLU 91 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 2kd2 n ASN 92 N -0.69 -5.58 0.09 -1.84 2.85 -1.26 -4.34 115.26 104.50 2kd2 n ASN 92 Ca 0.44 0.28 -0.20 0.00 -0.11 0.00 0.00 54.58 54.99 2kd2 n ASN 92 Cb 0.90 -0.79 -0.15 0.00 1.24 0.00 0.00 39.78 40.98 2kd2 n ASN 92 CO 0.00 0.00 0.00 0.03 -2.11 0.00 0.00 177.26 175.18 2kd2 h ARG 93 N 0.00 0.35 -4.88 1.20 -0.00 -1.98 -3.50 114.38 105.57 2kd2 h ARG 93 Ca 0.01 -0.60 0.00 0.00 -0.50 0.00 0.00 59.98 58.89 2kd2 h ARG 93 Cb 0.23 0.22 -0.06 0.00 0.00 0.00 0.00 29.97 30.37 2kd2 h ARG 93 CO 0.00 1.25 -1.17 0.43 0.00 0.00 0.00 179.97 180.48 2kd2 n SER 94 N -3.56 -4.21 -1.35 7.04 7.64 -1.26 -4.59 113.62 113.33 2kd2 n SER 94 Ca -0.17 1.28 0.00 0.00 1.01 0.00 0.00 58.87 60.99 2kd2 n SER 94 Cb 1.06 -4.94 0.00 0.00 -1.01 0.00 0.00 64.21 59.33 2kd2 n SER 94 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 2kd2 n LYS 95 N 1.07 0.04 0.00 1.43 2.85 -1.26 -4.36 118.16 117.93 2kd2 n LYS 95 Ca -0.18 -0.13 0.00 0.00 -1.05 0.00 0.00 58.31 56.94 2kd2 n LYS 95 Cb 0.28 0.20 0.00 0.00 -0.65 0.00 0.00 35.03 34.86 2kd2 n LYS 95 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 2kd2 n THR 96 N -0.11 0.00 -3.64 0.58 -1.04 -1.26 -4.58 114.28 104.22 2kd2 n THR 96 Ca 0.00 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.95 2kd2 n THR 96 Cb 0.08 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.52 2kd2 n THR 96 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2kd2 s THR 97 N 0.00 -0.18 0.12 12.58 -4.23 -1.26 -2.25 115.64 120.41 2kd2 s THR 97 Ca 0.00 0.00 0.04 0.00 -1.18 0.00 0.00 61.69 60.55 2kd2 s THR 97 Cb 0.00 -0.99 -0.04 0.00 1.34 0.00 0.00 72.50 72.81 2kd2 s THR 97 CO 0.00 0.00 0.09 -0.44 -0.54 0.00 0.00 174.62 173.73 2kd2 s SER 98 N 1.87 5.45 -0.07 3.99 0.01 -0.42 -4.96 113.70 119.57 2kd2 s SER 98 Ca -0.09 -0.08 -0.08 0.00 1.31 0.00 0.00 55.95 57.00 2kd2 s SER 98 Cb -0.06 -1.43 0.02 0.00 0.21 0.00 0.00 66.02 64.76 2kd2 s SER 98 CO -0.20 0.13 0.22 -0.89 0.41 0.00 0.00 173.24 172.92 2kd2 s THR 99 N -1.53 0.01 0.13 1.44 2.01 -1.26 -0.16 115.64 116.28 2kd2 s THR 99 Ca 0.29 -0.11 0.04 0.00 0.31 0.00 0.00 61.69 62.22 2kd2 s THR 99 Cb -0.11 -0.35 -0.04 0.00 0.01 0.00 0.00 72.50 72.00 2kd2 s THR 99 CO 0.22 -0.06 -0.10 0.26 -0.69 0.00 0.00 174.62 174.25 2kd2 s TRP 100 N -0.15 1.18 -0.15 4.92 0.51 0.86 -0.75 118.94 125.36 2kd2 s TRP 100 Ca -0.03 -0.75 -0.02 0.00 -2.12 0.00 0.00 56.10 53.19 2kd2 s TRP 100 Cb -0.03 -0.62 0.04 0.00 -0.81 0.00 0.00 33.47 32.06 2kd2 s TRP 100 CO 0.01 0.04 -0.00 0.08 -0.51 0.00 0.00 176.95 176.56 2kd2 s VAL 101 N -3.13 0.65 0.01 4.03 1.01 -1.26 -1.16 120.40 120.54 2kd2 s VAL 101 Ca 0.13 -0.36 -0.02 0.00 0.00 0.00 0.00 61.98 61.73 2kd2 s VAL 101 Cb 0.01 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.44 2kd2 s VAL 101 CO -0.00 0.04 0.04 -1.48 0.00 0.00 0.00 175.10 173.70 2kd2 s LEU 102 N 1.83 1.95 -0.88 3.92 2.34 -0.55 -4.90 118.68 122.39 2kd2 s LEU 102 Ca 0.02 -0.27 -0.25 0.00 0.06 0.00 0.00 54.13 53.68 2kd2 s LEU 102 Cb -0.15 0.28 -0.02 0.00 -0.56 0.00 0.00 46.19 45.74 2kd2 s LEU 102 CO -0.07 -0.25 1.78 -0.13 -1.06 0.00 0.00 176.35 176.62 2kd2 s ARG 103 N -1.08 2.84 0.14 1.48 0.52 -1.26 0.03 118.95 121.62 2kd2 s ARG 103 Ca -0.12 -0.34 0.10 0.00 -0.52 0.00 0.00 55.73 54.85 2kd2 s ARG 103 Cb -0.07 -4.98 -0.04 0.00 0.52 0.00 0.00 34.95 30.38 2kd2 s ARG 103 CO -0.00 -2.94 -0.24 -1.17 0.02 0.00 0.00 175.30 170.97 2kd2 s LEU 104 N 8.50 2.35 -0.79 2.53 0.20 0.10 -4.64 118.68 126.94 2kd2 s LEU 104 Ca 0.62 -0.78 0.00 0.00 0.69 0.00 0.00 54.13 54.67 2kd2 s LEU 104 Cb -0.06 -1.10 0.00 0.00 -0.43 0.00 0.00 46.19 44.60 2kd2 s LEU 104 CO 0.01 0.12 0.00 0.47 -0.29 0.00 0.00 176.35 176.66 2kd2 n ASP 105 N 0.73 -5.11 0.00 3.68 9.92 -1.26 -1.27 116.55 123.25 2kd2 n ASP 105 Ca -0.17 0.18 0.00 0.00 -0.53 0.00 0.00 54.79 54.28 2kd2 n ASP 105 Cb 0.54 -3.26 0.00 0.00 -0.64 0.00 0.00 41.12 37.76 2kd2 n ASP 105 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2kd2 n GLY 106 N -0.46 0.77 3.23 0.44 0.00 -1.26 -5.02 105.19 102.87 2kd2 n GLY 106 Ca -0.07 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 1.85 0.00 0.00 0.00 173.32 175.17 2kd2 s GLU 107 N -0.46 1.37 -0.89 1.61 2.12 -0.39 -5.07 118.70 116.99 2kd2 s GLU 107 Ca 0.00 -1.75 -0.25 0.00 0.36 0.00 0.00 54.97 53.33 2kd2 s GLU 107 Cb 0.00 0.27 -0.06 0.00 0.26 0.00 0.00 34.13 34.60 2kd2 s GLU 107 CO 0.00 -0.46 2.02 -0.51 -0.54 0.00 0.00 175.26 175.76 2kd2 s ASP 108 N -3.23 4.94 0.13 -1.70 1.01 -1.26 0.01 116.67 116.57 2kd2 s ASP 108 Ca 0.39 -0.57 -0.30 0.00 0.71 0.00 0.00 52.55 52.78 2kd2 s ASP 108 Cb 0.06 -2.56 -0.06 0.00 1.01 0.00 0.00 42.92 41.36 2kd2 s ASP 108 CO 0.17 -2.93 1.07 -0.22 0.21 0.00 0.00 175.17 173.46 2kd2 s LEU 109 N 10.85 4.46 -0.23 1.23 2.96 0.10 -4.89 118.68 133.17 2kd2 s LEU 109 Ca 0.74 1.96 -0.04 0.00 -0.22 0.00 0.00 54.13 56.56 2kd2 s LEU 109 Cb -0.08 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 43.01 2kd2 s LEU 109 CO 0.01 -0.22 -0.02 -0.60 -1.32 0.00 0.00 176.35 174.20 2kd2 s ARG 110 N 0.06 3.38 -0.00 1.98 3.52 -1.26 -1.47 118.95 125.14 2kd2 s ARG 110 Ca 0.50 -0.63 0.00 0.00 -0.13 0.00 0.00 55.73 55.47 2kd2 s ARG 110 Cb -0.27 -3.07 -0.04 0.00 -1.56 0.00 0.00 34.95 30.01 2kd2 s ARG 110 CO 0.32 -0.22 0.06 0.08 -0.81 0.00 0.00 175.30 174.73 2kd2 s VAL 111 N 1.49 4.56 0.02 7.11 1.01 -0.31 -1.27 120.40 133.01 2kd2 s VAL 111 Ca 0.05 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 61.60 2kd2 s VAL 111 Cb -0.15 -3.07 -0.01 0.00 0.00 0.00 0.00 36.38 33.15 2kd2 s VAL 111 CO -0.02 0.36 -0.08 -0.69 0.00 0.00 0.00 175.10 174.67 2kd2 s VAL 112 N -1.16 0.64 -0.30 2.92 1.01 -0.05 -0.10 120.40 123.36 2kd2 s VAL 112 Ca 0.22 -0.67 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 2kd2 s VAL 112 Cb -0.12 -0.60 0.09 0.00 0.00 0.00 0.00 36.38 35.76 2kd2 s VAL 112 CO 0.13 -0.05 0.08 -0.22 0.00 0.00 0.00 175.10 175.04 2kd2 s LEU 113 N -0.79 2.23 0.11 3.92 2.96 0.77 -0.16 118.68 127.72 2kd2 s LEU 113 Ca -0.02 -1.55 -0.30 0.00 -0.22 0.00 0.00 54.13 52.04 2kd2 s LEU 113 Cb -0.06 -0.88 -0.07 0.00 0.50 0.00 0.00 46.19 45.69 2kd2 s LEU 113 CO 0.00 -0.39 1.20 -1.61 -1.32 0.00 0.00 176.35 174.23 2kd2 s GLU 114 N 1.61 4.46 0.34 1.98 2.02 -0.73 -1.30 118.70 127.08 2kd2 s GLU 114 Ca 0.08 1.81 0.27 0.00 0.02 0.00 0.00 54.97 57.15 2kd2 s GLU 114 Cb -0.17 -3.30 0.97 0.00 0.10 0.00 0.00 34.13 31.72 2kd2 s GLU 114 CO -0.22 -0.18 1.78 -0.22 0.02 0.00 0.00 175.26 176.44 2kd2 h LYS 115 N 6.16 0.00 0.01 1.61 3.11 -1.79 0.28 116.57 125.95 2kd2 h LYS 115 Ca -0.43 0.00 0.03 0.00 -2.81 0.00 0.00 60.65 57.44 2kd2 h LYS 115 Cb 1.21 0.00 -0.05 0.00 -1.00 0.00 0.00 32.23 32.39 2kd2 h LYS 115 CO 0.79 0.00 -0.35 0.22 -2.81 0.00 0.00 179.45 177.29 2kd2 h ASP 116 N 0.00 -1.05 0.00 4.20 3.58 -1.91 -3.32 116.42 117.91 2kd2 h ASP 116 Ca 0.00 0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.58 2kd2 h ASP 116 Cb 0.55 0.42 0.00 0.00 1.72 0.00 0.00 39.33 42.02 2kd2 h ASP 116 CO 0.00 -0.41 -0.24 0.35 -2.88 0.00 0.00 179.24 176.06 2kd2 n THR 117 N -5.43 0.52 -2.44 2.25 -2.24 -1.23 -4.99 114.28 100.72 2kd2 n THR 117 Ca -0.05 -0.61 -0.19 0.00 -2.27 0.00 0.00 64.05 60.93 2kd2 n THR 117 Cb 0.34 0.44 -0.01 0.00 -2.10 0.00 0.00 70.33 69.00 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 -0.37 -1.94 -2.66 -0.78 2.81 0.98 -4.94 117.12 110.21 2kd2 n MET 118 Ca 0.04 0.91 -0.38 0.00 -1.81 0.00 0.00 57.70 56.46 2kd2 n MET 118 Cb 0.60 -5.57 -0.05 0.00 -0.71 0.00 0.00 33.22 27.49 2kd2 n MET 118 CO 0.00 0.00 0.00 0.16 1.51 0.00 0.00 175.97 177.64 2kd2 s ASP 119 N -2.07 7.25 -0.19 7.83 1.47 -1.14 -4.81 116.67 125.01 2kd2 s ASP 119 Ca 0.01 1.99 -0.07 0.00 1.18 0.00 0.00 52.55 55.66 2kd2 s ASP 119 Cb -0.01 -2.60 -0.04 0.00 -0.34 0.00 0.00 42.92 39.94 2kd2 s ASP 119 CO 0.02 -0.13 0.06 -0.69 0.68 0.00 0.00 175.17 175.10 2kd2 s VAL 120 N -1.46 4.62 -0.23 2.11 1.01 -1.26 -1.77 120.40 123.43 2kd2 s VAL 120 Ca 0.49 -0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.40 2kd2 s VAL 120 Cb -0.23 -3.09 0.04 0.00 0.00 0.00 0.00 36.38 33.10 2kd2 s VAL 120 CO 0.29 0.44 -0.15 0.86 0.00 0.00 0.00 175.10 176.54 2kd2 s TRP 121 N 0.61 3.06 -0.49 5.22 -0.00 0.77 -0.73 118.94 127.37 2kd2 s TRP 121 Ca 0.03 -2.03 -0.15 0.00 -0.00 0.00 0.00 56.10 53.95 2kd2 s TRP 121 Cb -0.13 -1.93 0.10 0.00 -0.00 0.00 0.00 33.47 31.51 2kd2 s TRP 121 CO 0.01 -0.85 0.42 0.00 -0.00 0.00 0.00 176.95 176.53 2kd2 n ASN 123 N 5.18 0.00 -2.69 0.00 3.02 -0.40 -2.67 115.26 117.70 2kd2 n ASN 123 Ca -0.13 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.38 2kd2 n ASN 123 Cb 0.42 0.00 0.12 0.00 -0.61 0.00 0.00 39.78 39.71 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 0.00 1.64 3.10 7.41 0.00 -1.26 -5.04 105.19 111.04 2kd2 n GLY 124 Ca 0.00 -0.19 -0.07 0.00 0.00 0.00 0.00 46.02 45.76 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 0.01 0.37 -0.59 1.61 0.74 -1.09 -5.10 119.66 115.60 2kd2 s GLN 125 Ca 0.17 0.81 -0.29 0.00 0.05 0.00 0.00 55.36 56.10 2kd2 s GLN 125 Cb 0.42 -0.01 -0.12 0.00 1.10 0.00 0.00 33.01 34.41 2kd2 s GLN 125 CO -0.10 -0.47 2.45 1.17 -0.55 0.00 0.00 175.29 177.79 2kd2 n LYS 126 N 5.38 0.81 -1.00 1.67 4.81 -1.26 -3.13 118.16 125.44 2kd2 n LYS 126 Ca -0.06 0.06 -0.33 0.00 -0.87 0.00 0.00 58.31 57.12 2kd2 n LYS 126 Cb 0.50 -2.78 0.14 0.00 0.02 0.00 0.00 35.03 32.91 2kd2 n LYS 126 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 2kd2 s MET 127 N 8.09 1.48 -0.43 1.64 -1.94 0.10 -4.98 119.30 123.26 2kd2 s MET 127 Ca 1.10 1.67 -0.13 0.00 -1.71 0.00 0.00 55.69 56.62 2kd2 s MET 127 Cb -0.57 -1.77 0.06 0.00 2.01 0.00 0.00 34.83 34.56 2kd2 s MET 127 CO 0.36 -2.31 0.31 -2.00 -0.01 0.00 0.00 175.02 171.36 2kd2 s GLU 128 N -4.32 2.83 0.39 2.03 2.12 -1.26 -4.65 118.70 115.85 2kd2 s GLU 128 Ca 0.71 -1.29 0.05 0.00 0.36 0.00 0.00 54.97 54.80 2kd2 s GLU 128 Cb -0.26 -3.93 0.07 0.00 0.26 0.00 0.00 34.13 30.27 2kd2 s GLU 128 CO 0.53 -0.91 0.54 0.25 -0.54 0.00 0.00 175.26 175.13 2kd2 n THR 129 N 5.07 0.00 0.00 -1.70 -2.24 -1.26 -3.89 114.28 110.26 2kd2 n THR 129 Ca -0.11 -1.21 0.00 0.00 -2.27 0.00 0.00 64.05 60.45 2kd2 n THR 129 Cb 0.44 -0.75 0.00 0.00 -2.10 0.00 0.00 70.33 67.92 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 -2.63 1.59 0.00 6.98 0.00 -0.87 -4.85 120.51 120.72 2kd2 n ALA 130 Ca -0.09 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.31 2kd2 n ALA 130 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.84 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 3.15 0.42 3.14 0.00 0.00 -1.26 -4.96 105.19 105.68 2kd2 n GLY 131 Ca 0.00 -0.68 -0.12 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.30 0.29 0.58 1.61 2.12 -1.26 -5.02 118.70 116.73 2kd2 s GLU 132 Ca 0.00 0.56 -0.18 0.00 0.36 0.00 0.00 54.97 55.71 2kd2 s GLU 132 Cb 0.00 -0.03 -0.04 0.00 0.26 0.00 0.00 34.13 34.33 2kd2 s GLU 132 CO 0.00 -0.13 1.12 -0.06 -0.54 0.00 0.00 175.26 175.65 2kd2 s PHE 133 N 1.02 2.66 0.24 5.30 0.08 -1.26 -0.11 117.98 125.90 2kd2 s PHE 133 Ca -0.07 1.55 0.04 0.00 0.12 0.00 0.00 56.93 58.57 2kd2 s PHE 133 Cb -0.08 -3.25 -0.02 0.00 -0.57 0.00 0.00 43.02 39.11 2kd2 s PHE 133 CO -0.07 -1.60 0.16 1.33 -0.10 0.00 0.00 175.22 174.93 2kd2 n VAL 134 N -1.67 0.00 0.22 -0.44 0.24 0.87 -4.74 118.33 112.82 2kd2 n VAL 134 Ca 0.11 -1.60 0.18 0.00 -2.04 0.00 0.00 64.34 60.99 2kd2 n VAL 134 Cb 0.51 0.73 0.86 0.00 -1.47 0.00 0.00 33.84 34.47 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 1.27 0.00 0.00 -1.34 3.32 -1.98 -3.34 116.42 114.35 2kd2 h ASP 135 Ca -0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.88 2kd2 h ASP 135 Cb 0.80 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.35 2kd2 h ASP 135 CO 0.26 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 176.88 2kd2 n ASP 136 N -3.55 0.00 0.00 6.45 5.75 -1.26 -5.11 116.55 118.83 2kd2 n ASP 136 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.79 2kd2 n ASP 136 Cb 0.35 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.36 2kd2 n ASP 136 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2kd2 n GLY 137 N 2.87 1.72 2.86 6.12 0.00 -0.94 -4.04 105.19 113.78 2kd2 n GLY 137 Ca 0.00 -0.18 -0.18 0.00 0.00 0.00 0.00 46.02 45.67 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 1.27 0.33 -0.70 2.61 2.01 -0.90 -0.09 115.64 120.17 2kd2 s THR 138 Ca 0.00 -0.03 -0.20 0.00 0.31 0.00 0.00 61.69 61.77 2kd2 s THR 138 Cb 0.00 -0.39 0.10 0.00 0.01 0.00 0.00 72.50 72.22 2kd2 s THR 138 CO 0.00 0.17 0.91 -1.61 -0.69 0.00 0.00 174.62 173.40 2kd2 s GLU 139 N 0.85 3.20 -0.43 4.92 2.02 0.85 -2.80 118.70 127.30 2kd2 s GLU 139 Ca -0.10 -1.22 -0.29 0.00 0.02 0.00 0.00 54.97 53.39 2kd2 s GLU 139 Cb -0.13 -4.39 0.02 0.00 0.10 0.00 0.00 34.13 29.73 2kd2 s GLU 139 CO -0.01 -1.71 1.27 0.99 0.02 0.00 0.00 175.26 175.82 2kd2 s THR 140 N 3.26 4.07 -0.39 3.63 2.01 -1.19 -4.02 115.64 123.01 2kd2 s THR 140 Ca 0.21 1.10 -0.15 0.00 0.31 0.00 0.00 61.69 63.16 2kd2 s THR 140 Cb -0.16 -4.39 0.01 0.00 0.01 0.00 0.00 72.50 67.96 2kd2 s THR 140 CO 0.04 -0.85 0.33 -1.00 -0.69 0.00 0.00 174.62 172.45 2kd2 s HIS 141 N 4.88 3.22 0.07 4.92 0.09 -1.26 -3.04 115.29 124.17 2kd2 s HIS 141 Ca 0.54 -0.40 -0.06 0.00 -0.00 0.00 0.00 55.06 55.14 2kd2 s HIS 141 Cb -0.11 -2.65 -0.01 0.00 -0.00 0.00 0.00 32.58 29.81 2kd2 s HIS 141 CO 0.31 -0.55 0.12 -0.59 -0.00 0.00 0.00 174.74 174.03 2kd2 s PHE 142 N 1.83 0.26 0.33 1.40 -0.12 -1.24 -2.06 117.98 118.38 2kd2 s PHE 142 Ca 0.08 -0.71 0.07 0.00 -0.05 0.00 0.00 56.93 56.32 2kd2 s PHE 142 Cb -0.18 -0.16 -0.07 0.00 -0.63 0.00 0.00 43.02 41.99 2kd2 s PHE 142 CO 0.11 -0.48 -0.04 -1.54 -0.05 0.00 0.00 175.22 173.21 2kd2 s SER 143 N -2.81 3.29 -0.31 1.98 1.04 -1.25 -3.65 113.70 111.98 2kd2 s SER 143 Ca 0.05 -1.25 -0.01 0.00 0.48 0.00 0.00 55.95 55.22 2kd2 s SER 143 Cb 0.05 -0.27 0.13 0.00 0.10 0.00 0.00 66.02 66.04 2kd2 s SER 143 CO -0.10 -0.35 0.27 -0.69 0.98 0.00 0.00 173.24 173.35 2kd2 s VAL 144 N -2.84 -0.30 0.00 5.02 1.01 -1.25 -4.64 120.40 117.40 2kd2 s VAL 144 Ca 0.32 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.62 2kd2 s VAL 144 Cb 0.05 -0.95 0.00 0.00 0.00 0.00 0.00 36.38 35.48 2kd2 s VAL 144 CO 0.15 -0.57 0.00 0.61 0.00 0.00 0.00 175.10 175.30 2kd2 n GLY 145 N 5.07 0.94 1.07 4.51 0.00 -1.26 -1.73 105.19 113.79 2kd2 n GLY 145 Ca 0.00 0.45 0.02 0.00 0.00 0.00 0.00 46.02 46.50 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 3.92 0.62 -3.64 1.61 2.85 -1.26 -5.10 115.26 114.26 2kd2 n ASN 146 Ca 0.00 -2.04 -0.18 0.00 -0.11 0.00 0.00 54.58 52.25 2kd2 n ASN 146 Cb 0.00 -0.26 -0.02 0.00 1.24 0.00 0.00 39.78 40.73 2kd2 n ASN 146 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 2kd2 n HIS 147 N 0.26 0.01 -3.64 1.20 8.25 -0.70 -5.15 115.22 115.45 2kd2 n HIS 147 Ca 0.04 -1.45 -0.21 0.00 -0.26 0.00 0.00 57.72 55.83 2kd2 n HIS 147 Cb 0.96 -0.23 -0.17 0.00 1.12 0.00 0.00 29.99 31.67 2kd2 n HIS 147 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2kd2 s ASP 148 N -2.78 1.43 0.05 0.41 -1.08 -1.26 -3.85 116.67 109.60 2kd2 s ASP 148 Ca 0.08 -0.09 -0.04 0.00 -0.52 0.00 0.00 52.55 51.98 2kd2 s ASP 148 Cb -0.01 -0.07 -0.02 0.00 -1.46 0.00 0.00 42.92 41.37 2kd2 s ASP 148 CO 0.05 -0.28 0.05 0.00 0.52 0.00 0.00 175.17 175.51 2kd2 s TYR 150 N -3.45 -0.33 -0.38 0.00 1.13 -0.49 -3.63 117.35 110.20 2kd2 s TYR 150 Ca 0.02 0.68 -0.16 0.00 -1.41 0.00 0.00 57.07 56.21 2kd2 s TYR 150 Cb 0.04 0.14 0.01 0.00 -1.10 0.00 0.00 41.96 41.05 2kd2 s TYR 150 CO -0.08 -0.32 0.37 0.42 -2.51 0.00 0.00 175.55 173.42 2kd2 s ILE 151 N -0.61 5.16 -0.66 -3.49 1.01 -1.17 -0.73 121.20 120.72 2kd2 s ILE 151 Ca -0.07 -0.24 -0.28 0.00 0.00 0.00 0.00 60.65 60.06 2kd2 s ILE 151 Cb -0.04 -3.91 0.03 0.00 0.01 0.00 0.00 42.46 38.55 2kd2 s ILE 151 CO 0.03 -0.24 1.26 -0.75 0.00 0.00 0.00 174.94 175.23 2kd2 s LYS 152 N 1.98 3.33 -0.03 2.79 2.20 0.92 -3.19 119.74 127.73 2kd2 s LYS 152 Ca 0.10 0.02 -0.05 0.00 -0.36 0.00 0.00 55.97 55.67 2kd2 s LYS 152 Cb -0.17 -4.11 -0.04 0.00 -1.51 0.00 0.00 37.83 32.00 2kd2 s LYS 152 CO 0.12 -1.95 0.21 0.00 -0.36 0.00 0.00 175.35 173.37 2kd2 s ALA 153 N 5.46 3.90 -0.06 3.13 0.00 -1.12 -0.02 121.76 133.04 2kd2 s ALA 153 Ca 0.40 -0.66 -0.02 0.00 0.00 0.00 0.00 51.96 51.68 2kd2 s ALA 153 Cb -0.08 -1.98 0.04 0.00 0.00 0.00 0.00 23.12 21.10 2kd2 s ALA 153 CO 0.20 0.68 0.12 0.08 0.00 0.00 0.00 175.76 176.83 2kd2 s VAL 154 N -1.23 -0.14 -0.01 0.00 1.01 -0.15 -2.12 120.40 117.75 2kd2 s VAL 154 Ca 0.24 0.30 -0.13 0.00 0.00 0.00 0.00 61.98 62.39 2kd2 s VAL 154 Cb -0.13 -0.22 -0.05 0.00 0.00 0.00 0.00 36.38 35.98 2kd2 s VAL 154 CO 0.14 0.12 0.37 -0.94 0.00 0.00 0.00 175.10 174.79 2kd2 s SER 155 N 1.76 6.73 -0.02 3.32 1.04 -1.26 -1.23 113.70 124.05 2kd2 s SER 155 Ca -0.02 0.88 0.02 0.00 0.48 0.00 0.00 55.95 57.30 2kd2 s SER 155 Cb -0.12 -2.22 0.01 0.00 0.10 0.00 0.00 66.02 63.79 2kd2 s SER 155 CO -0.05 0.33 -0.06 -0.55 0.98 0.00 0.00 173.24 173.89 2kd2 s SER 156 N -1.13 0.87 0.00 7.02 0.15 0.80 -4.90 113.70 116.52 2kd2 s SER 156 Ca 0.23 -0.13 0.00 0.00 0.70 0.00 0.00 55.95 56.75 2kd2 s SER 156 Cb -0.16 -0.24 0.00 0.00 -1.71 0.00 0.00 66.02 63.91 2kd2 s SER 156 CO 0.12 0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.20 2kd2 n GLY 157 N 3.38 0.52 0.12 9.45 0.00 -1.26 -1.15 105.19 116.24 2kd2 n GLY 157 Ca -0.18 -1.57 -0.17 0.00 0.00 0.00 0.00 46.02 44.09 2kd2 n GLY 157 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2kd2 h LYS 158 N 0.00 0.20 0.00 1.61 3.64 -1.98 -3.47 116.57 116.57 2kd2 h LYS 158 Ca 0.00 -0.34 0.00 0.00 -1.27 0.00 0.00 60.65 59.04 2kd2 h LYS 158 Cb 0.00 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 2kd2 h LYS 158 CO 0.00 1.00 0.00 0.54 -2.27 0.00 0.00 179.45 178.72 2kd2 n ARG 159 N -3.36 0.00 -2.31 1.90 1.74 -1.26 -5.00 116.66 108.37 2kd2 n ARG 159 Ca -0.24 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 56.81 2kd2 n ARG 159 Cb 1.05 -0.05 0.09 0.00 -1.02 0.00 0.00 32.46 32.53 2kd2 n ARG 159 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 2kd2 n LYS 160 N -2.25 1.08 0.00 5.56 2.85 -1.26 -4.91 118.16 119.22 2kd2 n LYS 160 Ca 0.00 -1.21 0.00 0.00 -1.05 0.00 0.00 58.31 56.05 2kd2 n LYS 160 Cb 0.00 0.41 0.00 0.00 -0.65 0.00 0.00 35.03 34.79 2kd2 n LYS 160 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2kd2 n GLU 161 N -1.20 0.00 -4.42 -1.58 2.13 -1.24 -4.77 120.64 109.57 2kd2 n GLU 161 Ca -0.20 0.49 -0.24 0.00 0.66 0.00 0.00 57.16 57.87 2kd2 n GLU 161 Cb 0.84 -1.47 -0.17 0.00 0.27 0.00 0.00 31.44 30.92 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 -0.94 0.76 0.09 8.31 0.00 -0.30 -5.02 107.32 110.21 2kd2 s GLY 162 Ca 0.00 -0.39 0.10 0.00 0.00 0.00 0.00 44.72 44.43 2kd2 s GLY 162 CO 0.00 0.28 -0.26 -0.42 0.00 0.00 0.00 173.10 172.70 2kd2 s ILE 163 N 0.87 2.16 -0.05 0.90 1.01 -1.26 -0.14 121.20 124.69 2kd2 s ILE 163 Ca -0.11 -1.57 0.02 0.00 0.00 0.00 0.00 60.65 58.98 2kd2 s ILE 163 Cb -0.15 -1.89 0.02 0.00 0.01 0.00 0.00 42.46 40.45 2kd2 s ILE 163 CO 0.01 0.20 -0.08 -0.63 0.00 0.00 0.00 174.94 174.44 2kd2 s ILE 164 N -0.95 0.79 -0.12 2.92 1.01 -0.36 -4.47 121.20 120.02 2kd2 s ILE 164 Ca 0.12 -0.28 -0.02 0.00 0.00 0.00 0.00 60.65 60.47 2kd2 s ILE 164 Cb -0.10 -0.76 -0.03 0.00 0.01 0.00 0.00 42.46 41.58 2kd2 s ILE 164 CO 0.04 0.28 -0.03 -1.00 0.00 0.00 0.00 174.94 174.23 2kd2 s HIS 165 N 0.76 3.04 -0.23 3.97 3.76 -1.26 -0.98 115.29 124.34 2kd2 s HIS 165 Ca -0.13 -0.08 0.01 0.00 -0.15 0.00 0.00 55.06 54.71 2kd2 s HIS 165 Cb -0.15 -1.86 0.06 0.00 1.11 0.00 0.00 32.58 31.74 2kd2 s HIS 165 CO 0.02 0.19 -0.06 0.95 -0.85 0.00 0.00 174.74 174.99 2kd2 s THR 166 N -0.24 1.57 0.24 1.30 -4.23 0.97 -4.95 115.64 110.30 2kd2 s THR 166 Ca 0.04 -1.24 -0.30 0.00 -1.18 0.00 0.00 61.69 59.02 2kd2 s THR 166 Cb -0.13 -1.82 -0.10 0.00 1.34 0.00 0.00 72.50 71.79 2kd2 s THR 166 CO 0.02 -0.09 1.38 -0.22 -0.54 0.00 0.00 174.62 175.18 2kd2 s LEU 167 N 1.38 4.40 -0.23 4.79 2.96 -1.26 -0.06 118.68 130.66 2kd2 s LEU 167 Ca -0.06 2.58 -0.03 0.00 -0.22 0.00 0.00 54.13 56.40 2kd2 s LEU 167 Cb -0.19 -3.62 0.08 0.00 0.50 0.00 0.00 46.19 42.96 2kd2 s LEU 167 CO -0.06 -0.62 0.08 -0.63 -1.32 0.00 0.00 176.35 173.80 2kd2 s ILE 168 N -0.10 0.28 -0.16 6.68 1.01 0.09 -0.56 121.20 128.44 2kd2 s ILE 168 Ca 0.57 -0.63 -0.04 0.00 0.00 0.00 0.00 60.65 60.55 2kd2 s ILE 168 Cb -0.40 -1.00 -0.03 0.00 0.01 0.00 0.00 42.46 41.05 2kd2 s ILE 168 CO 0.43 -0.42 -0.04 -0.69 0.00 0.00 0.00 174.94 174.22 2kd2 s VAL 169 N 1.95 3.83 -1.12 2.92 1.01 -0.92 -1.39 120.40 126.68 2kd2 s VAL 169 Ca 0.04 -0.38 -0.07 0.00 0.00 0.00 0.00 61.98 61.58 2kd2 s VAL 169 Cb -0.17 -2.68 0.01 0.00 0.00 0.00 0.00 36.38 33.54 2kd2 s VAL 169 CO -0.18 0.48 0.97 -0.67 0.00 0.00 0.00 175.10 175.71 2kd2 n ASP 170 N 3.66 -5.21 -3.71 3.32 2.03 -1.10 -2.52 116.55 113.01 2kd2 n ASP 170 Ca -0.17 -0.46 -0.25 0.00 0.52 0.00 0.00 54.79 54.43 2kd2 n ASP 170 Cb 0.52 -4.30 0.05 0.00 -0.72 0.00 0.00 41.12 36.68 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 -2.34 -4.53 -3.73 1.67 4.05 -1.26 -4.99 115.26 104.13 2kd2 n ASN 171 Ca -0.02 -0.68 -0.17 0.00 0.45 0.00 0.00 54.58 54.16 2kd2 n ASN 171 Cb 0.56 -4.47 -0.16 0.00 1.23 0.00 0.00 39.78 36.93 2kd2 n ASN 171 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 2kd2 s ARG 172 N -6.27 -0.04 0.50 1.20 0.52 -1.05 -5.14 118.95 108.67 2kd2 s ARG 172 Ca 0.46 0.28 -0.23 0.00 -0.52 0.00 0.00 55.73 55.72 2kd2 s ARG 172 Cb -0.22 -0.33 -0.06 0.00 0.52 0.00 0.00 34.95 34.86 2kd2 s ARG 172 CO 0.78 -0.23 1.34 -2.00 0.02 0.00 0.00 175.30 175.21 2kd2 s GLU 173 N 1.48 3.43 -0.08 3.54 2.12 -1.26 -2.17 118.70 125.76 2kd2 s GLU 173 Ca -0.04 2.19 0.04 0.00 0.36 0.00 0.00 54.97 57.52 2kd2 s GLU 173 Cb -0.13 -2.41 0.00 0.00 0.26 0.00 0.00 34.13 31.86 2kd2 s GLU 173 CO -0.03 -0.95 -0.19 0.42 -0.54 0.00 0.00 175.26 173.97 2kd2 s ILE 174 N -1.32 1.68 0.15 -3.70 -1.09 0.27 -4.90 121.20 112.29 2kd2 s ILE 174 Ca 0.67 -0.81 -0.31 0.00 -2.23 0.00 0.00 60.65 57.97 2kd2 s ILE 174 Cb -0.39 -1.46 -0.08 0.00 -1.58 0.00 0.00 42.46 38.95 2kd2 s ILE 174 CO 0.48 0.48 1.33 -2.16 -1.23 0.00 0.00 174.94 173.83 2kd2 s PRO 175 N 0.35 4.36 0.46 2.79 0.04 -1.26 -4.29 135.00 137.44 2kd2 s PRO 175 Ca -0.14 2.04 -0.00 0.00 0.04 0.00 0.00 61.00 62.94 2kd2 s PRO 175 Cb -0.16 -3.23 -0.01 0.00 0.04 0.00 0.00 34.50 31.15 2kd2 s PRO 175 CO 0.06 -0.33 0.69 -2.00 0.04 0.00 0.00 177.00 175.45 2kd2 s GLU 176 N 0.48 3.10 -0.74 4.56 -6.30 -1.26 -4.27 118.70 114.27 2kd2 s GLU 176 Ca 0.60 -0.41 -0.26 0.00 -2.50 0.00 0.00 54.97 52.40 2kd2 s GLU 176 Cb -0.36 -2.54 0.04 0.00 0.00 0.00 0.00 34.13 31.27 2kd2 s GLU 176 CO 0.34 -0.27 1.24 -0.51 0.02 0.00 0.00 175.26 176.07 2kd2 s LEU 177 N -4.58 3.38 -0.28 2.70 2.01 0.07 -4.83 118.68 117.15 2kd2 s LEU 177 Ca 0.48 -0.58 0.08 0.00 0.01 0.00 0.00 54.13 54.12 2kd2 s LEU 177 Cb -0.10 -2.54 0.45 0.00 0.01 0.00 0.00 46.19 44.02 2kd2 s LEU 177 CO 0.39 -1.76 1.30 0.35 1.01 0.00 0.00 176.35 177.63 2kd2 n THR 178 N 6.32 2.47 0.00 5.49 -2.24 -1.26 -4.76 114.28 120.30 2kd2 n THR 178 Ca 0.03 -3.49 0.00 0.00 -2.27 0.00 0.00 64.05 58.32 2kd2 n THR 178 Cb 0.48 -0.63 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 2kd2 n THR 178 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50