#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kd2 h PRO 87 N 0.00 0.51 -5.97 1.61 0.13 -1.99 -3.48 132.00 122.81 2kd2 h PRO 87 Ca 0.00 -0.27 -0.37 0.00 -0.87 0.00 0.00 66.00 64.49 2kd2 h PRO 87 Cb 0.00 0.01 0.12 0.00 0.13 0.00 0.00 31.00 31.26 2kd2 h PRO 87 CO 0.00 0.85 -0.91 -0.11 -0.23 0.00 0.00 178.00 177.59 2kd2 n LEU 88 N -4.01 -3.76 0.00 1.56 0.00 -1.26 -4.58 117.00 104.94 2kd2 n LEU 88 Ca -0.02 -0.92 0.00 0.00 0.00 0.00 0.00 56.01 55.07 2kd2 n LEU 88 Cb 0.53 -2.66 0.00 0.00 0.00 0.00 0.00 43.42 41.28 2kd2 n LEU 88 CO 0.45 0.35 0.00 0.61 0.00 0.00 0.00 177.39 178.80 2kd2 n GLY 89 N -1.53 0.74 1.59 -3.96 0.00 -1.26 -5.15 105.19 95.62 2kd2 n GLY 89 Ca -0.08 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.18 2kd2 n GLY 89 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2kd2 n SER 90 N 0.00 1.43 0.00 1.61 3.41 -1.26 -5.10 113.62 113.71 2kd2 n SER 90 Ca 0.00 -1.73 0.00 0.00 -0.26 0.00 0.00 58.87 56.88 2kd2 n SER 90 Cb 0.00 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 63.88 2kd2 n SER 90 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2kd2 n GLU 91 N -1.20 0.00 -0.04 4.33 1.02 -1.26 -5.05 120.64 118.43 2kd2 n GLU 91 Ca 0.02 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.11 2kd2 n GLU 91 Cb 0.26 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.66 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 -2.16 1.15 -2.25 1.62 4.13 -1.26 -4.98 115.26 111.51 2kd2 n ASN 92 Ca 0.00 0.19 -0.15 0.00 1.68 0.00 0.00 54.58 56.30 2kd2 n ASN 92 Cb 0.00 -0.58 -0.02 0.00 -1.54 0.00 0.00 39.78 37.64 2kd2 n ASN 92 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2kd2 n ARG 93 N -3.65 -1.93 -2.88 3.52 5.12 -1.26 -4.83 116.66 110.75 2kd2 n ARG 93 Ca -0.07 0.75 -0.43 0.00 -1.93 0.00 0.00 57.85 56.17 2kd2 n ARG 93 Cb 0.28 -5.31 -0.04 0.00 -1.16 0.00 0.00 32.46 26.22 2kd2 n ARG 93 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 2kd2 s SER 94 N -2.08 6.56 0.00 0.55 0.01 -1.26 -4.91 113.70 112.58 2kd2 s SER 94 Ca 0.00 0.31 0.00 0.00 1.31 0.00 0.00 55.95 57.57 2kd2 s SER 94 Cb 0.00 -2.43 0.00 0.00 0.21 0.00 0.00 66.02 63.80 2kd2 s SER 94 CO 0.00 -0.87 0.00 0.29 0.41 0.00 0.00 173.24 173.07 2kd2 n LYS 95 N 6.76 0.00 -0.64 12.44 5.02 -1.26 -4.91 118.16 135.57 2kd2 n LYS 95 Ca 0.05 0.24 -0.01 0.00 -2.02 0.00 0.00 58.31 56.57 2kd2 n LYS 95 Cb 0.48 -0.70 -0.01 0.00 -0.02 0.00 0.00 35.03 34.78 2kd2 n LYS 95 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2kd2 n THR 96 N -1.46 0.00 -3.64 -0.18 -2.24 -1.26 -5.10 114.28 100.39 2kd2 n THR 96 Ca 0.00 -0.05 -0.06 0.00 -2.27 0.00 0.00 64.05 61.66 2kd2 n THR 96 Cb 0.00 0.23 -0.07 0.00 -2.10 0.00 0.00 70.33 68.39 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 0.00 -0.17 0.10 4.28 -4.23 -1.26 -3.05 115.64 111.30 2kd2 s THR 97 Ca 0.02 0.01 0.04 0.00 -1.18 0.00 0.00 61.69 60.57 2kd2 s THR 97 Cb 0.02 -0.98 -0.04 0.00 1.34 0.00 0.00 72.50 72.84 2kd2 s THR 97 CO -0.01 0.00 0.08 -0.55 -0.54 0.00 0.00 174.62 173.61 2kd2 s SER 98 N 1.84 5.49 0.03 3.99 0.15 -0.28 -4.96 113.70 119.96 2kd2 s SER 98 Ca -0.09 -0.04 -0.05 0.00 0.70 0.00 0.00 55.95 56.47 2kd2 s SER 98 Cb -0.06 -1.46 -0.01 0.00 -1.71 0.00 0.00 66.02 62.78 2kd2 s SER 98 CO -0.19 0.15 0.07 -0.89 1.20 0.00 0.00 173.24 173.58 2kd2 s THR 99 N -1.45 0.12 -0.17 6.45 2.01 -1.26 -0.11 115.64 121.22 2kd2 s THR 99 Ca 0.29 -1.01 -0.09 0.00 0.31 0.00 0.00 61.69 61.20 2kd2 s THR 99 Cb -0.12 -0.70 0.07 0.00 0.01 0.00 0.00 72.50 71.76 2kd2 s THR 99 CO 0.22 -0.55 0.41 0.26 -0.69 0.00 0.00 174.62 174.26 2kd2 s TRP 100 N -2.18 -0.64 -0.30 4.92 0.51 0.47 -1.88 118.94 119.84 2kd2 s TRP 100 Ca -0.09 1.33 -0.08 0.00 -2.12 0.00 0.00 56.10 55.14 2kd2 s TRP 100 Cb -0.04 0.26 0.00 0.00 -0.81 0.00 0.00 33.47 32.89 2kd2 s TRP 100 CO -0.03 -0.37 0.11 0.08 -0.51 0.00 0.00 176.95 176.22 2kd2 s VAL 101 N 1.71 4.18 0.01 4.03 1.01 -1.26 -0.17 120.40 129.90 2kd2 s VAL 101 Ca -0.07 -0.61 -0.02 0.00 0.00 0.00 0.00 61.98 61.28 2kd2 s VAL 101 Cb -0.09 -3.15 -0.01 0.00 0.00 0.00 0.00 36.38 33.13 2kd2 s VAL 101 CO -0.13 0.07 0.02 -1.48 0.00 0.00 0.00 175.10 173.58 2kd2 s LEU 102 N 1.54 2.01 -0.89 3.92 2.34 -0.58 -4.92 118.68 122.10 2kd2 s LEU 102 Ca 0.03 -0.29 -0.25 0.00 0.06 0.00 0.00 54.13 53.68 2kd2 s LEU 102 Cb -0.17 0.22 -0.02 0.00 -0.56 0.00 0.00 46.19 45.66 2kd2 s LEU 102 CO 0.04 -0.24 1.78 -0.13 -1.06 0.00 0.00 176.35 176.74 2kd2 s ARG 103 N -1.06 2.85 0.15 1.48 0.52 -1.26 0.06 118.95 121.69 2kd2 s ARG 103 Ca -0.12 -0.38 0.10 0.00 -0.52 0.00 0.00 55.73 54.82 2kd2 s ARG 103 Cb -0.07 -5.00 -0.04 0.00 0.52 0.00 0.00 34.95 30.36 2kd2 s ARG 103 CO -0.00 -2.94 -0.23 -1.17 0.02 0.00 0.00 175.30 170.97 2kd2 s LEU 104 N 8.47 2.36 -0.80 2.53 0.20 0.11 -4.65 118.68 126.90 2kd2 s LEU 104 Ca 0.62 -0.78 0.00 0.00 0.69 0.00 0.00 54.13 54.66 2kd2 s LEU 104 Cb -0.06 -1.06 0.00 0.00 -0.43 0.00 0.00 46.19 44.64 2kd2 s LEU 104 CO 0.01 0.10 0.00 -0.67 -0.29 0.00 0.00 176.35 175.49 2kd2 n ASP 105 N 0.68 -5.11 0.00 3.68 -0.08 -1.26 -1.26 116.55 113.20 2kd2 n ASP 105 Ca -0.16 0.19 0.00 0.00 -1.51 0.00 0.00 54.79 53.31 2kd2 n ASP 105 Cb 0.55 -3.27 0.00 0.00 2.34 0.00 0.00 41.12 40.73 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 -0.47 0.77 3.23 0.27 0.00 -1.26 -5.02 105.19 102.71 2kd2 n GLY 106 Ca -0.08 0.00 -0.15 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 -0.46 1.38 -0.91 1.61 2.02 -0.39 -5.07 118.70 116.88 2kd2 s GLU 107 Ca 0.00 -1.76 -0.25 0.00 0.02 0.00 0.00 54.97 52.99 2kd2 s GLU 107 Cb 0.00 0.26 -0.06 0.00 0.10 0.00 0.00 34.13 34.43 2kd2 s GLU 107 CO 0.00 -0.47 1.99 -0.51 0.02 0.00 0.00 175.26 176.29 2kd2 s ASP 108 N -3.23 5.01 0.00 -0.19 1.01 -1.26 0.05 116.67 118.06 2kd2 s ASP 108 Ca 0.39 -0.68 -0.30 0.00 0.71 0.00 0.00 52.55 52.67 2kd2 s ASP 108 Cb 0.06 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 41.38 2kd2 s ASP 108 CO 0.17 -2.89 1.17 -0.22 0.21 0.00 0.00 175.17 173.62 2kd2 s LEU 109 N 10.62 4.33 -0.37 1.23 2.96 0.11 -4.88 118.68 132.68 2kd2 s LEU 109 Ca 0.72 1.89 -0.10 0.00 -0.22 0.00 0.00 54.13 56.42 2kd2 s LEU 109 Cb -0.07 -3.57 0.03 0.00 0.50 0.00 0.00 46.19 43.08 2kd2 s LEU 109 CO 0.01 -0.49 0.19 -0.60 -1.32 0.00 0.00 176.35 174.13 2kd2 s ARG 110 N 1.56 2.79 -0.04 1.98 3.52 -1.26 -1.52 118.95 125.97 2kd2 s ARG 110 Ca 0.57 -1.10 -0.12 0.00 -0.13 0.00 0.00 55.73 54.95 2kd2 s ARG 110 Cb -0.26 -3.67 -0.05 0.00 -1.56 0.00 0.00 34.95 29.40 2kd2 s ARG 110 CO 0.26 -0.69 0.32 0.08 -0.81 0.00 0.00 175.30 174.46 2kd2 s VAL 111 N 1.52 5.19 -0.04 7.11 1.01 0.76 -3.74 120.40 132.22 2kd2 s VAL 111 Ca 0.01 0.63 0.01 0.00 0.00 0.00 0.00 61.98 62.63 2kd2 s VAL 111 Cb -0.19 -3.61 0.02 0.00 0.00 0.00 0.00 36.38 32.60 2kd2 s VAL 111 CO 0.06 0.59 -0.02 -0.69 0.00 0.00 0.00 175.10 175.04 2kd2 s VAL 112 N -1.02 0.34 -0.32 2.92 1.01 0.14 -0.39 120.40 123.08 2kd2 s VAL 112 Ca 0.21 -0.01 0.02 0.00 0.00 0.00 0.00 61.98 62.19 2kd2 s VAL 112 Cb -0.15 -0.40 0.08 0.00 0.00 0.00 0.00 36.38 35.91 2kd2 s VAL 112 CO 0.10 0.18 0.02 -0.22 0.00 0.00 0.00 175.10 175.18 2kd2 s LEU 113 N 0.94 4.33 -0.13 3.92 2.96 0.84 -0.09 118.68 131.44 2kd2 s LEU 113 Ca -0.11 -1.78 -0.28 0.00 -0.22 0.00 0.00 54.13 51.74 2kd2 s LEU 113 Cb -0.14 -1.65 -0.01 0.00 0.50 0.00 0.00 46.19 44.89 2kd2 s LEU 113 CO -0.01 -0.33 0.94 -0.70 -1.32 0.00 0.00 176.35 174.93 2kd2 s GLU 114 N 1.05 4.37 0.38 1.98 2.56 -0.93 -1.13 118.70 126.99 2kd2 s GLU 114 Ca 0.02 1.26 0.27 0.00 0.00 0.00 0.00 54.97 56.52 2kd2 s GLU 114 Cb -0.20 -3.56 1.34 0.00 2.00 0.00 0.00 34.13 33.71 2kd2 s GLU 114 CO -0.05 -0.33 1.81 1.57 -0.56 0.00 0.00 175.26 177.70 2kd2 h LYS 115 N 7.18 0.00 -0.06 4.30 5.09 -1.88 0.31 116.57 131.50 2kd2 h LYS 115 Ca -0.30 0.00 0.04 0.00 0.09 0.00 0.00 60.65 60.48 2kd2 h LYS 115 Cb 1.14 0.00 -0.06 0.00 0.10 0.00 0.00 32.23 33.41 2kd2 h LYS 115 CO 0.85 0.00 -0.36 -0.44 -2.09 0.00 0.00 179.45 177.41 2kd2 h ASP 116 N 0.00 -1.10 0.00 7.07 5.19 -1.91 -3.31 116.42 122.35 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 0.45 0.00 0.00 0.18 0.00 0.00 39.33 40.10 2kd2 h ASP 116 CO 0.00 -0.40 -0.22 0.41 -3.12 0.00 0.00 179.24 175.90 2kd2 n THR 117 N -5.43 0.59 -2.64 0.35 -1.04 -1.15 -4.99 114.28 99.97 2kd2 n THR 117 Ca -0.04 -0.69 -0.18 0.00 -2.04 0.00 0.00 64.05 61.11 2kd2 n THR 117 Cb 0.34 0.41 -0.00 0.00 -1.82 0.00 0.00 70.33 69.26 2kd2 n THR 117 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 2kd2 n MET 118 N -0.42 -2.65 -3.16 -2.82 2.81 0.11 -4.94 117.12 106.05 2kd2 n MET 118 Ca 0.04 0.73 -0.34 0.00 -1.81 0.00 0.00 57.70 56.32 2kd2 n MET 118 Cb 0.60 -5.41 -0.06 0.00 -0.71 0.00 0.00 33.22 27.64 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 -2.23 6.89 -0.12 7.83 2.15 -1.18 -4.85 116.67 125.16 2kd2 s ASP 119 Ca 0.10 1.30 -0.04 0.00 0.43 0.00 0.00 52.55 54.34 2kd2 s ASP 119 Cb -0.05 -2.38 -0.04 0.00 -0.30 0.00 0.00 42.92 40.16 2kd2 s ASP 119 CO 0.12 -0.07 0.04 -0.69 -0.17 0.00 0.00 175.17 174.41 2kd2 s VAL 120 N -1.73 4.66 -0.08 1.11 1.01 -1.26 -2.19 120.40 121.92 2kd2 s VAL 120 Ca 0.47 -0.11 0.03 0.00 0.00 0.00 0.00 61.98 62.37 2kd2 s VAL 120 Cb -0.13 -3.01 0.01 0.00 0.00 0.00 0.00 36.38 33.25 2kd2 s VAL 120 CO 0.19 0.58 -0.16 0.86 0.00 0.00 0.00 175.10 176.56 2kd2 s TRP 121 N -0.62 1.87 -0.02 5.22 -0.00 0.87 -0.95 118.94 125.31 2kd2 s TRP 121 Ca 0.11 -0.74 0.00 0.00 -0.00 0.00 0.00 56.10 55.48 2kd2 s TRP 121 Cb -0.12 -1.31 0.02 0.00 -0.00 0.00 0.00 33.47 32.06 2kd2 s TRP 121 CO 0.02 -0.34 -0.00 0.00 -0.00 0.00 0.00 176.95 176.63 2kd2 n ASN 123 N 3.71 -0.23 -3.96 0.00 5.03 -1.24 -0.51 115.26 118.06 2kd2 n ASN 123 Ca -0.22 -1.08 -0.29 0.00 0.87 0.00 0.00 54.58 53.87 2kd2 n ASN 123 Cb 0.54 -2.66 0.00 0.00 -1.02 0.00 0.00 39.78 36.64 2kd2 n ASN 123 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2kd2 n GLY 124 N -2.08 -0.39 3.03 7.41 0.00 -1.26 -4.96 105.19 106.94 2kd2 n GLY 124 Ca -0.28 0.16 -0.13 0.00 0.00 0.00 0.00 46.02 45.77 2kd2 n GLY 124 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kd2 s GLN 125 N -6.56 0.19 0.25 1.61 -1.52 0.33 -5.13 119.66 108.83 2kd2 s GLN 125 Ca 0.42 0.76 -0.30 0.00 -1.95 0.00 0.00 55.36 54.28 2kd2 s GLN 125 Cb -0.22 -0.05 -0.14 0.00 -0.22 0.00 0.00 33.01 32.38 2kd2 s GLN 125 CO 0.86 -0.32 1.28 1.63 -0.25 0.00 0.00 175.29 178.50 2kd2 n LYS 126 N 5.36 1.80 -3.62 2.91 5.02 -1.26 -2.40 118.16 125.96 2kd2 n LYS 126 Ca -0.06 0.64 -0.20 0.00 -2.02 0.00 0.00 58.31 56.66 2kd2 n LYS 126 Cb 0.50 -2.21 -0.02 0.00 -0.02 0.00 0.00 35.03 33.28 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 -0.83 2.94 -0.34 1.97 -1.94 -0.12 -4.91 119.30 116.07 2kd2 s MET 127 Ca 0.65 -1.14 -0.03 0.00 -1.71 0.00 0.00 55.69 53.46 2kd2 s MET 127 Cb -0.68 -2.67 0.07 0.00 2.01 0.00 0.00 34.83 33.56 2kd2 s MET 127 CO 0.54 0.08 0.08 -1.21 -0.01 0.00 0.00 175.02 174.49 2kd2 s GLU 128 N -4.09 2.34 0.31 2.03 2.02 -1.26 -4.63 118.70 115.41 2kd2 s GLU 128 Ca 0.43 -1.41 0.05 0.00 0.02 0.00 0.00 54.97 54.06 2kd2 s GLU 128 Cb -0.08 -3.35 0.05 0.00 0.10 0.00 0.00 34.13 30.86 2kd2 s GLU 128 CO 0.29 -0.76 0.43 0.25 0.02 0.00 0.00 175.26 175.49 2kd2 n THR 129 N 4.65 0.00 -0.02 3.63 -2.24 -1.26 -3.90 114.28 115.14 2kd2 n THR 129 Ca -0.10 -1.03 -0.02 0.00 -2.27 0.00 0.00 64.05 60.63 2kd2 n THR 129 Cb 0.43 -0.74 -0.04 0.00 -2.10 0.00 0.00 70.33 67.88 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 -2.65 1.89 -2.80 6.98 0.00 -0.62 -4.76 120.51 118.55 2kd2 n ALA 130 Ca -0.07 -0.32 -0.17 0.00 0.00 0.00 0.00 53.44 52.87 2kd2 n ALA 130 Cb 0.32 0.13 -0.00 0.00 0.00 0.00 0.00 19.45 19.90 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 2.67 -0.50 3.52 0.00 0.00 -1.22 -4.80 105.19 104.85 2kd2 n GLY 131 Ca -0.08 0.05 -0.46 0.00 0.00 0.00 0.00 46.02 45.53 2kd2 n GLY 131 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2kd2 n GLU 132 N -3.26 1.41 -2.77 1.61 2.13 -0.83 -4.70 120.64 114.23 2kd2 n GLU 132 Ca -0.11 0.36 -0.43 0.00 0.66 0.00 0.00 57.16 57.65 2kd2 n GLU 132 Cb 0.59 -2.84 -0.03 0.00 0.27 0.00 0.00 31.44 29.43 2kd2 n GLU 132 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 2kd2 s PHE 133 N 8.19 3.15 0.50 4.31 2.19 -1.26 -1.01 117.98 134.05 2kd2 s PHE 133 Ca 1.06 0.99 0.08 0.00 0.33 0.00 0.00 56.93 59.39 2kd2 s PHE 133 Cb -0.60 -3.54 0.08 0.00 -1.31 0.00 0.00 43.02 37.66 2kd2 s PHE 133 CO 0.41 -0.72 0.68 1.33 1.83 0.00 0.00 175.22 178.75 2kd2 n VAL 134 N 5.79 0.00 -0.09 3.12 0.24 -0.89 -4.98 118.33 121.52 2kd2 n VAL 134 Ca 0.08 -1.68 0.23 0.00 -2.04 0.00 0.00 64.34 60.93 2kd2 n VAL 134 Cb 0.48 -0.56 0.68 0.00 -1.47 0.00 0.00 33.84 32.97 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 0.11 0.05 -1.07 -1.34 5.19 -2.05 -3.35 116.42 113.95 2kd2 h ASP 135 Ca -0.24 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.11 2kd2 h ASP 135 Cb 1.08 -0.01 -0.20 0.00 0.18 0.00 0.00 39.33 40.38 2kd2 h ASP 135 CO 0.34 0.02 -0.45 1.51 -3.12 0.00 0.00 179.24 177.54 2kd2 s ASP 136 N -5.95 -1.37 0.00 6.45 -4.77 -1.26 -5.14 116.67 104.63 2kd2 s ASP 136 Ca -0.05 -0.67 0.00 0.00 -3.30 0.00 0.00 52.55 48.53 2kd2 s ASP 136 Cb 0.21 1.89 0.00 0.00 -1.09 0.00 0.00 42.92 43.92 2kd2 s ASP 136 CO 0.75 -0.20 0.00 0.61 0.70 0.00 0.00 175.17 177.03 2kd2 n GLY 137 N 4.58 1.15 2.89 2.12 0.00 -1.26 -4.56 105.19 110.11 2kd2 n GLY 137 Ca 0.10 -2.14 -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 -1.10 0.49 -0.53 2.61 2.01 -1.22 -2.09 115.64 115.80 2kd2 s THR 138 Ca 0.00 -0.11 -0.06 0.00 0.31 0.00 0.00 61.69 61.82 2kd2 s THR 138 Cb 0.00 -0.51 0.14 0.00 0.01 0.00 0.00 72.50 72.14 2kd2 s THR 138 CO 0.00 0.21 0.37 -1.61 -0.69 0.00 0.00 174.62 172.90 2kd2 s GLU 139 N 0.80 2.48 -0.46 4.92 2.02 -0.18 -2.22 118.70 126.05 2kd2 s GLU 139 Ca -0.10 -2.07 -0.29 0.00 0.02 0.00 0.00 54.97 52.53 2kd2 s GLU 139 Cb -0.13 -3.83 0.03 0.00 0.10 0.00 0.00 34.13 30.30 2kd2 s GLU 139 CO 0.00 -1.17 1.18 0.95 0.02 0.00 0.00 175.26 176.24 2kd2 s THR 140 N 0.78 4.17 -0.33 3.63 -4.23 -1.11 -1.96 115.64 116.59 2kd2 s THR 140 Ca 0.11 1.20 -0.09 0.00 -1.18 0.00 0.00 61.69 61.72 2kd2 s THR 140 Cb -0.22 -4.55 0.01 0.00 1.34 0.00 0.00 72.50 69.08 2kd2 s THR 140 CO -0.03 -0.96 0.15 -1.00 -0.54 0.00 0.00 174.62 172.24 2kd2 s HIS 141 N 4.58 3.20 0.38 3.99 3.76 -1.26 -1.97 115.29 127.98 2kd2 s HIS 141 Ca 0.50 -0.87 0.05 0.00 -0.15 0.00 0.00 55.06 54.59 2kd2 s HIS 141 Cb -0.08 -2.36 -0.02 0.00 1.11 0.00 0.00 32.58 31.23 2kd2 s HIS 141 CO 0.32 -0.57 0.19 -0.59 -0.85 0.00 0.00 174.74 173.23 2kd2 s PHE 142 N 1.55 1.77 0.09 1.40 -0.12 -1.24 -1.59 117.98 119.84 2kd2 s PHE 142 Ca 0.03 -1.45 -0.01 0.00 -0.05 0.00 0.00 56.93 55.44 2kd2 s PHE 142 Cb -0.18 -0.98 -0.04 0.00 -0.63 0.00 0.00 43.02 41.19 2kd2 s PHE 142 CO 0.05 -0.54 0.02 -1.54 -0.05 0.00 0.00 175.22 173.17 2kd2 s SER 143 N -3.53 0.38 -0.29 1.98 1.04 -1.26 -4.03 113.70 108.00 2kd2 s SER 143 Ca 0.29 -1.08 -0.01 0.00 0.48 0.00 0.00 55.95 55.64 2kd2 s SER 143 Cb 0.02 0.25 0.13 0.00 0.10 0.00 0.00 66.02 66.53 2kd2 s SER 143 CO 0.20 -0.67 0.28 -0.69 0.98 0.00 0.00 173.24 173.34 2kd2 s VAL 144 N -3.98 -0.37 0.00 5.02 1.01 -1.26 -4.75 120.40 116.07 2kd2 s VAL 144 Ca 0.15 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.59 2kd2 s VAL 144 Cb 0.08 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.48 2kd2 s VAL 144 CO -0.04 -0.50 0.00 0.61 0.00 0.00 0.00 175.10 175.17 2kd2 n GLY 145 N 5.25 1.38 0.03 4.51 0.00 -1.26 -2.56 105.19 112.53 2kd2 n GLY 145 Ca -0.02 0.16 -0.01 0.00 0.00 0.00 0.00 46.02 46.16 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 10.46 2.91 -2.71 1.61 2.85 -1.26 -5.03 115.26 124.10 2kd2 n ASN 146 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2kd2 n ASN 146 Cb 0.00 0.97 0.00 0.00 1.24 0.00 0.00 39.78 41.99 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 -2.13 -2.58 -3.65 1.20 8.25 -1.06 -5.07 115.22 110.17 2kd2 n HIS 147 Ca -0.09 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.26 2kd2 n HIS 147 Cb 0.58 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.58 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 -1.70 0.04 0.09 0.41 2.15 -1.26 -4.21 116.67 112.18 2kd2 s ASP 148 Ca 0.00 0.78 -0.04 0.00 0.43 0.00 0.00 52.55 53.72 2kd2 s ASP 148 Cb 0.00 1.05 -0.03 0.00 -0.30 0.00 0.00 42.92 43.65 2kd2 s ASP 148 CO 0.00 -0.24 0.07 0.00 -0.17 0.00 0.00 175.17 174.83 2kd2 s TYR 150 N -3.93 -0.51 -0.38 0.00 1.13 -0.50 -3.59 117.35 109.56 2kd2 s TYR 150 Ca 0.11 0.84 -0.16 0.00 -1.41 0.00 0.00 57.07 56.46 2kd2 s TYR 150 Cb 0.07 0.32 0.00 0.00 -1.10 0.00 0.00 41.96 41.25 2kd2 s TYR 150 CO -0.07 -0.55 0.37 0.42 -2.51 0.00 0.00 175.55 173.21 2kd2 s ILE 151 N -1.32 5.16 -0.66 -3.49 1.01 -0.83 -0.82 121.20 120.25 2kd2 s ILE 151 Ca -0.11 -0.20 -0.27 0.00 0.00 0.00 0.00 60.65 60.07 2kd2 s ILE 151 Cb -0.01 -3.90 0.03 0.00 0.01 0.00 0.00 42.46 38.59 2kd2 s ILE 151 CO 0.08 -0.23 1.21 -0.75 0.00 0.00 0.00 174.94 175.24 2kd2 s LYS 152 N 1.99 3.32 0.06 2.79 2.20 0.95 -2.74 119.74 128.32 2kd2 s LYS 152 Ca 0.10 -0.09 -0.03 0.00 -0.36 0.00 0.00 55.97 55.59 2kd2 s LYS 152 Cb -0.17 -4.11 -0.05 0.00 -1.51 0.00 0.00 37.83 31.99 2kd2 s LYS 152 CO 0.12 -1.91 0.27 0.00 -0.36 0.00 0.00 175.35 173.47 2kd2 s ALA 153 N 5.23 3.90 -0.08 3.13 0.00 -0.94 -0.06 121.76 132.93 2kd2 s ALA 153 Ca 0.37 -0.68 -0.04 0.00 0.00 0.00 0.00 51.96 51.61 2kd2 s ALA 153 Cb -0.09 -1.98 0.04 0.00 0.00 0.00 0.00 23.12 21.09 2kd2 s ALA 153 CO 0.19 0.73 0.18 0.08 0.00 0.00 0.00 175.76 176.94 2kd2 s VAL 154 N -1.48 -0.12 -0.13 0.00 1.01 -0.07 -3.45 120.40 116.16 2kd2 s VAL 154 Ca 0.34 0.21 -0.12 0.00 0.00 0.00 0.00 61.98 62.41 2kd2 s VAL 154 Cb -0.13 -0.30 -0.05 0.00 0.00 0.00 0.00 36.38 35.90 2kd2 s VAL 154 CO 0.23 0.09 0.25 -0.94 0.00 0.00 0.00 175.10 174.73 2kd2 s SER 155 N 1.51 6.45 -0.03 3.32 1.04 -1.26 -1.31 113.70 123.42 2kd2 s SER 155 Ca -0.06 0.53 0.04 0.00 0.48 0.00 0.00 55.95 56.94 2kd2 s SER 155 Cb -0.11 -2.15 -0.01 0.00 0.10 0.00 0.00 66.02 63.84 2kd2 s SER 155 CO -0.07 0.21 -0.15 -0.94 0.98 0.00 0.00 173.24 173.27 2kd2 s SER 156 N -0.11 1.86 0.00 7.02 1.04 0.67 -4.74 113.70 119.44 2kd2 s SER 156 Ca 0.16 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.30 2kd2 s SER 156 Cb -0.13 -0.36 0.00 0.00 0.10 0.00 0.00 66.02 65.63 2kd2 s SER 156 CO 0.04 0.16 0.00 0.61 0.98 0.00 0.00 173.24 175.03 2kd2 n GLY 157 N 2.95 0.87 0.10 7.32 0.00 -1.26 -1.35 105.19 113.82 2kd2 n GLY 157 Ca -0.16 -2.03 -0.20 0.00 0.00 0.00 0.00 46.02 43.63 2kd2 n GLY 157 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kd2 h LYS 158 N 7.67 0.04 -2.05 1.61 1.57 -1.99 -3.43 116.57 119.98 2kd2 h LYS 158 Ca 0.00 -0.07 -0.57 0.00 -1.87 0.00 0.00 60.65 58.14 2kd2 h LYS 158 Cb 0.00 0.03 -0.40 0.00 0.08 0.00 0.00 32.23 31.94 2kd2 h LYS 158 CO 0.00 1.03 -0.98 0.54 -0.57 0.00 0.00 179.45 179.47 2kd2 n ARG 159 N -4.39 1.22 -3.31 3.15 1.74 -1.26 -4.94 116.66 108.87 2kd2 n ARG 159 Ca -0.25 -3.62 -0.17 0.00 -0.77 0.00 0.00 57.85 53.04 2kd2 n ARG 159 Cb 0.67 -1.51 0.06 0.00 -1.02 0.00 0.00 32.46 30.66 2kd2 n ARG 159 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2kd2 n LYS 160 N 1.17 -2.05 0.01 5.56 5.02 -1.26 -4.98 118.16 121.63 2kd2 n LYS 160 Ca 0.24 0.82 -0.01 0.00 -2.02 0.00 0.00 58.31 57.34 2kd2 n LYS 160 Cb 0.51 -5.55 -0.01 0.00 -0.02 0.00 0.00 35.03 29.96 2kd2 n LYS 160 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2kd2 h GLU 161 N -1.16 -0.07 -4.33 1.97 4.39 -1.87 -3.48 114.58 110.04 2kd2 h GLU 161 Ca -0.60 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 58.83 2kd2 h GLU 161 Cb 1.31 0.02 -0.25 0.00 -0.10 0.00 0.00 28.75 29.73 2kd2 h GLU 161 CO 0.44 -0.05 -0.74 0.20 -1.16 0.00 0.00 179.01 177.71 2kd2 s GLY 162 N -2.60 0.33 0.02 -3.84 0.00 -0.45 -5.03 107.32 95.75 2kd2 s GLY 162 Ca -0.01 -0.47 0.06 0.00 0.00 0.00 0.00 44.72 44.30 2kd2 s GLY 162 CO 0.03 -0.48 -0.18 -0.42 0.00 0.00 0.00 173.10 172.05 2kd2 s ILE 163 N -0.78 1.45 -0.05 0.90 1.01 -1.26 -0.23 121.20 122.23 2kd2 s ILE 163 Ca -0.05 -1.00 0.03 0.00 0.00 0.00 0.00 60.65 59.63 2kd2 s ILE 163 Cb -0.06 -1.25 0.01 0.00 0.01 0.00 0.00 42.46 41.17 2kd2 s ILE 163 CO -0.00 0.22 -0.13 -0.63 0.00 0.00 0.00 174.94 174.40 2kd2 s ILE 164 N -0.68 1.17 -0.07 2.92 1.01 -0.43 -4.98 121.20 120.14 2kd2 s ILE 164 Ca 0.06 -0.54 -0.01 0.00 0.00 0.00 0.00 60.65 60.16 2kd2 s ILE 164 Cb -0.08 -1.04 -0.03 0.00 0.01 0.00 0.00 42.46 41.32 2kd2 s ILE 164 CO 0.01 0.35 0.01 -1.00 0.00 0.00 0.00 174.94 174.31 2kd2 s HIS 165 N 0.36 3.15 -0.24 3.97 3.76 -1.26 -0.90 115.29 124.14 2kd2 s HIS 165 Ca -0.09 0.18 -0.02 0.00 -0.15 0.00 0.00 55.06 54.98 2kd2 s HIS 165 Cb -0.13 -1.77 0.07 0.00 1.11 0.00 0.00 32.58 31.87 2kd2 s HIS 165 CO 0.03 0.47 0.05 0.95 -0.85 0.00 0.00 174.74 175.39 2kd2 s THR 166 N -0.94 0.65 0.27 1.30 -4.23 0.92 -4.96 115.64 108.65 2kd2 s THR 166 Ca 0.15 -0.86 -0.30 0.00 -1.18 0.00 0.00 61.69 59.50 2kd2 s THR 166 Cb -0.11 -1.27 -0.10 0.00 1.34 0.00 0.00 72.50 72.36 2kd2 s THR 166 CO 0.04 -0.38 1.44 -0.22 -0.54 0.00 0.00 174.62 174.96 2kd2 s LEU 167 N 1.77 4.38 -0.09 4.79 2.96 -1.26 -0.03 118.68 131.21 2kd2 s LEU 167 Ca 0.03 2.71 -0.02 0.00 -0.22 0.00 0.00 54.13 56.62 2kd2 s LEU 167 Cb -0.17 -3.63 0.04 0.00 0.50 0.00 0.00 46.19 42.93 2kd2 s LEU 167 CO -0.15 -0.71 0.04 -0.63 -1.32 0.00 0.00 176.35 173.59 2kd2 s ILE 168 N -0.20 0.10 -0.13 6.68 1.01 0.00 -0.70 121.20 127.97 2kd2 s ILE 168 Ca 0.58 0.14 0.03 0.00 0.00 0.00 0.00 60.65 61.40 2kd2 s ILE 168 Cb -0.42 -0.42 0.00 0.00 0.01 0.00 0.00 42.46 41.63 2kd2 s ILE 168 CO 0.46 0.09 -0.22 -0.69 0.00 0.00 0.00 174.94 174.58 2kd2 s VAL 169 N 2.07 2.15 -1.27 2.92 1.01 -0.87 -1.41 120.40 125.01 2kd2 s VAL 169 Ca 0.04 -0.96 -0.04 0.00 0.00 0.00 0.00 61.98 61.02 2kd2 s VAL 169 Cb -0.13 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.40 2kd2 s VAL 169 CO -0.05 0.55 0.51 -0.67 0.00 0.00 0.00 175.10 175.44 2kd2 n ASP 170 N 3.85 -5.31 -3.05 3.32 -0.08 -1.17 -2.47 116.55 111.64 2kd2 n ASP 170 Ca -0.19 -0.24 -0.18 0.00 -1.51 0.00 0.00 54.79 52.67 2kd2 n ASP 170 Cb 0.52 -4.15 0.07 0.00 2.34 0.00 0.00 41.12 39.90 2kd2 n ASP 170 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 2kd2 n ASN 171 N -1.73 -4.53 -3.76 1.67 2.85 -1.26 -5.02 115.26 103.47 2kd2 n ASN 171 Ca -0.09 -0.47 -0.15 0.00 -0.11 0.00 0.00 54.58 53.76 2kd2 n ASN 171 Cb 0.60 -4.29 -0.16 0.00 1.24 0.00 0.00 39.78 37.18 2kd2 n ASN 171 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 2kd2 s ARG 172 N -5.79 -0.01 0.53 1.20 0.52 -1.03 -5.14 118.95 109.22 2kd2 s ARG 172 Ca 0.34 0.24 -0.22 0.00 -0.52 0.00 0.00 55.73 55.57 2kd2 s ARG 172 Cb -0.15 -0.24 -0.05 0.00 0.52 0.00 0.00 34.95 35.03 2kd2 s ARG 172 CO 0.60 -0.17 1.31 -2.00 0.02 0.00 0.00 175.30 175.06 2kd2 s GLU 173 N 1.14 3.27 -0.08 3.54 2.12 -1.26 -2.04 118.70 125.38 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 -0.13 -2.28 0.00 0.00 0.26 0.00 0.00 34.13 31.98 2kd2 s GLU 173 CO -0.04 -1.05 -0.20 0.42 -0.54 0.00 0.00 175.26 173.85 2kd2 s ILE 174 N -1.36 1.74 0.29 -3.70 -1.09 0.12 -4.89 121.20 112.31 2kd2 s ILE 174 Ca 0.70 -0.84 -0.29 0.00 -2.23 0.00 0.00 60.65 57.99 2kd2 s ILE 174 Cb -0.38 -1.51 -0.10 0.00 -1.58 0.00 0.00 42.46 38.89 2kd2 s ILE 174 CO 0.45 0.49 1.24 -2.16 -1.23 0.00 0.00 174.94 173.72 2kd2 s PRO 175 N 0.37 4.45 0.33 2.79 0.04 -1.26 -4.36 135.00 137.36 2kd2 s PRO 175 Ca -0.15 2.06 -0.09 0.00 0.04 0.00 0.00 61.00 62.85 2kd2 s PRO 175 Cb -0.16 -3.13 -0.06 0.00 0.04 0.00 0.00 34.50 31.18 2kd2 s PRO 175 CO 0.06 -0.07 0.67 -2.00 0.04 0.00 0.00 177.00 175.71 2kd2 s GLU 176 N -1.39 3.77 0.00 4.56 2.12 -1.26 -4.28 118.70 122.22 2kd2 s GLU 176 Ca 0.49 0.33 0.00 0.00 0.36 0.00 0.00 54.97 56.15 2kd2 s GLU 176 Cb -0.37 -2.51 0.00 0.00 0.26 0.00 0.00 34.13 31.52 2kd2 s GLU 176 CO 0.47 0.11 0.83 -0.11 -0.54 0.00 0.00 175.26 176.02 2kd2 n LEU 177 N -0.90 0.00 -3.93 2.70 7.94 -0.79 -4.86 117.00 117.16 2kd2 n LEU 177 Ca 0.01 0.83 -0.25 0.00 -1.11 0.00 0.00 56.01 55.49 2kd2 n LEU 177 Cb 0.54 -0.33 -0.02 0.00 0.53 0.00 0.00 43.42 44.14 2kd2 n LEU 177 CO 0.46 -0.33 -0.21 0.35 -1.11 0.00 0.00 177.39 176.55 2kd2 n THR 178 N -1.81 -3.21 0.00 1.96 -2.24 -1.26 -5.10 114.28 102.62 2kd2 n THR 178 Ca 0.00 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 2kd2 n THR 178 Cb 0.00 -2.78 0.00 0.00 -2.10 0.00 0.00 70.33 65.45 2kd2 n THR 178 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50