#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 0.84 -6.76 1.61 0.13 -2.10 -3.45 132.00 122.27 2kd2 h PRO 87 Ca 0.00 -0.44 -0.53 0.00 -0.87 0.00 0.00 66.00 64.16 2kd2 h PRO 87 Cb 0.00 0.02 0.06 0.00 0.13 0.00 0.00 31.00 31.21 2kd2 h PRO 87 CO 0.00 1.08 0.78 -1.17 -0.23 0.00 0.00 178.00 178.46 2kd2 s LEU 88 N -8.78 4.38 0.00 1.56 0.20 -1.26 -4.67 118.68 110.11 2kd2 s LEU 88 Ca -0.10 2.73 0.00 0.00 0.69 0.00 0.00 54.13 57.45 2kd2 s LEU 88 Cb 0.11 -3.63 0.00 0.00 -0.43 0.00 0.00 46.19 42.25 2kd2 s LEU 88 CO 0.87 -0.74 0.00 0.61 -0.29 0.00 0.00 176.35 176.79 2kd2 n GLY 89 N 2.13 0.97 3.73 7.98 0.00 -1.26 -5.02 105.19 113.70 2kd2 n GLY 89 Ca 0.07 -1.53 -0.09 0.00 0.00 0.00 0.00 46.02 44.47 2kd2 n GLY 89 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kd2 s SER 90 N -4.00 -0.01 -0.38 1.61 1.04 -1.26 -5.13 113.70 105.57 2kd2 s SER 90 Ca 0.00 -0.93 -0.05 0.00 0.48 0.00 0.00 55.95 55.44 2kd2 s SER 90 Cb 0.00 0.71 0.07 0.00 0.10 0.00 0.00 66.02 66.91 2kd2 s SER 90 CO 0.00 -1.37 0.16 -1.61 0.98 0.00 0.00 173.24 171.40 2kd2 s GLU 91 N -3.45 2.39 0.95 4.02 2.02 -1.26 -5.06 118.70 118.30 2kd2 s GLU 91 Ca 0.18 -1.47 -0.16 0.00 0.02 0.00 0.00 54.97 53.53 2kd2 s GLU 91 Cb -0.04 -3.54 0.22 0.00 0.10 0.00 0.00 34.13 30.88 2kd2 s GLU 91 CO 0.10 -0.87 1.19 0.09 0.02 0.00 0.00 175.26 175.79 2kd2 n ASN 92 N 4.74 -0.30 -4.87 -0.19 3.02 -1.26 -5.10 115.26 111.31 2kd2 n ASN 92 Ca -0.09 -1.38 -0.25 0.00 -0.03 0.00 0.00 54.58 52.83 2kd2 n ASN 92 Cb 0.43 -0.94 -0.02 0.00 -0.61 0.00 0.00 39.78 38.64 2kd2 n ASN 92 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2kd2 s ARG 93 N -5.61 2.29 0.07 3.52 3.00 -1.26 -5.15 118.95 115.81 2kd2 s ARG 93 Ca 0.69 -1.93 -0.26 0.00 0.00 0.00 0.00 55.73 54.23 2kd2 s ARG 93 Cb -0.03 -2.11 0.09 0.00 0.00 0.00 0.00 34.95 32.91 2kd2 s ARG 93 CO 0.49 -0.47 1.18 -1.12 0.00 0.00 0.00 175.30 175.38 2kd2 s SER 94 N -4.19 -0.01 -0.36 0.23 0.01 -1.26 -5.07 113.70 103.06 2kd2 s SER 94 Ca 0.36 -0.39 0.12 0.00 1.31 0.00 0.00 55.95 57.35 2kd2 s SER 94 Cb -0.01 0.30 0.45 0.00 0.21 0.00 0.00 66.02 66.97 2kd2 s SER 94 CO 0.22 -0.59 1.07 2.29 0.41 0.00 0.00 173.24 176.64 2kd2 n LYS 95 N -0.76 2.52 -2.81 12.44 0.00 -1.26 -4.80 118.16 123.50 2kd2 n LYS 95 Ca -0.01 -3.94 -0.01 0.00 -0.00 0.00 0.00 58.31 54.36 2kd2 n LYS 95 Cb 0.60 -1.85 0.06 0.00 -0.00 0.00 0.00 35.03 33.83 2kd2 n LYS 95 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2kd2 n THR 96 N -0.39 1.11 -3.64 0.58 -2.24 -1.26 -5.07 114.28 103.36 2kd2 n THR 96 Ca 0.26 -2.73 -0.06 0.00 -2.27 0.00 0.00 64.05 59.25 2kd2 n THR 96 Cb 0.77 1.22 -0.07 0.00 -2.10 0.00 0.00 70.33 70.16 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 -3.32 -0.16 0.11 4.28 -4.23 -1.26 -2.38 115.64 108.68 2kd2 s THR 97 Ca 0.25 0.01 0.04 0.00 -1.18 0.00 0.00 61.69 60.81 2kd2 s THR 97 Cb 0.35 -0.98 -0.04 0.00 1.34 0.00 0.00 72.50 73.17 2kd2 s THR 97 CO -0.04 0.00 0.09 -0.44 -0.54 0.00 0.00 174.62 173.69 2kd2 s SER 98 N 1.83 5.47 0.05 3.99 0.01 -0.49 -4.96 113.70 119.60 2kd2 s SER 98 Ca -0.09 -0.08 -0.02 0.00 1.31 0.00 0.00 55.95 57.07 2kd2 s SER 98 Cb -0.06 -1.43 -0.03 0.00 0.21 0.00 0.00 66.02 64.70 2kd2 s SER 98 CO -0.19 0.13 0.01 -0.89 0.41 0.00 0.00 173.24 172.71 2kd2 s THR 99 N -1.52 0.19 0.08 1.44 2.01 -1.26 -0.16 115.64 116.42 2kd2 s THR 99 Ca 0.30 -1.60 -0.15 0.00 0.31 0.00 0.00 61.69 60.54 2kd2 s THR 99 Cb -0.11 -1.35 0.03 0.00 0.01 0.00 0.00 72.50 71.07 2kd2 s THR 99 CO 0.22 -0.88 0.35 0.26 -0.69 0.00 0.00 174.62 173.88 2kd2 s TRP 100 N -3.63 -0.15 -0.13 4.92 0.51 0.10 -2.77 118.94 117.80 2kd2 s TRP 100 Ca 0.04 -0.06 -0.02 0.00 -2.12 0.00 0.00 56.10 53.94 2kd2 s TRP 100 Cb 0.06 0.17 0.04 0.00 -0.81 0.00 0.00 33.47 32.93 2kd2 s TRP 100 CO -0.09 -0.60 0.03 0.08 -0.51 0.00 0.00 176.95 175.86 2kd2 s VAL 101 N -3.14 0.35 0.00 4.03 1.01 -1.26 -1.07 120.40 120.32 2kd2 s VAL 101 Ca -0.01 -0.16 -0.04 0.00 0.00 0.00 0.00 61.98 61.77 2kd2 s VAL 101 Cb 0.01 -0.71 -0.01 0.00 0.00 0.00 0.00 36.38 35.67 2kd2 s VAL 101 CO -0.07 0.01 0.07 -1.48 0.00 0.00 0.00 175.10 173.63 2kd2 s LEU 102 N 1.96 1.83 -0.94 3.92 2.34 -0.57 -4.86 118.68 122.35 2kd2 s LEU 102 Ca 0.02 -0.26 -0.24 0.00 0.06 0.00 0.00 54.13 53.71 2kd2 s LEU 102 Cb -0.15 0.40 -0.02 0.00 -0.56 0.00 0.00 46.19 45.87 2kd2 s LEU 102 CO -0.07 -0.29 1.82 -0.13 -1.06 0.00 0.00 176.35 176.62 2kd2 s ARG 103 N -1.20 2.83 0.10 1.48 1.81 -1.26 -0.03 118.95 122.69 2kd2 s ARG 103 Ca -0.13 -0.54 0.09 0.00 -1.72 0.00 0.00 55.73 53.43 2kd2 s ARG 103 Cb -0.07 -5.15 -0.04 0.00 -0.45 0.00 0.00 34.95 29.24 2kd2 s ARG 103 CO 0.00 -3.08 -0.20 -1.17 -0.68 0.00 0.00 175.30 170.17 2kd2 s LEU 104 N 8.74 2.59 -0.80 2.53 0.20 0.11 -4.58 118.68 127.47 2kd2 s LEU 104 Ca 0.64 -0.58 0.00 0.00 0.69 0.00 0.00 54.13 54.88 2kd2 s LEU 104 Cb -0.05 -1.46 0.00 0.00 -0.43 0.00 0.00 46.19 44.25 2kd2 s LEU 104 CO -0.03 0.19 0.00 -0.67 -0.29 0.00 0.00 176.35 175.56 2kd2 n ASP 105 N 0.99 -5.10 0.00 3.68 -0.08 -1.26 -1.26 116.55 113.52 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 0.53 -3.27 0.00 0.00 2.34 0.00 0.00 41.12 40.72 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 0.76 3.19 0.27 0.00 -1.26 -5.03 105.19 102.64 2kd2 n GLY 106 Ca -0.08 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.48 1.14 -0.90 1.61 2.02 -0.39 -5.07 118.70 116.63 2kd2 s GLU 107 Ca 0.00 -1.59 -0.25 0.00 0.02 0.00 0.00 54.97 53.15 2kd2 s GLU 107 Cb 0.00 0.25 -0.08 0.00 0.10 0.00 0.00 34.13 34.40 2kd2 s GLU 107 CO 0.00 -0.35 2.07 -0.51 0.02 0.00 0.00 175.26 176.49 2kd2 s ASP 108 N -3.14 4.75 0.02 -0.19 1.11 -1.26 0.09 116.67 118.05 2kd2 s ASP 108 Ca 0.35 -0.57 -0.30 0.00 0.18 0.00 0.00 52.55 52.22 2kd2 s ASP 108 Cb 0.07 -2.56 -0.03 0.00 1.07 0.00 0.00 42.92 41.47 2kd2 s ASP 108 CO 0.10 -3.13 0.98 -0.22 1.18 0.00 0.00 175.17 174.08 2kd2 s LEU 109 N 11.61 4.39 -0.24 1.23 2.96 0.96 -4.88 118.68 134.71 2kd2 s LEU 109 Ca 0.76 1.69 -0.07 0.00 -0.22 0.00 0.00 54.13 56.29 2kd2 s LEU 109 Cb -0.08 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 43.01 2kd2 s LEU 109 CO 0.03 -0.24 0.07 -0.60 -1.32 0.00 0.00 176.35 174.29 2kd2 s ARG 110 N 0.88 3.71 -0.00 1.98 3.52 -1.26 -1.51 118.95 126.26 2kd2 s ARG 110 Ca 0.52 -0.46 0.01 0.00 -0.13 0.00 0.00 55.73 55.67 2kd2 s ARG 110 Cb -0.22 -3.30 -0.04 0.00 -1.56 0.00 0.00 34.95 29.84 2kd2 s ARG 110 CO 0.28 -0.10 0.03 0.08 -0.81 0.00 0.00 175.30 174.78 2kd2 s VAL 111 N 1.38 4.37 0.02 7.11 1.01 -0.23 -1.87 120.40 132.18 2kd2 s VAL 111 Ca 0.05 -0.53 0.02 0.00 0.00 0.00 0.00 61.98 61.52 2kd2 s VAL 111 Cb -0.15 -2.97 -0.01 0.00 0.00 0.00 0.00 36.38 33.25 2kd2 s VAL 111 CO 0.04 0.37 -0.07 -0.69 0.00 0.00 0.00 175.10 174.75 2kd2 s VAL 112 N -1.13 0.49 -0.29 2.92 1.01 -0.13 0.02 120.40 123.29 2kd2 s VAL 112 Ca 0.21 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.58 2kd2 s VAL 112 Cb -0.12 -0.48 0.09 0.00 0.00 0.00 0.00 36.38 35.87 2kd2 s VAL 112 CO 0.12 -0.10 0.05 -0.22 0.00 0.00 0.00 175.10 174.95 2kd2 s LEU 113 N -0.78 2.67 0.12 3.92 2.96 0.78 -0.08 118.68 128.27 2kd2 s LEU 113 Ca -0.03 -1.57 -0.30 0.00 -0.22 0.00 0.00 54.13 52.00 2kd2 s LEU 113 Cb -0.06 -1.04 -0.07 0.00 0.50 0.00 0.00 46.19 45.53 2kd2 s LEU 113 CO 0.00 -0.36 1.17 -0.70 -1.32 0.00 0.00 176.35 175.14 2kd2 s GLU 114 N 1.46 4.49 0.35 1.98 2.12 -0.61 -1.39 118.70 127.11 2kd2 s GLU 114 Ca 0.06 1.78 0.27 0.00 0.36 0.00 0.00 54.97 57.43 2kd2 s GLU 114 Cb -0.18 -3.31 0.95 0.00 0.26 0.00 0.00 34.13 31.86 2kd2 s GLU 114 CO -0.17 -0.14 1.78 0.87 -0.54 0.00 0.00 175.26 177.07 2kd2 h LYS 115 N 6.04 0.00 -0.09 4.30 1.79 -1.81 0.26 116.57 127.06 2kd2 h LYS 115 Ca -0.43 0.00 0.04 0.00 -2.18 0.00 0.00 60.65 58.08 2kd2 h LYS 115 Cb 1.21 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.80 2kd2 h LYS 115 CO 0.77 0.00 -0.35 0.22 -1.08 0.00 0.00 179.45 179.01 2kd2 h ASP 116 N 0.00 -1.09 0.00 0.86 3.58 -1.91 -3.32 116.42 114.53 2kd2 h ASP 116 Ca 0.00 0.15 0.00 0.00 0.42 0.00 0.00 57.03 57.60 2kd2 h ASP 116 Cb 0.58 0.45 0.00 0.00 1.72 0.00 0.00 39.33 42.08 2kd2 h ASP 116 CO 0.00 -0.39 -0.27 0.41 -2.88 0.00 0.00 179.24 176.10 2kd2 n THR 117 N -5.42 0.37 -2.37 2.25 -1.04 -1.24 -4.99 114.28 101.84 2kd2 n THR 117 Ca -0.04 -0.43 -0.21 0.00 -2.04 0.00 0.00 64.05 61.33 2kd2 n THR 117 Cb 0.34 0.49 -0.01 0.00 -1.82 0.00 0.00 70.33 69.33 2kd2 n THR 117 CO 0.00 0.00 0.00 0.80 -0.64 0.00 0.00 175.07 175.23 2kd2 n MET 118 N -0.26 -1.66 -2.64 -2.82 1.56 0.91 -4.95 117.12 107.25 2kd2 n MET 118 Ca 0.03 1.02 -0.37 0.00 -0.27 0.00 0.00 57.70 58.11 2kd2 n MET 118 Cb 0.61 -5.68 -0.05 0.00 2.15 0.00 0.00 33.22 30.26 2kd2 n MET 118 CO 0.00 0.00 0.00 0.34 -0.73 0.00 0.00 175.97 175.58 2kd2 s ASP 119 N -2.08 6.99 -0.10 6.12 -1.08 -1.13 -4.79 116.67 120.60 2kd2 s ASP 119 Ca 0.00 1.96 -0.04 0.00 -0.52 0.00 0.00 52.55 53.95 2kd2 s ASP 119 Cb 0.00 -2.58 -0.04 0.00 -1.46 0.00 0.00 42.92 38.84 2kd2 s ASP 119 CO 0.00 -0.32 0.04 -0.69 0.52 0.00 0.00 175.17 174.72 2kd2 s VAL 120 N -1.65 4.68 -0.12 1.11 1.01 -1.26 -1.57 120.40 122.61 2kd2 s VAL 120 Ca 0.55 -0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.44 2kd2 s VAL 120 Cb -0.21 -3.00 0.02 0.00 0.00 0.00 0.00 36.38 33.19 2kd2 s VAL 120 CO 0.26 0.60 -0.15 0.86 0.00 0.00 0.00 175.10 176.67 2kd2 s TRP 121 N -0.83 2.00 -0.31 5.22 -0.11 0.89 -1.59 118.94 124.21 2kd2 s TRP 121 Ca 0.13 -0.98 -0.02 0.00 1.22 0.00 0.00 56.10 56.44 2kd2 s TRP 121 Cb -0.12 -1.45 0.05 0.00 -1.50 0.00 0.00 33.47 30.45 2kd2 s TRP 121 CO 0.03 -0.52 0.01 0.00 -4.62 0.00 0.00 176.95 171.85 2kd2 n ASN 123 N 4.65 -5.75 -2.56 0.00 4.13 -0.78 -0.88 115.26 114.06 2kd2 n ASN 123 Ca -0.13 -0.74 -0.12 0.00 1.68 0.00 0.00 54.58 55.27 2kd2 n ASN 123 Cb 0.43 -3.05 -0.00 0.00 -1.54 0.00 0.00 39.78 35.62 2kd2 n ASN 123 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2kd2 n GLY 124 N -1.72 -0.50 2.80 7.41 0.00 -1.26 -4.92 105.19 107.00 2kd2 n GLY 124 Ca -0.17 0.01 -0.23 0.00 0.00 0.00 0.00 46.02 45.63 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 -5.14 0.74 0.65 1.61 -0.44 -0.06 -5.13 119.66 111.89 2kd2 s GLN 125 Ca 0.05 0.04 -0.17 0.00 -2.50 0.00 0.00 55.36 52.78 2kd2 s GLN 125 Cb -0.02 -1.04 -0.04 0.00 -1.64 0.00 0.00 33.01 30.27 2kd2 s GLN 125 CO 0.06 -0.28 0.82 1.17 0.50 0.00 0.00 175.29 177.56 2kd2 n LYS 126 N 5.01 0.64 -4.44 1.67 4.81 -1.26 -0.12 118.16 124.48 2kd2 n LYS 126 Ca -0.09 0.26 -0.25 0.00 -0.87 0.00 0.00 58.31 57.35 2kd2 n LYS 126 Cb 0.50 -2.05 -0.09 0.00 0.02 0.00 0.00 35.03 33.40 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 -2.80 1.97 -0.30 1.64 -1.94 -0.62 -4.71 119.30 112.54 2kd2 s MET 127 Ca 0.73 -1.86 0.02 0.00 -1.71 0.00 0.00 55.69 52.87 2kd2 s MET 127 Cb -0.39 -1.82 0.07 0.00 2.01 0.00 0.00 34.83 34.71 2kd2 s MET 127 CO 0.50 0.11 -0.03 -1.21 -0.01 0.00 0.00 175.02 174.38 2kd2 s GLU 128 N -3.68 2.02 0.48 2.03 2.02 -1.26 -4.76 118.70 115.55 2kd2 s GLU 128 Ca 0.34 -1.52 0.04 0.00 0.02 0.00 0.00 54.97 53.85 2kd2 s GLU 128 Cb 0.02 -3.06 0.02 0.00 0.10 0.00 0.00 34.13 31.21 2kd2 s GLU 128 CO 0.18 -0.71 0.67 0.95 0.02 0.00 0.00 175.26 176.37 2kd2 s THR 129 N 1.06 3.05 -0.12 3.63 -4.23 -1.26 -3.81 115.64 113.96 2kd2 s THR 129 Ca -0.02 -0.78 0.19 0.00 -1.18 0.00 0.00 61.69 59.91 2kd2 s THR 129 Cb -0.20 -3.09 -0.22 0.00 1.34 0.00 0.00 72.50 70.33 2kd2 s THR 129 CO -0.05 -0.05 0.55 0.00 -0.54 0.00 0.00 174.62 174.52 2kd2 n ALA 130 N -2.10 2.18 -2.76 3.99 0.00 0.86 -4.90 120.51 117.78 2kd2 n ALA 130 Ca 0.07 -0.70 -0.04 0.00 0.00 0.00 0.00 53.44 52.77 2kd2 n ALA 130 Cb 0.59 -0.72 0.01 0.00 0.00 0.00 0.00 19.45 19.33 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 1.41 -1.20 2.82 0.00 0.00 -1.26 -4.95 105.19 102.01 2kd2 n GLY 131 Ca -0.12 0.83 -0.30 0.00 0.00 0.00 0.00 46.02 46.42 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 -2.65 0.97 -0.08 1.61 2.02 -0.77 -5.06 118.70 114.74 2kd2 s GLU 132 Ca 0.13 -1.18 -0.22 0.00 0.02 0.00 0.00 54.97 53.72 2kd2 s GLU 132 Cb -0.04 -2.32 -0.04 0.00 0.10 0.00 0.00 34.13 31.84 2kd2 s GLU 132 CO 0.67 -0.91 0.63 -0.59 0.02 0.00 0.00 175.26 175.08 2kd2 s PHE 133 N 1.46 3.55 0.54 1.61 -0.71 -1.26 -0.17 117.98 123.01 2kd2 s PHE 133 Ca 0.07 1.13 -0.08 0.00 -1.04 0.00 0.00 56.93 57.01 2kd2 s PHE 133 Cb -0.18 -2.73 0.12 0.00 -1.21 0.00 0.00 43.02 39.03 2kd2 s PHE 133 CO -0.18 0.11 0.74 1.33 -1.34 0.00 0.00 175.22 175.87 2kd2 n VAL 134 N 3.76 0.00 -0.07 -2.49 0.24 -0.74 -4.90 118.33 114.12 2kd2 n VAL 134 Ca -0.03 -0.60 0.25 0.00 -2.04 0.00 0.00 64.34 61.92 2kd2 n VAL 134 Cb 0.51 -1.65 0.72 0.00 -1.47 0.00 0.00 33.84 31.96 2kd2 n VAL 134 CO 0.00 0.00 0.00 -0.78 -2.14 0.00 0.00 176.83 173.91 2kd2 h ASP 135 N -0.92 0.00 0.00 -1.34 1.82 -2.03 -3.39 116.42 110.55 2kd2 h ASP 135 Ca -0.24 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.40 2kd2 h ASP 135 Cb 0.68 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.69 2kd2 h ASP 135 CO 0.18 0.00 0.00 -0.90 -1.61 0.00 0.00 179.24 176.91 2kd2 n ASP 136 N -4.13 0.00 -3.59 2.28 5.68 -1.26 -5.12 116.55 110.41 2kd2 n ASP 136 Ca 0.14 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.43 2kd2 n ASP 136 Cb 0.81 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.79 2kd2 n ASP 136 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2kd2 n GLY 137 N 2.03 -3.19 2.90 6.12 0.00 -1.26 -4.68 105.19 107.12 2kd2 n GLY 137 Ca 0.00 -1.25 -0.13 0.00 0.00 0.00 0.00 46.02 44.63 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 -0.28 -0.03 -0.14 2.61 2.01 0.09 -1.78 115.64 118.11 2kd2 s THR 138 Ca 0.00 0.13 -0.03 0.00 0.31 0.00 0.00 61.69 62.10 2kd2 s THR 138 Cb 0.00 -0.17 -0.03 0.00 0.01 0.00 0.00 72.50 72.31 2kd2 s THR 138 CO 0.00 0.05 -0.02 -1.61 -0.69 0.00 0.00 174.62 172.35 2kd2 s GLU 139 N 0.77 3.48 -0.27 4.92 2.02 0.76 -0.46 118.70 129.92 2kd2 s GLU 139 Ca -0.06 -0.48 0.02 0.00 0.02 0.00 0.00 54.97 54.47 2kd2 s GLU 139 Cb -0.08 -2.89 0.06 0.00 0.10 0.00 0.00 34.13 31.32 2kd2 s GLU 139 CO -0.03 0.38 -0.09 0.99 0.02 0.00 0.00 175.26 176.53 2kd2 s THR 140 N -0.01 2.37 -0.40 3.63 2.01 -1.08 -1.85 115.64 120.32 2kd2 s THR 140 Ca 0.02 -1.56 -0.14 0.00 0.31 0.00 0.00 61.69 60.32 2kd2 s THR 140 Cb -0.13 -2.38 0.02 0.00 0.01 0.00 0.00 72.50 70.02 2kd2 s THR 140 CO 0.02 -0.03 0.28 -1.00 -0.69 0.00 0.00 174.62 173.20 2kd2 s HIS 141 N 1.14 3.24 -0.02 4.92 3.76 -1.26 -2.22 115.29 124.85 2kd2 s HIS 141 Ca -0.08 -0.63 0.01 0.00 -0.15 0.00 0.00 55.06 54.22 2kd2 s HIS 141 Cb -0.20 -2.55 0.01 0.00 1.11 0.00 0.00 32.58 30.95 2kd2 s HIS 141 CO -0.04 -0.58 -0.05 -0.59 -0.85 0.00 0.00 174.74 172.63 2kd2 s PHE 142 N 1.66 0.58 0.38 1.40 -0.12 -1.19 -0.10 117.98 120.59 2kd2 s PHE 142 Ca 0.05 -0.12 -0.15 0.00 -0.05 0.00 0.00 56.93 56.65 2kd2 s PHE 142 Cb -0.19 -0.47 -0.08 0.00 -0.63 0.00 0.00 43.02 41.65 2kd2 s PHE 142 CO 0.09 -0.09 0.81 -1.54 -0.05 0.00 0.00 175.22 174.44 2kd2 s SER 143 N 0.42 6.71 -0.31 1.98 1.04 -1.25 -3.45 113.70 118.83 2kd2 s SER 143 Ca -0.05 1.33 -0.02 0.00 0.48 0.00 0.00 55.95 57.69 2kd2 s SER 143 Cb -0.09 -2.40 0.11 0.00 0.10 0.00 0.00 66.02 63.74 2kd2 s SER 143 CO -0.00 -0.33 0.14 -0.69 0.98 0.00 0.00 173.24 173.34 2kd2 s VAL 144 N -2.20 0.36 0.00 5.02 1.01 -1.24 -4.73 120.40 118.63 2kd2 s VAL 144 Ca 0.55 -1.21 0.00 0.00 0.00 0.00 0.00 61.98 61.32 2kd2 s VAL 144 Cb -0.10 -1.28 0.00 0.00 0.00 0.00 0.00 36.38 35.00 2kd2 s VAL 144 CO 0.22 -0.76 0.00 0.61 0.00 0.00 0.00 175.10 175.17 2kd2 n GLY 145 N 4.85 1.07 0.72 4.51 0.00 -1.26 -0.07 105.19 115.02 2kd2 n GLY 145 Ca -0.01 0.55 0.04 0.00 0.00 0.00 0.00 46.02 46.60 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 8.54 2.42 -1.73 1.61 5.15 -1.26 -5.02 115.26 124.97 2kd2 n ASN 146 Ca 0.00 -3.56 0.00 0.00 -0.60 0.00 0.00 54.58 50.42 2kd2 n ASN 146 Cb 0.00 -0.55 0.00 0.00 -0.53 0.00 0.00 39.78 38.70 2kd2 n ASN 146 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 2kd2 n HIS 147 N -1.10 0.00 -3.51 1.20 8.25 0.91 -5.15 115.22 115.82 2kd2 n HIS 147 Ca 0.24 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.47 2kd2 n HIS 147 Cb 0.83 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.80 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 -0.99 2.17 0.25 0.41 1.01 -1.26 -3.61 116.67 114.65 2kd2 s ASP 148 Ca 0.00 -0.67 0.12 0.00 0.71 0.00 0.00 52.55 52.70 2kd2 s ASP 148 Cb 0.00 0.09 -0.05 0.00 1.01 0.00 0.00 42.92 43.98 2kd2 s ASP 148 CO 0.00 -0.37 -0.21 0.00 0.21 0.00 0.00 175.17 174.80 2kd2 s TYR 150 N -2.31 -0.69 -0.40 0.00 1.13 -0.47 -3.19 117.35 111.42 2kd2 s TYR 150 Ca 0.27 1.52 -0.15 0.00 -1.41 0.00 0.00 57.07 57.30 2kd2 s TYR 150 Cb -0.06 0.30 0.01 0.00 -1.10 0.00 0.00 41.96 41.11 2kd2 s TYR 150 CO 0.13 -0.44 0.32 0.42 -2.51 0.00 0.00 175.55 173.47 2kd2 s ILE 151 N -0.21 5.23 -0.66 -3.49 1.01 -0.94 -0.59 121.20 121.55 2kd2 s ILE 151 Ca -0.04 -0.50 -0.27 0.00 0.00 0.00 0.00 60.65 59.83 2kd2 s ILE 151 Cb -0.03 -3.91 0.03 0.00 0.01 0.00 0.00 42.46 38.56 2kd2 s ILE 151 CO 0.04 -0.28 1.20 -0.75 0.00 0.00 0.00 174.94 175.16 2kd2 s LYS 152 N 1.78 3.33 -0.09 2.79 2.20 0.89 -2.65 119.74 128.00 2kd2 s LYS 152 Ca 0.07 -0.07 -0.17 0.00 -0.36 0.00 0.00 55.97 55.44 2kd2 s LYS 152 Cb -0.18 -4.10 -0.05 0.00 -1.51 0.00 0.00 37.83 31.99 2kd2 s LYS 152 CO 0.11 -1.89 0.45 0.00 -0.36 0.00 0.00 175.35 173.65 2kd2 s ALA 153 N 5.20 3.54 -0.10 3.13 0.00 0.39 -0.03 121.76 133.90 2kd2 s ALA 153 Ca 0.37 -0.21 0.01 0.00 0.00 0.00 0.00 51.96 52.13 2kd2 s ALA 153 Cb -0.09 -2.57 0.02 0.00 0.00 0.00 0.00 23.12 20.48 2kd2 s ALA 153 CO 0.19 0.12 -0.13 0.08 0.00 0.00 0.00 175.76 176.03 2kd2 s VAL 154 N 0.19 1.31 -0.04 0.00 1.01 -0.38 -0.73 120.40 121.75 2kd2 s VAL 154 Ca 0.25 -0.53 -0.15 0.00 0.00 0.00 0.00 61.98 61.54 2kd2 s VAL 154 Cb -0.15 -1.22 -0.05 0.00 0.00 0.00 0.00 36.38 34.96 2kd2 s VAL 154 CO 0.11 0.40 0.40 -0.94 0.00 0.00 0.00 175.10 175.07 2kd2 s SER 155 N 1.04 6.73 0.02 3.32 1.04 -1.26 -1.23 113.70 123.36 2kd2 s SER 155 Ca -0.06 0.87 0.01 0.00 0.48 0.00 0.00 55.95 57.24 2kd2 s SER 155 Cb -0.15 -2.24 -0.01 0.00 0.10 0.00 0.00 66.02 63.72 2kd2 s SER 155 CO -0.01 0.24 -0.03 -0.94 0.98 0.00 0.00 173.24 173.47 2kd2 s SER 156 N -0.58 0.31 0.00 7.02 1.04 0.48 -4.81 113.70 117.16 2kd2 s SER 156 Ca 0.23 -0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.34 2kd2 s SER 156 Cb -0.16 0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.01 2kd2 s SER 156 CO 0.11 -0.16 0.00 0.61 0.98 0.00 0.00 173.24 174.78 2kd2 n GLY 157 N 2.14 3.72 0.33 7.32 0.00 -1.26 -0.76 105.19 116.68 2kd2 n GLY 157 Ca -0.19 -1.73 0.05 0.00 0.00 0.00 0.00 46.02 44.15 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 0.00 0.84 -0.86 1.61 6.56 -2.00 -3.16 116.57 119.57 2kd2 h LYS 158 Ca 0.00 -0.05 -0.36 0.00 -1.06 0.00 0.00 60.65 59.18 2kd2 h LYS 158 Cb 0.00 -0.19 -0.40 0.00 -0.57 0.00 0.00 32.23 31.07 2kd2 h LYS 158 CO 0.00 0.56 -1.09 0.54 -2.06 0.00 0.00 179.45 177.39 2kd2 n ARG 159 N -4.70 1.76 -3.17 3.15 5.12 -1.26 -5.01 116.66 112.56 2kd2 n ARG 159 Ca 0.16 -3.54 -0.11 0.00 -1.93 0.00 0.00 57.85 52.43 2kd2 n ARG 159 Cb 0.32 -1.55 0.01 0.00 -1.16 0.00 0.00 32.46 30.08 2kd2 n ARG 159 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2kd2 n LYS 160 N -0.33 -1.76 -0.04 5.56 4.01 -1.20 -4.97 118.16 119.44 2kd2 n LYS 160 Ca 0.14 1.56 -0.05 0.00 -0.51 0.00 0.00 58.31 59.45 2kd2 n LYS 160 Cb 0.81 -4.75 -0.05 0.00 -0.51 0.00 0.00 35.03 30.53 2kd2 n LYS 160 CO 0.00 0.00 0.00 -0.85 -1.11 0.00 0.00 177.40 175.44 2kd2 n GLU 161 N -1.27 1.12 -3.84 1.97 0.28 -1.13 -4.95 120.64 112.82 2kd2 n GLU 161 Ca -0.03 0.03 -0.36 0.00 -0.16 0.00 0.00 57.16 56.65 2kd2 n GLU 161 Cb 0.54 -1.18 -0.13 0.00 1.43 0.00 0.00 31.44 32.10 2kd2 n GLU 161 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 2kd2 s GLY 162 N -4.53 1.77 0.06 -1.84 0.00 0.06 -5.01 107.32 97.84 2kd2 s GLY 162 Ca -0.09 -1.68 0.04 0.00 0.00 0.00 0.00 44.72 42.99 2kd2 s GLY 162 CO 0.24 0.69 -0.03 -0.42 0.00 0.00 0.00 173.10 173.58 2kd2 s ILE 163 N 1.35 3.83 -0.05 0.90 1.01 -1.26 -0.39 121.20 126.59 2kd2 s ILE 163 Ca -0.02 -0.94 -0.01 0.00 0.00 0.00 0.00 60.65 59.67 2kd2 s ILE 163 Cb -0.19 -2.77 0.03 0.00 0.01 0.00 0.00 42.46 39.54 2kd2 s ILE 163 CO 0.00 0.21 0.03 -0.63 0.00 0.00 0.00 174.94 174.55 2kd2 s ILE 164 N -1.19 0.13 -0.08 2.92 1.01 -0.36 -4.99 121.20 118.64 2kd2 s ILE 164 Ca 0.22 0.24 -0.14 0.00 0.00 0.00 0.00 60.65 60.98 2kd2 s ILE 164 Cb -0.11 -0.32 -0.05 0.00 0.01 0.00 0.00 42.46 41.99 2kd2 s ILE 164 CO 0.14 0.20 0.34 -1.00 0.00 0.00 0.00 174.94 174.62 2kd2 s HIS 165 N 1.84 3.60 -0.27 3.97 3.76 -1.26 -1.25 115.29 125.69 2kd2 s HIS 165 Ca 0.02 0.80 0.01 0.00 -0.15 0.00 0.00 55.06 55.74 2kd2 s HIS 165 Cb -0.12 -2.29 0.07 0.00 1.11 0.00 0.00 32.58 31.35 2kd2 s HIS 165 CO -0.04 0.48 -0.02 0.95 -0.85 0.00 0.00 174.74 175.27 2kd2 s THR 166 N -0.40 1.62 0.26 1.30 -4.23 0.96 -4.95 115.64 110.20 2kd2 s THR 166 Ca 0.21 -1.48 -0.30 0.00 -1.18 0.00 0.00 61.69 58.93 2kd2 s THR 166 Cb -0.15 -1.98 -0.10 0.00 1.34 0.00 0.00 72.50 71.62 2kd2 s THR 166 CO 0.09 -0.27 1.37 -0.22 -0.54 0.00 0.00 174.62 175.05 2kd2 s LEU 167 N 1.31 4.41 -0.04 4.79 2.96 -1.26 -0.08 118.68 130.77 2kd2 s LEU 167 Ca -0.01 2.62 -0.00 0.00 -0.22 0.00 0.00 54.13 56.52 2kd2 s LEU 167 Cb -0.19 -3.63 0.03 0.00 0.50 0.00 0.00 46.19 42.90 2kd2 s LEU 167 CO -0.09 -0.61 0.00 -0.63 -1.32 0.00 0.00 176.35 173.70 2kd2 s ILE 168 N -0.34 0.23 -0.16 6.68 1.01 0.24 -1.01 121.20 127.85 2kd2 s ILE 168 Ca 0.55 0.12 0.01 0.00 0.00 0.00 0.00 60.65 61.33 2kd2 s ILE 168 Cb -0.40 -0.36 0.02 0.00 0.01 0.00 0.00 42.46 41.73 2kd2 s ILE 168 CO 0.45 0.19 -0.17 -0.69 0.00 0.00 0.00 174.94 174.73 2kd2 s VAL 169 N 1.43 1.78 -1.11 2.92 1.01 -0.80 -1.36 120.40 124.26 2kd2 s VAL 169 Ca -0.04 -0.77 -0.07 0.00 0.00 0.00 0.00 61.98 61.10 2kd2 s VAL 169 Cb -0.13 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.61 2kd2 s VAL 169 CO -0.03 0.49 0.89 -0.67 0.00 0.00 0.00 175.10 175.78 2kd2 n ASP 170 N 4.71 -5.49 -3.08 3.32 2.03 -1.20 -2.64 116.55 114.20 2kd2 n ASP 170 Ca -0.19 -0.40 -0.18 0.00 0.52 0.00 0.00 54.79 54.54 2kd2 n ASP 170 Cb 0.50 -4.13 0.07 0.00 -0.72 0.00 0.00 41.12 36.84 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 -2.06 -4.58 -3.77 1.67 2.85 -1.26 -5.02 115.26 103.10 2kd2 n ASN 171 Ca -0.01 -0.47 -0.17 0.00 -0.11 0.00 0.00 54.58 53.82 2kd2 n ASN 171 Cb 0.55 -4.33 -0.17 0.00 1.24 0.00 0.00 39.78 37.08 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 -5.81 0.11 0.53 1.20 1.81 -1.08 -5.14 118.95 110.57 2kd2 s ARG 172 Ca 0.34 0.19 -0.22 0.00 -1.72 0.00 0.00 55.73 54.32 2kd2 s ARG 172 Cb -0.15 -0.43 -0.05 0.00 -0.45 0.00 0.00 34.95 33.86 2kd2 s ARG 172 CO 0.61 -0.20 1.32 -2.00 -0.68 0.00 0.00 175.30 174.35 2kd2 s GLU 173 N 1.35 3.26 -0.09 3.54 2.12 -1.26 -1.91 118.70 125.71 2kd2 s GLU 173 Ca -0.05 2.14 0.04 0.00 0.36 0.00 0.00 54.97 57.46 2kd2 s GLU 173 Cb -0.13 -2.29 -0.00 0.00 0.26 0.00 0.00 34.13 31.97 2kd2 s GLU 173 CO -0.03 -1.07 -0.24 0.42 -0.54 0.00 0.00 175.26 173.81 2kd2 s ILE 174 N -1.35 2.06 0.06 -3.70 -1.09 -0.18 -4.88 121.20 112.12 2kd2 s ILE 174 Ca 0.70 -1.03 -0.31 0.00 -2.23 0.00 0.00 60.65 57.79 2kd2 s ILE 174 Cb -0.38 -1.77 -0.07 0.00 -1.58 0.00 0.00 42.46 38.66 2kd2 s ILE 174 CO 0.45 0.56 1.40 -2.16 -1.23 0.00 0.00 174.94 173.96 2kd2 s PRO 175 N 0.26 4.30 -0.18 2.79 0.04 -1.26 -4.49 135.00 136.46 2kd2 s PRO 175 Ca -0.16 2.03 -0.17 0.00 0.04 0.00 0.00 61.00 62.74 2kd2 s PRO 175 Cb -0.17 -3.41 -0.04 0.00 0.04 0.00 0.00 34.50 30.91 2kd2 s PRO 175 CO 0.08 -0.50 0.44 -2.00 0.04 0.00 0.00 177.00 175.05 2kd2 s GLU 176 N 1.75 4.23 -0.72 4.56 2.12 -1.26 -4.19 118.70 125.18 2kd2 s GLU 176 Ca 0.65 0.30 -0.27 0.00 0.36 0.00 0.00 54.97 56.01 2kd2 s GLU 176 Cb -0.34 -3.51 0.02 0.00 0.26 0.00 0.00 34.13 30.56 2kd2 s GLU 176 CO 0.29 0.01 1.45 -1.17 -0.54 0.00 0.00 175.26 175.30 2kd2 s LEU 177 N 1.14 3.21 -0.00 2.70 1.98 -1.11 -4.94 118.68 121.65 2kd2 s LEU 177 Ca 0.22 -0.30 -0.19 0.00 -2.89 0.00 0.00 54.13 50.96 2kd2 s LEU 177 Cb -0.15 -2.55 0.04 0.00 0.66 0.00 0.00 46.19 44.19 2kd2 s LEU 177 CO 0.08 -1.98 0.42 0.28 -1.89 0.00 0.00 176.35 173.27 2kd2 s THR 178 N 6.65 0.04 -1.16 3.68 -1.32 -1.26 -4.63 115.64 117.65 2kd2 s THR 178 Ca 0.45 -0.36 0.09 0.00 -1.21 0.00 0.00 61.69 60.65 2kd2 s THR 178 Cb -0.09 -0.81 0.07 0.00 -1.51 0.00 0.00 72.50 70.17 2kd2 s THR 178 CO 0.15 -0.20 0.79 1.67 -2.21 0.00 0.00 174.62 174.82