#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 4.34 0.02 1.61 0.04 -1.26 -4.89 135.00 134.87 2kd2 s PRO 87 Ca 0.00 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.08 2kd2 s PRO 87 Cb 0.00 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.29 2kd2 s PRO 87 CO 0.00 -0.40 0.00 1.28 0.04 0.00 0.00 177.00 177.92 2kd2 n LEU 88 N 3.78 0.04 0.00 -3.56 4.77 -1.26 -5.15 117.00 115.63 2kd2 n LEU 88 Ca 0.11 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 2kd2 n LEU 88 Cb 0.43 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 2kd2 n LEU 88 CO 0.58 -0.33 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 2kd2 n GLY 89 N 2.20 -0.49 3.13 -0.72 0.00 -1.26 -5.17 105.19 102.87 2kd2 n GLY 89 Ca 0.00 0.62 -0.12 0.00 0.00 0.00 0.00 46.02 46.52 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 2.00 1.03 -0.34 1.61 0.01 -1.26 -5.04 113.70 111.71 2kd2 s SER 90 Ca 0.00 -0.82 0.09 0.00 1.31 0.00 0.00 55.95 56.53 2kd2 s SER 90 Cb 0.00 0.07 0.67 0.00 0.21 0.00 0.00 66.02 66.97 2kd2 s SER 90 CO 0.00 -0.36 1.75 -0.62 0.41 0.00 0.00 173.24 174.43 2kd2 n GLU 91 N 0.58 3.00 -3.70 12.44 1.02 -1.26 -4.92 120.64 127.79 2kd2 n GLU 91 Ca -0.17 -3.07 -0.22 0.00 -0.02 0.00 0.00 57.16 53.69 2kd2 n GLU 91 Cb 0.58 -2.12 0.03 0.00 -0.02 0.00 0.00 31.44 29.92 2kd2 n GLU 91 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2kd2 n ASN 92 N -0.59 -1.31 -0.95 1.62 5.15 -1.26 -4.67 115.26 113.25 2kd2 n ASN 92 Ca 0.43 -0.81 0.00 0.00 -0.60 0.00 0.00 54.58 53.60 2kd2 n ASN 92 Cb 1.37 -4.08 -0.00 0.00 -0.53 0.00 0.00 39.78 36.54 2kd2 n ASN 92 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2kd2 n ARG 93 N -4.29 -0.07 -0.25 1.20 1.74 -1.26 -3.69 116.66 110.04 2kd2 n ARG 93 Ca -0.29 0.05 0.04 0.00 -0.77 0.00 0.00 57.85 56.88 2kd2 n ARG 93 Cb 0.67 -0.09 0.17 0.00 -1.02 0.00 0.00 32.46 32.20 2kd2 n ARG 93 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2kd2 h SER 94 N -0.03 0.29 -2.11 0.55 4.64 -1.92 -3.48 113.55 111.49 2kd2 h SER 94 Ca 0.00 0.10 0.16 0.00 -0.47 0.00 0.00 61.79 61.58 2kd2 h SER 94 Cb 0.03 0.07 -0.04 0.00 -0.31 0.00 0.00 62.40 62.16 2kd2 h SER 94 CO 0.00 0.12 -0.21 1.17 -0.87 0.00 0.00 176.83 177.04 2kd2 n LYS 95 N -4.99 -1.20 -1.38 4.77 4.81 -1.24 -3.73 118.16 115.19 2kd2 n LYS 95 Ca 0.13 0.79 -0.28 0.00 -0.87 0.00 0.00 58.31 58.09 2kd2 n LYS 95 Cb 0.39 -1.46 -0.08 0.00 0.02 0.00 0.00 35.03 33.90 2kd2 n LYS 95 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2kd2 n THR 96 N -2.83 3.83 -3.64 3.15 -2.24 -1.26 -4.78 114.28 106.51 2kd2 n THR 96 Ca 0.00 -2.66 -0.06 0.00 -2.27 0.00 0.00 64.05 59.06 2kd2 n THR 96 Cb 0.27 -2.07 -0.07 0.00 -2.10 0.00 0.00 70.33 66.37 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 0.10 -0.18 0.17 4.28 -4.23 -1.24 -2.56 115.64 111.97 2kd2 s THR 97 Ca 0.63 0.01 0.05 0.00 -1.18 0.00 0.00 61.69 61.20 2kd2 s THR 97 Cb 0.28 -0.98 -0.04 0.00 1.34 0.00 0.00 72.50 73.09 2kd2 s THR 97 CO -0.09 0.00 0.13 -0.55 -0.54 0.00 0.00 174.62 173.57 2kd2 s SER 98 N 1.86 5.47 0.04 3.99 0.15 -0.50 -4.95 113.70 119.77 2kd2 s SER 98 Ca -0.09 -0.15 -0.10 0.00 0.70 0.00 0.00 55.95 56.31 2kd2 s SER 98 Cb -0.06 -1.41 0.00 0.00 -1.71 0.00 0.00 66.02 62.84 2kd2 s SER 98 CO -0.19 0.07 0.20 0.42 1.20 0.00 0.00 173.24 174.93 2kd2 s THR 99 N -1.76 0.11 -0.16 6.45 -4.23 -1.26 -0.10 115.64 114.69 2kd2 s THR 99 Ca 0.31 -0.88 -0.11 0.00 -1.18 0.00 0.00 61.69 59.83 2kd2 s THR 99 Cb -0.10 -0.90 0.05 0.00 1.34 0.00 0.00 72.50 72.89 2kd2 s THR 99 CO 0.23 -0.49 0.40 0.26 -0.54 0.00 0.00 174.62 174.49 2kd2 s TRP 100 N -2.55 -0.53 -0.27 3.99 0.51 0.95 -1.82 118.94 119.23 2kd2 s TRP 100 Ca -0.05 1.19 -0.03 0.00 -2.12 0.00 0.00 56.10 55.09 2kd2 s TRP 100 Cb -0.01 0.21 0.02 0.00 -0.81 0.00 0.00 33.47 32.89 2kd2 s TRP 100 CO -0.04 -0.29 -0.02 0.08 -0.51 0.00 0.00 176.95 176.18 2kd2 s VAL 101 N 0.93 3.20 0.02 4.03 1.01 -1.26 -0.56 120.40 127.76 2kd2 s VAL 101 Ca -0.06 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 60.98 2kd2 s VAL 101 Cb -0.06 -2.65 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 2kd2 s VAL 101 CO -0.07 0.14 -0.03 -1.48 0.00 0.00 0.00 175.10 173.66 2kd2 s LEU 102 N 1.37 2.15 -0.84 3.92 2.34 -0.56 -4.91 118.68 122.15 2kd2 s LEU 102 Ca 0.01 -0.32 -0.25 0.00 0.06 0.00 0.00 54.13 53.63 2kd2 s LEU 102 Cb -0.17 -0.01 -0.00 0.00 -0.56 0.00 0.00 46.19 45.45 2kd2 s LEU 102 CO -0.02 -0.16 1.68 -0.60 -1.06 0.00 0.00 176.35 176.19 2kd2 s ARG 103 N -0.91 2.95 0.12 1.48 3.52 -1.26 0.21 118.95 125.07 2kd2 s ARG 103 Ca -0.08 -0.29 0.07 0.00 -0.13 0.00 0.00 55.73 55.30 2kd2 s ARG 103 Cb -0.06 -4.83 -0.04 0.00 -1.56 0.00 0.00 34.95 28.46 2kd2 s ARG 103 CO -0.00 -2.71 -0.17 -1.17 -0.81 0.00 0.00 175.30 170.44 2kd2 s LEU 104 N 7.77 2.38 -0.98 -0.88 0.20 0.50 -4.71 118.68 122.96 2kd2 s LEU 104 Ca 0.57 -0.78 0.00 0.00 0.69 0.00 0.00 54.13 54.61 2kd2 s LEU 104 Cb -0.07 -0.69 0.00 0.00 -0.43 0.00 0.00 46.19 45.00 2kd2 s LEU 104 CO 0.05 -0.07 0.00 -0.67 -0.29 0.00 0.00 176.35 175.37 2kd2 n ASP 105 N 0.65 -5.13 0.00 3.68 -0.08 -1.26 -1.23 116.55 113.19 2kd2 n ASP 105 Ca -0.16 0.23 0.00 0.00 -1.51 0.00 0.00 54.79 53.35 2kd2 n ASP 105 Cb 0.56 -3.44 0.00 0.00 2.34 0.00 0.00 41.12 40.58 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 -0.50 0.80 3.23 0.27 0.00 -1.26 -5.02 105.19 102.72 2kd2 n GLY 106 Ca -0.09 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.31 1.39 -0.96 1.61 2.02 -0.36 -5.07 118.70 117.01 2kd2 s GLU 107 Ca 0.00 -1.76 -0.24 0.00 0.02 0.00 0.00 54.97 52.99 2kd2 s GLU 107 Cb 0.00 0.28 -0.06 0.00 0.10 0.00 0.00 34.13 34.45 2kd2 s GLU 107 CO 0.00 -0.47 1.97 -0.51 0.02 0.00 0.00 175.26 176.27 2kd2 s ASP 108 N -3.23 5.02 0.01 -0.19 1.01 -1.26 -0.37 116.67 117.66 2kd2 s ASP 108 Ca 0.40 -0.84 -0.30 0.00 0.71 0.00 0.00 52.55 52.51 2kd2 s ASP 108 Cb 0.05 -2.57 -0.06 0.00 1.01 0.00 0.00 42.92 41.36 2kd2 s ASP 108 CO 0.17 -2.91 1.48 -0.22 0.21 0.00 0.00 175.17 173.90 2kd2 s LEU 109 N 10.64 4.33 -0.31 1.23 2.96 0.13 -4.87 118.68 132.79 2kd2 s LEU 109 Ca 0.71 2.21 -0.08 0.00 -0.22 0.00 0.00 54.13 56.75 2kd2 s LEU 109 Cb -0.06 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 43.08 2kd2 s LEU 109 CO 0.03 -0.77 0.12 -0.60 -1.32 0.00 0.00 176.35 173.80 2kd2 s ARG 110 N 2.54 3.06 -0.09 1.98 3.52 -1.26 -1.49 118.95 127.20 2kd2 s ARG 110 Ca 0.67 -0.89 -0.02 0.00 -0.13 0.00 0.00 55.73 55.35 2kd2 s ARG 110 Cb -0.34 -3.47 -0.03 0.00 -1.56 0.00 0.00 34.95 29.55 2kd2 s ARG 110 CO 0.28 -0.49 0.01 0.08 -0.81 0.00 0.00 175.30 174.37 2kd2 s VAL 111 N 1.52 4.40 -0.02 7.11 1.01 0.27 -3.77 120.40 130.92 2kd2 s VAL 111 Ca 0.03 -0.21 0.01 0.00 0.00 0.00 0.00 61.98 61.81 2kd2 s VAL 111 Cb -0.18 -2.86 0.01 0.00 0.00 0.00 0.00 36.38 33.35 2kd2 s VAL 111 CO 0.04 0.60 -0.04 -0.69 0.00 0.00 0.00 175.10 175.01 2kd2 s VAL 112 N -0.82 0.41 -0.36 2.92 1.01 -0.17 -0.03 120.40 123.35 2kd2 s VAL 112 Ca 0.13 -0.14 0.02 0.00 0.00 0.00 0.00 61.98 61.98 2kd2 s VAL 112 Cb -0.11 -0.40 0.10 0.00 0.00 0.00 0.00 36.38 35.97 2kd2 s VAL 112 CO 0.02 0.15 0.10 -0.22 0.00 0.00 0.00 175.10 175.16 2kd2 s LEU 113 N 0.36 4.90 0.16 3.92 2.96 0.86 -0.06 118.68 131.78 2kd2 s LEU 113 Ca -0.04 -2.09 -0.30 0.00 -0.22 0.00 0.00 54.13 51.48 2kd2 s LEU 113 Cb -0.08 -1.70 -0.07 0.00 0.50 0.00 0.00 46.19 44.84 2kd2 s LEU 113 CO -0.00 -0.43 1.11 -1.61 -1.32 0.00 0.00 176.35 174.09 2kd2 s GLU 114 N 0.99 4.57 0.38 1.98 2.02 -0.93 -1.40 118.70 126.31 2kd2 s GLU 114 Ca 0.09 1.71 0.27 0.00 0.02 0.00 0.00 54.97 57.07 2kd2 s GLU 114 Cb -0.20 -3.29 0.96 0.00 0.10 0.00 0.00 34.13 31.69 2kd2 s GLU 114 CO -0.07 0.03 1.80 0.87 0.02 0.00 0.00 175.26 177.91 2kd2 h LYS 115 N 5.39 0.00 -0.20 1.61 1.57 -1.84 0.26 116.57 123.36 2kd2 h LYS 115 Ca -0.44 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.40 2kd2 h LYS 115 Cb 1.21 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.45 2kd2 h LYS 115 CO 0.74 0.00 -0.28 0.22 -0.57 0.00 0.00 179.45 179.55 2kd2 h ASP 116 N 0.00 -0.89 0.00 0.86 3.58 -1.92 -3.30 116.42 114.74 2kd2 h ASP 116 Ca 0.00 0.14 0.00 0.00 0.42 0.00 0.00 57.03 57.59 2kd2 h ASP 116 Cb 0.60 0.40 0.00 0.00 1.72 0.00 0.00 39.33 42.05 2kd2 h ASP 116 CO 0.00 -0.32 -0.25 0.41 -2.88 0.00 0.00 179.24 176.20 2kd2 n THR 117 N -5.39 0.46 -2.14 2.25 -1.04 -1.23 -4.98 114.28 102.20 2kd2 n THR 117 Ca -0.02 -0.54 -0.15 0.00 -2.04 0.00 0.00 64.05 61.30 2kd2 n THR 117 Cb 0.31 0.46 -0.02 0.00 -1.82 0.00 0.00 70.33 69.25 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 -0.33 -1.84 -2.87 -2.82 1.56 0.89 -4.93 117.12 106.78 2kd2 n MET 118 Ca 0.03 0.78 -0.33 0.00 -0.27 0.00 0.00 57.70 57.91 2kd2 n MET 118 Cb 0.61 -5.30 -0.07 0.00 2.15 0.00 0.00 33.22 30.60 2kd2 n MET 118 CO 0.00 0.00 0.00 -0.51 -0.73 0.00 0.00 175.97 174.73 2kd2 s ASP 119 N -2.11 6.95 -0.18 6.12 1.01 -1.18 -4.82 116.67 122.47 2kd2 s ASP 119 Ca 0.00 1.64 -0.07 0.00 0.71 0.00 0.00 52.55 54.83 2kd2 s ASP 119 Cb 0.00 -2.52 -0.04 0.00 1.01 0.00 0.00 42.92 41.38 2kd2 s ASP 119 CO 0.00 -0.30 0.05 -0.69 0.21 0.00 0.00 175.17 174.43 2kd2 s VAL 120 N -2.09 4.59 -0.15 -1.27 1.01 -1.26 -2.18 120.40 119.05 2kd2 s VAL 120 Ca 0.59 -0.10 -0.01 0.00 0.00 0.00 0.00 61.98 62.46 2kd2 s VAL 120 Cb -0.10 -3.07 -0.01 0.00 0.00 0.00 0.00 36.38 33.20 2kd2 s VAL 120 CO 0.15 0.45 -0.10 0.86 0.00 0.00 0.00 175.10 176.46 2kd2 s TRP 121 N 0.49 2.87 -0.04 5.22 -0.00 0.92 -0.36 118.94 128.05 2kd2 s TRP 121 Ca 0.02 -0.69 -0.01 0.00 -0.00 0.00 0.00 56.10 55.42 2kd2 s TRP 121 Cb -0.13 -1.92 0.03 0.00 -0.00 0.00 0.00 33.47 31.46 2kd2 s TRP 121 CO 0.01 -0.28 0.08 0.00 -0.00 0.00 0.00 176.95 176.77 2kd2 n ASN 123 N 4.25 -0.66 -3.96 0.00 5.03 -1.25 -1.19 115.26 117.48 2kd2 n ASN 123 Ca -0.26 -1.01 -0.27 0.00 0.87 0.00 0.00 54.58 53.91 2kd2 n ASN 123 Cb 0.51 -3.05 -0.01 0.00 -1.02 0.00 0.00 39.78 36.20 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 -1.97 -0.29 3.07 7.41 0.00 -1.26 -4.96 105.19 107.18 2kd2 n GLY 124 Ca -0.30 0.15 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 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 -6.54 0.33 -0.59 1.61 0.74 -0.34 -5.09 119.66 109.77 2kd2 s GLN 125 Ca 0.18 0.76 -0.27 0.00 0.05 0.00 0.00 55.36 56.08 2kd2 s GLN 125 Cb -0.10 -0.11 -0.10 0.00 1.10 0.00 0.00 33.01 33.80 2kd2 s GLN 125 CO 0.88 -0.46 2.47 1.17 -0.55 0.00 0.00 175.29 178.80 2kd2 n LYS 126 N 5.38 0.83 -0.71 1.67 4.81 -1.26 -2.65 118.16 126.23 2kd2 n LYS 126 Ca -0.06 0.01 -0.31 0.00 -0.87 0.00 0.00 58.31 57.08 2kd2 n LYS 126 Cb 0.50 -3.02 0.16 0.00 0.02 0.00 0.00 35.03 32.69 2kd2 n LYS 126 CO 0.00 0.00 0.00 -1.33 1.17 0.00 0.00 177.40 177.24 2kd2 n MET 127 N 8.88 -0.41 -3.57 1.64 2.81 0.52 -4.98 117.12 122.01 2kd2 n MET 127 Ca 0.43 -0.05 -0.41 0.00 -1.81 0.00 0.00 57.70 55.86 2kd2 n MET 127 Cb 0.43 -2.36 -0.10 0.00 -0.71 0.00 0.00 33.22 30.48 2kd2 n MET 127 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 2kd2 s GLU 128 N -4.55 2.73 0.32 0.03 2.02 -1.26 -4.60 118.70 113.39 2kd2 s GLU 128 Ca 0.67 -1.34 0.05 0.00 0.02 0.00 0.00 54.97 54.37 2kd2 s GLU 128 Cb -0.23 -3.83 0.05 0.00 0.10 0.00 0.00 34.13 30.23 2kd2 s GLU 128 CO 0.58 -0.90 0.44 0.25 0.02 0.00 0.00 175.26 175.66 2kd2 n THR 129 N 4.99 0.00 -0.04 3.63 -2.24 -1.26 -3.89 114.28 115.47 2kd2 n THR 129 Ca -0.11 -1.02 -0.08 0.00 -2.27 0.00 0.00 64.05 60.57 2kd2 n THR 129 Cb 0.44 -0.78 -0.03 0.00 -2.10 0.00 0.00 70.33 67.86 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 -2.67 2.33 -2.35 6.98 0.00 -0.83 -4.81 120.51 119.15 2kd2 n ALA 130 Ca -0.07 -0.33 -0.04 0.00 0.00 0.00 0.00 53.44 52.99 2kd2 n ALA 130 Cb 0.32 0.38 0.02 0.00 0.00 0.00 0.00 19.45 20.17 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 2.62 0.24 3.60 0.00 0.00 -1.25 -4.93 105.19 105.47 2kd2 n GLY 131 Ca -0.16 -0.32 -0.43 0.00 0.00 0.00 0.00 46.02 45.11 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 -4.31 3.73 -0.26 1.61 2.02 -1.08 -4.91 118.70 115.51 2kd2 s GLU 132 Ca 0.01 0.56 -0.27 0.00 0.02 0.00 0.00 54.97 55.28 2kd2 s GLU 132 Cb -0.00 -3.89 0.01 0.00 0.10 0.00 0.00 34.13 30.34 2kd2 s GLU 132 CO 0.19 -1.30 0.95 -0.06 0.02 0.00 0.00 175.26 175.06 2kd2 s PHE 133 N 4.26 3.29 0.45 1.61 0.40 -1.26 -1.40 117.98 125.32 2kd2 s PHE 133 Ca 0.46 1.26 0.06 0.00 -0.60 0.00 0.00 56.93 58.10 2kd2 s PHE 133 Cb -0.08 -3.26 0.06 0.00 0.51 0.00 0.00 43.02 40.25 2kd2 s PHE 133 CO 0.29 -0.51 0.47 1.33 0.70 0.00 0.00 175.22 177.51 2kd2 n VAL 134 N 5.41 0.00 -0.08 -0.44 0.24 -0.91 -4.99 118.33 117.55 2kd2 n VAL 134 Ca 0.09 -1.64 0.15 0.00 -2.04 0.00 0.00 64.34 60.90 2kd2 n VAL 134 Cb 0.47 -0.36 0.55 0.00 -1.47 0.00 0.00 33.84 33.03 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 0.31 0.28 -1.24 -1.34 5.19 -2.05 -3.36 116.42 114.21 2kd2 h ASP 135 Ca -0.25 0.01 -0.14 0.00 -0.62 0.00 0.00 57.03 56.03 2kd2 h ASP 135 Cb 1.00 -0.05 -0.22 0.00 0.18 0.00 0.00 39.33 40.24 2kd2 h ASP 135 CO 0.37 0.16 -0.51 1.51 -3.12 0.00 0.00 179.24 177.65 2kd2 s ASP 136 N -6.16 -0.84 0.00 6.45 -4.77 -1.26 -5.14 116.67 104.95 2kd2 s ASP 136 Ca -0.07 -0.99 0.00 0.00 -3.30 0.00 0.00 52.55 48.19 2kd2 s ASP 136 Cb 0.20 1.61 0.00 0.00 -1.09 0.00 0.00 42.92 43.64 2kd2 s ASP 136 CO 0.75 -0.19 0.00 0.61 0.70 0.00 0.00 175.17 177.04 2kd2 n GLY 137 N 4.37 0.91 2.88 2.12 0.00 -1.26 -4.68 105.19 109.53 2kd2 n GLY 137 Ca 0.11 -2.18 -0.19 0.00 0.00 0.00 0.00 46.02 43.77 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 -0.99 0.41 -0.56 2.61 2.01 -1.14 -2.15 115.64 115.83 2kd2 s THR 138 Ca 0.00 -0.07 -0.12 0.00 0.31 0.00 0.00 61.69 61.81 2kd2 s THR 138 Cb 0.00 -0.45 0.14 0.00 0.01 0.00 0.00 72.50 72.21 2kd2 s THR 138 CO 0.00 0.19 0.48 -1.61 -0.69 0.00 0.00 174.62 172.99 2kd2 s GLU 139 N 0.83 2.87 -0.47 4.92 2.02 -0.49 -2.52 118.70 125.86 2kd2 s GLU 139 Ca -0.10 -1.89 -0.28 0.00 0.02 0.00 0.00 54.97 52.71 2kd2 s GLU 139 Cb -0.13 -4.15 0.03 0.00 0.10 0.00 0.00 34.13 29.98 2kd2 s GLU 139 CO -0.00 -1.27 1.11 0.95 0.02 0.00 0.00 175.26 176.07 2kd2 s THR 140 N 1.20 4.25 -0.40 3.63 -4.23 -1.20 -2.64 115.64 116.25 2kd2 s THR 140 Ca 0.07 1.17 -0.13 0.00 -1.18 0.00 0.00 61.69 61.62 2kd2 s THR 140 Cb -0.25 -4.58 0.03 0.00 1.34 0.00 0.00 72.50 69.04 2kd2 s THR 140 CO -0.01 -0.97 0.27 -1.00 -0.54 0.00 0.00 174.62 172.37 2kd2 s HIS 141 N 4.34 3.25 0.04 3.99 3.76 -1.26 -2.90 115.29 126.50 2kd2 s HIS 141 Ca 0.46 -0.81 0.00 0.00 -0.15 0.00 0.00 55.06 54.57 2kd2 s HIS 141 Cb -0.08 -2.61 -0.03 0.00 1.11 0.00 0.00 32.58 30.98 2kd2 s HIS 141 CO 0.31 -0.65 -0.04 -0.59 -0.85 0.00 0.00 174.74 172.92 2kd2 s PHE 142 N 1.62 0.47 0.38 1.40 -0.12 -1.24 -1.96 117.98 118.52 2kd2 s PHE 142 Ca 0.04 -0.69 0.08 0.00 -0.05 0.00 0.00 56.93 56.31 2kd2 s PHE 142 Cb -0.20 -0.31 -0.05 0.00 -0.63 0.00 0.00 43.02 41.83 2kd2 s PHE 142 CO 0.08 -0.21 0.11 -1.54 -0.05 0.00 0.00 175.22 173.61 2kd2 s SER 143 N -1.98 4.36 -0.31 1.98 1.04 -1.25 -3.68 113.70 113.85 2kd2 s SER 143 Ca -0.07 -1.01 0.01 0.00 0.48 0.00 0.00 55.95 55.36 2kd2 s SER 143 Cb -0.04 -0.54 0.15 0.00 0.10 0.00 0.00 66.02 65.69 2kd2 s SER 143 CO -0.03 -0.40 0.36 -0.69 0.98 0.00 0.00 173.24 173.46 2kd2 s VAL 144 N -2.55 -0.49 0.00 5.02 1.01 -1.25 -4.73 120.40 117.42 2kd2 s VAL 144 Ca 0.38 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.86 2kd2 s VAL 144 Cb 0.02 -0.91 0.00 0.00 0.00 0.00 0.00 36.38 35.48 2kd2 s VAL 144 CO 0.21 -0.41 0.00 0.61 0.00 0.00 0.00 175.10 175.51 2kd2 n GLY 145 N 5.12 0.50 0.71 4.51 0.00 -1.26 -1.02 105.19 113.75 2kd2 n GLY 145 Ca 0.01 0.60 0.06 0.00 0.00 0.00 0.00 46.02 46.69 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 8.76 1.61 -3.32 1.61 2.85 -1.26 -5.05 115.26 120.46 2kd2 n ASN 146 Ca 0.00 -3.52 -0.17 0.00 -0.11 0.00 0.00 54.58 50.79 2kd2 n ASN 146 Cb 0.00 -0.48 -0.04 0.00 1.24 0.00 0.00 39.78 40.50 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 -0.86 0.55 -3.62 1.20 8.25 -0.19 -5.15 115.22 115.40 2kd2 n HIS 147 Ca 0.16 -1.32 -0.16 0.00 -0.26 0.00 0.00 57.72 56.14 2kd2 n HIS 147 Cb 0.76 -0.15 -0.14 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 -2.44 0.77 0.04 0.41 -1.08 -1.26 -3.84 116.67 109.26 2kd2 s ASP 148 Ca 0.01 0.29 -0.04 0.00 -0.52 0.00 0.00 52.55 52.29 2kd2 s ASP 148 Cb 0.00 0.46 -0.02 0.00 -1.46 0.00 0.00 42.92 41.90 2kd2 s ASP 148 CO 0.01 -0.26 0.05 0.00 0.52 0.00 0.00 175.17 175.49 2kd2 s TYR 150 N -3.01 -0.34 -0.39 0.00 1.13 -0.49 -3.62 117.35 110.61 2kd2 s TYR 150 Ca -0.02 0.69 -0.16 0.00 -1.41 0.00 0.00 57.07 56.17 2kd2 s TYR 150 Cb 0.01 0.16 0.01 0.00 -1.10 0.00 0.00 41.96 41.04 2kd2 s TYR 150 CO -0.07 -0.36 0.39 0.42 -2.51 0.00 0.00 175.55 173.43 2kd2 s ILE 151 N -0.74 5.14 -0.67 -3.49 1.01 -1.14 -0.79 121.20 120.52 2kd2 s ILE 151 Ca -0.08 -0.27 -0.27 0.00 0.00 0.00 0.00 60.65 60.02 2kd2 s ILE 151 Cb -0.04 -3.95 0.03 0.00 0.01 0.00 0.00 42.46 38.51 2kd2 s ILE 151 CO 0.04 -0.30 1.25 -0.75 0.00 0.00 0.00 174.94 175.18 2kd2 s LYS 152 N 2.03 3.31 -0.04 2.79 2.20 0.88 -3.24 119.74 127.68 2kd2 s LYS 152 Ca 0.11 -0.03 -0.13 0.00 -0.36 0.00 0.00 55.97 55.57 2kd2 s LYS 152 Cb -0.17 -4.12 -0.05 0.00 -1.51 0.00 0.00 37.83 31.98 2kd2 s LYS 152 CO 0.12 -1.97 0.34 0.00 -0.36 0.00 0.00 175.35 173.48 2kd2 s ALA 153 N 5.47 3.74 -0.06 3.13 0.00 -1.05 0.05 121.76 133.05 2kd2 s ALA 153 Ca 0.39 -0.33 -0.01 0.00 0.00 0.00 0.00 51.96 52.01 2kd2 s ALA 153 Cb -0.08 -2.28 0.03 0.00 0.00 0.00 0.00 23.12 20.79 2kd2 s ALA 153 CO 0.19 0.51 -0.01 0.08 0.00 0.00 0.00 175.76 176.53 2kd2 s VAL 154 N -1.02 0.37 0.23 0.00 1.01 -0.20 -2.90 120.40 117.90 2kd2 s VAL 154 Ca 0.21 0.08 -0.09 0.00 0.00 0.00 0.00 61.98 62.18 2kd2 s VAL 154 Cb -0.15 -0.50 -0.07 0.00 0.00 0.00 0.00 36.38 35.66 2kd2 s VAL 154 CO 0.11 0.24 0.54 -0.94 0.00 0.00 0.00 175.10 175.05 2kd2 s SER 155 N 1.66 6.60 -0.09 3.32 1.04 -1.26 -1.30 113.70 123.67 2kd2 s SER 155 Ca 0.00 0.89 -0.04 0.00 0.48 0.00 0.00 55.95 57.28 2kd2 s SER 155 Cb -0.13 -2.21 0.04 0.00 0.10 0.00 0.00 66.02 63.82 2kd2 s SER 155 CO -0.04 -0.08 0.19 -0.94 0.98 0.00 0.00 173.24 173.35 2kd2 s SER 156 N -2.43 -0.06 0.00 7.02 1.04 0.69 -4.89 113.70 115.06 2kd2 s SER 156 Ca 0.47 0.40 0.00 0.00 0.48 0.00 0.00 55.95 57.30 2kd2 s SER 156 Cb -0.11 0.31 0.00 0.00 0.10 0.00 0.00 66.02 66.31 2kd2 s SER 156 CO 0.22 -0.17 0.00 0.61 0.98 0.00 0.00 173.24 174.88 2kd2 n GLY 157 N 4.39 0.49 0.05 7.32 0.00 -1.26 -1.17 105.19 115.01 2kd2 n GLY 157 Ca -0.23 -1.52 -0.04 0.00 0.00 0.00 0.00 46.02 44.23 2kd2 n GLY 157 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kd2 n LYS 158 N 0.00 0.32 0.00 1.61 5.02 -1.26 -4.91 118.16 118.95 2kd2 n LYS 158 Ca 0.00 0.29 0.00 0.00 -2.02 0.00 0.00 58.31 56.58 2kd2 n LYS 158 Cb 0.00 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 2kd2 n LYS 158 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 2kd2 n ARG 159 N -3.80 1.30 -2.67 1.97 0.00 -1.26 -4.96 116.66 107.25 2kd2 n ARG 159 Ca -0.07 0.00 -0.04 0.00 -0.00 0.00 0.00 57.85 57.74 2kd2 n ARG 159 Cb 0.26 -0.95 0.04 0.00 -0.00 0.00 0.00 32.46 31.80 2kd2 n ARG 159 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 2kd2 n LYS 160 N -2.20 0.40 0.21 2.89 4.81 -1.26 -5.04 118.16 117.97 2kd2 n LYS 160 Ca 0.00 -0.96 -0.09 0.00 -0.87 0.00 0.00 58.31 56.39 2kd2 n LYS 160 Cb 0.45 -0.09 -0.04 0.00 0.02 0.00 0.00 35.03 35.37 2kd2 n LYS 160 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 2kd2 h GLU 161 N 1.57 -0.57 -3.42 1.64 4.22 -1.92 -3.47 114.58 112.64 2kd2 h GLU 161 Ca -0.46 0.04 -0.20 0.00 0.08 0.00 0.00 59.36 58.81 2kd2 h GLU 161 Cb 1.24 0.13 -0.27 0.00 0.50 0.00 0.00 28.75 30.34 2kd2 h GLU 161 CO -0.13 -0.38 -0.58 0.20 -2.18 0.00 0.00 179.01 175.93 2kd2 s GLY 162 N -2.46 -0.08 0.06 1.92 0.00 -0.31 -5.04 107.32 101.40 2kd2 s GLY 162 Ca -0.09 0.38 0.08 0.00 0.00 0.00 0.00 44.72 45.09 2kd2 s GLY 162 CO 0.26 0.38 -0.21 -0.42 0.00 0.00 0.00 173.10 173.11 2kd2 s ILE 163 N 0.20 1.70 -0.07 0.90 1.01 -1.26 -0.22 121.20 123.45 2kd2 s ILE 163 Ca -0.01 -1.29 -0.00 0.00 0.00 0.00 0.00 60.65 59.34 2kd2 s ILE 163 Cb -0.02 -1.49 0.03 0.00 0.01 0.00 0.00 42.46 40.98 2kd2 s ILE 163 CO -0.01 0.15 -0.03 -0.63 0.00 0.00 0.00 174.94 174.42 2kd2 s ILE 164 N -0.89 0.56 -0.08 2.92 1.01 -0.42 -5.00 121.20 119.30 2kd2 s ILE 164 Ca 0.07 -0.04 -0.07 0.00 0.00 0.00 0.00 60.65 60.62 2kd2 s ILE 164 Cb -0.09 -0.65 -0.04 0.00 0.01 0.00 0.00 42.46 41.69 2kd2 s ILE 164 CO 0.02 0.27 0.17 -1.00 0.00 0.00 0.00 174.94 174.41 2kd2 s HIS 165 N 1.57 3.60 -0.24 3.97 3.76 -1.26 -1.03 115.29 125.66 2kd2 s HIS 165 Ca -0.00 0.53 -0.01 0.00 -0.15 0.00 0.00 55.06 55.42 2kd2 s HIS 165 Cb -0.13 -1.94 0.07 0.00 1.11 0.00 0.00 32.58 31.69 2kd2 s HIS 165 CO -0.04 0.71 0.03 0.95 -0.85 0.00 0.00 174.74 175.54 2kd2 s THR 166 N -1.11 0.91 0.23 1.30 -4.23 0.11 -4.96 115.64 107.89 2kd2 s THR 166 Ca 0.19 -1.00 -0.30 0.00 -1.18 0.00 0.00 61.69 59.39 2kd2 s THR 166 Cb -0.12 -1.44 -0.10 0.00 1.34 0.00 0.00 72.50 72.18 2kd2 s THR 166 CO 0.08 -0.33 1.46 -0.22 -0.54 0.00 0.00 174.62 175.08 2kd2 s LEU 167 N 1.66 4.38 -0.17 4.79 2.96 -1.26 -0.08 118.68 130.95 2kd2 s LEU 167 Ca 0.01 2.66 -0.04 0.00 -0.22 0.00 0.00 54.13 56.54 2kd2 s LEU 167 Cb -0.18 -3.62 0.06 0.00 0.50 0.00 0.00 46.19 42.95 2kd2 s LEU 167 CO -0.13 -0.73 0.06 -0.63 -1.32 0.00 0.00 176.35 173.60 2kd2 s ILE 168 N 0.22 0.24 -0.17 6.68 1.01 0.03 -0.54 121.20 128.68 2kd2 s ILE 168 Ca 0.61 -0.30 -0.02 0.00 0.00 0.00 0.00 60.65 60.94 2kd2 s ILE 168 Cb -0.42 -0.77 -0.01 0.00 0.01 0.00 0.00 42.46 41.27 2kd2 s ILE 168 CO 0.41 -0.18 -0.10 -0.69 0.00 0.00 0.00 174.94 174.38 2kd2 s VAL 169 N 1.99 3.12 -1.09 2.92 1.01 -0.86 -1.40 120.40 126.10 2kd2 s VAL 169 Ca 0.01 -0.61 -0.05 0.00 0.00 0.00 0.00 61.98 61.33 2kd2 s VAL 169 Cb -0.16 -2.36 0.01 0.00 0.00 0.00 0.00 36.38 33.86 2kd2 s VAL 169 CO -0.08 0.48 0.94 -0.67 0.00 0.00 0.00 175.10 175.77 2kd2 n ASP 170 N 4.18 -4.50 -3.72 3.32 -0.08 -1.12 -2.54 116.55 112.08 2kd2 n ASP 170 Ca -0.18 -0.47 -0.26 0.00 -1.51 0.00 0.00 54.79 52.37 2kd2 n ASP 170 Cb 0.52 -4.30 0.06 0.00 2.34 0.00 0.00 41.12 39.73 2kd2 n ASP 170 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2kd2 n ASN 171 N -2.42 -5.04 -3.77 1.67 3.02 -1.26 -4.99 115.26 102.46 2kd2 n ASN 171 Ca -0.07 -0.66 -0.19 0.00 -0.03 0.00 0.00 54.58 53.63 2kd2 n ASN 171 Cb 0.58 -4.50 -0.17 0.00 -0.61 0.00 0.00 39.78 35.08 2kd2 n ASN 171 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2kd2 s ARG 172 N -6.35 0.26 0.49 3.52 0.52 -1.05 -5.14 118.95 111.20 2kd2 s ARG 172 Ca 0.53 0.15 -0.23 0.00 -0.52 0.00 0.00 55.73 55.66 2kd2 s ARG 172 Cb -0.25 -0.57 -0.07 0.00 0.52 0.00 0.00 34.95 34.58 2kd2 s ARG 172 CO 0.78 -0.21 1.34 -2.00 0.02 0.00 0.00 175.30 175.22 2kd2 s GLU 173 N 1.46 3.48 -0.08 3.54 2.12 -1.26 -2.03 118.70 125.93 2kd2 s GLU 173 Ca -0.04 2.20 0.04 0.00 0.36 0.00 0.00 54.97 57.53 2kd2 s GLU 173 Cb -0.13 -2.45 0.00 0.00 0.26 0.00 0.00 34.13 31.81 2kd2 s GLU 173 CO -0.03 -0.91 -0.20 0.42 -0.54 0.00 0.00 175.26 174.00 2kd2 s ILE 174 N -1.31 1.74 0.28 -3.70 -1.09 0.30 -4.90 121.20 112.53 2kd2 s ILE 174 Ca 0.66 -0.85 -0.29 0.00 -2.23 0.00 0.00 60.65 57.94 2kd2 s ILE 174 Cb -0.39 -1.52 -0.10 0.00 -1.58 0.00 0.00 42.46 38.88 2kd2 s ILE 174 CO 0.48 0.49 1.25 -2.16 -1.23 0.00 0.00 174.94 173.77 2kd2 s PRO 175 N 0.34 4.44 -0.12 2.79 0.04 -1.26 -4.31 135.00 136.92 2kd2 s PRO 175 Ca -0.14 2.05 -0.22 0.00 0.04 0.00 0.00 61.00 62.73 2kd2 s PRO 175 Cb -0.16 -3.14 -0.03 0.00 0.04 0.00 0.00 34.50 31.20 2kd2 s PRO 175 CO 0.06 -0.10 0.65 -2.00 0.04 0.00 0.00 177.00 175.65 2kd2 s GLU 176 N -1.17 4.34 -0.47 4.56 2.12 -1.26 -4.26 118.70 122.56 2kd2 s GLU 176 Ca 0.50 0.73 -0.28 0.00 0.36 0.00 0.00 54.97 56.28 2kd2 s GLU 176 Cb -0.37 -3.50 -0.01 0.00 0.26 0.00 0.00 34.13 30.52 2kd2 s GLU 176 CO 0.45 -0.04 1.64 -1.17 -0.54 0.00 0.00 175.26 175.60 2kd2 s LEU 177 N 1.22 3.44 -0.17 2.70 1.98 -0.75 -4.91 118.68 122.18 2kd2 s LEU 177 Ca 0.33 0.71 -0.34 0.00 -2.89 0.00 0.00 54.13 51.94 2kd2 s LEU 177 Cb -0.17 -3.16 0.14 0.00 0.66 0.00 0.00 46.19 43.66 2kd2 s LEU 177 CO 0.14 -1.82 1.17 0.28 -1.89 0.00 0.00 176.35 174.23 2kd2 s THR 178 N 6.92 0.00 -1.98 3.68 -1.32 -1.26 -4.60 115.64 117.08 2kd2 s THR 178 Ca 0.66 0.00 0.16 0.00 -1.21 0.00 0.00 61.69 61.30 2kd2 s THR 178 Cb -0.15 -1.00 0.13 0.00 -1.51 0.00 0.00 72.50 69.96 2kd2 s THR 178 CO 0.28 0.00 1.00 0.00 -2.21 0.00 0.00 174.62 173.69