#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 2.91 0.03 1.61 0.04 -1.26 -5.07 135.00 133.27 2kd2 s PRO 87 Ca 0.00 1.44 0.02 0.00 0.04 0.00 0.00 61.00 62.50 2kd2 s PRO 87 Cb 0.00 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.56 2kd2 s PRO 87 CO 0.00 -1.17 -0.08 -0.51 0.04 0.00 0.00 177.00 175.28 2kd2 s LEU 88 N -4.65 2.20 0.00 -3.56 2.01 -1.26 -4.87 118.68 108.55 2kd2 s LEU 88 Ca 0.68 -0.46 0.00 0.00 0.01 0.00 0.00 54.13 54.37 2kd2 s LEU 88 Cb -0.21 -0.24 0.00 0.00 0.01 0.00 0.00 46.19 45.75 2kd2 s LEU 88 CO 0.39 -0.12 0.00 0.61 1.01 0.00 0.00 176.35 178.23 2kd2 n GLY 89 N 1.78 1.07 1.30 -3.19 0.00 -1.26 -5.09 105.19 99.80 2kd2 n GLY 89 Ca -0.20 0.00 0.16 0.00 0.00 0.00 0.00 46.02 45.98 2kd2 n GLY 89 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2kd2 n SER 90 N 0.00 -7.67 -3.51 1.61 2.88 -1.26 -4.89 113.62 100.77 2kd2 n SER 90 Ca 0.00 0.99 -0.21 0.00 -1.33 0.00 0.00 58.87 58.32 2kd2 n SER 90 Cb 0.00 -4.24 0.08 0.00 -0.75 0.00 0.00 64.21 59.31 2kd2 n SER 90 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2kd2 n GLU 91 N -4.13 -7.40 -2.56 -1.46 2.13 -1.26 -4.93 120.64 101.04 2kd2 n GLU 91 Ca -0.04 0.83 -0.43 0.00 0.66 0.00 0.00 57.16 58.18 2kd2 n GLU 91 Cb 0.61 -5.86 -0.02 0.00 0.27 0.00 0.00 31.44 26.44 2kd2 n GLU 91 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 2kd2 s ASN 92 N -3.74 7.03 0.31 4.31 3.84 -1.26 -4.74 114.94 120.69 2kd2 s ASN 92 Ca 0.35 1.51 0.00 0.00 0.21 0.00 0.00 52.86 54.93 2kd2 s ASN 92 Cb -0.15 -2.54 0.00 0.00 -0.55 0.00 0.00 41.25 38.01 2kd2 s ASN 92 CO 0.73 -0.71 0.00 0.54 -2.79 0.00 0.00 177.10 174.86 2kd2 n ARG 93 N 6.46 0.00 -1.63 0.43 1.74 -1.26 -5.10 116.66 117.29 2kd2 n ARG 93 Ca 0.13 0.00 -0.48 0.00 -0.77 0.00 0.00 57.85 56.73 2kd2 n ARG 93 Cb 0.46 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.85 2kd2 n ARG 93 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2kd2 n SER 94 N -3.29 2.44 -3.50 0.55 2.88 -1.26 -4.95 113.62 106.49 2kd2 n SER 94 Ca 0.00 1.10 0.02 0.00 -1.33 0.00 0.00 58.87 58.67 2kd2 n SER 94 Cb 0.00 -1.33 -0.05 0.00 -0.75 0.00 0.00 64.21 62.08 2kd2 n SER 94 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2kd2 s LYS 95 N 0.59 0.10 0.21 -1.46 0.00 -1.26 -5.17 119.74 112.75 2kd2 s LYS 95 Ca 0.80 0.19 -0.12 0.00 0.00 0.00 0.00 55.97 56.84 2kd2 s LYS 95 Cb -0.79 0.06 -0.07 0.00 0.00 0.00 0.00 37.83 37.03 2kd2 s LYS 95 CO 0.43 -0.02 0.57 0.99 0.00 0.00 0.00 175.35 177.31 2kd2 s THR 96 N 1.46 4.87 -0.28 3.79 2.01 -1.26 -5.08 115.64 121.15 2kd2 s THR 96 Ca -0.05 0.66 -0.14 0.00 0.31 0.00 0.00 61.69 62.46 2kd2 s THR 96 Cb -0.02 -3.66 0.09 0.00 0.01 0.00 0.00 72.50 68.92 2kd2 s THR 96 CO -0.13 0.04 0.67 0.42 -0.69 0.00 0.00 174.62 174.93 2kd2 s THR 97 N -1.70 -0.22 -0.28 -0.82 -4.23 -1.26 -3.24 115.64 103.88 2kd2 s THR 97 Ca 0.44 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 60.88 2kd2 s THR 97 Cb -0.13 -0.99 -0.01 0.00 1.34 0.00 0.00 72.50 72.72 2kd2 s THR 97 CO 0.20 0.00 0.10 -0.44 -0.54 0.00 0.00 174.62 173.94 2kd2 s SER 98 N 1.91 5.23 0.32 3.99 0.01 -0.93 -4.94 113.70 119.30 2kd2 s SER 98 Ca -0.09 -0.49 0.09 0.00 1.31 0.00 0.00 55.95 56.77 2kd2 s SER 98 Cb -0.07 -1.93 -0.04 0.00 0.21 0.00 0.00 66.02 64.19 2kd2 s SER 98 CO -0.20 -0.14 0.10 0.42 0.41 0.00 0.00 173.24 173.83 2kd2 s THR 99 N 1.57 3.09 0.01 1.44 -4.23 -1.26 -0.05 115.64 116.21 2kd2 s THR 99 Ca 0.04 -1.77 -0.14 0.00 -1.18 0.00 0.00 61.69 58.64 2kd2 s THR 99 Cb -0.16 -2.94 0.02 0.00 1.34 0.00 0.00 72.50 70.76 2kd2 s THR 99 CO 0.04 -0.23 0.30 0.26 -0.54 0.00 0.00 174.62 174.45 2kd2 s TRP 100 N -2.41 -0.14 -0.19 3.99 0.51 0.86 -2.15 118.94 119.42 2kd2 s TRP 100 Ca 0.36 0.12 0.01 0.00 -2.12 0.00 0.00 56.10 54.46 2kd2 s TRP 100 Cb -0.03 0.09 0.04 0.00 -0.81 0.00 0.00 33.47 32.76 2kd2 s TRP 100 CO 0.22 -0.44 -0.10 0.08 -0.51 0.00 0.00 176.95 176.20 2kd2 s VAL 101 N -1.88 1.58 0.01 4.03 1.01 -1.26 -0.07 120.40 123.82 2kd2 s VAL 101 Ca -0.10 -0.94 -0.02 0.00 0.00 0.00 0.00 61.98 60.93 2kd2 s VAL 101 Cb -0.03 -1.65 -0.01 0.00 0.00 0.00 0.00 36.38 34.69 2kd2 s VAL 101 CO 0.01 0.19 0.02 -1.48 0.00 0.00 0.00 175.10 173.84 2kd2 s LEU 102 N 1.43 2.01 -0.90 3.92 2.34 -0.56 -4.93 118.68 121.98 2kd2 s LEU 102 Ca -0.01 -0.29 -0.24 0.00 0.06 0.00 0.00 54.13 53.65 2kd2 s LEU 102 Cb -0.16 0.22 -0.02 0.00 -0.56 0.00 0.00 46.19 45.66 2kd2 s LEU 102 CO -0.08 -0.23 1.82 -0.13 -1.06 0.00 0.00 176.35 176.66 2kd2 s ARG 103 N -1.04 2.80 0.14 1.48 0.52 -1.26 0.00 118.95 121.59 2kd2 s ARG 103 Ca -0.11 -0.40 0.10 0.00 -0.52 0.00 0.00 55.73 54.80 2kd2 s ARG 103 Cb -0.07 -5.05 -0.04 0.00 0.52 0.00 0.00 34.95 30.31 2kd2 s ARG 103 CO -0.00 -3.05 -0.24 -1.17 0.02 0.00 0.00 175.30 170.86 2kd2 s LEU 104 N 8.82 2.36 -0.76 2.53 0.20 0.11 -4.64 118.68 127.29 2kd2 s LEU 104 Ca 0.64 -0.78 0.00 0.00 0.69 0.00 0.00 54.13 54.68 2kd2 s LEU 104 Cb -0.06 -1.09 0.00 0.00 -0.43 0.00 0.00 46.19 44.61 2kd2 s LEU 104 CO -0.01 0.12 0.00 -0.67 -0.29 0.00 0.00 176.35 175.50 2kd2 n ASP 105 N 0.72 -5.07 0.00 3.68 2.03 -1.26 -1.29 116.55 115.36 2kd2 n ASP 105 Ca -0.16 0.18 0.00 0.00 0.52 0.00 0.00 54.79 55.32 2kd2 n ASP 105 Cb 0.54 -3.20 0.00 0.00 -0.72 0.00 0.00 41.12 37.74 2kd2 n ASP 105 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kd2 n GLY 106 N -0.50 0.76 3.23 0.27 0.00 -1.26 -5.03 105.19 102.66 2kd2 n GLY 106 Ca -0.07 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.81 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 1.37 -0.92 1.61 2.02 -0.41 -5.07 118.70 116.82 2kd2 s GLU 107 Ca 0.00 -1.75 -0.25 0.00 0.02 0.00 0.00 54.97 53.00 2kd2 s GLU 107 Cb 0.00 0.27 -0.06 0.00 0.10 0.00 0.00 34.13 34.45 2kd2 s GLU 107 CO 0.00 -0.47 1.98 0.16 0.02 0.00 0.00 175.26 176.95 2kd2 s ASP 108 N -3.23 5.03 0.07 -0.19 -4.77 -1.26 0.06 116.67 112.38 2kd2 s ASP 108 Ca 0.39 -0.70 -0.30 0.00 -3.30 0.00 0.00 52.55 48.64 2kd2 s ASP 108 Cb 0.06 -2.56 -0.05 0.00 -1.09 0.00 0.00 42.92 39.27 2kd2 s ASP 108 CO 0.17 -2.86 1.14 -0.22 0.70 0.00 0.00 175.17 174.09 2kd2 s LEU 109 N 10.54 4.39 -0.32 2.11 2.96 0.10 -4.88 118.68 133.58 2kd2 s LEU 109 Ca 0.72 1.96 -0.08 0.00 -0.22 0.00 0.00 54.13 56.50 2kd2 s LEU 109 Cb -0.07 -3.58 0.02 0.00 0.50 0.00 0.00 46.19 43.06 2kd2 s LEU 109 CO 0.01 -0.39 0.12 -0.60 -1.32 0.00 0.00 176.35 174.18 2kd2 s ARG 110 N 0.82 2.99 -0.02 1.98 3.52 -1.26 -1.50 118.95 125.48 2kd2 s ARG 110 Ca 0.56 -0.94 -0.11 0.00 -0.13 0.00 0.00 55.73 55.11 2kd2 s ARG 110 Cb -0.28 -3.50 -0.05 0.00 -1.56 0.00 0.00 34.95 29.56 2kd2 s ARG 110 CO 0.30 -0.53 0.33 0.08 -0.81 0.00 0.00 175.30 174.66 2kd2 s VAL 111 N 1.51 5.19 -0.05 7.11 1.01 0.90 -0.07 120.40 135.99 2kd2 s VAL 111 Ca 0.02 0.56 0.00 0.00 0.00 0.00 0.00 61.98 62.56 2kd2 s VAL 111 Cb -0.18 -3.61 0.03 0.00 0.00 0.00 0.00 36.38 32.62 2kd2 s VAL 111 CO 0.04 0.53 -0.01 -0.69 0.00 0.00 0.00 175.10 174.96 2kd2 s VAL 112 N -1.14 0.37 -0.41 2.92 1.01 0.32 -0.09 120.40 123.38 2kd2 s VAL 112 Ca 0.23 0.03 -0.03 0.00 0.00 0.00 0.00 61.98 62.21 2kd2 s VAL 112 Cb -0.15 -0.46 0.11 0.00 0.00 0.00 0.00 36.38 35.89 2kd2 s VAL 112 CO 0.12 0.21 0.21 -0.22 0.00 0.00 0.00 175.10 175.42 2kd2 s LEU 113 N 1.31 5.25 -0.11 3.92 2.96 0.92 -0.02 118.68 132.92 2kd2 s LEU 113 Ca -0.05 -2.05 -0.30 0.00 -0.22 0.00 0.00 54.13 51.51 2kd2 s LEU 113 Cb -0.13 -1.83 -0.02 0.00 0.50 0.00 0.00 46.19 44.71 2kd2 s LEU 113 CO -0.02 -0.54 1.17 -0.70 -1.32 0.00 0.00 176.35 174.94 2kd2 s GLU 114 N 1.12 4.33 0.38 1.98 2.12 -0.97 -2.19 118.70 125.47 2kd2 s GLU 114 Ca 0.08 1.59 0.27 0.00 0.36 0.00 0.00 54.97 57.28 2kd2 s GLU 114 Cb -0.23 -3.61 1.35 0.00 0.26 0.00 0.00 34.13 31.90 2kd2 s GLU 114 CO -0.04 -0.50 1.82 1.57 -0.54 0.00 0.00 175.26 177.56 2kd2 h LYS 115 N 7.57 0.00 -0.08 4.30 5.09 -1.89 0.29 116.57 131.85 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 0.91 0.00 -0.36 -0.44 -2.09 0.00 0.00 179.45 177.46 2kd2 h ASP 116 N 0.00 -1.12 0.00 7.07 5.19 -1.90 -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 0.46 0.00 0.00 0.18 0.00 0.00 39.33 40.11 2kd2 h ASP 116 CO 0.00 -0.40 -0.22 0.35 -3.12 0.00 0.00 179.24 175.85 2kd2 n THR 117 N -5.43 0.61 -2.27 0.35 -2.24 -1.15 -4.98 114.28 99.16 2kd2 n THR 117 Ca -0.04 -0.71 -0.16 0.00 -2.27 0.00 0.00 64.05 60.87 2kd2 n THR 117 Cb 0.34 0.40 -0.02 0.00 -2.10 0.00 0.00 70.33 68.96 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 -0.43 -1.87 -2.88 -0.78 2.81 0.10 -4.94 117.12 109.14 2kd2 n MET 118 Ca 0.04 0.83 -0.35 0.00 -1.81 0.00 0.00 57.70 56.41 2kd2 n MET 118 Cb 0.59 -5.41 -0.07 0.00 -0.71 0.00 0.00 33.22 27.63 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 -2.10 7.09 -0.18 7.83 2.15 -1.18 -4.84 116.67 125.44 2kd2 s ASP 119 Ca 0.00 1.67 -0.07 0.00 0.43 0.00 0.00 52.55 54.58 2kd2 s ASP 119 Cb 0.00 -2.52 -0.04 0.00 -0.30 0.00 0.00 42.92 40.06 2kd2 s ASP 119 CO 0.00 -0.18 0.04 -0.69 -0.17 0.00 0.00 175.17 174.17 2kd2 s VAL 120 N -1.86 4.60 -0.26 1.11 1.01 -1.26 -2.28 120.40 121.45 2kd2 s VAL 120 Ca 0.54 -0.10 0.03 0.00 0.00 0.00 0.00 61.98 62.45 2kd2 s VAL 120 Cb -0.14 -3.07 0.06 0.00 0.00 0.00 0.00 36.38 33.24 2kd2 s VAL 120 CO 0.19 0.46 -0.10 0.86 0.00 0.00 0.00 175.10 176.50 2kd2 s TRP 121 N 0.43 3.29 -0.30 5.22 -0.11 0.97 -1.02 118.94 127.42 2kd2 s TRP 121 Ca 0.02 -2.35 -0.14 0.00 1.22 0.00 0.00 56.10 54.84 2kd2 s TRP 121 Cb -0.13 -1.97 -0.03 0.00 -1.50 0.00 0.00 33.47 29.84 2kd2 s TRP 121 CO 0.01 -0.88 0.34 0.00 -4.62 0.00 0.00 176.95 171.80 2kd2 n ASN 123 N 5.32 0.00 -2.69 0.00 4.13 0.89 -2.44 115.26 120.47 2kd2 n ASN 123 Ca -0.10 0.00 -0.05 0.00 1.68 0.00 0.00 54.58 56.11 2kd2 n ASN 123 Cb 0.50 0.00 0.11 0.00 -1.54 0.00 0.00 39.78 38.85 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 0.00 1.61 3.59 7.41 0.00 -1.26 -4.88 105.19 111.66 2kd2 n GLY 124 Ca 0.00 -0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.38 0.73 0.99 1.61 0.74 -1.02 -5.16 119.66 117.16 2kd2 s GLN 125 Ca 0.19 1.08 -0.13 0.00 0.05 0.00 0.00 55.36 56.54 2kd2 s GLN 125 Cb 0.42 0.24 0.08 0.00 1.10 0.00 0.00 33.01 34.84 2kd2 s GLN 125 CO -0.09 -0.13 0.47 1.17 -0.55 0.00 0.00 175.29 176.16 2kd2 n LYS 126 N 3.62 -0.65 -4.42 1.67 4.81 -1.26 -2.62 118.16 119.32 2kd2 n LYS 126 Ca -0.18 -0.15 -0.21 0.00 -0.87 0.00 0.00 58.31 56.91 2kd2 n LYS 126 Cb 0.57 -1.91 -0.10 0.00 0.02 0.00 0.00 35.03 33.60 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 -3.78 1.55 -0.29 1.64 -1.94 -0.19 -4.78 119.30 111.51 2kd2 s MET 127 Ca 0.59 -1.82 0.03 0.00 -1.71 0.00 0.00 55.69 52.77 2kd2 s MET 127 Cb -0.20 -0.93 0.07 0.00 2.01 0.00 0.00 34.83 35.79 2kd2 s MET 127 CO 0.66 -0.08 -0.04 -2.00 -0.01 0.00 0.00 175.02 173.55 2kd2 s GLU 128 N -3.82 2.02 0.36 2.03 2.12 -1.26 -4.67 118.70 115.49 2kd2 s GLU 128 Ca 0.32 -1.52 0.02 0.00 0.36 0.00 0.00 54.97 54.15 2kd2 s GLU 128 Cb 0.06 -3.04 0.07 0.00 0.26 0.00 0.00 34.13 31.48 2kd2 s GLU 128 CO 0.13 -0.71 0.50 0.25 -0.54 0.00 0.00 175.26 174.89 2kd2 n THR 129 N 4.40 0.00 -0.04 -1.70 -2.24 -1.26 -3.88 114.28 109.56 2kd2 n THR 129 Ca -0.08 -0.94 0.00 0.00 -2.27 0.00 0.00 64.05 60.76 2kd2 n THR 129 Cb 0.42 -0.95 -0.12 0.00 -2.10 0.00 0.00 70.33 67.57 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 -2.82 2.10 -3.78 6.98 0.00 -0.21 -4.81 120.51 117.97 2kd2 n ALA 130 Ca -0.08 -0.71 -0.24 0.00 0.00 0.00 0.00 53.44 52.41 2kd2 n ALA 130 Cb 0.33 -0.31 0.03 0.00 0.00 0.00 0.00 19.45 19.49 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 1.82 -0.33 3.54 0.00 0.00 -1.25 -4.89 105.19 104.08 2kd2 n GLY 131 Ca -0.14 0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -6.19 3.26 0.05 1.61 2.12 -1.08 -4.92 118.70 113.55 2kd2 s GLU 132 Ca 0.16 -0.23 -0.30 0.00 0.36 0.00 0.00 54.97 54.96 2kd2 s GLU 132 Cb -0.08 -4.14 -0.05 0.00 0.26 0.00 0.00 34.13 30.13 2kd2 s GLU 132 CO 0.82 -1.93 1.07 -0.59 -0.54 0.00 0.00 175.26 174.10 2kd2 s PHE 133 N 5.12 3.58 0.45 5.30 -0.71 -1.26 -1.87 117.98 128.59 2kd2 s PHE 133 Ca 0.34 1.55 0.03 0.00 -1.04 0.00 0.00 56.93 57.81 2kd2 s PHE 133 Cb -0.10 -3.24 0.03 0.00 -1.21 0.00 0.00 43.02 38.50 2kd2 s PHE 133 CO 0.17 -0.52 0.25 1.33 -1.34 0.00 0.00 175.22 175.11 2kd2 n VAL 134 N 3.68 0.00 0.15 -2.49 0.24 -1.06 -4.99 118.33 113.86 2kd2 n VAL 134 Ca 0.06 -1.89 0.18 0.00 -2.04 0.00 0.00 64.34 60.66 2kd2 n VAL 134 Cb 0.49 0.03 0.78 0.00 -1.47 0.00 0.00 33.84 33.68 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 0.68 0.00 -1.01 -1.34 5.19 -2.05 -3.37 116.42 114.52 2kd2 h ASP 135 Ca -0.31 0.00 0.04 0.00 -0.62 0.00 0.00 57.03 56.14 2kd2 h ASP 135 Cb 1.07 0.00 -0.21 0.00 0.18 0.00 0.00 39.33 40.37 2kd2 h ASP 135 CO 0.49 0.00 -0.37 -1.81 -3.12 0.00 0.00 179.24 174.44 2kd2 s ASP 136 N -5.73 -1.57 0.00 6.45 1.11 -1.26 -5.14 116.67 110.52 2kd2 s ASP 136 Ca -0.05 0.29 0.00 0.00 0.18 0.00 0.00 52.55 52.97 2kd2 s ASP 136 Cb 0.16 2.05 0.00 0.00 1.07 0.00 0.00 42.92 46.19 2kd2 s ASP 136 CO 0.57 -0.29 0.00 0.61 1.18 0.00 0.00 175.17 177.24 2kd2 n GLY 137 N 5.42 -0.75 2.89 0.21 0.00 -1.26 -4.56 105.19 107.14 2kd2 n GLY 137 Ca 0.04 -2.26 -0.19 0.00 0.00 0.00 0.00 46.02 43.61 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 -0.93 0.49 -0.57 2.61 2.01 -1.18 -2.56 115.64 115.51 2kd2 s THR 138 Ca 0.00 -0.12 -0.09 0.00 0.31 0.00 0.00 61.69 61.79 2kd2 s THR 138 Cb 0.00 -0.51 0.15 0.00 0.01 0.00 0.00 72.50 72.14 2kd2 s THR 138 CO 0.00 0.21 0.45 -1.61 -0.69 0.00 0.00 174.62 172.97 2kd2 s GLU 139 N 0.80 2.72 -0.47 4.92 2.02 -0.78 -1.71 118.70 126.20 2kd2 s GLU 139 Ca -0.10 -2.04 -0.28 0.00 0.02 0.00 0.00 54.97 52.57 2kd2 s GLU 139 Cb -0.13 -3.99 0.03 0.00 0.10 0.00 0.00 34.13 30.13 2kd2 s GLU 139 CO 0.00 -1.21 1.06 0.95 0.02 0.00 0.00 175.26 176.08 2kd2 s THR 140 N 0.88 4.30 -0.40 3.63 -4.23 -0.97 -2.64 115.64 116.22 2kd2 s THR 140 Ca 0.10 1.05 -0.09 0.00 -1.18 0.00 0.00 61.69 61.57 2kd2 s THR 140 Cb -0.22 -4.54 0.06 0.00 1.34 0.00 0.00 72.50 69.14 2kd2 s THR 140 CO -0.03 -0.95 0.23 -1.00 -0.54 0.00 0.00 174.62 172.33 2kd2 s HIS 141 N 4.20 3.31 -0.10 3.99 3.76 -1.26 -0.47 115.29 128.72 2kd2 s HIS 141 Ca 0.44 -1.43 0.03 0.00 -0.15 0.00 0.00 55.06 53.95 2kd2 s HIS 141 Cb -0.08 -2.77 0.00 0.00 1.11 0.00 0.00 32.58 30.84 2kd2 s HIS 141 CO 0.30 -0.80 -0.21 -0.59 -0.85 0.00 0.00 174.74 172.59 2kd2 s PHE 142 N 1.44 2.36 0.43 1.40 -0.12 -1.15 -1.05 117.98 121.30 2kd2 s PHE 142 Ca 0.02 -1.01 -0.04 0.00 -0.05 0.00 0.00 56.93 55.85 2kd2 s PHE 142 Cb -0.22 -1.61 -0.04 0.00 -0.63 0.00 0.00 43.02 40.53 2kd2 s PHE 142 CO 0.03 -0.43 0.71 -1.54 -0.05 0.00 0.00 175.22 173.93 2kd2 s SER 143 N 0.52 6.30 -0.23 1.98 1.04 -1.25 -3.55 113.70 118.51 2kd2 s SER 143 Ca -0.15 0.81 -0.03 0.00 0.48 0.00 0.00 55.95 57.05 2kd2 s SER 143 Cb -0.17 -2.19 0.11 0.00 0.10 0.00 0.00 66.02 63.87 2kd2 s SER 143 CO 0.06 -0.47 0.29 -0.69 0.98 0.00 0.00 173.24 173.41 2kd2 s VAL 144 N -2.57 -0.45 0.00 5.02 1.01 -1.26 -4.81 120.40 117.35 2kd2 s VAL 144 Ca 0.45 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.31 2kd2 s VAL 144 Cb -0.10 -0.76 0.00 0.00 0.00 0.00 0.00 36.38 35.52 2kd2 s VAL 144 CO 0.41 -0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.93 2kd2 n GLY 145 N 5.34 3.28 1.39 4.51 0.00 -1.26 -0.30 105.19 118.14 2kd2 n GLY 145 Ca -0.04 0.26 0.01 0.00 0.00 0.00 0.00 46.02 46.24 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 6.48 4.02 -1.92 1.61 2.85 -1.26 -4.98 115.26 122.06 2kd2 n ASN 146 Ca 0.00 -3.25 0.00 0.00 -0.11 0.00 0.00 54.58 51.22 2kd2 n ASN 146 Cb 0.00 -0.64 0.00 0.00 1.24 0.00 0.00 39.78 40.38 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 -0.47 -1.07 -3.62 1.20 8.25 0.59 -5.15 115.22 114.94 2kd2 n HIS 147 Ca 0.31 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.68 2kd2 n HIS 147 Cb 1.12 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 32.13 2kd2 n HIS 147 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 2kd2 s ASP 148 N -0.95 -0.15 0.12 0.41 -4.77 -1.26 -4.09 116.67 105.97 2kd2 s ASP 148 Ca 0.00 0.88 -0.04 0.00 -3.30 0.00 0.00 52.55 50.09 2kd2 s ASP 148 Cb 0.00 1.27 -0.03 0.00 -1.09 0.00 0.00 42.92 43.07 2kd2 s ASP 148 CO 0.00 -0.24 0.11 0.00 0.70 0.00 0.00 175.17 175.74 2kd2 s TYR 150 N -3.98 -0.46 -0.40 0.00 1.13 -0.16 -2.91 117.35 110.57 2kd2 s TYR 150 Ca 0.17 0.96 -0.16 0.00 -1.41 0.00 0.00 57.07 56.62 2kd2 s TYR 150 Cb 0.06 0.40 0.01 0.00 -1.10 0.00 0.00 41.96 41.34 2kd2 s TYR 150 CO -0.02 -0.33 0.38 0.42 -2.51 0.00 0.00 175.55 173.50 2kd2 s ILE 151 N -0.51 5.15 -0.55 -3.49 1.01 0.38 -0.20 121.20 122.98 2kd2 s ILE 151 Ca -0.01 -0.30 -0.28 0.00 0.00 0.00 0.00 60.65 60.06 2kd2 s ILE 151 Cb -0.02 -3.95 0.03 0.00 0.01 0.00 0.00 42.46 38.52 2kd2 s ILE 151 CO -0.01 -0.30 1.15 -0.75 0.00 0.00 0.00 174.94 175.03 2kd2 s LYS 152 N 2.00 3.53 0.01 2.79 2.20 0.88 -2.29 119.74 128.86 2kd2 s LYS 152 Ca 0.10 0.25 -0.01 0.00 -0.36 0.00 0.00 55.97 55.95 2kd2 s LYS 152 Cb -0.17 -4.00 -0.04 0.00 -1.51 0.00 0.00 37.83 32.11 2kd2 s LYS 152 CO 0.12 -1.59 0.14 0.00 -0.36 0.00 0.00 175.35 173.67 2kd2 s ALA 153 N 4.71 3.81 -0.04 3.13 0.00 -0.69 -0.16 121.76 132.52 2kd2 s ALA 153 Ca 0.42 -0.82 -0.02 0.00 0.00 0.00 0.00 51.96 51.54 2kd2 s ALA 153 Cb -0.08 -1.75 0.03 0.00 0.00 0.00 0.00 23.12 21.32 2kd2 s ALA 153 CO 0.26 0.74 0.09 0.08 0.00 0.00 0.00 175.76 176.93 2kd2 s VAL 154 N -1.31 -0.04 -0.11 0.00 1.01 -0.17 -3.12 120.40 116.67 2kd2 s VAL 154 Ca 0.27 0.14 -0.06 0.00 0.00 0.00 0.00 61.98 62.33 2kd2 s VAL 154 Cb -0.12 -0.16 -0.04 0.00 0.00 0.00 0.00 36.38 36.06 2kd2 s VAL 154 CO 0.18 0.06 0.12 -0.94 0.00 0.00 0.00 175.10 174.52 2kd2 s SER 155 N 0.81 6.19 -0.02 3.32 1.04 -1.26 -1.18 113.70 122.61 2kd2 s SER 155 Ca -0.06 0.41 0.02 0.00 0.48 0.00 0.00 55.95 56.80 2kd2 s SER 155 Cb -0.09 -1.96 0.00 0.00 0.10 0.00 0.00 66.02 64.07 2kd2 s SER 155 CO -0.03 0.40 -0.08 -0.44 0.98 0.00 0.00 173.24 174.07 2kd2 s SER 156 N -1.06 1.04 0.00 7.02 0.01 0.76 -4.81 113.70 116.66 2kd2 s SER 156 Ca 0.15 -0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.26 2kd2 s SER 156 Cb -0.12 -0.25 0.00 0.00 0.21 0.00 0.00 66.02 65.87 2kd2 s SER 156 CO 0.05 0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.37 2kd2 n GLY 157 N 3.23 0.84 0.23 3.44 0.00 -1.26 -1.31 105.19 110.35 2kd2 n GLY 157 Ca -0.17 -1.99 0.07 0.00 0.00 0.00 0.00 46.02 43.93 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 7.53 0.00 0.00 1.61 1.57 -1.99 -3.43 116.57 121.85 2kd2 h LYS 158 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2kd2 h LYS 158 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2kd2 h LYS 158 CO 0.00 0.18 0.00 0.54 -0.57 0.00 0.00 179.45 179.60 2kd2 n ARG 159 N -4.12 0.00 -2.71 3.15 5.12 -1.26 -5.03 116.66 111.81 2kd2 n ARG 159 Ca -0.02 0.00 -0.07 0.00 -1.93 0.00 0.00 57.85 55.82 2kd2 n ARG 159 Cb 0.25 0.00 0.10 0.00 -1.16 0.00 0.00 32.46 31.65 2kd2 n ARG 159 CO 0.00 0.00 0.00 0.36 -1.93 0.00 0.00 177.63 176.06 2kd2 n LYS 160 N -2.13 0.94 0.04 5.56 2.85 -1.26 -4.88 118.16 119.27 2kd2 n LYS 160 Ca 0.00 -1.69 -0.08 0.00 -1.05 0.00 0.00 58.31 55.48 2kd2 n LYS 160 Cb 0.00 -0.56 -0.06 0.00 -0.65 0.00 0.00 35.03 33.76 2kd2 n LYS 160 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 177.40 178.84 2kd2 h GLU 161 N 2.48 -0.19 -3.94 -1.58 4.22 -1.86 -3.47 114.58 110.24 2kd2 h GLU 161 Ca -0.21 0.01 -0.25 0.00 0.08 0.00 0.00 59.36 59.00 2kd2 h GLU 161 Cb 1.18 0.04 -0.27 0.00 0.50 0.00 0.00 28.75 30.21 2kd2 h GLU 161 CO 0.03 0.17 -0.73 0.20 -2.18 0.00 0.00 179.01 176.50 2kd2 s GLY 162 N -3.39 0.11 -0.03 1.92 0.00 -0.42 -5.02 107.32 100.48 2kd2 s GLY 162 Ca -0.10 -0.15 0.05 0.00 0.00 0.00 0.00 44.72 44.52 2kd2 s GLY 162 CO 0.35 -0.16 -0.18 -0.42 0.00 0.00 0.00 173.10 172.70 2kd2 s ILE 163 N -0.25 1.49 -0.07 0.90 1.01 -1.26 -0.17 121.20 122.85 2kd2 s ILE 163 Ca -0.02 -0.78 0.04 0.00 0.00 0.00 0.00 60.65 59.89 2kd2 s ILE 163 Cb -0.02 -1.27 0.00 0.00 0.01 0.00 0.00 42.46 41.19 2kd2 s ILE 163 CO -0.00 0.43 -0.19 -0.63 0.00 0.00 0.00 174.94 174.54 2kd2 s ILE 164 N -0.17 1.64 -0.01 2.92 1.01 -0.32 -4.97 121.20 121.30 2kd2 s ILE 164 Ca 0.01 -0.79 -0.00 0.00 0.00 0.00 0.00 60.65 59.86 2kd2 s ILE 164 Cb -0.10 -1.43 -0.04 0.00 0.01 0.00 0.00 42.46 40.90 2kd2 s ILE 164 CO 0.01 0.47 0.06 -1.00 0.00 0.00 0.00 174.94 174.48 2kd2 s HIS 165 N 0.34 3.24 -0.24 3.97 3.76 -1.26 -0.99 115.29 124.11 2kd2 s HIS 165 Ca -0.13 0.19 -0.03 0.00 -0.15 0.00 0.00 55.06 54.93 2kd2 s HIS 165 Cb -0.16 -1.73 0.08 0.00 1.11 0.00 0.00 32.58 31.88 2kd2 s HIS 165 CO 0.06 0.53 0.09 0.95 -0.85 0.00 0.00 174.74 175.52 2kd2 s THR 166 N -1.16 0.27 0.26 1.30 -4.23 0.77 -4.92 115.64 107.93 2kd2 s THR 166 Ca 0.22 -0.69 -0.30 0.00 -1.18 0.00 0.00 61.69 59.74 2kd2 s THR 166 Cb -0.12 -1.03 -0.10 0.00 1.34 0.00 0.00 72.50 72.59 2kd2 s THR 166 CO 0.12 -0.47 1.48 -0.22 -0.54 0.00 0.00 174.62 174.99 2kd2 s LEU 167 N 1.95 4.37 -0.25 4.79 2.96 -1.26 -0.09 118.68 131.16 2kd2 s LEU 167 Ca 0.05 2.75 -0.03 0.00 -0.22 0.00 0.00 54.13 56.67 2kd2 s LEU 167 Cb -0.17 -3.63 0.08 0.00 0.50 0.00 0.00 46.19 42.98 2kd2 s LEU 167 CO -0.20 -0.76 0.08 -0.63 -1.32 0.00 0.00 176.35 173.53 2kd2 s ILE 168 N -0.04 0.36 -0.09 6.68 1.01 0.72 -0.16 121.20 129.67 2kd2 s ILE 168 Ca 0.60 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 60.49 2kd2 s ILE 168 Cb -0.43 -1.11 -0.02 0.00 0.01 0.00 0.00 42.46 40.91 2kd2 s ILE 168 CO 0.45 -0.48 -0.11 -0.69 0.00 0.00 0.00 174.94 174.11 2kd2 s VAL 169 N 1.91 3.31 -1.41 2.92 1.01 -0.95 -0.99 120.40 126.19 2kd2 s VAL 169 Ca 0.05 -0.60 -0.01 0.00 0.00 0.00 0.00 61.98 61.41 2kd2 s VAL 169 Cb -0.17 -2.36 0.00 0.00 0.00 0.00 0.00 36.38 33.86 2kd2 s VAL 169 CO -0.20 0.56 0.16 -0.67 0.00 0.00 0.00 175.10 174.95 2kd2 n ASP 170 N 2.84 -5.15 -3.07 3.32 -0.08 -0.65 -2.36 116.55 111.41 2kd2 n ASP 170 Ca -0.18 -0.09 -0.18 0.00 -1.51 0.00 0.00 54.79 52.83 2kd2 n ASP 170 Cb 0.53 -4.16 0.07 0.00 2.34 0.00 0.00 41.12 39.89 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 -1.45 -4.61 -3.75 1.67 5.15 -1.26 -5.02 115.26 106.00 2kd2 n ASN 171 Ca -0.17 -0.47 -0.13 0.00 -0.60 0.00 0.00 54.58 53.21 2kd2 n ASN 171 Cb 0.64 -4.31 -0.14 0.00 -0.53 0.00 0.00 39.78 35.44 2kd2 n ASN 171 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2kd2 s ARG 172 N -5.82 0.11 0.53 1.20 0.52 -1.00 -5.14 118.95 109.35 2kd2 s ARG 172 Ca 0.35 0.39 -0.22 0.00 -0.52 0.00 0.00 55.73 55.73 2kd2 s ARG 172 Cb -0.15 -0.17 -0.05 0.00 0.52 0.00 0.00 34.95 35.10 2kd2 s ARG 172 CO 0.61 -0.16 1.32 -1.21 0.02 0.00 0.00 175.30 175.87 2kd2 s GLU 173 N 1.17 3.27 -0.07 3.54 2.02 -1.26 -2.24 118.70 125.12 2kd2 s GLU 173 Ca -0.09 2.13 0.03 0.00 0.02 0.00 0.00 54.97 57.07 2kd2 s GLU 173 Cb -0.11 -2.28 0.00 0.00 0.10 0.00 0.00 34.13 31.84 2kd2 s GLU 173 CO -0.06 -1.06 -0.18 0.42 0.02 0.00 0.00 175.26 174.41 2kd2 s ILE 174 N -1.36 1.53 0.17 -1.63 -1.09 0.77 -4.90 121.20 114.69 2kd2 s ILE 174 Ca 0.70 -0.72 -0.30 0.00 -2.23 0.00 0.00 60.65 58.09 2kd2 s ILE 174 Cb -0.38 -1.34 -0.08 0.00 -1.58 0.00 0.00 42.46 39.08 2kd2 s ILE 174 CO 0.45 0.44 1.32 -2.16 -1.23 0.00 0.00 174.94 173.76 2kd2 s PRO 175 N 0.39 4.38 -0.04 2.79 0.04 -1.26 -4.17 135.00 137.13 2kd2 s PRO 175 Ca -0.13 2.04 -0.20 0.00 0.04 0.00 0.00 61.00 62.75 2kd2 s PRO 175 Cb -0.16 -3.22 -0.05 0.00 0.04 0.00 0.00 34.50 31.12 2kd2 s PRO 175 CO 0.05 -0.29 0.55 -2.00 0.04 0.00 0.00 177.00 175.36 2kd2 s GLU 176 N 0.21 4.30 -0.53 4.56 2.12 -1.26 -4.35 118.70 123.75 2kd2 s GLU 176 Ca 0.58 0.64 -0.25 0.00 0.36 0.00 0.00 54.97 56.31 2kd2 s GLU 176 Cb -0.36 -3.37 0.04 0.00 0.26 0.00 0.00 34.13 30.70 2kd2 s GLU 176 CO 0.36 0.32 0.96 -1.17 -0.54 0.00 0.00 175.26 175.18 2kd2 s LEU 177 N 0.03 4.03 0.03 2.70 1.98 -0.91 -4.98 118.68 121.55 2kd2 s LEU 177 Ca 0.30 -0.20 -0.28 0.00 -2.89 0.00 0.00 54.13 51.06 2kd2 s LEU 177 Cb -0.17 -2.94 0.08 0.00 0.66 0.00 0.00 46.19 43.81 2kd2 s LEU 177 CO 0.15 -1.21 0.69 0.28 -1.89 0.00 0.00 176.35 174.38 2kd2 s THR 178 N 3.98 0.00 -2.81 3.68 -1.32 -1.26 -4.46 115.64 113.45 2kd2 s THR 178 Ca 0.33 0.00 0.25 0.00 -1.21 0.00 0.00 61.69 61.06 2kd2 s THR 178 Cb -0.12 -1.00 0.32 0.00 -1.51 0.00 0.00 72.50 70.20 2kd2 s THR 178 CO 0.21 0.00 1.44 0.00 -2.21 0.00 0.00 174.62 174.07