#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kdo s HIS 2 N 0.00 3.20 -0.28 1.61 0.09 -1.26 -5.08 115.29 113.57 2kdo s HIS 2 Ca 0.00 -0.02 -0.20 0.00 -0.00 0.00 0.00 55.06 54.84 2kdo s HIS 2 Cb 0.00 -2.05 0.10 0.00 -0.00 0.00 0.00 32.58 30.63 2kdo s HIS 2 CO 0.00 0.11 0.84 1.41 -0.00 0.00 0.00 174.74 177.10 2kdo s MET 3 N 0.38 0.62 -0.52 1.40 -2.45 -1.26 -5.12 119.30 112.34 2kdo s MET 3 Ca 0.01 0.90 -0.29 0.00 -1.25 0.00 0.00 55.69 55.06 2kdo s MET 3 Cb -0.13 0.21 0.03 0.00 1.25 0.00 0.00 34.83 36.19 2kdo s MET 3 CO 0.01 -0.10 1.19 -1.12 1.05 0.00 0.00 175.02 176.05 2kdo s SER 4 N 0.94 6.51 0.55 1.11 0.01 -1.26 -5.00 113.70 116.56 2kdo s SER 4 Ca -0.04 0.32 0.05 0.00 1.31 0.00 0.00 55.95 57.59 2kdo s SER 4 Cb -0.05 -2.55 0.05 0.00 0.21 0.00 0.00 66.02 63.68 2kdo s SER 4 CO -0.11 -1.39 0.43 2.30 0.41 0.00 0.00 173.24 174.89 2kdo n ILE 5 N 6.80 0.00 -3.67 1.44 -0.00 -1.26 -4.83 119.36 117.84 2kdo n ILE 5 Ca 0.11 -2.16 -0.15 0.00 -0.00 0.00 0.00 62.75 60.55 2kdo n ILE 5 Cb 0.49 -0.06 -0.15 0.00 -0.00 0.00 0.00 39.64 39.93 2kdo n ILE 5 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.55 176.67 2kdo s PHE 6 N -2.71 -0.28 -0.22 4.28 5.36 -1.26 -4.77 117.98 118.37 2kdo s PHE 6 Ca 0.33 0.77 -0.29 0.00 -0.96 0.00 0.00 56.93 56.78 2kdo s PHE 6 Cb -0.03 -0.16 -0.03 0.00 -0.34 0.00 0.00 43.02 42.46 2kdo s PHE 6 CO 0.21 -0.31 1.71 0.99 -1.46 0.00 0.00 175.22 176.37 2kdo s THR 7 N 2.33 3.56 0.21 0.12 2.01 -1.26 -5.01 115.64 117.61 2kdo s THR 7 Ca 0.02 0.63 -0.13 0.00 0.31 0.00 0.00 61.69 62.51 2kdo s THR 7 Cb -0.12 -3.60 -0.08 0.00 0.01 0.00 0.00 72.50 68.71 2kdo s THR 7 CO -0.07 -0.28 0.60 -2.16 -0.69 0.00 0.00 174.62 172.02 2kdo s PRO 8 N 4.95 3.95 -0.13 4.92 0.04 -1.26 -5.07 135.00 142.40 2kdo s PRO 8 Ca 0.76 0.48 -0.06 0.00 0.04 0.00 0.00 61.00 62.23 2kdo s PRO 8 Cb -0.26 -2.74 -0.04 0.00 0.04 0.00 0.00 34.50 31.50 2kdo s PRO 8 CO 0.31 0.36 0.07 0.99 0.04 0.00 0.00 177.00 178.77 2kdo s THR 9 N -1.68 4.91 -1.40 1.26 2.01 -1.26 -4.38 115.64 115.10 2kdo s THR 9 Ca 0.44 -0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.44 2kdo s THR 9 Cb -0.13 -3.15 0.00 0.00 0.01 0.00 0.00 72.50 69.23 2kdo s THR 9 CO 0.20 0.55 0.00 -3.20 -0.69 0.00 0.00 174.62 171.48 2kdo n ASN 10 N 2.62 -4.94 -0.47 3.53 5.15 -1.26 -4.83 115.26 115.06 2kdo n ASN 10 Ca -0.18 0.33 0.13 0.00 -0.60 0.00 0.00 54.58 54.25 2kdo n ASN 10 Cb 0.53 -3.60 0.28 0.00 -0.53 0.00 0.00 39.78 36.47 2kdo n ASN 10 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2kdo n GLN 11 N -2.14 1.35 -3.28 1.20 3.00 -1.26 -4.99 117.38 111.26 2kdo n GLN 11 Ca -0.13 -0.94 -0.09 0.00 -0.01 0.00 0.00 57.00 55.83 2kdo n GLN 11 Cb 0.49 -1.48 0.01 0.00 0.00 0.00 0.00 30.24 29.26 2kdo n GLN 11 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 2kdo n ILE 12 N -0.01 -8.32 -4.24 5.09 5.41 -1.26 -5.04 119.36 110.99 2kdo n ILE 12 Ca 0.13 -0.37 -0.13 0.00 1.00 0.00 0.00 62.75 63.38 2kdo n ILE 12 Cb 0.42 -5.86 -0.10 0.00 -0.71 0.00 0.00 39.64 33.39 2kdo n ILE 12 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 2kdo s ARG 13 N -3.79 1.17 -0.45 0.38 0.52 -1.26 -5.03 118.95 110.48 2kdo s ARG 13 Ca 0.09 -1.59 -0.06 0.00 -0.52 0.00 0.00 55.73 53.65 2kdo s ARG 13 Cb -0.02 -0.10 -0.16 0.00 0.52 0.00 0.00 34.95 35.19 2kdo s ARG 13 CO 0.79 -0.23 2.82 1.28 0.02 0.00 0.00 175.30 179.98 2kdo n LEU 14 N -0.28 5.12 0.00 2.53 4.77 -1.26 -3.63 117.00 124.25 2kdo n LEU 14 Ca -0.03 -2.98 0.00 0.00 -0.03 0.00 0.00 56.01 52.96 2kdo n LEU 14 Cb 0.64 -1.20 0.00 0.00 -2.33 0.00 0.00 43.42 40.54 2kdo n LEU 14 CO 0.34 1.29 -0.41 0.35 -1.33 0.00 0.00 177.39 177.62 2kdo n THR 15 N 3.05 0.00 -1.16 -5.08 -2.24 -1.26 -4.79 114.28 102.80 2kdo n THR 15 Ca 0.44 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 62.26 2kdo n THR 15 Cb 0.53 -0.86 0.23 0.00 -2.10 0.00 0.00 70.33 68.14 2kdo n THR 15 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2kdo n ASN 16 N -2.61 3.30 -4.75 3.42 6.94 -1.24 -4.74 115.26 115.58 2kdo n ASN 16 Ca 0.00 -3.30 -0.41 0.00 -0.02 0.00 0.00 54.58 50.86 2kdo n ASN 16 Cb 0.41 -0.58 -0.04 0.00 -2.36 0.00 0.00 39.78 37.22 2kdo n ASN 16 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 2kdo s VAL 17 N -2.99 3.64 0.03 3.53 -7.23 -1.26 -3.99 120.40 112.14 2kdo s VAL 17 Ca 0.43 1.50 -0.16 0.00 -1.81 0.00 0.00 61.98 61.93 2kdo s VAL 17 Cb 0.36 -3.96 -0.06 0.00 0.56 0.00 0.00 36.38 33.29 2kdo s VAL 17 CO 0.05 0.30 0.47 0.00 -0.31 0.00 0.00 175.10 175.61 2kdo s ALA 18 N -0.59 3.66 -0.13 1.32 0.00 0.13 -4.86 121.76 121.28 2kdo s ALA 18 Ca 0.48 -0.13 -0.16 0.00 0.00 0.00 0.00 51.96 52.15 2kdo s ALA 18 Cb -0.31 -2.48 -0.04 0.00 0.00 0.00 0.00 23.12 20.29 2kdo s ALA 18 CO 0.38 0.45 0.38 0.08 0.00 0.00 0.00 175.76 177.05 2kdo s VAL 19 N -1.11 5.24 -0.16 0.00 1.01 -1.26 -2.09 120.40 122.03 2kdo s VAL 19 Ca 0.26 0.75 -0.07 0.00 0.00 0.00 0.00 61.98 62.91 2kdo s VAL 19 Cb -0.18 -3.72 0.06 0.00 0.00 0.00 0.00 36.38 32.55 2kdo s VAL 19 CO 0.16 0.38 0.36 0.54 0.00 0.00 0.00 175.10 176.54 2kdo s VAL 20 N 0.41 -0.22 0.00 2.92 0.11 -1.08 -2.51 120.40 120.04 2kdo s VAL 20 Ca 0.21 0.15 0.03 0.00 -2.93 0.00 0.00 61.98 59.44 2kdo s VAL 20 Cb -0.14 -0.56 -0.01 0.00 -1.53 0.00 0.00 36.38 34.14 2kdo s VAL 20 CO 0.07 0.06 -0.10 0.00 -3.33 0.00 0.00 175.10 171.81 2kdo s ARG 21 N 1.79 0.74 -0.32 1.54 3.03 -1.07 -0.63 118.95 124.03 2kdo s ARG 21 Ca -0.06 -0.42 -0.03 0.00 2.03 0.00 0.00 55.73 57.25 2kdo s ARG 21 Cb -0.10 -0.71 0.06 0.00 -1.03 0.00 0.00 34.95 33.17 2kdo s ARG 21 CO -0.11 0.19 0.04 1.41 -1.13 0.00 0.00 175.30 175.70 2kdo s MET 22 N -0.46 2.41 -0.69 3.89 1.75 0.11 0.25 119.30 126.56 2kdo s MET 22 Ca 0.02 -1.32 -0.23 0.00 -1.25 0.00 0.00 55.69 52.91 2kdo s MET 22 Cb -0.05 -3.28 0.07 0.00 2.84 0.00 0.00 34.83 34.41 2kdo s MET 22 CO -0.00 -0.68 1.02 0.15 -0.65 0.00 0.00 175.02 174.86 2kdo s LYS 23 N 1.26 3.15 0.44 4.11 1.02 -1.26 -1.66 119.74 126.80 2kdo s LYS 23 Ca -0.03 -0.80 0.03 0.00 0.02 0.00 0.00 55.97 55.19 2kdo s LYS 23 Cb -0.20 -4.28 0.01 0.00 -0.52 0.00 0.00 37.83 32.84 2kdo s LYS 23 CO -0.01 -1.87 0.63 1.03 -0.92 0.00 0.00 175.35 174.21 2kdo s ARG 24 N 4.24 2.90 0.25 1.68 0.52 -1.20 -4.98 118.95 122.37 2kdo s ARG 24 Ca 0.25 -0.83 0.02 0.00 -0.52 0.00 0.00 55.73 54.65 2kdo s ARG 24 Cb -0.15 -2.64 0.31 0.00 0.52 0.00 0.00 34.95 32.99 2kdo s ARG 24 CO 0.09 -0.30 1.63 0.00 0.02 0.00 0.00 175.30 176.75 2kdo h ALA 25 N 0.48 0.95 0.01 2.13 0.00 -2.03 -3.29 119.26 117.50 2kdo h ALA 25 Ca -0.44 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.03 2kdo h ALA 25 Cb 1.27 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2kdo h ALA 25 CO 0.53 0.63 -0.00 0.78 0.00 0.00 0.00 179.25 181.19 2kdo h GLY 26 N 1.17 -0.01 -4.35 0.00 0.00 -2.01 -3.48 103.07 94.39 2kdo h GLY 26 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.33 2kdo h GLY 26 CO 0.07 -0.00 0.25 1.25 0.00 0.00 0.00 176.54 178.11 2kdo s LYS 27 N -2.60 0.91 0.09 4.80 2.20 -1.24 -5.16 119.74 118.74 2kdo s LYS 27 Ca -0.17 0.41 -0.13 0.00 -0.36 0.00 0.00 55.97 55.72 2kdo s LYS 27 Cb -0.02 0.43 -0.06 0.00 -1.51 0.00 0.00 37.83 36.67 2kdo s LYS 27 CO 0.64 -0.25 0.46 -0.98 -0.36 0.00 0.00 175.35 174.86 2kdo s ARG 28 N -0.78 3.89 -0.04 4.03 3.03 -1.26 -3.23 118.95 124.59 2kdo s ARG 28 Ca -0.07 0.36 0.02 0.00 2.03 0.00 0.00 55.73 58.07 2kdo s ARG 28 Cb -0.01 -3.03 0.01 0.00 -1.03 0.00 0.00 34.95 30.89 2kdo s ARG 28 CO 0.06 0.56 -0.08 -0.06 -1.13 0.00 0.00 175.30 174.65 2kdo s PHE 29 N -1.35 0.97 -0.05 5.89 0.08 -0.66 -4.59 117.98 118.27 2kdo s PHE 29 Ca 0.33 -0.29 0.05 0.00 0.12 0.00 0.00 56.93 57.14 2kdo s PHE 29 Cb -0.15 -0.75 -0.00 0.00 -0.57 0.00 0.00 43.02 41.55 2kdo s PHE 29 CO 0.18 -0.17 -0.19 -2.00 -0.10 0.00 0.00 175.22 172.94 2kdo s GLU 30 N 0.55 2.02 0.05 0.44 2.12 -1.22 0.06 118.70 122.72 2kdo s GLU 30 Ca -0.09 -0.68 0.06 0.00 0.36 0.00 0.00 54.97 54.62 2kdo s GLU 30 Cb -0.12 -1.72 -0.02 0.00 0.26 0.00 0.00 34.13 32.52 2kdo s GLU 30 CO 0.01 0.27 -0.17 0.42 -0.54 0.00 0.00 175.26 175.24 2kdo s ILE 31 N 0.03 1.40 -0.33 -3.70 -1.09 0.20 -1.47 121.20 116.23 2kdo s ILE 31 Ca -0.05 -1.14 -0.09 0.00 -2.23 0.00 0.00 60.65 57.15 2kdo s ILE 31 Cb -0.12 -1.24 0.02 0.00 -1.58 0.00 0.00 42.46 39.53 2kdo s ILE 31 CO 0.03 0.08 0.14 0.00 -1.23 0.00 0.00 174.94 173.96 2kdo s ALA 32 N -0.87 3.18 0.38 9.38 0.00 -1.26 -2.62 121.76 129.96 2kdo s ALA 32 Ca 0.04 -1.57 0.08 0.00 0.00 0.00 0.00 51.96 50.51 2kdo s ALA 32 Cb -0.08 -2.36 -0.06 0.00 0.00 0.00 0.00 23.12 20.61 2kdo s ALA 32 CO 0.02 -1.13 0.08 0.00 0.00 0.00 0.00 175.76 174.73 2kdo s TYR 34 N -2.59 2.55 -1.23 0.00 5.04 0.12 0.18 117.35 121.41 2kdo s TYR 34 Ca 0.37 0.77 -0.19 0.00 -2.44 0.00 0.00 57.07 55.58 2kdo s TYR 34 Cb 0.04 -3.76 0.06 0.00 0.35 0.00 0.00 41.96 38.65 2kdo s TYR 34 CO 0.20 -2.22 1.68 0.21 -1.34 0.00 0.00 175.55 174.08 2kdo s LYS 35 N 3.98 3.87 -0.49 4.97 2.20 -1.26 -4.27 119.74 128.74 2kdo s LYS 35 Ca 0.61 -1.78 0.06 0.00 -0.36 0.00 0.00 55.97 54.51 2kdo s LYS 35 Cb -0.22 -5.49 0.21 0.00 -1.51 0.00 0.00 37.83 30.82 2kdo s LYS 35 CO 0.22 -2.27 0.76 -1.71 -0.36 0.00 0.00 175.35 171.98 2kdo n ASN 36 N 8.61 -2.87 -1.91 1.43 5.15 -1.26 -4.91 115.26 119.51 2kdo n ASN 36 Ca 0.45 -3.03 -0.13 0.00 -0.60 0.00 0.00 54.58 51.27 2kdo n ASN 36 Cb 0.47 1.52 0.03 0.00 -0.53 0.00 0.00 39.78 41.27 2kdo n ASN 36 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 2kdo n LYS 37 N 2.34 -3.17 -0.35 1.20 3.00 -1.26 -4.92 118.16 114.99 2kdo n LYS 37 Ca 0.15 0.51 0.00 0.00 -0.00 0.00 0.00 58.31 58.98 2kdo n LYS 37 Cb 0.58 -4.54 0.14 0.00 0.00 0.00 0.00 35.03 31.21 2kdo n LYS 37 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.40 177.16 2kdo h VAL 38 N -0.95 1.13 -0.04 3.15 3.04 -1.91 0.14 116.25 120.81 2kdo h VAL 38 Ca -0.31 -0.40 0.00 0.00 -1.01 0.00 0.00 66.70 64.98 2kdo h VAL 38 Cb 1.21 -0.15 0.00 0.00 -2.01 0.00 0.00 31.29 30.34 2kdo h VAL 38 CO 0.32 0.21 0.00 1.33 -1.01 0.00 0.00 177.57 178.43 2kdo n VAL 39 N -4.50 0.05 0.20 1.51 0.24 -1.26 -3.57 118.33 111.00 2kdo n VAL 39 Ca 0.13 -0.14 0.06 0.00 -2.04 0.00 0.00 64.34 62.35 2kdo n VAL 39 Cb 0.12 -0.01 0.42 0.00 -1.47 0.00 0.00 33.84 32.91 2kdo n VAL 39 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2kdo h GLY 40 N 5.09 0.00 2.00 7.63 0.00 -1.08 -1.69 103.07 115.03 2kdo h GLY 40 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2kdo h GLY 40 CO 0.00 0.00 -0.06 -0.25 0.00 0.00 0.00 176.54 176.23 2kdo h TRP 41 N 0.00 0.00 -0.07 5.60 2.91 -1.67 0.12 115.95 122.84 2kdo h TRP 41 Ca -0.00 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.02 2kdo h TRP 41 Cb 0.71 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.36 2kdo h TRP 41 CO 0.00 0.06 0.00 -2.13 -1.03 0.00 0.00 178.44 175.34 2kdo n ARG 42 N -3.16 1.89 -0.02 2.65 3.00 -0.72 -4.21 116.66 116.10 2kdo n ARG 42 Ca 0.01 -1.77 0.00 0.00 -0.00 0.00 0.00 57.85 56.10 2kdo n ARG 42 Cb 0.37 -1.40 0.01 0.00 0.00 0.00 0.00 32.46 31.44 2kdo n ARG 42 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2kdo n SER 43 N 1.16 1.05 0.00 6.15 7.64 -0.73 -5.10 113.62 123.80 2kdo n SER 43 Ca 0.13 -1.60 0.00 0.00 1.01 0.00 0.00 58.87 58.41 2kdo n SER 43 Cb 0.51 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 2kdo n SER 43 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kdo n GLY 44 N -0.30 -0.56 2.76 0.23 0.00 0.38 -4.99 105.19 102.70 2kdo n GLY 44 Ca 0.01 -0.31 -0.22 0.00 0.00 0.00 0.00 46.02 45.50 2kdo n GLY 44 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2kdo s VAL 45 N -3.29 0.26 0.00 1.61 1.01 -1.22 -4.42 120.40 114.36 2kdo s VAL 45 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.15 2kdo s VAL 45 Cb 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 36.38 35.95 2kdo s VAL 45 CO 0.00 0.23 0.00 -0.62 0.00 0.00 0.00 175.10 174.71 2kdo n GLU 46 N 5.03 0.00 -4.30 2.72 -0.58 -1.26 -4.96 120.64 117.29 2kdo n GLU 46 Ca -0.09 0.00 -0.17 0.00 -0.42 0.00 0.00 57.16 56.48 2kdo n GLU 46 Cb 0.50 0.00 -0.10 0.00 -0.57 0.00 0.00 31.44 31.27 2kdo n GLU 46 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 2kdo s LYS 47 N 0.00 1.47 0.36 3.49 -2.85 -1.26 -5.10 119.74 115.84 2kdo s LYS 47 Ca 0.00 -1.81 -0.26 0.00 -1.00 0.00 0.00 55.97 52.90 2kdo s LYS 47 Cb 0.00 -0.04 -0.09 0.00 -2.06 0.00 0.00 37.83 35.64 2kdo s LYS 47 CO 0.00 -0.41 1.07 0.34 0.10 0.00 0.00 175.35 176.45 2kdo s ASP 48 N -3.31 6.93 0.54 0.03 -1.08 -1.26 -4.88 116.67 113.63 2kdo s ASP 48 Ca 0.37 2.13 0.28 0.00 -0.52 0.00 0.00 52.55 54.81 2kdo s ASP 48 Cb 0.06 -2.60 1.52 0.00 -1.46 0.00 0.00 42.92 40.44 2kdo s ASP 48 CO 0.16 -0.38 2.11 0.25 0.52 0.00 0.00 175.17 177.83 2kdo h LEU 49 N 2.98 0.00 -1.29 -1.34 5.85 -1.99 -2.32 115.31 117.19 2kdo h LEU 49 Ca -0.48 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.30 2kdo h LEU 49 Cb 1.21 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.20 2kdo h LEU 49 CO 0.64 0.10 0.51 -0.78 -0.34 0.00 0.00 178.44 178.57 2kdo h ASP 50 N 0.00 0.77 1.59 1.25 3.58 -1.94 0.50 116.42 122.16 2kdo h ASP 50 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2kdo h ASP 50 Cb 0.27 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.15 2kdo h ASP 50 CO 0.01 0.50 -0.37 -0.08 -2.88 0.00 0.00 179.24 176.43 2kdo h GLU 51 N 0.88 0.00 0.00 0.28 4.81 -1.81 -3.26 114.58 115.48 2kdo h GLU 51 Ca 0.33 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.43 2kdo h GLU 51 Cb 0.19 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 2kdo h GLU 51 CO -0.11 0.00 -0.80 0.28 -0.73 0.00 0.00 179.01 177.65 2kdo h VAL 52 N 0.00 0.80 -2.14 0.32 2.07 -1.02 -3.43 116.25 112.84 2kdo h VAL 52 Ca 0.00 -2.21 -0.52 0.00 0.82 0.00 0.00 66.70 64.79 2kdo h VAL 52 Cb 0.98 2.32 -0.06 0.00 -1.52 0.00 0.00 31.29 33.02 2kdo h VAL 52 CO 0.00 0.45 1.21 -0.76 0.02 0.00 0.00 177.57 178.49 2kdo s LEU 53 N -6.26 3.23 0.34 2.57 2.01 0.01 0.13 118.68 120.70 2kdo s LEU 53 Ca 0.02 -0.06 0.18 0.00 0.01 0.00 0.00 54.13 54.27 2kdo s LEU 53 Cb 0.08 -2.54 0.34 0.00 0.01 0.00 0.00 46.19 44.07 2kdo s LEU 53 CO 0.77 -2.12 1.57 1.56 1.01 0.00 0.00 176.35 179.14 2kdo h GLN 54 N 12.53 0.00 -5.31 1.70 4.20 -1.83 -3.45 115.11 122.94 2kdo h GLN 54 Ca -0.26 0.00 -0.40 0.00 0.06 0.00 0.00 58.65 58.05 2kdo h GLN 54 Cb 1.11 0.00 -0.20 0.00 0.30 0.00 0.00 27.48 28.69 2kdo h GLN 54 CO 1.25 0.39 -0.77 -0.08 -0.67 0.00 0.00 178.83 178.95 2kdo s THR 55 N -3.20 1.15 -0.83 -0.54 -1.32 -1.18 -4.81 115.64 104.92 2kdo s THR 55 Ca 0.03 -1.47 0.09 0.00 -1.21 0.00 0.00 61.69 59.13 2kdo s THR 55 Cb 0.08 -1.24 0.21 0.00 -1.51 0.00 0.00 72.50 70.04 2kdo s THR 55 CO 0.71 -0.32 1.12 0.00 -2.21 0.00 0.00 174.62 173.91 2kdo n HIS 56 N 0.97 0.29 -4.36 9.09 1.44 -1.26 -4.86 115.22 116.53 2kdo n HIS 56 Ca -0.19 -0.39 -0.32 0.00 -2.01 0.00 0.00 57.72 54.81 2kdo n HIS 56 Cb 0.55 -0.02 -0.10 0.00 0.12 0.00 0.00 29.99 30.54 2kdo n HIS 56 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 2kdo s SER 57 N -0.95 4.75 -0.06 4.39 0.01 -1.26 -4.80 113.70 115.78 2kdo s SER 57 Ca 0.17 -0.15 0.02 0.00 1.31 0.00 0.00 55.95 57.30 2kdo s SER 57 Cb 0.09 -1.12 -0.03 0.00 0.21 0.00 0.00 66.02 65.17 2kdo s SER 57 CO 0.12 0.26 -0.10 0.54 0.41 0.00 0.00 173.24 174.47 2kdo s VAL 58 N -1.07 3.43 0.48 3.43 0.11 -0.77 -4.73 120.40 121.27 2kdo s VAL 58 Ca 0.19 -0.58 -0.19 0.00 -2.93 0.00 0.00 61.98 58.46 2kdo s VAL 58 Cb -0.11 -2.38 -0.09 0.00 -1.53 0.00 0.00 36.38 32.27 2kdo s VAL 58 CO 0.10 0.59 0.99 0.12 -3.33 0.00 0.00 175.10 173.58 2kdo s PHE 59 N -0.75 3.22 0.18 1.54 2.19 -0.54 0.39 117.98 124.20 2kdo s PHE 59 Ca 0.12 1.56 0.00 0.00 0.33 0.00 0.00 56.93 58.94 2kdo s PHE 59 Cb -0.11 -2.91 0.00 0.00 -1.31 0.00 0.00 43.02 38.69 2kdo s PHE 59 CO 0.01 -0.47 0.00 0.28 1.83 0.00 0.00 175.22 176.87 2kdo n VAL 60 N -1.08 0.61 -4.65 3.12 0.31 -1.12 -3.45 118.33 112.06 2kdo n VAL 60 Ca 0.08 0.20 -0.29 0.00 -0.01 0.00 0.00 64.34 64.31 2kdo n VAL 60 Cb 0.53 -1.07 -0.17 0.00 -0.91 0.00 0.00 33.84 32.23 2kdo n VAL 60 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2kdo s ASN 61 N -5.49 2.61 0.05 4.52 3.84 -0.97 -4.83 114.94 114.66 2kdo s ASN 61 Ca 0.00 -0.47 0.16 0.00 0.21 0.00 0.00 52.86 52.76 2kdo s ASN 61 Cb 0.00 -1.19 -0.15 0.00 -0.55 0.00 0.00 41.25 39.36 2kdo s ASN 61 CO 0.00 0.06 0.80 0.55 -2.79 0.00 0.00 177.10 175.72 2kdo n VAL 62 N 4.01 1.25 -0.04 -5.21 3.14 -1.26 -1.38 118.33 118.84 2kdo n VAL 62 Ca -0.20 -0.71 -0.14 0.00 -2.96 0.00 0.00 64.34 60.34 2kdo n VAL 62 Cb 0.52 -0.78 -0.09 0.00 -1.06 0.00 0.00 33.84 32.42 2kdo n VAL 62 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 2kdo h SER 63 N 0.00 0.29 1.55 6.55 0.02 -1.98 -3.21 113.55 116.78 2kdo h SER 63 Ca -0.18 -0.59 -0.05 0.00 -0.84 0.00 0.00 61.79 60.13 2kdo h SER 63 Cb 1.64 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 64.09 2kdo h SER 63 CO 0.05 0.83 -0.46 0.11 -1.14 0.00 0.00 176.83 176.22 2kdo h LYS 64 N -0.24 0.00 -2.98 3.45 1.57 -2.01 -3.48 116.57 112.89 2kdo h LYS 64 Ca -0.00 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.65 2kdo h LYS 64 Cb 0.79 0.00 0.05 0.00 0.08 0.00 0.00 32.23 33.16 2kdo h LYS 64 CO 0.04 0.20 -0.26 0.41 -0.57 0.00 0.00 179.45 179.27 2kdo n GLY 65 N 1.18 0.30 3.45 3.86 0.00 -0.85 -5.03 105.19 108.11 2kdo n GLY 65 Ca 0.01 -0.31 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 2kdo n GLY 65 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kdo s GLN 66 N -5.02 3.63 -0.01 1.61 -0.21 -0.48 -5.01 119.66 114.18 2kdo s GLN 66 Ca 0.11 -0.51 -0.01 0.00 0.02 0.00 0.00 55.36 54.98 2kdo s GLN 66 Cb -0.05 -3.12 -0.04 0.00 1.00 0.00 0.00 33.01 30.80 2kdo s GLN 66 CO 0.26 -0.01 0.09 0.08 -2.12 0.00 0.00 175.29 173.59 2kdo s VAL 67 N 1.07 4.79 -0.21 1.09 1.01 -1.26 -2.30 120.40 124.59 2kdo s VAL 67 Ca 0.02 -0.39 -0.13 0.00 0.00 0.00 0.00 61.98 61.49 2kdo s VAL 67 Cb -0.14 -3.19 -0.05 0.00 0.00 0.00 0.00 36.38 33.00 2kdo s VAL 67 CO 0.02 0.35 0.26 0.00 0.00 0.00 0.00 175.10 175.72 2kdo s ALA 68 N -1.20 3.60 0.22 5.51 0.00 0.16 -4.91 121.76 125.13 2kdo s ALA 68 Ca 0.23 -0.67 0.01 0.00 0.00 0.00 0.00 51.96 51.54 2kdo s ALA 68 Cb -0.12 -2.41 0.02 0.00 0.00 0.00 0.00 23.12 20.61 2kdo s ALA 68 CO 0.14 -0.12 0.14 1.63 0.00 0.00 0.00 175.76 177.55 2kdo n LYS 69 N 4.10 0.78 -0.35 0.00 5.02 -1.26 -1.85 118.16 124.59 2kdo n LYS 69 Ca -0.12 -0.47 0.12 0.00 -2.02 0.00 0.00 58.31 55.82 2kdo n LYS 69 Cb 0.52 -0.06 0.31 0.00 -0.02 0.00 0.00 35.03 35.78 2kdo n LYS 69 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 2kdo h LYS 70 N 0.00 0.73 0.00 1.97 -0.00 -1.98 0.05 116.57 117.35 2kdo h LYS 70 Ca -0.05 -0.04 -0.02 0.00 -0.00 0.00 0.00 60.65 60.54 2kdo h LYS 70 Cb 0.20 -0.17 -0.00 0.00 -0.00 0.00 0.00 32.23 32.26 2kdo h LYS 70 CO 0.06 0.49 -0.07 1.05 -0.00 0.00 0.00 179.45 180.97 2kdo h GLU 71 N 0.76 0.00 0.04 0.07 9.09 -2.00 -2.27 114.58 120.27 2kdo h GLU 71 Ca 0.57 0.00 -0.36 0.00 0.05 0.00 0.00 59.36 59.63 2kdo h GLU 71 Cb 0.88 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.94 2kdo h GLU 71 CO -0.38 0.07 -2.01 -3.47 0.05 0.00 0.00 179.01 173.27 2kdo n ASP 72 N -3.97 1.99 -0.03 3.06 2.03 -0.08 -4.08 116.55 115.46 2kdo n ASP 72 Ca -0.03 0.22 0.02 0.00 0.52 0.00 0.00 54.79 55.52 2kdo n ASP 72 Cb 0.16 -0.79 0.36 0.00 -0.72 0.00 0.00 41.12 40.13 2kdo n ASP 72 CO 0.00 0.00 0.00 0.17 -1.92 0.00 0.00 177.20 175.45 2kdo h LEU 73 N -0.45 0.53 -1.57 -2.67 8.10 -1.27 0.53 115.31 118.52 2kdo h LEU 73 Ca -0.49 -0.04 -0.04 0.00 0.11 0.00 0.00 57.88 57.41 2kdo h LEU 73 Cb 1.73 -0.14 -0.01 0.00 -0.44 0.00 0.00 40.66 41.80 2kdo h LEU 73 CO -0.13 0.46 -0.20 -0.29 -4.11 0.00 0.00 178.44 174.16 2kdo h ILE 74 N 0.61 0.71 0.05 0.15 2.10 -1.54 -0.46 117.51 119.13 2kdo h ILE 74 Ca 0.15 -0.85 -0.37 0.00 1.08 0.00 0.00 64.86 64.88 2kdo h ILE 74 Cb 0.06 1.53 -0.04 0.00 -1.09 0.00 0.00 36.82 37.27 2kdo h ILE 74 CO -0.02 0.20 -2.11 -1.20 -1.08 0.00 0.00 178.15 173.94 2kdo n SER 75 N -3.67 2.02 -0.06 2.19 7.64 -0.35 -2.29 113.62 119.10 2kdo n SER 75 Ca -0.01 0.15 -0.12 0.00 1.01 0.00 0.00 58.87 59.90 2kdo n SER 75 Cb 0.32 -0.74 -0.06 0.00 -1.01 0.00 0.00 64.21 62.73 2kdo n SER 75 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kdo h ALA 76 N -0.19 0.25 0.00 -0.43 0.00 0.01 -3.31 119.26 115.58 2kdo h ALA 76 Ca -0.50 -0.27 -0.31 0.00 0.00 0.00 0.00 54.91 53.83 2kdo h ALA 76 Cb 1.82 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 19.49 2kdo h ALA 76 CO -0.09 0.05 -1.96 0.34 0.00 0.00 0.00 179.25 177.59 2kdo n PHE 77 N -4.62 0.60 -0.46 0.00 7.35 -0.19 -4.99 117.46 115.16 2kdo n PHE 77 Ca -0.05 0.22 0.00 0.00 -0.76 0.00 0.00 57.45 56.86 2kdo n PHE 77 Cb 0.30 -1.10 0.00 0.00 0.35 0.00 0.00 39.48 39.02 2kdo n PHE 77 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2kdo n GLY 78 N 1.62 0.74 2.99 7.13 0.00 -0.97 -5.04 105.19 111.66 2kdo n GLY 78 Ca -0.23 -0.31 -0.14 0.00 0.00 0.00 0.00 46.02 45.35 2kdo n GLY 78 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kdo s THR 79 N -2.00 -0.22 -1.52 2.61 2.01 -1.21 -4.96 115.64 110.35 2kdo s THR 79 Ca 0.00 0.23 -0.09 0.00 0.31 0.00 0.00 61.69 62.15 2kdo s THR 79 Cb 0.00 -0.38 -0.02 0.00 0.01 0.00 0.00 72.50 72.11 2kdo s THR 79 CO 0.00 0.10 2.74 -0.67 -0.69 0.00 0.00 174.62 176.09 2kdo n ASP 80 N 4.84 8.27 -3.39 3.53 2.03 -1.26 -4.02 116.55 126.54 2kdo n ASP 80 Ca -0.15 -2.77 -0.08 0.00 0.52 0.00 0.00 54.79 52.31 2kdo n ASP 80 Cb 0.51 -1.50 -0.08 0.00 -0.72 0.00 0.00 41.12 39.33 2kdo n ASP 80 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2kdo s ASP 81 N 1.65 0.05 0.47 1.67 2.15 -1.26 -5.01 116.67 116.38 2kdo s ASP 81 Ca 0.64 0.41 0.25 0.00 0.43 0.00 0.00 52.55 54.27 2kdo s ASP 81 Cb 0.18 1.23 1.14 0.00 -0.30 0.00 0.00 42.92 45.17 2kdo s ASP 81 CO -0.07 -0.28 1.93 0.06 -0.17 0.00 0.00 175.17 176.64 2kdo h GLN 82 N 8.17 0.00 -0.24 4.34 -0.00 -1.88 -2.91 115.11 122.59 2kdo h GLN 82 Ca -0.19 0.00 -0.05 0.00 -0.00 0.00 0.00 58.65 58.41 2kdo h GLN 82 Cb 1.15 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.62 2kdo h GLN 82 CO 0.24 0.19 -0.03 1.15 -0.00 0.00 0.00 178.83 180.39 2kdo h THR 83 N 0.00 1.27 -0.39 1.86 2.02 -1.96 0.14 112.91 115.85 2kdo h THR 83 Ca -0.00 -0.98 0.02 0.00 0.77 0.00 0.00 66.41 66.21 2kdo h THR 83 Cb 0.57 1.42 -0.03 0.00 -1.74 0.00 0.00 68.15 68.37 2kdo h THR 83 CO 0.03 0.31 0.22 -0.33 0.37 0.00 0.00 175.52 176.11 2kdo h GLU 84 N 0.21 0.43 -0.13 6.66 4.39 -1.93 0.19 114.58 124.40 2kdo h GLU 84 Ca 0.07 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 2kdo h GLU 84 Cb 0.47 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 2kdo h GLU 84 CO 0.02 0.29 0.04 0.82 -1.16 0.00 0.00 179.01 179.02 2kdo h ILE 85 N 0.45 1.18 -0.43 3.13 2.04 -1.43 -2.49 117.51 119.95 2kdo h ILE 85 Ca 0.15 -0.54 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 2kdo h ILE 85 Cb 0.02 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 2kdo h ILE 85 CO -0.08 0.16 0.22 0.00 0.00 0.00 0.00 178.15 178.45 2kdo h LYS 87 N 0.60 0.97 -0.51 0.00 3.64 -0.34 0.25 116.57 121.18 2kdo h LYS 87 Ca 0.15 -0.13 -0.12 0.00 -1.27 0.00 0.00 60.65 59.29 2kdo h LYS 87 Cb 0.05 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 2kdo h LYS 87 CO -0.02 0.75 -0.14 1.96 -2.27 0.00 0.00 179.45 179.73 2kdo h GLN 88 N 0.95 1.00 -0.04 1.90 1.08 -0.93 -2.08 115.11 116.99 2kdo h GLN 88 Ca 0.24 -0.39 -0.10 0.00 -1.45 0.00 0.00 58.65 56.95 2kdo h GLN 88 Cb 0.08 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.45 2kdo h GLN 88 CO -0.03 1.07 -0.43 0.82 -0.95 0.00 0.00 178.83 179.31 2kdo h ILE 89 N 0.86 1.31 0.00 2.54 2.04 -0.84 0.63 117.51 124.06 2kdo h ILE 89 Ca 0.13 -1.52 0.00 0.00 1.00 0.00 0.00 64.86 64.47 2kdo h ILE 89 Cb 0.71 1.77 0.00 0.00 -0.74 0.00 0.00 36.82 38.56 2kdo h ILE 89 CO 0.05 0.44 0.00 -0.07 0.00 0.00 0.00 178.15 178.57 2kdo h LEU 90 N 0.07 0.00 0.00 1.44 -0.00 -0.26 -0.43 115.31 116.13 2kdo h LEU 90 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2kdo h LEU 90 Cb 0.79 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.45 2kdo h LEU 90 CO 0.06 0.00 -1.26 1.07 -0.00 0.00 0.00 178.44 178.31 2kdo n THR 91 N -2.91 0.00 -2.69 0.22 5.66 -0.80 -4.62 114.28 109.14 2kdo n THR 91 Ca 0.04 -0.26 0.01 0.00 -3.05 0.00 0.00 64.05 60.79 2kdo n THR 91 Cb 0.50 0.53 0.04 0.00 -1.55 0.00 0.00 70.33 69.86 2kdo n THR 91 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2kdo n LYS 92 N -1.73 1.10 -4.29 1.09 5.02 0.19 -5.08 118.16 114.45 2kdo n LYS 92 Ca -0.00 -2.79 -0.15 0.00 -2.02 0.00 0.00 58.31 53.35 2kdo n LYS 92 Cb 0.33 -0.89 -0.10 0.00 -0.02 0.00 0.00 35.03 34.35 2kdo n LYS 92 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2kdo s GLY 93 N -2.96 1.43 -0.90 0.72 0.00 -0.17 -4.66 107.32 100.78 2kdo s GLY 93 Ca 0.27 -1.70 -0.23 0.00 0.00 0.00 0.00 44.72 43.05 2kdo s GLY 93 CO -0.09 -1.59 1.32 -0.54 0.00 0.00 0.00 173.10 172.20 2kdo s GLU 94 N -3.92 3.44 -0.08 2.90 2.02 0.14 -4.82 118.70 118.39 2kdo s GLU 94 Ca 0.28 -0.95 -0.12 0.00 0.02 0.00 0.00 54.97 54.20 2kdo s GLU 94 Cb 0.06 -4.89 -0.05 0.00 0.10 0.00 0.00 34.13 29.35 2kdo s GLU 94 CO 0.07 -2.10 0.30 0.54 0.02 0.00 0.00 175.26 174.09 2kdo s VAL 95 N 4.78 5.24 -1.13 2.63 0.11 -1.26 -2.61 120.40 128.17 2kdo s VAL 95 Ca 0.39 0.58 -0.20 0.00 -2.93 0.00 0.00 61.98 59.82 2kdo s VAL 95 Cb -0.04 -3.60 -0.06 0.00 -1.53 0.00 0.00 36.38 31.15 2kdo s VAL 95 CO -0.02 0.54 1.93 0.00 -3.33 0.00 0.00 175.10 174.22 2kdo n GLN 96 N 2.36 2.06 0.00 1.54 10.64 -1.04 -4.46 117.38 128.46 2kdo n GLN 96 Ca -0.15 -2.48 0.05 0.00 -1.83 0.00 0.00 57.00 52.59 2kdo n GLN 96 Cb 0.53 -3.41 -0.05 0.00 -0.86 0.00 0.00 30.24 26.46 2kdo n GLN 96 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.06 176.56 2kdo n VAL 97 N 6.69 0.00 -3.85 -0.39 0.24 -1.26 -4.97 118.33 114.79 2kdo n VAL 97 Ca 0.48 -0.28 -0.09 0.00 -2.04 0.00 0.00 64.34 62.41 2kdo n VAL 97 Cb 0.44 1.02 -0.07 0.00 -1.47 0.00 0.00 33.84 33.76 2kdo n VAL 97 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2kdo s SER 98 N -1.86 0.10 0.36 -1.34 0.01 -1.26 -5.18 113.70 104.52 2kdo s SER 98 Ca 0.05 -0.60 0.04 0.00 1.31 0.00 0.00 55.95 56.74 2kdo s SER 98 Cb 0.08 0.34 0.04 0.00 0.21 0.00 0.00 66.02 66.68 2kdo s SER 98 CO 0.39 -0.71 0.32 -0.90 0.41 0.00 0.00 173.24 172.74 2kdo n ASP 99 N 0.03 1.97 0.00 2.44 5.75 -1.26 -5.03 116.55 120.44 2kdo n ASP 99 Ca -0.16 -2.17 0.00 0.00 -0.01 0.00 0.00 54.79 52.45 2kdo n ASP 99 Cb 0.62 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.63 2kdo n ASP 99 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 2kdo n LYS 100 N -1.43 0.00 -3.69 0.11 3.00 -1.26 -4.91 118.16 109.98 2kdo n LYS 100 Ca 0.01 0.00 -0.28 0.00 -0.00 0.00 0.00 58.31 58.04 2kdo n LYS 100 Cb 0.40 0.00 0.03 0.00 0.00 0.00 0.00 35.03 35.46 2kdo n LYS 100 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2kdo n GLU 101 N 0.00 -5.44 0.00 1.64 -0.58 -1.26 -4.92 120.64 110.09 2kdo n GLU 101 Ca 0.00 0.64 0.00 0.00 -0.42 0.00 0.00 57.16 57.38 2kdo n GLU 101 Cb 0.00 -5.53 0.00 0.00 -0.57 0.00 0.00 31.44 25.34 2kdo n GLU 101 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2kdo n ARG 102 N -4.51 0.00 -3.64 3.49 5.12 -1.26 -5.07 116.66 110.79 2kdo n ARG 102 Ca 0.01 0.00 -0.11 0.00 -1.93 0.00 0.00 57.85 55.82 2kdo n ARG 102 Cb 0.54 0.00 -0.07 0.00 -1.16 0.00 0.00 32.46 31.77 2kdo n ARG 102 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 2kdo s HIS 103 N 0.07 -0.86 -0.25 -1.55 2.46 -1.26 -5.14 115.29 108.75 2kdo s HIS 103 Ca 0.00 1.93 -0.02 0.00 0.47 0.00 0.00 55.06 57.44 2kdo s HIS 103 Cb 0.00 0.39 0.14 0.00 -0.13 0.00 0.00 32.58 32.98 2kdo s HIS 103 CO 0.00 -0.42 0.39 0.99 -2.47 0.00 0.00 174.74 173.23 2kdo s THR 104 N 0.83 -0.63 -0.47 0.89 2.01 -1.26 -5.10 115.64 111.91 2kdo s THR 104 Ca -0.04 -0.10 0.03 0.00 0.31 0.00 0.00 61.69 61.90 2kdo s THR 104 Cb -0.05 -0.84 0.12 0.00 0.01 0.00 0.00 72.50 71.74 2kdo s THR 104 CO -0.07 -0.14 0.21 -1.58 -0.69 0.00 0.00 174.62 172.36 2kdo s GLN 105 N 2.56 1.88 0.23 4.92 0.74 -1.26 -4.88 119.66 123.86 2kdo s GLN 105 Ca 0.13 -2.36 -0.00 0.00 0.05 0.00 0.00 55.36 53.18 2kdo s GLN 105 Cb -0.15 -3.34 -0.04 0.00 1.10 0.00 0.00 33.01 30.59 2kdo s GLN 105 CO -0.18 -1.06 0.18 -0.51 -0.55 0.00 0.00 175.29 173.17 2kdo s LEU 106 N 0.15 1.21 0.18 3.68 1.43 -1.26 -5.06 118.68 119.02 2kdo s LEU 106 Ca 0.15 -1.43 -0.14 0.00 -1.03 0.00 0.00 54.13 51.67 2kdo s LEU 106 Cb -0.23 0.50 0.17 0.00 0.03 0.00 0.00 46.19 46.66 2kdo s LEU 106 CO -0.03 -0.90 1.68 1.05 0.23 0.00 0.00 176.35 178.38 2kdo h GLU 107 N 2.51 0.09 -2.71 1.70 4.11 -2.07 -3.23 114.58 114.98 2kdo h GLU 107 Ca -0.33 -0.01 -0.61 0.00 0.07 0.00 0.00 59.36 58.48 2kdo h GLU 107 Cb 1.25 -0.02 -0.42 0.00 0.50 0.00 0.00 28.75 30.06 2kdo h GLU 107 CO 0.49 0.06 -0.62 1.04 0.07 0.00 0.00 179.01 180.05 2kdo n GLN 108 N -5.25 1.93 -0.34 1.06 6.02 -1.26 -4.91 117.38 114.63 2kdo n GLN 108 Ca 0.05 -4.44 0.01 0.00 -0.01 0.00 0.00 57.00 52.61 2kdo n GLN 108 Cb 0.26 -2.21 0.14 0.00 1.02 0.00 0.00 30.24 29.46 2kdo n GLN 108 CO 0.00 0.00 0.00 1.98 -1.01 0.00 0.00 177.06 178.03 2kdo h MET 109 N 4.95 1.07 0.00 -1.09 4.05 -1.89 0.59 114.93 122.62 2kdo h MET 109 Ca 0.17 -0.06 -0.02 0.00 -0.28 0.00 0.00 59.70 59.51 2kdo h MET 109 Cb 0.74 -0.24 -0.00 0.00 -0.80 0.00 0.00 31.60 31.29 2kdo h MET 109 CO 0.73 0.71 -0.10 0.27 0.23 0.00 0.00 176.91 178.75 2kdo h PHE 110 N 1.10 0.00 0.14 1.39 -0.00 -1.92 -1.01 116.94 116.63 2kdo h PHE 110 Ca 0.39 0.00 -0.36 0.00 -0.00 0.00 0.00 57.97 58.00 2kdo h PHE 110 Cb 0.11 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.05 2kdo h PHE 110 CO -0.02 0.10 -1.89 -0.09 -0.00 0.00 0.00 178.31 176.41 2kdo h ARG 111 N 0.00 0.29 -0.60 6.09 2.43 -1.62 -3.15 114.38 117.82 2kdo h ARG 111 Ca -0.00 -0.49 -0.08 0.00 -0.81 0.00 0.00 59.98 58.60 2kdo h ARG 111 Cb 0.21 0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 2kdo h ARG 111 CO 0.01 1.20 0.07 0.22 -1.51 0.00 0.00 179.97 179.96 2kdo h ASP 112 N 0.08 0.98 1.30 -3.80 3.58 -0.67 0.19 116.42 118.07 2kdo h ASP 112 Ca -0.39 -0.27 0.00 0.00 0.42 0.00 0.00 57.03 56.79 2kdo h ASP 112 Cb 2.05 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 42.84 2kdo h ASP 112 CO 0.12 1.01 0.00 -0.29 -2.88 0.00 0.00 179.24 177.19 2kdo h ILE 113 N 0.91 0.00 0.11 2.25 2.10 -1.35 -3.19 117.51 118.34 2kdo h ILE 113 Ca 0.18 -0.50 -0.36 0.00 1.08 0.00 0.00 64.86 65.27 2kdo h ILE 113 Cb 0.46 1.42 -0.02 0.00 -1.09 0.00 0.00 36.82 37.60 2kdo h ILE 113 CO 0.02 0.00 -1.96 0.00 -1.08 0.00 0.00 178.15 175.13 2kdo n ALA 114 N -1.87 0.96 0.30 0.18 0.00 -0.84 -4.03 120.51 115.22 2kdo n ALA 114 Ca 0.04 -0.61 0.19 0.00 0.00 0.00 0.00 53.44 53.06 2kdo n ALA 114 Cb 0.38 -0.71 0.89 0.00 0.00 0.00 0.00 19.45 20.01 2kdo n ALA 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kdo h THR 115 N 0.06 0.00 -0.00 0.00 1.03 -0.66 0.22 112.91 113.56 2kdo h THR 115 Ca -0.41 -0.31 0.00 0.00 -0.01 0.00 0.00 66.41 65.68 2kdo h THR 115 Cb 2.03 1.30 0.00 0.00 -1.07 0.00 0.00 68.15 70.41 2kdo h THR 115 CO 0.09 0.00 -0.27 0.00 -0.01 0.00 0.00 175.52 175.32 2kdo n ILE 116 N -3.07 0.00 -0.04 0.00 0.13 -1.21 -3.88 119.36 111.29 2kdo n ILE 116 Ca -0.01 -0.07 0.00 0.00 -1.10 0.00 0.00 62.75 61.57 2kdo n ILE 116 Cb 0.21 0.20 0.00 0.00 -0.84 0.00 0.00 39.64 39.21 2kdo n ILE 116 CO 0.00 0.00 0.00 0.55 2.80 0.00 0.00 176.55 179.90 2kdo n VAL 117 N -0.99 0.00 0.04 9.51 3.14 -0.48 -4.65 118.33 124.91 2kdo n VAL 117 Ca 0.11 -0.39 -0.11 0.00 -2.96 0.00 0.00 64.34 60.99 2kdo n VAL 117 Cb 0.33 1.04 -0.04 0.00 -1.06 0.00 0.00 33.84 34.10 2kdo n VAL 117 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kdo h ALA 118 N 0.00 -0.12 0.00 1.55 0.00 -0.73 -1.83 119.26 118.13 2kdo h ALA 118 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2kdo h ALA 118 Cb 0.02 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2kdo h ALA 118 CO 0.00 -0.61 -0.28 -0.25 0.00 0.00 0.00 179.25 178.11 2kdo n ASP 119 N -5.26 0.44 -0.00 0.00 8.00 -1.26 -3.31 116.55 115.15 2kdo n ASP 119 Ca -0.05 0.21 0.13 0.00 0.71 0.00 0.00 54.79 55.80 2kdo n ASP 119 Cb 0.18 -0.19 0.51 0.00 -0.02 0.00 0.00 41.12 41.61 2kdo n ASP 119 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2kdo n LYS 120 N -1.76 0.01 -3.05 -1.24 4.01 -0.81 -1.23 118.16 114.10 2kdo n LYS 120 Ca 0.06 -0.00 -0.08 0.00 -0.51 0.00 0.00 58.31 57.77 2kdo n LYS 120 Cb 0.38 -1.50 -0.02 0.00 -0.51 0.00 0.00 35.03 33.37 2kdo n LYS 120 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2kdo s VAL 122 N 1.05 2.08 0.22 0.00 -7.23 -1.25 -4.75 120.40 110.53 2kdo s VAL 122 Ca 0.25 -0.21 0.05 0.00 -1.81 0.00 0.00 61.98 60.27 2kdo s VAL 122 Cb -0.03 -2.88 -0.03 0.00 0.56 0.00 0.00 36.38 34.00 2kdo s VAL 122 CO -0.07 0.00 0.29 0.54 -0.31 0.00 0.00 175.10 175.55 2kdo s ASN 123 N -4.76 6.10 -0.00 4.85 6.03 -1.26 0.01 114.94 125.90 2kdo s ASN 123 Ca 0.69 0.01 -0.00 0.00 -1.03 0.00 0.00 52.86 52.53 2kdo s ASN 123 Cb -0.06 -1.74 -0.00 0.00 -3.03 0.00 0.00 41.25 36.42 2kdo s ASN 123 CO 0.49 -0.02 0.31 -0.65 -2.03 0.00 0.00 177.10 175.20 2kdo h PRO 124 N 1.55 -0.00 -2.64 3.55 0.11 -1.86 -3.44 132.00 129.27 2kdo h PRO 124 Ca -0.50 0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.01 2kdo h PRO 124 Cb 1.22 0.00 -0.39 0.00 0.11 0.00 0.00 31.00 31.94 2kdo h PRO 124 CO 0.63 -0.00 -0.84 -1.83 -0.21 0.00 0.00 178.00 175.75 2kdo s GLU 125 N -1.63 1.29 0.14 1.05 -1.05 -1.26 -4.85 118.70 112.39 2kdo s GLU 125 Ca -0.00 -2.32 0.00 0.00 -0.15 0.00 0.00 54.97 52.50 2kdo s GLU 125 Cb 0.00 -2.00 0.00 0.00 -0.44 0.00 0.00 34.13 31.69 2kdo s GLU 125 CO 0.00 -1.32 0.00 2.41 0.95 0.00 0.00 175.26 177.30 2kdo n THR 126 N 2.84 0.00 -1.93 1.83 -1.04 -1.26 -5.10 114.28 109.61 2kdo n THR 126 Ca 0.23 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.24 2kdo n THR 126 Cb 0.42 -0.30 0.00 0.00 -1.82 0.00 0.00 70.33 68.63 2kdo n THR 126 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2kdo n LYS 127 N -2.87 0.00 -4.21 -2.82 3.00 -1.26 -5.17 118.16 104.84 2kdo n LYS 127 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 58.31 58.19 2kdo n LYS 127 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 35.03 34.93 2kdo n LYS 127 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2kdo s ARG 128 N 1.42 1.00 1.12 1.64 0.52 -1.26 -4.81 118.95 118.58 2kdo s ARG 128 Ca 0.00 -1.45 -0.17 0.00 -0.52 0.00 0.00 55.73 53.58 2kdo s ARG 128 Cb 0.00 -0.24 0.27 0.00 0.52 0.00 0.00 34.95 35.50 2kdo s ARG 128 CO 0.00 -0.09 0.60 -0.35 0.02 0.00 0.00 175.30 175.49 2kdo n PRO 129 N -0.16 -3.23 -2.03 3.54 -0.04 -1.26 -4.03 135.00 127.79 2kdo n PRO 129 Ca -0.09 -1.01 -0.18 0.00 -0.04 0.00 0.00 63.50 62.18 2kdo n PRO 129 Cb 0.62 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.55 2kdo n PRO 129 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 2kdo n TYR 130 N -4.96 -0.53 -3.71 0.54 4.19 -1.26 -4.96 117.16 106.48 2kdo n TYR 130 Ca 0.10 0.00 -0.30 0.00 3.31 0.00 0.00 57.90 61.01 2kdo n TYR 130 Cb 0.42 -3.41 -0.14 0.00 0.49 0.00 0.00 39.34 36.70 2kdo n TYR 130 CO 0.00 0.00 0.00 0.99 0.91 0.00 0.00 176.86 178.76 2kdo s THR 131 N -2.82 1.12 0.18 2.97 2.01 -1.26 -4.97 115.64 112.88 2kdo s THR 131 Ca 0.00 -2.03 -0.07 0.00 0.31 0.00 0.00 61.69 59.91 2kdo s THR 131 Cb 0.00 -1.81 -0.02 0.00 0.01 0.00 0.00 72.50 70.68 2kdo s THR 131 CO 0.00 -0.81 1.54 0.58 -0.69 0.00 0.00 174.62 175.24 2kdo h VAL 132 N 5.76 1.28 -0.85 3.82 2.07 -1.93 -3.13 116.25 123.28 2kdo h VAL 132 Ca -0.06 -1.53 0.18 0.00 0.82 0.00 0.00 66.70 66.12 2kdo h VAL 132 Cb 0.97 1.41 -0.06 0.00 -1.52 0.00 0.00 31.29 32.09 2kdo h VAL 132 CO 0.46 0.50 0.57 0.40 0.02 0.00 0.00 177.57 179.52 2kdo h ILE 133 N 0.66 0.72 0.01 4.57 1.08 -1.97 0.22 117.51 122.79 2kdo h ILE 133 Ca 0.06 -0.14 -0.00 0.00 -0.39 0.00 0.00 64.86 64.39 2kdo h ILE 133 Cb 0.92 0.28 0.00 0.00 -3.07 0.00 0.00 36.82 34.95 2kdo h ILE 133 CO 0.08 0.07 -0.00 -0.07 -0.69 0.00 0.00 178.15 177.54 2kdo h LEU 134 N 0.40 -0.01 -0.25 1.44 -0.00 -1.96 0.98 115.31 115.93 2kdo h LEU 134 Ca 0.43 -0.15 -0.19 0.00 -0.00 0.00 0.00 57.88 57.98 2kdo h LEU 134 Cb 1.07 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.71 2kdo h LEU 134 CO -0.15 0.14 -0.89 -0.29 -0.00 0.00 0.00 178.44 177.25 2kdo h ILE 135 N -0.16 1.60 -0.35 1.22 6.09 -1.50 -3.12 117.51 121.29 2kdo h ILE 135 Ca -0.00 -2.93 -0.04 0.00 -1.37 0.00 0.00 64.86 60.51 2kdo h ILE 135 Cb 0.15 2.60 -0.01 0.00 0.47 0.00 0.00 36.82 40.03 2kdo h ILE 135 CO 0.00 0.84 0.05 -0.08 -3.07 0.00 0.00 178.15 175.89 2kdo h GLU 136 N 0.02 0.59 -0.43 2.19 4.81 -0.46 -1.09 114.58 120.22 2kdo h GLU 136 Ca -0.02 -0.16 -0.01 0.00 -0.13 0.00 0.00 59.36 59.04 2kdo h GLU 136 Cb 1.55 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.85 2kdo h GLU 136 CO 0.12 0.67 0.22 -0.09 -0.73 0.00 0.00 179.01 179.20 2kdo h ARG 137 N 0.42 0.58 -0.05 1.92 1.12 -0.84 0.30 114.38 117.84 2kdo h ARG 137 Ca 0.11 -0.06 -0.03 0.00 -1.11 0.00 0.00 59.98 58.89 2kdo h ARG 137 Cb 0.37 -0.12 -0.00 0.00 -0.01 0.00 0.00 29.97 30.21 2kdo h ARG 137 CO 0.01 0.44 -0.07 0.00 -3.11 0.00 0.00 179.97 177.24 2kdo h ALA 138 N 1.66 0.07 -0.43 2.80 0.00 -1.41 -2.61 119.26 119.33 2kdo h ALA 138 Ca 0.15 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 2kdo h ALA 138 Cb 0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2kdo h ALA 138 CO -0.02 -0.10 -0.06 1.98 0.00 0.00 0.00 179.25 181.04 2kdo h MET 139 N -0.36 0.74 0.00 0.00 1.85 -0.84 -2.28 114.93 114.05 2kdo h MET 139 Ca 0.00 -0.22 -0.03 0.00 -0.61 0.00 0.00 59.70 58.84 2kdo h MET 139 Cb 0.62 -0.08 -0.00 0.00 0.43 0.00 0.00 31.60 32.56 2kdo h MET 139 CO 0.02 0.80 -0.17 -0.22 -0.40 0.00 0.00 176.91 176.94 2kdo h LYS 140 N 0.68 0.00 0.07 0.39 1.63 -0.42 0.27 116.57 119.19 2kdo h LYS 140 Ca 0.13 0.00 -0.27 0.00 -0.85 0.00 0.00 60.65 59.65 2kdo h LYS 140 Cb 0.51 0.00 0.02 0.00 -0.60 0.00 0.00 32.23 32.16 2kdo h LYS 140 CO 0.03 0.17 -1.13 0.22 -3.45 0.00 0.00 179.45 175.28 2kdo h ASP 141 N 0.00 0.73 0.12 4.20 3.58 -1.02 -3.37 116.42 120.67 2kdo h ASP 141 Ca -0.00 -0.65 -0.01 0.00 0.42 0.00 0.00 57.03 56.79 2kdo h ASP 141 Cb 0.39 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.21 2kdo h ASP 141 CO 0.02 1.46 -0.06 0.40 -2.88 0.00 0.00 179.24 178.19 2kdo h ILE 142 N 0.26 0.12 0.00 2.25 2.04 -1.18 -3.47 117.51 117.53 2kdo h ILE 142 Ca -0.14 -0.96 0.00 0.00 1.00 0.00 0.00 64.86 64.76 2kdo h ILE 142 Cb 1.80 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 2kdo h ILE 142 CO 0.21 0.04 0.00 1.57 0.00 0.00 0.00 178.15 179.97 2kdo n HIS 143 N -4.88 0.00 -2.28 1.37 -0.00 0.05 -4.96 115.22 104.52 2kdo n HIS 143 Ca -0.03 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.28 2kdo n HIS 143 Cb 0.09 -0.07 -0.03 0.00 -0.00 0.00 0.00 29.99 29.98 2kdo n HIS 143 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.34 175.87 2kdo s TYR 144 N -0.42 3.32 0.60 1.57 5.04 -1.26 -5.03 117.35 121.17 2kdo s TYR 144 Ca 0.00 1.32 -0.01 0.00 -2.44 0.00 0.00 57.07 55.95 2kdo s TYR 144 Cb 0.00 -3.53 0.04 0.00 0.35 0.00 0.00 41.96 38.83 2kdo s TYR 144 CO 0.00 -1.57 0.84 -1.12 -1.34 0.00 0.00 175.55 172.36 2kdo s SER 145 N 0.18 5.11 -0.30 4.32 0.01 -1.26 -4.97 113.70 116.80 2kdo s SER 145 Ca 0.54 0.08 -0.04 0.00 1.31 0.00 0.00 55.95 57.85 2kdo s SER 145 Cb -0.35 -0.88 -0.01 0.00 0.21 0.00 0.00 66.02 64.99 2kdo s SER 145 CO 0.38 -1.29 2.88 0.52 0.41 0.00 0.00 173.24 176.14 2kdo n VAL 146 N -2.51 3.11 -2.47 3.43 0.31 -1.26 -4.71 118.33 114.23 2kdo n VAL 146 Ca 0.08 -2.32 -0.13 0.00 -0.01 0.00 0.00 64.34 61.96 2kdo n VAL 146 Cb 0.60 -1.67 -0.01 0.00 -0.91 0.00 0.00 33.84 31.86 2kdo n VAL 146 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2kdo n LYS 147 N 1.27 -2.25 -3.64 5.55 5.02 -1.26 -2.98 118.16 119.88 2kdo n LYS 147 Ca 0.43 0.63 -0.27 0.00 -2.02 0.00 0.00 58.31 57.08 2kdo n LYS 147 Cb 0.65 -5.24 0.01 0.00 -0.02 0.00 0.00 35.03 30.43 2kdo n LYS 147 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 2kdo n THR 148 N -3.47 -4.23 -1.20 -0.18 5.66 -1.26 -1.79 114.28 107.81 2kdo n THR 148 Ca -0.15 0.03 -0.10 0.00 -3.05 0.00 0.00 64.05 60.78 2kdo n THR 148 Cb 0.62 -3.53 -0.04 0.00 -1.55 0.00 0.00 70.33 65.83 2kdo n THR 148 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 2kdo n ASN 149 N -1.81 -3.19 -4.48 1.09 0.23 -1.16 -4.93 115.26 101.00 2kdo n ASN 149 Ca -0.22 0.24 -0.33 0.00 -0.53 0.00 0.00 54.58 53.74 2kdo n ASN 149 Cb 0.67 -2.85 -0.13 0.00 -2.08 0.00 0.00 39.78 35.40 2kdo n ASN 149 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 2kdo s LYS 150 N -2.67 2.48 -1.22 -3.83 3.01 -0.74 -4.59 119.74 112.18 2kdo s LYS 150 Ca 0.00 -0.71 -0.07 0.00 -1.01 0.00 0.00 55.97 54.18 2kdo s LYS 150 Cb 0.00 -2.38 0.01 0.00 -1.01 0.00 0.00 37.83 34.45 2kdo s LYS 150 CO 0.00 0.62 0.93 0.43 0.51 0.00 0.00 175.35 177.84 2kdo n SER 151 N 2.23 -5.79 0.03 2.83 7.64 -1.26 -4.60 113.62 114.70 2kdo n SER 151 Ca -0.17 -0.42 0.01 0.00 1.01 0.00 0.00 58.87 59.29 2kdo n SER 151 Cb 0.52 -4.45 0.32 0.00 -1.01 0.00 0.00 64.21 59.60 2kdo n SER 151 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2kdo h THR 152 N -2.12 1.19 -0.06 0.44 1.35 -1.90 -0.98 112.91 110.82 2kdo h THR 152 Ca -0.49 -0.76 0.00 0.00 -0.55 0.00 0.00 66.41 64.61 2kdo h THR 152 Cb 1.32 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 2kdo h THR 152 CO 0.49 0.26 0.00 2.29 -0.25 0.00 0.00 175.52 178.31 2kdo n LYS 153 N -4.28 1.29 -0.08 4.72 2.85 -1.26 -2.55 118.16 118.84 2kdo n LYS 153 Ca 0.01 -0.44 -0.15 0.00 -1.05 0.00 0.00 58.31 56.68 2kdo n LYS 153 Cb 0.25 -1.34 -0.05 0.00 -0.65 0.00 0.00 35.03 33.24 2kdo n LYS 153 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 2kdo n GLN 154 N -0.35 0.42 -0.55 -1.58 1.13 -0.44 -4.61 117.38 111.40 2kdo n GLN 154 Ca 0.15 0.18 0.06 0.00 -1.94 0.00 0.00 57.00 55.45 2kdo n GLN 154 Cb 0.17 -1.21 0.29 0.00 0.11 0.00 0.00 30.24 29.60 2kdo n GLN 154 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2kdo n GLN 155 N -4.06 3.41 -0.27 -1.09 3.00 -0.81 -4.39 117.38 113.16 2kdo n GLN 155 Ca -0.27 -2.25 -0.01 0.00 -0.01 0.00 0.00 57.00 54.46 2kdo n GLN 155 Cb 0.60 -1.87 0.11 0.00 0.00 0.00 0.00 30.24 29.08 2kdo n GLN 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2kdo h ALA 156 N 3.68 1.02 -0.04 -1.58 0.00 -1.72 0.22 119.26 120.83 2kdo h ALA 156 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2kdo h ALA 156 Cb 1.34 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2kdo h ALA 156 CO 0.25 0.21 0.00 1.28 0.00 0.00 0.00 179.25 180.99 2kdo n LEU 157 N -4.67 0.56 -0.06 0.00 7.99 -1.26 -3.04 117.00 116.52 2kdo n LEU 157 Ca 0.10 -0.22 -0.12 0.00 -0.01 0.00 0.00 56.01 55.75 2kdo n LEU 157 Cb 0.14 -0.03 -0.04 0.00 -0.11 0.00 0.00 43.42 43.38 2kdo n LEU 157 CO 0.31 0.11 -0.90 1.21 -1.51 0.00 0.00 177.39 176.61 2kdo n GLU 158 N -0.45 0.26 -0.22 3.23 2.13 -0.27 -4.47 120.64 120.84 2kdo n GLU 158 Ca 0.17 0.10 -0.06 0.00 0.66 0.00 0.00 57.16 58.03 2kdo n GLU 158 Cb 0.17 -0.96 0.08 0.00 0.27 0.00 0.00 31.44 30.99 2kdo n GLU 158 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2kdo h VAL 159 N -0.37 1.26 0.00 6.31 2.07 -0.76 -0.21 116.25 124.56 2kdo h VAL 159 Ca -0.30 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.25 2kdo h VAL 159 Cb 1.28 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 2kdo h VAL 159 CO -0.16 0.37 0.00 0.00 0.02 0.00 0.00 177.57 177.79 2kdo n ILE 160 N -4.23 1.16 -0.10 4.57 3.06 -1.17 -2.26 119.36 120.39 2kdo n ILE 160 Ca 0.05 0.29 -0.12 0.00 -2.50 0.00 0.00 62.75 60.46 2kdo n ILE 160 Cb 0.27 -1.09 -0.12 0.00 0.54 0.00 0.00 39.64 39.24 2kdo n ILE 160 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 2kdo n LYS 161 N -1.49 0.82 0.27 9.51 4.76 -0.68 -4.01 118.16 127.34 2kdo n LYS 161 Ca 0.03 0.07 -0.16 0.00 -2.87 0.00 0.00 58.31 55.37 2kdo n LYS 161 Cb 0.14 -1.45 -0.08 0.00 -1.84 0.00 0.00 35.03 31.80 2kdo n LYS 161 CO 0.00 0.00 0.00 1.96 -1.37 0.00 0.00 177.40 177.99 2kdo h GLN 162 N 0.00 -0.76 0.00 1.97 4.20 -0.62 -1.11 115.11 118.79 2kdo h GLN 162 Ca -0.49 0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.25 2kdo h GLN 162 Cb 1.92 0.17 -0.00 0.00 0.30 0.00 0.00 27.48 29.87 2kdo h GLN 162 CO -0.03 -0.51 -0.11 1.37 -0.67 0.00 0.00 178.83 178.88 2kdo h LEU 163 N -0.79 0.00 -0.83 1.46 -0.00 -1.77 -2.74 115.31 110.65 2kdo h LEU 163 Ca -0.05 0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 57.71 2kdo h LEU 163 Cb 0.67 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.32 2kdo h LEU 163 CO 0.00 0.11 -0.55 0.50 -0.00 0.00 0.00 178.44 178.51 2kdo h LYS 164 N 0.00 0.11 -0.15 0.17 3.11 -1.56 0.19 116.57 118.44 2kdo h LYS 164 Ca -0.00 -0.07 -0.10 0.00 -2.81 0.00 0.00 60.65 57.67 2kdo h LYS 164 Cb 0.70 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.93 2kdo h LYS 164 CO 0.01 0.63 -0.34 1.49 -2.81 0.00 0.00 179.45 178.43 2kdo h GLU 165 N 0.09 0.30 0.12 1.90 4.22 -0.89 -3.18 114.58 117.12 2kdo h GLU 165 Ca -0.00 -0.12 -0.22 0.00 0.08 0.00 0.00 59.36 59.09 2kdo h GLU 165 Cb 0.99 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 30.24 2kdo h GLU 165 CO 0.08 0.61 -1.09 0.87 -2.18 0.00 0.00 179.01 177.29 2kdo h LYS 166 N 0.26 0.24 -3.01 1.92 6.56 -1.48 -3.46 116.57 117.59 2kdo h LYS 166 Ca 0.03 -0.42 -0.22 0.00 -1.06 0.00 0.00 60.65 58.99 2kdo h LYS 166 Cb 0.73 0.16 -0.31 0.00 -0.57 0.00 0.00 32.23 32.23 2kdo h LYS 166 CO 0.06 1.20 -0.52 1.41 -2.06 0.00 0.00 179.45 179.53 2kdo s MET 167 N -2.44 0.16 -0.18 3.15 1.75 0.62 -4.97 119.30 117.40 2kdo s MET 167 Ca -0.18 0.58 -0.29 0.00 -1.25 0.00 0.00 55.69 54.55 2kdo s MET 167 Cb 0.03 -0.12 -0.00 0.00 2.84 0.00 0.00 34.83 37.58 2kdo s MET 167 CO 0.78 -0.21 1.00 0.15 -0.65 0.00 0.00 175.02 176.09 2kdo s LYS 168 N 1.67 4.32 0.42 4.11 1.02 -1.23 -3.81 119.74 126.24 2kdo s LYS 168 Ca -0.05 1.32 0.05 0.00 0.02 0.00 0.00 55.97 57.30 2kdo s LYS 168 Cb -0.11 -3.60 -0.06 0.00 -0.52 0.00 0.00 37.83 33.55 2kdo s LYS 168 CO -0.08 -0.47 0.03 0.96 -0.92 0.00 0.00 175.35 174.87 2kdo s ILE 169 N 2.61 1.50 0.00 2.17 -0.00 -1.26 -4.05 121.20 122.17 2kdo s ILE 169 Ca 0.45 -2.00 0.00 0.00 -0.00 0.00 0.00 60.65 59.10 2kdo s ILE 169 Cb -0.16 -2.69 0.00 0.00 -0.00 0.00 0.00 42.46 39.60 2kdo s ILE 169 CO 0.11 0.00 0.00 1.21 -0.00 0.00 0.00 174.94 176.26 2kdo n GLU 170 N -0.98 0.00 -3.61 0.37 2.13 0.10 -4.76 120.64 113.90 2kdo n GLU 170 Ca -0.08 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.74 2kdo n GLU 170 Cb 0.67 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 32.37 2kdo n GLU 170 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 2kdo s ARG 171 N 0.91 0.34 0.57 5.31 6.06 -1.26 -5.01 118.95 125.86 2kdo s ARG 171 Ca 0.00 -0.17 -0.08 0.00 -2.50 0.00 0.00 55.73 52.97 2kdo s ARG 171 Cb 0.00 0.12 -0.03 0.00 0.06 0.00 0.00 34.95 35.11 2kdo s ARG 171 CO 0.00 -0.15 0.93 0.00 -2.50 0.00 0.00 175.30 173.58 2kdo s ALA 172 N -2.38 3.22 0.16 6.12 0.00 -1.24 -4.66 121.76 122.98 2kdo s ALA 172 Ca 0.13 -0.34 0.05 0.00 0.00 0.00 0.00 51.96 51.80 2kdo s ALA 172 Cb 0.04 -2.83 -0.04 0.00 0.00 0.00 0.00 23.12 20.28 2kdo s ALA 172 CO -0.04 -0.62 -0.11 -1.01 0.00 0.00 0.00 175.76 173.98 2kdo s HIS 173 N -3.01 1.35 0.60 0.00 3.76 -1.26 -5.03 115.29 111.70 2kdo s HIS 173 Ca 0.52 -0.72 0.05 0.00 -0.15 0.00 0.00 55.06 54.76 2kdo s HIS 173 Cb -0.11 -0.67 0.11 0.00 1.11 0.00 0.00 32.58 33.02 2kdo s HIS 173 CO 0.49 0.14 0.83 -1.33 -0.85 0.00 0.00 174.74 174.02 2kdo n MET 174 N -0.23 0.31 -2.55 1.40 2.81 -1.26 -4.88 117.12 112.73 2kdo n MET 174 Ca -0.10 -2.74 -0.41 0.00 -1.81 0.00 0.00 57.70 52.64 2kdo n MET 174 Cb 0.60 -0.41 -0.04 0.00 -0.71 0.00 0.00 33.22 32.67 2kdo n MET 174 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2kdo s ARG 175 N -4.67 4.55 0.03 0.03 0.52 -1.26 -4.91 118.95 113.24 2kdo s ARG 175 Ca 0.59 1.65 0.01 0.00 -0.52 0.00 0.00 55.73 57.46 2kdo s ARG 175 Cb -0.04 -3.34 -0.04 0.00 0.52 0.00 0.00 34.95 32.05 2kdo s ARG 175 CO 0.38 -0.03 0.07 -0.51 0.02 0.00 0.00 175.30 175.23 2kdo s LEU 176 N 0.32 3.79 0.01 2.53 1.43 -1.26 -0.30 118.68 125.21 2kdo s LEU 176 Ca 0.52 0.06 0.05 0.00 -1.03 0.00 0.00 54.13 53.73 2kdo s LEU 176 Cb -0.27 -2.31 -0.01 0.00 0.03 0.00 0.00 46.19 43.63 2kdo s LEU 176 CO 0.31 0.24 -0.15 0.00 0.23 0.00 0.00 176.35 176.98 2kdo s ARG 177 N -1.95 1.13 -0.08 1.70 1.70 -0.77 -3.30 118.95 117.38 2kdo s ARG 177 Ca 0.25 -0.62 0.02 0.00 -0.47 0.00 0.00 55.73 54.91 2kdo s ARG 177 Cb -0.12 -1.12 0.01 0.00 -0.57 0.00 0.00 34.95 33.16 2kdo s ARG 177 CO 0.16 0.30 -0.14 -0.06 -1.08 0.00 0.00 175.30 174.48 2kdo s PHE 178 N -0.51 1.73 -0.13 5.89 0.08 -0.09 -0.34 117.98 124.60 2kdo s PHE 178 Ca 0.05 -0.71 -0.06 0.00 0.12 0.00 0.00 56.93 56.32 2kdo s PHE 178 Cb -0.06 -1.25 -0.04 0.00 -0.57 0.00 0.00 43.02 41.10 2kdo s PHE 178 CO 0.00 -0.36 0.10 0.96 -0.10 0.00 0.00 175.22 175.82 2kdo s ILE 179 N 0.76 5.14 -0.12 0.64 -4.36 0.07 -0.71 121.20 122.63 2kdo s ILE 179 Ca -0.12 0.07 -0.05 0.00 -0.26 0.00 0.00 60.65 60.29 2kdo s ILE 179 Cb -0.16 -3.25 0.06 0.00 1.25 0.00 0.00 42.46 40.37 2kdo s ILE 179 CO 0.02 0.57 0.26 -0.22 0.24 0.00 0.00 174.94 175.81 2kdo s LEU 180 N -0.65 -0.05 0.39 0.37 0.20 -1.20 -1.16 118.68 116.58 2kdo s LEU 180 Ca 0.12 0.57 -0.25 0.00 0.69 0.00 0.00 54.13 55.26 2kdo s LEU 180 Cb -0.12 0.71 -0.11 0.00 -0.43 0.00 0.00 46.19 46.23 2kdo s LEU 180 CO 0.02 -0.21 1.02 -0.81 -0.29 0.00 0.00 176.35 176.08 2kdo n PRO 181 N 4.96 1.39 -0.36 0.98 -0.04 -1.26 0.51 135.00 141.18 2kdo n PRO 181 Ca -0.13 0.50 0.27 0.00 -0.04 0.00 0.00 63.50 64.09 2kdo n PRO 181 Cb 0.51 -2.01 0.52 0.00 -0.04 0.00 0.00 33.50 32.48 2kdo n PRO 181 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2kdo h VAL 182 N 1.69 0.33 -0.98 0.52 2.07 -1.88 0.21 116.25 118.21 2kdo h VAL 182 Ca -0.43 -0.10 0.24 0.00 0.82 0.00 0.00 66.70 67.22 2kdo h VAL 182 Cb 1.34 0.01 -0.12 0.00 -1.52 0.00 0.00 31.29 30.99 2kdo h VAL 182 CO 0.58 0.05 0.55 -1.13 0.02 0.00 0.00 177.57 177.64 2kdo h ASN 183 N 0.30 0.60 -0.06 0.57 -0.73 -1.89 -1.25 115.58 113.12 2kdo h ASN 183 Ca 0.71 0.14 0.00 0.00 1.87 0.00 0.00 56.30 59.02 2kdo h ASN 183 Cb 1.83 0.05 0.00 0.00 0.27 0.00 0.00 38.32 40.47 2kdo h ASN 183 CO -0.46 0.09 0.00 -0.62 -0.37 0.00 0.00 177.43 176.07 2kdo n GLU 184 N -4.92 1.97 0.15 6.67 -0.58 0.03 -4.66 120.64 119.29 2kdo n GLU 184 Ca 0.26 -1.35 0.02 0.00 -0.42 0.00 0.00 57.16 55.66 2kdo n GLU 184 Cb 0.72 -1.06 0.35 0.00 -0.57 0.00 0.00 31.44 30.88 2kdo n GLU 184 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 2kdo h GLY 185 N 0.46 0.14 2.00 0.62 0.00 0.57 -2.59 103.07 104.27 2kdo h GLY 185 Ca 0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 47.33 47.19 2kdo h GLY 185 CO 0.00 0.10 -0.17 1.70 0.00 0.00 0.00 176.54 178.17 2kdo h LYS 186 N 0.12 0.00 -0.22 4.80 3.64 -1.83 -0.04 116.57 123.04 2kdo h LYS 186 Ca 0.02 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 2kdo h LYS 186 Cb 0.58 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.39 2kdo h LYS 186 CO 0.04 0.17 0.12 0.87 -2.27 0.00 0.00 179.45 178.38 2kdo h LYS 187 N 0.00 0.31 0.00 1.90 6.56 -1.81 -2.38 116.57 121.15 2kdo h LYS 187 Ca -0.00 -0.04 -0.05 0.00 -1.06 0.00 0.00 60.65 59.50 2kdo h LYS 187 Cb 0.32 -0.06 -0.01 0.00 -0.57 0.00 0.00 32.23 31.91 2kdo h LYS 187 CO 0.02 0.30 -0.75 1.37 -2.06 0.00 0.00 179.45 178.33 2kdo h LEU 188 N 0.25 0.00 0.22 2.94 -0.00 -1.63 -3.32 115.31 113.77 2kdo h LEU 188 Ca 0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.95 2kdo h LEU 188 Cb 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.74 2kdo h LEU 188 CO -0.01 0.20 -0.10 0.50 -0.00 0.00 0.00 178.44 179.03 2kdo h LYS 189 N 0.00 -0.28 -0.85 0.17 3.64 -0.75 -0.10 116.57 118.40 2kdo h LYS 189 Ca -0.03 0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.31 2kdo h LYS 189 Cb 1.19 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 33.04 2kdo h LYS 189 CO 0.02 -0.18 0.07 -0.85 -2.27 0.00 0.00 179.45 176.24 2kdo n GLU 190 N -5.21 2.55 0.00 1.90 0.28 -0.92 -3.21 120.64 116.03 2kdo n GLU 190 Ca -0.09 -1.46 0.00 0.00 -0.16 0.00 0.00 57.16 55.45 2kdo n GLU 190 Cb 0.14 -1.79 0.00 0.00 1.43 0.00 0.00 31.44 31.22 2kdo n GLU 190 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2kdo n LYS 191 N 0.17 0.00 0.10 3.44 4.76 -0.87 -4.72 118.16 121.04 2kdo n LYS 191 Ca 0.16 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.38 2kdo n LYS 191 Cb 0.77 -0.61 -0.15 0.00 -1.84 0.00 0.00 35.03 33.20 2kdo n LYS 191 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2kdo h LEU 192 N 0.00 0.67 -0.01 -0.35 3.38 -1.16 -3.35 115.31 114.48 2kdo h LEU 192 Ca 0.00 -0.85 0.00 0.00 0.09 0.00 0.00 57.88 57.12 2kdo h LEU 192 Cb 0.93 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 2kdo h LEU 192 CO 0.00 1.70 0.00 0.11 0.09 0.00 0.00 178.44 180.34 2kdo h LYS 193 N 0.12 0.01 0.00 1.13 1.57 -1.73 -2.49 116.57 115.18 2kdo h LYS 193 Ca -0.29 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 2kdo h LYS 193 Cb 2.11 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.42 2kdo h LYS 193 CO 0.21 0.01 0.00 -1.00 -0.57 0.00 0.00 179.45 178.10 2kdo h PRO 194 N 0.01 0.00 0.00 3.15 0.13 -1.81 0.27 132.00 133.75 2kdo h PRO 194 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2kdo h PRO 194 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2kdo h PRO 194 CO -0.01 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.04 2kdo n LEU 195 N -3.04 0.75 -3.76 1.56 4.77 -0.94 -4.91 117.00 111.42 2kdo n LEU 195 Ca -0.03 0.58 -0.27 0.00 -0.03 0.00 0.00 56.01 56.26 2kdo n LEU 195 Cb 0.07 -0.35 0.05 0.00 -2.33 0.00 0.00 43.42 40.86 2kdo n LEU 195 CO 0.20 -0.20 0.15 -0.38 -1.33 0.00 0.00 177.39 175.83 2kdo n ILE 196 N -2.21 -2.74 -1.76 -0.08 2.08 0.08 -4.88 119.36 109.85 2kdo n ILE 196 Ca 0.05 -0.06 0.06 0.00 0.56 0.00 0.00 62.75 63.36 2kdo n ILE 196 Cb 0.41 -3.45 0.16 0.00 -0.75 0.00 0.00 39.64 36.01 2kdo n ILE 196 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 2kdo n LYS 197 N -4.76 1.17 -4.42 0.38 5.02 -1.25 -5.04 118.16 109.25 2kdo n LYS 197 Ca -0.01 -2.89 -0.26 0.00 -2.02 0.00 0.00 58.31 53.13 2kdo n LYS 197 Cb 0.56 -1.23 -0.11 0.00 -0.02 0.00 0.00 35.03 34.23 2kdo n LYS 197 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2kdo s VAL 198 N -2.41 2.52 0.03 -0.18 -7.23 -1.26 -4.40 120.40 107.46 2kdo s VAL 198 Ca 0.35 -2.09 0.01 0.00 -1.81 0.00 0.00 61.98 58.44 2kdo s VAL 198 Cb 0.36 -2.25 -0.04 0.00 0.56 0.00 0.00 36.38 35.01 2kdo s VAL 198 CO -0.08 -0.20 0.08 -0.63 -0.31 0.00 0.00 175.10 173.96 2kdo s ILE 199 N -1.93 4.67 -1.15 -0.62 1.01 0.32 -4.99 121.20 118.50 2kdo s ILE 199 Ca 0.24 -0.53 -0.20 0.00 0.00 0.00 0.00 60.65 60.15 2kdo s ILE 199 Cb -0.07 -3.18 -0.05 0.00 0.01 0.00 0.00 42.46 39.17 2kdo s ILE 199 CO 0.12 0.27 1.92 -0.62 0.00 0.00 0.00 174.94 176.63 2kdo n GLU 200 N 0.91 2.14 -0.88 2.79 1.02 -1.26 -4.01 120.64 121.34 2kdo n GLU 200 Ca -0.11 -2.54 -0.03 0.00 -0.02 0.00 0.00 57.16 54.46 2kdo n GLU 200 Cb 0.52 -3.42 -0.03 0.00 -0.02 0.00 0.00 31.44 28.49 2kdo n GLU 200 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2kdo n SER 201 N 10.17 -0.35 -4.88 1.62 7.64 -1.26 -4.32 113.62 122.25 2kdo n SER 201 Ca 0.48 -1.71 -0.30 0.00 1.01 0.00 0.00 58.87 58.35 2kdo n SER 201 Cb 0.44 0.09 0.03 0.00 -1.01 0.00 0.00 64.21 63.76 2kdo n SER 201 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2kdo s GLU 202 N 0.00 3.17 -0.02 1.43 8.01 -1.26 -4.71 118.70 125.33 2kdo s GLU 202 Ca 0.05 0.56 0.02 0.00 0.01 0.00 0.00 54.97 55.60 2kdo s GLU 202 Cb 0.05 -2.06 -0.03 0.00 -4.31 0.00 0.00 34.13 27.78 2kdo s GLU 202 CO -0.02 -0.82 -0.03 0.34 0.01 0.00 0.00 175.26 174.74 2kdo s ASP 203 N -4.28 4.90 -0.23 -0.19 2.15 -0.30 -1.70 116.67 117.02 2kdo s ASP 203 Ca 0.57 -0.04 0.18 0.00 0.43 0.00 0.00 52.55 53.69 2kdo s ASP 203 Cb -0.11 -1.24 0.48 0.00 -0.30 0.00 0.00 42.92 41.75 2kdo s ASP 203 CO 0.52 0.31 1.15 0.00 -0.17 0.00 0.00 175.17 176.98 2kdo n TYR 204 N 1.66 1.43 0.00 -5.34 9.36 -1.26 -3.47 117.16 119.54 2kdo n TYR 204 Ca -0.16 -1.90 0.00 0.00 3.32 0.00 0.00 57.90 59.16 2kdo n TYR 204 Cb 0.53 -0.25 0.00 0.00 -0.63 0.00 0.00 39.34 38.98 2kdo n TYR 204 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2kdo n GLY 205 N -0.53 -0.08 0.06 2.98 0.00 -1.26 -4.92 105.19 101.44 2kdo n GLY 205 Ca 0.18 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.27 2kdo n GLY 205 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kdo n GLN 206 N 0.00 0.64 -4.19 1.61 6.02 -1.26 -4.96 117.38 115.25 2kdo n GLN 206 Ca 0.00 -0.02 -0.11 0.00 -0.01 0.00 0.00 57.00 56.86 2kdo n GLN 206 Cb 0.00 -1.65 -0.10 0.00 1.02 0.00 0.00 30.24 29.51 2kdo n GLN 206 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2kdo s GLN 207 N -3.24 0.89 -1.11 -1.09 -0.21 -1.26 -3.21 119.66 110.42 2kdo s GLN 207 Ca -0.05 -1.38 -0.09 0.00 0.02 0.00 0.00 55.36 53.86 2kdo s GLN 207 Cb 0.11 -0.23 0.28 0.00 1.00 0.00 0.00 33.01 34.17 2kdo s GLN 207 CO 0.85 -0.03 1.11 -0.51 -2.12 0.00 0.00 175.29 174.59 2kdo s LEU 208 N -3.07 6.33 -0.79 2.90 2.01 0.18 -4.03 118.68 122.22 2kdo s LEU 208 Ca 0.14 -3.61 -0.26 0.00 0.01 0.00 0.00 54.13 50.41 2kdo s LEU 208 Cb 0.05 -2.21 0.01 0.00 0.01 0.00 0.00 46.19 44.06 2kdo s LEU 208 CO -0.03 -0.28 1.52 -0.70 1.01 0.00 0.00 176.35 177.87 2kdo s GLU 209 N -1.29 3.08 -0.07 1.70 2.12 -1.23 -3.22 118.70 119.80 2kdo s GLU 209 Ca 0.31 -0.25 -0.11 0.00 0.36 0.00 0.00 54.97 55.29 2kdo s GLU 209 Cb -0.10 -4.58 -0.05 0.00 0.26 0.00 0.00 34.13 29.67 2kdo s GLU 209 CO -0.08 -2.43 0.26 0.42 -0.54 0.00 0.00 175.26 172.90 2kdo s ILE 210 N 6.79 5.29 -0.24 -3.70 -1.09 0.11 -1.15 121.20 127.21 2kdo s ILE 210 Ca 0.48 0.50 -0.03 0.00 -2.23 0.00 0.00 60.65 59.37 2kdo s ILE 210 Cb -0.07 -3.54 0.02 0.00 -1.58 0.00 0.00 42.46 37.28 2kdo s ILE 210 CO 0.09 0.59 -0.05 -0.69 -1.23 0.00 0.00 174.94 173.66 2kdo s VAL 211 N -0.98 3.09 -0.32 2.92 1.01 -1.26 -0.92 120.40 123.94 2kdo s VAL 211 Ca 0.19 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 2kdo s VAL 211 Cb -0.14 -2.52 0.12 0.00 0.00 0.00 0.00 36.38 33.83 2kdo s VAL 211 CO 0.08 0.26 0.16 0.00 0.00 0.00 0.00 175.10 175.60 2kdo s LEU 213 N 1.66 -0.64 0.00 0.00 1.98 -1.26 -4.70 118.68 115.73 2kdo s LEU 213 Ca 0.13 1.15 0.00 0.00 -2.89 0.00 0.00 54.13 52.51 2kdo s LEU 213 Cb -0.19 2.12 0.00 0.00 0.66 0.00 0.00 46.19 48.78 2kdo s LEU 213 CO -0.22 -0.19 0.00 0.00 -1.89 0.00 0.00 176.35 174.05 2kdo n ILE 214 N 2.96 0.00 -3.53 6.68 0.13 -1.26 -4.88 119.36 119.45 2kdo n ILE 214 Ca -0.15 0.00 -0.08 0.00 -1.10 0.00 0.00 62.75 61.42 2kdo n ILE 214 Cb 0.56 -0.52 -0.03 0.00 -0.84 0.00 0.00 39.64 38.82 2kdo n ILE 214 CO 0.00 0.00 0.00 1.51 2.80 0.00 0.00 176.55 180.86 2kdo s ASP 215 N -4.21 -0.32 0.43 9.51 1.47 -1.26 -4.99 116.67 117.30 2kdo s ASP 215 Ca 0.00 0.07 0.30 0.00 1.18 0.00 0.00 52.55 54.10 2kdo s ASP 215 Cb 0.00 0.33 1.52 0.00 -0.34 0.00 0.00 42.92 44.42 2kdo s ASP 215 CO 0.00 -0.50 1.90 1.55 0.68 0.00 0.00 175.17 178.80 2kdo h PRO 216 N 2.10 0.00 0.45 2.11 0.13 -1.82 -1.83 132.00 133.14 2kdo h PRO 216 Ca -0.19 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.92 2kdo h PRO 216 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2kdo h PRO 216 CO 0.29 0.00 -0.22 0.78 -0.23 0.00 0.00 178.00 178.63 2kdo h GLY 217 N 0.55 -0.64 1.87 1.56 0.00 -1.53 -3.28 103.07 101.61 2kdo h GLY 217 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.57 2kdo h GLY 217 CO 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 176.54 176.31 2kdo h PHE 219 N 0.00 0.00 0.06 0.00 3.57 -1.38 -2.80 116.94 116.38 2kdo h PHE 219 Ca 0.00 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 2kdo h PHE 219 Cb 0.41 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.15 2kdo h PHE 219 CO 0.00 0.01 -0.03 0.00 -2.23 0.00 0.00 178.31 176.06 2kdo h ARG 220 N 0.00 -0.08 0.00 1.11 2.47 -1.70 0.86 114.38 117.04 2kdo h ARG 220 Ca -0.00 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 2kdo h ARG 220 Cb 0.02 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.35 2kdo h ARG 220 CO 0.00 -0.03 0.00 0.39 0.56 0.00 0.00 179.97 180.89 2kdo n GLU 221 N -5.11 0.89 -0.10 0.04 4.71 -1.07 -3.03 120.64 116.97 2kdo n GLU 221 Ca -0.08 0.00 -0.17 0.00 -0.01 0.00 0.00 57.16 56.90 2kdo n GLU 221 Cb 0.07 -1.39 -0.06 0.00 -1.01 0.00 0.00 31.44 29.06 2kdo n GLU 221 CO 0.00 0.00 0.00 -0.89 0.09 0.00 0.00 177.13 176.33 2kdo n ILE 222 N -0.89 1.44 0.28 -3.67 2.08 -0.64 -4.52 119.36 113.45 2kdo n ILE 222 Ca 0.17 -0.08 0.13 0.00 0.56 0.00 0.00 62.75 63.53 2kdo n ILE 222 Cb 0.08 -2.08 0.84 0.00 -0.75 0.00 0.00 39.64 37.72 2kdo n ILE 222 CO 0.00 0.00 0.00 -0.78 0.56 0.00 0.00 176.55 176.33 2kdo h ASP 223 N -0.91 0.00 -0.03 4.38 3.58 -0.94 -1.52 116.42 120.98 2kdo h ASP 223 Ca -0.30 0.00 0.01 0.00 0.42 0.00 0.00 57.03 57.16 2kdo h ASP 223 Cb 1.21 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.26 2kdo h ASP 223 CO -0.18 0.02 0.03 1.05 -2.88 0.00 0.00 179.24 177.28 2kdo h GLU 224 N 0.00 0.00 0.00 0.28 4.11 -1.76 -1.66 114.58 115.55 2kdo h GLU 224 Ca -0.00 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.18 2kdo h GLU 224 Cb 0.06 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.26 2kdo h GLU 224 CO 0.00 0.00 -1.95 1.47 0.07 0.00 0.00 179.01 178.60 2kdo n LEU 225 N -3.99 1.20 -0.17 3.06 -0.00 -0.67 -4.51 117.00 111.92 2kdo n LEU 225 Ca -0.02 -0.04 0.11 0.00 -0.00 0.00 0.00 56.01 56.06 2kdo n LEU 225 Cb 0.12 -0.04 0.43 0.00 -0.00 0.00 0.00 43.42 43.93 2kdo n LEU 225 CO 0.29 0.52 1.21 0.40 -0.00 0.00 0.00 177.39 179.80 2kdo h ILE 226 N 0.00 0.90 -0.91 1.47 1.08 -1.05 -0.04 117.51 118.96 2kdo h ILE 226 Ca -0.38 -0.20 0.16 0.00 -0.39 0.00 0.00 64.86 64.06 2kdo h ILE 226 Cb 1.74 0.27 -0.07 0.00 -3.07 0.00 0.00 36.82 35.69 2kdo h ILE 226 CO -0.01 0.10 0.59 0.07 -0.69 0.00 0.00 178.15 178.21 2kdo h LYS 227 N 0.57 0.64 0.00 2.37 2.10 -1.54 0.48 116.57 121.19 2kdo h LYS 227 Ca 0.34 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.96 2kdo h LYS 227 Cb 0.56 -0.14 0.00 0.00 -0.90 0.00 0.00 32.23 31.75 2kdo h LYS 227 CO -0.12 0.42 -1.69 0.36 -2.00 0.00 0.00 179.45 176.42 2kdo n LYS 228 N -4.58 0.52 0.05 0.07 2.85 -0.65 -0.80 118.16 115.61 2kdo n LYS 228 Ca 0.19 -0.14 -0.20 0.00 -1.05 0.00 0.00 58.31 57.10 2kdo n LYS 228 Cb 0.52 -1.37 -0.11 0.00 -0.65 0.00 0.00 35.03 33.42 2kdo n LYS 228 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 2kdo h GLU 229 N 0.00 0.61 0.00 -1.58 4.39 -0.68 -3.43 114.58 113.89 2kdo h GLU 229 Ca 0.00 -0.71 0.00 0.00 0.34 0.00 0.00 59.36 58.99 2kdo h GLU 229 Cb 0.71 0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.57 2kdo h GLU 229 CO 0.00 1.29 0.00 -2.37 -1.16 0.00 0.00 179.01 176.77 2kdo n THR 230 N -3.93 0.00 -0.09 1.13 5.66 -0.56 -4.61 114.28 111.89 2kdo n THR 230 Ca -0.12 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 60.81 2kdo n THR 230 Cb 0.86 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.65 2kdo n THR 230 CO 0.00 0.00 0.00 0.50 -3.05 0.00 0.00 175.07 172.52 2kdo h LYS 231 N 0.00 0.29 -0.37 1.09 3.64 -1.06 0.34 116.57 120.50 2kdo h LYS 231 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2kdo h LYS 231 Cb 0.00 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 2kdo h LYS 231 CO 0.00 0.19 0.00 0.41 -2.27 0.00 0.00 179.45 177.78 2kdo n GLY 232 N -1.20 0.69 0.68 5.01 0.00 0.02 -4.24 105.19 106.15 2kdo n GLY 232 Ca 0.00 -0.37 -0.04 0.00 0.00 0.00 0.00 46.02 45.62 2kdo n GLY 232 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kdo n LYS 233 N 0.47 0.20 0.00 1.61 4.76 -0.45 -5.04 118.16 119.72 2kdo n LYS 233 Ca 0.11 0.08 0.00 0.00 -2.87 0.00 0.00 58.31 55.63 2kdo n LYS 233 Cb 0.31 -0.86 0.00 0.00 -1.84 0.00 0.00 35.03 32.65 2kdo n LYS 233 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2kdo n GLY 234 N 2.71 0.83 3.08 0.72 0.00 0.11 -5.00 105.19 107.64 2kdo n GLY 234 Ca -0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 2kdo n GLY 234 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kdo s SER 235 N -0.35 0.09 -0.02 1.61 0.01 -0.31 -4.90 113.70 109.82 2kdo s SER 235 Ca 0.00 -0.31 0.02 0.00 1.31 0.00 0.00 55.95 56.97 2kdo s SER 235 Cb 0.00 0.19 -0.03 0.00 0.21 0.00 0.00 66.02 66.38 2kdo s SER 235 CO 0.00 -0.38 -0.05 -1.48 0.41 0.00 0.00 173.24 171.74 2kdo s LEU 236 N -1.51 3.27 0.00 2.44 2.34 -1.26 -0.75 118.68 123.21 2kdo s LEU 236 Ca -0.14 -0.06 0.01 0.00 0.06 0.00 0.00 54.13 54.00 2kdo s LEU 236 Cb -0.07 -1.83 -0.00 0.00 -0.56 0.00 0.00 46.19 43.73 2kdo s LEU 236 CO 0.00 0.31 0.15 -0.62 -1.06 0.00 0.00 176.35 175.13 2kdo n GLU 237 N 1.73 0.21 -4.38 1.48 -0.58 0.54 -4.99 120.64 114.64 2kdo n GLU 237 Ca -0.16 -1.21 -0.25 0.00 -0.42 0.00 0.00 57.16 55.12 2kdo n GLU 237 Cb 0.53 1.06 -0.12 0.00 -0.57 0.00 0.00 31.44 32.34 2kdo n GLU 237 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2kdo s VAL 238 N -2.55 2.13 -0.62 2.62 -7.23 -1.26 -1.85 120.40 111.65 2kdo s VAL 238 Ca 0.14 -1.94 -0.12 0.00 -1.81 0.00 0.00 61.98 58.24 2kdo s VAL 238 Cb 0.00 -1.99 0.16 0.00 0.56 0.00 0.00 36.38 35.11 2kdo s VAL 238 CO 0.10 -0.16 0.54 -0.22 -0.31 0.00 0.00 175.10 175.05 2kdo s LEU 239 N -2.57 6.16 0.45 1.32 0.20 0.59 -4.77 118.68 120.07 2kdo s LEU 239 Ca 0.18 -2.19 0.25 0.00 0.69 0.00 0.00 54.13 53.05 2kdo s LEU 239 Cb -0.08 -2.13 0.96 0.00 -0.43 0.00 0.00 46.19 44.52 2kdo s LEU 239 CO 0.08 -0.69 1.84 -0.55 -0.29 0.00 0.00 176.35 176.75 2kdo h ASN 240 N 8.27 0.00 -3.22 3.68 -1.07 -1.99 -3.40 115.58 117.86 2kdo h ASN 240 Ca -0.13 0.00 -0.57 0.00 0.07 0.00 0.00 56.30 55.67 2kdo h ASN 240 Cb 1.06 0.00 -0.05 0.00 -2.07 0.00 0.00 38.32 37.26 2kdo h ASN 240 CO 0.88 0.20 0.94 -0.22 0.07 0.00 0.00 177.43 179.30 2kdo s LEU 241 N -6.72 3.87 -0.07 6.14 2.96 -1.26 -4.84 118.68 118.77 2kdo s LEU 241 Ca 0.01 1.12 0.13 0.00 -0.22 0.00 0.00 54.13 55.17 2kdo s LEU 241 Cb 0.10 -3.54 0.26 0.00 0.50 0.00 0.00 46.19 43.51 2kdo s LEU 241 CO 0.63 -1.05 1.12 0.29 -1.32 0.00 0.00 176.35 176.01 2kdo n LYS 242 N 7.27 0.56 0.00 1.98 5.02 -1.26 -4.88 118.16 126.84 2kdo n LYS 242 Ca 0.14 -2.04 0.00 0.00 -2.02 0.00 0.00 58.31 54.39 2kdo n LYS 242 Cb 0.47 -0.77 0.00 0.00 -0.02 0.00 0.00 35.03 34.71 2kdo n LYS 242 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2kdo n ASP 243 N -0.36 0.00 -4.85 4.39 9.92 -1.26 -5.05 116.55 119.34 2kdo n ASP 243 Ca 0.09 0.00 -0.31 0.00 -0.53 0.00 0.00 54.79 54.03 2kdo n ASP 243 Cb 0.82 -0.22 -0.05 0.00 -0.64 0.00 0.00 41.12 41.02 2kdo n ASP 243 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2kdo s VAL 244 N -0.99 5.01 -0.14 2.53 0.11 -1.26 -5.10 120.40 120.56 2kdo s VAL 244 Ca 0.00 -0.50 0.01 0.00 -2.93 0.00 0.00 61.98 58.56 2kdo s VAL 244 Cb 0.00 -3.41 0.02 0.00 -1.53 0.00 0.00 36.38 31.46 2kdo s VAL 244 CO 0.00 0.18 -0.15 -1.83 -3.33 0.00 0.00 175.10 169.97 2kdo s GLU 245 N -2.32 2.33 0.45 1.54 1.03 -1.26 -5.01 118.70 115.45 2kdo s GLU 245 Ca 0.31 -0.58 0.03 0.00 0.03 0.00 0.00 54.97 54.76 2kdo s GLU 245 Cb -0.13 -2.07 -0.02 0.00 -0.80 0.00 0.00 34.13 31.12 2kdo s GLU 245 CO 0.23 -0.18 0.09 -1.21 -1.33 0.00 0.00 175.26 172.87 2kdo s GLU 246 N 1.31 2.03 0.00 -4.83 2.02 -1.26 -5.08 118.70 112.88 2kdo s GLU 246 Ca 0.01 -2.26 0.00 0.00 0.02 0.00 0.00 54.97 52.74 2kdo s GLU 246 Cb -0.14 -0.90 0.00 0.00 0.10 0.00 0.00 34.13 33.20 2kdo s GLU 246 CO -0.08 -0.45 0.00 0.41 0.02 0.00 0.00 175.26 175.16 2kdo n GLY 247 N -1.04 4.08 0.57 -1.39 0.00 -1.26 -4.01 105.19 102.15 2kdo n GLY 247 Ca -0.10 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.72 2kdo n GLY 247 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2kdo n ASP 248 N -0.43 1.08 -0.00 1.61 5.75 -0.69 -3.63 116.55 120.24 2kdo n ASP 248 Ca 0.00 -1.69 0.14 0.00 -0.01 0.00 0.00 54.79 53.24 2kdo n ASP 248 Cb 0.00 -0.42 0.67 0.00 -1.03 0.00 0.00 41.12 40.33 2kdo n ASP 248 CO 0.00 0.00 0.00 -1.84 -0.11 0.00 0.00 177.20 175.25 2kdo n GLU 249 N 0.15 0.14 -2.36 0.11 0.28 -1.26 -4.21 120.64 113.48 2kdo n GLU 249 Ca 0.00 -0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.58 2kdo n GLU 249 Cb 0.24 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.61 2kdo n GLU 249 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 2kdo n LYS 250 N -1.43 3.81 -0.06 3.44 0.00 -1.24 -4.69 118.16 117.99 2kdo n LYS 250 Ca 0.09 -3.62 -0.14 0.00 0.00 0.00 0.00 58.31 54.64 2kdo n LYS 250 Cb 0.31 -2.85 -0.06 0.00 0.00 0.00 0.00 35.03 32.42 2kdo n LYS 250 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.40 178.14 2kdo h PHE 251 N 5.58 0.69 -0.01 5.64 0.04 -1.93 -3.51 116.94 123.44 2kdo h PHE 251 Ca 0.41 -0.24 0.00 0.00 2.80 0.00 0.00 57.97 60.93 2kdo h PHE 251 Cb 0.59 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.61 2kdo h PHE 251 CO 1.27 0.97 0.00 -0.85 -0.60 0.00 0.00 178.31 179.10