#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kl0 s LEU 2 N 0.00 4.50 0.12 4.03 1.43 -1.26 -4.40 118.68 123.10 2kl0 s LEU 2 Ca 0.00 1.70 0.05 0.00 -1.03 0.00 0.00 54.13 54.85 2kl0 s LEU 2 Cb 0.00 -3.56 -0.04 0.00 0.03 0.00 0.00 46.19 42.62 2kl0 s LEU 2 CO 0.00 0.11 -0.12 0.68 0.23 0.00 0.00 176.35 177.24 2kl0 s VAL 3 N -1.33 1.20 -0.38 -1.59 -7.23 -0.98 -1.55 120.40 108.55 2kl0 s VAL 3 Ca 0.41 -1.75 -0.13 0.00 -1.81 0.00 0.00 61.98 58.70 2kl0 s VAL 3 Cb -0.21 -1.53 0.02 0.00 0.56 0.00 0.00 36.38 35.21 2kl0 s VAL 3 CO 0.26 -0.51 0.24 -0.89 -0.31 0.00 0.00 175.10 173.89 2kl0 s THR 4 N -2.41 4.95 -0.26 5.32 2.01 -1.23 -1.13 115.64 122.88 2kl0 s THR 4 Ca 0.09 -0.65 -0.06 0.00 0.31 0.00 0.00 61.69 61.38 2kl0 s THR 4 Cb -0.03 -3.71 -0.00 0.00 0.01 0.00 0.00 72.50 68.77 2kl0 s THR 4 CO 0.02 -0.21 0.04 -0.63 -0.69 0.00 0.00 174.62 173.15 2kl0 s ILE 5 N 1.63 3.85 -1.46 1.82 1.01 0.25 0.11 121.20 128.41 2kl0 s ILE 5 Ca 0.04 -0.53 -0.10 0.00 0.00 0.00 0.00 60.65 60.06 2kl0 s ILE 5 Cb -0.19 -2.88 0.05 0.00 0.01 0.00 0.00 42.46 39.45 2kl0 s ILE 5 CO 0.08 0.24 0.85 -3.20 0.00 0.00 0.00 174.94 172.91 2kl0 n ASN 6 N 4.85 -5.21 -0.03 3.58 2.85 -0.28 -0.12 115.26 120.91 2kl0 n ASN 6 Ca -0.16 -0.55 -0.00 0.00 -0.11 0.00 0.00 54.58 53.75 2kl0 n ASN 6 Cb 0.49 -4.18 -0.00 0.00 1.24 0.00 0.00 39.78 37.33 2kl0 n ASN 6 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2kl0 n GLY 7 N -1.62 0.44 3.18 8.20 0.00 -1.26 -4.98 105.19 109.15 2kl0 n GLY 7 Ca -0.01 -0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 2kl0 n GLY 7 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kl0 s GLU 8 N -0.57 2.79 0.04 1.61 2.56 0.83 -5.09 118.70 120.87 2kl0 s GLU 8 Ca 0.00 -0.79 -0.30 0.00 0.00 0.00 0.00 54.97 53.88 2kl0 s GLU 8 Cb 0.00 -2.14 -0.05 0.00 2.00 0.00 0.00 34.13 33.94 2kl0 s GLU 8 CO 0.00 0.14 1.11 -0.65 -0.56 0.00 0.00 175.26 175.30 2kl0 s GLN 9 N 0.44 4.48 -0.02 4.30 1.11 -1.26 0.84 119.66 129.55 2kl0 s GLN 9 Ca -0.17 1.63 -0.19 0.00 0.01 0.00 0.00 55.36 56.64 2kl0 s GLN 9 Cb -0.17 -3.39 0.04 0.00 -1.01 0.00 0.00 33.01 28.47 2kl0 s GLN 9 CO 0.07 -0.18 0.41 0.50 0.01 0.00 0.00 175.29 176.10 2kl0 s ARG 10 N 1.03 0.78 -0.07 2.91 3.52 -0.28 -4.92 118.95 121.92 2kl0 s ARG 10 Ca 0.56 -0.09 -0.12 0.00 -0.13 0.00 0.00 55.73 55.95 2kl0 s ARG 10 Cb -0.26 0.35 -0.05 0.00 -1.56 0.00 0.00 34.95 33.43 2kl0 s ARG 10 CO 0.29 -0.23 0.29 -2.00 -0.81 0.00 0.00 175.30 172.84 2kl0 s GLU 11 N -1.37 3.82 0.17 5.12 2.12 -1.26 -2.31 118.70 124.98 2kl0 s GLU 11 Ca -0.12 0.17 0.03 0.00 0.36 0.00 0.00 54.97 55.40 2kl0 s GLU 11 Cb -0.04 -3.25 -0.05 0.00 0.26 0.00 0.00 34.13 31.06 2kl0 s GLU 11 CO 0.05 0.64 -0.04 0.14 -0.54 0.00 0.00 175.26 175.51 2kl0 s VAL 12 N -0.77 0.94 0.00 3.70 -7.23 -1.26 -5.04 120.40 110.74 2kl0 s VAL 12 Ca 0.19 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.35 2kl0 s VAL 12 Cb -0.14 -2.03 0.00 0.00 0.56 0.00 0.00 36.38 34.77 2kl0 s VAL 12 CO 0.08 -0.58 0.41 0.00 -0.31 0.00 0.00 175.10 174.70 2kl0 n GLN 13 N -0.25 0.27 -2.15 4.82 6.02 -1.26 -5.06 117.38 119.77 2kl0 n GLN 13 Ca -0.08 -0.46 -0.36 0.00 -0.01 0.00 0.00 57.00 56.09 2kl0 n GLN 13 Cb 0.62 -0.58 0.01 0.00 1.02 0.00 0.00 30.24 31.31 2kl0 n GLN 13 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2kl0 s SER 14 N -0.11 5.59 0.00 1.08 0.01 -1.26 -4.93 113.70 114.08 2kl0 s SER 14 Ca 0.00 2.30 0.24 0.00 1.31 0.00 0.00 55.95 59.80 2kl0 s SER 14 Cb 0.00 -2.59 0.34 0.00 0.21 0.00 0.00 66.02 63.97 2kl0 s SER 14 CO 0.00 -1.32 1.32 0.00 0.41 0.00 0.00 173.24 173.65 2kl0 n ALA 15 N -1.26 2.97 -2.93 1.44 0.00 -1.26 -4.63 120.51 114.84 2kl0 n ALA 15 Ca 0.12 -0.59 -0.10 0.00 0.00 0.00 0.00 53.44 52.86 2kl0 n ALA 15 Cb 0.50 -0.91 -0.05 0.00 0.00 0.00 0.00 19.45 18.99 2kl0 n ALA 15 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2kl0 s SER 16 N -2.25 -0.16 0.13 0.00 1.04 -1.26 -3.12 113.70 108.08 2kl0 s SER 16 Ca 0.25 -0.41 -0.14 0.00 0.48 0.00 0.00 55.95 56.13 2kl0 s SER 16 Cb 0.19 0.46 -0.02 0.00 0.10 0.00 0.00 66.02 66.76 2kl0 s SER 16 CO 0.44 -0.85 1.58 0.58 0.98 0.00 0.00 173.24 175.97 2kl0 h VAL 17 N 2.43 1.26 -0.83 5.02 2.07 -1.50 -0.91 116.25 123.79 2kl0 h VAL 17 Ca -0.33 -1.01 0.01 0.00 0.82 0.00 0.00 66.70 66.19 2kl0 h VAL 17 Cb 1.25 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 32.07 2kl0 h VAL 17 CO 0.48 0.34 0.55 0.00 0.02 0.00 0.00 177.57 178.96 2kl0 h ALA 18 N 0.89 1.05 -0.50 1.67 0.00 -1.88 -0.48 119.26 120.02 2kl0 h ALA 18 Ca 0.12 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 2kl0 h ALA 18 Cb 0.47 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2kl0 h ALA 18 CO 0.02 0.46 -0.13 0.00 0.00 0.00 0.00 179.25 179.60 2kl0 h ALA 19 N 1.31 0.83 -0.40 0.00 0.00 -1.84 -1.41 119.26 117.75 2kl0 h ALA 19 Ca 0.30 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2kl0 h ALA 19 Cb -0.13 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 2kl0 h ALA 19 CO -0.07 0.65 0.15 1.25 0.00 0.00 0.00 179.25 181.23 2kl0 h LEU 20 N 0.83 0.56 -0.93 0.00 5.85 -0.42 -2.38 115.31 118.82 2kl0 h LEU 20 Ca 0.13 -0.18 -0.09 0.00 0.84 0.00 0.00 57.88 58.58 2kl0 h LEU 20 Cb 0.68 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 2kl0 h LEU 20 CO 0.05 0.59 -0.16 0.24 -0.34 0.00 0.00 178.44 178.82 2kl0 h MET 21 N 0.49 0.61 -0.62 1.25 2.86 -0.99 -2.85 114.93 115.68 2kl0 h MET 21 Ca 0.13 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 2kl0 h MET 21 Cb 0.21 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.79 2kl0 h MET 21 CO -0.01 0.74 0.35 1.15 1.06 0.00 0.00 176.91 180.20 2kl0 h THR 22 N 0.55 1.19 -0.85 2.22 2.02 -0.93 0.84 112.91 117.95 2kl0 h THR 22 Ca 0.09 -0.47 -0.02 0.00 0.77 0.00 0.00 66.41 66.78 2kl0 h THR 22 Cb 0.58 0.38 -0.04 0.00 -1.74 0.00 0.00 68.15 67.34 2kl0 h THR 22 CO 0.04 0.21 0.44 -0.33 0.37 0.00 0.00 175.52 176.24 2kl0 h GLU 23 N 0.84 1.21 -0.02 6.66 4.39 -1.22 -0.74 114.58 125.69 2kl0 h GLU 23 Ca 0.22 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.76 2kl0 h GLU 23 Cb 0.02 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.45 2kl0 h GLU 23 CO -0.04 0.90 0.00 1.28 -1.16 0.00 0.00 179.01 180.00 2kl0 n LEU 24 N -4.32 1.36 -2.52 1.33 4.32 -0.91 -4.90 117.00 111.36 2kl0 n LEU 24 Ca 0.09 -0.46 -0.21 0.00 -0.02 0.00 0.00 56.01 55.40 2kl0 n LEU 24 Cb 0.12 -0.01 -0.00 0.00 -1.62 0.00 0.00 43.42 41.91 2kl0 n LEU 24 CO 0.39 0.23 -0.22 -0.67 -1.22 0.00 0.00 177.39 175.91 2kl0 n ASP 25 N 0.07 -5.94 -0.06 -1.43 -0.08 0.24 -4.84 116.55 104.51 2kl0 n ASP 25 Ca 0.19 -0.06 0.13 0.00 -1.51 0.00 0.00 54.79 53.54 2kl0 n ASP 25 Cb 0.33 -4.92 0.38 0.00 2.34 0.00 0.00 41.12 39.25 2kl0 n ASP 25 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2kl0 s THR 27 N -2.83 2.38 0.00 0.00 2.01 -1.22 -4.75 115.64 111.23 2kl0 s THR 27 Ca 0.16 0.32 0.00 0.00 0.31 0.00 0.00 61.69 62.48 2kl0 s THR 27 Cb 0.18 -3.20 0.00 0.00 0.01 0.00 0.00 72.50 69.49 2kl0 s THR 27 CO 0.61 0.05 0.00 0.61 -0.69 0.00 0.00 174.62 175.20 2kl0 n GLY 28 N 2.18 0.02 1.25 4.40 0.00 -1.26 -5.01 105.19 106.76 2kl0 n GLY 28 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2kl0 n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kl0 n GLY 29 N -0.51 3.19 0.10 -0.02 0.00 -1.26 -4.79 105.19 101.90 2kl0 n GLY 29 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2kl0 n GLY 29 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2kl0 n HIS 30 N -1.37 0.00 -3.77 1.61 8.25 -1.26 -4.89 115.22 113.79 2kl0 n HIS 30 Ca 0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.14 2kl0 n HIS 30 Cb 0.00 -0.16 -0.04 0.00 1.12 0.00 0.00 29.99 30.90 2kl0 n HIS 30 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2kl0 s PHE 31 N -2.83 3.50 0.21 4.41 0.08 -1.26 -5.03 117.98 117.06 2kl0 s PHE 31 Ca 0.15 0.45 0.09 0.00 0.12 0.00 0.00 56.93 57.74 2kl0 s PHE 31 Cb 0.18 -1.92 -0.04 0.00 -0.57 0.00 0.00 43.02 40.67 2kl0 s PHE 31 CO 0.67 0.51 -0.07 0.00 -0.10 0.00 0.00 175.22 176.22 2kl0 s ALA 32 N -1.57 3.00 0.16 5.36 0.00 -1.26 -4.94 121.76 122.52 2kl0 s ALA 32 Ca 0.37 -1.55 0.04 0.00 0.00 0.00 0.00 51.96 50.83 2kl0 s ALA 32 Cb -0.13 -0.72 -0.05 0.00 0.00 0.00 0.00 23.12 22.23 2kl0 s ALA 32 CO 0.25 0.39 -0.09 0.14 0.00 0.00 0.00 175.76 176.45 2kl0 s VAL 33 N -1.94 1.17 -0.02 0.00 -7.23 -1.26 -2.30 120.40 108.82 2kl0 s VAL 33 Ca 0.27 -2.06 0.01 0.00 -1.81 0.00 0.00 61.98 58.39 2kl0 s VAL 33 Cb -0.08 -1.93 0.01 0.00 0.56 0.00 0.00 36.38 34.94 2kl0 s VAL 33 CO 0.17 -0.68 -0.03 0.00 -0.31 0.00 0.00 175.10 174.25 2kl0 s ALA 34 N -3.33 0.35 -0.15 1.32 0.00 0.14 -2.00 121.76 118.09 2kl0 s ALA 34 Ca 0.19 -0.03 0.01 0.00 0.00 0.00 0.00 51.96 52.12 2kl0 s ALA 34 Cb 0.03 -0.20 0.02 0.00 0.00 0.00 0.00 23.12 22.97 2kl0 s ALA 34 CO 0.02 0.02 -0.16 -1.17 0.00 0.00 0.00 175.76 174.47 2kl0 s LEU 35 N 0.40 1.81 -1.35 0.00 2.96 0.71 -1.89 118.68 121.32 2kl0 s LEU 35 Ca -0.04 -0.53 -0.01 0.00 -0.22 0.00 0.00 54.13 53.33 2kl0 s LEU 35 Cb -0.07 -1.26 0.01 0.00 0.50 0.00 0.00 46.19 45.37 2kl0 s LEU 35 CO -0.01 -0.04 0.64 0.59 -1.32 0.00 0.00 176.35 176.22 2kl0 n ASN 36 N 4.70 -1.16 -3.47 3.68 3.02 -0.41 -1.69 115.26 119.92 2kl0 n ASN 36 Ca -0.18 -0.87 -0.18 0.00 -0.03 0.00 0.00 54.58 53.32 2kl0 n ASN 36 Cb 0.50 -3.78 0.08 0.00 -0.61 0.00 0.00 39.78 35.98 2kl0 n ASN 36 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2kl0 n TYR 37 N -4.33 -2.16 -3.55 3.10 4.01 -1.26 -5.00 117.16 107.96 2kl0 n TYR 37 Ca -0.28 0.93 -0.09 0.00 -0.16 0.00 0.00 57.90 58.29 2kl0 n TYR 37 Cb 0.67 -4.98 -0.09 0.00 -0.31 0.00 0.00 39.34 34.62 2kl0 n TYR 37 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2kl0 s ASP 38 N -4.34 -0.00 0.17 7.72 2.15 -0.68 -5.13 116.67 116.55 2kl0 s ASP 38 Ca 0.01 0.68 -0.30 0.00 0.43 0.00 0.00 52.55 53.36 2kl0 s ASP 38 Cb -0.01 1.19 -0.09 0.00 -0.30 0.00 0.00 42.92 43.72 2kl0 s ASP 38 CO 0.74 -0.26 1.35 -0.69 -0.17 0.00 0.00 175.17 176.15 2kl0 s VAL 39 N 2.57 3.21 -0.14 1.11 1.01 -1.26 -0.21 120.40 126.68 2kl0 s VAL 39 Ca 0.04 0.94 -0.02 0.00 0.00 0.00 0.00 61.98 62.93 2kl0 s VAL 39 Cb -0.13 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 2kl0 s VAL 39 CO -0.13 0.12 -0.05 -0.69 0.00 0.00 0.00 175.10 174.34 2kl0 s VAL 40 N 0.48 3.75 0.45 2.92 1.01 -0.84 -4.92 120.40 123.25 2kl0 s VAL 40 Ca 0.60 -0.42 -0.23 0.00 0.00 0.00 0.00 61.98 61.93 2kl0 s VAL 40 Cb -0.37 -2.62 -0.08 0.00 0.00 0.00 0.00 36.38 33.31 2kl0 s VAL 40 CO 0.35 0.52 1.10 -2.16 0.00 0.00 0.00 175.10 174.92 2kl0 s PRO 41 N 0.15 3.87 0.00 2.72 0.04 -1.26 -4.38 135.00 136.14 2kl0 s PRO 41 Ca -0.02 1.61 0.00 0.00 0.04 0.00 0.00 61.00 62.63 2kl0 s PRO 41 Cb -0.14 -2.37 0.00 0.00 0.04 0.00 0.00 34.50 32.03 2kl0 s PRO 41 CO 0.03 -0.42 0.69 2.89 0.04 0.00 0.00 177.00 180.23 2kl0 n ARG 42 N -0.49 0.00 0.01 4.56 0.00 -1.26 -0.19 116.66 119.29 2kl0 n ARG 42 Ca 0.07 0.21 0.11 0.00 -0.00 0.00 0.00 57.85 58.24 2kl0 n ARG 42 Cb 0.49 -1.51 0.10 0.00 -0.00 0.00 0.00 32.46 31.54 2kl0 n ARG 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2kl0 n GLY 43 N -1.19 -1.18 0.03 2.89 0.00 -1.26 -4.05 105.19 100.42 2kl0 n GLY 43 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.59 2kl0 n GLY 43 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kl0 n LYS 44 N -1.61 2.18 -0.09 1.61 5.02 0.74 -4.70 118.16 121.30 2kl0 n LYS 44 Ca 0.04 -1.32 -0.09 0.00 -2.02 0.00 0.00 58.31 54.93 2kl0 n LYS 44 Cb 0.36 -1.01 -0.01 0.00 -0.02 0.00 0.00 35.03 34.34 2kl0 n LYS 44 CO 0.00 0.00 0.00 -1.49 -0.52 0.00 0.00 177.40 175.39 2kl0 h TRP 45 N 0.09 0.39 -0.05 2.13 4.06 -1.66 -0.13 115.95 120.78 2kl0 h TRP 45 Ca 0.00 0.01 -0.16 0.00 2.06 0.00 0.00 58.89 60.80 2kl0 h TRP 45 Cb 0.41 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 28.42 2kl0 h TRP 45 CO 0.01 0.25 -0.67 0.38 -3.56 0.00 0.00 178.44 174.85 2kl0 h ASP 46 N 0.43 0.24 -0.26 -3.49 2.03 -1.86 -2.90 116.42 110.61 2kl0 h ASP 46 Ca 0.11 -0.15 0.00 0.00 -0.73 0.00 0.00 57.03 56.26 2kl0 h ASP 46 Cb -0.05 -0.07 0.00 0.00 -0.83 0.00 0.00 39.33 38.38 2kl0 h ASP 46 CO -0.02 0.84 0.00 -0.62 -1.03 0.00 0.00 179.24 178.41 2kl0 n GLU 47 N -3.81 1.95 -3.90 4.15 1.02 -0.94 -4.59 120.64 114.51 2kl0 n GLU 47 Ca -0.03 -1.08 -0.32 0.00 -0.02 0.00 0.00 57.16 55.72 2kl0 n GLU 47 Cb 0.66 -1.42 -0.13 0.00 -0.02 0.00 0.00 31.44 30.53 2kl0 n GLU 47 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2kl0 s THR 48 N -1.64 2.82 0.59 2.62 2.01 -0.10 -5.04 115.64 116.90 2kl0 s THR 48 Ca 0.20 -3.14 -0.19 0.00 0.31 0.00 0.00 61.69 58.86 2kl0 s THR 48 Cb 0.12 -2.93 -0.05 0.00 0.01 0.00 0.00 72.50 69.65 2kl0 s THR 48 CO 0.10 -0.80 1.02 -2.65 -0.69 0.00 0.00 174.62 171.61 2kl0 n PRO 49 N 3.31 1.01 -3.35 4.92 -0.02 -1.26 -3.22 135.00 136.39 2kl0 n PRO 49 Ca 0.05 0.39 -0.38 0.00 -2.02 0.00 0.00 63.50 61.54 2kl0 n PRO 49 Cb 0.34 -2.22 -0.06 0.00 -0.02 0.00 0.00 33.50 31.55 2kl0 n PRO 49 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2kl0 s VAL 50 N -1.47 5.16 -0.12 -1.45 1.01 -1.18 -4.84 120.40 117.50 2kl0 s VAL 50 Ca 0.75 0.92 0.01 0.00 0.00 0.00 0.00 61.98 63.67 2kl0 s VAL 50 Cb -0.42 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.15 2kl0 s VAL 50 CO 0.47 0.37 -0.17 -0.89 0.00 0.00 0.00 175.10 174.89 2kl0 s THR 51 N 0.32 2.69 0.26 3.92 2.01 -1.26 -4.93 115.64 118.64 2kl0 s THR 51 Ca 0.25 -0.79 -0.30 0.00 0.31 0.00 0.00 61.69 61.16 2kl0 s THR 51 Cb -0.15 -2.10 -0.10 0.00 0.01 0.00 0.00 72.50 70.16 2kl0 s THR 51 CO 0.11 0.54 1.35 0.00 -0.69 0.00 0.00 174.62 175.93 2kl0 s ALA 52 N 0.33 3.55 0.00 7.40 0.00 -1.26 -2.39 121.76 129.39 2kl0 s ALA 52 Ca -0.14 1.23 0.00 0.00 0.00 0.00 0.00 51.96 53.05 2kl0 s ALA 52 Cb -0.17 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.45 2kl0 s ALA 52 CO 0.07 -0.64 0.00 0.41 0.00 0.00 0.00 175.76 175.60 2kl0 n GLY 53 N 1.85 3.32 3.77 0.00 0.00 -0.59 -4.57 105.19 108.97 2kl0 n GLY 53 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 2kl0 n GLY 53 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2kl0 s ASP 54 N -0.57 6.39 -0.12 1.61 -1.08 -1.01 -4.75 116.67 117.15 2kl0 s ASP 54 Ca 0.00 2.76 -0.28 0.00 -0.52 0.00 0.00 52.55 54.51 2kl0 s ASP 54 Cb 0.00 -2.65 -0.01 0.00 -1.46 0.00 0.00 42.92 38.80 2kl0 s ASP 54 CO 0.00 -0.81 0.95 -1.61 0.52 0.00 0.00 175.17 174.22 2kl0 s GLU 55 N -2.12 4.40 -0.06 4.34 2.02 -1.26 -3.57 118.70 122.44 2kl0 s GLU 55 Ca 0.55 1.27 0.05 0.00 0.02 0.00 0.00 54.97 56.85 2kl0 s GLU 55 Cb -0.40 -3.54 -0.00 0.00 0.10 0.00 0.00 34.13 30.28 2kl0 s GLU 55 CO 0.53 -0.29 -0.20 0.42 0.02 0.00 0.00 175.26 175.74 2kl0 s ILE 56 N 1.95 1.68 -0.04 -1.63 1.01 0.12 -1.28 121.20 123.01 2kl0 s ILE 56 Ca 0.45 -0.84 0.01 0.00 0.00 0.00 0.00 60.65 60.27 2kl0 s ILE 56 Cb -0.18 -1.44 0.02 0.00 0.01 0.00 0.00 42.46 40.87 2kl0 s ILE 56 CO 0.17 0.48 -0.05 -1.61 0.00 0.00 0.00 174.94 173.92 2kl0 s GLU 57 N 0.08 0.77 -0.17 2.79 2.02 -0.79 -1.12 118.70 122.28 2kl0 s GLU 57 Ca -0.07 -0.13 -0.06 0.00 0.02 0.00 0.00 54.97 54.73 2kl0 s GLU 57 Cb -0.14 -0.77 -0.03 0.00 0.10 0.00 0.00 34.13 33.29 2kl0 s GLU 57 CO 0.04 -0.03 0.02 0.42 0.02 0.00 0.00 175.26 175.72 2kl0 s ILE 58 N 0.68 4.38 -0.07 -1.63 1.01 -1.26 -0.69 121.20 123.63 2kl0 s ILE 58 Ca -0.09 -0.18 -0.21 0.00 0.00 0.00 0.00 60.65 60.17 2kl0 s ILE 58 Cb -0.12 -2.95 -0.04 0.00 0.01 0.00 0.00 42.46 39.35 2kl0 s ILE 58 CO 0.00 0.48 0.60 -0.76 0.00 0.00 0.00 174.94 175.26 2kl0 s LEU 59 N 0.35 4.33 0.17 2.97 2.01 -0.97 -4.91 118.68 122.62 2kl0 s LEU 59 Ca -0.00 1.06 0.09 0.00 0.01 0.00 0.00 54.13 55.28 2kl0 s LEU 59 Cb -0.13 -2.91 -0.04 0.00 0.01 0.00 0.00 46.19 43.12 2kl0 s LEU 59 CO 0.01 -0.02 -0.12 0.42 1.01 0.00 0.00 176.35 177.66 2kl0 s THR 60 N 0.48 3.09 0.01 5.49 -4.23 -1.26 -4.05 115.64 115.17 2kl0 s THR 60 Ca 0.32 -1.63 -0.40 0.00 -1.18 0.00 0.00 61.69 58.80 2kl0 s THR 60 Cb -0.17 -2.51 -0.20 0.00 1.34 0.00 0.00 72.50 70.97 2kl0 s THR 60 CO 0.15 -0.06 1.06 -2.65 -0.54 0.00 0.00 174.62 172.58 2kl0 n PRO 61 N 0.22 0.04 -3.13 3.99 -0.02 -1.26 -4.91 135.00 129.93 2kl0 n PRO 61 Ca -0.12 0.01 -0.39 0.00 -2.02 0.00 0.00 63.50 60.99 2kl0 n PRO 61 Cb 0.55 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.47 2kl0 n PRO 61 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2kl0 s ARG 62 N -0.02 4.38 0.21 -0.52 0.52 -1.26 -5.05 118.95 117.22 2kl0 s ARG 62 Ca 0.90 0.85 -0.25 0.00 -0.52 0.00 0.00 55.73 56.71 2kl0 s ARG 62 Cb -1.25 -3.34 -0.09 0.00 0.52 0.00 0.00 34.95 30.79 2kl0 s ARG 62 CO 0.57 0.35 0.83 -0.65 0.02 0.00 0.00 175.30 176.42 2kl0 s GLN 63 N -0.20 4.58 0.00 3.54 -0.21 -1.26 -4.76 119.66 121.36 2kl0 s GLN 63 Ca 0.34 1.21 0.00 0.00 0.02 0.00 0.00 55.36 56.92 2kl0 s GLN 63 Cb -0.19 -3.13 0.00 0.00 1.00 0.00 0.00 33.01 30.69 2kl0 s GLN 63 CO 0.19 0.49 0.00 0.41 -2.12 0.00 0.00 175.29 174.26 2kl0 n GLY 64 N 1.27 -1.29 3.65 3.09 0.00 -1.26 -5.12 105.19 105.52 2kl0 n GLY 64 Ca -0.03 0.47 -0.03 0.00 0.00 0.00 0.00 46.02 46.43 2kl0 n GLY 64 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2kl0 s GLY 65 N 0.00 0.18 -0.07 -0.02 0.00 -1.26 -5.15 107.32 101.00 2kl0 s GLY 65 Ca 0.00 3.28 -0.21 0.00 0.00 0.00 0.00 44.72 47.80 2kl0 s GLY 65 CO 0.00 2.38 0.59 -2.27 0.00 0.00 0.00 173.10 173.79 2kl0 s LEU 66 N 0.83 4.33 0.61 0.66 2.96 -1.26 -5.04 118.68 121.77 2kl0 s LEU 66 Ca -0.04 1.03 -0.19 0.00 -0.22 0.00 0.00 54.13 54.72 2kl0 s LEU 66 Cb -0.04 -2.89 -0.03 0.00 0.50 0.00 0.00 46.19 43.73 2kl0 s LEU 66 CO -0.12 -0.02 1.25 -0.62 -1.32 0.00 0.00 176.35 175.52 2kl0 n GLU 67 N 3.47 1.23 -1.41 1.98 4.71 -1.26 -4.76 120.64 124.59 2kl0 n GLU 67 Ca -0.05 0.47 -0.51 0.00 -0.01 0.00 0.00 57.16 57.06 2kl0 n GLU 67 Cb 0.51 -2.47 -0.08 0.00 -1.01 0.00 0.00 31.44 28.39 2kl0 n GLU 67 CO 0.00 0.00 0.00 1.58 0.09 0.00 0.00 177.13 178.80 2kl0 n HIS 68 N -1.64 1.43 -3.15 -0.32 -0.00 -1.26 -4.86 115.22 105.41 2kl0 n HIS 68 Ca 0.14 0.37 0.04 0.00 -0.00 0.00 0.00 57.72 58.28 2kl0 n HIS 68 Cb 0.47 -2.48 -0.01 0.00 -0.00 0.00 0.00 29.99 27.97 2kl0 n HIS 68 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2kl0 s HIS 69 N 7.44 -1.55 -0.67 1.57 5.04 -1.26 -5.09 115.29 120.77 2kl0 s HIS 69 Ca 1.13 1.23 0.05 0.00 -1.54 0.00 0.00 55.06 55.93 2kl0 s HIS 69 Cb -0.98 0.39 0.17 0.00 0.04 0.00 0.00 32.58 32.20 2kl0 s HIS 69 CO 0.51 -0.88 0.47 -1.01 -2.34 0.00 0.00 174.74 171.49 2kl0 s HIS 70 N 2.86 3.37 0.00 3.88 3.76 -1.26 -5.07 115.29 122.84 2kl0 s HIS 70 Ca 0.15 -3.26 0.00 0.00 -0.15 0.00 0.00 55.06 51.80 2kl0 s HIS 70 Cb -0.11 -2.59 0.00 0.00 1.11 0.00 0.00 32.58 30.98 2kl0 s HIS 70 CO -0.23 -0.58 0.00 1.58 -0.85 0.00 0.00 174.74 174.67 2kl0 n HIS 71 N 2.11 0.00 -0.14 1.40 -0.00 -1.26 -3.64 115.22 113.69 2kl0 n HIS 71 Ca 0.19 0.00 -0.29 0.00 0.46 0.00 0.00 57.72 58.08 2kl0 n HIS 71 Cb 0.36 0.00 -0.10 0.00 -0.12 0.00 0.00 29.99 30.12 2kl0 n HIS 71 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 2kl0 n HIS 72 N 13.56 0.07 1.87 1.57 -0.00 -1.26 -5.28 115.22 125.75 2kl0 n HIS 72 Ca 0.00 0.03 0.15 0.00 0.46 0.00 0.00 57.72 58.36 2kl0 n HIS 72 Cb 0.00 -1.01 0.89 0.00 -0.12 0.00 0.00 29.99 29.75 2kl0 n HIS 72 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52