#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 4.18 -0.00 4.03 1.43 -1.26 -4.52 118.68 122.54 2kl0 s LEU 2 Ca 0.00 1.58 0.08 0.00 -1.03 0.00 0.00 54.13 54.76 2kl0 s LEU 2 Cb 0.00 -4.06 -0.02 0.00 0.03 0.00 0.00 46.19 42.14 2kl0 s LEU 2 CO 0.00 -0.15 -0.25 0.68 0.23 0.00 0.00 176.35 176.87 2kl0 s VAL 3 N -1.81 2.19 -0.48 -1.59 -7.23 0.99 -2.95 120.40 109.52 2kl0 s VAL 3 Ca 0.52 -1.15 -0.24 0.00 -1.81 0.00 0.00 61.98 59.31 2kl0 s VAL 3 Cb -0.14 -1.79 0.03 0.00 0.56 0.00 0.00 36.38 35.04 2kl0 s VAL 3 CO 0.19 0.52 0.86 -0.89 -0.31 0.00 0.00 175.10 175.47 2kl0 s THR 4 N -0.68 4.54 -0.17 5.32 2.01 -1.24 -0.43 115.64 125.00 2kl0 s THR 4 Ca 0.11 0.46 -0.01 0.00 0.31 0.00 0.00 61.69 62.56 2kl0 s THR 4 Cb -0.10 -4.41 -0.00 0.00 0.01 0.00 0.00 72.50 68.00 2kl0 s THR 4 CO 0.00 -0.85 -0.13 -0.63 -0.69 0.00 0.00 174.62 172.32 2kl0 s ILE 5 N 3.57 2.75 -1.48 1.82 1.01 0.23 -1.47 121.20 127.63 2kl0 s ILE 5 Ca 0.32 -0.73 -0.04 0.00 0.00 0.00 0.00 60.65 60.20 2kl0 s ILE 5 Cb -0.12 -2.19 0.02 0.00 0.01 0.00 0.00 42.46 40.18 2kl0 s ILE 5 CO 0.23 0.50 0.38 0.59 0.00 0.00 0.00 174.94 176.63 2kl0 n ASN 6 N 4.29 -5.32 0.00 3.58 5.03 -1.18 0.13 115.26 121.79 2kl0 n ASN 6 Ca -0.19 -0.18 0.00 0.00 0.87 0.00 0.00 54.58 55.07 2kl0 n ASN 6 Cb 0.51 -4.36 0.00 0.00 -1.02 0.00 0.00 39.78 34.91 2kl0 n ASN 6 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2kl0 n GLY 7 N -1.26 0.47 3.24 7.41 0.00 -1.26 -5.00 105.19 108.79 2kl0 n GLY 7 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.31 2.61 0.13 1.61 2.56 0.12 -5.09 118.70 120.33 2kl0 s GLU 8 Ca 0.00 -0.86 -0.30 0.00 0.00 0.00 0.00 54.97 53.81 2kl0 s GLU 8 Cb 0.00 -2.13 -0.07 0.00 2.00 0.00 0.00 34.13 33.93 2kl0 s GLU 8 CO 0.00 0.30 1.11 -0.65 -0.56 0.00 0.00 175.26 175.46 2kl0 s GLN 9 N 0.02 4.55 0.04 4.30 -0.21 -1.26 0.76 119.66 127.87 2kl0 s GLN 9 Ca -0.08 1.70 -0.10 0.00 0.02 0.00 0.00 55.36 56.90 2kl0 s GLN 9 Cb -0.15 -3.31 0.00 0.00 1.00 0.00 0.00 33.01 30.55 2kl0 s GLN 9 CO 0.05 -0.01 0.20 0.50 -2.12 0.00 0.00 175.29 173.91 2kl0 s ARG 10 N 0.12 0.69 -0.24 2.91 3.52 0.43 -4.90 118.95 121.48 2kl0 s ARG 10 Ca 0.52 -0.62 -0.08 0.00 -0.13 0.00 0.00 55.73 55.42 2kl0 s ARG 10 Cb -0.28 0.29 -0.04 0.00 -1.56 0.00 0.00 34.95 33.36 2kl0 s ARG 10 CO 0.33 -0.20 0.10 -2.00 -0.81 0.00 0.00 175.30 172.71 2kl0 s GLU 11 N -2.54 3.78 -0.06 5.12 2.12 -1.26 -0.01 118.70 125.85 2kl0 s GLU 11 Ca -0.05 -0.42 0.04 0.00 0.36 0.00 0.00 54.97 54.91 2kl0 s GLU 11 Cb -0.01 -3.38 -0.00 0.00 0.26 0.00 0.00 34.13 30.99 2kl0 s GLU 11 CO -0.04 -0.10 -0.20 0.14 -0.54 0.00 0.00 175.26 174.52 2kl0 s VAL 12 N 1.42 1.70 -2.40 3.70 -7.23 -1.26 -5.00 120.40 111.33 2kl0 s VAL 12 Ca 0.06 -0.85 0.27 0.00 -1.81 0.00 0.00 61.98 59.65 2kl0 s VAL 12 Cb -0.15 -1.46 0.44 0.00 0.56 0.00 0.00 36.38 35.77 2kl0 s VAL 12 CO 0.05 0.48 1.64 0.00 -0.31 0.00 0.00 175.10 176.96 2kl0 n GLN 13 N 3.26 1.56 -1.25 4.82 3.00 -1.26 -4.93 117.38 122.59 2kl0 n GLN 13 Ca -0.19 -0.98 -0.32 0.00 -0.01 0.00 0.00 57.00 55.51 2kl0 n GLN 13 Cb 0.53 -1.48 0.10 0.00 0.00 0.00 0.00 30.24 29.38 2kl0 n GLN 13 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 2kl0 s SER 14 N -2.11 4.30 0.00 1.08 1.04 -1.26 -4.96 113.70 111.79 2kl0 s SER 14 Ca 0.34 1.95 0.00 0.00 0.48 0.00 0.00 55.95 58.72 2kl0 s SER 14 Cb 0.20 -2.54 0.01 0.00 0.10 0.00 0.00 66.02 63.79 2kl0 s SER 14 CO 0.37 -2.17 0.95 0.00 0.98 0.00 0.00 173.24 173.37 2kl0 n ALA 15 N -3.43 2.06 -3.23 5.32 0.00 -1.26 -4.84 120.51 115.13 2kl0 n ALA 15 Ca 0.10 -0.95 -0.13 0.00 0.00 0.00 0.00 53.44 52.46 2kl0 n ALA 15 Cb 0.52 -0.01 -0.06 0.00 0.00 0.00 0.00 19.45 19.90 2kl0 n ALA 15 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2kl0 s SER 16 N -0.89 -0.34 0.15 0.00 0.15 -1.26 -1.24 113.70 110.27 2kl0 s SER 16 Ca 0.01 0.10 -0.14 0.00 0.70 0.00 0.00 55.95 56.61 2kl0 s SER 16 Cb 0.00 0.44 0.03 0.00 -1.71 0.00 0.00 66.02 64.79 2kl0 s SER 16 CO 0.00 -0.66 1.74 0.58 1.20 0.00 0.00 173.24 176.11 2kl0 h VAL 17 N 3.01 1.18 -0.76 4.45 2.07 -1.45 -1.11 116.25 123.65 2kl0 h VAL 17 Ca -0.31 -0.50 -0.04 0.00 0.82 0.00 0.00 66.70 66.67 2kl0 h VAL 17 Cb 1.20 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 2kl0 h VAL 17 CO 0.42 0.20 0.31 0.00 0.02 0.00 0.00 177.57 178.52 2kl0 h ALA 18 N 1.09 1.11 -0.55 1.67 0.00 -1.84 -2.27 119.26 118.47 2kl0 h ALA 18 Ca 0.17 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2kl0 h ALA 18 Cb 0.10 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2kl0 h ALA 18 CO -0.02 0.64 0.07 0.00 0.00 0.00 0.00 179.25 179.93 2kl0 h ALA 19 N 1.23 1.09 -0.65 0.00 0.00 -1.76 -2.50 119.26 116.68 2kl0 h ALA 19 Ca 0.25 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2kl0 h ALA 19 Cb 0.20 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2kl0 h ALA 19 CO -0.02 0.59 0.27 1.25 0.00 0.00 0.00 179.25 181.33 2kl0 h LEU 20 N 0.84 0.89 -0.90 0.00 5.85 -0.67 -1.82 115.31 119.50 2kl0 h LEU 20 Ca 0.17 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 2kl0 h LEU 20 Cb 0.40 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.16 2kl0 h LEU 20 CO 0.01 0.81 0.56 -0.03 -0.34 0.00 0.00 178.44 179.45 2kl0 h MET 21 N 0.91 1.21 -0.48 1.25 4.05 -1.08 -0.87 114.93 119.92 2kl0 h MET 21 Ca 0.22 -0.10 -0.02 0.00 -0.28 0.00 0.00 59.70 59.51 2kl0 h MET 21 Cb 0.20 -0.26 -0.02 0.00 -0.80 0.00 0.00 31.60 30.72 2kl0 h MET 21 CO -0.02 0.83 0.21 1.15 0.23 0.00 0.00 176.91 179.31 2kl0 h THR 22 N 1.23 1.20 -0.39 -0.77 2.02 -1.02 0.31 112.91 115.48 2kl0 h THR 22 Ca 0.32 -0.61 -0.05 0.00 0.77 0.00 0.00 66.41 66.85 2kl0 h THR 22 Cb -0.08 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 67.02 2kl0 h THR 22 CO -0.06 0.23 0.04 -0.08 0.37 0.00 0.00 175.52 176.02 2kl0 h GLU 23 N 0.63 0.61 -0.01 6.66 4.81 -0.77 -0.91 114.58 125.59 2kl0 h GLU 23 Ca 0.16 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2kl0 h GLU 23 Cb 0.17 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.46 2kl0 h GLU 23 CO -0.02 0.60 -0.08 1.28 -0.73 0.00 0.00 179.01 180.07 2kl0 n LEU 24 N -4.28 1.10 -1.86 1.64 4.77 -0.38 -4.89 117.00 113.09 2kl0 n LEU 24 Ca 0.02 -0.32 -0.16 0.00 -0.03 0.00 0.00 56.01 55.52 2kl0 n LEU 24 Cb 0.24 -0.05 -0.04 0.00 -2.33 0.00 0.00 43.42 41.23 2kl0 n LEU 24 CO 0.39 0.19 -0.17 -0.67 -1.33 0.00 0.00 177.39 175.80 2kl0 n ASP 25 N -0.30 -4.35 -1.88 -1.43 -0.08 0.98 -4.80 116.55 104.70 2kl0 n ASP 25 Ca 0.17 0.27 -0.16 0.00 -1.51 0.00 0.00 54.79 53.56 2kl0 n ASP 25 Cb 0.32 -3.84 0.04 0.00 2.34 0.00 0.00 41.12 39.98 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 -2.24 2.59 0.00 0.00 2.01 -1.26 -4.39 115.64 112.35 2kl0 s THR 27 Ca 0.30 0.51 0.00 0.00 0.31 0.00 0.00 61.69 62.82 2kl0 s THR 27 Cb 0.24 -3.33 0.00 0.00 0.01 0.00 0.00 72.50 69.42 2kl0 s THR 27 CO -0.00 0.09 0.00 0.61 -0.69 0.00 0.00 174.62 174.63 2kl0 n GLY 28 N 1.90 1.44 2.38 4.40 0.00 -1.26 -4.94 105.19 109.12 2kl0 n GLY 28 Ca 0.06 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 0.00 0.63 0.28 -0.02 0.00 -1.26 -4.89 105.19 99.93 2kl0 n GLY 29 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 2kl0 n GLY 29 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2kl0 h HIS 30 N 0.00 0.96 -3.35 1.61 3.86 -1.92 -3.43 115.15 112.89 2kl0 h HIS 30 Ca 0.00 -0.20 -0.55 0.00 -1.16 0.00 0.00 60.37 58.45 2kl0 h HIS 30 Cb 0.03 -0.24 -0.03 0.00 1.06 0.00 0.00 27.41 28.23 2kl0 h HIS 30 CO 0.02 0.95 -0.14 -0.06 0.86 0.00 0.00 177.93 179.56 2kl0 s PHE 31 N -4.73 3.49 0.39 2.45 0.08 -1.26 -5.09 117.98 113.31 2kl0 s PHE 31 Ca -0.10 0.87 0.07 0.00 0.12 0.00 0.00 56.93 57.89 2kl0 s PHE 31 Cb 0.13 -2.24 0.00 0.00 -0.57 0.00 0.00 43.02 40.34 2kl0 s PHE 31 CO 0.84 0.35 0.54 0.00 -0.10 0.00 0.00 175.22 176.85 2kl0 s ALA 32 N -1.68 4.36 0.16 5.36 0.00 -1.26 -4.99 121.76 123.70 2kl0 s ALA 32 Ca 0.43 -1.55 0.04 0.00 0.00 0.00 0.00 51.96 50.88 2kl0 s ALA 32 Cb -0.12 -1.69 -0.05 0.00 0.00 0.00 0.00 23.12 21.27 2kl0 s ALA 32 CO 0.21 -0.20 -0.07 0.14 0.00 0.00 0.00 175.76 175.84 2kl0 s VAL 33 N -2.30 1.05 -0.04 0.00 -7.23 -1.26 -2.72 120.40 107.90 2kl0 s VAL 33 Ca 0.51 -2.04 0.01 0.00 -1.81 0.00 0.00 61.98 58.65 2kl0 s VAL 33 Cb -0.10 -1.93 0.02 0.00 0.56 0.00 0.00 36.38 34.93 2kl0 s VAL 33 CO 0.33 -0.67 -0.03 0.00 -0.31 0.00 0.00 175.10 174.41 2kl0 s ALA 34 N -3.40 0.58 -0.11 1.32 0.00 -0.24 -1.98 121.76 117.93 2kl0 s ALA 34 Ca 0.19 0.00 0.03 0.00 0.00 0.00 0.00 51.96 52.18 2kl0 s ALA 34 Cb 0.04 -0.38 0.01 0.00 0.00 0.00 0.00 23.12 22.78 2kl0 s ALA 34 CO 0.02 -0.01 -0.21 -1.17 0.00 0.00 0.00 175.76 174.38 2kl0 s LEU 35 N 0.90 2.00 -1.46 0.00 2.96 0.57 -2.50 118.68 121.14 2kl0 s LEU 35 Ca -0.11 -0.52 -0.10 0.00 -0.22 0.00 0.00 54.13 53.17 2kl0 s LEU 35 Cb -0.14 -1.31 0.05 0.00 0.50 0.00 0.00 46.19 45.29 2kl0 s LEU 35 CO -0.00 0.11 0.93 0.59 -1.32 0.00 0.00 176.35 176.66 2kl0 n ASN 36 N 3.75 -5.41 -3.06 3.68 5.03 -1.24 -1.61 115.26 116.40 2kl0 n ASN 36 Ca -0.20 -0.58 -0.16 0.00 0.87 0.00 0.00 54.58 54.51 2kl0 n ASN 36 Cb 0.52 -4.32 0.07 0.00 -1.02 0.00 0.00 39.78 35.04 2kl0 n ASN 36 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2kl0 n TYR 37 N -4.68 -2.02 -3.69 3.10 9.36 -1.26 -5.02 117.16 112.96 2kl0 n TYR 37 Ca 0.00 0.81 -0.10 0.00 3.32 0.00 0.00 57.90 61.93 2kl0 n TYR 37 Cb 0.55 -4.53 -0.11 0.00 -0.63 0.00 0.00 39.34 34.62 2kl0 n TYR 37 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2kl0 s ASP 38 N -3.87 -0.41 0.15 2.98 2.15 -0.63 -5.13 116.67 111.90 2kl0 s ASP 38 Ca 0.15 0.89 -0.31 0.00 0.43 0.00 0.00 52.55 53.72 2kl0 s ASP 38 Cb -0.07 0.89 -0.08 0.00 -0.30 0.00 0.00 42.92 43.36 2kl0 s ASP 38 CO 0.61 -0.20 1.38 -0.69 -0.17 0.00 0.00 175.17 176.10 2kl0 s VAL 39 N 1.72 3.19 -0.14 1.11 1.01 -1.26 -0.32 120.40 125.71 2kl0 s VAL 39 Ca -0.07 0.90 -0.03 0.00 0.00 0.00 0.00 61.98 62.77 2kl0 s VAL 39 Cb -0.09 -3.57 -0.03 0.00 0.00 0.00 0.00 36.38 32.68 2kl0 s VAL 39 CO -0.12 0.09 -0.04 -0.69 0.00 0.00 0.00 175.10 174.34 2kl0 s VAL 40 N 0.72 3.93 0.50 2.92 1.01 -0.84 -4.90 120.40 123.74 2kl0 s VAL 40 Ca 0.62 -0.36 -0.20 0.00 0.00 0.00 0.00 61.98 62.04 2kl0 s VAL 40 Cb -0.37 -2.70 -0.07 0.00 0.00 0.00 0.00 36.38 33.23 2kl0 s VAL 40 CO 0.34 0.52 1.08 -2.16 0.00 0.00 0.00 175.10 174.87 2kl0 s PRO 41 N 0.11 3.65 0.00 2.72 0.04 -1.26 -4.40 135.00 135.87 2kl0 s PRO 41 Ca -0.01 1.50 0.01 0.00 0.04 0.00 0.00 61.00 62.54 2kl0 s PRO 41 Cb -0.14 -2.11 0.07 0.00 0.04 0.00 0.00 34.50 32.36 2kl0 s PRO 41 CO 0.03 -0.58 0.80 2.89 0.04 0.00 0.00 177.00 180.18 2kl0 n ARG 42 N -1.00 0.02 0.04 4.56 1.85 -1.26 -0.76 116.66 120.12 2kl0 n ARG 42 Ca 0.10 0.23 0.12 0.00 -1.00 0.00 0.00 57.85 57.29 2kl0 n ARG 42 Cb 0.51 -1.50 0.11 0.00 -1.05 0.00 0.00 32.46 30.53 2kl0 n ARG 42 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2kl0 n GLY 43 N -1.13 -1.32 0.36 2.89 0.00 -1.26 -3.96 105.19 100.76 2kl0 n GLY 43 Ca 0.01 -0.32 0.04 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.04 1.57 -0.09 1.61 5.02 0.07 -4.65 118.16 119.65 2kl0 n LYS 44 Ca 0.03 -1.43 -0.09 0.00 -2.02 0.00 0.00 58.31 54.80 2kl0 n LYS 44 Cb 0.44 -1.16 -0.02 0.00 -0.02 0.00 0.00 35.03 34.27 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 1.36 0.41 -0.21 2.13 4.06 -1.66 0.20 115.95 122.24 2kl0 h TRP 45 Ca 0.00 0.00 -0.17 0.00 2.06 0.00 0.00 58.89 60.78 2kl0 h TRP 45 Cb 0.49 -0.14 -0.00 0.00 -1.00 0.00 0.00 29.16 28.51 2kl0 h TRP 45 CO 0.08 0.29 -0.56 0.22 -3.56 0.00 0.00 178.44 174.91 2kl0 h ASP 46 N 0.41 0.73 -0.15 -3.49 1.82 -1.84 -2.79 116.42 111.11 2kl0 h ASP 46 Ca 0.11 -0.40 0.00 0.00 -0.39 0.00 0.00 57.03 56.36 2kl0 h ASP 46 Cb -0.01 -0.21 0.00 0.00 0.68 0.00 0.00 39.33 39.79 2kl0 h ASP 46 CO -0.02 1.14 0.00 -0.62 -1.61 0.00 0.00 179.24 178.13 2kl0 n GLU 47 N -3.97 1.58 -3.91 0.28 -0.58 -1.02 -4.53 120.64 108.49 2kl0 n GLU 47 Ca -0.04 -0.64 -0.31 0.00 -0.42 0.00 0.00 57.16 55.75 2kl0 n GLU 47 Cb 0.62 -1.35 -0.13 0.00 -0.57 0.00 0.00 31.44 30.01 2kl0 n GLU 47 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2kl0 s THR 48 N -1.62 2.78 0.61 2.62 2.01 0.03 -5.04 115.64 117.03 2kl0 s THR 48 Ca 0.11 -3.22 -0.18 0.00 0.31 0.00 0.00 61.69 58.71 2kl0 s THR 48 Cb 0.07 -2.91 -0.04 0.00 0.01 0.00 0.00 72.50 69.64 2kl0 s THR 48 CO 0.06 -0.81 1.09 -2.65 -0.69 0.00 0.00 174.62 171.62 2kl0 n PRO 49 N 3.22 1.00 -4.68 4.92 -0.02 -1.26 -2.99 135.00 135.19 2kl0 n PRO 49 Ca 0.05 0.39 -0.33 0.00 -2.02 0.00 0.00 63.50 61.59 2kl0 n PRO 49 Cb 0.33 -2.30 -0.13 0.00 -0.02 0.00 0.00 33.50 31.38 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 -1.46 3.36 -0.15 -1.45 1.01 -0.37 -4.81 120.40 116.53 2kl0 s VAL 50 Ca 0.78 -0.57 -0.03 0.00 0.00 0.00 0.00 61.98 62.16 2kl0 s VAL 50 Cb -0.41 -2.41 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 2kl0 s VAL 50 CO 0.45 0.54 -0.07 -0.89 0.00 0.00 0.00 175.10 175.13 2kl0 s THR 51 N 0.03 3.60 -0.63 3.92 2.01 -1.26 -4.68 115.64 118.62 2kl0 s THR 51 Ca -0.03 -0.46 -0.26 0.00 0.31 0.00 0.00 61.69 61.25 2kl0 s THR 51 Cb -0.14 -2.56 -0.11 0.00 0.01 0.00 0.00 72.50 69.70 2kl0 s THR 51 CO 0.04 0.50 2.44 0.00 -0.69 0.00 0.00 174.62 176.91 2kl0 n ALA 52 N 3.59 0.65 0.00 7.40 0.00 -1.26 -1.16 120.51 129.73 2kl0 n ALA 52 Ca -0.18 -0.95 0.00 0.00 0.00 0.00 0.00 53.44 52.31 2kl0 n ALA 52 Cb 0.52 -3.09 0.00 0.00 0.00 0.00 0.00 19.45 16.88 2kl0 n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kl0 n GLY 53 N 6.21 0.75 3.77 0.00 0.00 -1.15 -0.94 105.19 113.83 2kl0 n GLY 53 Ca 0.43 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.07 2kl0 n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2kl0 s ASP 54 N 0.00 6.33 -0.34 1.61 1.01 -0.31 -4.76 116.67 120.21 2kl0 s ASP 54 Ca 0.00 2.46 -0.21 0.00 0.71 0.00 0.00 52.55 55.51 2kl0 s ASP 54 Cb 0.00 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.31 2kl0 s ASP 54 CO 0.00 -0.82 0.67 -1.61 0.21 0.00 0.00 175.17 173.62 2kl0 s GLU 55 N -2.37 3.77 -0.09 8.23 2.02 -1.26 -3.58 118.70 125.41 2kl0 s GLU 55 Ca 0.59 0.19 0.03 0.00 0.02 0.00 0.00 54.97 55.80 2kl0 s GLU 55 Cb -0.33 -3.78 -0.01 0.00 0.10 0.00 0.00 34.13 30.10 2kl0 s GLU 55 CO 0.42 -0.71 -0.19 0.42 0.02 0.00 0.00 175.26 175.22 2kl0 s ILE 56 N 2.76 2.58 -0.05 -1.63 1.09 -0.54 -3.71 121.20 121.70 2kl0 s ILE 56 Ca 0.26 -0.85 0.04 0.00 -1.10 0.00 0.00 60.65 59.00 2kl0 s ILE 56 Cb -0.14 -2.02 -0.00 0.00 -1.06 0.00 0.00 42.46 39.24 2kl0 s ILE 56 CO 0.14 0.55 -0.17 -1.61 -0.10 0.00 0.00 174.94 173.76 2kl0 s GLU 57 N 0.05 1.80 -0.21 2.79 2.02 -1.04 -3.10 118.70 121.02 2kl0 s GLU 57 Ca -0.08 -0.60 -0.08 0.00 0.02 0.00 0.00 54.97 54.23 2kl0 s GLU 57 Cb -0.15 -1.56 -0.04 0.00 0.10 0.00 0.00 34.13 32.48 2kl0 s GLU 57 CO 0.05 0.23 0.07 0.42 0.02 0.00 0.00 175.26 176.06 2kl0 s ILE 58 N 0.07 4.68 0.43 -1.63 1.01 -1.26 -1.08 121.20 123.43 2kl0 s ILE 58 Ca -0.05 -0.06 -0.21 0.00 0.00 0.00 0.00 60.65 60.33 2kl0 s ILE 58 Cb -0.12 -3.14 -0.11 0.00 0.01 0.00 0.00 42.46 39.10 2kl0 s ILE 58 CO 0.02 0.41 0.95 -0.76 0.00 0.00 0.00 174.94 175.56 2kl0 s LEU 59 N 0.85 3.92 -0.45 2.97 1.02 -1.10 -4.93 118.68 120.96 2kl0 s LEU 59 Ca 0.04 1.69 0.05 0.00 0.02 0.00 0.00 54.13 55.93 2kl0 s LEU 59 Cb -0.14 -4.54 0.18 0.00 0.02 0.00 0.00 46.19 41.72 2kl0 s LEU 59 CO 0.02 -0.38 0.51 0.35 0.02 0.00 0.00 176.35 176.87 2kl0 n THR 60 N -0.69 -0.73 -0.54 5.49 -2.24 -1.26 -4.27 114.28 110.05 2kl0 n THR 60 Ca 0.07 -2.56 0.00 0.00 -2.27 0.00 0.00 64.05 59.29 2kl0 n THR 60 Cb 0.54 -0.64 0.00 0.00 -2.10 0.00 0.00 70.33 68.13 2kl0 n THR 60 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2kl0 n PRO 61 N 2.73 0.37 -3.05 -0.78 -0.04 -1.26 -4.42 135.00 128.55 2kl0 n PRO 61 Ca 0.24 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.49 2kl0 n PRO 61 Cb 0.52 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.99 2kl0 n PRO 61 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2kl0 n ARG 62 N -0.60 -3.74 0.00 0.54 1.74 -1.26 -4.78 116.66 108.55 2kl0 n ARG 62 Ca 0.00 0.69 0.00 0.00 -0.77 0.00 0.00 57.85 57.77 2kl0 n ARG 62 Cb 0.00 -5.44 0.00 0.00 -1.02 0.00 0.00 32.46 26.00 2kl0 n ARG 62 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2kl0 n GLN 63 N -3.69 0.89 0.00 5.56 1.13 -1.26 -4.95 117.38 115.06 2kl0 n GLN 63 Ca -0.08 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.98 2kl0 n GLN 63 Cb 0.59 -1.18 0.00 0.00 0.11 0.00 0.00 30.24 29.76 2kl0 n GLN 63 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2kl0 n GLY 64 N 0.25 1.91 0.70 1.08 0.00 -1.26 -4.91 105.19 102.95 2kl0 n GLY 64 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.55 2kl0 n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kl0 n GLY 65 N 0.00 0.59 0.24 -0.02 0.00 -1.26 -4.96 105.19 99.78 2kl0 n GLY 65 Ca 0.00 -0.33 0.15 0.00 0.00 0.00 0.00 46.02 45.84 2kl0 n GLY 65 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2kl0 n LEU 66 N -0.54 0.77 -2.42 0.99 4.77 -1.26 -5.00 117.00 114.31 2kl0 n LEU 66 Ca 0.00 -0.23 -0.01 0.00 -0.03 0.00 0.00 56.01 55.73 2kl0 n LEU 66 Cb 0.31 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.36 2kl0 n LEU 66 CO 0.00 0.13 -0.51 1.21 -1.33 0.00 0.00 177.39 176.89 2kl0 n GLU 67 N -0.45 -4.76 -2.34 3.23 2.13 -1.26 -4.90 120.64 112.30 2kl0 n GLU 67 Ca 0.20 3.48 -0.38 0.00 0.66 0.00 0.00 57.16 61.13 2kl0 n GLU 67 Cb 0.25 -4.56 -0.02 0.00 0.27 0.00 0.00 31.44 27.38 2kl0 n GLU 67 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 2kl0 s HIS 68 N -0.58 3.09 -0.99 4.31 3.76 -1.26 -4.91 115.29 118.71 2kl0 s HIS 68 Ca -0.07 1.57 0.27 0.00 -0.15 0.00 0.00 55.06 56.68 2kl0 s HIS 68 Cb 0.00 -3.34 1.15 0.00 1.11 0.00 0.00 32.58 31.51 2kl0 s HIS 68 CO 0.20 -1.20 1.87 0.72 -0.85 0.00 0.00 174.74 175.48 2kl0 n HIS 69 N 0.00 0.02 -2.78 1.40 -0.00 -1.26 -4.98 115.22 107.63 2kl0 n HIS 69 Ca 0.05 0.01 -0.01 0.00 -0.00 0.00 0.00 57.72 57.76 2kl0 n HIS 69 Cb 0.47 -0.51 -0.01 0.00 -0.00 0.00 0.00 29.99 29.94 2kl0 n HIS 69 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2kl0 n HIS 70 N -1.52 -3.36 -0.11 4.41 8.25 -1.26 -4.88 115.22 116.74 2kl0 n HIS 70 Ca 0.07 1.61 -0.09 0.00 -0.26 0.00 0.00 57.72 59.04 2kl0 n HIS 70 Cb 0.32 -3.44 -0.02 0.00 1.12 0.00 0.00 29.99 27.97 2kl0 n HIS 70 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2kl0 h HIS 71 N 3.43 0.49 0.00 4.41 2.76 -2.04 -3.40 115.15 120.79 2kl0 h HIS 71 Ca -0.11 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.03 2kl0 h HIS 71 Cb 0.39 -0.15 0.00 0.00 1.55 0.00 0.00 27.41 29.20 2kl0 h HIS 71 CO 0.01 0.44 -0.26 1.58 -1.30 0.00 0.00 177.93 178.40 2kl0 n HIS 72 N -4.73 0.00 -1.63 5.26 -0.00 -1.26 -5.34 115.22 107.52 2kl0 n HIS 72 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.71 2kl0 n HIS 72 Cb 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.11 2kl0 n HIS 72 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92