#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kl4 n SER 2 N 0.00 -1.08 0.00 1.61 7.64 -1.26 -4.97 113.62 115.56 2kl4 n SER 2 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2kl4 n SER 2 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2kl4 n SER 2 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kl4 n HIS 3 N 0.00 0.00 0.05 1.43 -0.00 -1.26 -4.96 115.22 110.48 2kl4 n HIS 3 Ca 0.00 0.00 0.20 0.00 -0.00 0.00 0.00 57.72 57.92 2kl4 n HIS 3 Cb 0.00 0.00 0.73 0.00 -0.00 0.00 0.00 29.99 30.72 2kl4 n HIS 3 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.34 176.86 2kl4 h MET 4 N 0.00 0.00 0.51 -1.40 0.00 -1.95 -2.35 114.93 109.74 2kl4 h MET 4 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 59.70 59.68 2kl4 h MET 4 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 31.60 31.58 2kl4 h MET 4 CO 0.00 0.00 -0.48 1.05 0.00 0.00 0.00 176.91 177.48 2kl4 h GLU 5 N 0.00 -0.94 -0.93 1.72 4.11 -1.97 -1.54 114.58 115.03 2kl4 h GLU 5 Ca 0.22 0.06 0.07 0.00 0.07 0.00 0.00 59.36 59.78 2kl4 h GLU 5 Cb 1.01 0.21 -0.06 0.00 0.50 0.00 0.00 28.75 30.41 2kl4 h GLU 5 CO -0.00 -0.63 0.60 0.28 0.07 0.00 0.00 179.01 179.33 2kl4 h VAL 6 N -0.98 1.06 0.00 -1.06 2.07 -1.83 -2.72 116.25 112.79 2kl4 h VAL 6 Ca -0.06 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2kl4 h VAL 6 Cb 0.84 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 2kl4 h VAL 6 CO -0.04 0.19 -0.61 -0.26 0.02 0.00 0.00 177.57 176.87 2kl4 h PHE 7 N 1.05 0.00 -0.43 1.57 0.04 -1.53 -3.36 116.94 114.28 2kl4 h PHE 7 Ca 0.40 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 61.14 2kl4 h PHE 7 Cb 0.22 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.34 2kl4 h PHE 7 CO -0.00 0.00 0.14 0.00 -0.60 0.00 0.00 178.31 177.85 2kl4 h ALA 8 N 2.49 1.43 0.00 2.45 0.00 -0.94 -1.41 119.26 123.28 2kl4 h ALA 8 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2kl4 h ALA 8 Cb 0.76 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2kl4 h ALA 8 CO 0.00 0.42 0.00 0.39 0.00 0.00 0.00 179.25 180.06 2kl4 n GLU 9 N -4.34 0.02 -0.04 0.00 1.02 -1.26 -1.17 120.64 114.86 2kl4 n GLU 9 Ca 0.03 0.36 -0.05 0.00 -0.02 0.00 0.00 57.16 57.48 2kl4 n GLU 9 Cb 0.17 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.04 2kl4 n GLU 9 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 2kl4 n TYR 10 N -1.45 0.00 -0.19 -0.32 9.36 -0.62 -4.53 117.16 119.41 2kl4 n TYR 10 Ca 0.02 0.00 0.19 0.00 3.32 0.00 0.00 57.90 61.43 2kl4 n TYR 10 Cb 0.06 -0.37 0.55 0.00 -0.63 0.00 0.00 39.34 38.95 2kl4 n TYR 10 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 2kl4 h LEU 11 N 0.00 0.32 -1.45 2.98 3.38 -0.87 -1.85 115.31 117.81 2kl4 h LEU 11 Ca -0.21 0.03 0.14 0.00 0.09 0.00 0.00 57.88 57.92 2kl4 h LEU 11 Cb 1.39 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 42.05 2kl4 h LEU 11 CO -0.02 0.14 0.52 0.07 0.09 0.00 0.00 178.44 179.25 2kl4 h LYS 12 N 0.33 0.53 -0.03 1.13 2.10 -1.38 -2.97 116.57 116.28 2kl4 h LYS 12 Ca 0.41 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 59.03 2kl4 h LYS 12 Cb 1.10 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 32.31 2kl4 h LYS 12 CO -0.12 0.35 -0.01 0.41 -2.00 0.00 0.00 179.45 178.08 2kl4 n GLY 13 N -1.48 0.97 3.56 0.07 0.00 -0.70 -4.76 105.19 102.85 2kl4 n GLY 13 Ca 0.15 -0.69 -0.32 0.00 0.00 0.00 0.00 46.02 45.17 2kl4 n GLY 13 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2kl4 s ILE 14 N -2.00 3.56 -1.77 -0.61 1.01 -1.12 -4.80 121.20 115.46 2kl4 s ILE 14 Ca 0.28 -0.37 0.04 0.00 0.00 0.00 0.00 60.65 60.60 2kl4 s ILE 14 Cb 0.20 -4.28 0.08 0.00 0.01 0.00 0.00 42.46 38.48 2kl4 s ILE 14 CO 0.30 -1.21 0.79 -0.67 0.00 0.00 0.00 174.94 174.16 2kl4 n ASP 15 N 12.50 0.00 -3.45 3.58 -0.08 -1.26 -3.69 116.55 124.14 2kl4 n ASP 15 Ca 0.35 0.03 -0.31 0.00 -1.51 0.00 0.00 54.79 53.35 2kl4 n ASP 15 Cb 0.48 -0.12 -0.05 0.00 2.34 0.00 0.00 41.12 43.78 2kl4 n ASP 15 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 2kl4 n HIS 16 N -1.12 3.40 0.29 -0.67 8.25 -1.26 -4.92 115.22 119.20 2kl4 n HIS 16 Ca 0.02 -3.68 0.17 0.00 -0.26 0.00 0.00 57.72 53.97 2kl4 n HIS 16 Cb 0.02 -0.73 0.89 0.00 1.12 0.00 0.00 29.99 31.29 2kl4 n HIS 16 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2kl4 h PRO 17 N 4.16 0.00 0.00 -0.41 0.13 -1.98 -0.68 132.00 133.21 2kl4 h PRO 17 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 2kl4 h PRO 17 Cb 0.59 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.72 2kl4 h PRO 17 CO 0.96 0.04 0.00 -0.25 -0.23 0.00 0.00 178.00 178.52 2kl4 n ASP 18 N -3.31 0.00 -0.34 1.44 8.00 -1.26 -3.33 116.55 117.75 2kl4 n ASP 18 Ca -0.02 -0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.42 2kl4 n ASP 18 Cb 0.19 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.06 2kl4 n ASP 18 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2kl4 n HIS 19 N -1.23 0.00 -0.07 1.24 8.25 -0.34 -4.91 115.22 118.15 2kl4 n HIS 19 Ca 0.09 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.34 2kl4 n HIS 19 Cb 0.12 0.05 -0.12 0.00 1.12 0.00 0.00 29.99 31.16 2kl4 n HIS 19 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 2kl4 h ARG 20 N 0.00 0.07 -0.44 -0.41 1.12 -1.34 -3.41 114.38 109.98 2kl4 h ARG 20 Ca 0.00 -0.13 0.13 0.00 -1.11 0.00 0.00 59.98 58.87 2kl4 h ARG 20 Cb 1.18 0.05 -0.02 0.00 -0.01 0.00 0.00 29.97 31.17 2kl4 h ARG 20 CO 0.00 1.06 0.32 0.22 -3.11 0.00 0.00 179.97 178.46 2kl4 h ASP 21 N -0.76 0.00 -0.86 -3.80 3.58 -1.88 -1.42 116.42 111.28 2kl4 h ASP 21 Ca -0.29 0.00 0.04 0.00 0.42 0.00 0.00 57.03 57.20 2kl4 h ASP 21 Cb 1.42 -0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.41 2kl4 h ASP 21 CO -0.10 0.00 0.56 0.03 -2.88 0.00 0.00 179.24 176.86 2kl4 h ARG 22 N 0.00 1.01 -0.55 0.28 2.47 -1.96 0.10 114.38 115.74 2kl4 h ARG 22 Ca 0.21 -0.06 -0.11 0.00 -1.26 0.00 0.00 59.98 58.76 2kl4 h ARG 22 Cb 0.84 -0.23 -0.02 0.00 -1.65 0.00 0.00 29.97 28.92 2kl4 h ARG 22 CO -0.00 0.67 -0.08 1.15 0.56 0.00 0.00 179.97 182.27 2kl4 h THR 23 N 1.04 1.27 -0.59 2.04 2.02 -1.54 -2.31 112.91 114.83 2kl4 h THR 23 Ca 0.35 -1.23 0.05 0.00 0.77 0.00 0.00 66.41 66.34 2kl4 h THR 23 Cb 0.07 0.92 -0.05 0.00 -1.74 0.00 0.00 68.15 67.35 2kl4 h THR 23 CO -0.11 0.44 0.32 -0.33 0.37 0.00 0.00 175.52 176.21 2kl4 h GLU 24 N 0.92 0.59 -0.53 6.66 5.08 -1.25 0.50 114.58 126.55 2kl4 h GLU 24 Ca 0.15 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 2kl4 h GLU 24 Cb 0.64 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.73 2kl4 h GLU 24 CO 0.04 0.39 0.31 0.93 -1.00 0.00 0.00 179.01 179.68 2kl4 h GLU 25 N 0.61 0.72 -0.00 2.33 5.08 -0.79 -0.36 114.58 122.17 2kl4 h GLU 25 Ca 0.26 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2kl4 h GLU 25 Cb 0.15 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 2kl4 h GLU 25 CO -0.17 0.54 0.00 0.82 -1.00 0.00 0.00 179.01 179.20 2kl4 h ILE 26 N 0.70 1.05 -0.87 3.13 2.04 -1.09 -0.99 117.51 121.48 2kl4 h ILE 26 Ca 0.19 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.91 2kl4 h ILE 26 Cb 0.01 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 37.20 2kl4 h ILE 26 CO -0.03 0.04 0.58 -0.07 0.00 0.00 0.00 178.15 178.66 2kl4 h LEU 27 N -0.06 0.99 -0.41 1.44 3.38 -0.51 0.94 115.31 121.07 2kl4 h LEU 27 Ca 0.00 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 2kl4 h LEU 27 Cb 0.07 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2kl4 h LEU 27 CO -0.00 0.71 0.07 -1.28 0.09 0.00 0.00 178.44 178.04 2kl4 h SER 28 N 1.17 0.65 -0.45 -0.43 0.87 -0.99 -2.98 113.55 111.40 2kl4 h SER 28 Ca 0.32 -0.26 -0.11 0.00 -1.23 0.00 0.00 61.79 60.52 2kl4 h SER 28 Cb -0.11 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 61.65 2kl4 h SER 28 CO -0.08 0.74 -0.11 -0.25 -0.53 0.00 0.00 176.83 176.60 2kl4 h TRP 29 N 0.54 1.02 -0.59 2.24 7.01 -0.42 -2.71 115.95 123.04 2kl4 h TRP 29 Ca 0.13 -0.20 -0.01 0.00 2.11 0.00 0.00 58.89 60.92 2kl4 h TRP 29 Cb 0.36 -0.26 -0.03 0.00 -2.10 0.00 0.00 29.16 27.14 2kl4 h TRP 29 CO 0.02 0.97 0.34 0.28 -2.79 0.00 0.00 178.44 177.26 2kl4 h VAL 30 N 0.82 1.18 0.00 2.65 2.07 -0.85 -0.05 116.25 122.07 2kl4 h VAL 30 Ca 0.13 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 2kl4 h VAL 30 Cb 0.65 0.41 -0.00 0.00 -1.52 0.00 0.00 31.29 30.82 2kl4 h VAL 30 CO 0.04 0.20 -0.07 0.00 0.02 0.00 0.00 177.57 177.76 2kl4 h ALA 31 N 1.16 1.39 -0.05 1.67 0.00 -1.34 -1.07 119.26 121.02 2kl4 h ALA 31 Ca 0.21 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2kl4 h ALA 31 Cb 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2kl4 h ALA 31 CO -0.04 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.30 2kl4 n ALA 32 N -2.30 0.00 0.19 0.00 0.00 -0.76 -4.16 120.51 113.48 2kl4 n ALA 32 Ca -0.02 -0.05 0.03 0.00 0.00 0.00 0.00 53.44 53.40 2kl4 n ALA 32 Cb 0.17 0.00 0.37 0.00 0.00 0.00 0.00 19.45 19.98 2kl4 n ALA 32 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2kl4 h THR 33 N 0.00 1.22 -2.11 0.00 2.02 -1.07 -3.31 112.91 109.65 2kl4 h THR 33 Ca 0.00 -1.30 -0.57 0.00 0.77 0.00 0.00 66.41 65.31 2kl4 h THR 33 Cb 0.00 1.71 -0.42 0.00 -1.74 0.00 0.00 68.15 67.70 2kl4 h THR 33 CO 0.00 0.37 -0.74 0.49 0.37 0.00 0.00 175.52 176.00 2kl4 n PHE 34 N -4.02 3.39 0.30 3.16 3.72 -0.41 -4.96 117.46 118.64 2kl4 n PHE 34 Ca -0.02 -3.82 0.17 0.00 -0.05 0.00 0.00 57.45 53.73 2kl4 n PHE 34 Cb 0.42 -0.42 0.74 0.00 -0.94 0.00 0.00 39.48 39.27 2kl4 n PHE 34 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2kl4 h PRO 35 N 2.93 0.00 0.00 -1.08 0.13 -1.71 -1.02 132.00 131.24 2kl4 h PRO 35 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 2kl4 h PRO 35 Cb 0.64 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.77 2kl4 h PRO 35 CO 0.77 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.63 2kl4 n ASN 36 N -2.91 0.00 -4.76 1.44 4.13 -1.26 -4.69 115.26 107.21 2kl4 n ASN 36 Ca 0.00 0.09 -0.39 0.00 1.68 0.00 0.00 54.58 55.96 2kl4 n ASN 36 Cb 0.24 -0.36 -0.06 0.00 -1.54 0.00 0.00 39.78 38.07 2kl4 n ASN 36 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2kl4 s LEU 37 N -2.72 4.55 0.18 3.41 1.43 -0.39 -3.89 118.68 121.25 2kl4 s LEU 37 Ca 0.22 2.01 0.10 0.00 -1.03 0.00 0.00 54.13 55.43 2kl4 s LEU 37 Cb 0.19 -3.71 -0.04 0.00 0.03 0.00 0.00 46.19 42.65 2kl4 s LEU 37 CO 0.46 0.02 -0.15 -1.61 0.23 0.00 0.00 176.35 175.30 2kl4 s GLU 38 N -1.46 1.86 0.27 1.70 0.41 -0.18 -4.92 118.70 116.38 2kl4 s GLU 38 Ca 0.44 -1.36 -0.29 0.00 -0.41 0.00 0.00 54.97 53.35 2kl4 s GLU 38 Cb -0.26 -2.05 -0.09 0.00 -1.78 0.00 0.00 34.13 29.95 2kl4 s GLU 38 CO 0.32 0.42 1.17 -1.25 -0.49 0.00 0.00 175.26 175.44 2kl4 s PRO 39 N -2.76 4.54 -0.44 0.39 0.04 -1.26 -1.17 135.00 134.34 2kl4 s PRO 39 Ca 0.23 1.91 0.02 0.00 0.04 0.00 0.00 61.00 63.21 2kl4 s PRO 39 Cb -0.08 -3.18 0.19 0.00 0.04 0.00 0.00 34.50 31.47 2kl4 s PRO 39 CO 0.13 0.05 0.84 -1.14 0.04 0.00 0.00 177.00 176.92 2kl4 s GLN 40 N -1.21 0.73 0.33 4.56 0.74 -0.93 -4.82 119.66 119.07 2kl4 s GLN 40 Ca 0.48 -0.61 -0.28 0.00 0.05 0.00 0.00 55.36 54.99 2kl4 s GLN 40 Cb -0.34 -0.01 -0.10 0.00 1.10 0.00 0.00 33.01 33.67 2kl4 s GLN 40 CO 0.42 -0.93 1.24 0.00 -0.55 0.00 0.00 175.29 175.47 2kl4 s MET 41 N 1.17 4.36 0.02 1.67 0.23 -1.25 -4.02 119.30 121.48 2kl4 s MET 41 Ca 0.24 2.07 -0.15 0.00 -1.03 0.00 0.00 55.69 56.82 2kl4 s MET 41 Cb 0.03 -3.03 0.02 0.00 -1.53 0.00 0.00 34.83 30.32 2kl4 s MET 41 CO -0.08 -0.13 0.32 0.15 -2.03 0.00 0.00 175.02 173.25 2kl4 s LYS 42 N -1.81 0.78 -1.13 3.16 1.02 -0.52 -4.90 119.74 116.34 2kl4 s LYS 42 Ca 0.49 -0.39 -0.02 0.00 0.02 0.00 0.00 55.97 56.07 2kl4 s LYS 42 Cb -0.37 0.34 0.02 0.00 -0.52 0.00 0.00 37.83 37.30 2kl4 s LYS 42 CO 0.48 -0.24 0.15 0.91 -0.92 0.00 0.00 175.35 175.73 2kl4 n TRP 43 N 0.80 -1.54 -1.48 3.18 7.02 -1.26 -0.30 117.44 123.86 2kl4 n TRP 43 Ca -0.20 0.14 -0.17 0.00 -1.02 0.00 0.00 57.50 56.25 2kl4 n TRP 43 Cb 0.58 -2.89 -0.07 0.00 -2.42 0.00 0.00 31.31 26.51 2kl4 n TRP 43 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 2kl4 n ASN 44 N -1.95 -5.36 -4.34 -0.99 5.15 -1.26 -4.98 115.26 101.52 2kl4 n ASN 44 Ca -0.11 0.41 -0.33 0.00 -0.60 0.00 0.00 54.58 53.95 2kl4 n ASN 44 Cb 0.60 -4.47 -0.14 0.00 -0.53 0.00 0.00 39.78 35.23 2kl4 n ASN 44 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2kl4 s THR 45 N -2.41 3.03 -0.19 -0.44 -4.23 0.59 -4.93 115.64 107.06 2kl4 s THR 45 Ca 0.00 -0.65 -0.29 0.00 -1.18 0.00 0.00 61.69 59.57 2kl4 s THR 45 Cb 0.00 -2.30 -0.04 0.00 1.34 0.00 0.00 72.50 71.51 2kl4 s THR 45 CO 0.00 0.50 1.75 -2.16 -0.54 0.00 0.00 174.62 174.17 2kl4 s PRO 46 N 0.66 3.74 0.34 3.99 0.04 -1.14 -1.44 135.00 141.19 2kl4 s PRO 46 Ca -0.06 1.83 0.03 0.00 0.04 0.00 0.00 61.00 62.84 2kl4 s PRO 46 Cb -0.15 -4.10 -0.04 0.00 0.04 0.00 0.00 34.50 30.24 2kl4 s PRO 46 CO 0.02 -1.38 0.10 0.00 0.04 0.00 0.00 177.00 175.79 2kl4 s MET 47 N 4.90 1.72 -0.03 4.56 0.23 -1.26 -1.29 119.30 128.14 2kl4 s MET 47 Ca 0.78 -1.99 0.01 0.00 -1.03 0.00 0.00 55.69 53.46 2kl4 s MET 47 Cb -0.28 -0.58 0.02 0.00 -1.53 0.00 0.00 34.83 32.46 2kl4 s MET 47 CO 0.32 -0.35 -0.04 -0.06 -2.03 0.00 0.00 175.02 172.85 2kl4 s PHE 48 N -3.37 0.62 -0.19 3.16 0.40 -0.88 -2.18 117.98 115.54 2kl4 s PHE 48 Ca 0.32 -0.14 -0.18 0.00 -0.60 0.00 0.00 56.93 56.32 2kl4 s PHE 48 Cb 0.06 -0.54 -0.03 0.00 0.51 0.00 0.00 43.02 43.01 2kl4 s PHE 48 CO 0.15 -0.13 0.50 -1.54 0.70 0.00 0.00 175.22 174.89 2kl4 s SER 49 N 0.67 6.56 -1.07 1.36 1.04 -0.31 -4.18 113.70 117.77 2kl4 s SER 49 Ca -0.08 0.67 -0.22 0.00 0.48 0.00 0.00 55.95 56.80 2kl4 s SER 49 Cb -0.12 -2.28 -0.01 0.00 0.10 0.00 0.00 66.02 63.71 2kl4 s SER 49 CO -0.00 -0.14 1.77 0.21 0.98 0.00 0.00 173.24 176.05 2kl4 s ASN 50 N 1.07 5.82 0.00 7.02 2.47 -1.26 -1.01 114.94 129.04 2kl4 s ASN 50 Ca 0.24 -1.45 0.00 0.00 0.42 0.00 0.00 52.86 52.07 2kl4 s ASN 50 Cb -0.15 -2.57 0.00 0.00 -1.45 0.00 0.00 41.25 37.07 2kl4 s ASN 50 CO 0.09 -2.18 0.00 0.00 -3.72 0.00 0.00 177.10 171.30 2kl4 n GLN 51 N 8.65 0.00 0.00 0.43 6.02 -1.25 -2.99 117.38 128.24 2kl4 n GLN 51 Ca 0.41 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.40 2kl4 n GLN 51 Cb 0.48 -3.34 0.00 0.00 1.02 0.00 0.00 30.24 28.40 2kl4 n GLN 51 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2kl4 n GLY 52 N -1.56 0.00 0.00 1.08 0.00 -1.26 -5.11 105.19 98.34 2kl4 n GLY 52 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2kl4 n GLY 52 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2kl4 n THR 53 N 0.00 0.00 -2.13 2.61 -1.04 -1.16 -4.93 114.28 107.63 2kl4 n THR 53 Ca 0.00 0.00 0.05 0.00 -2.04 0.00 0.00 64.05 62.06 2kl4 n THR 53 Cb 0.00 -1.86 0.09 0.00 -1.82 0.00 0.00 70.33 66.74 2kl4 n THR 53 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 2kl4 n PHE 54 N -1.07 0.00 0.30 -1.42 -0.00 -1.26 -4.30 117.46 109.70 2kl4 n PHE 54 Ca 0.00 -0.84 0.18 0.00 -0.00 0.00 0.00 57.45 56.79 2kl4 n PHE 54 Cb 0.00 -0.18 0.81 0.00 -0.00 0.00 0.00 39.48 40.10 2kl4 n PHE 54 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 2kl4 h ILE 55 N 4.72 0.00 -2.41 -2.13 2.04 -1.81 -3.43 117.51 114.48 2kl4 h ILE 55 Ca -0.13 -0.38 -0.08 0.00 1.00 0.00 0.00 64.86 65.27 2kl4 h ILE 55 Cb 1.54 1.36 -0.23 0.00 -0.74 0.00 0.00 36.82 38.75 2kl4 h ILE 55 CO 0.06 0.00 -0.11 -0.51 0.00 0.00 0.00 178.15 177.59 2kl4 s ILE 56 N -3.77 -0.01 0.08 -0.67 2.07 -1.16 -3.93 121.20 113.82 2kl4 s ILE 56 Ca -0.00 0.02 -0.19 0.00 -1.41 0.00 0.00 60.65 59.07 2kl4 s ILE 56 Cb 0.10 -0.76 0.04 0.00 0.13 0.00 0.00 42.46 41.97 2kl4 s ILE 56 CO 0.50 0.01 0.46 -0.83 -1.91 0.00 0.00 174.94 173.17 2kl4 s GLY 57 N 0.70 -0.35 0.20 1.50 0.00 -1.22 -2.08 107.32 106.06 2kl4 s GLY 57 Ca -0.03 0.28 -0.00 0.00 0.00 0.00 0.00 44.72 44.97 2kl4 s GLY 57 CO -0.05 0.01 0.10 -0.11 0.00 0.00 0.00 173.10 173.05 2kl4 s PHE 58 N -3.05 1.18 -0.09 1.90 -0.12 -0.41 -3.76 117.98 113.63 2kl4 s PHE 58 Ca -0.02 -1.30 -0.14 0.00 -0.05 0.00 0.00 56.93 55.42 2kl4 s PHE 58 Cb 0.00 -0.61 0.03 0.00 -0.63 0.00 0.00 43.02 41.81 2kl4 s PHE 58 CO -0.07 -0.54 0.35 -1.54 -0.05 0.00 0.00 175.22 173.38 2kl4 s SER 59 N -3.17 -0.32 0.32 1.98 1.04 -0.88 -2.89 113.70 109.79 2kl4 s SER 59 Ca 0.35 0.48 -0.05 0.00 0.48 0.00 0.00 55.95 57.21 2kl4 s SER 59 Cb 0.07 0.57 -0.05 0.00 0.10 0.00 0.00 66.02 66.71 2kl4 s SER 59 CO 0.10 -0.26 0.60 0.42 0.98 0.00 0.00 173.24 175.07 2kl4 s THR 60 N -0.43 4.99 0.36 2.02 -4.23 -1.26 -1.06 115.64 116.02 2kl4 s THR 60 Ca -0.06 0.11 0.05 0.00 -1.18 0.00 0.00 61.69 60.61 2kl4 s THR 60 Cb -0.04 -3.75 -0.03 0.00 1.34 0.00 0.00 72.50 70.03 2kl4 s THR 60 CO 0.02 -0.39 0.20 -0.55 -0.54 0.00 0.00 174.62 173.35 2kl4 s SER 61 N -3.27 2.11 0.05 3.99 0.15 0.13 -4.91 113.70 111.95 2kl4 s SER 61 Ca 0.45 -1.69 -0.15 0.00 0.70 0.00 0.00 55.95 55.26 2kl4 s SER 61 Cb -0.11 0.52 -0.06 0.00 -1.71 0.00 0.00 66.02 64.67 2kl4 s SER 61 CO 0.31 -0.98 1.24 0.11 1.20 0.00 0.00 173.24 175.12 2kl4 h LYS 62 N 2.00 -0.27 -0.13 5.44 1.79 -2.01 -3.31 116.57 120.08 2kl4 h LYS 62 Ca -0.31 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.18 2kl4 h LYS 62 Cb 1.25 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.96 2kl4 h LYS 62 CO 0.47 -0.18 0.00 0.72 -1.08 0.00 0.00 179.45 179.39 2kl4 n HIS 63 N -3.80 0.25 -3.85 -1.35 8.25 -1.26 -5.03 115.22 108.45 2kl4 n HIS 63 Ca -0.03 -0.64 -0.09 0.00 -0.26 0.00 0.00 57.72 56.70 2kl4 n HIS 63 Cb 0.17 -0.10 -0.04 0.00 1.12 0.00 0.00 29.99 31.14 2kl4 n HIS 63 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2kl4 s HIS 64 N -1.57 0.07 0.25 4.41 -3.43 -1.25 -1.21 115.29 112.56 2kl4 s HIS 64 Ca 0.18 -0.43 0.03 0.00 -0.80 0.00 0.00 55.06 54.03 2kl4 s HIS 64 Cb 0.13 0.30 -0.03 0.00 -1.43 0.00 0.00 32.58 31.54 2kl4 s HIS 64 CO 0.06 -0.93 0.41 -1.17 -2.00 0.00 0.00 174.74 171.11 2kl4 s LEU 65 N -2.93 4.23 -0.13 5.38 2.96 -1.19 -0.69 118.68 126.31 2kl4 s LEU 65 Ca 0.14 0.24 0.00 0.00 -0.22 0.00 0.00 54.13 54.28 2kl4 s LEU 65 Cb -0.01 -3.04 0.02 0.00 0.50 0.00 0.00 46.19 43.67 2kl4 s LEU 65 CO 0.01 -0.11 -0.12 -0.44 -1.32 0.00 0.00 176.35 174.38 2kl4 s SER 66 N -3.78 2.44 -0.00 3.68 0.01 -0.22 -3.25 113.70 112.58 2kl4 s SER 66 Ca 0.36 -0.40 0.04 0.00 1.31 0.00 0.00 55.95 57.26 2kl4 s SER 66 Cb -0.10 -1.03 -0.01 0.00 0.21 0.00 0.00 66.02 65.09 2kl4 s SER 66 CO 0.31 -0.07 -0.13 -0.69 0.41 0.00 0.00 173.24 173.06 2kl4 s VAL 67 N 1.52 1.05 -0.05 3.43 1.01 -0.02 -2.07 120.40 125.27 2kl4 s VAL 67 Ca 0.04 -0.63 -0.29 0.00 0.00 0.00 0.00 61.98 61.09 2kl4 s VAL 67 Cb -0.13 -0.89 0.11 0.00 0.00 0.00 0.00 36.38 35.47 2kl4 s VAL 67 CO -0.09 0.25 0.91 -0.55 0.00 0.00 0.00 175.10 175.62 2kl4 s SER 68 N -0.44 -0.38 -0.05 3.32 0.15 -1.25 -0.52 113.70 114.54 2kl4 s SER 68 Ca 0.05 0.13 -0.16 0.00 0.70 0.00 0.00 55.95 56.67 2kl4 s SER 68 Cb -0.06 0.37 -0.11 0.00 -1.71 0.00 0.00 66.02 64.51 2kl4 s SER 68 CO -0.00 -0.54 0.67 1.55 1.20 0.00 0.00 173.24 176.11 2kl4 h PRO 69 N 2.19 -0.35 0.00 5.44 0.13 -1.85 -3.23 132.00 134.33 2kl4 h PRO 69 Ca -0.21 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 2kl4 h PRO 69 Cb 1.22 0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2kl4 h PRO 69 CO 0.31 -0.09 0.00 0.39 -0.23 0.00 0.00 178.00 178.39 2kl4 n GLU 70 N -5.02 0.00 0.00 0.86 1.02 -1.25 -3.00 120.64 113.25 2kl4 n GLU 70 Ca -0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 2kl4 n GLU 70 Cb 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.64 2kl4 n GLU 70 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 2kl4 n GLU 71 N -0.38 0.35 0.25 3.49 0.28 -1.26 -4.87 120.64 118.50 2kl4 n GLU 71 Ca 0.00 0.00 0.08 0.00 -0.16 0.00 0.00 57.16 57.08 2kl4 n GLU 71 Cb 0.00 -0.51 0.60 0.00 1.43 0.00 0.00 31.44 32.96 2kl4 n GLU 71 CO 0.00 0.00 0.00 0.97 -0.16 0.00 0.00 177.13 177.94 2kl4 h ILE 72 N 0.00 0.99 -0.36 3.84 2.10 -1.98 0.11 117.51 122.20 2kl4 h ILE 72 Ca 0.00 -0.35 0.11 0.00 1.08 0.00 0.00 64.86 65.70 2kl4 h ILE 72 Cb 0.02 1.19 -0.01 0.00 -1.09 0.00 0.00 36.82 36.93 2kl4 h ILE 72 CO 0.00 0.10 0.47 1.23 -1.08 0.00 0.00 178.15 178.87 2kl4 h GLY 73 N 0.33 0.00 -0.36 8.18 0.00 -1.97 -0.80 103.07 108.46 2kl4 h GLY 73 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2kl4 h GLY 73 CO 0.01 0.00 -0.43 1.39 0.00 0.00 0.00 176.54 177.51 2kl4 n ILE 74 N -3.52 0.00 0.00 2.60 2.08 0.35 -2.13 119.36 118.74 2kl4 n ILE 74 Ca 0.06 -0.29 0.00 0.00 0.56 0.00 0.00 62.75 63.09 2kl4 n ILE 74 Cb 0.63 1.09 0.00 0.00 -0.75 0.00 0.00 39.64 40.61 2kl4 n ILE 74 CO 0.00 0.00 0.00 -0.24 0.56 0.00 0.00 176.55 176.87 2kl4 n SER 75 N -0.66 0.00 -0.01 4.38 2.88 -0.35 -4.55 113.62 115.31 2kl4 n SER 75 Ca 0.04 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.38 2kl4 n SER 75 Cb 0.25 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.58 2kl4 n SER 75 CO 0.00 0.00 0.00 0.06 -1.23 0.00 0.00 175.04 173.87 2kl4 h GLN 76 N 0.00 0.19 0.00 -1.46 3.07 -1.73 -3.30 115.11 111.88 2kl4 h GLN 76 Ca 0.00 -0.33 -0.02 0.00 0.09 0.00 0.00 58.65 58.39 2kl4 h GLN 76 Cb 0.00 0.12 -0.00 0.00 0.08 0.00 0.00 27.48 27.68 2kl4 h GLN 76 CO 0.00 1.16 -0.10 0.74 0.09 0.00 0.00 178.83 180.72 2kl4 h PHE 77 N -0.52 0.00 -0.65 0.06 -1.00 -1.71 -2.91 116.94 110.22 2kl4 h PHE 77 Ca -0.22 0.00 0.15 0.00 2.81 0.00 0.00 57.97 60.72 2kl4 h PHE 77 Cb 1.55 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 41.08 2kl4 h PHE 77 CO 0.17 0.10 0.45 0.00 -1.61 0.00 0.00 178.31 177.41 2kl4 h ALA 78 N 1.90 2.31 -0.26 2.45 0.00 -1.50 -0.14 119.26 124.02 2kl4 h ALA 78 Ca -0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2kl4 h ALA 78 Cb 0.47 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2kl4 h ALA 78 CO 0.01 -0.48 -0.06 0.22 0.00 0.00 0.00 179.25 178.94 2kl4 h ASP 79 N 0.21 0.50 -0.59 0.00 3.58 -1.72 0.25 116.42 118.66 2kl4 h ASP 79 Ca 0.31 -0.36 -0.05 0.00 0.42 0.00 0.00 57.03 57.35 2kl4 h ASP 79 Cb 0.93 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 41.81 2kl4 h ASP 79 CO -0.06 0.75 0.19 0.00 -2.88 0.00 0.00 179.24 177.24 2kl4 h ALA 80 N 0.77 1.16 -0.41 -0.78 0.00 -1.25 -1.07 119.26 117.67 2kl4 h ALA 80 Ca 0.07 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 2kl4 h ALA 80 Cb 0.53 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2kl4 h ALA 80 CO 0.02 0.58 -0.03 0.82 0.00 0.00 0.00 179.25 180.65 2kl4 h ILE 81 N 0.92 1.27 -0.38 0.00 2.04 -1.01 -2.67 117.51 117.69 2kl4 h ILE 81 Ca 0.21 -1.08 0.01 0.00 1.00 0.00 0.00 64.86 65.00 2kl4 h ILE 81 Cb 0.27 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 2kl4 h ILE 81 CO -0.01 0.36 0.24 0.00 0.00 0.00 0.00 178.15 178.75 2kl4 h ALA 82 N 0.88 0.48 0.00 1.87 0.00 0.02 0.38 119.26 122.88 2kl4 h ALA 82 Ca 0.11 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2kl4 h ALA 82 Cb 0.53 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 2kl4 h ALA 82 CO 0.03 -0.08 -0.12 1.96 0.00 0.00 0.00 179.25 181.04 2kl4 h GLN 83 N 0.49 0.00 0.00 0.00 4.20 -1.24 -1.46 115.11 117.10 2kl4 h GLN 83 Ca 0.14 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.66 2kl4 h GLN 83 Cb -0.04 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.71 2kl4 h GLN 83 CO -0.04 0.12 -0.90 0.00 -0.67 0.00 0.00 178.83 177.34 2kl4 h ALA 84 N 1.88 0.45 0.00 3.87 0.00 -0.79 -3.48 119.26 121.18 2kl4 h ALA 84 Ca -0.00 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 54.09 2kl4 h ALA 84 Cb 0.35 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2kl4 h ALA 84 CO 0.02 1.12 0.00 0.41 0.00 0.00 0.00 179.25 180.79 2kl4 n GLY 85 N 1.25 1.82 3.55 0.00 0.00 -0.02 -5.10 105.19 106.68 2kl4 n GLY 85 Ca 0.00 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 2kl4 n GLY 85 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2kl4 s TYR 86 N 0.00 2.44 -2.00 1.61 2.02 -1.04 -4.83 117.35 115.56 2kl4 s TYR 86 Ca 0.00 0.04 0.00 0.00 -0.37 0.00 0.00 57.07 56.75 2kl4 s TYR 86 Cb 0.00 -4.53 0.03 0.00 -0.40 0.00 0.00 41.96 37.06 2kl4 s TYR 86 CO 0.00 -1.85 0.52 0.43 -1.57 0.00 0.00 175.55 173.08 2kl4 n SER 87 N 8.83 0.00 -1.05 2.29 7.64 -1.26 -3.54 113.62 126.53 2kl4 n SER 87 Ca 0.04 -0.97 0.05 0.00 1.01 0.00 0.00 58.87 59.01 2kl4 n SER 87 Cb 0.49 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.67 2kl4 n SER 87 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kl4 n ALA 88 N -0.52 -1.08 -2.44 -0.43 0.00 -1.26 -4.92 120.51 109.86 2kl4 n ALA 88 Ca 0.00 0.13 -0.27 0.00 0.00 0.00 0.00 53.44 53.30 2kl4 n ALA 88 Cb 0.00 -0.37 -0.01 0.00 0.00 0.00 0.00 19.45 19.07 2kl4 n ALA 88 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2kl4 s THR 89 N -0.64 1.52 -0.21 0.00 -4.23 0.12 -4.91 115.64 107.29 2kl4 s THR 89 Ca 0.00 -1.54 0.00 0.00 -1.18 0.00 0.00 61.69 58.97 2kl4 s THR 89 Cb 0.00 -2.07 0.00 0.00 1.34 0.00 0.00 72.50 71.77 2kl4 s THR 89 CO 0.00 0.00 0.31 0.29 -0.54 0.00 0.00 174.62 174.68 2kl4 n LYS 90 N -1.74 0.34 0.00 3.99 4.76 -1.26 -3.83 118.16 120.42 2kl4 n LYS 90 Ca -0.04 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.40 2kl4 n LYS 90 Cb 0.65 -1.30 0.00 0.00 -1.84 0.00 0.00 35.03 32.54 2kl4 n LYS 90 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2kl4 n GLY 91 N 0.72 0.08 3.83 0.72 0.00 -1.26 -5.17 105.19 104.12 2kl4 n GLY 91 Ca 0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 46.02 45.91 2kl4 n GLY 91 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2kl4 s LEU 92 N -1.25 -0.14 -0.24 0.99 0.05 -1.25 -4.90 118.68 111.94 2kl4 s LEU 92 Ca 0.00 -0.77 -0.06 0.00 0.05 0.00 0.00 54.13 53.35 2kl4 s LEU 92 Cb 0.00 2.65 -0.02 0.00 -2.05 0.00 0.00 46.19 46.77 2kl4 s LEU 92 CO 0.00 -1.38 0.02 0.72 -0.55 0.00 0.00 176.35 175.16 2kl4 s PHE 93 N -3.17 3.03 -0.10 3.48 -0.12 0.33 0.12 117.98 121.55 2kl4 s PHE 93 Ca 0.13 -0.69 -0.03 0.00 -0.05 0.00 0.00 56.93 56.30 2kl4 s PHE 93 Cb -0.05 -2.18 -0.03 0.00 -0.63 0.00 0.00 43.02 40.13 2kl4 s PHE 93 CO 0.08 -0.46 0.01 -0.98 -0.05 0.00 0.00 175.22 173.82 2kl4 s ARG 94 N 1.55 3.13 0.02 1.99 1.04 -1.26 -0.84 118.95 124.58 2kl4 s ARG 94 Ca 0.06 -0.39 0.06 0.00 -1.04 0.00 0.00 55.73 54.43 2kl4 s ARG 94 Cb -0.15 -2.86 -0.03 0.00 -2.04 0.00 0.00 34.95 29.87 2kl4 s ARG 94 CO 0.00 0.65 -0.18 0.42 -0.04 0.00 0.00 175.30 176.16 2kl4 s ILE 95 N -0.73 2.80 0.84 4.99 1.09 -1.20 -4.90 121.20 124.08 2kl4 s ILE 95 Ca 0.12 -1.09 -0.13 0.00 -1.10 0.00 0.00 60.65 58.45 2kl4 s ILE 95 Cb -0.12 -2.15 0.08 0.00 -1.06 0.00 0.00 42.46 39.21 2kl4 s ILE 95 CO 0.02 0.40 1.07 -0.81 -0.10 0.00 0.00 174.94 175.52 2kl4 n PRO 96 N 1.75 0.03 0.29 2.79 -0.04 -1.26 -3.17 135.00 135.39 2kl4 n PRO 96 Ca -0.16 0.08 0.15 0.00 -0.04 0.00 0.00 63.50 63.53 2kl4 n PRO 96 Cb 0.52 -2.33 0.89 0.00 -0.04 0.00 0.00 33.50 32.54 2kl4 n PRO 96 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2kl4 h TRP 97 N -1.11 0.00 0.21 0.54 -0.00 -1.52 -3.21 115.95 110.87 2kl4 h TRP 97 Ca -0.45 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 58.43 2kl4 h TRP 97 Cb 1.30 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.46 2kl4 h TRP 97 CO 0.45 0.00 -0.10 -0.97 -0.00 0.00 0.00 178.44 177.82 2kl4 h ASN 98 N 0.00 -0.24 -4.10 -3.49 -1.24 -1.91 -3.46 115.58 101.13 2kl4 h ASN 98 Ca 0.01 0.01 -0.48 0.00 0.71 0.00 0.00 56.30 56.55 2kl4 h ASN 98 Cb 0.05 0.06 0.07 0.00 0.73 0.00 0.00 38.32 39.24 2kl4 h ASN 98 CO -0.00 -0.17 0.30 -1.81 -1.29 0.00 0.00 177.43 174.46 2kl4 s ASP 99 N -2.42 5.46 0.21 1.15 1.11 -1.21 -5.02 116.67 115.95 2kl4 s ASP 99 Ca -0.04 0.92 -0.29 0.00 0.18 0.00 0.00 52.55 53.32 2kl4 s ASP 99 Cb 0.00 -1.79 -0.08 0.00 1.07 0.00 0.00 42.92 42.12 2kl4 s ASP 99 CO 0.13 -1.25 0.91 -2.16 1.18 0.00 0.00 175.17 173.98 2kl4 s PRO 100 N -5.20 4.78 -0.24 8.23 0.04 -1.26 -4.72 135.00 136.62 2kl4 s PRO 100 Ca 0.56 1.41 -0.29 0.00 0.04 0.00 0.00 61.00 62.73 2kl4 s PRO 100 Cb -0.11 -3.29 -0.01 0.00 0.04 0.00 0.00 34.50 31.13 2kl4 s PRO 100 CO 0.49 0.50 1.44 0.08 0.04 0.00 0.00 177.00 179.54 2kl4 s VAL 101 N -1.05 3.95 -0.90 -0.36 1.01 -1.26 -4.95 120.40 116.84 2kl4 s VAL 101 Ca 0.40 1.09 -0.25 0.00 0.00 0.00 0.00 61.98 63.22 2kl4 s VAL 101 Cb -0.25 -3.92 -0.06 0.00 0.00 0.00 0.00 36.38 32.14 2kl4 s VAL 101 CO 0.30 -0.34 2.01 -2.28 0.00 0.00 0.00 175.10 174.79 2kl4 s HIS 102 N 4.58 1.72 0.27 5.22 2.46 -1.26 -4.81 115.29 123.47 2kl4 s HIS 102 Ca 0.63 0.82 -0.02 0.00 0.47 0.00 0.00 55.06 56.95 2kl4 s HIS 102 Cb -0.21 -3.96 0.41 0.00 -0.13 0.00 0.00 32.58 28.69 2kl4 s HIS 102 CO 0.25 -1.68 1.91 1.88 -2.47 0.00 0.00 174.74 174.62 2kl4 h TYR 103 N 11.39 1.17 -0.49 3.88 -1.99 -1.98 -2.39 116.97 126.55 2kl4 h TYR 103 Ca 0.09 0.03 -0.11 0.00 2.00 0.00 0.00 58.73 60.74 2kl4 h TYR 103 Cb 1.00 -0.39 -0.02 0.00 2.00 0.00 0.00 36.73 39.32 2kl4 h TYR 103 CO 1.21 0.65 -0.11 1.49 -0.00 0.00 0.00 178.16 181.39 2kl4 h GLU 104 N 1.18 0.92 -0.06 4.88 4.81 -1.99 0.17 114.58 124.49 2kl4 h GLU 104 Ca 0.40 -0.33 -0.03 0.00 -0.13 0.00 0.00 59.36 59.27 2kl4 h GLU 104 Cb 0.08 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 2kl4 h GLU 104 CO -0.14 0.98 -0.08 1.25 -0.73 0.00 0.00 179.01 180.29 2kl4 h LEU 105 N 0.82 0.17 -1.04 1.64 7.12 -1.95 -3.22 115.31 118.85 2kl4 h LEU 105 Ca 0.13 -0.53 -0.08 0.00 0.13 0.00 0.00 57.88 57.54 2kl4 h LEU 105 Cb 0.64 -0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 40.71 2kl4 h LEU 105 CO 0.04 0.66 -0.36 0.17 -0.13 0.00 0.00 178.44 178.83 2kl4 h LEU 106 N -0.32 0.00 -0.40 2.25 8.10 -1.23 -2.73 115.31 120.98 2kl4 h LEU 106 Ca 0.01 0.00 -0.07 0.00 0.11 0.00 0.00 57.88 57.92 2kl4 h LEU 106 Cb 0.63 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.83 2kl4 h LEU 106 CO 0.02 0.36 -0.04 0.07 -4.11 0.00 0.00 178.44 174.74 2kl4 h LYS 107 N 0.00 0.74 -0.18 0.17 2.10 -0.76 -2.99 116.57 115.65 2kl4 h LYS 107 Ca -0.00 -0.26 0.05 0.00 -2.00 0.00 0.00 60.65 58.44 2kl4 h LYS 107 Cb 0.83 -0.06 -0.06 0.00 -0.90 0.00 0.00 32.23 32.05 2kl4 h LYS 107 CO 0.05 0.84 -0.18 1.96 -2.00 0.00 0.00 179.45 180.12 2kl4 h GLN 108 N 0.56 -0.20 -0.21 0.07 4.20 -1.49 -0.07 115.11 117.97 2kl4 h GLN 108 Ca 0.11 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.82 2kl4 h GLN 108 Cb 0.54 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 2kl4 h GLN 108 CO 0.03 -0.13 0.09 0.00 -0.67 0.00 0.00 178.83 178.15 2kl4 h MET 109 N -0.20 0.32 -0.47 1.46 -0.00 -1.62 -0.24 114.93 114.17 2kl4 h MET 109 Ca 0.11 -0.05 -0.06 0.00 -0.00 0.00 0.00 59.70 59.70 2kl4 h MET 109 Cb 0.37 -0.05 -0.02 0.00 -0.00 0.00 0.00 31.60 31.90 2kl4 h MET 109 CO -0.30 0.36 0.07 0.97 -0.00 0.00 0.00 176.91 178.02 2kl4 h ILE 110 N 0.20 1.25 -0.43 -0.10 -0.00 -1.31 -1.22 117.51 115.90 2kl4 h ILE 110 Ca 0.07 -0.92 -0.02 0.00 -0.00 0.00 0.00 64.86 63.99 2kl4 h ILE 110 Cb 0.16 0.93 -0.02 0.00 -0.00 0.00 0.00 36.82 37.89 2kl4 h ILE 110 CO -0.01 0.33 0.18 -0.33 -0.00 0.00 0.00 178.15 178.32 2kl4 h GLU 111 N 0.66 0.63 -0.52 2.19 5.08 -0.89 -2.06 114.58 119.66 2kl4 h GLU 111 Ca 0.14 -0.11 0.06 0.00 -1.00 0.00 0.00 59.36 58.45 2kl4 h GLU 111 Cb 0.39 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.49 2kl4 h GLU 111 CO 0.01 0.57 0.23 0.35 -1.00 0.00 0.00 179.01 179.17 2kl4 h PHE 112 N 0.54 0.42 0.00 4.33 3.57 -0.96 -2.20 116.94 122.65 2kl4 h PHE 112 Ca 0.14 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.66 2kl4 h PHE 112 Cb 0.17 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.80 2kl4 h PHE 112 CO -0.00 0.18 -0.02 -0.91 -2.23 0.00 0.00 178.31 175.33 2kl4 h ASN 113 N 0.45 0.00 0.06 0.41 4.21 -0.50 0.36 115.58 120.57 2kl4 h ASN 113 Ca 0.24 0.00 -0.12 0.00 1.21 0.00 0.00 56.30 57.63 2kl4 h ASN 113 Cb 0.20 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.40 2kl4 h ASN 113 CO -0.20 0.02 -0.60 0.40 -1.29 0.00 0.00 177.43 175.75 2kl4 h ILE 114 N 0.00 1.49 0.00 2.81 2.04 -1.17 -3.18 117.51 119.50 2kl4 h ILE 114 Ca -0.00 -2.39 0.00 0.00 1.00 0.00 0.00 64.86 63.47 2kl4 h ILE 114 Cb 0.10 3.09 0.00 0.00 -0.74 0.00 0.00 36.82 39.27 2kl4 h ILE 114 CO 0.00 0.61 0.00 0.06 0.00 0.00 0.00 178.15 178.83 2kl4 h GLN 115 N -0.72 0.00 0.00 2.37 3.07 -0.89 -1.80 115.11 117.14 2kl4 h GLN 115 Ca -0.13 0.00 -0.15 0.00 0.09 0.00 0.00 58.65 58.46 2kl4 h GLN 115 Cb 1.34 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.87 2kl4 h GLN 115 CO 0.02 0.00 -0.72 0.22 0.09 0.00 0.00 178.83 178.45 2kl4 h ASP 116 N 0.00 0.00 -1.20 0.06 3.58 -1.09 -3.25 116.42 114.51 2kl4 h ASP 116 Ca 0.00 0.00 -0.66 0.00 0.42 0.00 0.00 57.03 56.79 2kl4 h ASP 116 Cb 0.53 0.00 -0.33 0.00 1.72 0.00 0.00 39.33 41.25 2kl4 h ASP 116 CO 0.00 0.72 0.40 0.29 -2.88 0.00 0.00 179.24 177.77 2kl4 n LYS 117 N -3.52 2.97 0.00 0.28 4.76 -0.69 -5.09 118.16 116.87 2kl4 n LYS 117 Ca -0.00 -3.64 0.02 0.00 -2.87 0.00 0.00 58.31 51.82 2kl4 n LYS 117 Cb 0.74 -2.28 0.13 0.00 -1.84 0.00 0.00 35.03 31.78 2kl4 n LYS 117 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42