#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kp0 h PHE 7 N 0.00 0.54 0.00 -0.67 3.57 -2.05 -2.56 116.94 115.77 3kp0 h PHE 7 Ca 0.00 -0.11 0.00 0.00 3.53 0.00 0.00 57.97 61.39 3kp0 h PHE 7 Cb 0.00 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.60 3kp0 h PHE 7 CO 0.00 0.67 0.00 0.37 -2.23 0.00 0.00 178.31 177.12 3kp0 h GLN 8 N 0.44 0.00 -0.00 1.11 5.75 -2.06 -2.61 115.11 117.74 3kp0 h GLN 8 Ca 0.07 0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.52 3kp0 h GLN 8 Cb 0.62 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.18 3kp0 h GLN 8 CO 0.04 0.00 -0.18 1.96 -2.65 0.00 0.00 178.83 178.00 3kp0 h GLN 9 N 0.00 0.12 0.00 1.69 4.20 -1.96 -3.38 115.11 115.79 3kp0 h GLN 9 Ca 0.00 -0.13 -0.09 0.00 0.06 0.00 0.00 58.65 58.49 3kp0 h GLN 9 Cb 0.81 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.61 3kp0 h GLN 9 CO 0.00 0.88 -0.42 0.00 -0.67 0.00 0.00 178.83 178.62 3kp0 h ARG 10 N -0.58 0.00 -0.00 1.46 3.08 -1.40 -3.07 114.38 113.86 3kp0 h ARG 10 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3kp0 h ARG 10 Cb 0.94 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.99 3kp0 h ARG 10 CO 0.04 0.42 -0.05 2.89 -1.07 0.00 0.00 179.97 182.20 3kp0 n ARG 11 N -3.34 0.78 -0.20 0.04 1.85 -0.99 -4.33 116.66 110.46 3kp0 n ARG 11 Ca 0.01 -0.18 -0.03 0.00 -1.00 0.00 0.00 57.85 56.65 3kp0 n ARG 11 Cb 0.62 -1.50 0.03 0.00 -1.05 0.00 0.00 32.46 30.57 3kp0 n ARG 11 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3kp0 h ALA 12 N 3.72 0.17 0.00 2.89 0.00 -1.71 0.36 119.26 124.69 3kp0 h ALA 12 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3kp0 h ALA 12 Cb 0.27 0.64 0.00 0.00 0.00 0.00 0.00 17.79 18.69 3kp0 h ALA 12 CO 0.00 -0.56 0.00 -2.39 0.00 0.00 0.00 179.25 176.30 3kp0 n HIS 13 N -5.44 0.00 0.02 0.00 1.44 -1.26 -2.06 115.22 107.92 3kp0 n HIS 13 Ca 0.06 0.00 0.04 0.00 -2.01 0.00 0.00 57.72 55.81 3kp0 n HIS 13 Cb 0.35 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.39 3kp0 n HIS 13 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3kp0 n LEU 14 N -0.66 0.02 -0.33 2.39 4.77 0.09 -4.70 117.00 118.58 3kp0 n LEU 14 Ca 0.05 -0.03 0.30 0.00 -0.03 0.00 0.00 56.01 56.31 3kp0 n LEU 14 Cb 0.02 0.00 0.64 0.00 -2.33 0.00 0.00 43.42 41.76 3kp0 n LEU 14 CO 0.04 0.00 1.27 0.00 -1.33 0.00 0.00 177.39 177.38 3kp0 h ALA 15 N 0.77 2.73 -0.01 -1.18 0.00 -1.17 -0.59 119.26 119.82 3kp0 h ALA 15 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3kp0 h ALA 15 Cb 0.37 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3kp0 h ALA 15 CO 0.00 -1.12 -0.34 0.09 0.00 0.00 0.00 179.25 177.88 3kp0 n ASN 16 N -4.40 1.37 -4.74 0.00 5.03 -1.26 -4.92 115.26 106.34 3kp0 n ASN 16 Ca 0.26 -1.10 -0.41 0.00 0.87 0.00 0.00 54.58 54.20 3kp0 n ASN 16 Cb 1.11 0.27 -0.05 0.00 -1.02 0.00 0.00 39.78 40.09 3kp0 n ASN 16 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3kp0 s LEU 17 N -2.50 4.53 0.74 3.41 1.43 -0.23 -5.05 118.68 121.01 3kp0 s LEU 17 Ca 0.22 1.90 -0.11 0.00 -1.03 0.00 0.00 54.13 55.12 3kp0 s LEU 17 Cb 0.19 -3.60 0.04 0.00 0.03 0.00 0.00 46.19 42.85 3kp0 s LEU 17 CO 0.54 -0.06 1.08 -0.94 0.23 0.00 0.00 176.35 177.20 3kp0 s SER 18 N -0.26 4.87 0.34 2.29 1.04 -1.26 -4.78 113.70 115.94 3kp0 s SER 18 Ca 0.46 1.71 0.09 0.00 0.48 0.00 0.00 55.95 58.69 3kp0 s SER 18 Cb -0.25 -2.49 0.82 0.00 0.10 0.00 0.00 66.02 64.21 3kp0 s SER 18 CO 0.32 -1.78 1.83 0.44 0.98 0.00 0.00 173.24 175.02 3kp0 h ASP 19 N -0.95 0.68 0.08 7.02 3.32 -1.98 0.20 116.42 124.78 3kp0 h ASP 19 Ca -0.44 0.06 -0.21 0.00 0.02 0.00 0.00 57.03 56.47 3kp0 h ASP 19 Cb 1.22 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.71 3kp0 h ASP 19 CO 0.54 0.29 -0.77 -0.33 -1.72 0.00 0.00 179.24 177.25 3kp0 h GLU 20 N 0.69 0.59 0.17 3.56 3.07 -1.99 -0.95 114.58 119.71 3kp0 h GLU 20 Ca 0.51 -0.49 -0.01 0.00 -0.50 0.00 0.00 59.36 58.87 3kp0 h GLU 20 Cb 0.88 0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.90 3kp0 h GLU 20 CO -0.27 1.11 -0.08 0.93 -1.40 0.00 0.00 179.01 179.30 3kp0 h GLU 21 N 0.39 -0.22 0.02 2.33 5.08 -1.46 -2.48 114.58 118.25 3kp0 h GLU 21 Ca -0.05 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.36 3kp0 h GLU 21 Cb 1.38 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 30.63 3kp0 h GLU 21 CO 0.15 -0.10 -0.30 1.25 -1.00 0.00 0.00 179.01 179.00 3kp0 h LEU 22 N -0.28 -0.90 -0.85 1.33 5.85 -0.54 -0.91 115.31 119.01 3kp0 h LEU 22 Ca -0.02 0.12 0.21 0.00 0.84 0.00 0.00 57.88 59.03 3kp0 h LEU 22 Cb 0.22 0.36 -0.13 0.00 0.37 0.00 0.00 40.66 41.48 3kp0 h LEU 22 CO 0.04 -0.37 0.24 -0.61 -0.34 0.00 0.00 178.44 177.39 3kp0 h GLN 23 N -0.47 0.24 -0.52 1.25 4.15 -1.16 0.15 115.11 118.74 3kp0 h GLN 23 Ca 0.06 -0.01 -0.09 0.00 0.77 0.00 0.00 58.65 59.37 3kp0 h GLN 23 Cb 0.54 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.16 3kp0 h GLN 23 CO -0.24 0.16 -0.03 1.15 -1.93 0.00 0.00 178.83 177.94 3kp0 h THR 24 N 0.25 1.26 0.00 2.39 2.02 -0.72 -0.63 112.91 117.48 3kp0 h THR 24 Ca 0.52 -1.12 -0.13 0.00 0.77 0.00 0.00 66.41 66.45 3kp0 h THR 24 Cb 1.01 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 68.28 3kp0 h THR 24 CO -0.61 0.40 -0.64 -0.09 0.37 0.00 0.00 175.52 174.95 3kp0 h ARG 25 N 0.83 0.00 0.24 6.66 2.43 -0.17 0.39 114.38 124.77 3kp0 h ARG 25 Ca 0.15 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.31 3kp0 h ARG 25 Cb 0.54 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 3kp0 h ARG 25 CO 0.03 0.64 -0.11 0.35 -1.51 0.00 0.00 179.97 179.36 3kp0 h PHE 26 N 0.00 -0.30 -0.00 2.20 3.57 0.02 -2.44 116.94 120.00 3kp0 h PHE 26 Ca -0.01 -0.01 -0.17 0.00 3.53 0.00 0.00 57.97 61.31 3kp0 h PHE 26 Cb 1.14 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.96 3kp0 h PHE 26 CO 0.00 -0.05 -0.80 -1.49 -2.23 0.00 0.00 178.31 173.74 3kp0 h TRP 27 N -0.52 0.11 0.00 0.41 4.06 -1.09 -2.11 115.95 116.81 3kp0 h TRP 27 Ca -0.03 -0.06 0.00 0.00 2.06 0.00 0.00 58.89 60.86 3kp0 h TRP 27 Cb 0.39 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 28.53 3kp0 h TRP 27 CO -0.01 0.84 0.00 1.05 -3.56 0.00 0.00 178.44 176.77 3kp0 h GLU 28 N 0.04 0.00 0.20 0.49 4.11 -0.96 -1.27 114.58 117.19 3kp0 h GLU 28 Ca -0.02 0.00 -0.35 0.00 0.07 0.00 0.00 59.36 59.06 3kp0 h GLU 28 Cb 1.41 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.68 3kp0 h GLU 28 CO 0.11 0.00 -1.68 0.52 0.07 0.00 0.00 179.01 178.04 3kp0 h MET 29 N 0.00 0.43 -0.41 1.06 2.86 -1.31 -2.77 114.93 114.79 3kp0 h MET 29 Ca 0.00 -0.73 0.08 0.00 -2.06 0.00 0.00 59.70 57.00 3kp0 h MET 29 Cb 0.68 0.27 -0.08 0.00 0.06 0.00 0.00 31.60 32.52 3kp0 h MET 29 CO 0.00 1.34 -0.15 0.00 1.06 0.00 0.00 176.91 179.16 3kp0 h ALA 30 N 0.15 0.19 -0.56 6.32 0.00 -1.18 0.15 119.26 124.33 3kp0 h ALA 30 Ca -0.32 0.15 0.11 0.00 0.00 0.00 0.00 54.91 54.86 3kp0 h ALA 30 Cb 2.12 0.40 -0.09 0.00 0.00 0.00 0.00 17.79 20.21 3kp0 h ALA 30 CO 0.20 -0.50 0.02 1.49 0.00 0.00 0.00 179.25 180.45 3kp0 h GLU 31 N -0.06 0.13 -0.30 0.00 4.81 -1.33 -1.14 114.58 116.68 3kp0 h GLU 31 Ca 0.20 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.46 3kp0 h GLU 31 Cb 0.37 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 3kp0 h GLU 31 CO -0.46 0.09 0.20 0.87 -0.73 0.00 0.00 179.01 178.98 3kp0 h LYS 32 N 0.13 0.22 0.18 1.92 1.57 -0.47 -2.24 116.57 117.88 3kp0 h LYS 32 Ca 0.29 -0.01 -0.35 0.00 -1.87 0.00 0.00 60.65 58.70 3kp0 h LYS 32 Cb 0.45 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.71 3kp0 h LYS 32 CO -0.46 0.14 -1.77 0.82 -0.57 0.00 0.00 179.45 177.62 3kp0 h ILE 33 N 0.22 0.90 0.00 1.86 2.04 0.11 -3.36 117.51 119.28 3kp0 h ILE 33 Ca 0.13 -2.49 -0.13 0.00 1.00 0.00 0.00 64.86 63.37 3kp0 h ILE 33 Cb 0.23 2.74 -0.02 0.00 -0.74 0.00 0.00 36.82 39.02 3kp0 h ILE 33 CO -0.02 0.86 -0.63 -0.37 0.00 0.00 0.00 178.15 177.99 3kp0 h VAL 34 N 0.08 1.00 -0.55 1.67 -1.51 -1.31 -3.40 116.25 112.24 3kp0 h VAL 34 Ca -0.35 -2.43 0.09 0.00 -1.23 0.00 0.00 66.70 62.78 3kp0 h VAL 34 Cb 2.08 2.49 -0.11 0.00 -2.13 0.00 0.00 31.29 33.62 3kp0 h VAL 34 CO 0.16 0.57 -0.41 0.44 -1.23 0.00 0.00 177.57 177.10 3kp0 h ASP 35 N 0.00 -1.42 0.63 4.19 3.32 -1.55 0.72 116.42 122.31 3kp0 h ASP 35 Ca -0.01 0.24 0.00 0.00 0.02 0.00 0.00 57.03 57.28 3kp0 h ASP 35 Cb 1.46 0.65 0.00 0.00 0.22 0.00 0.00 39.33 41.66 3kp0 h ASP 35 CO 0.08 -0.33 0.00 1.55 -1.72 0.00 0.00 179.24 178.81 3kp0 h PRO 36 N -0.23 0.00 0.04 3.56 0.13 -1.80 -1.35 132.00 132.36 3kp0 h PRO 36 Ca 0.18 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.31 3kp0 h PRO 36 Cb 0.56 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.69 3kp0 h PRO 36 CO -0.67 0.00 -0.02 -0.07 -0.23 0.00 0.00 178.00 177.01 3kp0 h LEU 37 N 0.00 -0.05 -0.98 1.56 3.38 -1.12 0.89 115.31 119.00 3kp0 h LEU 37 Ca 0.00 -0.55 0.23 0.00 0.09 0.00 0.00 57.88 57.65 3kp0 h LEU 37 Cb 0.32 0.01 -0.12 0.00 0.09 0.00 0.00 40.66 40.96 3kp0 h LEU 37 CO 0.00 0.55 0.55 -0.07 0.09 0.00 0.00 178.44 179.56 3kp0 h LEU 38 N -0.68 0.61 0.28 1.67 3.38 -1.10 0.58 115.31 120.05 3kp0 h LEU 38 Ca -0.01 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 3kp0 h LEU 38 Cb 0.60 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.39 3kp0 h LEU 38 CO 0.01 0.10 -0.14 -0.78 0.09 0.00 0.00 178.44 177.72 3kp0 h ASP 39 N 0.56 -0.32 -1.18 -0.43 3.58 -1.08 -1.49 116.42 116.05 3kp0 h ASP 39 Ca 0.62 -0.13 0.34 0.00 0.42 0.00 0.00 57.03 58.27 3kp0 h ASP 39 Cb 1.14 0.08 -0.09 0.00 1.72 0.00 0.00 39.33 42.19 3kp0 h ASP 39 CO -0.47 -0.05 0.80 -0.07 -2.88 0.00 0.00 179.24 176.57 3kp0 h LEU 40 N -0.61 0.25 -0.20 2.28 3.38 -0.01 -2.21 115.31 118.20 3kp0 h LEU 40 Ca -0.04 0.06 -0.21 0.00 0.09 0.00 0.00 57.88 57.78 3kp0 h LEU 40 Cb 0.44 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 3kp0 h LEU 40 CO 0.06 0.00 -0.94 1.23 0.09 0.00 0.00 178.44 178.89 3kp0 h GLY 41 N 0.19 0.28 1.53 0.83 0.00 -0.15 -3.16 103.07 102.59 3kp0 h GLY 41 Ca 0.65 -0.51 -0.19 0.00 0.00 0.00 0.00 47.33 47.27 3kp0 h GLY 41 CO -0.22 0.45 -0.75 0.50 0.00 0.00 0.00 176.54 176.53 3kp0 h LYS 42 N 0.13 0.46 -0.37 4.80 1.57 -0.69 -3.35 116.57 119.11 3kp0 h LYS 42 Ca -0.06 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 3kp0 h LYS 42 Cb 1.58 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.97 3kp0 h LYS 42 CO 0.15 1.02 0.00 1.63 -0.57 0.00 0.00 179.45 181.67 3kp0 n LYS 43 N -3.84 2.12 -4.06 3.15 5.02 -1.01 -4.95 118.16 114.58 3kp0 n LYS 43 Ca -0.05 -1.71 -0.10 0.00 -2.02 0.00 0.00 58.31 54.43 3kp0 n LYS 43 Cb 0.72 -1.42 -0.08 0.00 -0.02 0.00 0.00 35.03 34.23 3kp0 n LYS 43 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3kp0 s ASN 44 N -1.29 0.08 0.30 4.39 0.01 -1.20 -5.07 114.94 112.16 3kp0 s ASN 44 Ca 0.34 -1.07 0.03 0.00 -0.71 0.00 0.00 52.86 51.45 3kp0 s ASN 44 Cb 0.19 0.43 -0.04 0.00 0.41 0.00 0.00 41.25 42.24 3kp0 s ASN 44 CO 0.26 -0.91 0.12 0.28 -1.51 0.00 0.00 177.10 175.34 3kp0 s THR 45 N -4.04 0.54 0.19 1.60 -1.32 -1.26 -4.91 115.64 106.44 3kp0 s THR 45 Ca 0.25 -2.00 -0.05 0.00 -1.21 0.00 0.00 61.69 58.68 3kp0 s THR 45 Cb 0.04 -2.58 -0.03 0.00 -1.51 0.00 0.00 72.50 68.43 3kp0 s THR 45 CO 0.05 0.00 0.22 0.42 -2.21 0.00 0.00 174.62 173.10 3kp0 s THR 46 N -3.59 0.04 0.23 5.08 -4.23 -1.26 -5.04 115.64 106.87 3kp0 s THR 46 Ca 0.35 -1.73 -0.08 0.00 -1.18 0.00 0.00 61.69 59.05 3kp0 s THR 46 Cb 0.06 -2.20 0.21 0.00 1.34 0.00 0.00 72.50 71.91 3kp0 s THR 46 CO 0.15 -0.16 1.68 -0.65 -0.54 0.00 0.00 174.62 175.10 3kp0 h PRO 47 N 2.58 0.20 0.00 3.99 0.11 -1.99 -0.83 132.00 136.07 3kp0 h PRO 47 Ca -0.33 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.70 3kp0 h PRO 47 Cb 1.23 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3kp0 h PRO 47 CO 0.50 0.13 -0.31 0.66 -0.21 0.00 0.00 178.00 178.77 3kp0 h SER 48 N 0.21 0.00 0.22 -2.05 4.64 -1.98 0.14 113.55 114.72 3kp0 h SER 48 Ca 0.36 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.36 3kp0 h SER 48 Cb 0.59 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.71 3kp0 h SER 48 CO -0.49 0.31 -1.39 0.40 -0.87 0.00 0.00 176.83 174.79 3kp0 h ILE 49 N 0.00 1.29 -0.33 0.95 2.04 -1.74 -1.38 117.51 118.33 3kp0 h ILE 49 Ca -0.00 -2.62 -0.02 0.00 1.00 0.00 0.00 64.86 63.21 3kp0 h ILE 49 Cb 0.56 2.91 -0.01 0.00 -0.74 0.00 0.00 36.82 39.54 3kp0 h ILE 49 CO 0.04 0.79 0.11 -0.33 0.00 0.00 0.00 178.15 178.76 3kp0 h GLU 50 N 0.20 0.51 -0.08 2.37 4.39 -0.82 -0.75 114.58 120.40 3kp0 h GLU 50 Ca -0.23 -0.10 0.03 0.00 0.34 0.00 0.00 59.36 59.39 3kp0 h GLU 50 Cb 2.08 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 30.62 3kp0 h GLU 50 CO 0.26 0.53 -0.10 0.00 -1.16 0.00 0.00 179.01 178.55 3kp0 h ARG 51 N 0.38 -0.13 -0.99 2.33 3.08 -0.80 -2.26 114.38 116.01 3kp0 h ARG 51 Ca 0.11 0.01 0.10 0.00 0.07 0.00 0.00 59.98 60.27 3kp0 h ARG 51 Cb 0.23 0.03 -0.08 0.00 0.08 0.00 0.00 29.97 30.23 3kp0 h ARG 51 CO -0.01 -0.08 0.62 0.66 -1.07 0.00 0.00 179.97 180.09 3kp0 h SER 52 N -0.13 0.94 -0.59 7.04 4.64 -1.11 0.96 113.55 125.29 3kp0 h SER 52 Ca 0.06 0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.38 3kp0 h SER 52 Cb 0.22 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.13 3kp0 h SER 52 CO -0.15 0.53 0.22 0.58 -0.87 0.00 0.00 176.83 177.14 3kp0 h VAL 53 N 1.03 1.23 0.01 0.95 2.07 -0.71 -2.69 116.25 118.13 3kp0 h VAL 53 Ca 0.47 -0.74 -0.20 0.00 0.82 0.00 0.00 66.70 67.05 3kp0 h VAL 53 Cb 0.39 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 3kp0 h VAL 53 CO -0.24 0.29 -0.91 -0.07 0.02 0.00 0.00 177.57 176.66 3kp0 h LEU 54 N 0.90 0.11 -2.05 2.57 3.38 -0.67 -2.46 115.31 117.09 3kp0 h LEU 54 Ca 0.21 -0.10 0.12 0.00 0.09 0.00 0.00 57.88 58.19 3kp0 h LEU 54 Cb 0.21 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 3kp0 h LEU 54 CO -0.01 0.96 0.36 -0.07 0.09 0.00 0.00 178.44 179.77 3kp0 h LEU 55 N 0.04 0.00 0.00 1.67 3.38 -0.55 -1.20 115.31 118.66 3kp0 h LEU 55 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3kp0 h LEU 55 Cb 1.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.33 3kp0 h LEU 55 CO 0.13 0.00 -0.74 0.54 0.09 0.00 0.00 178.44 178.45 3kp0 n ARG 56 N -3.97 0.08 0.05 1.13 1.74 -0.94 -3.78 116.66 110.97 3kp0 n ARG 56 Ca 0.07 0.00 0.11 0.00 -0.77 0.00 0.00 57.85 57.26 3kp0 n ARG 56 Cb 0.54 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.43 3kp0 n ARG 56 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 3kp0 n MET 57 N -1.63 0.52 0.00 5.56 2.81 -0.47 -4.96 117.12 118.95 3kp0 n MET 57 Ca 0.04 0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.94 3kp0 n MET 57 Cb 0.36 -1.69 0.00 0.00 -0.71 0.00 0.00 33.22 31.18 3kp0 n MET 57 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3kp0 n GLY 58 N 1.26 1.43 3.46 3.03 0.00 -1.09 -4.89 105.19 108.39 3kp0 n GLY 58 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 3kp0 n GLY 58 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kp0 s PHE 59 N -1.82 2.51 0.93 1.61 0.08 -1.10 -4.95 117.98 115.24 3kp0 s PHE 59 Ca 0.00 -0.28 -0.12 0.00 0.12 0.00 0.00 56.93 56.65 3kp0 s PHE 59 Cb 0.00 -1.37 0.15 0.00 -0.57 0.00 0.00 43.02 41.23 3kp0 s PHE 59 CO 0.00 0.33 1.13 -1.54 -0.10 0.00 0.00 175.22 175.04 3kp0 s SER 60 N -1.91 3.33 0.44 1.36 1.04 -1.26 -4.40 113.70 112.29 3kp0 s SER 60 Ca 0.16 1.00 0.17 0.00 0.48 0.00 0.00 55.95 57.77 3kp0 s SER 60 Cb -0.10 -1.60 1.00 0.00 0.10 0.00 0.00 66.02 65.42 3kp0 s SER 60 CO 0.08 -2.67 1.94 0.77 0.98 0.00 0.00 173.24 174.34 3kp0 h SER 61 N -1.58 0.00 0.69 7.02 4.64 -1.98 -0.77 113.55 121.57 3kp0 h SER 61 Ca -0.51 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.77 3kp0 h SER 61 Cb 1.33 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.43 3kp0 h SER 61 CO 0.61 0.24 -0.33 -0.07 -0.87 0.00 0.00 176.83 176.41 3kp0 h LEU 62 N 0.00 -0.79 -0.60 5.97 3.38 -1.98 -0.28 115.31 121.01 3kp0 h LEU 62 Ca -0.00 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.07 3kp0 h LEU 62 Cb 0.46 0.20 -0.11 0.00 0.09 0.00 0.00 40.66 41.31 3kp0 h LEU 62 CO 0.03 -0.41 -0.46 -0.33 0.09 0.00 0.00 178.44 177.36 3kp0 h GLU 63 N -1.23 -0.22 0.00 1.13 5.08 -1.89 -0.17 114.58 117.28 3kp0 h GLU 63 Ca -0.09 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 3kp0 h GLU 63 Cb 0.72 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.02 3kp0 h GLU 63 CO 0.16 -0.15 -0.03 0.00 -1.00 0.00 0.00 179.01 177.99 3kp0 h ALA 64 N 0.55 1.90 0.00 3.43 0.00 -1.17 -0.35 119.26 123.63 3kp0 h ALA 64 Ca 0.17 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 3kp0 h ALA 64 Cb 0.56 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3kp0 h ALA 64 CO -0.71 0.04 -0.41 -0.22 0.00 0.00 0.00 179.25 177.95 3kp0 h LYS 65 N 0.00 0.00 0.05 0.00 1.63 0.74 -2.68 116.57 116.31 3kp0 h LYS 65 Ca -0.00 0.00 -0.22 0.00 -0.85 0.00 0.00 60.65 59.58 3kp0 h LYS 65 Cb 0.05 0.00 0.02 0.00 -0.60 0.00 0.00 32.23 31.70 3kp0 h LYS 65 CO 0.00 0.41 -0.88 0.00 -3.45 0.00 0.00 179.45 175.53 3kp0 h ALA 66 N 1.59 0.04 0.39 5.00 0.00 -0.13 -2.90 119.26 123.26 3kp0 h ALA 66 Ca -0.00 -0.66 -0.02 0.00 0.00 0.00 0.00 54.91 54.22 3kp0 h ALA 66 Cb 0.88 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3kp0 h ALA 66 CO 0.05 0.51 -0.19 0.82 0.00 0.00 0.00 179.25 180.44 3kp0 h ILE 67 N 0.06 0.52 -0.07 0.00 2.04 -1.42 -2.35 117.51 116.29 3kp0 h ILE 67 Ca -0.12 -0.54 0.02 0.00 1.00 0.00 0.00 64.86 65.22 3kp0 h ILE 67 Cb 1.59 0.75 -0.00 0.00 -0.74 0.00 0.00 36.82 38.42 3kp0 h ILE 67 CO 0.17 0.09 0.06 0.58 0.00 0.00 0.00 178.15 179.05 3kp0 h VAL 68 N -0.88 0.75 -0.21 1.67 2.07 -1.62 0.40 116.25 118.43 3kp0 h VAL 68 Ca -0.05 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.33 3kp0 h VAL 68 Cb 0.55 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.27 3kp0 h VAL 68 CO 0.09 0.00 -0.39 0.44 0.02 0.00 0.00 177.57 177.73 3kp0 h ASP 69 N 0.00 0.71 0.06 0.57 5.19 -1.40 -2.30 116.42 119.25 3kp0 h ASP 69 Ca 0.04 -0.54 -0.00 0.00 -0.62 0.00 0.00 57.03 55.90 3kp0 h ASP 69 Cb 0.16 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.47 3kp0 h ASP 69 CO -0.00 1.12 -0.03 0.11 -3.12 0.00 0.00 179.24 177.32 3kp0 h LYS 70 N 0.33 -0.08 -0.87 3.56 1.79 -0.75 -2.87 116.57 117.68 3kp0 h LYS 70 Ca 0.01 0.01 0.22 0.00 -2.18 0.00 0.00 60.65 58.71 3kp0 h LYS 70 Cb 0.99 0.02 -0.13 0.00 -1.58 0.00 0.00 32.23 31.53 3kp0 h LYS 70 CO 0.09 0.36 0.32 1.15 -1.08 0.00 0.00 179.45 180.28 3kp0 h THR 71 N -0.54 0.42 -0.49 -0.16 2.02 -0.29 0.56 112.91 114.44 3kp0 h THR 71 Ca -0.01 -0.11 -0.09 0.00 0.77 0.00 0.00 66.41 66.97 3kp0 h THR 71 Cb 0.47 0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.93 3kp0 h THR 71 CO 0.01 0.06 -0.06 0.24 0.37 0.00 0.00 175.52 176.14 3kp0 h MET 72 N 0.32 0.86 0.00 6.66 2.86 -1.44 -2.05 114.93 122.14 3kp0 h MET 72 Ca 0.54 -0.27 -0.01 0.00 -2.06 0.00 0.00 59.70 57.90 3kp0 h MET 72 Cb 1.05 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.63 3kp0 h MET 72 CO -0.57 0.90 -0.03 -0.44 1.06 0.00 0.00 176.91 177.83 3kp0 h ASP 73 N 0.78 0.00 -0.14 1.22 3.45 0.30 -1.41 116.42 120.63 3kp0 h ASP 73 Ca 0.14 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.60 3kp0 h ASP 73 Cb 0.56 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.33 3kp0 h ASP 73 CO 0.03 0.03 0.00 0.54 -1.57 0.00 0.00 179.24 178.28 3kp0 n ARG 74 N -4.21 1.80 -1.92 3.56 5.12 -0.51 -4.92 116.66 115.58 3kp0 n ARG 74 Ca -0.03 -1.19 -0.21 0.00 -1.93 0.00 0.00 57.85 54.49 3kp0 n ARG 74 Cb 0.12 -1.43 -0.06 0.00 -1.16 0.00 0.00 32.46 29.93 3kp0 n ARG 74 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3kp0 n GLY 75 N 1.18 1.01 1.54 -0.13 0.00 -0.53 -4.87 105.19 103.39 3kp0 n GLY 75 Ca 0.17 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.20 3kp0 n GLY 75 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3kp0 n LEU 76 N -2.63 5.12 0.18 0.99 4.32 -0.82 -4.47 117.00 119.69 3kp0 n LEU 76 Ca -0.22 -3.18 0.05 0.00 -0.02 0.00 0.00 56.01 52.64 3kp0 n LEU 76 Cb 0.69 -0.66 0.23 0.00 -1.62 0.00 0.00 43.42 42.06 3kp0 n LEU 76 CO 0.31 0.79 0.62 0.24 -1.22 0.00 0.00 177.39 178.13 3kp0 h MET 77 N 2.42 0.00 0.00 3.23 2.86 -1.90 -3.01 114.93 118.53 3kp0 h MET 77 Ca 0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 3kp0 h MET 77 Cb 1.92 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.58 3kp0 h MET 77 CO 0.50 0.40 0.00 0.78 1.06 0.00 0.00 176.91 179.64 3kp0 h GLY 78 N 2.65 0.00 0.69 8.32 0.00 -1.97 -1.73 103.07 111.03 3kp0 h GLY 78 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 3kp0 h GLY 78 CO 0.05 0.00 -1.36 0.28 0.00 0.00 0.00 176.54 175.51 3kp0 n LYS 79 N -2.38 0.62 -0.62 4.80 4.76 -1.14 -5.06 118.16 119.14 3kp0 n LYS 79 Ca -0.00 0.04 0.00 0.00 -2.87 0.00 0.00 58.31 55.48 3kp0 n LYS 79 Cb 0.12 -1.73 0.00 0.00 -1.84 0.00 0.00 35.03 31.57 3kp0 n LYS 79 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3kp0 n GLY 80 N 1.24 -1.66 0.36 0.72 0.00 -0.65 -4.59 105.19 100.60 3kp0 n GLY 80 Ca -0.03 -0.75 0.19 0.00 0.00 0.00 0.00 46.02 45.43 3kp0 n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kp0 h ALA 81 N 0.00 2.17 0.11 4.61 0.00 -1.82 0.35 119.26 124.67 3kp0 h ALA 81 Ca 0.00 -0.01 -0.27 0.00 0.00 0.00 0.00 54.91 54.63 3kp0 h ALA 81 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3kp0 h ALA 81 CO 0.00 -0.50 -1.20 0.78 0.00 0.00 0.00 179.25 178.33 3kp0 h GLY 82 N 0.00 0.32 0.64 0.00 0.00 -1.90 -2.84 103.07 99.29 3kp0 h GLY 82 Ca 0.17 -0.77 0.04 0.00 0.00 0.00 0.00 47.33 46.77 3kp0 h GLY 82 CO -0.00 0.68 0.02 0.84 0.00 0.00 0.00 176.54 178.08 3kp0 h HIS 83 N 0.09 0.03 -0.69 5.60 6.17 -1.23 -1.53 115.15 123.60 3kp0 h HIS 83 Ca -0.12 0.02 0.05 0.00 0.71 0.00 0.00 60.37 61.02 3kp0 h HIS 83 Cb 1.91 0.03 -0.04 0.00 2.52 0.00 0.00 27.41 31.83 3kp0 h HIS 83 CO 0.06 -0.02 0.45 0.82 0.71 0.00 0.00 177.93 179.96 3kp0 h ILE 84 N 0.11 1.05 -0.27 6.26 1.08 -1.18 0.25 117.51 124.81 3kp0 h ILE 84 Ca 0.12 -0.26 -0.15 0.00 -0.39 0.00 0.00 64.86 64.18 3kp0 h ILE 84 Cb 0.14 0.23 -0.01 0.00 -3.07 0.00 0.00 36.82 34.11 3kp0 h ILE 84 CO -0.19 0.14 -0.44 0.58 -0.69 0.00 0.00 178.15 177.55 3kp0 h VAL 85 N 0.76 1.30 0.37 1.67 2.07 -1.25 -2.52 116.25 118.63 3kp0 h VAL 85 Ca 0.29 -1.63 -0.02 0.00 0.82 0.00 0.00 66.70 66.16 3kp0 h VAL 85 Cb 0.17 1.56 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 3kp0 h VAL 85 CO -0.09 0.52 -0.18 0.22 0.02 0.00 0.00 177.57 178.07 3kp0 h TYR 86 N 0.55 -0.45 -0.75 1.57 3.20 0.41 -0.16 116.97 121.34 3kp0 h TYR 86 Ca 0.04 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.95 3kp0 h TYR 86 Cb 0.98 0.15 -0.06 0.00 1.54 0.00 0.00 36.73 39.34 3kp0 h TYR 86 CO 0.05 -0.13 0.44 0.87 -1.64 0.00 0.00 178.16 177.75 3kp0 h LYS 87 N -0.82 0.80 0.00 1.82 1.79 -0.90 -0.08 116.57 119.18 3kp0 h LYS 87 Ca -0.05 -0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 58.35 3kp0 h LYS 87 Cb 0.53 -0.18 -0.00 0.00 -1.58 0.00 0.00 32.23 31.00 3kp0 h LYS 87 CO 0.08 0.53 -0.09 0.82 -1.08 0.00 0.00 179.45 179.71 3kp0 h ILE 88 N 0.82 0.22 0.07 1.86 1.08 -1.47 -2.18 117.51 117.90 3kp0 h ILE 88 Ca 0.33 -0.78 -0.00 0.00 -0.39 0.00 0.00 64.86 64.01 3kp0 h ILE 88 Cb 0.16 1.64 0.00 0.00 -3.07 0.00 0.00 36.82 35.55 3kp0 h ILE 88 CO -0.17 0.09 -0.03 0.00 -0.69 0.00 0.00 178.15 177.35 3kp0 h ALA 89 N 1.91 -0.09 0.00 1.87 0.00 0.04 -3.18 119.26 119.81 3kp0 h ALA 89 Ca -0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3kp0 h ALA 89 Cb 0.63 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3kp0 h ALA 89 CO 0.01 -0.12 0.00 1.63 0.00 0.00 0.00 179.25 180.77 3kp0 n LYS 90 N -4.78 0.03 -0.06 0.00 5.02 -0.14 -1.73 118.16 116.50 3kp0 n LYS 90 Ca -0.06 0.18 -0.04 0.00 -2.02 0.00 0.00 58.31 56.37 3kp0 n LYS 90 Cb 0.25 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.75 3kp0 n LYS 90 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3kp0 n GLU 91 N -1.47 0.36 0.00 1.97 -0.58 -0.83 -4.15 120.64 115.93 3kp0 n GLU 91 Ca 0.05 0.47 0.01 0.00 -0.42 0.00 0.00 57.16 57.26 3kp0 n GLU 91 Cb 0.21 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 29.61 3kp0 n GLU 91 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3kp0 n LYS 92 N -4.14 0.15 -3.56 3.49 4.76 -1.20 -4.82 118.16 112.85 3kp0 n LYS 92 Ca -0.06 0.00 -0.26 0.00 -2.87 0.00 0.00 58.31 55.12 3kp0 n LYS 92 Cb 0.21 -1.11 0.04 0.00 -1.84 0.00 0.00 35.03 32.33 3kp0 n LYS 92 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 3kp0 n ASN 93 N -0.61 -5.34 -3.26 4.39 4.05 -1.04 -5.00 115.26 108.45 3kp0 n ASN 93 Ca 0.01 -0.55 -0.14 0.00 0.45 0.00 0.00 54.58 54.34 3kp0 n ASN 93 Cb 0.00 -4.27 -0.02 0.00 1.23 0.00 0.00 39.78 36.72 3kp0 n ASN 93 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 177.26 176.51 3kp0 n ILE 94 N -4.62 0.00 -2.73 -1.44 -5.35 -0.71 -5.04 119.36 99.47 3kp0 n ILE 94 Ca -0.01 -1.08 -0.21 0.00 -0.27 0.00 0.00 62.75 61.18 3kp0 n ILE 94 Cb 0.56 0.08 0.07 0.00 -1.74 0.00 0.00 39.64 38.60 3kp0 n ILE 94 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3kp0 s SER 95 N -2.35 4.94 0.04 7.28 1.04 -1.26 -4.46 113.70 118.92 3kp0 s SER 95 Ca 0.04 -0.35 -0.32 0.00 0.48 0.00 0.00 55.95 55.81 3kp0 s SER 95 Cb -0.00 -0.31 -0.18 0.00 0.10 0.00 0.00 66.02 65.63 3kp0 s SER 95 CO 0.03 -1.41 1.34 0.58 0.98 0.00 0.00 173.24 174.76 3kp0 h VAL 96 N -0.07 0.04 -0.15 5.02 2.07 -1.94 -1.60 116.25 119.63 3kp0 h VAL 96 Ca -0.37 -0.16 0.02 0.00 0.82 0.00 0.00 66.70 67.01 3kp0 h VAL 96 Cb 1.28 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 3kp0 h VAL 96 CO 0.45 0.00 0.10 0.03 0.02 0.00 0.00 177.57 178.17 3kp0 h ARG 97 N -1.27 0.11 -0.49 1.57 3.08 -1.92 -0.68 114.38 114.77 3kp0 h ARG 97 Ca -0.11 -0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.01 3kp0 h ARG 97 Cb 0.86 -0.02 -0.07 0.00 0.08 0.00 0.00 29.97 30.82 3kp0 h ARG 97 CO 0.19 0.07 0.11 0.93 -1.07 0.00 0.00 179.97 180.20 3kp0 h GLU 98 N 0.11 0.24 0.01 0.04 4.39 -1.88 -2.07 114.58 115.42 3kp0 h GLU 98 Ca 0.06 -0.01 -0.26 0.00 0.34 0.00 0.00 59.36 59.49 3kp0 h GLU 98 Cb 0.11 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 28.66 3kp0 h GLU 98 CO -0.01 0.16 -1.41 0.00 -1.16 0.00 0.00 179.01 176.59 3kp0 h ALA 99 N 1.37 0.56 0.27 3.43 0.00 -0.17 -3.19 119.26 121.55 3kp0 h ALA 99 Ca 0.24 -1.21 -0.01 0.00 0.00 0.00 0.00 54.91 53.93 3kp0 h ALA 99 Cb 0.32 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3kp0 h ALA 99 CO -0.31 1.42 -0.13 0.78 0.00 0.00 0.00 179.25 181.01 3kp0 h GLY 100 N 3.15 -0.38 -0.99 0.00 0.00 -1.24 -0.93 103.07 102.67 3kp0 h GLY 100 Ca -0.17 0.14 0.13 0.00 0.00 0.00 0.00 47.33 47.43 3kp0 h GLY 100 CO 0.11 -0.14 -0.46 1.04 0.00 0.00 0.00 176.54 177.09 3kp0 n LEU 101 N -5.09 -0.79 0.14 3.11 4.32 -0.79 -0.29 117.00 117.61 3kp0 n LEU 101 Ca -0.09 1.74 -0.13 0.00 -0.02 0.00 0.00 56.01 57.50 3kp0 n LEU 101 Cb 0.26 -0.33 -0.06 0.00 -1.62 0.00 0.00 43.42 41.66 3kp0 n LEU 101 CO 0.30 -1.51 0.68 0.00 -1.22 0.00 0.00 177.39 175.64 3kp0 h ALA 102 N 1.05 -0.52 -0.66 -1.18 0.00 -1.52 -2.68 119.26 113.75 3kp0 h ALA 102 Ca 0.28 -0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.24 3kp0 h ALA 102 Cb 0.52 0.44 -0.08 0.00 0.00 0.00 0.00 17.79 18.67 3kp0 h ALA 102 CO -0.96 -0.84 0.23 -0.07 0.00 0.00 0.00 179.25 177.61 3kp0 h LEU 103 N -0.54 0.19 0.00 0.00 3.38 0.19 0.23 115.31 118.76 3kp0 h LEU 103 Ca 0.01 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3kp0 h LEU 103 Cb 0.53 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.37 3kp0 h LEU 103 CO -0.12 0.10 0.00 -1.54 0.09 0.00 0.00 178.44 176.97 3kp0 n SER 104 N -5.03 0.00 -0.69 -0.43 3.41 0.60 -1.51 113.62 109.97 3kp0 n SER 104 Ca 0.11 0.41 0.08 0.00 -0.26 0.00 0.00 58.87 59.21 3kp0 n SER 104 Cb 0.33 -0.43 0.08 0.00 -0.26 0.00 0.00 64.21 63.93 3kp0 n SER 104 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3kp0 n GLU 105 N -1.43 1.44 0.00 4.33 1.02 0.78 -4.81 120.64 121.96 3kp0 n GLU 105 Ca 0.02 -1.56 0.00 0.00 -0.02 0.00 0.00 57.16 55.59 3kp0 n GLU 105 Cb 0.06 -1.33 0.00 0.00 -0.02 0.00 0.00 31.44 30.15 3kp0 n GLU 105 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3kp0 n GLY 106 N 0.94 0.64 3.93 0.62 0.00 -0.57 -5.08 105.19 105.67 3kp0 n GLY 106 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 3kp0 n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kp0 s LYS 107 N -0.99 3.54 0.00 1.61 1.02 -1.06 -4.29 119.74 119.56 3kp0 s LYS 107 Ca 0.00 -0.21 0.00 0.00 0.02 0.00 0.00 55.97 55.78 3kp0 s LYS 107 Cb 0.00 -2.68 0.00 0.00 -0.52 0.00 0.00 37.83 34.63 3kp0 s LYS 107 CO 0.00 0.20 0.00 0.66 -0.92 0.00 0.00 175.35 175.29 3kp0 n TYR 108 N -1.34 0.00 1.35 3.18 4.01 -1.26 -4.01 117.16 119.09 3kp0 n TYR 108 Ca -0.04 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.81 3kp0 n TYR 108 Cb 0.55 -1.74 0.65 0.00 -0.31 0.00 0.00 39.34 38.49 3kp0 n TYR 108 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 3kp0 n TRP 109 N -1.98 0.00 -0.08 -0.72 7.02 -1.26 -1.65 117.44 118.77 3kp0 n TRP 109 Ca 0.00 0.00 -0.15 0.00 -1.02 0.00 0.00 57.50 56.33 3kp0 n TRP 109 Cb 0.24 -0.04 -0.10 0.00 -2.42 0.00 0.00 31.31 29.00 3kp0 n TRP 109 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3kp0 h ASP 110 N 0.00 0.00 -1.01 -0.99 5.19 -1.90 -3.26 116.42 114.45 3kp0 h ASP 110 Ca 0.00 -0.55 0.03 0.00 -0.62 0.00 0.00 57.03 55.89 3kp0 h ASP 110 Cb 0.03 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.48 3kp0 h ASP 110 CO 0.00 1.15 0.66 0.44 -3.12 0.00 0.00 179.24 178.38 3kp0 h ASP 111 N -1.00 1.11 -0.97 6.45 3.32 -1.93 -1.77 116.42 121.64 3kp0 h ASP 111 Ca -0.16 -0.01 0.22 0.00 0.02 0.00 0.00 57.03 57.09 3kp0 h ASP 111 Cb 0.99 -0.26 -0.12 0.00 0.22 0.00 0.00 39.33 40.16 3kp0 h ASP 111 CO -0.10 0.77 0.54 0.00 -1.72 0.00 0.00 179.24 178.73 3kp0 h ALA 112 N 1.41 1.64 0.00 3.45 0.00 -1.44 0.59 119.26 124.90 3kp0 h ALA 112 Ca 0.40 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.43 3kp0 h ALA 112 Cb -0.02 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3kp0 h ALA 112 CO -0.12 -0.22 0.00 -0.89 0.00 0.00 0.00 179.25 178.02 3kp0 n ILE 113 N -4.89 0.00 -1.05 0.00 5.41 -0.66 -5.10 119.36 113.07 3kp0 n ILE 113 Ca 0.24 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.99 3kp0 n ILE 113 Cb 0.66 -0.16 0.00 0.00 -0.71 0.00 0.00 39.64 39.43 3kp0 n ILE 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55