#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3klz n ALA 26 N 0.00 2.36 0.26 7.82 0.00 -1.26 -4.86 120.51 124.83 3klz n ALA 26 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 3klz n ALA 26 Cb 0.00 0.00 0.67 0.00 0.00 0.00 0.00 19.45 20.12 3klz n ALA 26 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3klz h LYS 27 N 0.00 0.00 -0.94 0.00 1.57 -2.06 -2.74 116.57 112.40 3klz h LYS 27 Ca 0.00 0.00 0.26 0.00 -1.87 0.00 0.00 60.65 59.04 3klz h LYS 27 Cb 0.00 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 32.17 3klz h LYS 27 CO 0.00 0.05 0.44 0.87 -0.57 0.00 0.00 179.45 180.24 3klz h LYS 28 N 0.00 0.34 0.00 3.15 1.57 -1.99 -0.16 116.57 119.48 3klz h LYS 28 Ca -0.00 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.65 3klz h LYS 28 Cb 0.10 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 3klz h LYS 28 CO 0.01 0.23 -0.53 0.00 -0.57 0.00 0.00 179.45 178.58 3klz h ALA 29 N 1.78 1.11 0.01 3.86 0.00 -1.85 0.23 119.26 124.40 3klz h ALA 29 Ca 0.63 -0.49 -0.24 0.00 0.00 0.00 0.00 54.91 54.81 3klz h ALA 29 Cb 1.31 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 19.03 3klz h ALA 29 CO -0.58 0.67 -0.95 0.00 0.00 0.00 0.00 179.25 178.38 3klz h ALA 30 N 1.47 0.10 -0.45 0.00 0.00 -1.23 -2.29 119.26 116.86 3klz h ALA 30 Ca -0.01 -0.67 -0.10 0.00 0.00 0.00 0.00 54.91 54.13 3klz h ALA 30 Cb 0.95 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 3klz h ALA 30 CO 0.07 0.60 -0.11 1.88 0.00 0.00 0.00 179.25 181.69 3klz h TYR 31 N 0.26 0.97 -0.05 0.00 0.05 -1.12 0.28 116.97 117.37 3klz h TYR 31 Ca -0.12 -0.21 0.01 0.00 0.05 0.00 0.00 58.73 58.46 3klz h TYR 31 Cb 1.62 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 39.12 3klz h TYR 31 CO 0.12 0.96 0.01 -0.22 -1.05 0.00 0.00 178.16 177.97 3klz h LYS 32 N 0.69 0.02 -0.66 4.88 3.64 -1.00 -1.21 116.57 122.94 3klz h LYS 32 Ca 0.11 -0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.58 3klz h LYS 32 Cb 0.65 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.40 3klz h LYS 32 CO 0.04 0.02 0.30 1.03 -2.27 0.00 0.00 179.45 178.57 3klz h SER 33 N 0.03 0.37 -0.16 4.20 0.87 -1.31 -1.50 113.55 116.05 3klz h SER 33 Ca 0.02 0.06 0.01 0.00 -1.23 0.00 0.00 61.79 60.65 3klz h SER 33 Cb 0.02 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 61.98 3klz h SER 33 CO -0.03 0.22 0.08 0.15 -0.53 0.00 0.00 176.83 176.71 3klz h PHE 34 N 0.52 0.15 -0.41 2.24 3.57 -0.46 -1.37 116.94 121.19 3klz h PHE 34 Ca 0.32 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.83 3klz h PHE 34 Cb 0.35 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 3klz h PHE 34 CO -0.13 0.09 0.24 -0.07 -2.23 0.00 0.00 178.31 176.22 3klz h LEU 35 N 0.17 0.49 -2.02 0.59 3.38 -0.63 -0.76 115.31 116.54 3klz h LEU 35 Ca 0.06 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 3klz h LEU 35 Cb 0.01 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 3klz h LEU 35 CO -0.04 0.40 -0.08 -0.07 0.09 0.00 0.00 178.44 178.74 3klz h LEU 36 N 0.54 0.00 -0.01 1.67 3.38 -1.14 -0.13 115.31 119.62 3klz h LEU 36 Ca 0.15 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.91 3klz h LEU 36 Cb 0.00 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.77 3klz h LEU 36 CO -0.03 0.08 -0.80 0.00 0.09 0.00 0.00 178.44 177.79 3klz h ALA 37 N 1.92 0.11 -0.59 1.53 0.00 -0.31 -0.77 119.26 121.15 3klz h ALA 37 Ca -0.00 -0.62 0.01 0.00 0.00 0.00 0.00 54.91 54.30 3klz h ALA 37 Cb 0.17 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3klz h ALA 37 CO 0.01 0.51 0.38 0.82 0.00 0.00 0.00 179.25 180.97 3klz h ILE 38 N 0.15 1.12 -0.49 0.00 2.04 -0.63 0.22 117.51 119.91 3klz h ILE 38 Ca -0.10 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 3klz h ILE 38 Cb 1.48 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 3klz h ILE 38 CO 0.16 0.14 0.26 -1.28 0.00 0.00 0.00 178.15 177.43 3klz h SER 39 N 0.76 0.63 -0.78 1.72 0.87 -0.96 -1.15 113.55 114.64 3klz h SER 39 Ca 0.23 -0.10 -0.04 0.00 -1.23 0.00 0.00 61.79 60.64 3klz h SER 39 Cb -0.04 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 61.72 3klz h SER 39 CO -0.07 0.55 0.31 0.00 -0.53 0.00 0.00 176.83 177.09 3klz h ALA 40 N 1.10 1.07 -0.37 6.23 0.00 -0.85 -0.64 119.26 125.81 3klz h ALA 40 Ca 0.17 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.92 3klz h ALA 40 Cb 0.07 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 3klz h ALA 40 CO -0.03 0.66 0.16 0.78 0.00 0.00 0.00 179.25 180.82 3klz h GLY 41 N 1.16 0.48 1.32 0.00 0.00 -0.34 -0.23 103.07 105.46 3klz h GLY 41 Ca 0.26 -0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.44 3klz h GLY 41 CO -0.02 0.06 0.16 -2.22 0.00 0.00 0.00 176.54 174.52 3klz h ILE 42 N 0.33 1.22 -0.17 2.60 2.04 -0.98 -2.03 117.51 120.52 3klz h ILE 42 Ca 0.16 -0.78 -0.20 0.00 1.00 0.00 0.00 64.86 65.04 3klz h ILE 42 Cb 0.10 0.62 0.01 0.00 -0.74 0.00 0.00 36.82 36.81 3klz h ILE 42 CO -0.14 0.30 -0.68 1.56 0.00 0.00 0.00 178.15 179.19 3klz h GLN 43 N 0.83 0.77 -0.65 2.37 4.20 -0.18 -1.52 115.11 120.93 3klz h GLN 43 Ca 0.19 -0.59 -0.07 0.00 0.06 0.00 0.00 58.65 58.23 3klz h GLN 43 Cb 0.26 0.11 -0.03 0.00 0.30 0.00 0.00 27.48 28.13 3klz h GLN 43 CO -0.01 1.21 0.14 0.82 -0.67 0.00 0.00 178.83 180.32 3klz h ILE 44 N 0.49 1.26 -0.58 2.54 1.08 -1.09 -2.79 117.51 118.43 3klz h ILE 44 Ca -0.04 -0.98 0.06 0.00 -0.39 0.00 0.00 64.86 63.52 3klz h ILE 44 Cb 1.31 0.64 -0.06 0.00 -3.07 0.00 0.00 36.82 35.64 3klz h ILE 44 CO 0.14 0.37 0.27 1.23 -0.69 0.00 0.00 178.15 179.48 3klz h GLY 45 N 0.98 0.82 0.34 5.37 0.00 -1.24 -1.87 103.07 107.46 3klz h GLY 45 Ca 0.20 -0.18 0.12 0.00 0.00 0.00 0.00 47.33 47.47 3klz h GLY 45 CO 0.01 0.08 0.36 -2.22 0.00 0.00 0.00 176.54 174.76 3klz h ILE 46 N 0.51 0.77 -0.51 2.60 2.04 -1.18 -0.41 117.51 121.34 3klz h ILE 46 Ca 0.27 -0.19 0.10 0.00 1.00 0.00 0.00 64.86 66.03 3klz h ILE 46 Cb 0.23 0.16 -0.08 0.00 -0.74 0.00 0.00 36.82 36.38 3klz h ILE 46 CO -0.21 0.10 0.00 0.00 0.00 0.00 0.00 178.15 178.04 3klz h ALA 47 N 1.49 0.49 -0.12 1.87 0.00 -1.08 -0.63 119.26 121.28 3klz h ALA 47 Ca 0.39 0.15 -0.08 0.00 0.00 0.00 0.00 54.91 55.37 3klz h ALA 47 Cb 0.49 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3klz h ALA 47 CO -0.32 -0.39 -0.31 0.74 0.00 0.00 0.00 179.25 178.97 3klz h PHE 48 N 0.12 0.26 -0.26 0.00 0.04 -0.70 0.11 116.94 116.50 3klz h PHE 48 Ca 0.26 -0.05 -0.01 0.00 2.80 0.00 0.00 57.97 60.96 3klz h PHE 48 Cb 0.39 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.47 3klz h PHE 48 CO -0.32 0.52 0.11 0.28 -0.60 0.00 0.00 178.31 178.30 3klz h VAL 49 N 0.20 1.16 0.21 -0.55 2.07 -0.60 -0.59 116.25 118.16 3klz h VAL 49 Ca 0.03 -0.49 -0.00 0.00 0.82 0.00 0.00 66.70 67.05 3klz h VAL 49 Cb 0.65 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 3klz h VAL 49 CO 0.05 0.17 -0.14 0.15 0.02 0.00 0.00 177.57 177.81 3klz h PHE 50 N 0.28 -0.37 -0.69 1.57 3.57 -0.93 -1.46 116.94 118.92 3klz h PHE 50 Ca 0.09 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.72 3klz h PHE 50 Cb 0.16 0.13 -0.09 0.00 2.79 0.00 0.00 35.95 38.94 3klz h PHE 50 CO -0.01 -0.22 0.21 -0.92 -2.23 0.00 0.00 178.31 175.14 3klz h TYR 51 N -0.35 0.35 -0.56 0.41 5.03 -0.87 -1.03 116.97 119.95 3klz h TYR 51 Ca -0.02 0.04 -0.08 0.00 2.58 0.00 0.00 58.73 61.25 3klz h TYR 51 Cb 0.30 -0.05 -0.02 0.00 1.55 0.00 0.00 36.73 38.51 3klz h TYR 51 CO -0.10 -0.00 0.02 1.15 -1.32 0.00 0.00 178.16 177.91 3klz h THR 52 N 0.34 1.26 0.17 1.81 2.02 -0.72 -1.83 112.91 115.97 3klz h THR 52 Ca 0.37 -1.08 -0.01 0.00 0.77 0.00 0.00 66.41 66.46 3klz h THR 52 Cb 0.58 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 3klz h THR 52 CO -0.42 0.39 -0.08 0.58 0.37 0.00 0.00 175.52 176.36 3klz h VAL 53 N 0.85 0.86 -0.79 3.16 2.07 -0.79 -2.76 116.25 118.86 3klz h VAL 53 Ca 0.16 -0.14 0.05 0.00 0.82 0.00 0.00 66.70 67.59 3klz h VAL 53 Cb 0.51 0.95 -0.05 0.00 -1.52 0.00 0.00 31.29 31.18 3klz h VAL 53 CO 0.02 0.03 0.52 0.58 0.02 0.00 0.00 177.57 178.75 3klz h VAL 54 N -0.29 1.08 -0.56 2.57 2.07 -0.96 -2.11 116.25 118.05 3klz h VAL 54 Ca -0.02 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.18 3klz h VAL 54 Cb 0.23 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.09 3klz h VAL 54 CO 0.04 0.17 0.00 0.35 0.02 0.00 0.00 177.57 178.14 3klz n THR 55 N -4.47 0.75 -2.74 2.57 -2.24 -0.71 -4.89 114.28 102.55 3klz n THR 55 Ca 0.11 -0.80 -0.41 0.00 -2.27 0.00 0.00 64.05 60.68 3klz n THR 55 Cb 0.17 0.52 -0.05 0.00 -2.10 0.00 0.00 70.33 68.87 3klz n THR 55 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3klz s THR 56 N -1.25 4.43 -0.77 4.28 2.01 -0.79 -3.50 115.64 120.04 3klz s THR 56 Ca 0.41 2.06 0.00 0.00 0.31 0.00 0.00 61.69 64.48 3klz s THR 56 Cb 0.22 -4.32 0.00 0.00 0.01 0.00 0.00 72.50 68.41 3klz s THR 56 CO 0.29 0.35 0.00 0.61 -0.69 0.00 0.00 174.62 175.18 3klz n GLY 57 N 2.11 0.68 1.69 4.40 0.00 -1.26 -4.93 105.19 107.88 3klz n GLY 57 Ca 0.01 -0.65 -0.01 0.00 0.00 0.00 0.00 46.02 45.37 3klz n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3klz n ALA 58 N 0.34 3.96 -0.25 4.61 0.00 -1.23 -4.66 120.51 123.28 3klz n ALA 58 Ca -0.08 -1.70 0.06 0.00 0.00 0.00 0.00 53.44 51.71 3klz n ALA 58 Cb 0.35 -1.17 0.18 0.00 0.00 0.00 0.00 19.45 18.81 3klz n ALA 58 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 3klz h HIS 59 N 2.48 0.19 0.00 0.00 2.07 -1.92 -2.17 115.15 115.82 3klz h HIS 59 Ca 0.14 0.05 0.00 0.00 -2.85 0.00 0.00 60.37 57.70 3klz h HIS 59 Cb 1.88 0.03 0.00 0.00 2.57 0.00 0.00 27.41 31.89 3klz h HIS 59 CO 0.97 -0.13 -0.42 -0.25 -3.07 0.00 0.00 177.93 175.02 3klz n ASP 60 N -5.21 0.43 -4.78 3.10 8.00 -1.26 -4.88 116.55 111.95 3klz n ASP 60 Ca 0.14 -0.10 -0.34 0.00 0.71 0.00 0.00 54.79 55.20 3klz n ASP 60 Cb 0.47 0.12 0.01 0.00 -0.02 0.00 0.00 41.12 41.69 3klz n ASP 60 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 3klz s MET 61 N -3.01 3.32 0.53 -1.24 -1.94 -0.82 -4.98 119.30 111.16 3klz s MET 61 Ca 0.11 1.48 -0.22 0.00 -1.71 0.00 0.00 55.69 55.35 3klz s MET 61 Cb 0.17 -2.01 -0.05 0.00 2.01 0.00 0.00 34.83 34.95 3klz s MET 61 CO 0.67 -0.85 1.37 -2.14 -0.01 0.00 0.00 175.02 174.06 3klz s PRO 62 N -3.52 3.23 0.16 2.03 0.02 -1.26 -4.87 135.00 130.79 3klz s PRO 62 Ca 0.70 2.26 -0.27 0.00 0.02 0.00 0.00 61.00 63.71 3klz s PRO 62 Cb -0.21 -2.32 0.01 0.00 0.02 0.00 0.00 34.50 31.99 3klz s PRO 62 CO 0.30 -1.12 1.56 -0.92 -0.33 0.00 0.00 177.00 176.48 3klz h TYR 63 N 1.60 -1.41 -0.72 6.54 5.03 -1.93 -2.45 116.97 123.64 3klz h TYR 63 Ca -0.51 0.09 -0.02 0.00 2.58 0.00 0.00 58.73 60.87 3klz h TYR 63 Cb 1.29 0.70 -0.03 0.00 1.55 0.00 0.00 36.73 40.24 3klz h TYR 63 CO 0.47 -0.43 0.36 0.78 -1.32 0.00 0.00 178.16 178.02 3klz h GLY 64 N -0.23 1.09 0.99 1.82 0.00 -1.99 -2.28 103.07 102.48 3klz h GLY 64 Ca 0.17 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.96 3klz h GLY 64 CO -0.71 0.50 0.33 -2.08 0.00 0.00 0.00 176.54 174.58 3klz h VAL 65 N 0.99 1.19 -0.20 4.60 2.07 -1.87 -1.11 116.25 121.93 3klz h VAL 65 Ca 0.25 -0.48 -0.00 0.00 0.82 0.00 0.00 66.70 67.29 3klz h VAL 65 Cb 0.09 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 3klz h VAL 65 CO -0.03 0.21 0.12 0.74 0.02 0.00 0.00 177.57 178.63 3klz h THR 66 N 0.80 1.07 -0.44 2.57 2.02 -1.21 -1.00 112.91 116.73 3klz h THR 66 Ca 0.21 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 67.21 3klz h THR 66 Cb 0.04 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 3klz h THR 66 CO -0.03 0.07 0.22 0.11 0.37 0.00 0.00 175.52 176.25 3klz h LYS 67 N 0.25 0.61 -0.05 6.66 1.79 -1.20 -2.06 116.57 122.58 3klz h LYS 67 Ca 0.07 -0.07 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 3klz h LYS 67 Cb 0.00 -0.12 -0.00 0.00 -1.58 0.00 0.00 32.23 30.53 3klz h LYS 67 CO -0.01 0.47 -0.02 1.25 -1.08 0.00 0.00 179.45 180.06 3klz h LEU 68 N 0.62 0.10 -0.80 2.94 5.85 -0.58 -0.78 115.31 122.66 3klz h LEU 68 Ca 0.16 -0.42 0.04 0.00 0.84 0.00 0.00 57.88 58.50 3klz h LEU 68 Cb 0.06 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.01 3klz h LEU 68 CO -0.02 0.50 0.50 -0.07 -0.34 0.00 0.00 178.44 179.01 3klz h LEU 69 N -0.30 0.80 0.11 2.25 3.38 -1.10 -0.89 115.31 119.56 3klz h LEU 69 Ca 0.01 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3klz h LEU 69 Cb 0.47 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.05 3klz h LEU 69 CO 0.01 0.54 -0.05 1.23 0.09 0.00 0.00 178.44 180.25 3klz h GLY 70 N 0.95 -0.15 0.72 0.83 0.00 -1.32 -2.26 103.07 101.84 3klz h GLY 70 Ca 0.33 0.06 0.07 0.00 0.00 0.00 0.00 47.33 47.78 3klz h GLY 70 CO -0.14 -0.05 0.62 -1.33 0.00 0.00 0.00 176.54 175.63 3klz h GLY 71 N -0.22 1.47 0.97 4.60 0.00 -0.90 -1.23 103.07 107.76 3klz h GLY 71 Ca -0.01 -0.45 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 3klz h GLY 71 CO 0.02 0.31 0.17 1.41 0.00 0.00 0.00 176.54 178.45 3klz h LEU 72 N 1.11 0.35 -0.67 3.11 3.38 -1.00 -2.65 115.31 118.94 3klz h LEU 72 Ca 0.42 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.33 3klz h LEU 72 Cb 0.18 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 3klz h LEU 72 CO -0.18 0.31 0.43 0.00 0.09 0.00 0.00 178.44 179.10 3klz h ALA 73 N 1.06 0.85 -0.17 1.53 0.00 -1.10 -2.45 119.26 118.97 3klz h ALA 73 Ca 0.10 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.01 3klz h ALA 73 Cb 0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3klz h ALA 73 CO -0.02 0.29 0.20 0.35 0.00 0.00 0.00 179.25 180.07 3klz h PHE 74 N 0.91 0.00 -0.08 0.00 3.04 -0.89 -1.93 116.94 117.99 3klz h PHE 74 Ca 0.24 0.00 0.02 0.00 3.98 0.00 0.00 57.97 62.22 3klz h PHE 74 Cb -0.08 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 38.42 3klz h PHE 74 CO -0.02 0.00 0.11 0.66 -2.02 0.00 0.00 178.31 177.03 3klz h SER 75 N 0.00 0.00 -0.95 0.41 4.64 -1.17 -0.18 113.55 116.30 3klz h SER 75 Ca 0.08 0.00 0.25 0.00 -0.47 0.00 0.00 61.79 61.66 3klz h SER 75 Cb 0.48 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.44 3klz h SER 75 CO -0.00 0.00 0.47 0.25 -0.87 0.00 0.00 176.83 176.68 3klz h LEU 76 N 0.00 0.42 0.16 5.97 5.85 -1.53 -2.07 115.31 124.11 3klz h LEU 76 Ca 0.04 0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.93 3klz h LEU 76 Cb 0.25 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 3klz h LEU 76 CO -0.00 -0.03 -0.22 1.23 -0.34 0.00 0.00 178.44 179.09 3klz h GLY 77 N 0.40 -0.43 1.68 3.75 0.00 -1.23 -0.57 103.07 106.67 3klz h GLY 77 Ca 0.63 0.25 -0.15 0.00 0.00 0.00 0.00 47.33 48.05 3klz h GLY 77 CO -0.55 -0.20 -0.59 -2.00 0.00 0.00 0.00 176.54 173.20 3klz h LEU 78 N -0.43 0.37 -0.52 3.11 5.85 -1.68 -1.94 115.31 120.07 3klz h LEU 78 Ca 0.01 -0.21 0.05 0.00 0.84 0.00 0.00 57.88 58.57 3klz h LEU 78 Cb 0.43 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.31 3klz h LEU 78 CO -0.09 0.87 0.26 0.40 -0.34 0.00 0.00 178.44 179.54 3klz h ILE 79 N 0.25 0.94 -0.08 4.05 2.04 -1.12 -0.61 117.51 122.98 3klz h ILE 79 Ca -0.00 -0.17 -0.00 0.00 1.00 0.00 0.00 64.86 65.69 3klz h ILE 79 Cb 1.10 0.40 -0.00 0.00 -0.74 0.00 0.00 36.82 37.58 3klz h ILE 79 CO 0.10 0.09 0.05 -0.07 0.00 0.00 0.00 178.15 178.31 3klz h LEU 80 N 0.50 0.10 -0.11 1.44 3.38 -0.89 -2.01 115.31 117.71 3klz h LEU 80 Ca 0.23 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3klz h LEU 80 Cb 0.15 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 3klz h LEU 80 CO -0.17 0.14 0.07 0.58 0.09 0.00 0.00 178.44 179.14 3klz h VAL 81 N 0.05 1.02 0.10 1.22 2.07 -1.01 -0.44 116.25 119.26 3klz h VAL 81 Ca 0.03 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 3klz h VAL 81 Cb 0.06 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 3klz h VAL 81 CO -0.00 0.03 -0.05 0.58 0.02 0.00 0.00 177.57 178.14 3klz h VAL 82 N 0.14 1.09 -0.36 2.57 2.07 -1.15 0.17 116.25 120.78 3klz h VAL 82 Ca 0.04 -0.74 -0.12 0.00 0.82 0.00 0.00 66.70 66.70 3klz h VAL 82 Cb -0.01 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 3klz h VAL 82 CO -0.02 0.18 -0.28 0.40 0.02 0.00 0.00 177.57 177.88 3klz h ILE 83 N -0.47 1.28 -0.00 4.57 2.04 -1.33 -2.99 117.51 120.59 3klz h ILE 83 Ca -0.01 -1.40 0.00 0.00 1.00 0.00 0.00 64.86 64.44 3klz h ILE 83 Cb 0.39 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 3klz h ILE 83 CO 0.02 0.46 -0.17 0.35 0.00 0.00 0.00 178.15 178.81 3klz n THR 84 N -4.09 0.00 -1.03 -0.27 -2.24 -0.18 -4.95 114.28 101.52 3klz n THR 84 Ca -0.00 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 3klz n THR 84 Cb 0.46 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 3klz n THR 84 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3klz n GLY 85 N 1.34 0.50 3.73 3.38 0.00 -0.71 -5.05 105.19 108.37 3klz n GLY 85 Ca 0.12 -0.91 -0.36 0.00 0.00 0.00 0.00 46.02 44.88 3klz n GLY 85 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3klz s GLY 86 N -2.86 2.66 -0.45 -0.02 0.00 0.53 -4.99 107.32 102.20 3klz s GLY 86 Ca 0.00 1.08 -0.13 0.00 0.00 0.00 0.00 44.72 45.68 3klz s GLY 86 CO 0.00 1.50 0.35 -0.54 0.00 0.00 0.00 173.10 174.41 3klz s GLU 87 N -3.57 2.82 -0.24 2.90 2.02 -0.92 -4.81 118.70 116.91 3klz s GLU 87 Ca 0.79 -1.42 -0.07 0.00 0.02 0.00 0.00 54.97 54.29 3klz s GLU 87 Cb -0.34 -4.00 -0.03 0.00 0.10 0.00 0.00 34.13 29.86 3klz s GLU 87 CO 0.41 -1.02 0.07 -1.17 0.02 0.00 0.00 175.26 173.58 3klz s LEU 88 N 1.55 3.52 0.20 1.80 2.96 -1.26 -4.11 118.68 123.33 3klz s LEU 88 Ca 0.04 -0.15 -0.23 0.00 -0.22 0.00 0.00 54.13 53.57 3klz s LEU 88 Cb -0.24 -1.93 0.11 0.00 0.50 0.00 0.00 46.19 44.63 3klz s LEU 88 CO 0.05 0.01 1.55 0.15 -1.32 0.00 0.00 176.35 176.78 3klz h PHE 89 N 7.94 -1.40 -0.67 5.38 3.57 -1.96 0.41 116.94 130.21 3klz h PHE 89 Ca -0.37 0.11 0.12 0.00 3.53 0.00 0.00 57.97 61.36 3klz h PHE 89 Cb 1.18 0.75 -0.04 0.00 2.79 0.00 0.00 35.95 40.62 3klz h PHE 89 CO 0.65 -0.39 0.45 1.79 -2.23 0.00 0.00 178.31 178.58 3klz h THR 90 N -0.02 0.84 -0.01 4.41 1.35 -1.95 -1.88 112.91 115.65 3klz h THR 90 Ca 0.27 -0.13 0.00 0.00 -0.55 0.00 0.00 66.41 65.99 3klz h THR 90 Cb 0.53 0.42 0.00 0.00 -1.73 0.00 0.00 68.15 67.36 3klz h THR 90 CO -0.95 0.07 -0.46 -0.24 -0.25 0.00 0.00 175.52 173.69 3klz n SER 91 N -4.47 1.18 -0.25 5.36 2.88 0.12 -4.39 113.62 114.06 3klz n SER 91 Ca 0.12 -0.95 0.02 0.00 -1.33 0.00 0.00 58.87 56.73 3klz n SER 91 Cb 0.46 0.36 0.14 0.00 -0.75 0.00 0.00 64.21 64.42 3klz n SER 91 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 3klz h SER 92 N 1.14 0.45 0.00 -3.46 0.02 -0.10 -2.33 113.55 109.28 3klz h SER 92 Ca 0.00 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3klz h SER 92 Cb 0.57 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.10 3klz h SER 92 CO 0.00 0.25 0.00 1.33 -1.14 0.00 0.00 176.83 177.27 3klz n VAL 93 N -4.87 0.00 1.27 2.27 0.24 -1.26 -3.02 118.33 112.96 3klz n VAL 93 Ca 0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.41 3klz n VAL 93 Cb 0.29 -0.18 0.00 0.00 -1.47 0.00 0.00 33.84 32.48 3klz n VAL 93 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3klz n LEU 94 N 0.14 0.40 -1.56 1.34 -0.00 -0.88 -3.18 117.00 113.26 3klz n LEU 94 Ca 0.00 -0.20 -0.01 0.00 -0.00 0.00 0.00 56.01 55.80 3klz n LEU 94 Cb 0.01 -0.20 0.03 0.00 -0.00 0.00 0.00 43.42 43.26 3klz n LEU 94 CO 0.00 0.10 0.31 0.00 -0.00 0.00 0.00 177.39 177.80 3klz n ILE 95 N -0.22 0.00 -3.21 1.47 0.13 -1.17 -5.16 119.36 111.20 3klz n ILE 95 Ca 0.00 -0.25 -0.24 0.00 -1.10 0.00 0.00 62.75 61.16 3klz n ILE 95 Cb 0.10 0.53 -0.01 0.00 -0.84 0.00 0.00 39.64 39.43 3klz n ILE 95 CO 0.00 0.00 0.00 -0.22 2.80 0.00 0.00 176.55 179.13 3klz s LEU 96 N -1.05 3.89 -0.01 9.51 1.98 -1.19 -4.82 118.68 126.98 3klz s LEU 96 Ca 0.02 0.45 -0.01 0.00 -2.89 0.00 0.00 54.13 51.71 3klz s LEU 96 Cb 0.11 -3.33 0.00 0.00 0.66 0.00 0.00 46.19 43.64 3klz s LEU 96 CO -0.03 -0.42 0.02 1.33 -1.89 0.00 0.00 176.35 175.35 3klz n VAL 97 N -1.90 -1.84 -3.19 1.68 0.24 -1.26 -5.04 118.33 107.03 3klz n VAL 97 Ca -0.03 0.26 -0.01 0.00 -2.04 0.00 0.00 64.34 62.52 3klz n VAL 97 Cb 0.56 -2.61 -0.01 0.00 -1.47 0.00 0.00 33.84 30.31 3klz n VAL 97 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3klz s ALA 98 N -0.06 -2.16 -0.35 2.33 0.00 -1.26 -4.93 121.76 115.34 3klz s ALA 98 Ca -0.02 0.04 -0.10 0.00 0.00 0.00 0.00 51.96 51.88 3klz s ALA 98 Cb 0.00 -2.67 0.01 0.00 0.00 0.00 0.00 23.12 20.46 3klz s ALA 98 CO 0.05 -2.21 0.38 1.17 0.00 0.00 0.00 175.76 175.15 3klz n LYS 99 N 4.27 -2.37 -0.24 0.00 4.81 -1.26 -3.53 118.16 119.85 3klz n LYS 99 Ca 0.12 2.09 0.00 0.00 -0.87 0.00 0.00 58.31 59.65 3klz n LYS 99 Cb 0.56 -5.09 0.00 0.00 0.02 0.00 0.00 35.03 30.52 3klz n LYS 99 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3klz n ALA 100 N -0.07 0.00 -1.92 3.14 0.00 -1.26 -3.88 120.51 116.52 3klz n ALA 100 Ca 0.08 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.50 3klz n ALA 100 Cb 0.29 -0.23 -0.02 0.00 0.00 0.00 0.00 19.45 19.50 3klz n ALA 100 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3klz n SER 101 N 0.00 -3.05 -1.35 0.00 7.64 -1.23 -2.64 113.62 112.99 3klz n SER 101 Ca 0.00 0.81 -0.17 0.00 1.01 0.00 0.00 58.87 60.52 3klz n SER 101 Cb 0.00 -3.21 -0.07 0.00 -1.01 0.00 0.00 64.21 59.92 3klz n SER 101 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3klz n GLY 102 N 0.91 1.52 4.47 0.23 0.00 -1.26 -2.69 105.19 108.37 3klz n GLY 102 Ca -0.13 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.67 3klz n GLY 102 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3klz n LYS 103 N -2.52 0.00 -2.77 1.61 5.02 -1.25 -4.91 118.16 113.34 3klz n LYS 103 Ca -0.17 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 55.85 3klz n LYS 103 Cb 0.56 -2.00 0.00 0.00 -0.02 0.00 0.00 35.03 33.57 3klz n LYS 103 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3klz s ILE 104 N -0.46 4.81 -0.57 -0.18 -0.00 -1.10 -4.94 121.20 118.76 3klz s ILE 104 Ca 0.00 0.03 -0.05 0.00 -0.00 0.00 0.00 60.65 60.63 3klz s ILE 104 Cb 0.00 -3.82 -0.09 0.00 -0.00 0.00 0.00 42.46 38.55 3klz s ILE 104 CO 0.00 -0.74 2.21 -1.54 -0.00 0.00 0.00 174.94 174.86 3klz n SER 105 N -2.19 4.27 0.00 4.36 3.41 -1.26 -4.16 113.62 118.06 3klz n SER 105 Ca -0.00 -2.23 0.00 0.00 -0.26 0.00 0.00 58.87 56.38 3klz n SER 105 Cb 0.56 -1.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.51 3klz n SER 105 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 3klz n TRP 106 N 3.60 0.00 -0.00 7.33 7.02 -1.08 -4.77 117.44 129.53 3klz n TRP 106 Ca 0.37 0.00 -0.14 0.00 -1.02 0.00 0.00 57.50 56.71 3klz n TRP 106 Cb 0.29 -0.16 -0.09 0.00 -2.42 0.00 0.00 31.31 28.94 3klz n TRP 106 CO 0.00 0.00 0.00 -0.22 -2.02 0.00 0.00 177.69 175.45 3klz h LYS 107 N 0.29 -0.54 -0.00 -0.99 3.64 -1.89 0.40 116.57 117.48 3klz h LYS 107 Ca 0.00 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3klz h LYS 107 Cb 0.00 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 3klz h LYS 107 CO 0.00 -0.36 -0.22 0.39 -2.27 0.00 0.00 179.45 176.99 3klz n GLU 108 N -5.44 0.14 -0.03 1.90 -0.58 -1.26 -0.13 120.64 115.23 3klz n GLU 108 Ca -0.05 -0.05 -0.12 0.00 -0.42 0.00 0.00 57.16 56.52 3klz n GLU 108 Cb 0.38 -1.50 -0.10 0.00 -0.57 0.00 0.00 31.44 29.65 3klz n GLU 108 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 3klz h LEU 109 N 0.12 -0.04 -0.92 -4.62 7.12 -1.70 0.27 115.31 115.55 3klz h LEU 109 Ca 0.00 -0.67 0.06 0.00 0.13 0.00 0.00 57.88 57.40 3klz h LEU 109 Cb 0.47 0.01 -0.06 0.00 -0.53 0.00 0.00 40.66 40.55 3klz h LEU 109 CO 0.00 0.70 0.58 0.58 -0.13 0.00 0.00 178.44 180.18 3klz h VAL 110 N -0.83 1.07 -0.07 1.05 2.07 -0.87 -0.53 116.25 118.13 3klz h VAL 110 Ca -0.00 -0.37 0.03 0.00 0.82 0.00 0.00 66.70 67.17 3klz h VAL 110 Cb 0.70 -0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 3klz h VAL 110 CO 0.01 0.19 -0.08 -0.09 0.02 0.00 0.00 177.57 177.62 3klz h ARG 111 N 1.07 -0.11 -0.93 1.57 9.65 -0.50 0.13 114.38 125.26 3klz h ARG 111 Ca 0.40 0.01 0.19 0.00 -1.10 0.00 0.00 59.98 59.48 3klz h ARG 111 Cb 0.15 0.02 -0.11 0.00 -1.39 0.00 0.00 29.97 28.65 3klz h ARG 111 CO -0.17 -0.07 0.50 -0.97 2.80 0.00 0.00 179.97 182.06 3klz h ASN 112 N -0.11 0.58 -0.60 -3.80 -1.24 0.31 0.05 115.58 110.78 3klz h ASN 112 Ca 0.06 0.12 -0.10 0.00 0.71 0.00 0.00 56.30 57.09 3klz h ASN 112 Cb 0.19 0.03 -0.02 0.00 0.73 0.00 0.00 38.32 39.25 3klz h ASN 112 CO -0.14 0.16 -0.01 -0.50 -1.29 0.00 0.00 177.43 175.66 3klz h TRP 113 N 0.60 1.15 -0.47 0.67 4.06 0.24 -2.24 115.95 119.96 3klz h TRP 113 Ca 0.55 -0.20 -0.04 0.00 2.06 0.00 0.00 58.89 61.25 3klz h TRP 113 Cb 0.92 -0.30 -0.02 0.00 -1.00 0.00 0.00 29.16 28.76 3klz h TRP 113 CO -0.06 1.02 0.12 1.15 -3.56 0.00 0.00 178.44 177.11 3klz h THR 114 N 0.95 1.23 -0.64 1.49 2.02 0.57 -0.90 112.91 117.63 3klz h THR 114 Ca 0.17 -0.81 -0.02 0.00 0.77 0.00 0.00 66.41 66.52 3klz h THR 114 Cb 0.57 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 3klz h THR 114 CO 0.03 0.29 0.33 0.58 0.37 0.00 0.00 175.52 177.12 3klz h VAL 115 N 0.64 1.21 -0.07 3.16 2.07 -0.86 -0.90 116.25 121.50 3klz h VAL 115 Ca 0.15 -0.57 -0.22 0.00 0.82 0.00 0.00 66.70 66.89 3klz h VAL 115 Cb 0.31 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 3klz h VAL 115 CO 0.00 0.24 -0.83 0.58 0.02 0.00 0.00 177.57 177.57 3klz h VAL 116 N 0.88 1.34 -0.29 2.57 2.07 -1.22 0.74 116.25 122.33 3klz h VAL 116 Ca 0.22 -2.17 -0.05 0.00 0.82 0.00 0.00 66.70 65.52 3klz h VAL 116 Cb 0.08 2.17 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 3klz h VAL 116 CO -0.03 0.66 -0.02 0.22 0.02 0.00 0.00 177.57 178.42 3klz h TYR 117 N 0.37 0.57 -0.12 1.57 3.20 -1.09 0.21 116.97 121.68 3klz h TYR 117 Ca -0.06 -0.11 -0.01 0.00 3.14 0.00 0.00 58.73 61.70 3klz h TYR 117 Cb 1.45 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 39.57 3klz h TYR 117 CO 0.07 0.68 0.05 0.35 -1.64 0.00 0.00 178.16 177.66 3klz h PHE 118 N 0.30 0.19 -0.21 -3.82 3.57 -1.14 -1.56 116.94 114.27 3klz h PHE 118 Ca 0.08 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.61 3klz h PHE 118 Cb 0.46 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.10 3klz h PHE 118 CO 0.04 0.28 -0.08 0.78 -2.23 0.00 0.00 178.31 177.10 3klz h GLY 119 N 0.04 0.11 0.15 2.40 0.00 -0.76 -0.56 103.07 104.45 3klz h GLY 119 Ca 0.04 0.10 0.17 0.00 0.00 0.00 0.00 47.33 47.65 3klz h GLY 119 CO -0.00 -0.10 0.53 3.43 0.00 0.00 0.00 176.54 180.40 3klz h ASN 120 N -0.05 0.66 -0.18 0.19 2.35 -0.43 -1.18 115.58 116.95 3klz h ASN 120 Ca 0.11 0.10 -0.05 0.00 -0.55 0.00 0.00 56.30 55.91 3klz h ASN 120 Cb 0.21 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 3klz h ASN 120 CO -0.24 0.24 -0.06 0.25 -1.65 0.00 0.00 177.43 175.97 3klz h LEU 121 N 0.69 0.37 -0.25 1.61 5.85 -0.42 -1.74 115.31 121.43 3klz h LEU 121 Ca 0.53 -0.39 0.02 0.00 0.84 0.00 0.00 57.88 58.88 3klz h LEU 121 Cb 0.81 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 3klz h LEU 121 CO -0.38 0.67 0.12 0.00 -0.34 0.00 0.00 178.44 178.51 3klz h GLY 123 N 0.26 0.68 1.00 0.00 0.00 -1.23 -0.71 103.07 103.07 3klz h GLY 123 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.42 3klz h GLY 123 CO -0.07 -0.10 0.35 1.76 0.00 0.00 0.00 176.54 178.47 3klz h SER 124 N 0.23 0.64 -0.38 0.19 0.02 -0.32 -2.53 113.55 111.40 3klz h SER 124 Ca 0.28 -0.03 -0.12 0.00 -0.84 0.00 0.00 61.79 61.08 3klz h SER 124 Cb 0.41 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 3klz h SER 124 CO -0.38 0.48 -0.24 0.40 -1.14 0.00 0.00 176.83 175.95 3klz h ILE 125 N 0.73 1.28 -0.58 3.27 1.08 -0.66 -1.72 117.51 120.91 3klz h ILE 125 Ca 0.20 -1.40 0.10 0.00 -0.39 0.00 0.00 64.86 63.37 3klz h ILE 125 Cb -0.05 1.34 -0.08 0.00 -3.07 0.00 0.00 36.82 34.96 3klz h ILE 125 CO -0.04 0.46 0.17 0.40 -0.69 0.00 0.00 178.15 178.46 3klz h ILE 126 N 0.65 0.72 -0.66 -0.67 2.04 -1.06 -1.61 117.51 116.91 3klz h ILE 126 Ca 0.08 -0.11 -0.06 0.00 1.00 0.00 0.00 64.86 65.76 3klz h ILE 126 Cb 0.81 0.36 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 3klz h ILE 126 CO 0.07 0.06 0.18 0.25 0.00 0.00 0.00 178.15 178.70 3klz h LEU 127 N 0.33 0.99 -0.51 1.44 5.85 -1.24 -2.25 115.31 119.91 3klz h LEU 127 Ca 0.30 -0.23 0.09 0.00 0.84 0.00 0.00 57.88 58.89 3klz h LEU 127 Cb 0.40 -0.26 -0.08 0.00 0.37 0.00 0.00 40.66 41.09 3klz h LEU 127 CO -0.34 0.96 0.07 0.58 -0.34 0.00 0.00 178.44 179.37 3klz h VAL 128 N 0.98 0.67 -0.24 1.05 2.07 -0.73 0.89 116.25 120.94 3klz h VAL 128 Ca 0.21 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.65 3klz h VAL 128 Cb 0.34 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 3klz h VAL 128 CO -0.00 0.04 0.10 -0.26 0.02 0.00 0.00 177.57 177.47 3klz h PHE 129 N 0.19 0.35 -0.42 1.57 0.04 -0.98 -0.40 116.94 117.29 3klz h PHE 129 Ca 0.26 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 61.00 3klz h PHE 129 Cb 0.37 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 38.40 3klz h PHE 129 CO -0.26 0.36 0.23 0.82 -0.60 0.00 0.00 178.31 178.86 3klz h ILE 130 N 0.24 1.15 -0.83 -0.55 2.04 -1.10 -2.15 117.51 116.31 3klz h ILE 130 Ca 0.08 -0.38 -0.03 0.00 1.00 0.00 0.00 64.86 65.53 3klz h ILE 130 Cb 0.15 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 36.83 3klz h ILE 130 CO -0.01 0.16 0.40 0.24 0.00 0.00 0.00 178.15 178.94 3klz h MET 131 N 0.54 1.20 -0.41 2.37 2.86 -0.66 -1.59 114.93 119.25 3klz h MET 131 Ca 0.15 -0.17 0.02 0.00 -2.06 0.00 0.00 59.70 57.63 3klz h MET 131 Cb 0.04 -0.22 -0.03 0.00 0.06 0.00 0.00 31.60 31.46 3klz h MET 131 CO -0.02 0.92 0.24 -0.07 1.06 0.00 0.00 176.91 179.03 3klz h LEU 132 N 1.19 0.39 -1.87 1.22 3.38 -0.92 -2.02 115.31 116.68 3klz h LEU 132 Ca 0.29 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.33 3klz h LEU 132 Cb 0.11 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 3klz h LEU 132 CO -0.04 0.28 0.25 0.00 0.09 0.00 0.00 178.44 179.02 3klz h ALA 133 N 1.18 2.13 0.00 1.53 0.00 -0.85 -0.81 119.26 122.44 3klz h ALA 133 Ca 0.16 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3klz h ALA 133 Cb 0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 3klz h ALA 133 CO -0.08 -0.21 -0.08 1.79 0.00 0.00 0.00 179.25 180.67 3klz h THR 134 N 0.16 0.23 -2.57 0.00 1.35 -0.54 -3.46 112.91 108.08 3klz h THR 134 Ca 0.16 -0.63 -0.37 0.00 -0.55 0.00 0.00 66.41 65.03 3klz h THR 134 Cb 0.44 1.50 -0.06 0.00 -1.73 0.00 0.00 68.15 68.31 3klz h THR 134 CO -0.02 0.08 -0.43 0.54 -0.25 0.00 0.00 175.52 175.44 3klz n ARG 135 N -3.25 -1.71 0.08 4.72 1.74 -0.31 -4.87 116.66 113.06 3klz n ARG 135 Ca -0.00 0.95 0.14 0.00 -0.77 0.00 0.00 57.85 58.16 3klz n ARG 135 Cb 0.30 -5.49 0.63 0.00 -1.02 0.00 0.00 32.46 26.89 3klz n ARG 135 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 3klz h GLN 136 N 0.00 0.08 -0.02 5.56 4.15 -1.83 -1.28 115.11 121.77 3klz h GLN 136 Ca -0.41 -0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.01 3klz h GLN 136 Cb 1.28 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.95 3klz h GLN 136 CO 0.52 0.05 0.28 0.27 -1.93 0.00 0.00 178.83 178.03 3klz h PHE 137 N 0.08 0.00 0.00 3.99 -5.15 -1.89 0.61 116.94 114.58 3klz h PHE 137 Ca 0.16 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.93 3klz h PHE 137 Cb 0.53 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.70 3klz h PHE 137 CO -0.00 0.00 0.00 0.52 -2.00 0.00 0.00 178.31 176.83 3klz h MET 138 N 0.00 0.00 -7.09 6.09 2.86 -1.55 -1.53 114.93 113.71 3klz h MET 138 Ca 0.01 0.00 -0.55 0.00 -2.06 0.00 0.00 59.70 57.10 3klz h MET 138 Cb 0.57 0.00 0.18 0.00 0.06 0.00 0.00 31.60 32.41 3klz h MET 138 CO -0.00 0.00 0.26 0.39 1.06 0.00 0.00 176.91 178.62 3klz n GLU 139 N -2.36 0.45 -3.69 1.72 -0.58 0.21 -0.89 120.64 115.50 3klz n GLU 139 Ca 0.04 0.22 -0.21 0.00 -0.42 0.00 0.00 57.16 56.79 3klz n GLU 139 Cb 0.38 -2.37 0.04 0.00 -0.57 0.00 0.00 31.44 28.92 3klz n GLU 139 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 3klz n ASP 140 N -2.42 -1.21 -2.19 1.62 2.03 -1.26 -1.48 116.55 111.64 3klz n ASP 140 Ca 0.14 -0.81 -0.20 0.00 0.52 0.00 0.00 54.79 54.44 3klz n ASP 140 Cb 0.50 -4.11 -0.03 0.00 -0.72 0.00 0.00 41.12 36.76 3klz n ASP 140 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3klz n GLY 141 N -1.55 0.11 1.65 0.27 0.00 -1.23 -1.00 105.19 103.45 3klz n GLY 141 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3klz n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3klz n GLY 142 N -0.83 1.78 0.40 -0.02 0.00 -0.07 -4.15 105.19 102.31 3klz n GLY 142 Ca -0.22 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.01 3klz n GLY 142 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3klz h GLN 143 N 2.82 0.00 -0.02 1.61 1.08 -0.86 -0.85 115.11 118.89 3klz h GLN 143 Ca 0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 3klz h GLN 143 Cb 0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3klz h GLN 143 CO 0.00 0.00 -0.01 1.25 -0.95 0.00 0.00 178.83 179.12 3klz h LEU 144 N 0.00 0.04 -0.69 1.46 6.46 -1.70 0.12 115.31 121.01 3klz h LEU 144 Ca 0.28 -0.44 0.11 0.00 -0.12 0.00 0.00 57.88 57.71 3klz h LEU 144 Cb 1.14 -0.01 -0.08 0.00 -0.73 0.00 0.00 40.66 40.98 3klz h LEU 144 CO -0.00 0.47 0.29 1.23 -0.62 0.00 0.00 178.44 179.80 3klz h GLY 145 N -0.39 1.01 0.97 3.75 0.00 -0.40 0.12 103.07 108.14 3klz h GLY 145 Ca 0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 47.33 47.14 3klz h GLY 145 CO 0.00 -0.02 0.16 1.41 0.00 0.00 0.00 176.54 178.09 3klz h LEU 146 N 0.47 0.71 -0.49 3.11 3.38 -1.01 -1.29 115.31 120.20 3klz h LEU 146 Ca 0.36 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 58.16 3klz h LEU 146 Cb 0.46 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 3klz h LEU 146 CO -0.33 0.72 0.26 -1.13 0.09 0.00 0.00 178.44 178.05 3klz h ASN 147 N 0.67 0.38 -0.65 -0.43 -1.24 0.01 -0.79 115.58 113.53 3klz h ASN 147 Ca 0.16 0.02 0.01 0.00 0.71 0.00 0.00 56.30 57.20 3klz h ASN 147 Cb 0.26 -0.05 -0.03 0.00 0.73 0.00 0.00 38.32 39.22 3klz h ASN 147 CO -0.01 0.27 0.43 0.00 -1.29 0.00 0.00 177.43 176.83 3klz h ALA 148 N 1.25 0.82 -0.35 1.57 0.00 -0.38 -0.93 119.26 121.24 3klz h ALA 148 Ca 0.21 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 3klz h ALA 148 Cb 0.09 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3klz h ALA 148 CO -0.13 0.25 -0.24 0.52 0.00 0.00 0.00 179.25 179.65 3klz h MET 149 N 0.88 0.77 -0.81 0.00 2.86 -0.96 -2.48 114.93 115.19 3klz h MET 149 Ca 0.24 -0.37 0.01 0.00 -2.06 0.00 0.00 59.70 57.52 3klz h MET 149 Cb -0.10 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.51 3klz h MET 149 CO -0.05 0.99 0.53 0.00 1.06 0.00 0.00 176.91 179.44 3klz h ALA 150 N 0.77 1.04 -0.54 6.32 0.00 -0.94 0.22 119.26 126.12 3klz h ALA 150 Ca 0.07 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3klz h ALA 150 Cb 0.80 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 3klz h ALA 150 CO 0.06 0.42 0.35 0.82 0.00 0.00 0.00 179.25 180.91 3klz h ILE 151 N 1.08 1.15 -0.18 0.00 2.04 -1.10 -1.84 117.51 118.65 3klz h ILE 151 Ca 0.30 -0.28 -0.17 0.00 1.00 0.00 0.00 64.86 65.71 3klz h ILE 151 Cb -0.10 0.37 -0.00 0.00 -0.74 0.00 0.00 36.82 36.34 3klz h ILE 151 CO -0.07 0.14 -0.59 0.28 0.00 0.00 0.00 178.15 177.91 3klz h SER 152 N 0.73 0.67 -0.59 1.72 0.02 -0.96 -3.11 113.55 112.03 3klz h SER 152 Ca 0.20 -0.37 -0.05 0.00 -0.84 0.00 0.00 61.79 60.73 3klz h SER 152 Cb -0.07 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.25 3klz h SER 152 CO -0.04 1.11 0.20 1.56 -1.14 0.00 0.00 176.83 178.51 3klz h GLN 153 N 0.45 0.94 0.00 3.45 4.20 -0.43 -2.31 115.11 121.41 3klz h GLN 153 Ca -0.00 -0.18 -0.03 0.00 0.06 0.00 0.00 58.65 58.50 3klz h GLN 153 Cb 1.15 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.78 3klz h GLN 153 CO 0.11 0.81 -0.16 1.25 -0.67 0.00 0.00 178.83 180.17 3klz h HIS 154 N 0.92 0.00 0.00 2.96 2.76 -1.29 -0.12 115.15 120.38 3klz h HIS 154 Ca 0.21 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.38 3klz h HIS 154 Cb 0.26 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.22 3klz h HIS 154 CO 0.02 0.16 0.00 1.63 -1.30 0.00 0.00 177.93 178.44 3klz n LYS 155 N -4.08 0.60 -0.34 5.26 5.02 -0.88 -3.76 118.16 119.99 3klz n LYS 155 Ca -0.02 0.01 0.07 0.00 -2.02 0.00 0.00 58.31 56.35 3klz n LYS 155 Cb 0.24 -1.50 0.22 0.00 -0.02 0.00 0.00 35.03 33.97 3klz n LYS 155 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3klz n LEU 156 N -1.18 3.54 -0.31 -0.35 4.77 -0.06 -4.50 117.00 118.92 3klz n LEU 156 Ca 0.17 -2.44 0.03 0.00 -0.03 0.00 0.00 56.01 53.74 3klz n LEU 156 Cb 0.18 -0.40 0.04 0.00 -2.33 0.00 0.00 43.42 40.91 3klz n LEU 156 CO 0.20 0.72 0.35 1.41 -1.33 0.00 0.00 177.39 178.74 3klz n HIS 157 N 0.23 0.00 -2.17 -1.77 8.25 -1.25 -4.90 115.22 113.61 3klz n HIS 157 Ca 0.17 -0.28 -0.34 0.00 -0.26 0.00 0.00 57.72 57.01 3klz n HIS 157 Cb 0.66 -0.07 0.01 0.00 1.12 0.00 0.00 29.99 31.71 3klz n HIS 157 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3klz s HIS 158 N -0.79 2.73 0.75 4.41 3.76 -1.26 -5.06 115.29 119.83 3klz s HIS 158 Ca 0.08 1.55 -0.11 0.00 -0.15 0.00 0.00 55.06 56.43 3klz s HIS 158 Cb 0.07 -3.21 0.04 0.00 1.11 0.00 0.00 32.58 30.60 3klz s HIS 158 CO 0.01 -1.46 1.08 0.95 -0.85 0.00 0.00 174.74 174.46 3klz s THR 159 N -1.98 3.53 0.20 1.30 -4.23 -1.26 -4.80 115.64 108.40 3klz s THR 159 Ca 0.70 0.50 -0.11 0.00 -1.18 0.00 0.00 61.69 61.60 3klz s THR 159 Cb -0.21 -3.15 0.15 0.00 1.34 0.00 0.00 72.50 70.62 3klz s THR 159 CO 0.30 -0.65 1.71 0.15 -0.54 0.00 0.00 174.62 175.58 3klz h PHE 160 N -0.97 0.17 -0.36 3.99 3.04 -1.96 0.28 116.94 121.13 3klz h PHE 160 Ca -0.45 0.03 -0.10 0.00 3.98 0.00 0.00 57.97 61.44 3klz h PHE 160 Cb 1.23 0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.75 3klz h PHE 160 CO 0.56 -0.03 -0.16 1.25 -2.02 0.00 0.00 178.31 177.90 3klz h LEU 161 N 0.24 0.77 -0.20 0.59 5.85 -1.99 -0.69 115.31 119.89 3klz h LEU 161 Ca 0.30 -0.40 0.02 0.00 0.84 0.00 0.00 57.88 58.63 3klz h LEU 161 Cb 0.43 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 3klz h LEU 161 CO -0.39 1.00 0.07 -0.61 -0.34 0.00 0.00 178.44 178.17 3klz h GLN 162 N 0.54 0.16 -0.74 1.25 4.15 -1.83 0.54 115.11 119.18 3klz h GLN 162 Ca 0.08 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.47 3klz h GLN 162 Cb 0.70 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.32 3klz h GLN 162 CO 0.05 0.11 0.38 0.00 -1.93 0.00 0.00 178.83 177.43 3klz h ALA 163 N 1.12 0.96 -0.36 3.38 0.00 -0.81 -0.49 119.26 123.06 3klz h ALA 163 Ca 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3klz h ALA 163 Cb 0.05 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3klz h ALA 163 CO -0.08 0.50 0.24 0.35 0.00 0.00 0.00 179.25 180.26 3klz h PHE 164 N 1.04 0.45 -0.50 0.00 3.57 -0.89 0.03 116.94 120.64 3klz h PHE 164 Ca 0.26 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.74 3klz h PHE 164 Cb 0.09 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.65 3klz h PHE 164 CO 0.01 0.28 0.20 0.00 -2.23 0.00 0.00 178.31 176.56 3klz h ALA 165 N 1.14 0.65 -0.99 2.41 0.00 -0.60 0.96 119.26 122.83 3klz h ALA 165 Ca 0.13 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 54.95 3klz h ALA 165 Cb -0.05 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 17.48 3klz h ALA 165 CO -0.03 0.26 0.64 -0.07 0.00 0.00 0.00 179.25 180.05 3klz h LEU 166 N 0.66 1.02 -0.58 0.00 3.38 -0.92 0.71 115.31 119.59 3klz h LEU 166 Ca 0.17 0.01 -0.12 0.00 0.09 0.00 0.00 57.88 58.03 3klz h LEU 166 Cb 0.20 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 3klz h LEU 166 CO -0.01 0.65 -0.15 1.23 0.09 0.00 0.00 178.44 180.25 3klz h GLY 167 N 1.16 1.06 0.88 0.83 0.00 -0.42 -1.71 103.07 104.86 3klz h GLY 167 Ca 0.43 -0.88 -0.00 0.00 0.00 0.00 0.00 47.33 46.88 3klz h GLY 167 CO -0.17 0.80 0.02 -2.00 0.00 0.00 0.00 176.54 175.19 3klz h LEU 168 N 0.86 0.06 -1.04 3.11 5.85 -0.02 -2.79 115.31 121.35 3klz h LEU 168 Ca 0.13 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 3klz h LEU 168 Cb 0.71 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.70 3klz h LEU 168 CO 0.05 0.17 0.21 0.24 -0.34 0.00 0.00 178.44 178.78 3klz h MET 169 N -0.07 0.91 0.19 1.25 2.86 -0.84 -2.41 114.93 116.82 3klz h MET 169 Ca 0.01 -0.16 0.01 0.00 -2.06 0.00 0.00 59.70 57.50 3klz h MET 169 Cb 0.13 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 3klz h MET 169 CO -0.00 0.76 -0.23 0.00 1.06 0.00 0.00 176.91 178.50 3klz h ASN 171 N -0.47 0.00 0.21 0.00 -1.24 -1.35 -1.60 115.58 111.13 3klz h ASN 171 Ca 0.01 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.02 3klz h ASN 171 Cb 0.46 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.50 3klz h ASN 171 CO -0.08 0.31 -0.17 0.40 -1.29 0.00 0.00 177.43 176.60 3klz h ILE 172 N 0.00 0.64 -0.67 2.57 2.04 -1.30 0.24 117.51 121.03 3klz h ILE 172 Ca -0.00 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.91 3klz h ILE 172 Cb 0.86 0.64 -0.05 0.00 -0.74 0.00 0.00 36.82 37.52 3klz h ILE 172 CO 0.04 0.00 0.39 -0.07 0.00 0.00 0.00 178.15 178.51 3klz h LEU 173 N -0.39 0.61 -0.27 1.44 -0.00 -1.05 -1.69 115.31 113.96 3klz h LEU 173 Ca -0.01 0.02 -0.07 0.00 -0.00 0.00 0.00 57.88 57.82 3klz h LEU 173 Cb 0.35 -0.10 -0.01 0.00 -0.00 0.00 0.00 40.66 40.89 3klz h LEU 173 CO -0.02 0.40 -0.11 0.58 -0.00 0.00 0.00 178.44 179.30 3klz h VAL 174 N 0.74 1.29 -0.78 1.22 2.07 -1.17 -1.17 116.25 118.45 3klz h VAL 174 Ca 0.29 -1.18 -0.04 0.00 0.82 0.00 0.00 66.70 66.59 3klz h VAL 174 Cb 0.13 1.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.36 3klz h VAL 174 CO -0.16 0.37 0.33 0.00 0.02 0.00 0.00 177.57 178.14 3klz h LEU 176 N 1.12 0.74 0.30 0.00 3.38 -1.13 0.16 115.31 119.88 3klz h LEU 176 Ca 0.26 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 3klz h LEU 176 Cb 0.18 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3klz h LEU 176 CO -0.03 0.51 -0.15 0.00 0.09 0.00 0.00 178.44 178.87 3klz h ALA 177 N 1.32 -0.41 -0.46 1.53 0.00 -0.55 -0.94 119.26 119.75 3klz h ALA 177 Ca 0.30 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 55.05 3klz h ALA 177 Cb 0.04 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 3klz h ALA 177 CO -0.12 -0.54 0.25 0.28 0.00 0.00 0.00 179.25 179.12 3klz h VAL 178 N -0.78 1.00 -0.37 0.00 2.07 -0.89 -2.51 116.25 114.77 3klz h VAL 178 Ca -0.04 -0.17 0.08 0.00 0.82 0.00 0.00 66.70 67.38 3klz h VAL 178 Cb 0.51 0.45 -0.07 0.00 -1.52 0.00 0.00 31.29 30.66 3klz h VAL 178 CO 0.07 0.09 -0.12 -0.25 0.02 0.00 0.00 177.57 177.38 3klz h TRP 179 N 0.50 -0.27 -0.64 1.57 2.91 -0.90 -1.58 115.95 117.55 3klz h TRP 179 Ca 0.19 0.04 0.15 0.00 1.13 0.00 0.00 58.89 60.40 3klz h TRP 179 Cb 0.07 0.18 -0.03 0.00 -0.51 0.00 0.00 29.16 28.86 3klz h TRP 179 CO -0.09 -0.19 0.44 0.52 -1.03 0.00 0.00 178.44 178.09 3klz h MET 180 N -0.04 0.20 0.00 2.65 2.86 -0.73 -0.98 114.93 118.90 3klz h MET 180 Ca 0.18 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.81 3klz h MET 180 Cb 0.31 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 31.93 3klz h MET 180 CO -0.40 0.13 -0.01 1.79 1.06 0.00 0.00 176.91 179.48 3klz h THR 181 N 0.20 0.03 0.00 2.22 1.35 -1.09 -2.92 112.91 112.71 3klz h THR 181 Ca 0.31 -0.53 -0.00 0.00 -0.55 0.00 0.00 66.41 65.63 3klz h THR 181 Cb 0.92 1.51 -0.00 0.00 -1.73 0.00 0.00 68.15 68.85 3klz h THR 181 CO -0.06 0.01 -0.02 -0.26 -0.25 0.00 0.00 175.52 174.94 3klz h PHE 182 N 0.00 0.00 -0.59 4.73 0.04 -1.15 -0.20 116.94 119.76 3klz h PHE 182 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3klz h PHE 182 Cb 0.51 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.66 3klz h PHE 182 CO 0.00 0.02 0.00 -1.13 -0.60 0.00 0.00 178.31 176.60 3klz n SER 183 N -3.60 3.73 -4.76 2.17 3.41 -1.10 -4.96 113.62 108.51 3klz n SER 183 Ca -0.03 -1.99 -0.36 0.00 -0.26 0.00 0.00 58.87 56.23 3klz n SER 183 Cb 0.11 -0.39 0.02 0.00 -0.26 0.00 0.00 64.21 63.69 3klz n SER 183 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3klz s ALA 184 N -1.16 2.71 0.00 7.33 0.00 -0.09 -4.96 121.76 125.58 3klz s ALA 184 Ca 0.44 0.98 0.00 0.00 0.00 0.00 0.00 51.96 53.38 3klz s ALA 184 Cb 0.24 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.93 3klz s ALA 184 CO 0.32 -0.97 0.37 2.89 0.00 0.00 0.00 175.76 178.37 3klz n ARG 185 N -1.21 -0.30 -4.04 0.00 1.85 -1.26 -5.04 116.66 106.66 3klz n ARG 185 Ca 0.11 -0.41 -0.10 0.00 -1.00 0.00 0.00 57.85 56.45 3klz n ARG 185 Cb 0.49 -0.81 -0.06 0.00 -1.05 0.00 0.00 32.46 31.03 3klz n ARG 185 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 3klz s SER 186 N -0.08 -0.03 0.16 2.89 1.04 -1.26 -5.02 113.70 111.40 3klz s SER 186 Ca 0.00 -1.02 -0.11 0.00 0.48 0.00 0.00 55.95 55.30 3klz s SER 186 Cb 0.00 0.55 0.02 0.00 0.10 0.00 0.00 66.02 66.70 3klz s SER 186 CO 0.00 -1.09 1.59 -0.07 0.98 0.00 0.00 173.24 174.64 3klz h LEU 187 N 2.31 0.96 -0.25 2.42 3.38 -2.00 -2.94 115.31 119.19 3klz h LEU 187 Ca -0.28 -0.34 0.05 0.00 0.09 0.00 0.00 57.88 57.40 3klz h LEU 187 Cb 1.25 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.69 3klz h LEU 187 CO 0.38 1.07 -0.08 0.74 0.09 0.00 0.00 178.44 180.65 3klz h THR 188 N 0.82 0.71 -0.91 0.22 2.02 -1.99 -0.81 112.91 112.98 3klz h THR 188 Ca 0.14 0.00 0.22 0.00 0.77 0.00 0.00 66.41 67.54 3klz h THR 188 Cb 0.63 0.71 -0.17 0.00 -1.74 0.00 0.00 68.15 67.58 3klz h THR 188 CO 0.04 0.00 -0.04 0.44 0.37 0.00 0.00 175.52 176.33 3klz h ASP 189 N -0.02 -0.53 -0.08 4.18 5.19 -1.92 0.47 116.42 123.70 3klz h ASP 189 Ca 0.12 0.26 -0.02 0.00 -0.62 0.00 0.00 57.03 56.77 3klz h ASP 189 Cb 0.21 0.47 -0.00 0.00 0.18 0.00 0.00 39.33 40.19 3klz h ASP 189 CO -0.27 -0.29 -0.05 0.11 -3.12 0.00 0.00 179.24 175.62 3klz h LYS 190 N 0.04 0.17 -0.32 3.56 1.57 -1.03 -2.78 116.57 117.78 3klz h LYS 190 Ca 0.51 -0.08 0.05 0.00 -1.87 0.00 0.00 60.65 59.26 3klz h LYS 190 Cb 0.96 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.22 3klz h LYS 190 CO -0.86 0.55 0.06 0.28 -0.57 0.00 0.00 179.45 178.92 3klz h VAL 191 N -0.21 0.84 -0.59 0.50 2.07 -0.78 -2.00 116.25 116.09 3klz h VAL 191 Ca 0.02 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.51 3klz h VAL 191 Cb 0.51 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 3klz h VAL 191 CO 0.01 0.03 0.39 0.24 0.02 0.00 0.00 177.57 178.27 3klz h MET 192 N 0.18 0.65 0.00 1.57 2.86 -0.89 -2.08 114.93 117.22 3klz h MET 192 Ca 0.15 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 3klz h MET 192 Cb 0.16 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.68 3klz h MET 192 CO -0.20 0.43 -0.79 1.33 1.06 0.00 0.00 176.91 178.74 3klz n VAL 193 N -4.47 0.18 0.03 -2.22 0.24 -1.05 -4.24 118.33 106.80 3klz n VAL 193 Ca 0.07 -0.19 -0.11 0.00 -2.04 0.00 0.00 64.34 62.07 3klz n VAL 193 Cb 0.15 0.15 -0.14 0.00 -1.47 0.00 0.00 33.84 32.54 3klz n VAL 193 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 3klz h LEU 194 N 0.00 0.15 0.42 1.34 3.38 -0.69 -3.41 115.31 116.49 3klz h LEU 194 Ca 0.00 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 3klz h LEU 194 Cb 0.67 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.38 3klz h LEU 194 CO 0.00 1.19 -0.20 0.40 0.09 0.00 0.00 178.44 179.92 3klz h ILE 195 N 0.03 0.59 -0.27 1.22 2.04 -1.62 -3.05 117.51 116.45 3klz h ILE 195 Ca -0.20 -0.10 -0.07 0.00 1.00 0.00 0.00 64.86 65.49 3klz h ILE 195 Cb 1.95 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 38.66 3klz h ILE 195 CO 0.12 0.02 -0.11 -0.07 0.00 0.00 0.00 178.15 178.11 3klz h LEU 196 N -0.62 0.56 -1.36 1.44 3.38 -1.83 -0.37 115.31 116.52 3klz h LEU 196 Ca -0.06 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.49 3klz h LEU 196 Cb 0.46 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3klz h LEU 196 CO 0.09 0.84 0.15 -0.65 0.09 0.00 0.00 178.44 178.96 3klz h PRO 197 N 0.28 0.59 0.05 1.13 0.11 -1.79 0.40 132.00 132.76 3klz h PRO 197 Ca 0.06 -0.08 -0.00 0.00 0.11 0.00 0.00 66.00 66.09 3klz h PRO 197 Cb 0.62 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.62 3klz h PRO 197 CO 0.04 0.50 -0.02 0.28 -0.21 0.00 0.00 178.00 178.58 3klz h VAL 198 N 0.58 1.29 -0.73 3.15 2.07 -1.42 -1.57 116.25 119.63 3klz h VAL 198 Ca 0.14 -1.19 0.11 0.00 0.82 0.00 0.00 66.70 66.59 3klz h VAL 198 Cb 0.14 2.06 -0.05 0.00 -1.52 0.00 0.00 31.29 31.91 3klz h VAL 198 CO -0.01 0.29 0.48 0.00 0.02 0.00 0.00 177.57 178.35 3klz h ALA 199 N 0.30 1.94 0.24 1.67 0.00 -0.74 -0.63 119.26 122.05 3klz h ALA 199 Ca -0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3klz h ALA 199 Cb 0.53 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3klz h ALA 199 CO 0.01 -0.11 -0.12 1.98 0.00 0.00 0.00 179.25 181.01 3klz h MET 200 N 0.54 -0.31 -0.67 0.00 -1.53 -0.11 -1.46 114.93 111.40 3klz h MET 200 Ca 0.35 0.02 -0.08 0.00 -3.44 0.00 0.00 59.70 56.55 3klz h MET 200 Cb 0.61 0.07 -0.03 0.00 -0.55 0.00 0.00 31.60 31.70 3klz h MET 200 CO -0.12 0.01 0.11 0.27 0.14 0.00 0.00 176.91 177.31 3klz h PHE 201 N -0.65 1.18 0.08 1.39 -5.15 -0.67 -1.75 116.94 111.36 3klz h PHE 201 Ca -0.03 -0.16 -0.00 0.00 -0.20 0.00 0.00 57.97 57.57 3klz h PHE 201 Cb 0.46 -0.32 0.00 0.00 0.22 0.00 0.00 35.95 36.31 3klz h PHE 201 CO 0.02 0.98 -0.04 0.28 -2.00 0.00 0.00 178.31 177.56 3klz h VAL 202 N 1.04 1.11 0.00 0.88 2.07 -1.21 -0.43 116.25 119.71 3klz h VAL 202 Ca 0.20 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 67.04 3klz h VAL 202 Cb 0.44 1.55 -0.00 0.00 -1.52 0.00 0.00 31.29 31.76 3klz h VAL 202 CO 0.01 0.17 -0.02 0.77 0.02 0.00 0.00 177.57 178.52 3klz h SER 203 N -0.42 0.00 0.48 0.57 4.64 -1.24 0.28 113.55 117.87 3klz h SER 203 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3klz h SER 203 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 3klz h SER 203 CO 0.02 0.02 -0.17 -1.20 -0.87 0.00 0.00 176.83 174.63 3klz n SER 204 N -3.22 0.44 -1.18 4.97 7.64 -0.66 -4.89 113.62 116.72 3klz n SER 204 Ca -0.02 -0.37 -0.13 0.00 1.01 0.00 0.00 58.87 59.36 3klz n SER 204 Cb 0.17 -0.07 -0.04 0.00 -1.01 0.00 0.00 64.21 63.26 3klz n SER 204 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3klz n GLY 205 N 1.35 0.76 3.76 0.23 0.00 0.09 -5.01 105.19 106.38 3klz n GLY 205 Ca 0.12 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.37 3klz n GLY 205 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3klz s PHE 206 N -2.54 2.63 -0.22 1.61 0.08 -0.20 -4.97 117.98 114.37 3klz s PHE 206 Ca 0.00 1.47 -0.09 0.00 0.12 0.00 0.00 56.93 58.43 3klz s PHE 206 Cb 0.00 -3.54 -0.04 0.00 -0.57 0.00 0.00 43.02 38.86 3klz s PHE 206 CO 0.00 -2.06 0.11 -1.21 -0.10 0.00 0.00 175.22 171.96 3klz s GLU 207 N -2.80 4.00 -0.20 0.44 0.41 -0.72 -4.71 118.70 115.11 3klz s GLU 207 Ca 0.67 -0.32 -0.04 0.00 -0.41 0.00 0.00 54.97 54.88 3klz s GLU 207 Cb -0.33 -3.38 -0.01 0.00 -1.78 0.00 0.00 34.13 28.62 3klz s GLU 207 CO 0.40 0.13 -0.05 -1.58 -0.49 0.00 0.00 175.26 173.67 3klz s HIS 208 N 0.80 2.96 0.24 1.61 5.65 -1.26 -4.20 115.29 121.08 3klz s HIS 208 Ca 0.06 -0.77 0.00 0.00 0.25 0.00 0.00 55.06 54.60 3klz s HIS 208 Cb -0.13 -2.06 0.28 0.00 -1.18 0.00 0.00 32.58 29.49 3klz s HIS 208 CO 0.02 -0.41 1.63 0.00 -0.65 0.00 0.00 174.74 175.32 3klz h ILE 210 N 0.41 1.33 -0.93 0.00 1.08 -1.97 -2.52 117.51 114.91 3klz h ILE 210 Ca 0.04 -1.48 0.01 0.00 -0.39 0.00 0.00 64.86 63.04 3klz h ILE 210 Cb 0.86 1.77 -0.05 0.00 -3.07 0.00 0.00 36.82 36.34 3klz h ILE 210 CO 0.07 0.46 0.61 0.00 -0.69 0.00 0.00 178.15 178.60 3klz h ALA 211 N 0.64 1.17 0.00 1.87 0.00 -1.86 -0.67 119.26 120.40 3klz h ALA 211 Ca 0.03 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3klz h ALA 211 Cb 0.86 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 3klz h ALA 211 CO 0.07 0.57 -0.14 -0.91 0.00 0.00 0.00 179.25 178.84 3klz h ASN 212 N 1.26 0.00 0.02 0.00 2.35 -1.23 -0.76 115.58 117.22 3klz h ASN 212 Ca 0.34 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.07 3klz h ASN 212 Cb -0.15 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 3klz h ASN 212 CO -0.07 0.14 -0.05 0.24 -1.65 0.00 0.00 177.43 176.04 3klz h MET 213 N 0.00 0.08 0.00 0.81 2.86 -0.66 -1.87 114.93 116.15 3klz h MET 213 Ca -0.00 -0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.58 3klz h MET 213 Cb 0.29 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 3klz h MET 213 CO 0.02 0.15 -0.35 0.35 1.06 0.00 0.00 176.91 178.14 3klz h PHE 214 N 0.08 0.00 -0.24 -0.22 3.57 -1.33 -3.39 116.94 115.41 3klz h PHE 214 Ca 0.02 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 3klz h PHE 214 Cb 0.15 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 3klz h PHE 214 CO 0.00 0.75 0.10 0.37 -2.23 0.00 0.00 178.31 177.31 3klz h GLN 215 N -1.00 0.35 0.04 1.11 5.75 -0.85 -0.58 115.11 119.93 3klz h GLN 215 Ca -0.08 -0.06 -0.00 0.00 -0.15 0.00 0.00 58.65 58.36 3klz h GLN 215 Cb 0.77 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.26 3klz h GLN 215 CO -0.05 0.38 -0.02 0.28 -2.65 0.00 0.00 178.83 176.77 3klz h VAL 216 N 0.24 1.30 -0.94 2.39 2.07 -1.61 -2.39 116.25 117.31 3klz h VAL 216 Ca 0.08 -1.22 0.09 0.00 0.82 0.00 0.00 66.70 66.47 3klz h VAL 216 Cb 0.15 2.10 -0.07 0.00 -1.52 0.00 0.00 31.29 31.95 3klz h VAL 216 CO -0.01 0.30 0.61 -0.65 0.02 0.00 0.00 177.57 177.84 3klz h PRO 217 N -0.61 0.95 -0.65 1.57 0.11 -1.72 -0.16 132.00 131.50 3klz h PRO 217 Ca -0.01 -0.06 0.05 0.00 0.11 0.00 0.00 66.00 66.10 3klz h PRO 217 Cb 0.54 -0.21 -0.05 0.00 0.11 0.00 0.00 31.00 31.38 3klz h PRO 217 CO 0.01 0.63 0.36 1.98 -0.21 0.00 0.00 178.00 180.77 3klz h MET 218 N 0.98 0.66 -0.30 1.05 1.85 -1.06 0.51 114.93 118.63 3klz h MET 218 Ca 0.44 -0.04 -0.14 0.00 -0.61 0.00 0.00 59.70 59.35 3klz h MET 218 Cb 0.37 -0.15 -0.01 0.00 0.43 0.00 0.00 31.60 32.24 3klz h MET 218 CO -0.19 0.44 -0.36 0.00 -0.40 0.00 0.00 176.91 176.39 3klz h ALA 219 N 1.33 0.80 -0.47 0.39 0.00 -0.73 0.77 119.26 121.34 3klz h ALA 219 Ca 0.29 -0.43 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 3klz h ALA 219 Cb 0.16 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3klz h ALA 219 CO -0.17 0.65 0.19 0.82 0.00 0.00 0.00 179.25 180.73 3klz h ILE 220 N 0.57 1.21 -0.62 0.00 2.04 -0.51 -1.08 117.51 119.11 3klz h ILE 220 Ca 0.06 -0.65 0.05 0.00 1.00 0.00 0.00 64.86 65.32 3klz h ILE 220 Cb 0.89 0.75 -0.05 0.00 -0.74 0.00 0.00 36.82 37.67 3klz h ILE 220 CO 0.08 0.24 0.34 1.23 0.00 0.00 0.00 178.15 180.04 3klz h GLY 221 N 0.62 0.90 0.94 5.37 0.00 0.37 -2.00 103.07 109.27 3klz h GLY 221 Ca 0.16 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.24 3klz h GLY 221 CO -0.01 0.14 0.14 -2.22 0.00 0.00 0.00 176.54 174.59 3klz h ILE 222 N 0.63 1.14 -0.82 2.60 2.04 -0.48 -0.30 117.51 122.32 3klz h ILE 222 Ca 0.28 -0.39 0.11 0.00 1.00 0.00 0.00 64.86 65.86 3klz h ILE 222 Cb 0.17 0.91 -0.08 0.00 -0.74 0.00 0.00 36.82 37.08 3klz h ILE 222 CO -0.18 0.14 0.45 0.50 0.00 0.00 0.00 178.15 179.07 3klz h LYS 223 N 0.31 0.71 0.00 2.37 3.64 -0.75 0.26 116.57 123.11 3klz h LYS 223 Ca 0.09 -0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.29 3klz h LYS 223 Cb 0.10 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 3klz h LYS 223 CO -0.01 0.47 -1.21 1.88 -2.27 0.00 0.00 179.45 178.31 3klz h TYR 224 N 0.73 0.00 0.00 1.91 0.05 -1.25 -3.38 116.97 115.04 3klz h TYR 224 Ca 0.41 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.19 3klz h TYR 224 Cb 0.44 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.18 3klz h TYR 224 CO -0.07 0.50 -1.61 1.19 -1.05 0.00 0.00 178.16 177.13 3klz n PHE 225 N -2.93 0.28 -1.69 4.88 3.72 -0.14 -4.95 117.46 116.63 3klz n PHE 225 Ca -0.07 0.08 -0.44 0.00 -0.05 0.00 0.00 57.45 56.98 3klz n PHE 225 Cb 0.79 -0.59 -0.02 0.00 -0.94 0.00 0.00 39.48 38.72 3klz n PHE 225 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3klz n ALA 226 N -2.16 1.47 -1.60 4.37 0.00 0.05 -4.98 120.51 117.66 3klz n ALA 226 Ca -0.02 0.39 -0.29 0.00 0.00 0.00 0.00 53.44 53.52 3klz n ALA 226 Cb 0.54 -2.31 0.14 0.00 0.00 0.00 0.00 19.45 17.82 3klz n ALA 226 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3klz s PRO 227 N -0.72 1.10 0.42 0.00 0.04 -1.26 -4.95 135.00 129.63 3klz s PRO 227 Ca 0.65 0.18 0.09 0.00 0.04 0.00 0.00 61.00 61.96 3klz s PRO 227 Cb -0.60 -1.84 0.90 0.00 0.04 0.00 0.00 34.50 32.99 3klz s PRO 227 CO 0.52 -2.20 2.02 1.49 0.04 0.00 0.00 177.00 178.87 3klz h GLU 228 N -1.50 0.35 -0.09 4.56 4.57 -2.01 -2.42 114.58 118.05 3klz h GLU 228 Ca -0.49 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 57.62 3klz h GLU 228 Cb 1.32 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.83 3klz h GLU 228 CO 0.59 0.31 -0.09 0.66 -1.18 0.00 0.00 179.01 179.30 3klz h SER 229 N 0.35 0.12 0.20 1.04 4.64 -1.99 -1.78 113.55 116.13 3klz h SER 229 Ca 0.09 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.38 3klz h SER 229 Cb 0.10 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 3klz h SER 229 CO -0.01 0.23 -0.10 0.15 -0.87 0.00 0.00 176.83 176.23 3klz h PHE 230 N 0.12 -0.25 -0.64 4.77 3.57 -1.80 -0.33 116.94 122.38 3klz h PHE 230 Ca 0.03 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3klz h PHE 230 Cb 0.25 0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.04 3klz h PHE 230 CO 0.00 -0.12 0.41 -1.49 -2.23 0.00 0.00 178.31 174.88 3klz h TRP 231 N -0.32 0.82 0.47 0.41 4.06 -1.46 -1.88 115.95 118.06 3klz h TRP 231 Ca -0.03 0.01 -0.02 0.00 2.06 0.00 0.00 58.89 60.91 3klz h TRP 231 Cb 0.25 -0.28 0.00 0.00 -1.00 0.00 0.00 29.16 28.13 3klz h TRP 231 CO -0.05 0.54 -0.23 0.00 -3.56 0.00 0.00 178.44 175.14 3klz h ALA 232 N 1.57 -0.63 -0.91 1.49 0.00 -1.19 -0.93 119.26 118.66 3klz h ALA 232 Ca 0.23 -0.19 0.20 0.00 0.00 0.00 0.00 54.91 55.16 3klz h ALA 232 Cb -0.07 0.24 -0.11 0.00 0.00 0.00 0.00 17.79 17.85 3klz h ALA 232 CO -0.05 -0.66 0.45 0.52 0.00 0.00 0.00 179.25 179.52 3klz h MET 233 N -1.03 0.50 0.00 0.00 2.86 -0.98 -1.76 114.93 114.53 3klz h MET 233 Ca -0.06 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.54 3klz h MET 233 Cb 0.58 -0.11 -0.00 0.00 0.06 0.00 0.00 31.60 32.12 3klz h MET 233 CO 0.11 0.33 -0.44 1.79 1.06 0.00 0.00 176.91 179.76 3klz h THR 234 N 0.52 0.05 -0.14 2.22 1.35 -1.37 -3.47 112.91 112.07 3klz h THR 234 Ca 0.54 -1.08 -0.06 0.00 -0.55 0.00 0.00 66.41 65.26 3klz h THR 234 Cb 0.95 1.83 -0.02 0.00 -1.73 0.00 0.00 68.15 69.18 3klz h THR 234 CO -0.46 0.03 -0.06 0.61 -0.25 0.00 0.00 175.52 175.39 3klz n GLY 235 N 1.14 0.60 3.94 5.82 0.00 -0.41 -5.03 105.19 111.26 3klz n GLY 235 Ca 0.02 -0.41 -0.20 0.00 0.00 0.00 0.00 46.02 45.42 3klz n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3klz s ALA 236 N -1.98 4.34 0.06 4.61 0.00 -0.87 -5.02 121.76 122.91 3klz s ALA 236 Ca 0.00 -1.79 -0.09 0.00 0.00 0.00 0.00 51.96 50.08 3klz s ALA 236 Cb 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 23.12 21.90 3klz s ALA 236 CO 0.00 -0.37 0.19 0.54 0.00 0.00 0.00 175.76 176.12 3klz s ASN 237 N -4.30 0.07 0.59 0.00 2.20 -1.26 -4.60 114.94 107.65 3klz s ASN 237 Ca 0.51 -0.50 0.34 0.00 -0.94 0.00 0.00 52.86 52.26 3klz s ASN 237 Cb -0.05 0.31 1.86 0.00 -2.00 0.00 0.00 41.25 41.37 3klz s ASN 237 CO 0.30 -0.64 2.22 -0.29 -2.94 0.00 0.00 177.10 175.75 3klz h ILE 238 N 3.13 0.34 0.00 0.54 2.10 -1.99 -0.35 117.51 121.28 3klz h ILE 238 Ca -0.33 -0.20 0.00 0.00 1.08 0.00 0.00 64.86 65.41 3klz h ILE 238 Cb 1.19 1.14 0.00 0.00 -1.09 0.00 0.00 36.82 38.07 3klz h ILE 238 CO 0.52 0.03 0.00 0.00 -1.08 0.00 0.00 178.15 177.62 3klz h ALA 239 N 1.96 1.00 0.00 0.18 0.00 -2.00 -1.95 119.26 118.46 3klz h ALA 239 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3klz h ALA 239 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3klz h ALA 239 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.29 3klz n GLN 240 N -2.52 0.41 -0.92 0.00 6.02 -0.14 -3.51 117.38 116.71 3klz n GLN 240 Ca 0.01 0.03 0.05 0.00 -0.01 0.00 0.00 57.00 57.08 3klz n GLN 240 Cb 0.25 -1.50 0.13 0.00 1.02 0.00 0.00 30.24 30.14 3klz n GLN 240 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3klz n TYR 241 N -1.27 0.00 0.04 1.08 4.01 -0.73 -4.79 117.16 115.50 3klz n TYR 241 Ca 0.13 -1.08 0.10 0.00 -0.16 0.00 0.00 57.90 56.89 3klz n TYR 241 Cb 0.21 -0.20 0.54 0.00 -0.31 0.00 0.00 39.34 39.58 3klz n TYR 241 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3klz h ALA 242 N 0.95 1.99 0.00 -0.72 0.00 -1.62 -1.50 119.26 118.35 3klz h ALA 242 Ca -0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3klz h ALA 242 Cb 1.35 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3klz h ALA 242 CO 0.04 -0.05 0.00 0.38 0.00 0.00 0.00 179.25 179.61 3klz h ASP 243 N 0.29 0.00 -2.28 0.00 2.03 -1.90 -3.41 116.42 111.15 3klz h ASP 243 Ca 0.16 0.00 -0.60 0.00 -0.73 0.00 0.00 57.03 55.86 3klz h ASP 243 Cb 0.28 0.00 -0.12 0.00 -0.83 0.00 0.00 39.33 38.66 3klz h ASP 243 CO -0.03 0.00 0.90 -0.22 -1.03 0.00 0.00 179.24 178.86 3klz s LEU 244 N -5.52 3.94 0.24 0.15 2.96 -0.57 -4.73 118.68 115.15 3klz s LEU 244 Ca 0.00 -1.03 -0.22 0.00 -0.22 0.00 0.00 54.13 52.66 3klz s LEU 244 Cb 0.09 -2.49 0.04 0.00 0.50 0.00 0.00 46.19 44.34 3klz s LEU 244 CO 0.44 -1.53 0.70 0.54 -1.32 0.00 0.00 176.35 175.18 3klz s ASN 245 N 3.90 -0.34 0.36 3.68 2.20 -1.26 -4.88 114.94 118.60 3klz s ASN 245 Ca 0.31 -0.43 0.07 0.00 -0.94 0.00 0.00 52.86 51.87 3klz s ASN 245 Cb -0.10 0.68 0.69 0.00 -2.00 0.00 0.00 41.25 40.52 3klz s ASN 245 CO 0.06 -1.22 1.89 -0.26 -2.94 0.00 0.00 177.10 174.63 3klz h PHE 246 N 2.00 0.40 0.82 1.54 0.04 -1.97 -1.63 116.94 118.13 3klz h PHE 246 Ca -0.23 -0.04 -0.04 0.00 2.80 0.00 0.00 57.97 60.45 3klz h PHE 246 Cb 1.26 -0.11 0.01 0.00 2.20 0.00 0.00 35.95 39.31 3klz h PHE 246 CO 0.37 0.46 -0.39 0.28 -0.60 0.00 0.00 178.31 178.43 3klz h VAL 247 N 0.36 0.13 -0.68 -0.55 2.07 -1.96 -1.67 116.25 113.94 3klz h VAL 247 Ca 0.08 -0.10 0.10 0.00 0.82 0.00 0.00 66.70 67.59 3klz h VAL 247 Cb 0.36 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 3klz h VAL 247 CO 0.02 0.01 0.45 0.78 0.02 0.00 0.00 177.57 178.85 3klz h ASN 248 N -1.19 0.49 0.67 0.57 2.35 -1.82 -1.20 115.58 115.45 3klz h ASN 248 Ca -0.11 0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.62 3klz h ASN 248 Cb 0.86 -0.09 0.01 0.00 0.05 0.00 0.00 38.32 39.14 3klz h ASN 248 CO 0.19 0.29 -0.33 0.15 -1.65 0.00 0.00 177.43 176.08 3klz h PHE 249 N 0.54 -0.86 0.23 1.19 3.57 -1.10 0.19 116.94 120.70 3klz h PHE 249 Ca 0.32 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.79 3klz h PHE 249 Cb 0.51 0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.53 3klz h PHE 249 CO -0.00 -0.53 -0.18 0.82 -2.23 0.00 0.00 178.31 176.19 3klz h ILE 250 N -0.91 0.62 -0.00 1.41 1.08 -0.92 0.99 117.51 119.77 3klz h ILE 250 Ca -0.09 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.34 3klz h ILE 250 Cb 0.70 0.62 0.00 0.00 -3.07 0.00 0.00 36.82 35.07 3klz h ILE 250 CO 0.14 0.00 -0.15 0.58 -0.69 0.00 0.00 178.15 178.04 3klz h VAL 251 N -0.42 1.58 0.00 1.67 2.07 -1.26 -0.94 116.25 118.94 3klz h VAL 251 Ca -0.01 -1.90 -0.06 0.00 0.82 0.00 0.00 66.70 65.55 3klz h VAL 251 Cb 0.37 2.81 -0.01 0.00 -1.52 0.00 0.00 31.29 32.94 3klz h VAL 251 CO -0.01 0.51 -0.38 0.78 0.02 0.00 0.00 177.57 178.49 3klz h ASN 252 N -0.61 0.00 0.00 0.57 2.35 -0.74 -3.42 115.58 113.73 3klz h ASN 252 Ca -0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 3klz h ASN 252 Cb 0.91 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.28 3klz h ASN 252 CO 0.03 0.27 0.00 -3.20 -1.65 0.00 0.00 177.43 172.88 3klz n ASN 253 N -3.12 0.05 -0.20 5.81 5.15 -0.79 -4.71 115.26 117.45 3klz n ASN 253 Ca 0.02 0.02 0.01 0.00 -0.60 0.00 0.00 54.58 54.02 3klz n ASN 253 Cb 0.64 -0.01 0.10 0.00 -0.53 0.00 0.00 39.78 39.99 3klz n ASN 253 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 3klz h LEU 254 N 0.00 -0.10 0.49 1.20 6.46 -0.67 0.50 115.31 123.19 3klz h LEU 254 Ca 0.00 0.13 -0.02 0.00 -0.12 0.00 0.00 57.88 57.86 3klz h LEU 254 Cb 0.00 0.19 -0.00 0.00 -0.73 0.00 0.00 40.66 40.12 3klz h LEU 254 CO 0.00 -0.04 -0.31 0.40 -0.62 0.00 0.00 178.44 177.87 3klz h ILE 255 N 0.20 0.00 -0.69 4.05 1.08 -1.42 0.82 117.51 121.55 3klz h ILE 255 Ca 0.31 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.84 3klz h ILE 255 Cb 0.48 0.00 -0.05 0.00 -3.07 0.00 0.00 36.82 34.18 3klz h ILE 255 CO -0.44 0.00 0.40 -0.65 -0.69 0.00 0.00 178.15 176.77 3klz h PRO 256 N -0.75 0.71 -0.36 2.37 0.11 -1.76 -1.64 132.00 130.68 3klz h PRO 256 Ca -0.07 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.92 3klz h PRO 256 Cb 0.61 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.54 3klz h PRO 256 CO 0.06 0.47 -0.07 0.28 -0.21 0.00 0.00 178.00 178.53 3klz h VAL 257 N 0.74 1.27 -0.24 3.15 2.07 -0.91 0.74 116.25 123.06 3klz h VAL 257 Ca 0.31 -1.13 0.01 0.00 0.82 0.00 0.00 66.70 66.70 3klz h VAL 257 Cb 0.17 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 3klz h VAL 257 CO -0.17 0.37 0.15 0.74 0.02 0.00 0.00 177.57 178.68 3klz h THR 258 N 0.48 1.05 -0.29 2.57 2.02 -0.66 0.18 112.91 118.26 3klz h THR 258 Ca 0.09 -0.11 0.05 0.00 0.77 0.00 0.00 66.41 67.22 3klz h THR 258 Cb 0.57 0.71 -0.05 0.00 -1.74 0.00 0.00 68.15 67.64 3klz h THR 258 CO 0.03 0.06 -0.01 -0.07 0.37 0.00 0.00 175.52 175.89 3klz h LEU 259 N 0.31 -0.15 -0.47 2.58 3.38 -1.21 -1.23 115.31 118.53 3klz h LEU 259 Ca 0.09 0.07 0.07 0.00 0.09 0.00 0.00 57.88 58.20 3klz h LEU 259 Cb -0.02 0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.80 3klz h LEU 259 CO -0.03 -0.04 0.12 1.23 0.09 0.00 0.00 178.44 179.81 3klz h GLY 260 N 0.07 0.58 0.89 0.83 0.00 -0.43 -0.43 103.07 104.58 3klz h GLY 260 Ca 0.14 -0.05 0.02 0.00 0.00 0.00 0.00 47.33 47.44 3klz h GLY 260 CO -0.25 -0.03 0.22 3.43 0.00 0.00 0.00 176.54 179.91 3klz h ASN 261 N 0.27 0.36 -0.31 0.19 2.35 -0.35 0.43 115.58 118.52 3klz h ASN 261 Ca 0.23 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.97 3klz h ASN 261 Cb 0.28 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 3klz h ASN 261 CO -0.28 0.26 0.14 0.40 -1.65 0.00 0.00 177.43 176.31 3klz h ILE 262 N 0.46 1.16 -0.73 2.81 2.04 -0.83 -0.36 117.51 122.06 3klz h ILE 262 Ca 0.16 -0.46 -0.04 0.00 1.00 0.00 0.00 64.86 65.51 3klz h ILE 262 Cb 0.02 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 3klz h ILE 262 CO -0.08 0.17 0.29 0.58 0.00 0.00 0.00 178.15 179.10 3klz h VAL 263 N 0.36 1.25 -0.59 1.67 2.07 -0.82 0.27 116.25 120.46 3klz h VAL 263 Ca 0.10 -0.79 0.08 0.00 0.82 0.00 0.00 66.70 66.91 3klz h VAL 263 Cb 0.13 0.41 -0.06 0.00 -1.52 0.00 0.00 31.29 30.24 3klz h VAL 263 CO -0.01 0.32 0.26 1.23 0.02 0.00 0.00 177.57 179.38 3klz h GLY 264 N 1.05 0.83 1.24 2.17 0.00 0.46 0.98 103.07 109.80 3klz h GLY 264 Ca 0.24 -0.16 -0.22 0.00 0.00 0.00 0.00 47.33 47.20 3klz h GLY 264 CO -0.02 0.04 -0.76 -1.33 0.00 0.00 0.00 176.54 174.48 3klz h GLY 265 N 0.48 0.83 0.64 4.60 0.00 -0.82 -2.98 103.07 105.82 3klz h GLY 265 Ca 0.28 -1.16 0.08 0.00 0.00 0.00 0.00 47.33 46.53 3klz h GLY 265 CO -0.25 1.03 0.53 -1.33 0.00 0.00 0.00 176.54 176.52 3klz h GLY 266 N 0.67 1.33 0.96 4.60 0.00 0.13 0.70 103.07 111.46 3klz h GLY 266 Ca -0.05 -0.37 -0.05 0.00 0.00 0.00 0.00 47.33 46.87 3klz h GLY 266 CO 0.15 0.22 0.09 -2.08 0.00 0.00 0.00 176.54 174.93 3klz h VAL 267 N 0.93 1.24 -0.48 4.60 2.07 -0.84 0.11 116.25 123.87 3klz h VAL 267 Ca 0.40 -0.85 -0.12 0.00 0.82 0.00 0.00 66.70 66.95 3klz h VAL 267 Cb 0.26 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 3klz h VAL 267 CO -0.20 0.30 -0.15 0.15 0.02 0.00 0.00 177.57 177.68 3klz h PHE 268 N 0.59 1.09 -0.30 1.57 3.04 -1.24 0.13 116.94 121.83 3klz h PHE 268 Ca 0.14 -0.25 -0.13 0.00 3.98 0.00 0.00 57.97 61.71 3klz h PHE 268 Cb 0.35 -0.26 -0.00 0.00 2.56 0.00 0.00 35.95 38.59 3klz h PHE 268 CO 0.02 1.05 -0.32 0.28 -2.02 0.00 0.00 178.31 177.32 3klz h VAL 269 N 0.81 1.30 -0.21 1.41 2.07 -0.82 -0.45 116.25 120.36 3klz h VAL 269 Ca 0.12 -1.50 0.04 0.00 0.82 0.00 0.00 66.70 66.18 3klz h VAL 269 Cb 0.72 1.57 -0.04 0.00 -1.52 0.00 0.00 31.29 32.02 3klz h VAL 269 CO 0.06 0.48 -0.05 1.23 0.02 0.00 0.00 177.57 179.30 3klz h GLY 270 N 0.50 0.15 0.71 2.17 0.00 -0.65 0.18 103.07 106.13 3klz h GLY 270 Ca 0.04 0.07 0.06 0.00 0.00 0.00 0.00 47.33 47.51 3klz h GLY 270 CO 0.08 -0.08 0.49 1.98 0.00 0.00 0.00 176.54 179.01 3klz h MET 271 N -0.00 0.87 -0.53 4.80 1.85 -0.64 -2.09 114.93 119.18 3klz h MET 271 Ca 0.10 -0.05 -0.06 0.00 -0.61 0.00 0.00 59.70 59.08 3klz h MET 271 Cb 0.15 -0.20 -0.02 0.00 0.43 0.00 0.00 31.60 31.97 3klz h MET 271 CO -0.22 0.58 0.11 2.35 -0.40 0.00 0.00 176.91 179.33 3klz h TRP 272 N 0.90 0.90 -0.45 1.39 7.01 -0.38 -2.74 115.95 122.57 3klz h TRP 272 Ca 0.36 -0.12 0.04 0.00 2.11 0.00 0.00 58.89 61.28 3klz h TRP 272 Cb 0.18 -0.25 -0.04 0.00 -2.10 0.00 0.00 29.16 26.95 3klz h TRP 272 CO -0.04 0.80 0.22 -0.92 -2.79 0.00 0.00 178.44 175.71 3klz h TYR 273 N 0.74 0.41 -0.43 2.65 3.20 -0.03 -2.38 116.97 121.14 3klz h TYR 273 Ca 0.16 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.02 3klz h TYR 273 Cb 0.37 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 3klz h TYR 273 CO 0.03 0.20 0.13 -1.49 -1.64 0.00 0.00 178.16 175.39 3klz h TRP 274 N 0.45 0.64 -0.53 -3.82 -0.00 -1.25 -2.43 115.95 109.00 3klz h TRP 274 Ca 0.20 -0.04 -0.11 0.00 -0.00 0.00 0.00 58.89 58.94 3klz h TRP 274 Cb 0.11 -0.19 -0.02 0.00 -0.00 0.00 0.00 29.16 29.06 3klz h TRP 274 CO -0.11 0.53 -0.09 -0.07 -0.00 0.00 0.00 178.44 178.70 3klz h LEU 275 N 0.62 0.99 -1.17 -4.49 3.38 -1.14 0.85 115.31 114.36 3klz h LEU 275 Ca 0.15 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.77 3klz h LEU 275 Cb 0.20 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.68 3klz h LEU 275 CO -0.01 1.11 0.00 0.16 0.09 0.00 0.00 178.44 179.79 3klz h ILE 276 N 0.86 0.00 0.00 1.22 -0.00 -1.31 -2.56 117.51 115.72 3klz h ILE 276 Ca 0.14 -0.59 -0.01 0.00 -0.00 0.00 0.00 64.86 64.40 3klz h ILE 276 Cb 0.65 1.58 -0.00 0.00 -0.00 0.00 0.00 36.82 39.05 3klz h ILE 276 CO 0.05 0.00 -0.06 0.22 -0.00 0.00 0.00 178.15 178.35 3klz h TYR 277 N 0.00 0.00 0.00 0.16 3.20 -0.93 -3.28 116.97 116.13 3klz h TYR 277 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3klz h TYR 277 Cb 0.59 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.86 3klz h TYR 277 CO 0.00 0.59 0.00 1.28 -1.64 0.00 0.00 178.16 178.39 3klz n LEU 278 N -4.67 0.00 0.00 2.82 4.77 0.24 -5.10 117.00 115.06 3klz n LEU 278 Ca -0.07 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 3klz n LEU 278 Cb 0.29 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3klz n LEU 278 CO 0.19 -0.23 0.10 1.17 -1.33 0.00 0.00 177.39 177.30