#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kcv n HIS 30 N 0.00 2.18 -0.33 2.13 -0.00 -1.26 -4.84 115.22 113.10 3kcv n HIS 30 Ca 0.00 0.24 0.26 0.00 -0.00 0.00 0.00 57.72 58.21 3kcv n HIS 30 Cb 0.00 -2.57 0.50 0.00 -0.00 0.00 0.00 29.99 27.92 3kcv n HIS 30 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 3kcv h PRO 31 N 7.98 0.22 0.04 1.57 0.11 -2.02 -1.00 132.00 138.90 3kcv h PRO 31 Ca -0.47 -0.01 -0.22 0.00 0.11 0.00 0.00 66.00 65.40 3kcv h PRO 31 Cb 1.29 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 3kcv h PRO 31 CO 0.94 0.14 -1.01 1.25 -0.21 0.00 0.00 178.00 179.11 3kcv h LEU 32 N 0.22 0.18 -0.41 2.35 6.46 -1.99 -1.15 115.31 120.98 3kcv h LEU 32 Ca 0.76 -0.18 -0.03 0.00 -0.12 0.00 0.00 57.88 58.32 3kcv h LEU 32 Cb 1.82 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 41.67 3kcv h LEU 32 CO -0.66 1.08 0.15 0.50 -0.62 0.00 0.00 178.44 178.89 3kcv h LYS 33 N 0.05 0.62 -0.89 1.25 3.64 -1.67 -1.45 116.57 118.11 3kcv h LYS 33 Ca -0.05 -0.12 0.17 0.00 -1.27 0.00 0.00 60.65 59.37 3kcv h LYS 33 Cb 1.72 -0.10 -0.10 0.00 -0.41 0.00 0.00 32.23 33.34 3kcv h LYS 33 CO 0.15 0.60 0.47 1.15 -2.27 0.00 0.00 179.45 179.55 3kcv h THR 34 N 0.51 0.68 -0.21 1.00 2.02 -1.13 -0.83 112.91 114.96 3kcv h THR 34 Ca 0.13 -0.21 -0.04 0.00 0.77 0.00 0.00 66.41 67.06 3kcv h THR 34 Cb 0.22 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.63 3kcv h THR 34 CO -0.01 0.11 -0.01 0.15 0.37 0.00 0.00 175.52 176.13 3kcv h PHE 35 N 0.62 0.42 -0.52 3.16 3.57 -0.40 0.14 116.94 123.93 3kcv h PHE 35 Ca 0.51 -0.08 0.03 0.00 3.53 0.00 0.00 57.97 61.96 3kcv h PHE 35 Cb 0.78 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.37 3kcv h PHE 35 CO -0.08 0.58 0.30 1.88 -2.23 0.00 0.00 178.31 178.77 3kcv h TYR 36 N 0.13 0.56 -0.24 0.41 0.05 -0.93 0.47 116.97 117.43 3kcv h TYR 36 Ca 0.06 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.85 3kcv h TYR 36 Cb 0.43 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 37.98 3kcv h TYR 36 CO 0.04 0.31 0.12 -0.07 -1.05 0.00 0.00 178.16 177.51 3kcv h LEU 37 N 0.59 0.28 -0.17 3.88 3.38 -0.98 -0.66 115.31 121.63 3kcv h LEU 37 Ca 0.22 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 58.09 3kcv h LEU 37 Cb 0.06 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 3kcv h LEU 37 CO -0.11 0.24 -0.23 0.00 0.09 0.00 0.00 178.44 178.42 3kcv h ALA 38 N 1.81 0.26 -0.91 1.53 0.00 0.52 -1.15 119.26 121.31 3kcv h ALA 38 Ca 0.09 -0.37 0.09 0.00 0.00 0.00 0.00 54.91 54.71 3kcv h ALA 38 Cb 0.02 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.70 3kcv h ALA 38 CO -0.01 0.22 0.59 0.82 0.00 0.00 0.00 179.25 180.86 3kcv h ILE 39 N 0.09 1.00 -0.51 0.00 2.04 -0.58 -1.11 117.51 118.45 3kcv h ILE 39 Ca 0.02 -0.33 -0.04 0.00 1.00 0.00 0.00 64.86 65.51 3kcv h ILE 39 Cb 0.80 -0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 3kcv h ILE 39 CO 0.05 0.18 0.16 0.74 0.00 0.00 0.00 178.15 179.28 3kcv h THR 40 N 0.96 1.23 -0.81 -0.27 2.02 -0.86 -1.80 112.91 113.37 3kcv h THR 40 Ca 0.42 -0.76 -0.03 0.00 0.77 0.00 0.00 66.41 66.81 3kcv h THR 40 Cb 0.33 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 67.47 3kcv h THR 40 CO -0.17 0.28 0.39 0.00 0.37 0.00 0.00 175.52 176.38 3kcv h ALA 41 N 1.02 1.16 -0.23 6.16 0.00 -0.13 0.17 119.26 127.40 3kcv h ALA 41 Ca 0.16 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.94 3kcv h ALA 41 Cb 0.27 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3kcv h ALA 41 CO -0.01 0.64 0.10 0.78 0.00 0.00 0.00 179.25 180.76 3kcv h GLY 42 N 1.18 0.29 1.04 0.00 0.00 -1.04 0.20 103.07 104.74 3kcv h GLY 42 Ca 0.28 -0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.54 3kcv h GLY 42 CO -0.04 0.05 0.56 -2.08 0.00 0.00 0.00 176.54 175.04 3kcv h VAL 43 N 0.22 1.26 0.18 4.60 2.07 -0.92 -2.34 116.25 121.31 3kcv h VAL 43 Ca 0.10 -0.56 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 3kcv h VAL 43 Cb 0.04 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 29.75 3kcv h VAL 43 CO -0.08 0.27 -0.08 -0.26 0.02 0.00 0.00 177.57 177.43 3kcv h PHE 44 N 1.29 -0.22 -0.17 1.57 0.04 0.09 -0.29 116.94 119.25 3kcv h PHE 44 Ca 0.34 -0.01 -0.05 0.00 2.80 0.00 0.00 57.97 61.05 3kcv h PHE 44 Cb -0.05 0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.16 3kcv h PHE 44 CO 0.01 0.02 -0.12 0.97 -0.60 0.00 0.00 178.31 178.58 3kcv h ILE 45 N -0.43 1.18 -0.35 -0.55 6.09 -0.66 -1.74 117.51 121.05 3kcv h ILE 45 Ca -0.02 -0.79 -0.03 0.00 -1.37 0.00 0.00 64.86 62.65 3kcv h ILE 45 Cb 0.33 1.19 -0.01 0.00 0.47 0.00 0.00 36.82 38.80 3kcv h ILE 45 CO 0.04 0.25 0.09 0.28 -3.07 0.00 0.00 178.15 175.73 3kcv h SER 46 N 0.25 0.53 -0.94 2.19 0.02 -1.27 -2.08 113.55 112.25 3kcv h SER 46 Ca 0.05 -0.23 0.09 0.00 -0.84 0.00 0.00 61.79 60.87 3kcv h SER 46 Cb 0.37 -0.14 -0.08 0.00 0.14 0.00 0.00 62.40 62.70 3kcv h SER 46 CO 0.02 0.62 0.58 0.40 -1.14 0.00 0.00 176.83 177.32 3kcv h ILE 47 N 0.41 0.97 -0.38 3.27 2.04 -0.63 0.56 117.51 123.74 3kcv h ILE 47 Ca 0.11 -0.34 0.06 0.00 1.00 0.00 0.00 64.86 65.69 3kcv h ILE 47 Cb 0.30 -0.10 -0.05 0.00 -0.74 0.00 0.00 36.82 36.23 3kcv h ILE 47 CO 0.00 0.18 0.08 0.00 0.00 0.00 0.00 178.15 178.41 3kcv h ALA 48 N 1.48 0.41 -0.44 1.87 0.00 -0.97 -1.59 119.26 120.03 3kcv h ALA 48 Ca 0.44 0.08 -0.15 0.00 0.00 0.00 0.00 54.91 55.28 3kcv h ALA 48 Cb 0.35 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3kcv h ALA 48 CO -0.23 -0.32 -0.30 0.35 0.00 0.00 0.00 179.25 178.75 3kcv h PHE 49 N 0.20 1.15 -0.41 0.00 3.04 -0.63 -2.07 116.94 118.23 3kcv h PHE 49 Ca 0.18 -0.31 0.03 0.00 3.98 0.00 0.00 57.97 61.85 3kcv h PHE 49 Cb 0.22 -0.25 -0.03 0.00 2.56 0.00 0.00 35.95 38.44 3kcv h PHE 49 CO -0.19 1.14 0.21 0.28 -2.02 0.00 0.00 178.31 177.73 3kcv h VAL 50 N 0.82 0.99 -0.91 1.41 2.07 -0.76 -1.04 116.25 118.82 3kcv h VAL 50 Ca 0.09 -0.15 0.08 0.00 0.82 0.00 0.00 66.70 67.54 3kcv h VAL 50 Cb 0.89 0.52 -0.07 0.00 -1.52 0.00 0.00 31.29 31.11 3kcv h VAL 50 CO 0.08 0.08 0.57 0.15 0.02 0.00 0.00 177.57 178.47 3kcv h PHE 51 N 0.43 1.05 -0.22 1.57 3.57 -1.15 0.25 116.94 122.43 3kcv h PHE 51 Ca 0.17 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 3kcv h PHE 51 Cb 0.07 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.46 3kcv h PHE 51 CO -0.10 0.50 0.07 -0.92 -2.23 0.00 0.00 178.31 175.63 3kcv h TYR 52 N 1.00 0.36 -0.21 0.41 3.20 -0.86 0.48 116.97 121.34 3kcv h TYR 52 Ca 0.41 -0.04 0.02 0.00 3.14 0.00 0.00 58.73 62.27 3kcv h TYR 52 Cb 0.26 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 3kcv h TYR 52 CO -0.02 0.43 0.07 0.82 -1.64 0.00 0.00 178.16 177.81 3kcv h ILE 53 N 0.18 0.94 -0.51 1.81 1.08 -0.72 -1.68 117.51 118.61 3kcv h ILE 53 Ca 0.07 -0.06 0.07 0.00 -0.39 0.00 0.00 64.86 64.56 3kcv h ILE 53 Cb 0.24 0.76 -0.06 0.00 -3.07 0.00 0.00 36.82 34.69 3kcv h ILE 53 CO -0.00 0.03 0.17 0.74 -0.69 0.00 0.00 178.15 178.40 3kcv h THR 54 N 0.16 0.80 -0.37 -0.27 2.02 -0.76 -1.57 112.91 112.93 3kcv h THR 54 Ca 0.09 -0.12 -0.07 0.00 0.77 0.00 0.00 66.41 67.08 3kcv h THR 54 Cb 0.07 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 66.89 3kcv h THR 54 CO -0.10 0.06 -0.08 0.00 0.37 0.00 0.00 175.52 175.77 3kcv h ALA 55 N 1.35 1.18 -0.84 6.16 0.00 -0.68 -3.13 119.26 123.29 3kcv h ALA 55 Ca 0.25 -0.27 -0.49 0.00 0.00 0.00 0.00 54.91 54.40 3kcv h ALA 55 Cb 0.29 -0.16 -0.27 0.00 0.00 0.00 0.00 17.79 17.65 3kcv h ALA 55 CO -0.27 0.53 0.45 0.25 0.00 0.00 0.00 179.25 180.21 3kcv n THR 56 N -4.21 3.13 -3.28 0.00 -2.24 -0.65 -4.89 114.28 102.15 3kcv n THR 56 Ca 0.01 -2.55 -0.42 0.00 -2.27 0.00 0.00 64.05 58.82 3kcv n THR 56 Cb 0.32 -0.67 -0.08 0.00 -2.10 0.00 0.00 70.33 67.79 3kcv n THR 56 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3kcv s THR 57 N -3.80 5.04 0.00 4.28 2.01 -0.65 -4.14 115.64 118.38 3kcv s THR 57 Ca 0.56 -0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.51 3kcv s THR 57 Cb 0.47 -4.01 0.00 0.00 0.01 0.00 0.00 72.50 68.96 3kcv s THR 57 CO 0.05 -0.35 0.00 0.61 -0.69 0.00 0.00 174.62 174.24 3kcv n GLY 58 N 5.00 0.95 1.54 4.40 0.00 -1.26 -4.98 105.19 110.84 3kcv n GLY 58 Ca -0.06 -0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.49 3kcv n GLY 58 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3kcv n THR 59 N -2.29 1.97 0.38 2.61 -2.24 -1.26 -4.54 114.28 108.92 3kcv n THR 59 Ca 0.00 -0.89 -0.18 0.00 -2.27 0.00 0.00 64.05 60.71 3kcv n THR 59 Cb 0.05 -0.70 -0.09 0.00 -2.10 0.00 0.00 70.33 67.48 3kcv n THR 59 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3kcv h GLY 60 N 2.80 -1.00 2.00 3.38 0.00 -1.93 -3.11 103.07 105.21 3kcv h GLY 60 Ca 0.27 0.38 -0.06 0.00 0.00 0.00 0.00 47.33 47.92 3kcv h GLY 60 CO 0.50 -0.36 -0.28 -0.84 0.00 0.00 0.00 176.54 175.56 3kcv h THR 61 N -0.95 1.12 -3.99 4.70 2.02 -2.05 -3.45 112.91 110.31 3kcv h THR 61 Ca -0.09 -0.98 -0.53 0.00 0.77 0.00 0.00 66.41 65.58 3kcv h THR 61 Cb 0.74 1.54 0.09 0.00 -1.74 0.00 0.00 68.15 68.78 3kcv h THR 61 CO 0.14 0.27 0.59 -0.04 0.37 0.00 0.00 175.52 176.86 3kcv s MET 62 N -4.32 3.71 0.11 6.66 1.00 -1.18 -4.92 119.30 120.36 3kcv s MET 62 Ca -0.03 2.11 -0.35 0.00 0.00 0.00 0.00 55.69 57.42 3kcv s MET 62 Cb 0.15 -2.55 -0.15 0.00 0.00 0.00 0.00 34.83 32.27 3kcv s MET 62 CO 0.70 -0.70 1.52 -2.30 0.00 0.00 0.00 175.02 174.24 3kcv n PRO 63 N -0.30 1.79 -0.32 2.03 -0.02 -1.26 -4.82 135.00 132.09 3kcv n PRO 63 Ca 0.06 0.65 -0.07 0.00 -2.02 0.00 0.00 63.50 62.12 3kcv n PRO 63 Cb 0.45 -2.38 -0.05 0.00 -0.02 0.00 0.00 33.50 31.50 3kcv n PRO 63 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3kcv n PHE 64 N 3.38 -0.25 0.00 6.00 7.35 -1.26 -1.62 117.46 131.06 3kcv n PHE 64 Ca 0.18 0.98 0.00 0.00 -0.76 0.00 0.00 57.45 57.85 3kcv n PHE 64 Cb 0.25 -0.62 0.00 0.00 0.35 0.00 0.00 39.48 39.46 3kcv n PHE 64 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3kcv n GLY 65 N -1.24 -3.21 0.37 7.13 0.00 -1.26 -1.78 105.19 105.19 3kcv n GLY 65 Ca 0.03 0.45 0.25 0.00 0.00 0.00 0.00 46.02 46.75 3kcv n GLY 65 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3kcv h MET 66 N 0.00 0.32 -0.22 1.61 2.86 -1.67 0.56 114.93 118.38 3kcv h MET 66 Ca 0.00 -0.02 -0.07 0.00 -2.06 0.00 0.00 59.70 57.56 3kcv h MET 66 Cb 0.00 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 3kcv h MET 66 CO 0.00 0.21 -0.12 0.00 1.06 0.00 0.00 176.91 178.06 3kcv h ALA 67 N 1.75 0.31 0.89 6.32 0.00 -1.41 -1.68 119.26 125.44 3kcv h ALA 67 Ca 0.71 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 55.27 3kcv h ALA 67 Cb 1.75 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 19.47 3kcv h ALA 67 CO -0.50 0.17 -0.43 0.87 0.00 0.00 0.00 179.25 179.36 3kcv h LYS 68 N 0.17 -1.15 -0.43 0.00 6.56 0.80 -1.28 116.57 121.24 3kcv h LYS 68 Ca 0.05 0.08 0.04 0.00 -1.06 0.00 0.00 60.65 59.75 3kcv h LYS 68 Cb 0.62 0.26 -0.05 0.00 -0.57 0.00 0.00 32.23 32.50 3kcv h LYS 68 CO 0.04 -0.76 -0.25 -0.11 -2.06 0.00 0.00 179.45 176.30 3kcv n LEU 69 N -5.57 -0.45 -0.05 2.94 7.94 0.36 0.87 117.00 123.04 3kcv n LEU 69 Ca -0.15 0.84 -0.01 0.00 -1.11 0.00 0.00 56.01 55.58 3kcv n LEU 69 Cb 0.47 -0.14 0.27 0.00 0.53 0.00 0.00 43.42 44.56 3kcv n LEU 69 CO 0.37 -0.66 0.98 0.58 -1.11 0.00 0.00 177.39 177.55 3kcv h VAL 70 N 0.00 1.20 0.24 1.96 2.07 -1.25 -0.89 116.25 119.58 3kcv h VAL 70 Ca 0.07 -0.71 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 3kcv h VAL 70 Cb 0.18 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 3kcv h VAL 70 CO -0.40 0.26 -0.12 1.23 0.02 0.00 0.00 177.57 178.56 3kcv h GLY 71 N 0.86 -0.34 0.57 2.17 0.00 0.17 -1.98 103.07 104.52 3kcv h GLY 71 Ca 0.14 0.12 0.09 0.00 0.00 0.00 0.00 47.33 47.69 3kcv h GLY 71 CO -0.00 -0.12 0.58 -1.33 0.00 0.00 0.00 176.54 175.66 3kcv h GLY 72 N -0.44 1.47 0.61 4.60 0.00 -0.77 0.39 103.07 108.93 3kcv h GLY 72 Ca -0.03 -0.40 0.05 0.00 0.00 0.00 0.00 47.33 46.95 3kcv h GLY 72 CO 0.05 0.20 0.09 -2.22 0.00 0.00 0.00 176.54 174.66 3kcv h ILE 73 N 0.97 0.84 -0.19 2.60 2.04 -1.00 -1.62 117.51 121.16 3kcv h ILE 73 Ca 0.44 -0.08 -0.04 0.00 1.00 0.00 0.00 64.86 66.19 3kcv h ILE 73 Cb 0.35 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 3kcv h ILE 73 CO -0.23 0.04 -0.06 0.00 0.00 0.00 0.00 178.15 177.90 3kcv h PHE 75 N 0.27 0.67 -0.02 0.00 3.57 0.01 -2.41 116.94 119.03 3kcv h PHE 75 Ca 0.06 -0.05 0.01 0.00 3.53 0.00 0.00 57.97 61.52 3kcv h PHE 75 Cb 0.29 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 38.83 3kcv h PHE 75 CO 0.01 0.57 0.14 0.66 -2.23 0.00 0.00 178.31 177.45 3kcv h SER 76 N 0.64 0.00 -0.75 0.41 4.64 -1.24 -1.62 113.55 115.62 3kcv h SER 76 Ca 0.15 0.00 0.15 0.00 -0.47 0.00 0.00 61.79 61.61 3kcv h SER 76 Cb 0.24 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.18 3kcv h SER 76 CO -0.00 0.00 -0.23 0.25 -0.87 0.00 0.00 176.83 175.98 3kcv h LEU 77 N 0.00 -0.84 -1.15 5.97 6.46 -1.59 -0.28 115.31 123.87 3kcv h LEU 77 Ca 0.01 0.24 0.05 0.00 -0.12 0.00 0.00 57.88 58.06 3kcv h LEU 77 Cb 0.28 0.51 -0.06 0.00 -0.73 0.00 0.00 40.66 40.67 3kcv h LEU 77 CO -0.00 -0.27 0.58 1.23 -0.62 0.00 0.00 178.44 179.37 3kcv h GLY 78 N -0.03 1.29 1.75 3.75 0.00 -1.50 0.17 103.07 108.50 3kcv h GLY 78 Ca 0.35 -0.42 -0.21 0.00 0.00 0.00 0.00 47.33 47.05 3kcv h GLY 78 CO -0.79 0.32 -0.93 -2.00 0.00 0.00 0.00 176.54 173.15 3kcv h LEU 79 N 1.05 0.29 -1.19 3.11 5.85 -1.52 -1.77 115.31 121.14 3kcv h LEU 79 Ca 0.37 -0.25 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 3kcv h LEU 79 Cb 0.14 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 3kcv h LEU 79 CO -0.13 1.07 0.16 0.40 -0.34 0.00 0.00 178.44 179.60 3kcv h ILE 80 N 0.11 1.20 0.73 4.05 2.04 -0.24 -1.56 117.51 123.84 3kcv h ILE 80 Ca -0.06 -0.66 -0.04 0.00 1.00 0.00 0.00 64.86 65.11 3kcv h ILE 80 Cb 1.58 0.65 0.01 0.00 -0.74 0.00 0.00 36.82 38.32 3kcv h ILE 80 CO 0.14 0.25 -0.35 -0.07 0.00 0.00 0.00 178.15 178.13 3kcv h LEU 81 N 0.71 -0.82 -0.89 1.44 4.07 -0.54 -1.06 115.31 118.22 3kcv h LEU 81 Ca 0.17 0.01 0.21 0.00 0.08 0.00 0.00 57.88 58.34 3kcv h LEU 81 Cb 0.20 0.21 -0.12 0.00 1.08 0.00 0.00 40.66 42.03 3kcv h LEU 81 CO -0.01 -0.53 0.40 0.00 -1.08 0.00 0.00 178.44 177.22 3kcv h VAL 83 N 0.43 0.00 0.00 0.00 2.07 -1.30 0.05 116.25 117.50 3kcv h VAL 83 Ca 0.55 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 67.29 3kcv h VAL 83 Cb 1.01 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 3kcv h VAL 83 CO -0.50 0.00 0.00 0.52 0.02 0.00 0.00 177.57 177.61 3kcv n VAL 84 N -4.69 0.00 0.00 2.57 0.31 -0.41 -2.30 118.33 113.82 3kcv n VAL 84 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 3kcv n VAL 84 Cb 0.08 -0.27 0.00 0.00 -0.91 0.00 0.00 33.84 32.74 3kcv n VAL 84 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3kcv n GLY 86 N 0.16 0.01 3.86 0.00 0.00 -0.54 -5.03 105.19 103.66 3kcv n GLY 86 Ca 0.00 -0.38 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 3kcv n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kcv s ALA 87 N -2.70 3.13 -0.45 4.61 0.00 -0.11 -4.95 121.76 121.29 3kcv s ALA 87 Ca 0.08 -0.01 -0.18 0.00 0.00 0.00 0.00 51.96 51.85 3kcv s ALA 87 Cb -0.04 -3.03 0.04 0.00 0.00 0.00 0.00 23.12 20.09 3kcv s ALA 87 CO 0.10 -0.41 0.51 0.34 0.00 0.00 0.00 175.76 176.31 3kcv s ASP 88 N -3.59 6.21 -0.27 0.00 2.15 -0.92 -4.75 116.67 115.50 3kcv s ASP 88 Ca 0.56 -0.77 -0.07 0.00 0.43 0.00 0.00 52.55 52.71 3kcv s ASP 88 Cb -0.10 -2.25 -0.00 0.00 -0.30 0.00 0.00 42.92 40.26 3kcv s ASP 88 CO 0.41 -0.70 0.07 -0.22 -0.17 0.00 0.00 175.17 174.56 3kcv s LEU 89 N 2.31 3.64 -0.24 -1.34 2.96 -1.26 -4.36 118.68 120.39 3kcv s LEU 89 Ca 0.13 -0.52 -0.11 0.00 -0.22 0.00 0.00 54.13 53.41 3kcv s LEU 89 Cb -0.18 -1.88 -0.06 0.00 0.50 0.00 0.00 46.19 44.56 3kcv s LEU 89 CO 0.13 -0.13 0.75 0.33 -1.32 0.00 0.00 176.35 176.11 3kcv n PHE 90 N 4.88 0.25 -0.17 5.38 7.35 -1.26 -0.43 117.46 133.47 3kcv n PHE 90 Ca -0.15 0.17 0.00 0.00 -0.76 0.00 0.00 57.45 56.71 3kcv n PHE 90 Cb 0.49 -0.71 0.00 0.00 0.35 0.00 0.00 39.48 39.61 3kcv n PHE 90 CO 0.00 0.00 0.00 2.41 -0.76 0.00 0.00 176.76 178.41 3kcv n THR 91 N 2.15 0.00 -0.36 -2.13 -1.04 -1.26 -4.85 114.28 106.80 3kcv n THR 91 Ca 0.19 0.00 0.35 0.00 -2.04 0.00 0.00 64.05 62.54 3kcv n THR 91 Cb -0.00 -0.05 0.71 0.00 -1.82 0.00 0.00 70.33 69.17 3kcv n THR 91 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 3kcv h SER 92 N 0.00 0.09 -0.40 8.00 4.64 -1.11 -1.54 113.55 123.22 3kcv h SER 92 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3kcv h SER 92 Cb 0.00 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 3kcv h SER 92 CO 0.00 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.31 3kcv n THR 93 N -4.26 1.80 -0.29 2.95 -2.24 -1.26 -4.00 114.28 106.97 3kcv n THR 93 Ca 0.28 -1.41 0.10 0.00 -2.27 0.00 0.00 64.05 60.75 3kcv n THR 93 Cb 1.26 0.08 0.26 0.00 -2.10 0.00 0.00 70.33 69.83 3kcv n THR 93 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 3kcv h VAL 94 N 2.55 0.48 -0.46 2.28 3.04 -1.65 0.18 116.25 122.67 3kcv h VAL 94 Ca 0.00 -0.12 -0.07 0.00 -1.01 0.00 0.00 66.70 65.50 3kcv h VAL 94 Cb 1.25 0.10 -0.02 0.00 -2.01 0.00 0.00 31.29 30.61 3kcv h VAL 94 CO 0.17 0.06 -0.00 -0.07 -1.01 0.00 0.00 177.57 176.72 3kcv h LEU 95 N 0.35 0.73 -1.04 3.16 3.38 -1.88 -2.19 115.31 117.82 3kcv h LEU 95 Ca 0.51 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 58.26 3kcv h LEU 95 Cb 0.93 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 3kcv h LEU 95 CO -0.53 0.80 0.22 0.40 0.09 0.00 0.00 178.44 179.42 3kcv h ILE 96 N 0.71 1.22 0.00 1.22 5.03 -1.05 -0.73 117.51 123.91 3kcv h ILE 96 Ca 0.14 -0.73 -0.01 0.00 -0.12 0.00 0.00 64.86 64.14 3kcv h ILE 96 Cb 0.44 0.52 -0.00 0.00 -3.03 0.00 0.00 36.82 34.75 3kcv h ILE 96 CO 0.02 0.29 -0.04 0.58 -0.68 0.00 0.00 178.15 178.32 3kcv h VAL 97 N 0.89 0.08 0.25 1.67 2.07 -0.95 0.10 116.25 120.35 3kcv h VAL 97 Ca 0.21 -0.93 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 3kcv h VAL 97 Cb 0.21 1.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.85 3kcv h VAL 97 CO -0.01 0.04 -0.12 0.58 0.02 0.00 0.00 177.57 178.08 3kcv h VAL 98 N 0.00 0.81 0.00 2.57 2.07 -1.08 -3.38 116.25 117.25 3kcv h VAL 98 Ca -0.00 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.11 3kcv h VAL 98 Cb 0.86 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.68 3kcv h VAL 98 CO 0.01 0.09 0.00 0.00 0.02 0.00 0.00 177.57 177.68 3kcv n ALA 99 N -2.35 -0.30 0.17 1.67 0.00 -0.31 -1.45 120.51 117.94 3kcv n ALA 99 Ca -0.09 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.20 3kcv n ALA 99 Cb 0.22 0.19 -0.08 0.00 0.00 0.00 0.00 19.45 19.78 3kcv n ALA 99 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3kcv h LYS 100 N 0.00 -0.38 0.00 0.00 1.57 -1.06 0.16 116.57 116.86 3kcv h LYS 100 Ca 0.00 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3kcv h LYS 100 Cb 0.00 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.40 3kcv h LYS 100 CO 0.00 -0.26 0.00 0.00 -0.57 0.00 0.00 179.45 178.62 3kcv n ALA 101 N -2.30 1.39 -1.81 3.86 0.00 -1.26 -4.86 120.51 115.53 3kcv n ALA 101 Ca -0.09 0.13 -0.07 0.00 0.00 0.00 0.00 53.44 53.40 3kcv n ALA 101 Cb 0.19 -1.35 -0.01 0.00 0.00 0.00 0.00 19.45 18.28 3kcv n ALA 101 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3kcv n SER 102 N -2.22 -3.11 0.00 0.00 7.64 0.57 -0.88 113.62 115.63 3kcv n SER 102 Ca 0.01 0.06 0.00 0.00 1.01 0.00 0.00 58.87 59.94 3kcv n SER 102 Cb 0.14 -2.01 0.00 0.00 -1.01 0.00 0.00 64.21 61.33 3kcv n SER 102 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3kcv n GLY 103 N -1.40 0.29 0.36 0.23 0.00 -0.53 -4.74 105.19 99.41 3kcv n GLY 103 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3kcv n GLY 103 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3kcv n ARG 104 N -2.00 0.55 -3.73 1.61 3.00 -0.06 -4.31 116.66 111.72 3kcv n ARG 104 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.85 57.56 3kcv n ARG 104 Cb 0.00 -1.20 -0.13 0.00 0.00 0.00 0.00 32.46 31.13 3kcv n ARG 104 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 3kcv s ILE 105 N -1.27 1.59 0.22 5.15 2.07 -1.26 -5.05 121.20 122.65 3kcv s ILE 105 Ca 0.00 -2.81 -0.30 0.00 -1.41 0.00 0.00 60.65 56.13 3kcv s ILE 105 Cb 0.00 -2.10 -0.15 0.00 0.13 0.00 0.00 42.46 40.33 3kcv s ILE 105 CO 0.00 -0.92 0.95 1.07 -1.91 0.00 0.00 174.94 174.13 3kcv n THR 106 N 3.29 1.57 -0.31 4.00 5.66 -1.26 -4.25 114.28 122.99 3kcv n THR 106 Ca 0.11 -0.39 0.15 0.00 -3.05 0.00 0.00 64.05 60.87 3kcv n THR 106 Cb 0.35 -0.68 0.33 0.00 -1.55 0.00 0.00 70.33 68.78 3kcv n THR 106 CO 0.00 0.00 0.00 -0.50 -3.05 0.00 0.00 175.07 171.52 3kcv h TRP 107 N 2.23 0.60 -0.97 1.09 6.55 -1.97 0.38 115.95 123.87 3kcv h TRP 107 Ca -0.38 0.04 0.04 0.00 0.95 0.00 0.00 58.89 59.54 3kcv h TRP 107 Cb 1.37 -0.12 -0.06 0.00 -0.86 0.00 0.00 29.16 29.49 3kcv h TRP 107 CO 0.49 -0.12 0.63 0.78 -1.05 0.00 0.00 178.44 179.16 3kcv h GLY 108 N 0.33 1.41 2.00 1.49 0.00 -1.99 0.25 103.07 106.56 3kcv h GLY 108 Ca 0.59 -0.48 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 3kcv h GLY 108 CO -0.58 0.41 -0.04 1.46 0.00 0.00 0.00 176.54 177.79 3kcv h GLN 109 N 1.22 0.00 0.00 4.80 4.20 -0.63 -2.16 115.11 122.54 3kcv h GLN 109 Ca 0.39 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.10 3kcv h GLN 109 Cb 0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.79 3kcv h GLN 109 CO -0.12 0.04 -0.01 1.25 -0.67 0.00 0.00 178.83 179.31 3kcv h LEU 110 N 0.00 0.00 0.00 1.46 6.46 0.11 -3.41 115.31 119.92 3kcv h LEU 110 Ca -0.00 -0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 3kcv h LEU 110 Cb 0.62 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.55 3kcv h LEU 110 CO 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 178.44 177.83 3kcv n ALA 111 N -2.05 0.00 0.00 1.25 0.00 0.22 -4.97 120.51 114.96 3kcv n ALA 111 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 3kcv n ALA 111 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 3kcv n ALA 111 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 3kcv n LYS 112 N -0.81 0.00 0.00 0.00 2.85 -0.85 -3.42 118.16 115.93 3kcv n LYS 112 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 3kcv n LYS 112 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 3kcv n LYS 112 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3kcv n ASN 113 N 1.53 0.00 -0.25 -5.58 5.03 -1.26 -3.68 115.26 111.05 3kcv n ASN 113 Ca 0.00 0.00 0.06 0.00 0.87 0.00 0.00 54.58 55.51 3kcv n ASN 113 Cb 0.00 0.00 0.19 0.00 -1.02 0.00 0.00 39.78 38.95 3kcv n ASN 113 CO 0.00 0.00 0.00 -0.50 -1.83 0.00 0.00 177.26 174.93 3kcv h TRP 114 N 0.00 0.33 -0.69 3.10 4.06 -1.96 0.11 115.95 120.91 3kcv h TRP 114 Ca 0.00 0.04 -0.02 0.00 2.06 0.00 0.00 58.89 60.97 3kcv h TRP 114 Cb 0.00 -0.03 -0.03 0.00 -1.00 0.00 0.00 29.16 28.10 3kcv h TRP 114 CO 0.00 -0.07 0.34 1.25 -3.56 0.00 0.00 178.44 176.40 3kcv h LEU 115 N 0.30 0.89 -0.68 -4.49 5.85 -1.92 0.14 115.31 115.40 3kcv h LEU 115 Ca 0.43 -0.12 0.03 0.00 0.84 0.00 0.00 57.88 59.05 3kcv h LEU 115 Cb 0.73 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 3kcv h LEU 115 CO -0.50 0.76 0.43 -1.13 -0.34 0.00 0.00 178.44 177.66 3kcv h ASN 116 N 0.95 0.71 0.52 1.25 -1.24 -1.19 -1.90 115.58 114.68 3kcv h ASN 116 Ca 0.24 -0.00 -0.03 0.00 0.71 0.00 0.00 56.30 57.22 3kcv h ASN 116 Cb 0.10 -0.16 0.01 0.00 0.73 0.00 0.00 38.32 39.00 3kcv h ASN 116 CO -0.03 0.49 -0.25 0.58 -1.29 0.00 0.00 177.43 176.93 3kcv h VAL 117 N 0.84 0.46 -0.57 2.57 2.07 -0.11 -1.44 116.25 120.06 3kcv h VAL 117 Ca 0.27 -0.21 0.12 0.00 0.82 0.00 0.00 66.70 67.70 3kcv h VAL 117 Cb 0.00 0.54 -0.10 0.00 -1.52 0.00 0.00 31.29 30.21 3kcv h VAL 117 CO -0.10 0.03 -0.07 0.22 0.02 0.00 0.00 177.57 177.68 3kcv h TYR 118 N -0.83 -0.16 -0.00 1.57 3.20 -0.67 0.31 116.97 120.38 3kcv h TYR 118 Ca -0.07 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.85 3kcv h TYR 118 Cb 0.59 0.16 -0.00 0.00 1.54 0.00 0.00 36.73 39.02 3kcv h TYR 118 CO -0.01 -0.20 0.00 0.35 -1.64 0.00 0.00 178.16 176.66 3kcv h PHE 119 N 0.06 0.00 -0.70 -3.82 3.57 -1.35 -1.55 116.94 113.15 3kcv h PHE 119 Ca 0.29 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.87 3kcv h PHE 119 Cb 0.45 -0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.12 3kcv h PHE 119 CO -0.40 0.03 0.36 0.78 -2.23 0.00 0.00 178.31 176.85 3kcv h GLY 120 N -0.02 1.04 0.33 2.40 0.00 -0.41 -0.66 103.07 105.76 3kcv h GLY 120 Ca 0.00 -0.24 0.05 0.00 0.00 0.00 0.00 47.33 47.15 3kcv h GLY 120 CO -0.00 0.09 -0.18 3.43 0.00 0.00 0.00 176.54 179.88 3kcv h ASN 121 N 0.63 -0.57 -0.80 0.19 -0.26 -0.02 -1.40 115.58 113.35 3kcv h ASN 121 Ca 0.33 0.11 -0.01 0.00 -0.56 0.00 0.00 56.30 56.18 3kcv h ASN 121 Cb 0.31 0.28 -0.04 0.00 -1.06 0.00 0.00 38.32 37.81 3kcv h ASN 121 CO -0.24 -0.23 0.47 0.25 -1.06 0.00 0.00 177.43 176.63 3kcv h LEU 122 N -0.20 0.96 -0.72 1.61 5.85 -0.31 -0.09 115.31 122.42 3kcv h LEU 122 Ca 0.12 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.77 3kcv h LEU 122 Cb 0.38 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 3kcv h LEU 122 CO -0.30 0.75 0.47 0.58 -0.34 0.00 0.00 178.44 179.60 3kcv h VAL 123 N 1.09 1.18 0.04 1.05 2.07 -0.94 0.77 116.25 121.52 3kcv h VAL 123 Ca 0.28 -0.33 0.01 0.00 0.82 0.00 0.00 66.70 67.49 3kcv h VAL 123 Cb -0.03 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 29.85 3kcv h VAL 123 CO -0.05 0.18 -0.10 1.23 0.02 0.00 0.00 177.57 178.84 3kcv h GLY 124 N 0.96 -0.15 0.03 2.17 0.00 -0.35 -0.41 103.07 105.32 3kcv h GLY 124 Ca 0.26 0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.71 3kcv h GLY 124 CO -0.06 -0.11 -0.08 0.00 0.00 0.00 0.00 176.54 176.29 3kcv h ALA 125 N 0.74 -0.65 -0.95 3.60 0.00 -0.53 -1.88 119.26 119.59 3kcv h ALA 125 Ca 0.02 -0.02 0.17 0.00 0.00 0.00 0.00 54.91 55.09 3kcv h ALA 125 Cb 0.22 0.48 -0.10 0.00 0.00 0.00 0.00 17.79 18.39 3kcv h ALA 125 CO -0.07 -0.67 0.55 -0.07 0.00 0.00 0.00 179.25 178.98 3kcv h LEU 126 N -0.12 0.69 -0.48 0.00 3.38 -0.85 0.25 115.31 118.17 3kcv h LEU 126 Ca -0.00 0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.10 3kcv h LEU 126 Cb 0.12 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 3kcv h LEU 126 CO -0.04 0.26 0.24 -0.07 0.09 0.00 0.00 178.44 178.93 3kcv h LEU 127 N 0.72 0.36 -0.77 1.67 -0.00 -0.92 -1.75 115.31 114.62 3kcv h LEU 127 Ca 0.53 0.02 -0.05 0.00 -0.00 0.00 0.00 57.88 58.39 3kcv h LEU 127 Cb 0.80 -0.04 -0.03 0.00 -0.00 0.00 0.00 40.66 41.38 3kcv h LEU 127 CO -0.38 0.25 0.29 0.15 -0.00 0.00 0.00 178.44 178.76 3kcv h PHE 128 N 0.48 1.18 -0.43 1.13 3.57 0.22 -1.82 116.94 121.29 3kcv h PHE 128 Ca 0.21 -0.10 0.09 0.00 3.53 0.00 0.00 57.97 61.70 3kcv h PHE 128 Cb 0.11 -0.35 -0.09 0.00 2.79 0.00 0.00 35.95 38.41 3kcv h PHE 128 CO -0.10 0.91 -0.18 0.28 -2.23 0.00 0.00 178.31 176.99 3kcv h VAL 129 N 1.12 0.44 -0.12 1.41 2.07 -0.54 -0.08 116.25 120.55 3kcv h VAL 129 Ca 0.25 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.79 3kcv h VAL 129 Cb 0.24 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 3kcv h VAL 129 CO -0.02 0.00 0.01 0.25 0.02 0.00 0.00 177.57 177.83 3kcv h LEU 130 N -0.09 -0.02 -0.58 2.57 5.85 -0.54 0.78 115.31 123.28 3kcv h LEU 130 Ca 0.21 0.02 0.05 0.00 0.84 0.00 0.00 57.88 59.00 3kcv h LEU 130 Cb 0.41 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 3kcv h LEU 130 CO -0.49 0.01 0.31 0.25 -0.34 0.00 0.00 178.44 178.18 3kcv h LEU 131 N 0.06 0.44 -0.89 2.25 5.85 -1.08 0.36 115.31 122.30 3kcv h LEU 131 Ca 0.05 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.74 3kcv h LEU 131 Cb 0.06 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 3kcv h LEU 131 CO -0.08 0.30 0.06 0.24 -0.34 0.00 0.00 178.44 178.61 3kcv h MET 132 N 0.58 0.87 -0.51 1.25 2.86 -0.59 -0.32 114.93 119.07 3kcv h MET 132 Ca 0.26 -0.22 -0.11 0.00 -2.06 0.00 0.00 59.70 57.57 3kcv h MET 132 Cb 0.16 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 3kcv h MET 132 CO -0.17 0.83 -0.12 2.35 1.06 0.00 0.00 176.91 180.86 3kcv h TRP 133 N 0.82 1.08 0.00 -0.22 2.91 -0.13 -2.73 115.95 117.69 3kcv h TRP 133 Ca 0.17 -0.22 -0.07 0.00 1.13 0.00 0.00 58.89 59.89 3kcv h TRP 133 Cb 0.41 -0.27 -0.01 0.00 -0.51 0.00 0.00 29.16 28.78 3kcv h TRP 133 CO 0.02 1.02 -0.35 -0.07 -1.03 0.00 0.00 178.44 178.03 3kcv h LEU 134 N 0.86 0.00 -0.85 0.65 3.38 -0.55 -1.62 115.31 117.18 3kcv h LEU 134 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3kcv h LEU 134 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 3kcv h LEU 134 CO 0.05 0.35 0.00 0.77 0.09 0.00 0.00 178.44 179.70 3kcv h SER 135 N 0.00 0.00 -0.54 -0.43 4.64 -0.77 -3.47 113.55 112.98 3kcv h SER 135 Ca -0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.08 3kcv h SER 135 Cb 0.80 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.79 3kcv h SER 135 CO 0.05 0.00 -0.21 0.61 -0.87 0.00 0.00 176.83 176.40 3kcv n GLY 136 N 0.26 1.20 0.12 -0.77 0.00 -0.61 -4.87 105.19 100.53 3kcv n GLY 136 Ca 0.02 -0.24 0.08 0.00 0.00 0.00 0.00 46.02 45.88 3kcv n GLY 136 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3kcv n GLU 137 N -1.97 0.10 0.33 1.61 4.07 -1.24 -2.37 120.64 121.16 3kcv n GLU 137 Ca -0.11 0.58 0.22 0.00 -0.06 0.00 0.00 57.16 57.79 3kcv n GLU 137 Cb 0.46 -1.88 1.16 0.00 -0.06 0.00 0.00 31.44 31.12 3kcv n GLU 137 CO 0.00 0.00 0.00 0.10 -0.06 0.00 0.00 177.13 177.17 3kcv h TYR 138 N 0.00 0.00 -0.01 4.31 -0.00 -1.89 0.19 116.97 119.56 3kcv h TYR 138 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 3kcv h TYR 138 Cb 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.85 3kcv h TYR 138 CO 0.00 0.00 -0.16 -1.33 -0.00 0.00 0.00 178.16 176.67 3kcv n MET 139 N -3.13 1.07 -1.71 0.10 2.81 -1.00 -1.05 117.12 114.22 3kcv n MET 139 Ca -0.03 -0.60 -0.42 0.00 -1.81 0.00 0.00 57.70 54.84 3kcv n MET 139 Cb 0.11 -1.49 -0.01 0.00 -0.71 0.00 0.00 33.22 31.12 3kcv n MET 139 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 3kcv n THR 140 N -0.44 1.89 -3.47 2.03 -1.04 0.65 -1.75 114.28 112.16 3kcv n THR 140 Ca 0.15 -0.47 -0.21 0.00 -2.04 0.00 0.00 64.05 61.47 3kcv n THR 140 Cb 0.34 -1.63 0.07 0.00 -1.82 0.00 0.00 70.33 67.29 3kcv n THR 140 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3kcv n ALA 141 N 0.53 -1.16 -3.43 2.41 0.00 -1.26 -1.84 120.51 115.75 3kcv n ALA 141 Ca 0.05 0.36 -0.20 0.00 0.00 0.00 0.00 53.44 53.65 3kcv n ALA 141 Cb 0.36 -4.97 0.07 0.00 0.00 0.00 0.00 19.45 14.91 3kcv n ALA 141 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3kcv n ASN 142 N -2.53 -5.43 0.00 0.00 4.05 -0.87 -1.28 115.26 109.20 3kcv n ASN 142 Ca 0.01 -0.47 0.00 0.00 0.45 0.00 0.00 54.58 54.56 3kcv n ASN 142 Cb 0.56 -4.44 0.00 0.00 1.23 0.00 0.00 39.78 37.13 3kcv n ASN 142 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3kcv n GLY 143 N -1.74 1.67 0.25 8.20 0.00 -0.72 -4.27 105.19 108.59 3kcv n GLY 143 Ca -0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 3kcv n GLY 143 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3kcv h GLN 144 N 2.71 0.82 0.52 1.61 1.08 -1.10 0.25 115.11 121.00 3kcv h GLN 144 Ca 0.00 -0.43 -0.02 0.00 -1.45 0.00 0.00 58.65 56.76 3kcv h GLN 144 Cb 0.00 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.43 3kcv h GLN 144 CO 0.00 1.06 -0.43 2.35 -0.95 0.00 0.00 178.83 180.86 3kcv h TRP 145 N 0.67 -1.19 -0.96 2.96 7.01 -1.56 0.91 115.95 123.80 3kcv h TRP 145 Ca 0.06 0.00 0.23 0.00 2.11 0.00 0.00 58.89 61.29 3kcv h TRP 145 Cb 0.95 0.45 -0.07 0.00 -2.10 0.00 0.00 29.16 28.39 3kcv h TRP 145 CO 0.05 -0.60 0.63 0.78 -2.79 0.00 0.00 178.44 176.52 3kcv h GLY 146 N -0.93 0.95 1.49 2.65 0.00 -1.00 -0.70 103.07 105.54 3kcv h GLY 146 Ca -0.07 -0.19 -0.23 0.00 0.00 0.00 0.00 47.33 46.84 3kcv h GLY 146 CO -0.00 -0.05 -0.95 -2.00 0.00 0.00 0.00 176.54 173.54 3kcv h LEU 147 N 0.39 0.59 -0.85 3.11 5.85 -0.65 -1.41 115.31 122.34 3kcv h LEU 147 Ca 0.52 -0.47 0.07 0.00 0.84 0.00 0.00 57.88 58.83 3kcv h LEU 147 Cb 1.33 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 42.11 3kcv h LEU 147 CO -0.21 1.27 0.52 -1.13 -0.34 0.00 0.00 178.44 178.55 3kcv h ASN 148 N 0.26 0.81 0.39 1.25 -1.24 0.67 -0.21 115.58 117.50 3kcv h ASN 148 Ca -0.09 0.02 -0.02 0.00 0.71 0.00 0.00 56.30 56.93 3kcv h ASN 148 Cb 1.59 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 40.50 3kcv h ASN 148 CO 0.17 0.51 -0.19 0.58 -1.29 0.00 0.00 177.43 177.21 3kcv h VAL 149 N 0.94 0.62 -0.56 2.57 2.07 -1.25 -1.02 116.25 119.61 3kcv h VAL 149 Ca 0.37 -0.01 0.09 0.00 0.82 0.00 0.00 66.70 67.98 3kcv h VAL 149 Cb 0.20 0.63 -0.07 0.00 -1.52 0.00 0.00 31.29 30.52 3kcv h VAL 149 CO -0.18 0.00 0.17 -0.07 0.02 0.00 0.00 177.57 177.51 3kcv h LEU 150 N -0.52 0.11 -0.11 2.57 3.38 -0.48 0.68 115.31 120.93 3kcv h LEU 150 Ca -0.05 0.09 -0.24 0.00 0.09 0.00 0.00 57.88 57.76 3kcv h LEU 150 Cb 0.40 0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.26 3kcv h LEU 150 CO 0.09 0.08 -0.91 1.56 0.09 0.00 0.00 178.44 179.35 3kcv h GLN 151 N 0.32 0.69 -0.35 1.13 4.20 -1.06 -0.32 115.11 119.72 3kcv h GLN 151 Ca 0.28 -0.65 -0.02 0.00 0.06 0.00 0.00 58.65 58.32 3kcv h GLN 151 Cb 0.37 0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.30 3kcv h GLN 151 CO -0.32 1.25 0.14 1.15 -0.67 0.00 0.00 178.83 180.38 3kcv h THR 152 N 0.43 1.14 0.23 -0.54 2.02 -0.82 -1.71 112.91 113.67 3kcv h THR 152 Ca -0.09 -0.42 -0.31 0.00 0.77 0.00 0.00 66.41 66.36 3kcv h THR 152 Cb 1.54 0.72 0.03 0.00 -1.74 0.00 0.00 68.15 68.71 3kcv h THR 152 CO 0.18 0.16 -1.38 0.00 0.37 0.00 0.00 175.52 174.85 3kcv h ALA 153 N 1.67 -0.13 -0.23 6.16 0.00 -0.79 -3.30 119.26 122.63 3kcv h ALA 153 Ca 0.12 -0.85 0.02 0.00 0.00 0.00 0.00 54.91 54.20 3kcv h ALA 153 Cb 0.10 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3kcv h ALA 153 CO -0.01 0.65 0.16 0.22 0.00 0.00 0.00 179.25 180.26 3kcv h ASP 154 N 0.04 0.21 -0.03 0.00 3.58 -0.60 -2.66 116.42 116.97 3kcv h ASP 154 Ca -0.24 -0.00 -0.06 0.00 0.42 0.00 0.00 57.03 57.14 3kcv h ASP 154 Cb 2.07 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 43.07 3kcv h ASP 154 CO 0.25 0.15 -0.22 -0.74 -2.88 0.00 0.00 179.24 175.79 3kcv h HIS 155 N 0.25 0.29 -0.48 0.28 2.76 -1.45 -3.23 115.15 113.57 3kcv h HIS 155 Ca 0.09 -0.13 0.14 0.00 -2.20 0.00 0.00 60.37 58.27 3kcv h HIS 155 Cb 0.06 -0.04 -0.02 0.00 1.55 0.00 0.00 27.41 28.96 3kcv h HIS 155 CO -0.00 0.87 0.57 0.87 -1.30 0.00 0.00 177.93 178.94 3kcv h LYS 156 N -0.37 0.00 -0.01 5.26 1.57 -1.55 -0.52 116.57 120.95 3kcv h LYS 156 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3kcv h LYS 156 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.21 3kcv h LYS 156 CO 0.05 0.00 -0.61 1.33 -0.57 0.00 0.00 179.45 179.65 3kcv n VAL 157 N -3.55 0.00 -3.18 0.50 0.24 -1.19 -4.55 118.33 106.60 3kcv n VAL 157 Ca 0.09 -0.12 -0.46 0.00 -2.04 0.00 0.00 64.34 61.81 3kcv n VAL 157 Cb 0.76 0.90 -0.03 0.00 -1.47 0.00 0.00 33.84 34.01 3kcv n VAL 157 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 3kcv s HIS 158 N -2.71 3.45 -0.29 6.34 3.76 -0.20 -4.85 115.29 120.79 3kcv s HIS 158 Ca 0.15 -1.65 -0.15 0.00 -0.15 0.00 0.00 55.06 53.26 3kcv s HIS 158 Cb 0.18 -3.99 0.10 0.00 1.11 0.00 0.00 32.58 29.98 3kcv s HIS 158 CO 0.67 -1.19 0.74 -1.01 -0.85 0.00 0.00 174.74 173.11 3kcv s HIS 159 N 1.31 -1.03 0.84 1.40 4.02 -1.26 -4.98 115.29 115.59 3kcv s HIS 159 Ca 0.21 1.98 -0.11 0.00 1.02 0.00 0.00 55.06 58.15 3kcv s HIS 159 Cb -0.11 0.62 0.10 0.00 -1.02 0.00 0.00 32.58 32.17 3kcv s HIS 159 CO -0.07 -0.51 1.15 0.95 1.02 0.00 0.00 174.74 177.28 3kcv s THR 160 N 1.90 2.34 0.22 1.30 -4.23 -1.26 -4.78 115.64 111.13 3kcv s THR 160 Ca -0.09 0.13 -0.08 0.00 -1.18 0.00 0.00 61.69 60.47 3kcv s THR 160 Cb -0.06 -2.37 0.19 0.00 1.34 0.00 0.00 72.50 71.59 3kcv s THR 160 CO -0.19 -0.13 1.84 0.15 -0.54 0.00 0.00 174.62 175.75 3kcv h PHE 161 N -1.32 1.19 0.00 3.99 3.57 -1.94 -0.52 116.94 121.91 3kcv h PHE 161 Ca -0.44 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.02 3kcv h PHE 161 Cb 1.27 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 39.63 3kcv h PHE 161 CO 0.51 0.83 0.00 -0.89 -2.23 0.00 0.00 178.31 176.53 3kcv n ILE 162 N -4.36 0.00 -0.32 1.41 5.41 -1.26 -1.45 119.36 118.80 3kcv n ILE 162 Ca 0.09 1.34 0.13 0.00 1.00 0.00 0.00 62.75 65.31 3kcv n ILE 162 Cb 0.10 -2.26 0.26 0.00 -0.71 0.00 0.00 39.64 37.04 3kcv n ILE 162 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 3kcv n GLU 163 N -1.64 -0.07 -0.15 0.38 1.02 -1.16 0.15 120.64 119.17 3kcv n GLU 163 Ca 0.00 1.37 -0.09 0.00 -0.02 0.00 0.00 57.16 58.41 3kcv n GLU 163 Cb 0.00 -2.17 -0.00 0.00 -0.02 0.00 0.00 31.44 29.25 3kcv n GLU 163 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3kcv h ALA 164 N 1.82 0.56 0.45 0.62 0.00 -1.07 0.40 119.26 122.03 3kcv h ALA 164 Ca 0.55 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 3kcv h ALA 164 Cb 1.13 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3kcv h ALA 164 CO -0.86 0.21 -0.22 0.28 0.00 0.00 0.00 179.25 178.66 3kcv h VAL 165 N 0.54 0.52 -0.97 0.00 2.07 0.87 -1.22 116.25 118.07 3kcv h VAL 165 Ca 0.14 -0.31 0.14 0.00 0.82 0.00 0.00 66.70 67.49 3kcv h VAL 165 Cb 0.27 0.66 -0.08 0.00 -1.52 0.00 0.00 31.29 30.61 3kcv h VAL 165 CO -0.00 0.05 0.61 0.00 0.02 0.00 0.00 177.57 178.25 3kcv h LEU 167 N 0.86 0.00 -0.24 0.00 3.38 -0.78 -1.15 115.31 117.39 3kcv h LEU 167 Ca 0.50 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 58.26 3kcv h LEU 167 Cb 0.64 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 3kcv h LEU 167 CO -0.27 0.54 -0.89 1.23 0.09 0.00 0.00 178.44 179.15 3kcv h GLY 168 N 2.15 0.42 0.60 0.83 0.00 -0.39 -1.05 103.07 105.64 3kcv h GLY 168 Ca -0.01 -0.71 0.00 0.00 0.00 0.00 0.00 47.33 46.62 3kcv h GLY 168 CO 0.07 0.63 -0.34 -2.22 0.00 0.00 0.00 176.54 174.67 3kcv h ILE 169 N 0.22 0.29 -0.09 2.60 2.04 -0.35 -2.32 117.51 119.90 3kcv h ILE 169 Ca -0.06 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.82 3kcv h ILE 169 Cb 1.51 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.86 3kcv h ILE 169 CO 0.15 0.00 -0.05 -0.07 0.00 0.00 0.00 178.15 178.18 3kcv h LEU 170 N -0.70 -0.16 0.62 1.44 3.38 -1.22 -1.33 115.31 117.35 3kcv h LEU 170 Ca -0.02 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3kcv h LEU 170 Cb 0.64 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 3kcv h LEU 170 CO -0.08 -0.07 -0.44 0.00 0.09 0.00 0.00 178.44 177.94 3kcv h ALA 171 N 1.03 -1.20 0.00 1.53 0.00 -1.20 -2.58 119.26 116.85 3kcv h ALA 171 Ca 0.05 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 3kcv h ALA 171 Cb 0.12 0.60 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 3kcv h ALA 171 CO -0.12 -1.18 -0.09 -0.97 0.00 0.00 0.00 179.25 176.90 3kcv h ASN 172 N -1.02 0.00 -0.71 0.00 -1.24 -1.44 0.18 115.58 111.36 3kcv h ASN 172 Ca -0.08 0.00 0.03 0.00 0.71 0.00 0.00 56.30 56.96 3kcv h ASN 172 Cb 0.84 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 39.84 3kcv h ASN 172 CO 0.04 0.09 0.44 0.25 -1.29 0.00 0.00 177.43 176.96 3kcv h LEU 173 N 0.00 0.71 -0.38 0.34 7.12 -0.94 -1.38 115.31 120.79 3kcv h LEU 173 Ca -0.00 0.00 -0.19 0.00 0.13 0.00 0.00 57.88 57.82 3kcv h LEU 173 Cb 0.23 -0.15 -0.01 0.00 -0.53 0.00 0.00 40.66 40.20 3kcv h LEU 173 CO 0.01 0.49 -0.77 0.24 -0.13 0.00 0.00 178.44 178.29 3kcv h MET 174 N 0.85 0.37 -0.53 1.25 2.86 -0.28 -1.44 114.93 118.00 3kcv h MET 174 Ca 0.29 -0.32 -0.02 0.00 -2.06 0.00 0.00 59.70 57.59 3kcv h MET 174 Cb 0.04 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 3kcv h MET 174 CO -0.12 0.97 0.25 0.28 1.06 0.00 0.00 176.91 179.35 3kcv h VAL 175 N 0.24 1.20 -0.27 -2.22 2.07 -1.16 0.33 116.25 116.44 3kcv h VAL 175 Ca -0.04 -0.58 -0.03 0.00 0.82 0.00 0.00 66.70 66.87 3kcv h VAL 175 Cb 1.35 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 3kcv h VAL 175 CO 0.13 0.23 0.03 0.00 0.02 0.00 0.00 177.57 177.98 3kcv h LEU 177 N 0.25 0.93 0.12 0.00 3.38 -1.15 0.20 115.31 119.05 3kcv h LEU 177 Ca 0.08 -0.15 0.02 0.00 0.09 0.00 0.00 57.88 57.92 3kcv h LEU 177 Cb 0.36 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 3kcv h LEU 177 CO 0.01 0.83 -0.29 0.00 0.09 0.00 0.00 178.44 179.08 3kcv h ALA 178 N 1.14 -0.49 -0.79 1.53 0.00 -0.76 -0.37 119.26 119.52 3kcv h ALA 178 Ca 0.24 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 3kcv h ALA 178 Cb 0.16 0.47 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 3kcv h ALA 178 CO -0.02 -0.83 0.31 0.28 0.00 0.00 0.00 179.25 178.99 3kcv h VAL 179 N -0.50 1.26 0.38 0.00 2.07 -0.91 -0.96 116.25 117.59 3kcv h VAL 179 Ca 0.03 -0.83 -0.02 0.00 0.82 0.00 0.00 66.70 66.70 3kcv h VAL 179 Cb 0.53 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 3kcv h VAL 179 CO -0.17 0.34 -0.22 -0.25 0.02 0.00 0.00 177.57 177.29 3kcv h TRP 180 N 1.16 -0.58 -1.17 1.57 2.91 -0.36 -2.44 115.95 117.04 3kcv h TRP 180 Ca 0.26 -0.01 0.36 0.00 1.13 0.00 0.00 58.89 60.64 3kcv h TRP 180 Cb 0.22 0.20 -0.12 0.00 -0.51 0.00 0.00 29.16 28.95 3kcv h TRP 180 CO 0.02 -0.33 0.73 0.52 -1.03 0.00 0.00 178.44 178.35 3kcv h MET 181 N -0.56 0.22 0.00 2.65 2.86 -0.99 0.15 114.93 119.26 3kcv h MET 181 Ca -0.05 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 3kcv h MET 181 Cb 0.44 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.05 3kcv h MET 181 CO 0.06 0.14 -0.04 1.03 1.06 0.00 0.00 176.91 179.16 3kcv h SER 182 N 0.22 0.00 -0.21 1.22 0.87 -0.68 -2.81 113.55 112.17 3kcv h SER 182 Ca 0.73 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 61.26 3kcv h SER 182 Cb 2.07 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 64.02 3kcv h SER 182 CO -0.42 0.04 -0.01 1.88 -0.53 0.00 0.00 176.83 177.79 3kcv h TYR 183 N 0.00 0.41 0.00 2.24 0.99 -0.51 -3.07 116.97 117.04 3kcv h TYR 183 Ca -0.00 -0.08 0.00 0.00 2.00 0.00 0.00 58.73 60.65 3kcv h TYR 183 Cb 0.14 -0.11 0.00 0.00 1.00 0.00 0.00 36.73 37.77 3kcv h TYR 183 CO 0.00 0.58 0.00 0.43 -0.00 0.00 0.00 178.16 179.17 3kcv n SER 184 N -4.67 0.00 -4.74 3.88 7.64 -1.06 -4.80 113.62 109.88 3kcv n SER 184 Ca -0.04 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.43 3kcv n SER 184 Cb 0.24 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.40 3kcv n SER 184 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3kcv s GLY 185 N -1.65 2.87 0.00 0.23 0.00 -1.16 -5.02 107.32 102.59 3kcv s GLY 185 Ca 0.00 0.83 0.00 0.00 0.00 0.00 0.00 44.72 45.55 3kcv s GLY 185 CO 0.00 1.64 0.00 0.54 0.00 0.00 0.00 173.10 175.28 3kcv n ARG 186 N 2.19 0.00 -1.95 2.90 5.12 -1.26 -4.87 116.66 118.79 3kcv n ARG 186 Ca 0.02 0.10 -0.26 0.00 -1.93 0.00 0.00 57.85 55.78 3kcv n ARG 186 Cb 0.46 -0.45 0.17 0.00 -1.16 0.00 0.00 32.46 31.48 3kcv n ARG 186 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 3kcv n SER 187 N -1.56 0.38 -0.09 0.55 3.41 -1.26 -4.91 113.62 110.14 3kcv n SER 187 Ca 0.00 -1.60 -0.12 0.00 -0.26 0.00 0.00 58.87 56.88 3kcv n SER 187 Cb 0.00 -0.88 -0.05 0.00 -0.26 0.00 0.00 64.21 63.03 3kcv n SER 187 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3kcv h LEU 188 N 0.00 0.59 -0.94 1.04 5.85 -1.99 -2.29 115.31 117.58 3kcv h LEU 188 Ca -0.38 -0.43 0.17 0.00 0.84 0.00 0.00 57.88 58.08 3kcv h LEU 188 Cb 1.13 -0.16 -0.17 0.00 0.37 0.00 0.00 40.66 41.82 3kcv h LEU 188 CO 0.30 0.89 -0.27 0.80 -0.34 0.00 0.00 178.44 179.82 3kcv n MET 189 N -4.42 -0.12 0.01 1.25 1.56 -1.26 -1.37 117.12 112.75 3kcv n MET 189 Ca -0.04 1.45 -0.13 0.00 -0.27 0.00 0.00 57.70 58.72 3kcv n MET 189 Cb 0.38 -2.17 -0.09 0.00 2.15 0.00 0.00 33.22 33.50 3kcv n MET 189 CO 0.00 0.00 0.00 -0.44 -0.73 0.00 0.00 175.97 174.80 3kcv h ASP 190 N 0.00 0.02 -0.53 6.12 5.19 -1.86 -1.82 116.42 123.54 3kcv h ASP 190 Ca 0.41 -0.28 -0.02 0.00 -0.62 0.00 0.00 57.03 56.52 3kcv h ASP 190 Cb 0.65 -0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.12 3kcv h ASP 190 CO -0.95 0.30 0.28 0.11 -3.12 0.00 0.00 179.24 175.85 3kcv h LYS 191 N -0.26 0.79 0.00 3.56 1.57 -0.75 -3.17 116.57 118.31 3kcv h LYS 191 Ca 0.00 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 3kcv h LYS 191 Cb 0.29 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 3kcv h LYS 191 CO 0.00 0.61 -0.40 0.00 -0.57 0.00 0.00 179.45 179.09 3kcv h ALA 192 N 1.51 0.02 -0.97 3.86 0.00 -1.22 -3.41 119.26 119.05 3kcv h ALA 192 Ca 0.20 -0.41 0.06 0.00 0.00 0.00 0.00 54.91 54.76 3kcv h ALA 192 Cb 0.08 0.35 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 3kcv h ALA 192 CO -0.03 0.35 0.63 0.74 0.00 0.00 0.00 179.25 180.94 3kcv h PHE 193 N -1.00 1.16 -0.66 0.00 0.05 -1.43 -2.11 116.94 112.96 3kcv h PHE 193 Ca -0.03 0.03 0.17 0.00 3.82 0.00 0.00 57.97 61.96 3kcv h PHE 193 Cb 0.44 -0.38 -0.03 0.00 2.00 0.00 0.00 35.95 37.98 3kcv h PHE 193 CO -0.11 0.61 0.46 0.97 -0.18 0.00 0.00 178.31 180.07 3kcv h ILE 194 N 1.15 0.72 0.00 -0.55 6.09 -1.76 -0.67 117.51 122.49 3kcv h ILE 194 Ca 0.42 -0.04 -0.01 0.00 -1.37 0.00 0.00 64.86 63.86 3kcv h ILE 194 Cb 0.14 0.58 -0.00 0.00 0.47 0.00 0.00 36.82 38.02 3kcv h ILE 194 CO -0.17 0.02 -0.03 0.24 -3.07 0.00 0.00 178.15 175.15 3kcv h MET 195 N 0.13 0.00 0.24 2.19 2.86 -1.61 -3.37 114.93 115.37 3kcv h MET 195 Ca 0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.96 3kcv h MET 195 Cb 1.08 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.72 3kcv h MET 195 CO -0.04 0.03 -0.26 0.28 1.06 0.00 0.00 176.91 177.98 3kcv h VAL 196 N 0.00 0.45 -0.17 -2.22 2.07 -1.21 -1.79 116.25 113.38 3kcv h VAL 196 Ca -0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 3kcv h VAL 196 Cb 0.73 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 3kcv h VAL 196 CO 0.00 0.00 0.07 -0.07 0.02 0.00 0.00 177.57 177.59 3kcv h LEU 197 N -0.53 0.09 -1.02 2.57 4.07 -1.76 0.81 115.31 119.54 3kcv h LEU 197 Ca -0.00 0.01 -0.07 0.00 0.08 0.00 0.00 57.88 57.90 3kcv h LEU 197 Cb 0.50 -0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.22 3kcv h LEU 197 CO -0.07 0.08 -0.03 -0.65 -1.08 0.00 0.00 178.44 176.69 3kcv h PRO 198 N 0.16 0.66 0.20 1.13 0.11 -1.77 -0.84 132.00 131.66 3kcv h PRO 198 Ca 0.07 -0.17 -0.01 0.00 0.11 0.00 0.00 66.00 66.00 3kcv h PRO 198 Cb 0.03 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.07 3kcv h PRO 198 CO -0.07 0.70 -0.10 0.28 -0.21 0.00 0.00 178.00 178.61 3kcv h VAL 199 N 0.62 0.76 -0.51 3.15 2.07 -1.09 -2.89 116.25 118.36 3kcv h VAL 199 Ca 0.12 -1.01 0.13 0.00 0.82 0.00 0.00 66.70 66.76 3kcv h VAL 199 Cb 0.44 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.43 3kcv h VAL 199 CO 0.02 0.19 0.36 0.00 0.02 0.00 0.00 177.57 178.16 3kcv h ALA 200 N -0.35 2.33 -0.13 1.67 0.00 -0.87 -1.54 119.26 120.37 3kcv h ALA 200 Ca -0.03 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 3kcv h ALA 200 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3kcv h ALA 200 CO 0.05 -0.47 -0.25 1.98 0.00 0.00 0.00 179.25 180.56 3kcv h MET 201 N 0.11 0.40 0.00 0.00 -1.53 -1.13 0.21 114.93 112.99 3kcv h MET 201 Ca 0.24 -0.25 -0.00 0.00 -3.44 0.00 0.00 59.70 56.25 3kcv h MET 201 Cb 0.82 0.03 -0.00 0.00 -0.55 0.00 0.00 31.60 31.90 3kcv h MET 201 CO -0.03 0.85 -0.00 0.27 0.14 0.00 0.00 176.91 178.14 3kcv h PHE 202 N -0.01 0.00 0.19 1.39 -5.15 -1.26 -2.38 116.94 109.72 3kcv h PHE 202 Ca 0.01 0.00 -0.30 0.00 -0.20 0.00 0.00 57.97 57.47 3kcv h PHE 202 Cb 0.84 0.00 0.02 0.00 0.22 0.00 0.00 35.95 37.03 3kcv h PHE 202 CO 0.10 0.00 -1.44 0.28 -2.00 0.00 0.00 178.31 175.26 3kcv h VAL 203 N 0.00 1.17 -0.27 0.88 2.07 -1.14 -0.77 116.25 118.20 3kcv h VAL 203 Ca -0.00 -2.55 -0.13 0.00 0.82 0.00 0.00 66.70 64.84 3kcv h VAL 203 Cb 0.75 2.93 -0.01 0.00 -1.52 0.00 0.00 31.29 33.44 3kcv h VAL 203 CO 0.00 0.79 -0.36 0.00 0.02 0.00 0.00 177.57 178.02 3kcv h ALA 204 N 0.09 0.87 0.00 1.67 0.00 -0.65 -2.97 119.26 118.27 3kcv h ALA 204 Ca -0.27 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.22 3kcv h ALA 204 Cb 1.98 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.65 3kcv h ALA 204 CO 0.18 0.63 0.00 0.77 0.00 0.00 0.00 179.25 180.84 3kcv h SER 205 N 0.50 0.00 -2.66 0.00 0.02 -1.54 -3.45 113.55 106.42 3kcv h SER 205 Ca 0.05 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.88 3kcv h SER 205 Cb 0.86 0.00 0.05 0.00 0.14 0.00 0.00 62.40 63.44 3kcv h SER 205 CO 0.07 0.00 -0.22 0.61 -1.14 0.00 0.00 176.83 176.15 3kcv n GLY 206 N 0.14 0.42 3.82 -3.77 0.00 -1.06 -5.04 105.19 99.71 3kcv n GLY 206 Ca 0.02 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 3kcv n GLY 206 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kcv s PHE 207 N -3.10 3.30 -0.36 1.61 0.08 -0.32 -5.00 117.98 114.19 3kcv s PHE 207 Ca 0.15 1.56 -0.26 0.00 0.12 0.00 0.00 56.93 58.49 3kcv s PHE 207 Cb -0.06 -2.86 0.02 0.00 -0.57 0.00 0.00 43.02 39.54 3kcv s PHE 207 CO 0.23 -0.32 0.96 -1.21 -0.10 0.00 0.00 175.22 174.78 3kcv s GLU 208 N -3.51 3.88 -0.34 0.44 0.41 -0.54 -4.81 118.70 114.24 3kcv s GLU 208 Ca 0.62 0.67 -0.07 0.00 -0.41 0.00 0.00 54.97 55.78 3kcv s GLU 208 Cb -0.10 -3.79 0.03 0.00 -1.78 0.00 0.00 34.13 28.49 3kcv s GLU 208 CO 0.21 -0.95 0.12 -1.58 -0.49 0.00 0.00 175.26 172.57 3kcv s HIS 209 N 3.54 3.24 0.47 1.61 2.46 -1.26 -3.59 115.29 121.75 3kcv s HIS 209 Ca 0.40 -1.26 0.24 0.00 0.47 0.00 0.00 55.06 54.91 3kcv s HIS 209 Cb -0.12 -2.31 1.27 0.00 -0.13 0.00 0.00 32.58 31.29 3kcv s HIS 209 CO 0.18 -0.69 1.87 0.66 -2.47 0.00 0.00 174.74 174.29 3kcv h SER 210 N 8.27 0.22 -0.01 9.88 4.64 -1.94 0.68 113.55 135.28 3kcv h SER 210 Ca -0.25 0.03 -0.23 0.00 -0.47 0.00 0.00 61.79 60.87 3kcv h SER 210 Cb 1.09 -0.01 0.02 0.00 -0.31 0.00 0.00 62.40 63.19 3kcv h SER 210 CO 0.62 0.08 -0.87 0.40 -0.87 0.00 0.00 176.83 176.18 3kcv h ILE 211 N 0.22 1.33 -0.83 0.95 1.08 -1.97 -2.02 117.51 116.27 3kcv h ILE 211 Ca 0.46 -2.16 0.00 0.00 -0.39 0.00 0.00 64.86 62.77 3kcv h ILE 211 Cb 1.43 2.42 -0.04 0.00 -3.07 0.00 0.00 36.82 37.56 3kcv h ILE 211 CO -0.11 0.66 0.52 0.00 -0.69 0.00 0.00 178.15 178.53 3kcv h ALA 212 N 0.39 1.05 -0.60 1.87 0.00 -1.26 -2.18 119.26 118.52 3kcv h ALA 212 Ca -0.11 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 3kcv h ALA 212 Cb 1.54 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 3kcv h ALA 212 CO 0.17 0.49 0.25 -0.91 0.00 0.00 0.00 179.25 179.25 3kcv h ASN 213 N 1.13 0.79 0.00 0.00 4.21 -1.24 -1.82 115.58 118.65 3kcv h ASN 213 Ca 0.30 -0.10 0.00 0.00 1.21 0.00 0.00 56.30 57.71 3kcv h ASN 213 Cb -0.09 -0.20 0.00 0.00 -1.12 0.00 0.00 38.32 36.91 3kcv h ASN 213 CO -0.06 0.71 0.15 0.24 -1.29 0.00 0.00 177.43 177.17 3kcv h MET 214 N 0.86 0.00 0.00 0.81 2.86 -0.69 -1.72 114.93 117.05 3kcv h MET 214 Ca 0.21 0.00 -0.37 0.00 -2.06 0.00 0.00 59.70 57.48 3kcv h MET 214 Cb 0.15 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.76 3kcv h MET 214 CO -0.02 0.00 -2.20 0.34 1.06 0.00 0.00 176.91 176.09 3kcv n PHE 215 N -2.48 0.00 0.15 -0.22 7.35 -1.01 -4.48 117.46 116.76 3kcv n PHE 215 Ca -0.02 0.00 -0.14 0.00 -0.76 0.00 0.00 57.45 56.54 3kcv n PHE 215 Cb 0.19 -0.84 -0.07 0.00 0.35 0.00 0.00 39.48 39.11 3kcv n PHE 215 CO 0.00 0.00 0.00 1.98 -0.76 0.00 0.00 176.76 177.98 3kcv h MET 216 N -0.90 -0.35 0.59 -4.13 4.05 -0.93 -0.45 114.93 112.82 3kcv h MET 216 Ca -0.55 0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 58.86 3kcv h MET 216 Cb 1.47 0.08 0.01 0.00 -0.80 0.00 0.00 31.60 32.35 3kcv h MET 216 CO -0.33 -0.23 -0.28 0.82 0.23 0.00 0.00 176.91 177.11 3kcv h ILE 217 N -0.36 0.40 -0.80 1.77 2.04 -1.59 -1.43 117.51 117.53 3kcv h ILE 217 Ca -0.01 -0.11 0.18 0.00 1.00 0.00 0.00 64.86 65.92 3kcv h ILE 217 Cb 0.31 0.44 -0.11 0.00 -0.74 0.00 0.00 36.82 36.72 3kcv h ILE 217 CO 0.00 0.02 0.28 -0.65 0.00 0.00 0.00 178.15 177.80 3kcv h PRO 218 N -0.86 0.34 -0.94 2.37 0.11 -1.72 0.10 132.00 131.40 3kcv h PRO 218 Ca -0.08 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 66.03 3kcv h PRO 218 Cb 0.63 -0.08 -0.05 0.00 0.11 0.00 0.00 31.00 31.62 3kcv h PRO 218 CO 0.13 0.22 0.62 1.98 -0.21 0.00 0.00 178.00 180.75 3kcv h MET 219 N 0.35 1.20 -0.46 1.05 4.05 -0.86 -0.70 114.93 119.56 3kcv h MET 219 Ca 0.47 -0.07 -0.05 0.00 -0.28 0.00 0.00 59.70 59.77 3kcv h MET 219 Cb 0.82 -0.27 -0.02 0.00 -0.80 0.00 0.00 31.60 31.33 3kcv h MET 219 CO -0.50 0.79 0.10 0.78 0.23 0.00 0.00 176.91 178.31 3kcv h GLY 220 N 1.24 0.80 0.67 1.39 0.00 0.25 -2.11 103.07 105.30 3kcv h GLY 220 Ca 0.36 -0.51 0.05 0.00 0.00 0.00 0.00 47.33 47.23 3kcv h GLY 220 CO -0.09 0.47 0.26 -2.22 0.00 0.00 0.00 176.54 174.96 3kcv h ILE 221 N 0.61 0.93 0.15 2.60 2.04 -0.59 -0.16 117.51 123.09 3kcv h ILE 221 Ca 0.14 -0.17 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 3kcv h ILE 221 Cb 0.34 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 3kcv h ILE 221 CO 0.00 0.09 -0.11 0.58 0.00 0.00 0.00 178.15 178.71 3kcv h VAL 222 N 0.49 0.75 -0.57 1.67 2.07 -0.85 0.77 116.25 120.58 3kcv h VAL 222 Ca 0.24 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.75 3kcv h VAL 222 Cb 0.17 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 3kcv h VAL 222 CO -0.18 0.00 0.30 0.40 0.02 0.00 0.00 177.57 178.10 3kcv h ILE 223 N -0.27 1.20 -0.69 4.57 2.04 -1.31 -0.05 117.51 123.00 3kcv h ILE 223 Ca -0.01 -0.52 0.06 0.00 1.00 0.00 0.00 64.86 65.39 3kcv h ILE 223 Cb 0.24 0.50 -0.05 0.00 -0.74 0.00 0.00 36.82 36.77 3kcv h ILE 223 CO -0.01 0.22 0.39 -0.09 0.00 0.00 0.00 178.15 178.66 3kcv h ARG 224 N 0.77 0.71 0.00 2.37 2.43 -0.72 0.28 114.38 120.22 3kcv h ARG 224 Ca 0.20 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 3kcv h ARG 224 Cb 0.08 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 3kcv h ARG 224 CO -0.03 0.47 -0.50 -0.25 -1.51 0.00 0.00 179.97 178.15 3kcv n ASP 225 N -4.76 0.53 0.00 -3.80 9.92 0.24 -4.35 116.55 114.33 3kcv n ASP 225 Ca 0.09 -0.04 0.00 0.00 -0.53 0.00 0.00 54.79 54.31 3kcv n ASP 225 Cb 0.16 0.14 0.00 0.00 -0.64 0.00 0.00 41.12 40.79 3kcv n ASP 225 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 3kcv n PHE 226 N -1.73 0.00 -1.84 1.24 3.72 -0.08 -5.07 117.46 113.70 3kcv n PHE 226 Ca 0.05 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.07 3kcv n PHE 226 Cb 0.37 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.95 3kcv n PHE 226 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3kcv s ALA 227 N -0.35 2.82 0.71 4.37 0.00 0.08 -4.95 121.76 124.43 3kcv s ALA 227 Ca 0.00 1.28 -0.14 0.00 0.00 0.00 0.00 51.96 53.10 3kcv s ALA 227 Cb 0.00 -3.54 0.03 0.00 0.00 0.00 0.00 23.12 19.60 3kcv s ALA 227 CO 0.00 -1.30 1.14 -1.54 0.00 0.00 0.00 175.76 174.06 3kcv s SER 228 N -1.03 4.60 0.53 0.00 1.04 -1.26 -4.87 113.70 112.72 3kcv s SER 228 Ca 0.71 2.10 0.30 0.00 0.48 0.00 0.00 55.95 59.55 3kcv s SER 228 Cb -0.39 -2.56 1.49 0.00 0.10 0.00 0.00 66.02 64.67 3kcv s SER 228 CO 0.46 -1.97 2.07 -0.65 0.98 0.00 0.00 173.24 174.12 3kcv h PRO 229 N -0.33 0.00 -0.54 4.02 0.11 -1.99 -1.33 132.00 131.94 3kcv h PRO 229 Ca -0.46 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.71 3kcv h PRO 229 Cb 1.26 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.32 3kcv h PRO 229 CO 0.51 0.10 0.24 0.93 -0.21 0.00 0.00 178.00 179.58 3kcv h GLU 230 N 0.00 0.45 -0.06 1.05 3.07 -1.99 -1.03 114.58 116.07 3kcv h GLU 230 Ca -0.00 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 58.83 3kcv h GLU 230 Cb 0.37 -0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 28.18 3kcv h GLU 230 CO 0.01 0.30 0.02 0.35 -1.40 0.00 0.00 179.01 178.29 3kcv h PHE 231 N 0.46 0.10 -0.46 4.33 3.57 -1.63 0.20 116.94 123.52 3kcv h PHE 231 Ca 0.25 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.77 3kcv h PHE 231 Cb 0.22 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.90 3kcv h PHE 231 CO -0.13 0.29 0.26 -1.49 -2.23 0.00 0.00 178.31 175.02 3kcv h TRP 232 N -0.12 0.48 0.50 0.41 -0.00 -1.07 -1.04 115.95 115.12 3kcv h TRP 232 Ca 0.02 0.02 -0.02 0.00 -0.00 0.00 0.00 58.89 58.90 3kcv h TRP 232 Cb 0.24 -0.15 0.00 0.00 -0.00 0.00 0.00 29.16 29.26 3kcv h TRP 232 CO 0.01 0.27 -0.24 1.15 -0.00 0.00 0.00 178.44 179.62 3kcv h THR 233 N 0.52 0.50 -0.43 1.49 2.02 -1.21 -1.09 112.91 114.70 3kcv h THR 233 Ca 0.19 -0.11 0.09 0.00 0.77 0.00 0.00 66.41 67.35 3kcv h THR 233 Cb 0.04 0.55 -0.09 0.00 -1.74 0.00 0.00 68.15 66.90 3kcv h THR 233 CO -0.10 0.02 -0.26 0.00 0.37 0.00 0.00 175.52 175.55 3kcv h ALA 234 N -0.27 -0.01 0.00 6.16 0.00 -0.43 0.23 119.26 124.93 3kcv h ALA 234 Ca -0.07 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3kcv h ALA 234 Cb 0.55 0.60 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3kcv h ALA 234 CO 0.11 -0.63 0.00 -0.39 0.00 0.00 0.00 179.25 178.34 3kcv h VAL 235 N -0.18 0.00 -4.16 0.00 -1.51 -1.26 -3.48 116.25 105.65 3kcv h VAL 235 Ca 0.20 -0.54 0.00 0.00 -1.23 0.00 0.00 66.70 65.13 3kcv h VAL 235 Cb 0.50 1.48 0.00 0.00 -2.13 0.00 0.00 31.29 31.14 3kcv h VAL 235 CO -0.53 0.00 -0.11 0.61 -1.23 0.00 0.00 177.57 176.30 3kcv n GLY 236 N 0.90 -0.88 1.88 5.19 0.00 0.07 -5.06 105.19 107.29 3kcv n GLY 236 Ca 0.04 0.34 -0.00 0.00 0.00 0.00 0.00 46.02 46.40 3kcv n GLY 236 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3kcv n SER 237 N -0.93 -0.72 -3.45 1.61 2.88 -0.52 -5.04 113.62 107.45 3kcv n SER 237 Ca 0.03 -1.30 -0.12 0.00 -1.33 0.00 0.00 58.87 56.15 3kcv n SER 237 Cb 0.38 1.15 -0.03 0.00 -0.75 0.00 0.00 64.21 64.96 3kcv n SER 237 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3kcv s ALA 238 N -1.49 -1.54 0.48 -1.46 0.00 -1.26 -4.50 121.76 111.98 3kcv s ALA 238 Ca 0.13 0.51 0.28 0.00 0.00 0.00 0.00 51.96 52.87 3kcv s ALA 238 Cb -0.01 0.78 1.34 0.00 0.00 0.00 0.00 23.12 25.23 3kcv s ALA 238 CO 0.01 -0.72 1.81 -1.35 0.00 0.00 0.00 175.76 175.52 3kcv h PRO 239 N 2.15 0.17 0.00 0.00 0.11 -1.96 0.15 132.00 132.60 3kcv h PRO 239 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3kcv h PRO 239 Cb 1.29 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3kcv h PRO 239 CO 0.39 0.11 0.00 0.39 -0.21 0.00 0.00 178.00 178.68 3kcv n GLU 240 N -4.39 0.10 0.08 1.05 4.71 -1.26 -1.16 120.64 119.77 3kcv n GLU 240 Ca 0.23 0.30 0.11 0.00 -0.01 0.00 0.00 57.16 57.80 3kcv n GLU 240 Cb 1.01 -1.68 0.45 0.00 -1.01 0.00 0.00 31.44 30.22 3kcv n GLU 240 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3kcv n ASN 241 N -1.86 0.46 -2.44 1.62 3.02 0.04 -3.56 115.26 112.54 3kcv n ASN 241 Ca 0.03 0.58 -0.13 0.00 -0.03 0.00 0.00 54.58 55.04 3kcv n ASN 241 Cb 0.23 -0.69 0.03 0.00 -0.61 0.00 0.00 39.78 38.74 3kcv n ASN 241 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3kcv n PHE 242 N -1.98 2.04 0.31 3.10 3.72 -0.31 -4.88 117.46 119.48 3kcv n PHE 242 Ca 0.04 -2.25 0.20 0.00 -0.05 0.00 0.00 57.45 55.39 3kcv n PHE 242 Cb 0.28 -0.28 1.04 0.00 -0.94 0.00 0.00 39.48 39.58 3kcv n PHE 242 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3kcv h SER 243 N 2.43 0.00 1.71 4.37 4.64 -1.60 -2.20 113.55 122.89 3kcv h SER 243 Ca 0.12 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.38 3kcv h SER 243 Cb 1.38 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.46 3kcv h SER 243 CO 0.49 0.00 -0.27 0.45 -0.87 0.00 0.00 176.83 176.64 3kcv h HIS 244 N 0.00 0.00 -0.58 4.77 3.86 -1.90 -3.43 115.15 117.87 3kcv h HIS 244 Ca 0.01 0.00 -0.35 0.00 -1.16 0.00 0.00 60.37 58.87 3kcv h HIS 244 Cb 0.24 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.66 3kcv h HIS 244 CO 0.00 0.27 1.06 -0.51 0.86 0.00 0.00 177.93 179.60 3kcv s LEU 245 N -6.35 3.14 0.01 2.43 1.43 -0.83 -4.72 118.68 113.79 3kcv s LEU 245 Ca 0.05 -1.43 -0.05 0.00 -1.03 0.00 0.00 54.13 51.67 3kcv s LEU 245 Cb 0.06 -2.58 -0.00 0.00 0.03 0.00 0.00 46.19 43.70 3kcv s LEU 245 CO 0.71 -2.82 0.10 0.42 0.23 0.00 0.00 176.35 174.98 3kcv s THR 246 N 10.17 0.09 0.31 5.49 -4.23 -1.26 -4.65 115.64 121.56 3kcv s THR 246 Ca 0.67 -0.74 0.07 0.00 -1.18 0.00 0.00 61.69 60.52 3kcv s THR 246 Cb -0.02 -0.39 0.31 0.00 1.34 0.00 0.00 72.50 73.74 3kcv s THR 246 CO 0.08 -0.40 1.67 0.58 -0.54 0.00 0.00 174.62 176.00 3kcv h VAL 247 N 4.37 0.35 -0.33 2.29 2.07 -1.98 -0.70 116.25 122.32 3kcv h VAL 247 Ca -0.31 -0.11 -0.08 0.00 0.82 0.00 0.00 66.70 67.03 3kcv h VAL 247 Cb 1.20 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 3kcv h VAL 247 CO 0.41 0.06 -0.09 -0.03 0.02 0.00 0.00 177.57 177.93 3kcv h MET 248 N 0.31 0.64 -0.58 1.57 1.85 -1.97 -1.34 114.93 115.41 3kcv h MET 248 Ca 0.62 -0.25 -0.01 0.00 -0.61 0.00 0.00 59.70 59.46 3kcv h MET 248 Cb 1.31 -0.03 -0.03 0.00 0.43 0.00 0.00 31.60 33.28 3kcv h MET 248 CO -0.60 0.82 0.34 -0.91 -0.40 0.00 0.00 176.91 176.16 3kcv h ASN 249 N 0.42 0.70 0.03 1.39 4.21 -1.47 -0.85 115.58 120.01 3kcv h ASN 249 Ca 0.08 -0.07 0.03 0.00 1.21 0.00 0.00 56.30 57.55 3kcv h ASN 249 Cb 0.60 -0.18 -0.04 0.00 -1.12 0.00 0.00 38.32 37.58 3kcv h ASN 249 CO 0.04 0.57 -0.22 0.15 -1.29 0.00 0.00 177.43 176.68 3kcv h PHE 250 N 0.78 -0.57 0.06 1.19 3.57 -1.04 0.16 116.94 121.10 3kcv h PHE 250 Ca 0.21 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.72 3kcv h PHE 250 Cb -0.00 0.25 -0.00 0.00 2.79 0.00 0.00 35.95 38.99 3kcv h PHE 250 CO -0.02 -0.31 -0.05 0.82 -2.23 0.00 0.00 178.31 176.53 3kcv h ILE 251 N -0.36 0.90 0.10 1.41 1.08 -1.08 0.43 117.51 119.98 3kcv h ILE 251 Ca 0.05 0.00 -0.31 0.00 -0.39 0.00 0.00 64.86 64.21 3kcv h ILE 251 Cb 0.42 0.90 -0.02 0.00 -3.07 0.00 0.00 36.82 35.05 3kcv h ILE 251 CO -0.18 0.00 -1.63 0.71 -0.69 0.00 0.00 178.15 176.36 3kcv h THR 252 N -0.11 1.02 -0.01 -0.27 1.35 -1.02 -1.02 112.91 112.85 3kcv h THR 252 Ca -0.00 -2.71 0.00 0.00 -0.55 0.00 0.00 66.41 63.14 3kcv h THR 252 Cb 0.10 2.66 0.00 0.00 -1.73 0.00 0.00 68.15 69.18 3kcv h THR 252 CO -0.00 0.78 -0.45 0.47 -0.25 0.00 0.00 175.52 176.07 3kcv n ASP 253 N -3.38 1.18 0.00 5.36 10.43 0.55 -4.54 116.55 126.15 3kcv n ASP 253 Ca -0.19 -0.95 0.00 0.00 2.57 0.00 0.00 54.79 56.23 3kcv n ASP 253 Cb 1.04 0.35 0.00 0.00 1.84 0.00 0.00 41.12 44.35 3kcv n ASP 253 CO 0.00 0.00 0.00 -3.20 -1.07 0.00 0.00 177.20 172.93 3kcv n ASN 254 N -0.74 0.00 -0.14 -2.24 2.85 -0.90 -4.59 115.26 109.50 3kcv n ASN 254 Ca 0.09 0.00 -0.04 0.00 -0.11 0.00 0.00 54.58 54.52 3kcv n ASN 254 Cb 0.37 0.00 0.05 0.00 1.24 0.00 0.00 39.78 41.44 3kcv n ASN 254 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 3kcv h LEU 255 N 0.00 0.10 0.46 1.20 5.85 -0.87 0.13 115.31 122.18 3kcv h LEU 255 Ca 0.00 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 3kcv h LEU 255 Cb 0.00 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.10 3kcv h LEU 255 CO 0.00 0.09 -0.22 0.40 -0.34 0.00 0.00 178.44 178.37 3kcv h ILE 256 N 0.29 0.53 -0.34 4.05 2.04 -1.43 -0.37 117.51 122.27 3kcv h ILE 256 Ca 0.22 -0.22 -0.10 0.00 1.00 0.00 0.00 64.86 65.76 3kcv h ILE 256 Cb 0.25 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 3kcv h ILE 256 CO -0.25 0.04 -0.20 -0.65 0.00 0.00 0.00 178.15 177.09 3kcv h PRO 257 N -0.75 0.64 -0.04 2.37 0.11 -1.76 -1.84 132.00 130.74 3kcv h PRO 257 Ca -0.06 -0.24 -0.26 0.00 0.11 0.00 0.00 66.00 65.55 3kcv h PRO 257 Cb 0.54 -0.04 0.02 0.00 0.11 0.00 0.00 31.00 31.62 3kcv h PRO 257 CO 0.10 0.80 -0.98 0.28 -0.21 0.00 0.00 178.00 177.99 3kcv h VAL 258 N 0.57 1.28 -0.53 3.15 2.07 -0.76 -1.01 116.25 121.02 3kcv h VAL 258 Ca 0.09 -2.18 -0.03 0.00 0.82 0.00 0.00 66.70 65.40 3kcv h VAL 258 Cb 0.66 2.28 -0.02 0.00 -1.52 0.00 0.00 31.29 32.69 3kcv h VAL 258 CO 0.05 0.68 0.22 0.74 0.02 0.00 0.00 177.57 179.28 3kcv h THR 259 N 0.43 1.21 -0.68 2.57 2.02 -1.06 0.14 112.91 117.54 3kcv h THR 259 Ca -0.11 -0.65 -0.04 0.00 0.77 0.00 0.00 66.41 66.38 3kcv h THR 259 Cb 1.63 0.66 -0.03 0.00 -1.74 0.00 0.00 68.15 68.66 3kcv h THR 259 CO 0.19 0.25 0.27 0.40 0.37 0.00 0.00 175.52 177.00 3kcv h ILE 260 N 0.71 1.24 -0.52 3.11 2.04 -1.24 -1.05 117.51 121.80 3kcv h ILE 260 Ca 0.18 -0.77 -0.03 0.00 1.00 0.00 0.00 64.86 65.23 3kcv h ILE 260 Cb 0.18 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 3kcv h ILE 260 CO -0.02 0.31 0.20 1.23 0.00 0.00 0.00 178.15 179.87 3kcv h GLY 261 N 0.97 0.84 0.38 5.37 0.00 -0.94 -0.81 103.07 108.89 3kcv h GLY 261 Ca 0.23 -0.47 0.06 0.00 0.00 0.00 0.00 47.33 47.15 3kcv h GLY 261 CO -0.02 0.44 -0.06 3.43 0.00 0.00 0.00 176.54 180.34 3kcv h ASN 262 N 0.70 -0.25 -0.10 0.19 -0.26 -0.11 0.84 115.58 116.59 3kcv h ASN 262 Ca 0.17 0.09 -0.00 0.00 -0.56 0.00 0.00 56.30 56.00 3kcv h ASN 262 Cb 0.21 0.18 -0.00 0.00 -1.06 0.00 0.00 38.32 37.65 3kcv h ASN 262 CO -0.01 -0.08 0.04 0.40 -1.06 0.00 0.00 177.43 176.72 3kcv h ILE 263 N 0.03 1.12 -0.96 2.81 2.04 -1.01 -1.68 117.51 119.86 3kcv h ILE 263 Ca 0.16 -0.37 0.11 0.00 1.00 0.00 0.00 64.86 65.76 3kcv h ILE 263 Cb 0.24 1.19 -0.07 0.00 -0.74 0.00 0.00 36.82 37.43 3kcv h ILE 263 CO -0.32 0.11 0.61 0.40 0.00 0.00 0.00 178.15 178.96 3kcv h ILE 264 N 0.02 0.95 0.00 -0.67 2.04 -0.92 0.13 117.51 119.06 3kcv h ILE 264 Ca 0.03 -0.33 -0.06 0.00 1.00 0.00 0.00 64.86 65.50 3kcv h ILE 264 Cb 0.14 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.11 3kcv h ILE 264 CO -0.00 0.18 -0.30 1.23 0.00 0.00 0.00 178.15 179.25 3kcv h GLY 265 N 0.96 0.00 0.90 5.37 0.00 -0.16 -0.14 103.07 110.01 3kcv h GLY 265 Ca 0.46 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.47 3kcv h GLY 265 CO -0.22 0.00 -1.51 -1.33 0.00 0.00 0.00 176.54 173.48 3kcv h GLY 266 N 1.55 0.45 0.12 4.60 0.00 -1.06 -3.28 103.07 105.45 3kcv h GLY 266 Ca -0.00 -1.16 0.17 0.00 0.00 0.00 0.00 47.33 46.34 3kcv h GLY 266 CO 0.04 1.01 0.48 -1.33 0.00 0.00 0.00 176.54 176.74 3kcv h GLY 267 N 0.29 1.53 1.35 4.60 0.00 -0.28 0.17 103.07 110.73 3kcv h GLY 267 Ca -0.29 -0.27 -0.16 0.00 0.00 0.00 0.00 47.33 46.61 3kcv h GLY 267 CO 0.18 -0.09 -0.51 1.41 0.00 0.00 0.00 176.54 177.53 3kcv h LEU 268 N 0.62 0.76 -0.72 3.11 3.38 -1.18 0.76 115.31 122.04 3kcv h LEU 268 Ca 0.52 -0.39 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 3kcv h LEU 268 Cb 0.80 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 3kcv h LEU 268 CO -0.40 1.13 0.30 -0.07 0.09 0.00 0.00 178.44 179.49 3kcv h LEU 269 N 0.54 0.98 -0.23 1.67 3.38 -1.28 -1.29 115.31 119.08 3kcv h LEU 269 Ca 0.02 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 3kcv h LEU 269 Cb 1.07 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 3kcv h LEU 269 CO 0.10 0.88 0.02 0.58 0.09 0.00 0.00 178.44 180.12 3kcv h VAL 270 N 1.03 1.24 -0.92 1.22 2.07 -0.77 0.23 116.25 120.34 3kcv h VAL 270 Ca 0.24 -0.81 0.10 0.00 0.82 0.00 0.00 66.70 67.04 3kcv h VAL 270 Cb 0.19 1.33 -0.08 0.00 -1.52 0.00 0.00 31.29 31.21 3kcv h VAL 270 CO -0.02 0.26 0.56 1.23 0.02 0.00 0.00 177.57 179.62 3kcv h GLY 271 N 0.18 1.46 0.87 2.17 0.00 -0.71 0.74 103.07 107.79 3kcv h GLY 271 Ca 0.07 -0.39 -0.11 0.00 0.00 0.00 0.00 47.33 46.90 3kcv h GLY 271 CO 0.01 0.18 -0.32 -2.00 0.00 0.00 0.00 176.54 174.41 3kcv h LEU 272 N 0.94 0.61 -0.23 3.11 5.85 -1.10 -2.43 115.31 122.05 3kcv h LEU 272 Ca 0.44 -0.53 0.06 0.00 0.84 0.00 0.00 57.88 58.69 3kcv h LEU 272 Cb 0.37 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 41.15 3kcv h LEU 272 CO -0.24 1.02 -0.28 0.74 -0.34 0.00 0.00 178.44 179.34 3kcv h THR 273 N 0.21 0.33 0.28 1.05 2.02 0.13 -1.57 112.91 115.36 3kcv h THR 273 Ca 0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.20 3kcv h THR 273 Cb 0.91 0.33 -0.03 0.00 -1.74 0.00 0.00 68.15 67.61 3kcv h THR 273 CO 0.07 0.00 -0.41 0.22 0.37 0.00 0.00 175.52 175.77 3kcv h TYR 274 N -0.30 -1.15 -0.01 3.16 3.20 -0.88 -0.85 116.97 120.15 3kcv h TYR 274 Ca 0.13 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.02 3kcv h TYR 274 Cb 0.50 0.47 -0.00 0.00 1.54 0.00 0.00 36.73 39.24 3kcv h TYR 274 CO -0.42 -0.55 0.01 -1.49 -1.64 0.00 0.00 178.16 174.07 3kcv h TRP 275 N -0.76 0.01 0.01 -3.82 -0.00 -1.37 -0.59 115.95 109.43 3kcv h TRP 275 Ca -0.01 -0.00 0.02 0.00 -0.00 0.00 0.00 58.89 58.90 3kcv h TRP 275 Cb 0.72 -0.00 -0.03 0.00 -0.00 0.00 0.00 29.16 29.85 3kcv h TRP 275 CO -0.29 0.10 -0.13 0.28 -0.00 0.00 0.00 178.44 178.40 3kcv h VAL 276 N -0.07 0.68 -0.01 1.49 2.07 -1.23 0.36 116.25 119.53 3kcv h VAL 276 Ca 0.00 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.35 3kcv h VAL 276 Cb 0.09 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 3kcv h VAL 276 CO -0.00 0.00 -0.77 0.40 0.02 0.00 0.00 177.57 177.22 3kcv h ILE 277 N -0.23 1.50 -0.18 4.57 2.04 -1.20 -3.33 117.51 120.68 3kcv h ILE 277 Ca 0.04 -2.48 -0.17 0.00 1.00 0.00 0.00 64.86 63.25 3kcv h ILE 277 Cb 0.28 2.35 0.01 0.00 -0.74 0.00 0.00 36.82 38.71 3kcv h ILE 277 CO -0.12 0.72 -0.57 0.22 0.00 0.00 0.00 178.15 178.40 3kcv h TYR 278 N 0.07 0.92 -0.03 1.37 3.20 -0.93 -3.25 116.97 118.32 3kcv h TYR 278 Ca -0.02 -0.37 0.01 0.00 3.14 0.00 0.00 58.73 61.49 3kcv h TYR 278 Cb 1.35 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 39.46 3kcv h TYR 278 CO 0.01 1.17 0.05 -0.07 -1.64 0.00 0.00 178.16 177.68 3kcv h LEU 279 N 0.40 0.00 0.00 2.82 3.38 -1.03 -3.51 115.31 117.38 3kcv h LEU 279 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3kcv h LEU 279 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 3kcv h LEU 279 CO 0.12 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.19