#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kcv s HIS 30 N 0.00 2.00 0.37 2.13 5.04 -1.26 -4.87 115.29 118.70 3kcv s HIS 30 Ca 0.00 0.38 0.09 0.00 -1.54 0.00 0.00 55.06 53.98 3kcv s HIS 30 Cb 0.00 -3.94 0.83 0.00 0.04 0.00 0.00 32.58 29.50 3kcv s HIS 30 CO 0.00 -3.43 1.92 -1.35 -2.34 0.00 0.00 174.74 169.54 3kcv h PRO 31 N 10.37 0.65 -0.21 2.88 0.11 -2.04 -1.01 132.00 142.75 3kcv h PRO 31 Ca -0.37 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.68 3kcv h PRO 31 Cb 1.17 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 3kcv h PRO 31 CO 0.98 0.43 0.03 1.25 -0.21 0.00 0.00 178.00 180.47 3kcv h LEU 32 N 0.67 0.34 -0.09 2.35 5.85 -1.99 -0.96 115.31 121.48 3kcv h LEU 32 Ca 0.37 -0.27 0.03 0.00 0.84 0.00 0.00 57.88 58.85 3kcv h LEU 32 Cb 0.52 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.42 3kcv h LEU 32 CO -0.14 0.53 -0.12 0.50 -0.34 0.00 0.00 178.44 178.87 3kcv h LYS 33 N 0.15 -0.15 -0.97 1.25 3.64 -1.68 -1.50 116.57 117.31 3kcv h LYS 33 Ca 0.06 0.01 0.12 0.00 -1.27 0.00 0.00 60.65 59.58 3kcv h LYS 33 Cb 0.33 0.03 -0.09 0.00 -0.41 0.00 0.00 32.23 32.10 3kcv h LYS 33 CO 0.01 -0.10 0.60 1.15 -2.27 0.00 0.00 179.45 178.84 3kcv h THR 34 N -0.15 0.89 -0.45 1.00 2.02 -1.03 -0.70 112.91 114.48 3kcv h THR 34 Ca 0.07 -0.32 -0.06 0.00 0.77 0.00 0.00 66.41 66.88 3kcv h THR 34 Cb 0.26 -0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 66.53 3kcv h THR 34 CO -0.19 0.17 0.06 0.15 0.37 0.00 0.00 175.52 176.09 3kcv h PHE 35 N 0.93 0.81 -0.62 3.16 3.57 -0.60 0.16 116.94 124.36 3kcv h PHE 35 Ca 0.49 -0.12 -0.09 0.00 3.53 0.00 0.00 57.97 61.78 3kcv h PHE 35 Cb 0.52 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 3kcv h PHE 35 CO -0.02 0.77 0.02 1.88 -2.23 0.00 0.00 178.31 178.73 3kcv h TYR 36 N 0.62 1.17 0.00 0.41 0.05 -0.60 0.24 116.97 118.86 3kcv h TYR 36 Ca 0.14 -0.19 -0.05 0.00 0.05 0.00 0.00 58.73 58.67 3kcv h TYR 36 Cb 0.40 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 37.82 3kcv h TYR 36 CO 0.03 1.02 -0.24 -0.07 -1.05 0.00 0.00 178.16 177.85 3kcv h LEU 37 N 0.99 0.00 -0.34 3.88 3.38 -0.86 -0.54 115.31 121.81 3kcv h LEU 37 Ca 0.18 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.97 3kcv h LEU 37 Cb 0.54 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 3kcv h LEU 37 CO 0.03 0.24 -0.46 0.00 0.09 0.00 0.00 178.44 178.33 3kcv h ALA 38 N 1.76 0.51 -0.70 1.53 0.00 0.15 0.14 119.26 122.66 3kcv h ALA 38 Ca -0.00 -0.48 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 3kcv h ALA 38 Cb 0.59 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 3kcv h ALA 38 CO 0.03 0.67 0.24 0.82 0.00 0.00 0.00 179.25 181.02 3kcv h ILE 39 N 0.72 1.25 -0.69 0.00 2.04 -0.54 -1.20 117.51 119.10 3kcv h ILE 39 Ca 0.04 -0.84 -0.02 0.00 1.00 0.00 0.00 64.86 65.03 3kcv h ILE 39 Cb 1.07 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 3kcv h ILE 39 CO 0.11 0.33 0.34 0.74 0.00 0.00 0.00 178.15 179.67 3kcv h THR 40 N 1.01 1.22 -0.42 -0.27 2.02 -0.88 -1.53 112.91 114.06 3kcv h THR 40 Ca 0.23 -0.60 -0.12 0.00 0.77 0.00 0.00 66.41 66.69 3kcv h THR 40 Cb 0.27 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 3kcv h THR 40 CO -0.01 0.26 -0.20 0.00 0.37 0.00 0.00 175.52 175.94 3kcv h ALA 41 N 1.40 0.59 -0.81 6.16 0.00 -1.06 0.15 119.26 125.70 3kcv h ALA 41 Ca 0.24 -0.37 0.15 0.00 0.00 0.00 0.00 54.91 54.93 3kcv h ALA 41 Cb 0.09 -0.14 -0.10 0.00 0.00 0.00 0.00 17.79 17.64 3kcv h ALA 41 CO -0.03 0.55 0.37 0.78 0.00 0.00 0.00 179.25 180.92 3kcv h GLY 42 N 0.69 1.28 0.65 0.00 0.00 -0.49 0.22 103.07 105.42 3kcv h GLY 42 Ca 0.09 -0.20 -0.06 0.00 0.00 0.00 0.00 47.33 47.16 3kcv h GLY 42 CO 0.06 -0.08 -0.20 -2.08 0.00 0.00 0.00 176.54 174.25 3kcv h VAL 43 N 0.53 1.41 -1.00 4.60 2.07 -1.06 -2.27 116.25 120.53 3kcv h VAL 43 Ca 0.45 -1.52 0.16 0.00 0.82 0.00 0.00 66.70 66.61 3kcv h VAL 43 Cb 0.66 2.19 -0.10 0.00 -1.52 0.00 0.00 31.29 32.53 3kcv h VAL 43 CO -0.39 0.43 0.62 -0.26 0.02 0.00 0.00 177.57 177.99 3kcv h PHE 44 N -0.19 1.07 0.02 1.57 -1.00 0.02 -0.22 116.94 118.21 3kcv h PHE 44 Ca -0.00 0.03 -0.24 0.00 2.81 0.00 0.00 57.97 60.58 3kcv h PHE 44 Cb 0.79 -0.33 0.00 0.00 3.61 0.00 0.00 35.95 40.03 3kcv h PHE 44 CO 0.11 0.32 -1.00 0.97 -1.61 0.00 0.00 178.31 177.11 3kcv h ILE 45 N 0.84 1.41 -0.25 -0.55 6.09 -0.54 -1.79 117.51 122.71 3kcv h ILE 45 Ca 0.54 -2.53 -0.01 0.00 -1.37 0.00 0.00 64.86 61.49 3kcv h ILE 45 Cb 0.74 2.50 -0.01 0.00 0.47 0.00 0.00 36.82 40.52 3kcv h ILE 45 CO -0.32 0.75 0.11 0.28 -3.07 0.00 0.00 178.15 175.90 3kcv h SER 46 N 0.21 0.34 -0.87 2.19 0.02 -1.00 -2.00 113.55 112.45 3kcv h SER 46 Ca -0.09 -0.15 0.13 0.00 -0.84 0.00 0.00 61.79 60.84 3kcv h SER 46 Cb 1.65 -0.09 -0.09 0.00 0.14 0.00 0.00 62.40 64.01 3kcv h SER 46 CO 0.17 0.40 0.47 0.40 -1.14 0.00 0.00 176.83 177.13 3kcv h ILE 47 N 0.26 0.79 -0.15 3.27 2.04 -1.04 0.50 117.51 123.19 3kcv h ILE 47 Ca 0.09 -0.24 0.05 0.00 1.00 0.00 0.00 64.86 65.75 3kcv h ILE 47 Cb 0.16 0.02 -0.06 0.00 -0.74 0.00 0.00 36.82 36.20 3kcv h ILE 47 CO -0.01 0.13 -0.26 0.00 0.00 0.00 0.00 178.15 178.01 3kcv h ALA 48 N 1.54 -0.24 0.50 1.87 0.00 -0.77 -1.70 119.26 120.46 3kcv h ALA 48 Ca 0.46 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.39 3kcv h ALA 48 Cb 0.58 0.50 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3kcv h ALA 48 CO -0.33 -0.72 -0.25 0.74 0.00 0.00 0.00 179.25 178.70 3kcv h PHE 49 N -0.32 -0.64 -0.75 0.00 0.04 -0.57 -2.08 116.94 112.61 3kcv h PHE 49 Ca 0.11 -0.01 0.15 0.00 2.80 0.00 0.00 57.97 61.01 3kcv h PHE 49 Cb 0.48 0.21 -0.14 0.00 2.20 0.00 0.00 35.95 38.70 3kcv h PHE 49 CO -0.36 -0.39 -0.18 0.28 -0.60 0.00 0.00 178.31 177.05 3kcv n VAL 50 N -3.85 -0.32 -0.30 -0.55 0.31 0.07 0.19 118.33 113.88 3kcv n VAL 50 Ca -0.08 1.72 -0.00 0.00 -0.01 0.00 0.00 64.34 65.97 3kcv n VAL 50 Cb 0.27 -2.39 0.12 0.00 -0.91 0.00 0.00 33.84 30.93 3kcv n VAL 50 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 3kcv h PHE 51 N 0.00 0.95 -0.47 3.52 3.57 -1.17 0.31 116.94 123.65 3kcv h PHE 51 Ca 0.36 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.88 3kcv h PHE 51 Cb 0.56 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 3kcv h PHE 51 CO -0.57 0.50 0.23 -0.92 -2.23 0.00 0.00 178.31 175.31 3kcv h TYR 52 N 0.95 0.67 -0.04 0.41 3.20 0.28 0.35 116.97 122.79 3kcv h TYR 52 Ca 0.35 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.19 3kcv h TYR 52 Cb 0.13 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.18 3kcv h TYR 52 CO -0.04 0.53 0.02 0.82 -1.64 0.00 0.00 178.16 177.86 3kcv h ILE 53 N 0.62 1.05 -0.90 1.81 1.08 -0.84 -1.67 117.51 118.65 3kcv h ILE 53 Ca 0.16 -0.13 0.05 0.00 -0.39 0.00 0.00 64.86 64.55 3kcv h ILE 53 Cb 0.11 1.06 -0.06 0.00 -3.07 0.00 0.00 36.82 34.86 3kcv h ILE 53 CO -0.02 0.04 0.58 0.74 -0.69 0.00 0.00 178.15 178.80 3kcv h THR 54 N 0.01 1.11 -0.19 -0.27 2.02 -0.70 -1.39 112.91 113.50 3kcv h THR 54 Ca 0.01 -0.37 -0.12 0.00 0.77 0.00 0.00 66.41 66.70 3kcv h THR 54 Cb 0.04 -0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 66.36 3kcv h THR 54 CO -0.00 0.20 -0.39 0.00 0.37 0.00 0.00 175.52 175.70 3kcv h ALA 55 N 1.39 0.98 -0.58 6.16 0.00 -0.74 -3.27 119.26 123.22 3kcv h ALA 55 Ca 0.37 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3kcv h ALA 55 Cb 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3kcv h ALA 55 CO -0.14 0.61 0.00 0.25 0.00 0.00 0.00 179.25 179.97 3kcv n THR 56 N -4.04 0.76 -2.94 0.00 -2.24 -0.64 -4.90 114.28 100.29 3kcv n THR 56 Ca -0.01 -0.83 -0.40 0.00 -2.27 0.00 0.00 64.05 60.53 3kcv n THR 56 Cb 0.49 0.59 -0.05 0.00 -2.10 0.00 0.00 70.33 69.26 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 -1.24 4.64 -0.22 4.28 2.01 -0.58 -3.60 115.64 120.93 3kcv s THR 57 Ca 0.43 1.72 0.00 0.00 0.31 0.00 0.00 61.69 64.15 3kcv s THR 57 Cb 0.23 -4.16 0.00 0.00 0.01 0.00 0.00 72.50 68.58 3kcv s THR 57 CO 0.31 0.38 0.00 0.61 -0.69 0.00 0.00 174.62 175.23 3kcv n GLY 58 N 2.26 0.54 1.22 4.40 0.00 -1.26 -4.94 105.19 107.40 3kcv n GLY 58 Ca -0.02 -0.99 0.08 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.95 2.04 -0.13 2.61 -2.24 -1.24 -4.55 114.28 107.82 3kcv n THR 59 Ca -0.02 -1.46 0.08 0.00 -2.27 0.00 0.00 64.05 60.37 3kcv n THR 59 Cb 0.07 -0.03 0.40 0.00 -2.10 0.00 0.00 70.33 68.68 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 2.85 0.81 1.62 3.38 0.00 -1.92 -0.97 103.07 108.84 3kcv h GLY 60 Ca 0.00 -0.26 -0.02 0.00 0.00 0.00 0.00 47.33 47.05 3kcv h GLY 60 CO 0.24 0.19 0.13 0.00 0.00 0.00 0.00 176.54 177.10 3kcv h THR 61 N 0.64 1.14 -4.17 4.70 1.03 -2.02 -3.46 112.91 110.77 3kcv h THR 61 Ca 0.28 -0.46 -0.48 0.00 -0.01 0.00 0.00 66.41 65.74 3kcv h THR 61 Cb 0.29 0.74 0.03 0.00 -1.07 0.00 0.00 68.15 68.14 3kcv h THR 61 CO -0.09 0.18 0.38 -0.04 -0.01 0.00 0.00 175.52 175.93 3kcv s MET 62 N -5.22 3.71 0.07 0.00 1.00 -0.37 -4.98 119.30 113.51 3kcv s MET 62 Ca -0.08 1.11 -0.33 0.00 0.00 0.00 0.00 55.69 56.39 3kcv s MET 62 Cb 0.16 -2.09 -0.12 0.00 0.00 0.00 0.00 34.83 32.78 3kcv s MET 62 CO 0.74 -0.48 1.76 -2.30 0.00 0.00 0.00 175.02 174.74 3kcv n PRO 63 N -1.63 2.38 -0.21 2.03 -0.02 -1.26 -4.87 135.00 131.42 3kcv n PRO 63 Ca 0.08 0.87 -0.02 0.00 -2.02 0.00 0.00 63.50 62.40 3kcv n PRO 63 Cb 0.53 -2.70 0.05 0.00 -0.02 0.00 0.00 33.50 31.36 3kcv n PRO 63 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 3kcv h PHE 64 N 7.81 -0.53 -0.45 6.00 3.57 -1.93 -1.61 116.94 129.80 3kcv h PHE 64 Ca -0.46 0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.09 3kcv h PHE 64 Cb 1.25 0.33 -0.02 0.00 2.79 0.00 0.00 35.95 40.30 3kcv h PHE 64 CO 0.76 -0.32 0.27 0.78 -2.23 0.00 0.00 178.31 177.57 3kcv h GLY 65 N -0.06 0.66 1.01 2.40 0.00 -1.96 -1.88 103.07 103.24 3kcv h GLY 65 Ca 0.28 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 3kcv h GLY 65 CO -0.66 0.27 0.54 -0.33 0.00 0.00 0.00 176.54 176.36 3kcv h MET 66 N 0.60 1.20 -0.21 4.80 2.86 -1.69 0.54 114.93 123.02 3kcv h MET 66 Ca 0.16 -0.10 -0.19 0.00 -2.06 0.00 0.00 59.70 57.51 3kcv h MET 66 Cb 0.00 -0.25 0.00 0.00 0.06 0.00 0.00 31.60 31.41 3kcv h MET 66 CO -0.03 0.83 -0.59 0.00 1.06 0.00 0.00 176.91 178.18 3kcv h ALA 67 N 1.30 0.36 -0.45 6.32 0.00 -1.34 -1.76 119.26 123.68 3kcv h ALA 67 Ca 0.32 -0.53 -0.11 0.00 0.00 0.00 0.00 54.91 54.58 3kcv h ALA 67 Cb -0.07 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3kcv h ALA 67 CO -0.06 0.61 -0.18 0.87 0.00 0.00 0.00 179.25 180.49 3kcv h LYS 68 N 0.52 0.87 0.49 0.00 6.56 -1.23 -1.22 116.57 122.56 3kcv h LYS 68 Ca -0.01 -0.34 -0.02 0.00 -1.06 0.00 0.00 60.65 59.22 3kcv h LYS 68 Cb 1.21 -0.05 -0.02 0.00 -0.57 0.00 0.00 32.23 32.81 3kcv h LYS 68 CO 0.13 0.98 -0.44 1.25 -2.06 0.00 0.00 179.45 179.31 3kcv h LEU 69 N 0.77 -1.18 -1.50 2.94 5.85 -0.83 0.35 115.31 121.71 3kcv h LEU 69 Ca 0.11 0.09 0.15 0.00 0.84 0.00 0.00 57.88 59.07 3kcv h LEU 69 Cb 0.71 0.38 -0.06 0.00 0.37 0.00 0.00 40.66 42.06 3kcv h LEU 69 CO 0.05 -0.59 0.53 0.58 -0.34 0.00 0.00 178.44 178.67 3kcv h VAL 70 N -0.91 0.80 -0.13 1.05 2.07 -1.26 0.32 116.25 118.18 3kcv h VAL 70 Ca -0.06 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.31 3kcv h VAL 70 Cb 0.77 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 3kcv h VAL 70 CO -0.02 0.09 0.02 1.23 0.02 0.00 0.00 177.57 178.91 3kcv h GLY 71 N 0.49 0.14 1.29 2.17 0.00 -0.90 -1.97 103.07 104.29 3kcv h GLY 71 Ca 0.40 -0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.71 3kcv h GLY 71 CO -0.15 -0.01 0.38 -1.33 0.00 0.00 0.00 176.54 175.44 3kcv h GLY 72 N 0.07 1.00 1.61 4.60 0.00 0.18 0.29 103.07 110.82 3kcv h GLY 72 Ca 0.06 -0.43 -0.11 0.00 0.00 0.00 0.00 47.33 46.84 3kcv h GLY 72 CO -0.09 0.42 -0.36 -2.22 0.00 0.00 0.00 176.54 174.29 3kcv h ILE 73 N 0.94 1.29 0.00 2.60 2.04 -1.09 -1.86 117.51 121.44 3kcv h ILE 73 Ca 0.24 -1.47 -0.07 0.00 1.00 0.00 0.00 64.86 64.56 3kcv h ILE 73 Cb 0.01 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 3kcv h ILE 73 CO -0.04 0.46 -0.31 0.00 0.00 0.00 0.00 178.15 178.25 3kcv h PHE 75 N 0.00 0.11 0.00 0.00 3.57 -0.13 -3.21 116.94 117.28 3kcv h PHE 75 Ca -0.00 -0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.45 3kcv h PHE 75 Cb 0.66 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.38 3kcv h PHE 75 CO 0.00 0.66 -0.02 0.66 -2.23 0.00 0.00 178.31 177.37 3kcv h SER 76 N 0.07 0.00 -1.21 0.41 4.64 -1.38 -1.56 113.55 114.53 3kcv h SER 76 Ca -0.01 0.00 0.39 0.00 -0.47 0.00 0.00 61.79 61.70 3kcv h SER 76 Cb 1.06 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.02 3kcv h SER 76 CO 0.08 0.02 0.76 0.25 -0.87 0.00 0.00 176.83 177.08 3kcv h LEU 77 N 0.00 0.32 -0.12 5.97 6.46 -1.74 -0.33 115.31 125.87 3kcv h LEU 77 Ca -0.00 0.14 -0.03 0.00 -0.12 0.00 0.00 57.88 57.88 3kcv h LEU 77 Cb 0.13 0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 40.18 3kcv h LEU 77 CO 0.00 -0.15 -0.03 1.23 -0.62 0.00 0.00 178.44 178.88 3kcv h GLY 78 N 0.16 0.25 1.07 3.75 0.00 -1.46 0.16 103.07 106.99 3kcv h GLY 78 Ca 0.77 -0.20 -0.13 0.00 0.00 0.00 0.00 47.33 47.78 3kcv h GLY 78 CO -0.45 0.19 -0.22 -2.00 0.00 0.00 0.00 176.54 174.06 3kcv h LEU 79 N -0.08 0.94 0.21 3.11 5.85 -1.54 -1.77 115.31 122.04 3kcv h LEU 79 Ca 0.03 -0.41 -0.00 0.00 0.84 0.00 0.00 57.88 58.34 3kcv h LEU 79 Cb 0.44 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 3kcv h LEU 79 CO 0.01 1.14 -0.25 0.40 -0.34 0.00 0.00 178.44 179.41 3kcv h ILE 80 N 0.74 0.00 -0.95 4.05 2.04 -1.05 -1.50 117.51 120.84 3kcv h ILE 80 Ca 0.10 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.11 3kcv h ILE 80 Cb 0.79 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 36.71 3kcv h ILE 80 CO 0.07 0.00 -0.35 -0.11 0.00 0.00 0.00 178.15 177.75 3kcv n LEU 81 N -3.83 -0.58 -0.33 1.44 7.94 0.55 -0.02 117.00 122.17 3kcv n LEU 81 Ca -0.06 1.65 0.11 0.00 -1.11 0.00 0.00 56.01 56.61 3kcv n LEU 81 Cb 0.22 -0.39 0.29 0.00 0.53 0.00 0.00 43.42 44.06 3kcv n LEU 81 CO 0.12 -1.50 1.16 0.00 -1.11 0.00 0.00 177.39 176.06 3kcv h VAL 83 N 0.70 0.00 0.00 0.00 2.07 0.63 0.19 116.25 119.85 3kcv h VAL 83 Ca 0.54 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 67.30 3kcv h VAL 83 Cb 0.83 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 3kcv h VAL 83 CO -0.38 0.00 0.00 0.52 0.02 0.00 0.00 177.57 177.73 3kcv n VAL 84 N -4.21 0.00 0.00 2.57 0.31 -0.42 -1.47 118.33 115.11 3kcv n VAL 84 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 3kcv n VAL 84 Cb 0.01 -0.85 0.00 0.00 -0.91 0.00 0.00 33.84 32.09 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 0.84 0.05 3.84 0.00 0.00 -0.54 -5.03 105.19 104.34 3kcv n GLY 86 Ca 0.00 -0.47 -0.32 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.57 3.10 -0.63 4.61 0.00 -0.05 -4.95 121.76 121.27 3kcv s ALA 87 Ca 0.04 0.18 -0.16 0.00 0.00 0.00 0.00 51.96 52.02 3kcv s ALA 87 Cb -0.02 -3.07 0.14 0.00 0.00 0.00 0.00 23.12 20.17 3kcv s ALA 87 CO 0.05 -0.13 0.63 0.34 0.00 0.00 0.00 175.76 176.66 3kcv s ASP 88 N -2.88 6.33 -0.24 0.00 -1.08 0.37 -4.77 116.67 114.40 3kcv s ASP 88 Ca 0.59 -1.90 -0.16 0.00 -0.52 0.00 0.00 52.55 50.56 3kcv s ASP 88 Cb -0.10 -2.24 -0.04 0.00 -1.46 0.00 0.00 42.92 39.08 3kcv s ASP 88 CO 0.27 -0.87 0.40 -0.22 0.52 0.00 0.00 175.17 175.26 3kcv s LEU 89 N 1.62 4.08 -0.36 -1.34 2.96 -1.26 -4.01 118.68 120.37 3kcv s LEU 89 Ca 0.10 0.40 -0.33 0.00 -0.22 0.00 0.00 54.13 54.07 3kcv s LEU 89 Cb -0.23 -2.48 -0.14 0.00 0.50 0.00 0.00 46.19 43.83 3kcv s LEU 89 CO 0.01 -0.15 1.16 0.33 -1.32 0.00 0.00 176.35 176.38 3kcv n PHE 90 N 5.02 1.22 -0.12 5.38 7.35 -1.26 -0.36 117.46 134.69 3kcv n PHE 90 Ca -0.08 0.80 0.00 0.00 -0.76 0.00 0.00 57.45 57.41 3kcv n PHE 90 Cb 0.51 -1.59 0.00 0.00 0.35 0.00 0.00 39.48 38.75 3kcv n PHE 90 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 3kcv n THR 91 N 2.95 0.00 0.22 -2.13 -2.24 -1.26 -4.73 114.28 107.09 3kcv n THR 91 Ca 0.23 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 62.10 3kcv n THR 91 Cb -0.04 -0.09 0.47 0.00 -2.10 0.00 0.00 70.33 68.57 3kcv n THR 91 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3kcv h SER 92 N 0.00 0.00 0.61 3.42 4.64 -1.11 -1.45 113.55 119.67 3kcv h SER 92 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3kcv h SER 92 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3kcv h SER 92 CO 0.00 0.25 -0.45 0.35 -0.87 0.00 0.00 176.83 176.11 3kcv n THR 93 N -3.48 0.04 0.03 2.95 -2.24 -1.22 -4.13 114.28 106.23 3kcv n THR 93 Ca -0.00 -0.03 0.19 0.00 -2.27 0.00 0.00 64.05 61.93 3kcv n THR 93 Cb 0.42 0.11 0.44 0.00 -2.10 0.00 0.00 70.33 69.20 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 0.00 0.07 0.00 2.28 3.04 -1.56 -1.71 116.25 118.37 3kcv h VAL 94 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 3kcv h VAL 94 Cb 0.53 0.21 0.00 0.00 -2.01 0.00 0.00 31.29 30.01 3kcv h VAL 94 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.57 176.74 3kcv n LEU 95 N -3.13 0.00 -0.31 3.16 4.77 -1.26 -1.89 117.00 118.34 3kcv n LEU 95 Ca 0.12 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.18 3kcv n LEU 95 Cb 1.10 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 42.43 3kcv n LEU 95 CO 0.18 0.00 1.13 0.40 -1.33 0.00 0.00 177.39 177.76 3kcv h ILE 96 N 0.00 0.74 0.00 -0.08 5.03 -1.68 -0.43 117.51 121.08 3kcv h ILE 96 Ca 0.00 -0.23 0.00 0.00 -0.12 0.00 0.00 64.86 64.51 3kcv h ILE 96 Cb 0.00 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 33.79 3kcv h ILE 96 CO 0.00 0.12 0.00 0.52 -0.68 0.00 0.00 178.15 178.11 3kcv n VAL 97 N -4.83 1.02 -0.05 1.67 0.31 -0.84 -0.62 118.33 114.99 3kcv n VAL 97 Ca 0.18 0.53 -0.06 0.00 -0.01 0.00 0.00 64.34 64.99 3kcv n VAL 97 Cb 0.46 -1.50 -0.06 0.00 -0.91 0.00 0.00 33.84 31.82 3kcv n VAL 97 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 3kcv n VAL 98 N -2.19 0.58 -0.37 2.52 0.24 -0.44 -2.81 118.33 115.86 3kcv n VAL 98 Ca 0.00 -0.29 0.33 0.00 -2.04 0.00 0.00 64.34 62.33 3kcv n VAL 98 Cb 0.10 -0.82 0.66 0.00 -1.47 0.00 0.00 33.84 32.31 3kcv n VAL 98 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3kcv h ALA 99 N 0.22 2.82 0.07 2.33 0.00 -0.87 -1.61 119.26 122.22 3kcv h ALA 99 Ca -0.23 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 3kcv h ALA 99 Cb 1.44 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.32 3kcv h ALA 99 CO -0.01 -1.25 -0.03 0.87 0.00 0.00 0.00 179.25 178.83 3kcv h LYS 100 N 0.14 -0.09 0.00 0.00 1.79 -1.02 -1.85 116.57 115.55 3kcv h LYS 100 Ca 0.64 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 59.12 3kcv h LYS 100 Cb 2.17 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 32.84 3kcv h LYS 100 CO -0.17 0.47 0.00 0.00 -1.08 0.00 0.00 179.45 178.67 3kcv n ALA 101 N -2.60 0.00 -0.13 3.86 0.00 -1.12 0.51 120.51 121.03 3kcv n ALA 101 Ca -0.07 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.32 3kcv n ALA 101 Cb 0.29 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.76 3kcv n ALA 101 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3kcv h SER 102 N 0.00 -0.44 -0.66 0.00 4.64 -1.62 0.16 113.55 115.63 3kcv h SER 102 Ca 0.00 0.13 0.06 0.00 -0.47 0.00 0.00 61.79 61.52 3kcv h SER 102 Cb 0.00 0.28 -0.09 0.00 -0.31 0.00 0.00 62.40 62.28 3kcv h SER 102 CO 0.00 -0.16 -0.50 1.23 -0.87 0.00 0.00 176.83 176.54 3kcv h GLY 103 N -0.02 -1.12 0.00 -0.77 0.00 -0.43 -3.45 103.07 97.27 3kcv h GLY 103 Ca 0.20 0.81 0.00 0.00 0.00 0.00 0.00 47.33 48.34 3kcv h GLY 103 CO -0.44 -0.14 0.00 0.54 0.00 0.00 0.00 176.54 176.49 3kcv n ARG 104 N -4.96 0.00 0.00 4.80 1.74 1.92 -4.97 116.66 115.19 3kcv n ARG 104 Ca -0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3kcv n ARG 104 Cb 0.25 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.69 3kcv n ARG 104 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 3kcv n ILE 105 N 0.00 0.00 -1.77 0.55 -0.00 -0.37 -4.19 119.36 113.58 3kcv n ILE 105 Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 62.75 62.41 3kcv n ILE 105 Cb 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 39.64 39.69 3kcv n ILE 105 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.55 175.66 3kcv s THR 106 N -1.35 3.01 0.08 1.39 2.01 -1.26 -4.20 115.64 115.32 3kcv s THR 106 Ca 0.00 0.50 -0.23 0.00 0.31 0.00 0.00 61.69 62.27 3kcv s THR 106 Cb 0.00 -3.05 -0.15 0.00 0.01 0.00 0.00 72.50 69.31 3kcv s THR 106 CO 0.00 -0.26 1.69 -0.50 -0.69 0.00 0.00 174.62 174.86 3kcv h TRP 107 N 0.16 0.00 -0.90 4.92 4.06 -1.98 -0.49 115.95 121.71 3kcv h TRP 107 Ca -0.48 -0.00 0.24 0.00 2.06 0.00 0.00 58.89 60.71 3kcv h TRP 107 Cb 1.26 -0.00 -0.16 0.00 -1.00 0.00 0.00 29.16 29.26 3kcv h TRP 107 CO 0.52 0.05 0.07 0.78 -3.56 0.00 0.00 178.44 176.30 3kcv h GLY 108 N -0.04 1.17 0.93 1.49 0.00 -1.99 0.10 103.07 104.73 3kcv h GLY 108 Ca 0.00 0.10 -0.15 0.00 0.00 0.00 0.00 47.33 47.28 3kcv h GLY 108 CO -0.00 -0.43 -0.52 1.46 0.00 0.00 0.00 176.54 177.06 3kcv h GLN 109 N 0.08 0.58 -0.40 4.80 4.20 -1.88 -2.16 115.11 120.33 3kcv h GLN 109 Ca 0.54 -0.45 0.01 0.00 0.06 0.00 0.00 58.65 58.81 3kcv h GLN 109 Cb 1.08 0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.92 3kcv h GLN 109 CO -0.80 1.07 0.25 -0.07 -0.67 0.00 0.00 178.83 178.61 3kcv h LEU 110 N 0.21 0.42 0.84 1.46 3.38 0.21 -2.31 115.31 119.53 3kcv h LEU 110 Ca -0.03 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 3kcv h LEU 110 Cb 1.15 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.81 3kcv h LEU 110 CO 0.11 0.30 -0.48 0.00 0.09 0.00 0.00 178.44 178.46 3kcv h ALA 111 N 1.16 -1.30 -1.23 1.53 0.00 -0.93 -2.99 119.26 115.51 3kcv h ALA 111 Ca 0.15 -0.26 0.36 0.00 0.00 0.00 0.00 54.91 55.16 3kcv h ALA 111 Cb -0.03 0.57 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 3kcv h ALA 111 CO -0.05 -1.24 0.97 -0.22 0.00 0.00 0.00 179.25 178.72 3kcv h LYS 112 N -1.22 0.00 0.04 0.00 1.63 -1.18 -1.36 116.57 114.48 3kcv h LYS 112 Ca -0.11 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.68 3kcv h LYS 112 Cb 0.96 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.59 3kcv h LYS 112 CO 0.14 0.00 -0.02 -0.97 -3.45 0.00 0.00 179.45 175.15 3kcv h ASN 113 N 0.00 -0.05 -0.73 4.20 -1.24 -1.28 -3.28 115.58 113.21 3kcv h ASN 113 Ca 0.58 -0.62 0.06 0.00 0.71 0.00 0.00 56.30 57.04 3kcv h ASN 113 Cb 2.52 0.01 -0.06 0.00 0.73 0.00 0.00 38.32 41.53 3kcv h ASN 113 CO -0.01 0.70 0.42 -0.50 -1.29 0.00 0.00 177.43 176.76 3kcv h TRP 114 N -0.91 0.78 -0.76 0.67 6.55 -1.15 0.89 115.95 122.02 3kcv h TRP 114 Ca -0.01 0.03 0.18 0.00 0.95 0.00 0.00 58.89 60.04 3kcv h TRP 114 Cb 0.66 -0.24 -0.13 0.00 -0.86 0.00 0.00 29.16 28.59 3kcv h TRP 114 CO 0.16 0.38 0.08 1.25 -1.05 0.00 0.00 178.44 179.26 3kcv h LEU 115 N 0.77 -0.21 -0.02 -4.49 5.85 -1.63 0.14 115.31 115.72 3kcv h LEU 115 Ca 0.32 0.18 -0.01 0.00 0.84 0.00 0.00 57.88 59.21 3kcv h LEU 115 Cb 0.19 0.30 -0.00 0.00 0.37 0.00 0.00 40.66 41.51 3kcv h LEU 115 CO -0.18 -0.14 -0.04 -1.13 -0.34 0.00 0.00 178.44 176.61 3kcv h ASN 116 N 0.15 0.08 -0.77 1.25 -0.73 -1.03 -1.90 115.58 112.63 3kcv h ASN 116 Ca 0.43 -0.55 0.03 0.00 1.87 0.00 0.00 56.30 58.07 3kcv h ASN 116 Cb 0.77 -0.02 -0.05 0.00 0.27 0.00 0.00 38.32 39.29 3kcv h ASN 116 CO -0.62 0.61 0.50 0.58 -0.37 0.00 0.00 177.43 178.13 3kcv h VAL 117 N -0.46 1.13 0.09 2.57 2.07 -0.56 -1.31 116.25 119.78 3kcv h VAL 117 Ca 0.00 -0.33 0.01 0.00 0.82 0.00 0.00 66.70 67.19 3kcv h VAL 117 Cb 0.60 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 3kcv h VAL 117 CO 0.01 0.18 -0.10 0.22 0.02 0.00 0.00 177.57 177.90 3kcv h TYR 118 N 0.98 -0.26 -0.46 1.57 3.20 -0.73 0.34 116.97 121.60 3kcv h TYR 118 Ca 0.30 0.00 -0.13 0.00 3.14 0.00 0.00 58.73 62.05 3kcv h TYR 118 Cb -0.01 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 3kcv h TYR 118 CO -0.03 -0.16 -0.22 0.35 -1.64 0.00 0.00 178.16 176.46 3kcv h PHE 119 N -0.22 1.09 -0.48 -3.82 3.57 -1.13 -1.52 116.94 114.43 3kcv h PHE 119 Ca 0.01 -0.26 -0.09 0.00 3.53 0.00 0.00 57.97 61.16 3kcv h PHE 119 Cb 0.22 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 3kcv h PHE 119 CO -0.12 1.07 -0.03 0.78 -2.23 0.00 0.00 178.31 177.78 3kcv h GLY 120 N 0.89 0.94 0.66 2.40 0.00 -1.10 -0.88 103.07 105.99 3kcv h GLY 120 Ca 0.11 -0.72 0.06 0.00 0.00 0.00 0.00 47.33 46.78 3kcv h GLY 120 CO 0.07 0.66 0.31 3.43 0.00 0.00 0.00 176.54 181.01 3kcv h ASN 121 N 0.72 0.44 -0.28 0.19 -0.26 0.08 -1.28 115.58 115.20 3kcv h ASN 121 Ca 0.13 0.04 -0.05 0.00 -0.56 0.00 0.00 56.30 55.86 3kcv h ASN 121 Cb 0.56 -0.05 -0.01 0.00 -1.06 0.00 0.00 38.32 37.76 3kcv h ASN 121 CO 0.03 0.29 -0.03 0.25 -1.06 0.00 0.00 177.43 176.92 3kcv h LEU 122 N 0.58 0.52 -0.53 1.61 5.85 -1.12 -0.23 115.31 121.99 3kcv h LEU 122 Ca 0.27 -0.33 0.10 0.00 0.84 0.00 0.00 57.88 58.76 3kcv h LEU 122 Cb 0.19 -0.14 -0.08 0.00 0.37 0.00 0.00 40.66 41.00 3kcv h LEU 122 CO -0.19 0.72 0.03 0.58 -0.34 0.00 0.00 178.44 179.25 3kcv h VAL 123 N 0.30 0.61 -0.05 1.05 2.07 -0.96 0.93 116.25 120.19 3kcv h VAL 123 Ca 0.08 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.57 3kcv h VAL 123 Cb 0.48 0.45 -0.05 0.00 -1.52 0.00 0.00 31.29 30.64 3kcv h VAL 123 CO 0.02 0.03 -0.46 1.23 0.02 0.00 0.00 177.57 178.40 3kcv h GLY 124 N 0.15 -1.17 0.61 2.17 0.00 -0.87 -0.70 103.07 103.26 3kcv h GLY 124 Ca 0.27 0.67 0.05 0.00 0.00 0.00 0.00 47.33 48.32 3kcv h GLY 124 CO -0.42 -0.27 0.07 0.00 0.00 0.00 0.00 176.54 175.92 3kcv h ALA 125 N -0.53 0.35 -0.56 3.60 0.00 -0.17 -1.77 119.26 120.17 3kcv h ALA 125 Ca 0.02 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.01 3kcv h ALA 125 Cb 0.60 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 3kcv h ALA 125 CO -0.34 -0.34 0.36 -0.07 0.00 0.00 0.00 179.25 178.86 3kcv h LEU 126 N 0.18 0.60 -1.25 0.00 3.38 -0.79 0.53 115.31 117.96 3kcv h LEU 126 Ca 0.16 -0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.21 3kcv h LEU 126 Cb 0.17 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.73 3kcv h LEU 126 CO -0.21 0.43 0.55 -0.07 0.09 0.00 0.00 178.44 179.23 3kcv h LEU 127 N 0.72 0.76 -0.29 1.67 3.38 -0.71 -1.80 115.31 119.03 3kcv h LEU 127 Ca 0.22 0.02 -0.20 0.00 0.09 0.00 0.00 57.88 58.00 3kcv h LEU 127 Cb -0.03 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.57 3kcv h LEU 127 CO -0.07 0.46 -0.69 0.15 0.09 0.00 0.00 178.44 178.38 3kcv h PHE 128 N 0.85 0.90 -0.32 1.13 3.57 -0.26 -1.94 116.94 120.87 3kcv h PHE 128 Ca 0.38 -0.37 0.06 0.00 3.53 0.00 0.00 57.97 61.57 3kcv h PHE 128 Cb 0.37 -0.15 -0.08 0.00 2.79 0.00 0.00 35.95 38.88 3kcv h PHE 128 CO -0.00 1.17 -0.47 0.28 -2.23 0.00 0.00 178.31 177.06 3kcv h VAL 129 N 0.49 0.08 -0.05 1.41 2.07 -0.59 -0.05 116.25 119.60 3kcv h VAL 129 Ca -0.03 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.51 3kcv h VAL 129 Cb 1.29 0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 3kcv h VAL 129 CO 0.14 0.00 -0.36 0.25 0.02 0.00 0.00 177.57 177.62 3kcv h LEU 130 N -0.40 -1.12 -0.48 2.57 5.85 -1.09 0.49 115.31 121.12 3kcv h LEU 130 Ca 0.10 0.13 0.08 0.00 0.84 0.00 0.00 57.88 59.03 3kcv h LEU 130 Cb 0.61 0.43 -0.06 0.00 0.37 0.00 0.00 40.66 42.01 3kcv h LEU 130 CO -0.53 -0.33 0.11 0.25 -0.34 0.00 0.00 178.44 177.60 3kcv h LEU 131 N -0.41 0.04 -1.14 2.25 5.85 -1.25 0.68 115.31 121.34 3kcv h LEU 131 Ca 0.02 0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.86 3kcv h LEU 131 Cb 0.46 0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.53 3kcv h LEU 131 CO -0.27 0.05 0.59 0.24 -0.34 0.00 0.00 178.44 178.71 3kcv h MET 132 N 0.26 1.05 0.54 1.25 2.86 -0.79 -0.33 114.93 119.76 3kcv h MET 132 Ca 0.24 -0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.79 3kcv h MET 132 Cb 0.30 -0.24 0.01 0.00 0.06 0.00 0.00 31.60 31.73 3kcv h MET 132 CO -0.30 0.69 -0.26 2.35 1.06 0.00 0.00 176.91 180.46 3kcv h TRP 133 N 1.08 -0.67 -0.93 -0.22 -0.00 0.81 -2.80 115.95 113.22 3kcv h TRP 133 Ca 0.37 -0.02 0.27 0.00 -0.00 0.00 0.00 58.89 59.51 3kcv h TRP 133 Cb 0.11 0.22 -0.14 0.00 -0.00 0.00 0.00 29.16 29.34 3kcv h TRP 133 CO -0.00 -0.37 0.36 -0.07 -0.00 0.00 0.00 178.44 178.36 3kcv h LEU 134 N -0.84 0.20 -0.28 0.65 -0.00 -0.46 0.49 115.31 115.07 3kcv h LEU 134 Ca -0.07 0.19 0.00 0.00 -0.00 0.00 0.00 57.88 58.00 3kcv h LEU 134 Cb 0.60 0.22 0.00 0.00 -0.00 0.00 0.00 40.66 41.48 3kcv h LEU 134 CO 0.12 -0.14 0.00 -1.54 -0.00 0.00 0.00 178.44 176.88 3kcv n SER 135 N -5.16 0.22 -2.35 -0.43 3.41 -0.18 -4.88 113.62 104.25 3kcv n SER 135 Ca 0.25 0.56 -0.16 0.00 -0.26 0.00 0.00 58.87 59.26 3kcv n SER 135 Cb 0.80 -0.60 0.04 0.00 -0.26 0.00 0.00 64.21 64.18 3kcv n SER 135 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kcv n GLY 136 N -0.27 -0.15 0.22 5.00 0.00 0.17 -4.93 105.19 105.23 3kcv n GLY 136 Ca 0.02 -0.10 0.10 0.00 0.00 0.00 0.00 46.02 46.05 3kcv n GLY 136 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3kcv h GLU 137 N -1.27 0.00 0.00 1.61 4.57 -1.77 -3.27 114.58 114.45 3kcv h GLU 137 Ca -0.39 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.79 3kcv h GLU 137 Cb 1.26 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.85 3kcv h GLU 137 CO 0.40 0.20 0.01 0.10 -1.18 0.00 0.00 179.01 178.55 3kcv h TYR 138 N 0.00 0.00 -0.00 0.92 -0.00 -1.91 0.18 116.97 116.16 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 0.82 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.55 3kcv h TYR 138 CO 0.00 0.00 -0.32 -1.33 -0.00 0.00 0.00 178.16 176.51 3kcv n MET 139 N -2.30 0.08 -1.64 0.10 2.81 -1.23 -1.16 117.12 113.77 3kcv n MET 139 Ca -0.02 -0.03 -0.44 0.00 -1.81 0.00 0.00 57.70 55.40 3kcv n MET 139 Cb 0.05 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 31.04 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 -1.43 1.72 -3.73 2.03 -1.04 0.63 -0.46 114.28 111.99 3kcv n THR 140 Ca 0.07 -0.43 -0.22 0.00 -2.04 0.00 0.00 64.05 61.43 3kcv n THR 140 Cb 0.33 -1.25 0.03 0.00 -1.82 0.00 0.00 70.33 67.62 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 0.66 -1.99 -2.35 2.41 0.00 -1.26 -1.89 120.51 116.09 3kcv n ALA 141 Ca 0.09 -0.17 -0.12 0.00 0.00 0.00 0.00 53.44 53.24 3kcv n ALA 141 Cb 0.33 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.81 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 -3.04 -3.92 0.00 0.00 4.05 -0.88 -1.79 115.26 109.68 3kcv n ASN 142 Ca -0.29 -0.05 0.00 0.00 0.45 0.00 0.00 54.58 54.69 3kcv n ASN 142 Cb 0.67 -3.05 0.00 0.00 1.23 0.00 0.00 39.78 38.64 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 -1.06 1.80 0.34 8.20 0.00 0.39 -4.11 105.19 110.75 3kcv n GLY 143 Ca -0.12 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.97 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 2.76 0.54 0.34 1.61 1.08 -1.07 0.24 115.11 120.60 3kcv h GLN 144 Ca 0.00 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.15 3kcv h GLN 144 Cb 0.00 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.31 3kcv h GLN 144 CO 0.00 0.36 -0.16 2.35 -0.95 0.00 0.00 178.83 180.42 3kcv h TRP 145 N 0.56 -0.42 -0.21 2.96 7.01 -1.56 0.99 115.95 125.27 3kcv h TRP 145 Ca 0.24 -0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.27 3kcv h TRP 145 Cb 0.24 0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 27.43 3kcv h TRP 145 CO -0.00 -0.14 0.15 0.78 -2.79 0.00 0.00 178.44 176.44 3kcv h GLY 146 N -0.68 0.11 1.06 2.65 0.00 -0.66 -0.30 103.07 105.25 3kcv h GLY 146 Ca -0.05 -0.04 -0.14 0.00 0.00 0.00 0.00 47.33 47.10 3kcv h GLY 146 CO 0.08 0.03 -0.36 -2.00 0.00 0.00 0.00 176.54 174.29 3kcv h LEU 147 N 0.09 0.90 -0.60 3.11 5.85 -0.61 -1.36 115.31 122.69 3kcv h LEU 147 Ca 0.10 -0.47 0.11 0.00 0.84 0.00 0.00 57.88 58.45 3kcv h LEU 147 Cb 0.27 -0.25 -0.08 0.00 0.37 0.00 0.00 40.66 40.96 3kcv h LEU 147 CO -0.01 1.19 0.15 -1.13 -0.34 0.00 0.00 178.44 178.30 3kcv h ASN 148 N 0.62 0.05 -0.33 1.25 -0.73 0.93 -0.29 115.58 117.08 3kcv h ASN 148 Ca 0.05 0.10 -0.05 0.00 1.87 0.00 0.00 56.30 58.27 3kcv h ASN 148 Cb 0.94 0.13 -0.01 0.00 0.27 0.00 0.00 38.32 39.65 3kcv h ASN 148 CO 0.09 0.04 0.01 0.58 -0.37 0.00 0.00 177.43 177.77 3kcv h VAL 149 N 0.29 1.26 -0.28 2.57 2.07 -1.24 -1.15 116.25 119.77 3kcv h VAL 149 Ca 0.31 -0.95 0.04 0.00 0.82 0.00 0.00 66.70 66.93 3kcv h VAL 149 Cb 0.45 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 3kcv h VAL 149 CO -0.38 0.31 0.03 -0.07 0.02 0.00 0.00 177.57 177.48 3kcv h LEU 150 N 0.39 -0.04 -0.26 2.57 3.38 -0.55 0.89 115.31 121.69 3kcv h LEU 150 Ca 0.09 0.05 -0.15 0.00 0.09 0.00 0.00 57.88 57.97 3kcv h LEU 150 Cb 0.44 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 3kcv h LEU 150 CO 0.02 0.01 -0.42 1.56 0.09 0.00 0.00 178.44 179.70 3kcv h GLN 151 N 0.13 0.75 -0.35 1.13 4.20 -1.01 -0.39 115.11 119.57 3kcv h GLN 151 Ca 0.13 -0.46 -0.10 0.00 0.06 0.00 0.00 58.65 58.29 3kcv h GLN 151 Cb 0.15 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 3kcv h GLN 151 CO -0.19 1.08 -0.18 1.79 -0.67 0.00 0.00 178.83 180.65 3kcv h THR 152 N 0.49 1.26 0.17 -0.54 1.35 -1.09 -1.68 112.91 112.87 3kcv h THR 152 Ca 0.02 -1.22 -0.01 0.00 -0.55 0.00 0.00 66.41 64.65 3kcv h THR 152 Cb 1.02 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.63 3kcv h THR 152 CO 0.10 0.40 -0.08 0.00 -0.25 0.00 0.00 175.52 175.69 3kcv h ALA 153 N 1.22 -0.23 -0.13 6.62 0.00 -0.81 -3.25 119.26 122.69 3kcv h ALA 153 Ca 0.09 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.92 3kcv h ALA 153 Cb 0.64 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 3kcv h ALA 153 CO 0.04 -0.56 -0.05 0.22 0.00 0.00 0.00 179.25 178.91 3kcv h ASP 154 N -0.38 -0.18 -1.26 0.00 3.58 -0.92 -2.66 116.42 114.60 3kcv h ASP 154 Ca -0.02 0.05 0.38 0.00 0.42 0.00 0.00 57.03 57.85 3kcv h ASP 154 Cb 0.29 0.11 -0.10 0.00 1.72 0.00 0.00 39.33 41.35 3kcv h ASP 154 CO 0.04 -0.07 0.83 -0.74 -2.88 0.00 0.00 179.24 176.42 3kcv h HIS 155 N -0.04 0.47 -0.12 0.28 2.76 -1.37 -2.45 115.15 114.68 3kcv h HIS 155 Ca 0.07 0.02 -0.19 0.00 -2.20 0.00 0.00 60.37 58.07 3kcv h HIS 155 Cb 0.14 -0.12 -0.00 0.00 1.55 0.00 0.00 27.41 28.97 3kcv h HIS 155 CO -0.19 -0.08 -0.71 0.87 -1.30 0.00 0.00 177.93 176.53 3kcv h LYS 156 N 0.17 0.55 0.00 5.26 1.57 -1.51 -3.11 116.57 119.50 3kcv h LYS 156 Ca 0.72 -0.43 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 3kcv h LYS 156 Cb 2.27 0.08 0.00 0.00 0.08 0.00 0.00 32.23 34.66 3kcv h LYS 156 CO -0.30 1.05 0.00 -0.39 -0.57 0.00 0.00 179.45 179.24 3kcv h VAL 157 N 0.39 0.00 -0.14 0.50 -1.51 -1.54 -3.27 116.25 110.69 3kcv h VAL 157 Ca -0.03 -0.43 -0.03 0.00 -1.23 0.00 0.00 66.70 64.98 3kcv h VAL 157 Cb 1.29 1.31 -0.02 0.00 -2.13 0.00 0.00 31.29 31.75 3kcv h VAL 157 CO 0.13 0.00 0.04 1.41 -1.23 0.00 0.00 177.57 177.92 3kcv n HIS 158 N -2.51 0.46 -3.48 5.19 8.25 -1.18 -4.73 115.22 117.23 3kcv n HIS 158 Ca 0.03 -0.34 -0.38 0.00 -0.26 0.00 0.00 57.72 56.77 3kcv n HIS 158 Cb 0.33 -0.25 -0.06 0.00 1.12 0.00 0.00 29.99 31.13 3kcv n HIS 158 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3kcv s HIS 159 N -1.10 3.73 1.02 4.41 3.76 -1.23 -5.09 115.29 120.79 3kcv s HIS 159 Ca 0.11 1.02 -0.12 0.00 -0.15 0.00 0.00 55.06 55.92 3kcv s HIS 159 Cb 0.08 -2.31 0.20 0.00 1.11 0.00 0.00 32.58 31.67 3kcv s HIS 159 CO 0.03 0.63 1.08 0.95 -0.85 0.00 0.00 174.74 176.58 3kcv s THR 160 N -1.10 2.23 0.14 1.30 -4.23 -1.26 -4.75 115.64 107.97 3kcv s THR 160 Ca 0.25 0.08 -0.17 0.00 -1.18 0.00 0.00 61.69 60.66 3kcv s THR 160 Cb -0.17 -2.31 -0.01 0.00 1.34 0.00 0.00 72.50 71.36 3kcv s THR 160 CO 0.14 -0.10 1.80 0.15 -0.54 0.00 0.00 174.62 176.08 3kcv h PHE 161 N -2.08 0.43 -0.61 3.99 3.57 -1.97 -0.58 116.94 119.70 3kcv h PHE 161 Ca -0.54 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 60.94 3kcv h PHE 161 Cb 1.31 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.87 3kcv h PHE 161 CO 0.36 0.27 0.24 0.82 -2.23 0.00 0.00 178.31 177.77 3kcv h ILE 162 N 0.46 1.23 -0.36 1.41 2.04 -1.99 -1.42 117.51 118.89 3kcv h ILE 162 Ca 0.13 -0.72 -0.11 0.00 1.00 0.00 0.00 64.86 65.15 3kcv h ILE 162 Cb -0.05 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 3kcv h ILE 162 CO -0.03 0.28 -0.24 -0.33 0.00 0.00 0.00 178.15 177.83 3kcv h GLU 163 N 0.85 0.72 -0.73 2.37 5.08 -1.88 -0.55 114.58 120.45 3kcv h GLU 163 Ca 0.20 -0.30 -0.07 0.00 -1.00 0.00 0.00 59.36 58.20 3kcv h GLU 163 Cb 0.21 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 3kcv h GLU 163 CO -0.02 0.90 0.20 0.00 -1.00 0.00 0.00 179.01 179.08 3kcv h ALA 164 N 1.10 0.96 -0.01 3.43 0.00 -0.87 0.36 119.26 124.23 3kcv h ALA 164 Ca 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3kcv h ALA 164 Cb 0.74 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3kcv h ALA 164 CO 0.06 0.67 -0.02 0.28 0.00 0.00 0.00 179.25 180.24 3kcv h VAL 165 N 1.09 1.44 -0.82 0.00 2.07 -0.96 -1.25 116.25 117.82 3kcv h VAL 165 Ca 0.23 -1.33 0.10 0.00 0.82 0.00 0.00 66.70 66.52 3kcv h VAL 165 Cb 0.35 2.32 -0.06 0.00 -1.52 0.00 0.00 31.29 32.38 3kcv h VAL 165 CO -0.00 0.35 0.53 0.00 0.02 0.00 0.00 177.57 178.47 3kcv h LEU 167 N 0.77 0.00 -0.12 0.00 3.38 -0.92 -1.29 115.31 117.13 3kcv h LEU 167 Ca 0.38 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.19 3kcv h LEU 167 Cb 0.45 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.20 3kcv h LEU 167 CO -0.15 0.52 -0.56 1.23 0.09 0.00 0.00 178.44 179.57 3kcv h GLY 168 N 1.90 0.65 0.98 0.83 0.00 0.27 -0.79 103.07 106.92 3kcv h GLY 168 Ca -0.01 -0.91 -0.00 0.00 0.00 0.00 0.00 47.33 46.41 3kcv h GLY 168 CO 0.07 0.81 -0.05 -2.22 0.00 0.00 0.00 176.54 175.15 3kcv h ILE 169 N 0.23 0.89 -0.17 2.60 2.04 -0.49 -2.34 117.51 120.27 3kcv h ILE 169 Ca -0.04 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.87 3kcv h ILE 169 Cb 1.20 0.89 -0.06 0.00 -0.74 0.00 0.00 36.82 38.12 3kcv h ILE 169 CO 0.12 0.00 -0.18 -0.07 0.00 0.00 0.00 178.15 178.01 3kcv h LEU 170 N -0.13 -0.58 0.57 1.44 3.38 -1.28 -1.34 115.31 117.36 3kcv h LEU 170 Ca -0.01 0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 3kcv h LEU 170 Cb 0.11 0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 3kcv h LEU 170 CO 0.01 -0.23 -0.46 0.00 0.09 0.00 0.00 178.44 177.85 3kcv h ALA 171 N 0.85 -1.07 0.00 1.53 0.00 -1.12 -2.91 119.26 116.55 3kcv h ALA 171 Ca 0.11 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3kcv h ALA 171 Cb 0.38 0.62 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 3kcv h ALA 171 CO -0.30 -1.13 -0.05 -0.97 0.00 0.00 0.00 179.25 176.80 3kcv h ASN 172 N -1.00 0.00 -0.31 0.00 -1.24 -1.40 -1.65 115.58 109.98 3kcv h ASN 172 Ca -0.07 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 56.94 3kcv h ASN 172 Cb 0.85 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.88 3kcv h ASN 172 CO -0.00 0.05 0.16 0.25 -1.29 0.00 0.00 177.43 176.60 3kcv h LEU 173 N 0.00 0.39 -0.19 0.34 6.46 -1.07 -1.42 115.31 119.82 3kcv h LEU 173 Ca -0.00 -0.10 -0.02 0.00 -0.12 0.00 0.00 57.88 57.64 3kcv h LEU 173 Cb 0.50 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 40.33 3kcv h LEU 173 CO 0.01 0.38 0.04 0.24 -0.62 0.00 0.00 178.44 178.48 3kcv h MET 174 N 0.38 0.31 -0.63 1.25 2.86 -1.15 -1.62 114.93 116.33 3kcv h MET 174 Ca 0.11 -0.08 0.12 0.00 -2.06 0.00 0.00 59.70 57.79 3kcv h MET 174 Cb 0.08 -0.04 -0.09 0.00 0.06 0.00 0.00 31.60 31.61 3kcv h MET 174 CO -0.02 0.45 0.12 0.28 1.06 0.00 0.00 176.91 178.80 3kcv h VAL 175 N 0.11 0.59 -0.09 -2.22 2.07 -1.21 0.10 116.25 115.60 3kcv h VAL 175 Ca 0.06 -0.08 -0.15 0.00 0.82 0.00 0.00 66.70 67.34 3kcv h VAL 175 Cb 0.29 0.33 0.01 0.00 -1.52 0.00 0.00 31.29 30.40 3kcv h VAL 175 CO 0.00 0.04 -0.54 0.00 0.02 0.00 0.00 177.57 177.09 3kcv h LEU 177 N 0.12 0.75 0.56 0.00 3.38 -0.99 0.16 115.31 119.29 3kcv h LEU 177 Ca -0.04 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 3kcv h LEU 177 Cb 1.19 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.87 3kcv h LEU 177 CO 0.11 0.34 -0.27 0.00 0.09 0.00 0.00 178.44 178.71 3kcv h ALA 178 N 1.60 -0.83 -0.41 1.53 0.00 -0.60 -0.56 119.26 119.98 3kcv h ALA 178 Ca 0.51 -0.16 0.12 0.00 0.00 0.00 0.00 54.91 55.37 3kcv h ALA 178 Cb 0.76 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 3kcv h ALA 178 CO -0.27 -0.78 0.35 0.28 0.00 0.00 0.00 179.25 178.83 3kcv h VAL 179 N -1.07 0.59 0.11 0.00 2.07 -1.06 -0.96 116.25 115.94 3kcv h VAL 179 Ca -0.08 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.27 3kcv h VAL 179 Cb 0.58 0.74 0.01 0.00 -1.52 0.00 0.00 31.29 31.10 3kcv h VAL 179 CO 0.13 0.00 -0.77 -0.25 0.02 0.00 0.00 177.57 176.70 3kcv h TRP 180 N 0.00 0.43 0.00 1.57 2.91 -0.59 -3.15 115.95 117.12 3kcv h TRP 180 Ca 0.20 -0.32 0.00 0.00 1.13 0.00 0.00 58.89 59.90 3kcv h TRP 180 Cb 0.89 -0.02 0.00 0.00 -0.51 0.00 0.00 29.16 29.53 3kcv h TRP 180 CO 0.00 1.30 0.00 0.52 -1.03 0.00 0.00 178.44 179.23 3kcv h MET 181 N -0.48 0.00 0.00 2.65 2.86 -0.47 -1.45 114.93 118.03 3kcv h MET 181 Ca -0.14 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.45 3kcv h MET 181 Cb 1.55 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.20 3kcv h MET 181 CO 0.11 0.00 -0.22 1.03 1.06 0.00 0.00 176.91 178.88 3kcv h SER 182 N 0.00 0.00 0.98 1.22 0.87 -1.15 -3.12 113.55 112.34 3kcv h SER 182 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3kcv h SER 182 Cb 0.07 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.03 3kcv h SER 182 CO 0.00 0.22 0.00 -1.22 -0.53 0.00 0.00 176.83 175.30 3kcv n TYR 183 N -3.38 0.69 -0.56 2.24 4.01 -0.55 -2.78 117.16 116.83 3kcv n TYR 183 Ca 0.00 0.24 0.10 0.00 -0.16 0.00 0.00 57.90 58.08 3kcv n TYR 183 Cb 0.43 -0.89 0.36 0.00 -0.31 0.00 0.00 39.34 38.93 3kcv n TYR 183 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3kcv n SER 184 N -2.10 4.62 -4.62 7.72 3.41 -1.18 -4.93 113.62 116.54 3kcv n SER 184 Ca 0.04 -2.34 -0.34 0.00 -0.26 0.00 0.00 58.87 55.97 3kcv n SER 184 Cb 0.30 -0.57 -0.10 0.00 -0.26 0.00 0.00 64.21 63.58 3kcv n SER 184 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3kcv s GLY 185 N -0.92 1.80 -0.19 5.00 0.00 -1.12 -5.02 107.32 106.88 3kcv s GLY 185 Ca 0.51 -0.81 -0.16 0.00 0.00 0.00 0.00 44.72 44.26 3kcv s GLY 185 CO 0.27 -0.40 -0.29 0.54 0.00 0.00 0.00 173.10 173.22 3kcv n ARG 186 N 2.62 0.52 -1.27 2.90 5.12 -1.26 -4.67 116.66 120.62 3kcv n ARG 186 Ca -0.18 0.30 -0.39 0.00 -1.93 0.00 0.00 57.85 55.66 3kcv n ARG 186 Cb 0.53 -1.51 0.02 0.00 -1.16 0.00 0.00 32.46 30.34 3kcv n ARG 186 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3kcv n SER 187 N -4.47 -3.30 -0.10 0.55 2.88 -1.26 -4.83 113.62 103.10 3kcv n SER 187 Ca -0.19 0.64 -0.10 0.00 -1.33 0.00 0.00 58.87 57.89 3kcv n SER 187 Cb 0.52 -0.91 -0.03 0.00 -0.75 0.00 0.00 64.21 63.04 3kcv n SER 187 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 3kcv h LEU 188 N -0.03 0.45 0.00 2.46 5.85 -1.99 -2.31 115.31 119.74 3kcv h LEU 188 Ca -0.42 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.05 3kcv h LEU 188 Cb 1.43 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.34 3kcv h LEU 188 CO 0.42 0.59 0.00 0.80 -0.34 0.00 0.00 178.44 179.90 3kcv n MET 189 N -4.66 0.00 -0.29 1.25 1.56 -1.26 -1.37 117.12 112.36 3kcv n MET 189 Ca -0.03 0.79 0.16 0.00 -0.27 0.00 0.00 57.70 58.36 3kcv n MET 189 Cb 0.20 -1.45 0.31 0.00 2.15 0.00 0.00 33.22 34.43 3kcv n MET 189 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 3kcv n ASP 190 N -2.51 -0.00 0.07 6.12 9.92 -1.20 -0.83 116.55 128.12 3kcv n ASP 190 Ca 0.00 1.42 -0.15 0.00 -0.53 0.00 0.00 54.79 55.54 3kcv n ASP 190 Cb 0.00 -0.56 -0.06 0.00 -0.64 0.00 0.00 41.12 39.85 3kcv n ASP 190 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 3kcv h LYS 191 N 0.00 0.43 0.00 -1.24 1.57 -1.05 -3.33 116.57 112.95 3kcv h LYS 191 Ca 0.56 -0.49 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 3kcv h LYS 191 Cb 1.26 0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.72 3kcv h LYS 191 CO -0.76 1.15 -0.41 0.00 -0.57 0.00 0.00 179.45 178.87 3kcv h ALA 192 N 0.67 0.01 0.00 3.86 0.00 0.28 -3.38 119.26 120.71 3kcv h ALA 192 Ca -0.09 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3kcv h ALA 192 Cb 1.64 0.39 0.00 0.00 0.00 0.00 0.00 17.79 19.82 3kcv h ALA 192 CO 0.17 0.38 0.05 1.19 0.00 0.00 0.00 179.25 181.05 3kcv n PHE 193 N -4.65 0.00 -0.02 0.00 0.99 -0.65 -1.87 117.46 111.26 3kcv n PHE 193 Ca -0.06 0.00 -0.16 0.00 -0.00 0.00 0.00 57.45 57.22 3kcv n PHE 193 Cb 0.22 -0.18 -0.14 0.00 -1.00 0.00 0.00 39.48 38.38 3kcv n PHE 193 CO 0.00 0.00 0.00 1.51 -0.00 0.00 0.00 176.76 178.27 3kcv n ILE 194 N -1.12 1.67 0.54 4.37 0.13 -1.25 -3.99 119.36 119.71 3kcv n ILE 194 Ca 0.00 -0.71 0.13 0.00 -1.10 0.00 0.00 62.75 61.07 3kcv n ILE 194 Cb 0.05 -1.39 0.41 0.00 -0.84 0.00 0.00 39.64 37.86 3kcv n ILE 194 CO 0.00 0.00 0.00 0.24 2.80 0.00 0.00 176.55 179.59 3kcv h MET 195 N 0.04 0.00 0.24 9.51 2.86 -1.56 -3.37 114.93 122.65 3kcv h MET 195 Ca -0.40 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.24 3kcv h MET 195 Cb 2.03 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.67 3kcv h MET 195 CO 0.06 0.00 -0.25 0.28 1.06 0.00 0.00 176.91 178.07 3kcv h VAL 196 N 0.00 0.47 0.02 -2.22 2.07 -1.68 -1.80 116.25 113.11 3kcv h VAL 196 Ca 0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 3kcv h VAL 196 Cb 0.68 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 3kcv h VAL 196 CO 0.00 0.00 -0.28 -0.07 0.02 0.00 0.00 177.57 177.24 3kcv h LEU 197 N -0.52 -0.83 -1.31 2.57 4.07 -1.80 0.50 115.31 117.99 3kcv h LEU 197 Ca -0.00 0.11 -0.06 0.00 0.08 0.00 0.00 57.88 58.01 3kcv h LEU 197 Cb 0.49 0.33 -0.01 0.00 1.08 0.00 0.00 40.66 42.55 3kcv h LEU 197 CO -0.06 -0.35 -0.12 -0.65 -1.08 0.00 0.00 178.44 176.18 3kcv h PRO 198 N -0.44 0.32 0.07 1.13 0.11 -1.74 -0.79 132.00 130.67 3kcv h PRO 198 Ca 0.06 -0.08 -0.12 0.00 0.11 0.00 0.00 66.00 65.97 3kcv h PRO 198 Cb 0.52 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 31.60 3kcv h PRO 198 CO -0.23 0.45 -0.52 0.28 -0.21 0.00 0.00 178.00 177.78 3kcv h VAL 199 N 0.31 1.58 -0.15 3.15 2.07 -1.16 -2.49 116.25 119.55 3kcv h VAL 199 Ca 0.06 -2.37 0.01 0.00 0.82 0.00 0.00 66.70 65.23 3kcv h VAL 199 Cb 0.40 3.13 -0.01 0.00 -1.52 0.00 0.00 31.29 33.30 3kcv h VAL 199 CO 0.02 0.66 0.10 0.00 0.02 0.00 0.00 177.57 178.37 3kcv h ALA 200 N 0.11 1.96 0.14 1.67 0.00 -0.82 -1.39 119.26 120.93 3kcv h ALA 200 Ca -0.09 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3kcv h ALA 200 Cb 1.37 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.12 3kcv h ALA 200 CO 0.10 0.03 -0.07 1.98 0.00 0.00 0.00 179.25 181.29 3kcv h MET 201 N 0.15 -0.18 0.00 0.00 -1.53 -1.12 0.21 114.93 112.45 3kcv h MET 201 Ca 0.06 0.01 -0.10 0.00 -3.44 0.00 0.00 59.70 56.23 3kcv h MET 201 Cb 0.06 0.04 -0.01 0.00 -0.55 0.00 0.00 31.60 31.13 3kcv h MET 201 CO -0.01 -0.03 -0.48 0.27 0.14 0.00 0.00 176.91 176.79 3kcv h PHE 202 N -0.29 0.00 0.14 1.39 -5.15 -0.91 -2.29 116.94 109.82 3kcv h PHE 202 Ca -0.02 0.00 -0.29 0.00 -0.20 0.00 0.00 57.97 57.46 3kcv h PHE 202 Cb 0.23 0.00 0.01 0.00 0.22 0.00 0.00 35.95 36.41 3kcv h PHE 202 CO -0.04 0.48 -1.33 0.28 -2.00 0.00 0.00 178.31 175.71 3kcv h VAL 203 N 0.00 1.41 0.00 0.88 2.07 -1.25 -0.76 116.25 118.60 3kcv h VAL 203 Ca -0.00 -2.97 0.00 0.00 0.82 0.00 0.00 66.70 64.54 3kcv h VAL 203 Cb 1.07 2.92 0.00 0.00 -1.52 0.00 0.00 31.29 33.76 3kcv h VAL 203 CO 0.06 0.87 0.00 0.00 0.02 0.00 0.00 177.57 178.52 3kcv n ALA 204 N -2.58 2.08 0.81 1.67 0.00 0.72 -2.96 120.51 120.25 3kcv n ALA 204 Ca -0.11 -0.07 0.08 0.00 0.00 0.00 0.00 53.44 53.35 3kcv n ALA 204 Cb 1.04 -1.39 -0.07 0.00 0.00 0.00 0.00 19.45 19.03 3kcv n ALA 204 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3kcv n SER 205 N -1.60 1.09 -0.21 0.00 7.64 -0.87 -4.74 113.62 114.92 3kcv n SER 205 Ca 0.06 -1.04 -0.03 0.00 1.01 0.00 0.00 58.87 58.87 3kcv n SER 205 Cb 0.29 0.85 -0.01 0.00 -1.01 0.00 0.00 64.21 64.33 3kcv n SER 205 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3kcv n GLY 206 N 1.36 0.57 3.77 0.23 0.00 -1.11 -5.00 105.19 105.01 3kcv n GLY 206 Ca 0.04 -0.95 -0.40 0.00 0.00 0.00 0.00 46.02 44.71 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 -2.10 3.02 -0.09 1.61 0.08 -0.31 -4.98 117.98 115.21 3kcv s PHE 207 Ca 0.00 1.42 -0.13 0.00 0.12 0.00 0.00 56.93 58.34 3kcv s PHE 207 Cb 0.00 -3.67 -0.05 0.00 -0.57 0.00 0.00 43.02 38.73 3kcv s PHE 207 CO 0.00 -1.88 0.31 -1.21 -0.10 0.00 0.00 175.22 172.34 3kcv s GLU 208 N -1.86 3.96 -0.16 0.44 0.41 -0.43 -4.71 118.70 116.36 3kcv s GLU 208 Ca 0.50 0.17 -0.00 0.00 -0.41 0.00 0.00 54.97 55.23 3kcv s GLU 208 Cb -0.39 -3.30 0.04 0.00 -1.78 0.00 0.00 34.13 28.69 3kcv s GLU 208 CO 0.52 0.51 -0.06 -1.58 -0.49 0.00 0.00 175.26 174.16 3kcv s HIS 209 N -0.40 1.73 0.28 1.61 5.65 -1.26 -3.98 115.29 118.92 3kcv s HIS 209 Ca 0.19 -1.06 0.02 0.00 0.25 0.00 0.00 55.06 54.46 3kcv s HIS 209 Cb -0.14 -1.33 0.64 0.00 -1.18 0.00 0.00 32.58 30.57 3kcv s HIS 209 CO 0.07 -0.61 1.75 0.66 -0.65 0.00 0.00 174.74 175.97 3kcv h SER 210 N 8.12 0.58 0.82 9.88 4.64 -1.94 -0.96 113.55 134.69 3kcv h SER 210 Ca -0.26 0.11 -0.22 0.00 -0.47 0.00 0.00 61.79 60.95 3kcv h SER 210 Cb 1.11 0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 63.20 3kcv h SER 210 CO 0.41 0.19 -1.01 0.40 -0.87 0.00 0.00 176.83 175.96 3kcv h ILE 211 N 0.63 1.62 -0.16 0.95 1.08 -1.96 -1.97 117.51 117.69 3kcv h ILE 211 Ca 0.52 -3.12 -0.07 0.00 -0.39 0.00 0.00 64.86 61.80 3kcv h ILE 211 Cb 0.82 2.76 -0.01 0.00 -3.07 0.00 0.00 36.82 37.31 3kcv h ILE 211 CO -0.40 0.90 -0.19 0.00 -0.69 0.00 0.00 178.15 177.77 3kcv h ALA 212 N 0.93 1.38 -0.13 1.87 0.00 -1.59 -2.69 119.26 119.02 3kcv h ALA 212 Ca -0.04 -0.26 -0.18 0.00 0.00 0.00 0.00 54.91 54.43 3kcv h ALA 212 Cb 1.72 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.41 3kcv h ALA 212 CO 0.14 0.43 -0.65 -0.91 0.00 0.00 0.00 179.25 178.26 3kcv h ASN 213 N 0.26 0.58 0.00 0.00 2.35 -1.08 -1.80 115.58 115.89 3kcv h ASN 213 Ca 0.05 -0.35 0.00 0.00 -0.55 0.00 0.00 56.30 55.45 3kcv h ASN 213 Cb 0.49 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.69 3kcv h ASN 213 CO 0.03 1.08 0.28 0.24 -1.65 0.00 0.00 177.43 177.42 3kcv h MET 214 N 0.37 0.00 0.00 0.81 2.86 -1.01 -1.72 114.93 116.24 3kcv h MET 214 Ca -0.02 0.00 -0.28 0.00 -2.06 0.00 0.00 59.70 57.35 3kcv h MET 214 Cb 1.22 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.84 3kcv h MET 214 CO 0.12 0.00 -1.91 0.34 1.06 0.00 0.00 176.91 176.52 3kcv n PHE 215 N -2.28 0.00 -0.06 -0.22 7.35 -1.10 -4.28 117.46 116.87 3kcv n PHE 215 Ca -0.01 0.00 -0.07 0.00 -0.76 0.00 0.00 57.45 56.60 3kcv n PHE 215 Cb 0.31 -0.78 -0.02 0.00 0.35 0.00 0.00 39.48 39.35 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 -0.97 -0.01 -0.01 -4.13 4.05 -0.84 -0.37 114.93 112.65 3kcv h MET 216 Ca -0.42 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 58.99 3kcv h MET 216 Cb 1.35 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.16 3kcv h MET 216 CO -0.26 -0.01 -0.02 0.82 0.23 0.00 0.00 176.91 177.68 3kcv h ILE 217 N -0.01 1.46 0.00 1.77 2.04 -1.60 -1.40 117.51 119.76 3kcv h ILE 217 Ca 0.13 -1.39 -0.03 0.00 1.00 0.00 0.00 64.86 64.57 3kcv h ILE 217 Cb 0.20 2.38 -0.00 0.00 -0.74 0.00 0.00 36.82 38.66 3kcv h ILE 217 CO -0.27 0.36 -0.14 -0.65 0.00 0.00 0.00 178.15 177.46 3kcv h PRO 218 N -0.54 0.00 -0.61 2.37 0.11 -1.70 -0.29 132.00 131.33 3kcv h PRO 218 Ca 0.00 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.04 3kcv h PRO 218 Cb 0.61 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.69 3kcv h PRO 218 CO 0.00 0.14 0.09 1.98 -0.21 0.00 0.00 178.00 180.01 3kcv h MET 219 N 0.00 1.02 -0.63 1.05 4.05 -0.98 -0.61 114.93 118.82 3kcv h MET 219 Ca -0.00 -0.28 -0.02 0.00 -0.28 0.00 0.00 59.70 59.12 3kcv h MET 219 Cb 0.24 -0.12 -0.03 0.00 -0.80 0.00 0.00 31.60 30.90 3kcv h MET 219 CO 0.02 0.95 0.32 0.78 0.23 0.00 0.00 176.91 179.21 3kcv h GLY 220 N 0.92 0.96 0.91 1.39 0.00 -0.22 -2.16 103.07 104.88 3kcv h GLY 220 Ca 0.18 -0.46 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 3kcv h GLY 220 CO 0.01 0.44 0.10 -2.22 0.00 0.00 0.00 176.54 174.87 3kcv h ILE 221 N 0.86 1.20 -0.36 2.60 2.04 -0.78 0.21 117.51 123.29 3kcv h ILE 221 Ca 0.22 -0.63 0.06 0.00 1.00 0.00 0.00 64.86 65.51 3kcv h ILE 221 Cb 0.09 1.04 -0.05 0.00 -0.74 0.00 0.00 36.82 37.16 3kcv h ILE 221 CO -0.03 0.21 0.04 0.58 0.00 0.00 0.00 178.15 178.95 3kcv h VAL 222 N 0.33 0.78 -0.29 1.67 2.07 -1.01 0.11 116.25 119.91 3kcv h VAL 222 Ca 0.10 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.55 3kcv h VAL 222 Cb 0.23 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 3kcv h VAL 222 CO -0.00 0.03 0.10 0.40 0.02 0.00 0.00 177.57 178.11 3kcv h ILE 223 N 0.15 1.19 -0.10 4.57 2.04 -1.24 -0.10 117.51 124.03 3kcv h ILE 223 Ca 0.17 -0.62 -0.06 0.00 1.00 0.00 0.00 64.86 65.36 3kcv h ILE 223 Cb 0.22 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 3kcv h ILE 223 CO -0.26 0.21 -0.21 -0.09 0.00 0.00 0.00 178.15 177.80 3kcv h ARG 224 N 0.32 0.16 0.00 2.37 2.43 -0.61 0.49 114.38 119.54 3kcv h ARG 224 Ca 0.10 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 3kcv h ARG 224 Cb 0.23 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 3kcv h ARG 224 CO -0.00 0.37 -1.01 -0.25 -1.51 0.00 0.00 179.97 177.57 3kcv n ASP 225 N -4.22 0.67 0.00 -3.80 9.92 0.36 -4.57 116.55 114.90 3kcv n ASP 225 Ca -0.01 -0.44 0.00 0.00 -0.53 0.00 0.00 54.79 53.80 3kcv n ASP 225 Cb 0.31 0.86 0.00 0.00 -0.64 0.00 0.00 41.12 41.66 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 -1.77 0.00 -1.77 1.24 3.72 -0.06 -5.05 117.46 113.76 3kcv n PHE 226 Ca 0.03 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.02 3kcv n PHE 226 Cb 0.40 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.94 3kcv n PHE 226 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3kcv n ALA 227 N -0.29 2.29 -1.76 4.37 0.00 0.15 -4.96 120.51 120.31 3kcv n ALA 227 Ca 0.00 0.31 -0.38 0.00 0.00 0.00 0.00 53.44 53.37 3kcv n ALA 227 Cb 0.02 -2.42 0.01 0.00 0.00 0.00 0.00 19.45 17.06 3kcv n ALA 227 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3kcv s SER 228 N -0.25 5.85 0.50 0.00 1.04 -1.26 -4.89 113.70 114.69 3kcv s SER 228 Ca 0.56 2.55 0.27 0.00 0.48 0.00 0.00 55.95 59.81 3kcv s SER 228 Cb -0.46 -2.62 1.36 0.00 0.10 0.00 0.00 66.02 64.40 3kcv s SER 228 CO 0.62 -1.16 1.89 -0.65 0.98 0.00 0.00 173.24 174.92 3kcv h PRO 229 N 1.94 0.11 -0.43 4.02 0.11 -1.99 0.20 132.00 135.95 3kcv h PRO 229 Ca -0.50 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.52 3kcv h PRO 229 Cb 1.27 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 3kcv h PRO 229 CO 0.59 0.07 -0.09 0.93 -0.21 0.00 0.00 178.00 179.29 3kcv h GLU 230 N 0.11 0.76 0.04 1.05 3.07 -1.98 -1.10 114.58 116.52 3kcv h GLU 230 Ca 0.42 -0.24 -0.00 0.00 -0.50 0.00 0.00 59.36 59.04 3kcv h GLU 230 Cb 1.49 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.33 3kcv h GLU 230 CO -0.06 0.83 -0.02 0.35 -1.40 0.00 0.00 179.01 178.72 3kcv h PHE 231 N 0.69 -0.05 -0.12 4.33 3.57 -0.98 0.31 116.94 124.70 3kcv h PHE 231 Ca 0.12 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.63 3kcv h PHE 231 Cb 0.56 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.31 3kcv h PHE 231 CO 0.03 0.15 0.08 -1.49 -2.23 0.00 0.00 178.31 174.85 3kcv h TRP 232 N -0.24 0.11 0.09 0.41 -0.00 -1.16 -0.12 115.95 115.04 3kcv h TRP 232 Ca -0.01 0.00 -0.26 0.00 -0.00 0.00 0.00 58.89 58.63 3kcv h TRP 232 Cb 0.22 -0.04 -0.00 0.00 -0.00 0.00 0.00 29.16 29.35 3kcv h TRP 232 CO -0.01 0.07 -1.16 1.15 -0.00 0.00 0.00 178.44 178.49 3kcv h THR 233 N 0.11 1.53 -0.12 1.49 2.02 -1.06 -1.12 112.91 115.76 3kcv h THR 233 Ca 0.05 -3.05 -0.16 0.00 0.77 0.00 0.00 66.41 64.02 3kcv h THR 233 Cb 0.06 2.86 -0.01 0.00 -1.74 0.00 0.00 68.15 69.32 3kcv h THR 233 CO -0.01 0.89 -0.62 0.00 0.37 0.00 0.00 175.52 176.15 3kcv h ALA 234 N 0.68 0.71 0.02 6.16 0.00 0.83 -3.28 119.26 124.38 3kcv h ALA 234 Ca -0.11 -0.55 -0.30 0.00 0.00 0.00 0.00 54.91 53.95 3kcv h ALA 234 Cb 1.88 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 19.55 3kcv h ALA 234 CO 0.19 0.72 -1.77 1.33 0.00 0.00 0.00 179.25 179.71 3kcv n VAL 235 N -3.90 1.63 -0.84 0.00 0.24 -0.49 -4.88 118.33 110.08 3kcv n VAL 235 Ca -0.03 -0.78 0.00 0.00 -2.04 0.00 0.00 64.34 61.49 3kcv n VAL 235 Cb 0.64 -1.13 0.00 0.00 -1.47 0.00 0.00 33.84 31.87 3kcv n VAL 235 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3kcv n GLY 236 N 1.63 0.80 2.01 7.63 0.00 -0.57 -5.09 105.19 111.59 3kcv n GLY 236 Ca -0.20 -0.47 -0.07 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.71 -1.04 -4.01 1.61 2.88 -0.53 -5.04 113.62 106.78 3kcv n SER 237 Ca 0.00 -1.98 -0.09 0.00 -1.33 0.00 0.00 58.87 55.47 3kcv n SER 237 Cb 0.26 1.81 -0.11 0.00 -0.75 0.00 0.00 64.21 65.42 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 -1.91 0.24 0.40 -1.46 0.00 -1.26 -4.65 121.76 113.12 3kcv s ALA 238 Ca 0.12 -0.72 0.14 0.00 0.00 0.00 0.00 51.96 51.51 3kcv s ALA 238 Cb -0.02 0.16 0.98 0.00 0.00 0.00 0.00 23.12 24.24 3kcv s ALA 238 CO 0.09 -0.18 1.87 -1.35 0.00 0.00 0.00 175.76 176.19 3kcv h PRO 239 N 4.37 0.50 -1.09 0.00 0.11 -1.96 0.40 132.00 134.33 3kcv h PRO 239 Ca -0.33 -0.03 0.32 0.00 0.11 0.00 0.00 66.00 66.07 3kcv h PRO 239 Cb 1.20 -0.11 -0.12 0.00 0.11 0.00 0.00 31.00 32.07 3kcv h PRO 239 CO 0.45 0.33 0.67 0.93 -0.21 0.00 0.00 178.00 180.17 3kcv h GLU 240 N 0.51 0.32 -0.39 1.05 3.07 -1.95 -0.83 114.58 116.36 3kcv h GLU 240 Ca 0.44 -0.02 -0.13 0.00 -0.50 0.00 0.00 59.36 59.15 3kcv h GLU 240 Cb 0.93 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.76 3kcv h GLU 240 CO -0.18 0.21 -0.28 -0.91 -1.40 0.00 0.00 179.01 176.45 3kcv h ASN 241 N 0.33 0.85 -1.28 1.42 2.35 -1.32 -3.13 115.58 114.80 3kcv h ASN 241 Ca 0.69 -0.34 -0.70 0.00 -0.55 0.00 0.00 56.30 55.41 3kcv h ASN 241 Cb 1.76 -0.23 -0.28 0.00 0.05 0.00 0.00 38.32 39.61 3kcv h ASN 241 CO -0.44 1.07 0.92 0.49 -1.65 0.00 0.00 177.43 177.83 3kcv n PHE 242 N -4.09 3.13 0.03 1.19 3.72 -0.33 -4.73 117.46 116.39 3kcv n PHE 242 Ca -0.01 -2.82 0.02 0.00 -0.05 0.00 0.00 57.45 54.59 3kcv n PHE 242 Cb 0.47 -1.38 0.09 0.00 -0.94 0.00 0.00 39.48 37.73 3kcv n PHE 242 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3kcv n SER 243 N -0.79 0.08 0.02 4.37 3.41 -1.17 -1.98 113.62 117.57 3kcv n SER 243 Ca 0.60 0.49 0.13 0.00 -0.26 0.00 0.00 58.87 59.83 3kcv n SER 243 Cb 0.54 -0.50 0.36 0.00 -0.26 0.00 0.00 64.21 64.35 3kcv n SER 243 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3kcv n HIS 244 N -1.58 0.17 -1.28 7.33 8.25 -1.26 -4.43 115.22 122.42 3kcv n HIS 244 Ca -0.00 0.05 -0.36 0.00 -0.26 0.00 0.00 57.72 57.15 3kcv n HIS 244 Cb 0.06 -0.45 -0.05 0.00 1.12 0.00 0.00 29.99 30.67 3kcv n HIS 244 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3kcv n LEU 245 N -1.66 8.37 -4.94 2.41 4.77 -0.84 -4.76 117.00 120.35 3kcv n LEU 245 Ca 0.06 -4.24 -0.24 0.00 -0.03 0.00 0.00 56.01 51.56 3kcv n LEU 245 Cb 0.36 -1.54 -0.02 0.00 -2.33 0.00 0.00 43.42 39.89 3kcv n LEU 245 CO 0.32 2.04 0.09 0.42 -1.33 0.00 0.00 177.39 178.93 3kcv s THR 246 N 1.98 5.16 0.03 -5.08 -4.23 -1.26 -4.74 115.64 107.50 3kcv s THR 246 Ca 0.69 -0.55 -0.22 0.00 -1.18 0.00 0.00 61.69 60.44 3kcv s THR 246 Cb 0.20 -3.83 -0.16 0.00 1.34 0.00 0.00 72.50 70.05 3kcv s THR 246 CO -0.05 -0.41 1.35 0.58 -0.54 0.00 0.00 174.62 175.55 3kcv h VAL 247 N 1.05 1.34 -0.48 2.29 2.07 -2.00 -1.26 116.25 119.26 3kcv h VAL 247 Ca -0.50 -1.18 0.13 0.00 0.82 0.00 0.00 66.70 65.98 3kcv h VAL 247 Cb 1.21 1.88 -0.02 0.00 -1.52 0.00 0.00 31.29 32.85 3kcv h VAL 247 CO 0.63 0.34 0.35 -0.03 0.02 0.00 0.00 177.57 178.87 3kcv h MET 248 N -0.13 0.04 0.38 1.57 1.85 -1.98 -1.42 114.93 115.24 3kcv h MET 248 Ca 0.02 -0.00 -0.02 0.00 -0.61 0.00 0.00 59.70 59.09 3kcv h MET 248 Cb 0.57 -0.01 0.00 0.00 0.43 0.00 0.00 31.60 32.59 3kcv h MET 248 CO 0.02 0.03 -0.18 -0.91 -0.40 0.00 0.00 176.91 175.46 3kcv h ASN 249 N 0.04 -0.43 -0.92 1.39 4.21 -1.82 -0.84 115.58 117.21 3kcv h ASN 249 Ca 0.23 -0.13 0.12 0.00 1.21 0.00 0.00 56.30 57.74 3kcv h ASN 249 Cb 0.87 0.11 -0.14 0.00 -1.12 0.00 0.00 38.32 38.04 3kcv h ASN 249 CO -0.01 -0.01 -0.42 0.33 -1.29 0.00 0.00 177.43 176.03 3kcv n PHE 250 N -5.14 -0.11 0.32 1.19 7.35 -0.50 -0.36 117.46 120.21 3kcv n PHE 250 Ca -0.09 1.14 -0.13 0.00 -0.76 0.00 0.00 57.45 57.60 3kcv n PHE 250 Cb 0.27 -0.76 -0.06 0.00 0.35 0.00 0.00 39.48 39.28 3kcv n PHE 250 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 3kcv h ILE 251 N 0.00 0.00 0.00 -2.13 2.04 -1.33 -0.03 117.51 116.06 3kcv h ILE 251 Ca 0.26 -0.32 -0.10 0.00 1.00 0.00 0.00 64.86 65.70 3kcv h ILE 251 Cb 0.49 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 3kcv h ILE 251 CO -0.90 0.00 -0.46 0.71 0.00 0.00 0.00 178.15 177.51 3kcv h THR 252 N -1.19 1.18 0.00 -0.27 1.35 -1.00 -1.05 112.91 111.94 3kcv h THR 252 Ca -0.09 -1.65 0.00 0.00 -0.55 0.00 0.00 66.41 64.12 3kcv h THR 252 Cb 0.66 1.93 0.00 0.00 -1.73 0.00 0.00 68.15 69.01 3kcv h THR 252 CO 0.14 0.45 -1.65 0.47 -0.25 0.00 0.00 175.52 174.68 3kcv n ASP 253 N -3.78 0.41 0.09 5.36 10.43 0.52 -4.63 116.55 124.94 3kcv n ASP 253 Ca -0.01 -0.31 0.00 0.00 2.57 0.00 0.00 54.79 57.04 3kcv n ASP 253 Cb 0.51 1.66 0.00 0.00 1.84 0.00 0.00 41.12 45.14 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 -2.00 0.50 -0.21 -2.24 4.05 -0.91 -4.58 115.26 109.88 3kcv n ASN 254 Ca -0.01 0.29 0.01 0.00 0.45 0.00 0.00 54.58 55.31 3kcv n ASN 254 Cb 0.48 0.01 0.12 0.00 1.23 0.00 0.00 39.78 41.61 3kcv n ASN 254 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 3kcv h LEU 255 N 0.00 0.14 0.16 1.20 5.85 -0.73 0.91 115.31 122.85 3kcv h LEU 255 Ca 0.00 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 3kcv h LEU 255 Cb 0.00 0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.13 3kcv h LEU 255 CO 0.00 0.08 -0.08 0.40 -0.34 0.00 0.00 178.44 178.50 3kcv h ILE 256 N 0.35 0.96 -0.63 4.05 2.04 -1.45 -0.37 117.51 122.46 3kcv h ILE 256 Ca 0.32 -0.87 -0.02 0.00 1.00 0.00 0.00 64.86 65.29 3kcv h ILE 256 Cb 0.44 1.47 -0.03 0.00 -0.74 0.00 0.00 36.82 37.96 3kcv h ILE 256 CO -0.36 0.19 0.31 -0.65 0.00 0.00 0.00 178.15 177.65 3kcv h PRO 257 N -0.67 0.90 -0.16 2.37 0.11 -1.77 -1.86 132.00 130.93 3kcv h PRO 257 Ca -0.02 -0.13 -0.14 0.00 0.11 0.00 0.00 66.00 65.82 3kcv h PRO 257 Cb 0.49 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.42 3kcv h PRO 257 CO 0.04 0.72 -0.48 -0.24 -0.21 0.00 0.00 178.00 177.83 3kcv h VAL 258 N 0.87 1.32 -0.15 3.15 3.04 -0.84 -1.07 116.25 122.57 3kcv h VAL 258 Ca 0.22 -1.69 -0.02 0.00 -1.01 0.00 0.00 66.70 64.20 3kcv h VAL 258 Cb 0.11 1.72 -0.01 0.00 -2.01 0.00 0.00 31.29 31.10 3kcv h VAL 258 CO -0.03 0.52 0.03 0.74 -1.01 0.00 0.00 177.57 177.82 3kcv h THR 259 N 0.34 1.21 -0.57 3.17 2.02 -0.92 0.10 112.91 118.26 3kcv h THR 259 Ca 0.02 -0.68 0.11 0.00 0.77 0.00 0.00 66.41 66.63 3kcv h THR 259 Cb 0.96 1.39 -0.08 0.00 -1.74 0.00 0.00 68.15 68.68 3kcv h THR 259 CO 0.08 0.20 0.10 0.40 0.37 0.00 0.00 175.52 176.67 3kcv h ILE 260 N 0.03 0.64 -0.62 3.11 2.04 -1.08 -1.03 117.51 120.59 3kcv h ILE 260 Ca 0.04 -0.08 -0.03 0.00 1.00 0.00 0.00 64.86 65.80 3kcv h ILE 260 Cb 0.29 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 36.73 3kcv h ILE 260 CO 0.00 0.04 0.29 1.23 0.00 0.00 0.00 178.15 179.71 3kcv h GLY 261 N 0.22 0.97 0.84 5.37 0.00 -0.87 -0.70 103.07 108.89 3kcv h GLY 261 Ca 0.30 -0.49 0.07 0.00 0.00 0.00 0.00 47.33 47.20 3kcv h GLY 261 CO -0.40 0.46 0.59 3.43 0.00 0.00 0.00 176.54 180.63 3kcv h ASN 262 N 0.86 0.91 0.38 0.19 -0.26 0.11 0.86 115.58 118.63 3kcv h ASN 262 Ca 0.21 0.01 -0.18 0.00 -0.56 0.00 0.00 56.30 55.78 3kcv h ASN 262 Cb 0.13 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.20 3kcv h ASN 262 CO -0.03 0.58 -0.76 0.40 -1.06 0.00 0.00 177.43 176.57 3kcv h ILE 263 N 1.04 1.41 -0.17 2.81 2.04 -0.67 -1.04 117.51 122.93 3kcv h ILE 263 Ca 0.39 -2.26 -0.01 0.00 1.00 0.00 0.00 64.86 63.98 3kcv h ILE 263 Cb 0.21 2.21 -0.01 0.00 -0.74 0.00 0.00 36.82 38.48 3kcv h ILE 263 CO -0.15 0.67 0.04 0.40 0.00 0.00 0.00 178.15 179.11 3kcv h ILE 264 N 0.20 1.09 0.00 -0.67 2.04 -0.51 0.12 117.51 119.78 3kcv h ILE 264 Ca -0.03 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.54 3kcv h ILE 264 Cb 1.33 0.91 0.00 0.00 -0.74 0.00 0.00 36.82 38.33 3kcv h ILE 264 CO 0.12 0.10 0.00 0.61 0.00 0.00 0.00 178.15 178.99 3kcv n GLY 265 N -1.32 -1.18 0.17 5.37 0.00 0.24 -0.92 105.19 107.55 3kcv n GLY 265 Ca -0.00 -0.13 -0.27 0.00 0.00 0.00 0.00 46.02 45.62 3kcv n GLY 265 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kcv n GLY 266 N 1.00 -0.42 0.37 -0.02 0.00 -0.69 -4.35 105.19 101.07 3kcv n GLY 266 Ca 0.13 -0.14 0.19 0.00 0.00 0.00 0.00 46.02 46.20 3kcv n GLY 266 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3kcv h GLY 267 N -0.55 0.00 0.82 -0.02 0.00 -0.84 -0.23 103.07 102.26 3kcv h GLY 267 Ca -0.66 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.65 3kcv h GLY 267 CO -0.36 0.00 -0.20 -2.00 0.00 0.00 0.00 176.54 173.97 3kcv h LEU 268 N 0.00 -0.48 -1.52 3.11 6.46 -1.25 0.54 115.31 122.16 3kcv h LEU 268 Ca 0.18 -0.07 -0.04 0.00 -0.12 0.00 0.00 57.88 57.83 3kcv h LEU 268 Cb 0.84 0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.89 3kcv h LEU 268 CO -0.00 -0.21 -0.14 -0.07 -0.62 0.00 0.00 178.44 177.40 3kcv h LEU 269 N -0.75 0.12 -0.09 2.25 -0.00 -1.61 -1.10 115.31 114.14 3kcv h LEU 269 Ca -0.06 -0.02 0.03 0.00 -0.00 0.00 0.00 57.88 57.83 3kcv h LEU 269 Cb 0.53 -0.03 -0.06 0.00 -0.00 0.00 0.00 40.66 41.09 3kcv h LEU 269 CO 0.10 0.28 -0.53 0.58 -0.00 0.00 0.00 178.44 178.87 3kcv h VAL 270 N 0.13 0.00 -0.99 1.22 2.07 -1.00 0.18 116.25 117.85 3kcv h VAL 270 Ca 0.03 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.69 3kcv h VAL 270 Cb 0.33 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 29.95 3kcv h VAL 270 CO 0.02 0.00 -0.42 0.61 0.02 0.00 0.00 177.57 177.80 3kcv n GLY 271 N -1.43 -2.13 0.36 2.17 0.00 0.17 -0.94 105.19 103.38 3kcv n GLY 271 Ca -0.06 1.12 -0.15 0.00 0.00 0.00 0.00 46.02 46.93 3kcv n GLY 271 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3kcv h LEU 272 N 0.00 -0.88 -0.25 0.99 4.07 -0.81 -2.31 115.31 116.12 3kcv h LEU 272 Ca 0.31 0.08 0.06 0.00 0.08 0.00 0.00 57.88 58.41 3kcv h LEU 272 Cb 0.56 0.29 -0.07 0.00 1.08 0.00 0.00 40.66 42.53 3kcv h LEU 272 CO -0.98 -0.47 -0.25 0.74 -1.08 0.00 0.00 178.44 176.41 3kcv h THR 273 N -0.70 0.38 -0.37 0.22 2.02 0.13 -1.62 112.91 112.98 3kcv h THR 273 Ca -0.02 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.21 3kcv h THR 273 Cb 0.63 0.38 -0.08 0.00 -1.74 0.00 0.00 68.15 67.33 3kcv h THR 273 CO -0.05 0.00 -0.52 0.22 0.37 0.00 0.00 175.52 175.54 3kcv h TYR 274 N -0.25 -1.56 0.04 3.16 3.20 -0.72 -0.74 116.97 120.11 3kcv h TYR 274 Ca 0.14 0.08 -0.00 0.00 3.14 0.00 0.00 58.73 62.09 3kcv h TYR 274 Cb 0.46 0.73 -0.00 0.00 1.54 0.00 0.00 36.73 39.46 3kcv h TYR 274 CO -0.40 -0.49 -0.06 -1.49 -1.64 0.00 0.00 178.16 174.08 3kcv h TRP 275 N -0.40 -0.18 0.01 -3.82 4.06 -0.92 -0.77 115.95 113.93 3kcv h TRP 275 Ca 0.09 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 61.04 3kcv h TRP 275 Cb 0.61 0.07 0.00 0.00 -1.00 0.00 0.00 29.16 28.84 3kcv h TRP 275 CO -0.68 -0.08 -0.01 0.28 -3.56 0.00 0.00 178.44 174.40 3kcv h VAL 276 N -0.11 1.11 -0.55 1.49 2.07 -1.21 0.28 116.25 119.33 3kcv h VAL 276 Ca -0.00 -0.38 -0.05 0.00 0.82 0.00 0.00 66.70 67.08 3kcv h VAL 276 Cb 0.10 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 3kcv h VAL 276 CO -0.02 0.10 0.06 -0.38 0.02 0.00 0.00 177.57 177.35 3kcv n ILE 277 N -5.02 2.73 -0.08 4.57 5.41 -0.29 -3.01 119.36 123.66 3kcv n ILE 277 Ca -0.08 -1.58 -0.14 0.00 1.00 0.00 0.00 62.75 61.95 3kcv n ILE 277 Cb 0.11 -0.29 -0.07 0.00 -0.71 0.00 0.00 39.64 38.68 3kcv n ILE 277 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3kcv n TYR 278 N 0.20 0.00 0.15 1.39 9.36 -0.29 -4.91 117.16 123.06 3kcv n TYR 278 Ca 0.30 0.00 -0.10 0.00 3.32 0.00 0.00 57.90 61.42 3kcv n TYR 278 Cb 1.19 -0.60 -0.05 0.00 -0.63 0.00 0.00 39.34 39.25 3kcv n TYR 278 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 3kcv h LEU 279 N -0.29 -0.78 0.00 2.98 3.38 -0.93 -3.51 115.31 116.16 3kcv h LEU 279 Ca -0.38 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.65 3kcv h LEU 279 Cb 1.46 0.26 0.00 0.00 0.09 0.00 0.00 40.66 42.47 3kcv h LEU 279 CO -0.15 -0.36 0.00 -2.11 0.09 0.00 0.00 178.44 175.90