#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kcv h PRO 31 N 0.00 0.22 0.15 1.57 0.11 -2.05 -1.07 132.00 130.93 3kcv h PRO 31 Ca 0.00 -0.01 -0.29 0.00 0.11 0.00 0.00 66.00 65.81 3kcv h PRO 31 Cb 0.00 -0.05 0.01 0.00 0.11 0.00 0.00 31.00 31.07 3kcv h PRO 31 CO 0.00 0.14 -1.31 -0.07 -0.21 0.00 0.00 178.00 176.56 3kcv h LEU 32 N 0.22 0.51 -0.61 2.35 4.07 -2.04 -1.08 115.31 118.73 3kcv h LEU 32 Ca 0.68 -0.55 -0.02 0.00 0.08 0.00 0.00 57.88 58.07 3kcv h LEU 32 Cb 2.04 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 43.59 3kcv h LEU 32 CO -0.29 1.43 0.32 0.50 -1.08 0.00 0.00 178.44 179.32 3kcv h LYS 33 N 0.09 0.86 -0.34 1.13 3.64 -1.73 -1.57 116.57 118.65 3kcv h LYS 33 Ca -0.16 -0.11 -0.09 0.00 -1.27 0.00 0.00 60.65 59.02 3kcv h LYS 33 Cb 2.01 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 33.66 3kcv h LYS 33 CO 0.22 0.67 -0.16 1.15 -2.27 0.00 0.00 179.45 179.06 3kcv h THR 34 N 0.83 1.25 -0.49 1.00 2.02 -1.25 -0.86 112.91 115.41 3kcv h THR 34 Ca 0.21 -1.16 -0.09 0.00 0.77 0.00 0.00 66.41 66.14 3kcv h THR 34 Cb 0.07 1.16 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 3kcv h THR 34 CO -0.03 0.39 -0.06 0.15 0.37 0.00 0.00 175.52 176.34 3kcv h PHE 35 N 0.56 0.93 -0.76 3.16 3.57 -1.09 0.14 116.94 123.45 3kcv h PHE 35 Ca 0.09 -0.16 -0.03 0.00 3.53 0.00 0.00 57.97 61.41 3kcv h PHE 35 Cb 0.59 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 3kcv h PHE 35 CO 0.02 0.88 0.37 1.88 -2.23 0.00 0.00 178.31 179.23 3kcv h TYR 36 N 0.78 1.09 -0.27 0.41 0.05 -0.93 0.22 116.97 118.33 3kcv h TYR 36 Ca 0.14 -0.05 -0.13 0.00 0.05 0.00 0.00 58.73 58.73 3kcv h TYR 36 Cb 0.55 -0.34 -0.01 0.00 1.01 0.00 0.00 36.73 37.94 3kcv h TYR 36 CO 0.03 0.80 -0.39 -0.07 -1.05 0.00 0.00 178.16 177.48 3kcv h LEU 37 N 1.07 0.66 -0.42 3.88 3.38 -0.67 -0.52 115.31 122.69 3kcv h LEU 37 Ca 0.26 -0.29 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 3kcv h LEU 37 Cb 0.11 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3kcv h LEU 37 CO -0.03 0.98 -0.16 0.00 0.09 0.00 0.00 178.44 179.31 3kcv h ALA 38 N 1.05 0.59 -0.91 1.53 0.00 -0.62 -1.11 119.26 119.79 3kcv h ALA 38 Ca 0.05 -0.36 0.07 0.00 0.00 0.00 0.00 54.91 54.67 3kcv h ALA 38 Cb 0.90 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.48 3kcv h ALA 38 CO 0.08 0.52 0.59 0.82 0.00 0.00 0.00 179.25 181.26 3kcv h ILE 39 N 0.68 1.04 -0.49 0.00 2.04 -0.77 -1.22 117.51 118.79 3kcv h ILE 39 Ca 0.10 -0.35 -0.04 0.00 1.00 0.00 0.00 64.86 65.57 3kcv h ILE 39 Cb 0.72 -0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 3kcv h ILE 39 CO 0.05 0.18 0.14 0.74 0.00 0.00 0.00 178.15 179.27 3kcv h THR 40 N 1.01 1.23 -0.44 -0.27 2.02 -0.48 -1.66 112.91 114.31 3kcv h THR 40 Ca 0.40 -0.79 -0.07 0.00 0.77 0.00 0.00 66.41 66.73 3kcv h THR 40 Cb 0.25 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 3kcv h THR 40 CO -0.16 0.29 0.01 0.00 0.37 0.00 0.00 175.52 176.02 3kcv h ALA 41 N 1.00 1.18 -0.43 6.16 0.00 -0.74 0.15 119.26 126.58 3kcv h ALA 41 Ca 0.16 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3kcv h ALA 41 Cb 0.29 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3kcv h ALA 41 CO -0.00 0.54 0.23 0.78 0.00 0.00 0.00 179.25 180.80 3kcv h GLY 42 N 0.95 0.64 0.85 0.00 0.00 -0.82 0.19 103.07 104.88 3kcv h GLY 42 Ca 0.14 -0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.15 3kcv h GLY 42 CO 0.02 0.28 0.04 -2.08 0.00 0.00 0.00 176.54 174.79 3kcv h VAL 43 N 0.55 1.22 -0.46 4.60 2.07 -1.07 -2.25 116.25 120.91 3kcv h VAL 43 Ca 0.15 -0.72 0.09 0.00 0.82 0.00 0.00 66.70 67.05 3kcv h VAL 43 Cb 0.05 1.28 -0.09 0.00 -1.52 0.00 0.00 31.29 31.01 3kcv h VAL 43 CO -0.02 0.22 -0.14 -0.26 0.02 0.00 0.00 177.57 177.39 3kcv h PHE 44 N 0.16 -0.31 -0.00 1.57 0.04 -0.39 -0.20 116.94 117.81 3kcv h PHE 44 Ca 0.07 0.04 -0.11 0.00 2.80 0.00 0.00 57.97 60.77 3kcv h PHE 44 Cb 0.30 0.21 -0.02 0.00 2.20 0.00 0.00 35.95 38.64 3kcv h PHE 44 CO 0.02 -0.22 -0.52 0.82 -0.60 0.00 0.00 178.31 177.80 3kcv h ILE 45 N -0.03 1.37 -0.29 -0.55 5.03 -0.58 -1.77 117.51 120.70 3kcv h ILE 45 Ca 0.22 -1.78 -0.01 0.00 -0.12 0.00 0.00 64.86 63.16 3kcv h ILE 45 Cb 0.37 1.96 -0.01 0.00 -3.03 0.00 0.00 36.82 36.10 3kcv h ILE 45 CO -0.49 0.51 0.13 0.28 -0.68 0.00 0.00 178.15 177.90 3kcv h SER 46 N 0.00 0.39 -0.74 1.72 0.02 -0.89 -2.10 113.55 111.95 3kcv h SER 46 Ca -0.01 -0.15 0.07 0.00 -0.84 0.00 0.00 61.79 60.87 3kcv h SER 46 Cb 0.92 -0.10 -0.06 0.00 0.14 0.00 0.00 62.40 63.30 3kcv h SER 46 CO 0.07 0.43 0.41 0.40 -1.14 0.00 0.00 176.83 177.00 3kcv h ILE 47 N 0.33 0.94 -0.35 3.27 2.04 -0.83 0.52 117.51 123.42 3kcv h ILE 47 Ca 0.10 -0.25 0.07 0.00 1.00 0.00 0.00 64.86 65.78 3kcv h ILE 47 Cb 0.15 0.14 -0.06 0.00 -0.74 0.00 0.00 36.82 36.31 3kcv h ILE 47 CO -0.01 0.13 -0.06 0.00 0.00 0.00 0.00 178.15 178.21 3kcv h ALA 48 N 1.40 0.26 -0.07 1.87 0.00 -1.09 -1.57 119.26 120.06 3kcv h ALA 48 Ca 0.34 0.13 -0.11 0.00 0.00 0.00 0.00 54.91 55.27 3kcv h ALA 48 Cb 0.26 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 3kcv h ALA 48 CO -0.21 -0.44 -0.46 0.35 0.00 0.00 0.00 179.25 178.48 3kcv h PHE 49 N 0.03 0.19 -0.50 0.00 3.04 -0.66 -2.01 116.94 117.02 3kcv h PHE 49 Ca 0.17 -0.06 -0.06 0.00 3.98 0.00 0.00 57.97 62.01 3kcv h PHE 49 Cb 0.26 -0.04 -0.02 0.00 2.56 0.00 0.00 35.95 38.71 3kcv h PHE 49 CO -0.30 0.59 0.08 0.28 -2.02 0.00 0.00 178.31 176.95 3kcv h VAL 50 N 0.13 1.25 -0.30 1.41 2.07 -0.55 -1.07 116.25 119.19 3kcv h VAL 50 Ca 0.01 -0.93 -0.03 0.00 0.82 0.00 0.00 66.70 66.57 3kcv h VAL 50 Cb 0.87 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 3kcv h VAL 50 CO 0.07 0.33 0.04 0.15 0.02 0.00 0.00 177.57 178.18 3kcv h PHE 51 N 0.71 0.44 -0.14 1.57 3.57 -1.01 0.21 116.94 122.29 3kcv h PHE 51 Ca 0.15 -0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.50 3kcv h PHE 51 Cb 0.39 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.00 3kcv h PHE 51 CO 0.03 0.41 -0.41 -0.92 -2.23 0.00 0.00 178.31 175.19 3kcv h TYR 52 N 0.43 0.69 -0.26 0.41 3.20 -1.14 0.48 116.97 120.79 3kcv h TYR 52 Ca 0.10 -0.27 0.01 0.00 3.14 0.00 0.00 58.73 61.71 3kcv h TYR 52 Cb 0.22 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 3kcv h TYR 52 CO 0.01 1.03 0.13 0.82 -1.64 0.00 0.00 178.16 178.51 3kcv h ILE 53 N 0.16 1.01 -0.28 1.81 1.08 -0.98 -1.81 117.51 118.49 3kcv h ILE 53 Ca -0.01 -0.10 -0.01 0.00 -0.39 0.00 0.00 64.86 64.36 3kcv h ILE 53 Cb 1.03 0.70 -0.01 0.00 -3.07 0.00 0.00 36.82 35.46 3kcv h ILE 53 CO 0.09 0.05 0.15 0.74 -0.69 0.00 0.00 178.15 178.49 3kcv h THR 54 N 0.28 1.14 -0.23 -0.27 2.02 -0.93 -1.61 112.91 113.31 3kcv h THR 54 Ca 0.10 -0.37 -0.04 0.00 0.77 0.00 0.00 66.41 66.87 3kcv h THR 54 Cb 0.02 0.86 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 3kcv h THR 54 CO -0.06 0.14 -0.04 0.00 0.37 0.00 0.00 175.52 175.93 3kcv h ALA 55 N 1.02 1.51 -0.62 6.16 0.00 -0.82 -3.03 119.26 123.47 3kcv h ALA 55 Ca 0.10 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3kcv h ALA 55 Cb 0.09 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3kcv h ALA 55 CO -0.01 0.35 0.00 0.25 0.00 0.00 0.00 179.25 179.84 3kcv n THR 56 N -4.31 1.32 -2.43 0.00 -2.24 -0.69 -4.84 114.28 101.09 3kcv n THR 56 Ca 0.00 -1.10 -0.43 0.00 -2.27 0.00 0.00 64.05 60.26 3kcv n THR 56 Cb 0.23 0.35 -0.02 0.00 -2.10 0.00 0.00 70.33 68.79 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 -1.34 4.16 0.00 4.28 2.01 -0.62 -4.11 115.64 120.03 3kcv s THR 57 Ca 0.45 1.32 0.00 0.00 0.31 0.00 0.00 61.69 63.77 3kcv s THR 57 Cb 0.26 -4.16 0.00 0.00 0.01 0.00 0.00 72.50 68.61 3kcv s THR 57 CO 0.27 -0.46 0.00 0.61 -0.69 0.00 0.00 174.62 174.34 3kcv n GLY 58 N 4.27 0.68 2.26 4.40 0.00 -1.26 -5.05 105.19 110.50 3kcv n GLY 58 Ca 0.15 -0.38 -0.22 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.23 0.05 -0.08 2.61 -2.24 -1.26 -4.79 114.28 108.34 3kcv n THR 59 Ca 0.00 -4.44 -0.13 0.00 -2.27 0.00 0.00 64.05 57.21 3kcv n THR 59 Cb 0.09 -1.32 -0.14 0.00 -2.10 0.00 0.00 70.33 66.86 3kcv n THR 59 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kcv n GLY 60 N 0.83 -0.81 0.29 3.38 0.00 -1.26 -4.20 105.19 103.43 3kcv n GLY 60 Ca 0.24 -0.23 0.18 0.00 0.00 0.00 0.00 46.02 46.22 3kcv n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kcv h THR 61 N 0.01 0.05 -2.92 2.61 1.03 -2.05 -3.44 112.91 108.20 3kcv h THR 61 Ca -0.48 -0.40 -0.62 0.00 -0.01 0.00 0.00 66.41 64.90 3kcv h THR 61 Cb 2.09 1.38 -0.06 0.00 -1.07 0.00 0.00 68.15 70.50 3kcv h THR 61 CO 0.02 0.01 -0.31 -0.04 -0.01 0.00 0.00 175.52 175.19 3kcv s MET 62 N -3.82 3.70 0.18 0.00 1.00 -1.26 -5.06 119.30 114.05 3kcv s MET 62 Ca -0.01 0.14 -0.32 0.00 0.00 0.00 0.00 55.69 55.50 3kcv s MET 62 Cb 0.10 -3.14 -0.11 0.00 0.00 0.00 0.00 34.83 31.68 3kcv s MET 62 CO 0.51 0.68 1.72 -2.14 0.00 0.00 0.00 175.02 175.80 3kcv s PRO 63 N -1.37 4.14 0.15 2.03 0.02 -1.26 -4.90 135.00 133.81 3kcv s PRO 63 Ca 0.24 2.57 -0.22 0.00 0.02 0.00 0.00 61.00 63.62 3kcv s PRO 63 Cb -0.14 -3.20 0.03 0.00 0.02 0.00 0.00 34.50 31.21 3kcv s PRO 63 CO 0.13 -0.75 1.26 0.34 -0.33 0.00 0.00 177.00 177.64 3kcv n PHE 64 N 4.35 -0.23 -0.13 6.54 7.35 -1.26 -1.62 117.46 132.46 3kcv n PHE 64 Ca 0.16 1.01 -0.02 0.00 -0.76 0.00 0.00 57.45 57.85 3kcv n PHE 64 Cb 0.36 -0.65 0.22 0.00 0.35 0.00 0.00 39.48 39.77 3kcv n PHE 64 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 3kcv h GLY 65 N 0.00 0.88 1.18 7.13 0.00 -1.98 -1.80 103.07 108.48 3kcv h GLY 65 Ca 0.18 -0.46 -0.18 0.00 0.00 0.00 0.00 47.33 46.87 3kcv h GLY 65 CO -0.78 0.44 -0.53 -0.33 0.00 0.00 0.00 176.54 175.34 3kcv h MET 66 N 0.81 0.87 -0.13 4.80 2.86 -1.70 0.70 114.93 123.14 3kcv h MET 66 Ca 0.19 -0.54 -0.22 0.00 -2.06 0.00 0.00 59.70 57.07 3kcv h MET 66 Cb 0.20 0.06 0.01 0.00 0.06 0.00 0.00 31.60 31.93 3kcv h MET 66 CO -0.01 1.17 -0.78 0.00 1.06 0.00 0.00 176.91 178.35 3kcv h ALA 67 N 0.72 0.37 -0.37 6.32 0.00 -1.29 -1.64 119.26 123.36 3kcv h ALA 67 Ca 0.02 -0.61 -0.06 0.00 0.00 0.00 0.00 54.91 54.26 3kcv h ALA 67 Cb 1.13 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 3kcv h ALA 67 CO 0.12 0.70 -0.01 0.87 0.00 0.00 0.00 179.25 180.93 3kcv h LYS 68 N 0.48 0.66 -0.13 0.00 6.56 -1.35 -1.17 116.57 121.62 3kcv h LYS 68 Ca -0.05 -0.21 0.04 0.00 -1.06 0.00 0.00 60.65 59.36 3kcv h LYS 68 Cb 1.40 -0.06 -0.04 0.00 -0.57 0.00 0.00 32.23 32.96 3kcv h LYS 68 CO 0.16 0.77 -0.13 1.25 -2.06 0.00 0.00 179.45 179.43 3kcv h LEU 69 N 0.47 -0.41 -1.08 2.94 5.85 -0.81 0.36 115.31 122.64 3kcv h LEU 69 Ca 0.10 0.08 -0.06 0.00 0.84 0.00 0.00 57.88 58.84 3kcv h LEU 69 Cb 0.48 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.69 3kcv h LEU 69 CO 0.02 -0.17 -0.02 0.58 -0.34 0.00 0.00 178.44 178.50 3kcv h VAL 70 N -0.16 1.22 -0.36 1.05 2.07 -1.18 -0.67 116.25 118.23 3kcv h VAL 70 Ca 0.09 -0.92 -0.11 0.00 0.82 0.00 0.00 66.70 66.59 3kcv h VAL 70 Cb 0.29 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 3kcv h VAL 70 CO -0.22 0.31 -0.22 1.23 0.02 0.00 0.00 177.57 178.70 3kcv h GLY 71 N 0.91 0.75 0.76 2.17 0.00 -1.05 -1.94 103.07 104.67 3kcv h GLY 71 Ca 0.12 -0.62 0.01 0.00 0.00 0.00 0.00 47.33 46.83 3kcv h GLY 71 CO 0.02 0.57 -0.19 -1.33 0.00 0.00 0.00 176.54 175.61 3kcv h GLY 72 N 0.98 -0.39 0.43 4.60 0.00 -0.06 0.33 103.07 108.96 3kcv h GLY 72 Ca 0.09 0.21 0.08 0.00 0.00 0.00 0.00 47.33 47.71 3kcv h GLY 72 CO 0.05 -0.18 0.12 -2.22 0.00 0.00 0.00 176.54 174.31 3kcv h ILE 73 N -0.40 0.76 -1.00 2.60 2.04 -1.06 -0.66 117.51 119.79 3kcv h ILE 73 Ca 0.00 -0.09 0.04 0.00 1.00 0.00 0.00 64.86 65.82 3kcv h ILE 73 Cb 0.38 0.47 -0.06 0.00 -0.74 0.00 0.00 36.82 36.88 3kcv h ILE 73 CO -0.05 0.05 0.65 0.00 0.00 0.00 0.00 178.15 178.80 3kcv h PHE 75 N 1.25 0.92 0.00 0.00 3.57 0.67 -2.74 116.94 120.60 3kcv h PHE 75 Ca 0.40 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.93 3kcv h PHE 75 Cb 0.03 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.48 3kcv h PHE 75 CO -0.00 0.40 0.00 -1.13 -2.23 0.00 0.00 178.31 175.35 3kcv n SER 76 N -4.54 0.08 -0.30 0.41 3.41 -1.09 -1.55 113.62 110.03 3kcv n SER 76 Ca 0.16 0.53 0.16 0.00 -0.26 0.00 0.00 58.87 59.45 3kcv n SER 76 Cb 0.35 -0.54 0.41 0.00 -0.26 0.00 0.00 64.21 64.17 3kcv n SER 76 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3kcv h LEU 77 N 0.00 0.61 -0.97 1.04 7.12 -1.67 -0.46 115.31 120.98 3kcv h LEU 77 Ca 0.00 0.07 -0.05 0.00 0.13 0.00 0.00 57.88 58.03 3kcv h LEU 77 Cb 0.15 -0.05 -0.03 0.00 -0.53 0.00 0.00 40.66 40.21 3kcv h LEU 77 CO 0.00 0.24 0.20 1.23 -0.13 0.00 0.00 178.44 179.98 3kcv h GLY 78 N 0.61 1.02 1.48 3.75 0.00 -1.49 0.16 103.07 108.60 3kcv h GLY 78 Ca 0.52 -0.57 -0.27 0.00 0.00 0.00 0.00 47.33 47.02 3kcv h GLY 78 CO -0.27 0.54 -1.36 -2.00 0.00 0.00 0.00 176.54 173.44 3kcv h LEU 79 N 0.92 0.19 -0.49 3.11 5.85 -1.54 -1.76 115.31 121.59 3kcv h LEU 79 Ca 0.21 -0.25 -0.06 0.00 0.84 0.00 0.00 57.88 58.62 3kcv h LEU 79 Cb 0.26 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 3kcv h LEU 79 CO -0.01 1.21 0.08 0.40 -0.34 0.00 0.00 178.44 179.78 3kcv h ILE 80 N 0.03 1.25 0.02 4.05 2.04 -1.03 -1.54 117.51 122.33 3kcv h ILE 80 Ca -0.16 -0.92 0.03 0.00 1.00 0.00 0.00 64.86 64.81 3kcv h ILE 80 Cb 1.93 0.89 -0.04 0.00 -0.74 0.00 0.00 36.82 38.86 3kcv h ILE 80 CO 0.14 0.33 -0.27 -0.07 0.00 0.00 0.00 178.15 178.28 3kcv h LEU 81 N 0.69 -0.79 -0.29 1.44 4.07 -0.69 -0.90 115.31 118.83 3kcv h LEU 81 Ca 0.15 0.11 0.06 0.00 0.08 0.00 0.00 57.88 58.28 3kcv h LEU 81 Cb 0.39 0.32 -0.06 0.00 1.08 0.00 0.00 40.66 42.39 3kcv h LEU 81 CO 0.01 -0.34 -0.12 0.00 -1.08 0.00 0.00 178.44 176.90 3kcv h VAL 83 N -0.07 1.30 0.00 0.00 2.07 -1.17 0.07 116.25 118.44 3kcv h VAL 83 Ca 0.15 -2.34 0.00 0.00 0.82 0.00 0.00 66.70 65.33 3kcv h VAL 83 Cb 0.30 2.57 0.00 0.00 -1.52 0.00 0.00 31.29 32.64 3kcv h VAL 83 CO -0.34 0.71 0.00 0.58 0.02 0.00 0.00 177.57 178.54 3kcv h VAL 84 N 0.28 0.00 -0.01 2.57 2.07 -1.17 -3.11 116.25 116.88 3kcv h VAL 84 Ca -0.15 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 66.93 3kcv h VAL 84 Cb 1.77 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 32.90 3kcv h VAL 84 CO 0.21 0.00 -0.24 0.00 0.02 0.00 0.00 177.57 177.56 3kcv n GLY 86 N 0.99 -1.22 0.00 0.00 0.00 -0.54 -5.03 105.19 99.38 3kcv n GLY 86 Ca 0.05 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.57 3kcv n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kcv n ALA 87 N -2.13 0.00 -3.40 4.61 0.00 -0.10 -4.97 120.51 114.52 3kcv n ALA 87 Ca -0.02 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.21 3kcv n ALA 87 Cb 0.53 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.89 3kcv n ALA 87 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3kcv s ASP 88 N -0.83 1.84 -0.29 0.00 -1.08 -0.73 -4.89 116.67 110.68 3kcv s ASP 88 Ca 0.00 -1.75 -0.11 0.00 -0.52 0.00 0.00 52.55 50.17 3kcv s ASP 88 Cb 0.00 0.22 -0.03 0.00 -1.46 0.00 0.00 42.92 41.64 3kcv s ASP 88 CO 0.00 -0.28 0.18 -0.22 0.52 0.00 0.00 175.17 175.37 3kcv s LEU 89 N 1.35 4.06 -0.41 -1.34 2.96 -1.26 -4.12 118.68 119.92 3kcv s LEU 89 Ca 0.17 -0.19 -0.21 0.00 -0.22 0.00 0.00 54.13 53.68 3kcv s LEU 89 Cb -0.18 -2.08 -0.11 0.00 0.50 0.00 0.00 46.19 44.31 3kcv s LEU 89 CO -0.04 -0.11 1.34 0.33 -1.32 0.00 0.00 176.35 176.56 3kcv n PHE 90 N 5.04 0.48 0.00 5.38 7.35 -1.26 -0.46 117.46 134.00 3kcv n PHE 90 Ca -0.14 0.32 0.00 0.00 -0.76 0.00 0.00 57.45 56.87 3kcv n PHE 90 Cb 0.51 -1.30 0.00 0.00 0.35 0.00 0.00 39.48 39.04 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 3.88 0.00 -0.31 -2.13 -2.24 -1.26 -4.89 114.28 107.34 3kcv n THR 91 Ca 0.34 0.00 0.17 0.00 -2.27 0.00 0.00 64.05 62.29 3kcv n THR 91 Cb -0.00 0.00 0.43 0.00 -2.10 0.00 0.00 70.33 68.65 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 0.58 -0.93 3.42 4.64 -1.16 -1.57 113.55 118.53 3kcv h SER 92 Ca 0.00 0.07 -0.53 0.00 -0.47 0.00 0.00 61.79 60.86 3kcv h SER 92 Cb 0.00 -0.03 -0.29 0.00 -0.31 0.00 0.00 62.40 61.77 3kcv h SER 92 CO 0.00 0.20 0.61 0.35 -0.87 0.00 0.00 176.83 177.12 3kcv n THR 93 N -4.64 3.25 0.21 2.95 -2.24 -1.26 -4.40 114.28 108.14 3kcv n THR 93 Ca 0.22 -2.33 -0.16 0.00 -2.27 0.00 0.00 64.05 59.51 3kcv n THR 93 Cb 0.68 -0.66 -0.08 0.00 -2.10 0.00 0.00 70.33 68.17 3kcv n THR 93 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 3kcv h VAL 94 N 1.03 0.14 0.00 2.28 2.07 -1.67 -2.12 116.25 117.98 3kcv h VAL 94 Ca 0.59 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 68.05 3kcv h VAL 94 Cb 2.17 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 3kcv h VAL 94 CO 1.17 0.00 -0.28 -0.07 0.02 0.00 0.00 177.57 178.41 3kcv h LEU 95 N -0.80 0.00 0.49 2.57 3.38 -1.87 -2.20 115.31 116.88 3kcv h LEU 95 Ca -0.02 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 3kcv h LEU 95 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 3kcv h LEU 95 CO -0.13 0.28 -0.24 0.40 0.09 0.00 0.00 178.44 178.84 3kcv h ILE 96 N 0.00 0.48 0.00 1.22 5.03 -1.88 -0.73 117.51 121.64 3kcv h ILE 96 Ca -0.00 -0.27 0.00 0.00 -0.12 0.00 0.00 64.86 64.47 3kcv h ILE 96 Cb 0.60 0.59 0.00 0.00 -3.03 0.00 0.00 36.82 34.98 3kcv h ILE 96 CO 0.04 0.04 0.00 0.52 -0.68 0.00 0.00 178.15 178.07 3kcv n VAL 97 N -5.31 1.13 -0.00 1.67 0.31 -0.81 -0.59 118.33 114.73 3kcv n VAL 97 Ca -0.11 0.34 -0.00 0.00 -0.01 0.00 0.00 64.34 64.56 3kcv n VAL 97 Cb 0.30 -1.21 -0.00 0.00 -0.91 0.00 0.00 33.84 32.02 3kcv n VAL 97 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3kcv h VAL 98 N 0.00 0.00 0.00 2.52 2.07 -1.21 -3.34 116.25 116.29 3kcv h VAL 98 Ca 0.00 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 3kcv h VAL 98 Cb 0.21 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.98 3kcv h VAL 98 CO 0.00 0.00 -0.16 0.00 0.02 0.00 0.00 177.57 177.43 3kcv h ALA 99 N -1.98 1.47 -0.16 1.67 0.00 -1.08 -1.12 119.26 118.05 3kcv h ALA 99 Ca 0.00 -0.15 -0.17 0.00 0.00 0.00 0.00 54.91 54.60 3kcv h ALA 99 Cb 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3kcv h ALA 99 CO 0.00 0.20 -0.60 -0.22 0.00 0.00 0.00 179.25 178.63 3kcv h LYS 100 N 0.00 0.52 0.00 0.00 3.64 -1.05 0.97 116.57 120.65 3kcv h LYS 100 Ca -0.00 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 3kcv h LYS 100 Cb 0.34 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 3kcv h LYS 100 CO 0.02 0.97 0.00 0.00 -2.27 0.00 0.00 179.45 178.17 3kcv n ALA 101 N -2.52 2.39 -1.22 5.00 0.00 -0.93 -4.87 120.51 118.37 3kcv n ALA 101 Ca -0.04 -0.15 -0.08 0.00 0.00 0.00 0.00 53.44 53.18 3kcv n ALA 101 Cb 0.63 -1.42 -0.03 0.00 0.00 0.00 0.00 19.45 18.63 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 -1.10 -4.30 0.00 0.00 7.64 0.33 -0.90 113.62 115.29 3kcv n SER 102 Ca 0.17 0.19 0.00 0.00 1.01 0.00 0.00 58.87 60.24 3kcv n SER 102 Cb 0.13 -2.48 0.00 0.00 -1.01 0.00 0.00 64.21 60.85 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 -1.55 2.88 2.14 0.23 0.00 -0.49 -4.94 105.19 103.47 3kcv n GLY 103 Ca -0.08 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 3kcv n GLY 103 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kcv n ARG 104 N -2.00 2.39 -4.03 1.61 3.00 -0.08 -4.86 116.66 112.70 3kcv n ARG 104 Ca 0.00 -1.32 -0.11 0.00 -0.01 0.00 0.00 57.85 56.41 3kcv n ARG 104 Cb 0.00 -2.23 -0.11 0.00 0.00 0.00 0.00 32.46 30.12 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 1.55 0.35 -0.14 0.55 2.07 -1.26 -4.95 121.20 119.37 3kcv s ILE 105 Ca 0.63 -0.97 -0.12 0.00 -1.41 0.00 0.00 60.65 58.78 3kcv s ILE 105 Cb 0.25 -0.45 -0.05 0.00 0.13 0.00 0.00 42.46 42.35 3kcv s ILE 105 CO -0.02 -0.41 0.25 0.28 -1.91 0.00 0.00 174.94 173.14 3kcv s THR 106 N -1.35 5.32 0.08 4.00 -1.32 -1.26 -5.03 115.64 116.08 3kcv s THR 106 Ca -0.12 0.47 -0.30 0.00 -1.21 0.00 0.00 61.69 60.53 3kcv s THR 106 Cb -0.10 -3.58 -0.13 0.00 -1.51 0.00 0.00 72.50 67.19 3kcv s THR 106 CO -0.00 0.46 1.47 -0.50 -2.21 0.00 0.00 174.62 173.83 3kcv h TRP 107 N 6.15 -1.25 0.53 9.09 6.55 -2.00 -0.60 115.95 134.42 3kcv h TRP 107 Ca -0.45 0.02 -0.03 0.00 0.95 0.00 0.00 58.89 59.39 3kcv h TRP 107 Cb 1.18 0.52 0.01 0.00 -0.86 0.00 0.00 29.16 30.00 3kcv h TRP 107 CO 0.64 -0.53 -0.26 0.78 -1.05 0.00 0.00 178.44 178.02 3kcv h GLY 108 N -0.72 -0.75 -2.70 1.49 0.00 -1.98 0.97 103.07 99.38 3kcv h GLY 108 Ca -0.02 0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.58 3kcv h GLY 108 CO -0.17 -0.27 0.00 -1.06 0.00 0.00 0.00 176.54 175.04 3kcv n GLN 109 N -5.36 0.89 0.00 4.80 6.02 -1.24 -2.02 117.38 120.48 3kcv n GLN 109 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.87 3kcv n GLN 109 Cb 0.31 -1.05 0.00 0.00 1.02 0.00 0.00 30.24 30.52 3kcv n GLN 109 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 3kcv n LEU 110 N 1.18 0.31 -0.45 1.08 0.00 -0.23 -4.65 117.00 114.24 3kcv n LEU 110 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 56.01 56.10 3kcv n LEU 110 Cb 0.45 0.00 0.01 0.00 0.00 0.00 0.00 43.42 43.88 3kcv n LEU 110 CO 0.00 0.05 0.32 0.00 0.00 0.00 0.00 177.39 177.76 3kcv n ALA 111 N -1.23 3.11 0.26 1.96 0.00 0.23 -4.56 120.51 120.27 3kcv n ALA 111 Ca 0.00 -0.57 0.10 0.00 0.00 0.00 0.00 53.44 52.97 3kcv n ALA 111 Cb 0.13 -0.61 0.69 0.00 0.00 0.00 0.00 19.45 19.66 3kcv n ALA 111 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 3kcv h LYS 112 N 2.22 0.00 0.00 0.00 2.10 -1.65 -3.00 116.57 116.23 3kcv h LYS 112 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3kcv h LYS 112 Cb 0.62 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.95 3kcv h LYS 112 CO 0.00 0.10 0.00 -0.91 -2.00 0.00 0.00 179.45 176.64 3kcv h ASN 113 N 0.00 0.00 -0.89 7.07 -0.26 -1.88 -3.32 115.58 116.30 3kcv h ASN 113 Ca -0.00 0.00 0.18 0.00 -0.56 0.00 0.00 56.30 55.92 3kcv h ASN 113 Cb 0.21 0.00 -0.17 0.00 -1.06 0.00 0.00 38.32 37.30 3kcv h ASN 113 CO 0.01 0.00 -0.22 -0.50 -1.06 0.00 0.00 177.43 175.66 3kcv h TRP 114 N 0.00 -0.47 -0.48 1.19 4.06 -1.84 0.33 115.95 118.75 3kcv h TRP 114 Ca 0.00 0.08 0.10 0.00 2.06 0.00 0.00 58.89 61.13 3kcv h TRP 114 Cb 0.74 0.35 -0.09 0.00 -1.00 0.00 0.00 29.16 29.15 3kcv h TRP 114 CO 0.00 -0.38 -0.15 1.25 -3.56 0.00 0.00 178.44 175.60 3kcv h LEU 115 N -0.00 -0.54 -0.35 -4.49 5.85 -1.81 0.15 115.31 114.12 3kcv h LEU 115 Ca 0.43 0.15 -0.07 0.00 0.84 0.00 0.00 57.88 59.23 3kcv h LEU 115 Cb 0.65 0.33 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 3kcv h LEU 115 CO -0.91 -0.19 -0.06 -1.13 -0.34 0.00 0.00 178.44 175.81 3kcv h ASN 116 N -0.04 0.67 -0.50 1.25 -1.24 -0.70 -1.91 115.58 113.11 3kcv h ASN 116 Ca 0.23 -0.35 -0.03 0.00 0.71 0.00 0.00 56.30 56.86 3kcv h ASN 116 Cb 0.39 -0.18 -0.02 0.00 0.73 0.00 0.00 38.32 39.24 3kcv h ASN 116 CO -0.51 0.86 0.18 0.58 -1.29 0.00 0.00 177.43 177.25 3kcv h VAL 117 N 0.46 1.22 -0.28 2.57 2.07 -0.50 -1.39 116.25 120.40 3kcv h VAL 117 Ca 0.09 -0.70 0.02 0.00 0.82 0.00 0.00 66.70 66.93 3kcv h VAL 117 Cb 0.56 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 3kcv h VAL 117 CO 0.03 0.26 0.15 0.22 0.02 0.00 0.00 177.57 178.25 3kcv h TYR 118 N 0.66 0.28 -0.64 1.57 3.20 -0.68 0.34 116.97 121.70 3kcv h TYR 118 Ca 0.16 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.01 3kcv h TYR 118 Cb 0.23 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.38 3kcv h TYR 118 CO 0.01 0.16 0.26 0.35 -1.64 0.00 0.00 178.16 177.29 3kcv h PHE 119 N 0.31 0.98 -0.50 -3.82 3.57 -1.25 -1.62 116.94 114.61 3kcv h PHE 119 Ca 0.11 -0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 3kcv h PHE 119 Cb 0.02 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.45 3kcv h PHE 119 CO -0.09 0.77 0.23 0.78 -2.23 0.00 0.00 178.31 177.78 3kcv h GLY 120 N 0.90 0.77 0.39 2.40 0.00 -0.90 -0.66 103.07 105.98 3kcv h GLY 120 Ca 0.21 -0.39 0.10 0.00 0.00 0.00 0.00 47.33 47.25 3kcv h GLY 120 CO -0.02 0.37 0.25 3.43 0.00 0.00 0.00 176.54 180.57 3kcv h ASN 121 N 0.66 0.26 -0.41 0.19 -0.26 -0.17 -1.40 115.58 114.46 3kcv h ASN 121 Ca 0.17 0.08 0.00 0.00 -0.56 0.00 0.00 56.30 55.99 3kcv h ASN 121 Cb 0.13 0.05 -0.02 0.00 -1.06 0.00 0.00 38.32 37.41 3kcv h ASN 121 CO -0.02 0.15 0.26 0.25 -1.06 0.00 0.00 177.43 177.01 3kcv h LEU 122 N 0.44 0.47 -0.69 1.61 5.85 -0.46 -0.24 115.31 122.28 3kcv h LEU 122 Ca 0.32 -0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.95 3kcv h LEU 122 Cb 0.39 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 3kcv h LEU 122 CO -0.30 0.36 0.19 0.58 -0.34 0.00 0.00 178.44 178.93 3kcv h VAL 123 N 0.54 1.26 -0.27 1.05 2.07 -0.91 0.84 116.25 120.83 3kcv h VAL 123 Ca 0.15 -0.92 0.06 0.00 0.82 0.00 0.00 66.70 66.81 3kcv h VAL 123 Cb -0.04 0.54 -0.06 0.00 -1.52 0.00 0.00 31.29 30.20 3kcv h VAL 123 CO -0.03 0.36 -0.16 1.23 0.02 0.00 0.00 177.57 178.99 3kcv h GLY 124 N 1.03 0.04 -0.01 2.17 0.00 -0.91 -0.48 103.07 104.92 3kcv h GLY 124 Ca 0.22 0.20 0.01 0.00 0.00 0.00 0.00 47.33 47.76 3kcv h GLY 124 CO -0.00 -0.17 -0.23 0.00 0.00 0.00 0.00 176.54 176.15 3kcv h ALA 125 N 1.06 -0.68 -0.73 3.60 0.00 -0.42 -1.91 119.26 120.19 3kcv h ALA 125 Ca 0.14 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.09 3kcv h ALA 125 Cb 0.35 0.70 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 3kcv h ALA 125 CO -0.35 -0.75 0.40 -0.07 0.00 0.00 0.00 179.25 178.48 3kcv h LEU 126 N -0.28 0.59 -0.84 0.00 3.38 -0.82 0.20 115.31 117.55 3kcv h LEU 126 Ca 0.01 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.07 3kcv h LEU 126 Cb 0.30 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 40.91 3kcv h LEU 126 CO -0.15 0.37 0.52 -0.07 0.09 0.00 0.00 178.44 179.19 3kcv h LEU 127 N 0.72 0.82 -0.60 1.67 3.38 -0.99 -1.63 115.31 118.68 3kcv h LEU 127 Ca 0.33 0.02 -0.15 0.00 0.09 0.00 0.00 57.88 58.17 3kcv h LEU 127 Cb 0.25 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3kcv h LEU 127 CO -0.21 0.53 -0.51 0.15 0.09 0.00 0.00 178.44 178.49 3kcv h PHE 128 N 0.95 0.62 -0.73 1.13 3.57 -0.47 -1.89 116.94 120.12 3kcv h PHE 128 Ca 0.36 -0.21 0.13 0.00 3.53 0.00 0.00 57.97 61.79 3kcv h PHE 128 Cb 0.15 -0.12 -0.09 0.00 2.79 0.00 0.00 35.95 38.68 3kcv h PHE 128 CO -0.04 0.91 0.29 0.28 -2.23 0.00 0.00 178.31 177.52 3kcv h VAL 129 N 0.39 0.68 -0.25 1.41 2.07 -0.10 0.19 116.25 120.64 3kcv h VAL 129 Ca 0.02 -0.15 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 3kcv h VAL 129 Cb 1.03 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 3kcv h VAL 129 CO 0.09 0.08 0.06 0.25 0.02 0.00 0.00 177.57 178.07 3kcv h LEU 130 N 0.44 0.38 -0.67 2.57 5.85 -0.88 0.84 115.31 123.83 3kcv h LEU 130 Ca 0.40 -0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.88 3kcv h LEU 130 Cb 0.58 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 3kcv h LEU 130 CO -0.39 0.52 0.43 0.25 -0.34 0.00 0.00 178.44 178.91 3kcv h LEU 131 N 0.23 0.79 -0.85 2.25 5.85 -1.02 0.44 115.31 123.00 3kcv h LEU 131 Ca 0.08 -0.04 -0.12 0.00 0.84 0.00 0.00 57.88 58.64 3kcv h LEU 131 Cb 0.29 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 3kcv h LEU 131 CO 0.00 0.60 -0.57 0.24 -0.34 0.00 0.00 178.44 178.37 3kcv h MET 132 N 0.91 0.01 0.47 1.25 2.86 -0.78 -0.12 114.93 119.54 3kcv h MET 132 Ca 0.24 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.85 3kcv h MET 132 Cb -0.07 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.60 3kcv h MET 132 CO -0.05 0.58 -0.23 2.35 1.06 0.00 0.00 176.91 180.62 3kcv h TRP 133 N 0.01 -0.59 -0.57 -0.22 2.91 -0.28 -3.12 115.95 114.08 3kcv h TRP 133 Ca -0.01 -0.01 0.08 0.00 1.13 0.00 0.00 58.89 60.08 3kcv h TRP 133 Cb 1.01 0.20 -0.03 0.00 -0.51 0.00 0.00 29.16 29.82 3kcv h TRP 133 CO 0.00 -0.27 0.38 -0.07 -1.03 0.00 0.00 178.44 177.46 3kcv h LEU 134 N -0.98 0.38 -1.20 0.65 3.38 -0.83 -0.20 115.31 116.52 3kcv h LEU 134 Ca -0.07 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3kcv h LEU 134 Cb 0.59 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.26 3kcv h LEU 134 CO 0.11 0.24 0.00 -1.54 0.09 0.00 0.00 178.44 177.34 3kcv n SER 135 N -4.47 0.54 -3.64 -0.43 3.41 -0.07 -4.83 113.62 104.13 3kcv n SER 135 Ca 0.09 0.73 -0.24 0.00 -0.26 0.00 0.00 58.87 59.19 3kcv n SER 135 Cb 0.32 -0.81 0.07 0.00 -0.26 0.00 0.00 64.21 63.54 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 -1.04 -0.49 0.14 5.00 0.00 -0.09 -4.89 105.19 103.82 3kcv n GLY 136 Ca -0.01 0.21 0.08 0.00 0.00 0.00 0.00 46.02 46.31 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 -2.39 0.00 0.00 1.61 4.57 -1.74 -3.34 114.58 113.29 3kcv h GLU 137 Ca -0.58 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.60 3kcv h GLU 137 Cb 1.37 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.96 3kcv h GLU 137 CO 0.57 0.12 0.00 2.48 -1.18 0.00 0.00 179.01 181.00 3kcv n TYR 138 N -2.91 0.38 0.81 0.92 4.11 -1.26 -0.19 117.16 119.02 3kcv n TYR 138 Ca -0.00 0.20 0.08 0.00 -0.00 0.00 0.00 57.90 58.18 3kcv n TYR 138 Cb 0.62 -0.81 -0.09 0.00 -0.00 0.00 0.00 39.34 39.06 3kcv n TYR 138 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.86 175.53 3kcv n MET 139 N -1.89 1.34 -2.14 -3.48 2.81 -1.25 -1.16 117.12 111.34 3kcv n MET 139 Ca -0.01 -0.10 -0.39 0.00 -1.81 0.00 0.00 57.70 55.39 3kcv n MET 139 Cb 0.02 -1.32 -0.01 0.00 -0.71 0.00 0.00 33.22 31.20 3kcv n MET 139 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 3kcv s THR 140 N -2.56 2.80 0.00 2.03 2.01 0.73 -0.64 115.64 120.02 3kcv s THR 140 Ca 0.08 0.72 0.00 0.00 0.31 0.00 0.00 61.69 62.80 3kcv s THR 140 Cb 0.13 -3.43 0.00 0.00 0.01 0.00 0.00 72.50 69.22 3kcv s THR 140 CO 0.68 0.11 0.00 0.00 -0.69 0.00 0.00 174.62 174.71 3kcv n ALA 141 N 0.23 0.00 -2.19 7.40 0.00 -1.26 -1.97 120.51 122.73 3kcv n ALA 141 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.45 3kcv n ALA 141 Cb 0.44 -0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.55 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 1.38 -1.67 0.00 0.00 2.85 -0.88 -3.70 115.26 113.25 3kcv n ASN 142 Ca 0.00 -0.01 0.00 0.00 -0.11 0.00 0.00 54.58 54.46 3kcv n ASN 142 Cb 0.00 -0.86 0.00 0.00 1.24 0.00 0.00 39.78 40.16 3kcv n ASN 142 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3kcv n GLY 143 N -0.90 3.39 0.22 8.20 0.00 0.19 -4.74 105.19 111.55 3kcv n GLY 143 Ca -0.01 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.10 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 2.36 0.00 0.46 1.61 1.08 -1.73 0.22 115.11 119.12 3kcv h GLN 144 Ca 0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 3kcv h GLN 144 Cb 0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 3kcv h GLN 144 CO 0.00 0.23 -0.34 2.35 -0.95 0.00 0.00 178.83 180.12 3kcv h TRP 145 N 0.00 -0.92 -0.91 2.96 7.01 -1.64 0.80 115.95 123.26 3kcv h TRP 145 Ca -0.00 -0.00 -0.00 0.00 2.11 0.00 0.00 58.89 60.99 3kcv h TRP 145 Cb 0.75 0.34 -0.04 0.00 -2.10 0.00 0.00 29.16 28.10 3kcv h TRP 145 CO 0.00 -0.51 0.55 0.78 -2.79 0.00 0.00 178.44 176.48 3kcv h GLY 146 N -0.79 1.31 0.91 2.65 0.00 -0.47 -2.01 103.07 104.66 3kcv h GLY 146 Ca -0.05 -0.54 -0.00 0.00 0.00 0.00 0.00 47.33 46.74 3kcv h GLY 146 CO 0.01 0.52 0.06 -2.00 0.00 0.00 0.00 176.54 175.13 3kcv h LEU 147 N 1.25 0.16 -0.69 3.11 5.85 -0.89 -1.28 115.31 122.81 3kcv h LEU 147 Ca 0.33 -0.11 0.11 0.00 0.84 0.00 0.00 57.88 59.05 3kcv h LEU 147 Cb -0.07 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 40.84 3kcv h LEU 147 CO -0.06 0.22 0.28 -1.13 -0.34 0.00 0.00 178.44 177.41 3kcv h ASN 148 N 0.08 0.28 -0.73 1.25 -0.73 -0.46 0.07 115.58 115.33 3kcv h ASN 148 Ca 0.04 0.09 0.00 0.00 1.87 0.00 0.00 56.30 58.30 3kcv h ASN 148 Cb 0.10 0.06 -0.04 0.00 0.27 0.00 0.00 38.32 38.72 3kcv h ASN 148 CO -0.01 0.14 0.47 0.58 -0.37 0.00 0.00 177.43 178.25 3kcv h VAL 149 N 0.46 1.20 -0.31 2.57 2.07 -1.04 -0.96 116.25 120.24 3kcv h VAL 149 Ca 0.36 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 3kcv h VAL 149 Cb 0.48 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 3kcv h VAL 149 CO -0.34 0.19 0.10 -0.07 0.02 0.00 0.00 177.57 177.47 3kcv h LEU 150 N 0.99 0.44 -0.51 2.57 3.38 -0.03 0.90 115.31 123.06 3kcv h LEU 150 Ca 0.27 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 3kcv h LEU 150 Cb -0.09 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3kcv h LEU 150 CO -0.05 0.52 0.07 1.56 0.09 0.00 0.00 178.44 180.63 3kcv h GLN 151 N 0.34 0.84 0.27 1.13 4.20 -0.77 -0.35 115.11 120.78 3kcv h GLN 151 Ca 0.10 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 3kcv h GLN 151 Cb 0.23 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.92 3kcv h GLN 151 CO -0.00 0.84 -0.13 1.15 -0.67 0.00 0.00 178.83 180.01 3kcv h THR 152 N 0.72 0.60 -0.80 -0.54 2.02 -1.12 -1.73 112.91 112.06 3kcv h THR 152 Ca 0.15 -0.84 0.16 0.00 0.77 0.00 0.00 66.41 66.65 3kcv h THR 152 Cb 0.41 0.96 -0.10 0.00 -1.74 0.00 0.00 68.15 67.68 3kcv h THR 152 CO 0.01 0.14 0.33 0.00 0.37 0.00 0.00 175.52 176.37 3kcv h ALA 153 N -0.49 1.17 -0.12 6.16 0.00 -0.80 -1.81 119.26 123.37 3kcv h ALA 153 Ca -0.04 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3kcv h ALA 153 Cb 0.51 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3kcv h ALA 153 CO 0.06 -0.24 0.00 -3.47 0.00 0.00 0.00 179.25 175.61 3kcv n ASP 154 N -5.01 0.00 -0.11 0.00 -0.08 -0.15 -3.06 116.55 108.14 3kcv n ASP 154 Ca 0.16 0.97 0.11 0.00 -1.51 0.00 0.00 54.79 54.52 3kcv n ASP 154 Cb 0.48 -0.48 0.19 0.00 2.34 0.00 0.00 41.12 43.65 3kcv n ASP 154 CO 0.00 0.00 0.00 1.57 0.12 0.00 0.00 177.20 178.89 3kcv n HIS 155 N -1.94 0.34 0.21 -0.67 -0.00 -0.65 0.11 115.22 112.61 3kcv n HIS 155 Ca 0.00 0.34 0.08 0.00 0.46 0.00 0.00 57.72 58.60 3kcv n HIS 155 Cb 0.00 -0.78 0.40 0.00 -0.12 0.00 0.00 29.99 29.49 3kcv n HIS 155 CO 0.00 0.00 0.00 0.87 0.46 0.00 0.00 176.34 177.67 3kcv h LYS 156 N 0.00 0.00 -0.46 1.57 1.57 -1.34 -2.60 116.57 115.31 3kcv h LYS 156 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 3kcv h LYS 156 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.06 3kcv h LYS 156 CO -0.22 0.29 0.00 1.33 -0.57 0.00 0.00 179.45 180.28 3kcv n VAL 157 N -3.45 0.62 -1.04 0.50 0.24 0.31 -4.25 118.33 111.25 3kcv n VAL 157 Ca 0.00 -0.61 -0.04 0.00 -2.04 0.00 0.00 64.34 61.65 3kcv n VAL 157 Cb 0.47 0.30 0.32 0.00 -1.47 0.00 0.00 33.84 33.45 3kcv n VAL 157 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 3kcv n HIS 158 N 0.82 2.34 -4.17 6.34 8.25 -0.98 -4.86 115.22 122.96 3kcv n HIS 158 Ca 0.15 -1.14 -0.31 0.00 -0.26 0.00 0.00 57.72 56.16 3kcv n HIS 158 Cb 0.39 -0.65 -0.08 0.00 1.12 0.00 0.00 29.99 30.77 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 -2.97 3.08 0.90 4.41 3.76 -1.26 -5.11 115.29 118.10 3kcv s HIS 159 Ca 0.55 0.05 -0.10 0.00 -0.15 0.00 0.00 55.06 55.40 3kcv s HIS 159 Cb 0.44 -1.61 0.13 0.00 1.11 0.00 0.00 32.58 32.65 3kcv s HIS 159 CO 0.13 0.49 1.14 0.95 -0.85 0.00 0.00 174.74 176.60 3kcv s THR 160 N -1.24 2.23 0.31 1.30 -4.23 -1.26 -4.76 115.64 107.99 3kcv s THR 160 Ca 0.24 0.07 0.04 0.00 -1.18 0.00 0.00 61.69 60.86 3kcv s THR 160 Cb -0.12 -2.16 0.29 0.00 1.34 0.00 0.00 72.50 71.86 3kcv s THR 160 CO 0.16 -0.10 1.88 0.15 -0.54 0.00 0.00 174.62 176.17 3kcv h PHE 161 N -1.78 1.00 -0.11 3.99 3.57 -1.96 -0.56 116.94 121.09 3kcv h PHE 161 Ca -0.43 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.02 3kcv h PHE 161 Cb 1.26 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 39.68 3kcv h PHE 161 CO 0.51 0.44 -0.24 0.82 -2.23 0.00 0.00 178.31 177.61 3kcv h ILE 162 N 0.90 1.39 -0.28 1.41 2.04 -1.98 -1.48 117.51 119.50 3kcv h ILE 162 Ca 0.44 -1.54 0.05 0.00 1.00 0.00 0.00 64.86 64.80 3kcv h ILE 162 Cb 0.45 2.12 -0.04 0.00 -0.74 0.00 0.00 36.82 38.61 3kcv h ILE 162 CO -0.20 0.45 0.01 -0.33 0.00 0.00 0.00 178.15 178.08 3kcv h GLU 163 N -0.08 0.10 -0.28 2.37 5.08 -1.85 -0.68 114.58 119.24 3kcv h GLU 163 Ca 0.00 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.41 3kcv h GLU 163 Cb 0.84 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 30.01 3kcv h GLU 163 CO 0.05 0.06 -0.11 0.00 -1.00 0.00 0.00 179.01 178.02 3kcv h ALA 164 N 1.24 0.13 -0.37 3.43 0.00 -1.04 0.21 119.26 122.86 3kcv h ALA 164 Ca 0.13 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 3kcv h ALA 164 Cb 0.17 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3kcv h ALA 164 CO -0.22 -0.50 0.21 0.28 0.00 0.00 0.00 179.25 179.02 3kcv h VAL 165 N -0.06 1.14 -0.41 0.00 2.07 -1.09 -1.29 116.25 116.61 3kcv h VAL 165 Ca 0.14 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.26 3kcv h VAL 165 Cb 0.27 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 3kcv h VAL 165 CO -0.32 0.14 0.03 0.00 0.02 0.00 0.00 177.57 177.44 3kcv h LEU 167 N 0.62 0.00 -0.10 0.00 3.38 -0.85 -1.38 115.31 116.97 3kcv h LEU 167 Ca 0.13 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 3kcv h LEU 167 Cb 0.34 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 3kcv h LEU 167 CO 0.01 0.41 -0.05 1.23 0.09 0.00 0.00 178.44 180.13 3kcv h GLY 168 N 1.64 0.23 1.00 0.83 0.00 0.16 -1.03 103.07 105.90 3kcv h GLY 168 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.12 3kcv h GLY 168 CO 0.05 0.19 0.19 -2.22 0.00 0.00 0.00 176.54 174.75 3kcv h ILE 169 N -0.15 1.07 0.04 2.60 5.03 -0.32 -2.35 117.51 123.43 3kcv h ILE 169 Ca 0.02 -0.13 0.00 0.00 -0.12 0.00 0.00 64.86 64.63 3kcv h ILE 169 Cb 0.51 0.66 -0.00 0.00 -3.03 0.00 0.00 36.82 34.95 3kcv h ILE 169 CO 0.02 0.07 -0.04 -0.07 -0.68 0.00 0.00 178.15 177.45 3kcv h LEU 170 N 0.38 -0.09 0.34 1.44 3.38 -1.28 -1.27 115.31 118.22 3kcv h LEU 170 Ca 0.10 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 3kcv h LEU 170 Cb -0.04 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 3kcv h LEU 170 CO -0.02 -0.06 -0.49 0.00 0.09 0.00 0.00 178.44 177.96 3kcv h ALA 171 N 0.88 -1.01 0.00 1.53 0.00 -1.20 -2.99 119.26 116.47 3kcv h ALA 171 Ca 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 3kcv h ALA 171 Cb 0.08 0.75 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 3kcv h ALA 171 CO -0.01 -1.12 -0.13 -0.97 0.00 0.00 0.00 179.25 177.02 3kcv h ASN 172 N -0.87 0.00 -0.51 0.00 -1.24 -1.39 -1.73 115.58 109.84 3kcv h ASN 172 Ca -0.03 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 56.96 3kcv h ASN 172 Cb 0.80 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.83 3kcv h ASN 172 CO -0.15 0.13 0.27 0.25 -1.29 0.00 0.00 177.43 176.64 3kcv h LEU 173 N 0.00 0.66 -0.26 0.34 6.46 -1.13 -1.51 115.31 119.86 3kcv h LEU 173 Ca -0.00 -0.11 -0.13 0.00 -0.12 0.00 0.00 57.88 57.52 3kcv h LEU 173 Cb 0.60 -0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 40.36 3kcv h LEU 173 CO 0.02 0.58 -0.33 0.24 -0.62 0.00 0.00 178.44 178.33 3kcv h MET 174 N 0.68 0.69 -0.08 1.25 2.86 -1.20 -1.62 114.93 117.51 3kcv h MET 174 Ca 0.18 -0.39 0.02 0.00 -2.06 0.00 0.00 59.70 57.46 3kcv h MET 174 Cb 0.08 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 3kcv h MET 174 CO -0.03 1.00 -0.06 0.28 1.06 0.00 0.00 176.91 179.17 3kcv h VAL 175 N 0.41 0.82 -0.47 -2.22 2.07 -1.27 0.09 116.25 115.69 3kcv h VAL 175 Ca 0.03 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.52 3kcv h VAL 175 Cb 0.91 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 3kcv h VAL 175 CO 0.08 0.00 0.15 0.00 0.02 0.00 0.00 177.57 177.82 3kcv h LEU 177 N 0.62 0.45 -0.17 0.00 3.38 -1.21 0.16 115.31 118.53 3kcv h LEU 177 Ca 0.15 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 3kcv h LEU 177 Cb 0.26 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3kcv h LEU 177 CO -0.01 0.35 -0.03 0.00 0.09 0.00 0.00 178.44 178.85 3kcv h ALA 178 N 1.72 0.24 -0.04 1.53 0.00 -0.21 -0.55 119.26 121.95 3kcv h ALA 178 Ca 0.14 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3kcv h ALA 178 Cb -0.01 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 3kcv h ALA 178 CO -0.03 -0.02 0.01 0.28 0.00 0.00 0.00 179.25 179.49 3kcv h VAL 179 N 0.05 1.20 -0.99 0.00 2.07 -1.03 -0.96 116.25 116.59 3kcv h VAL 179 Ca 0.05 -0.60 0.19 0.00 0.82 0.00 0.00 66.70 67.16 3kcv h VAL 179 Cb 0.44 1.54 -0.10 0.00 -1.52 0.00 0.00 31.29 31.66 3kcv h VAL 179 CO 0.01 0.16 0.61 -0.25 0.02 0.00 0.00 177.57 178.13 3kcv h TRP 180 N -0.18 0.94 -0.20 1.57 2.91 -0.56 0.75 115.95 121.18 3kcv h TRP 180 Ca 0.01 0.03 -0.20 0.00 1.13 0.00 0.00 58.89 59.86 3kcv h TRP 180 Cb 0.26 -0.28 0.00 0.00 -0.51 0.00 0.00 29.16 28.63 3kcv h TRP 180 CO 0.01 0.22 -0.67 0.52 -1.03 0.00 0.00 178.44 177.49 3kcv h MET 181 N 0.68 0.76 -0.65 2.65 2.86 -1.03 -3.29 114.93 116.91 3kcv h MET 181 Ca 0.55 -0.55 -0.05 0.00 -2.06 0.00 0.00 59.70 57.59 3kcv h MET 181 Cb 0.97 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.70 3kcv h MET 181 CO -0.33 1.17 0.20 1.03 1.06 0.00 0.00 176.91 180.04 3kcv h SER 182 N 0.55 0.95 0.00 1.22 0.87 0.12 -2.37 113.55 114.89 3kcv h SER 182 Ca -0.02 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 3kcv h SER 182 Cb 1.27 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.98 3kcv h SER 182 CO 0.14 0.91 0.00 -1.22 -0.53 0.00 0.00 176.83 176.13 3kcv n TYR 183 N -4.35 0.00 -0.71 2.24 4.01 0.22 -1.98 117.16 116.59 3kcv n TYR 183 Ca 0.04 -0.11 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 3kcv n TYR 183 Cb 0.22 -0.11 0.00 0.00 -0.31 0.00 0.00 39.34 39.14 3kcv n TYR 183 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 3kcv n SER 184 N 0.40 0.51 -4.85 7.72 7.64 -0.89 -5.03 113.62 119.12 3kcv n SER 184 Ca 0.00 -1.21 -0.22 0.00 1.01 0.00 0.00 58.87 58.45 3kcv n SER 184 Cb 0.20 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.36 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 -0.21 1.39 0.00 0.23 0.00 -0.84 -5.05 107.32 102.84 3kcv s GLY 185 Ca 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 44.72 43.35 3kcv s GLY 185 CO 0.00 -1.41 0.00 0.54 0.00 0.00 0.00 173.10 172.23 3kcv n ARG 186 N -1.18 0.00 -0.57 2.90 5.12 -1.26 -4.67 116.66 116.99 3kcv n ARG 186 Ca -0.08 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.55 3kcv n ARG 186 Cb 0.58 -0.10 0.26 0.00 -1.16 0.00 0.00 32.46 32.04 3kcv n ARG 186 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 3kcv s SER 187 N -1.54 0.06 0.08 0.55 1.04 -1.26 -4.66 113.70 107.97 3kcv s SER 187 Ca 0.00 1.06 -0.21 0.00 0.48 0.00 0.00 55.95 57.28 3kcv s SER 187 Cb 0.00 -1.57 -0.10 0.00 0.10 0.00 0.00 66.02 64.44 3kcv s SER 187 CO 0.00 -4.71 1.61 0.25 0.98 0.00 0.00 173.24 171.38 3kcv h LEU 188 N -2.97 0.22 0.00 2.42 5.85 -2.00 -2.32 115.31 116.52 3kcv h LEU 188 Ca -0.51 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.04 3kcv h LEU 188 Cb 1.33 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.31 3kcv h LEU 188 CO 0.39 0.34 0.00 0.80 -0.34 0.00 0.00 178.44 179.62 3kcv n MET 189 N -4.86 0.00 -0.30 1.25 1.56 -1.26 -1.38 117.12 112.13 3kcv n MET 189 Ca -0.05 0.72 -0.08 0.00 -0.27 0.00 0.00 57.70 58.02 3kcv n MET 189 Cb 0.13 -1.29 -0.07 0.00 2.15 0.00 0.00 33.22 34.13 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 -2.05 -0.77 -0.26 6.12 9.92 -1.19 -0.57 116.55 127.76 3kcv n ASP 190 Ca 0.00 1.42 0.07 0.00 -0.53 0.00 0.00 54.79 55.76 3kcv n ASP 190 Cb 0.00 -0.24 0.21 0.00 -0.64 0.00 0.00 41.12 40.46 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 0.30 0.00 -1.24 1.57 -1.23 -3.21 116.57 112.76 3kcv h LYS 191 Ca 0.12 -0.02 -0.12 0.00 -1.87 0.00 0.00 60.65 58.76 3kcv h LYS 191 Cb 0.30 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 3kcv h LYS 191 CO -0.68 0.20 -0.79 0.00 -0.57 0.00 0.00 179.45 177.61 3kcv h ALA 192 N 1.63 0.14 -0.43 3.86 0.00 0.42 -3.41 119.26 121.47 3kcv h ALA 192 Ca 0.45 -0.83 0.02 0.00 0.00 0.00 0.00 54.91 54.55 3kcv h ALA 192 Cb 0.79 0.52 -0.03 0.00 0.00 0.00 0.00 17.79 19.07 3kcv h ALA 192 CO -0.51 0.50 0.24 0.74 0.00 0.00 0.00 179.25 180.22 3kcv h PHE 193 N -1.00 0.46 0.00 0.00 0.05 -1.40 -2.11 116.94 112.93 3kcv h PHE 193 Ca -0.18 0.02 0.00 0.00 3.82 0.00 0.00 57.97 61.62 3kcv h PHE 193 Cb 0.95 -0.14 0.00 0.00 2.00 0.00 0.00 35.95 38.76 3kcv h PHE 193 CO 0.03 0.26 0.41 0.97 -0.18 0.00 0.00 178.31 179.80 3kcv h ILE 194 N 0.49 0.00 0.00 -0.55 6.09 -1.77 0.32 117.51 122.09 3kcv h ILE 194 Ca 0.17 0.00 -0.09 0.00 -1.37 0.00 0.00 64.86 63.58 3kcv h ILE 194 Cb 0.03 0.26 -0.02 0.00 0.47 0.00 0.00 36.82 37.57 3kcv h ILE 194 CO -0.09 0.00 -1.27 0.23 -3.07 0.00 0.00 178.15 173.95 3kcv n MET 195 N -2.09 0.62 0.06 2.19 2.81 -0.79 -4.55 117.12 115.36 3kcv n MET 195 Ca -0.01 0.16 -0.03 0.00 -1.81 0.00 0.00 57.70 56.01 3kcv n MET 195 Cb 0.43 -1.80 -0.01 0.00 -0.71 0.00 0.00 33.22 31.12 3kcv n MET 195 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3kcv h VAL 196 N 0.00 0.00 -0.92 2.03 2.07 -0.45 -1.77 116.25 117.21 3kcv h VAL 196 Ca -0.09 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.56 3kcv h VAL 196 Cb 1.31 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.93 3kcv h VAL 196 CO 0.02 0.00 -0.39 0.18 0.02 0.00 0.00 177.57 177.40 3kcv n LEU 197 N -2.66 -0.67 0.10 2.57 4.32 -1.26 -0.39 117.00 119.01 3kcv n LEU 197 Ca -0.02 1.60 0.04 0.00 -0.02 0.00 0.00 56.01 57.61 3kcv n LEU 197 Cb 0.07 -0.34 0.45 0.00 -1.62 0.00 0.00 43.42 41.99 3kcv n LEU 197 CO 0.05 -1.42 1.02 -0.65 -1.22 0.00 0.00 177.39 175.17 3kcv h PRO 198 N 0.00 0.31 0.00 3.23 0.11 -1.78 -1.06 132.00 132.80 3kcv h PRO 198 Ca 0.29 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.34 3kcv h PRO 198 Cb 0.52 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.56 3kcv h PRO 198 CO -0.90 0.30 -0.16 0.28 -0.21 0.00 0.00 178.00 177.31 3kcv h VAL 199 N 0.31 0.62 -1.03 3.15 2.07 0.21 -3.17 116.25 118.41 3kcv h VAL 199 Ca 0.07 -1.51 0.26 0.00 0.82 0.00 0.00 66.70 66.35 3kcv h VAL 199 Cb 0.14 1.22 -0.11 0.00 -1.52 0.00 0.00 31.29 31.02 3kcv h VAL 199 CO -0.00 0.21 0.64 0.00 0.02 0.00 0.00 177.57 178.44 3kcv h ALA 200 N -0.65 2.02 0.37 1.67 0.00 -0.91 -0.57 119.26 121.19 3kcv h ALA 200 Ca -0.03 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3kcv h ALA 200 Cb 0.47 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 3kcv h ALA 200 CO -0.02 -0.47 -0.51 1.98 0.00 0.00 0.00 179.25 180.23 3kcv h MET 201 N 0.48 -0.88 0.00 0.00 -1.53 -1.30 0.21 114.93 111.91 3kcv h MET 201 Ca 0.62 0.06 0.00 0.00 -3.44 0.00 0.00 59.70 56.94 3kcv h MET 201 Cb 1.39 0.20 0.00 0.00 -0.55 0.00 0.00 31.60 32.64 3kcv h MET 201 CO -0.39 -0.59 0.00 0.27 0.14 0.00 0.00 176.91 176.34 3kcv h PHE 202 N -0.92 0.00 0.15 1.39 -5.15 -1.11 -2.30 116.94 108.99 3kcv h PHE 202 Ca -0.04 0.00 -0.35 0.00 -0.20 0.00 0.00 57.97 57.38 3kcv h PHE 202 Cb 0.83 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.00 3kcv h PHE 202 CO -0.33 0.00 -1.80 0.28 -2.00 0.00 0.00 178.31 174.46 3kcv h VAL 203 N 0.00 0.86 -0.23 0.88 2.07 -0.89 -0.59 116.25 118.34 3kcv h VAL 203 Ca 0.00 -2.50 -0.04 0.00 0.82 0.00 0.00 66.70 64.98 3kcv h VAL 203 Cb 0.42 2.66 -0.01 0.00 -1.52 0.00 0.00 31.29 32.84 3kcv h VAL 203 CO 0.00 0.85 0.00 0.00 0.02 0.00 0.00 177.57 178.44 3kcv h ALA 204 N 0.20 0.31 0.00 1.67 0.00 -0.52 -2.13 119.26 118.78 3kcv h ALA 204 Ca -0.35 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.34 3kcv h ALA 204 Cb 2.07 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.77 3kcv h ALA 204 CO 0.14 0.03 0.00 0.43 0.00 0.00 0.00 179.25 179.86 3kcv n SER 205 N -4.66 0.30 -3.46 0.00 7.64 -0.88 -4.83 113.62 107.74 3kcv n SER 205 Ca -0.04 0.60 -0.23 0.00 1.01 0.00 0.00 58.87 60.21 3kcv n SER 205 Cb 0.23 -0.65 0.08 0.00 -1.01 0.00 0.00 64.21 62.86 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 -0.56 -0.48 3.78 0.23 0.00 -0.80 -5.01 105.19 102.34 3kcv n GLY 206 Ca 0.01 0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.93 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 -3.31 2.73 -0.34 1.61 0.08 -0.26 -4.99 117.98 113.50 3kcv s PHE 207 Ca 0.54 1.53 -0.14 0.00 0.12 0.00 0.00 56.93 58.99 3kcv s PHE 207 Cb -0.24 -3.07 -0.02 0.00 -0.57 0.00 0.00 43.02 39.12 3kcv s PHE 207 CO 0.70 -1.56 0.29 -1.21 -0.10 0.00 0.00 175.22 173.33 3kcv s GLU 208 N -4.42 3.54 -0.29 0.44 0.41 -0.63 -4.81 118.70 112.95 3kcv s GLU 208 Ca 0.64 -0.54 -0.07 0.00 -0.41 0.00 0.00 54.97 54.58 3kcv s GLU 208 Cb -0.18 -3.80 0.00 0.00 -1.78 0.00 0.00 34.13 28.37 3kcv s GLU 208 CO 0.46 -0.46 0.08 -1.58 -0.49 0.00 0.00 175.26 173.27 3kcv s HIS 209 N 1.84 3.14 0.31 1.61 5.65 -1.26 -3.82 115.29 122.75 3kcv s HIS 209 Ca 0.08 -0.88 0.08 0.00 0.25 0.00 0.00 55.06 54.59 3kcv s HIS 209 Cb -0.17 -2.26 0.82 0.00 -1.18 0.00 0.00 32.58 29.79 3kcv s HIS 209 CO 0.11 -0.54 1.74 0.66 -0.65 0.00 0.00 174.74 176.06 3kcv h SER 210 N 8.24 0.68 -0.04 9.88 4.64 -1.92 -0.69 113.55 134.34 3kcv h SER 210 Ca -0.33 0.12 -0.15 0.00 -0.47 0.00 0.00 61.79 60.97 3kcv h SER 210 Cb 1.13 0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 3kcv h SER 210 CO 0.60 0.16 -0.46 0.40 -0.87 0.00 0.00 176.83 176.66 3kcv h ILE 211 N 0.63 1.31 -0.34 0.95 1.08 -1.97 -1.99 117.51 117.17 3kcv h ILE 211 Ca 0.61 -1.66 -0.08 0.00 -0.39 0.00 0.00 64.86 63.34 3kcv h ILE 211 Cb 1.09 1.62 -0.01 0.00 -3.07 0.00 0.00 36.82 36.45 3kcv h ILE 211 CO -0.45 0.52 -0.10 0.00 -0.69 0.00 0.00 178.15 177.43 3kcv h ALA 212 N 1.02 0.48 -0.21 1.87 0.00 -1.53 -2.93 119.26 117.97 3kcv h ALA 212 Ca 0.03 -0.31 0.06 0.00 0.00 0.00 0.00 54.91 54.69 3kcv h ALA 212 Cb 0.98 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 3kcv h ALA 212 CO 0.09 0.34 0.17 -0.91 0.00 0.00 0.00 179.25 178.94 3kcv h ASN 213 N 0.46 0.00 0.26 0.00 2.35 -1.00 -1.73 115.58 115.92 3kcv h ASN 213 Ca 0.08 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.79 3kcv h ASN 213 Cb 0.61 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.98 3kcv h ASN 213 CO 0.04 0.00 -0.22 0.24 -1.65 0.00 0.00 177.43 175.83 3kcv h MET 214 N 0.00 0.00 0.00 0.81 2.86 -1.16 -1.81 114.93 115.62 3kcv h MET 214 Ca 0.10 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.59 3kcv h MET 214 Cb 0.44 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.08 3kcv h MET 214 CO -0.00 0.22 -0.86 0.35 1.06 0.00 0.00 176.91 177.69 3kcv h PHE 215 N 0.00 0.00 0.07 -0.22 3.57 -1.48 -3.39 116.94 115.50 3kcv h PHE 215 Ca -0.00 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.51 3kcv h PHE 215 Cb 0.41 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.14 3kcv h PHE 215 CO 0.00 1.16 -0.11 1.98 -2.23 0.00 0.00 178.31 179.11 3kcv h MET 216 N -1.00 -0.21 0.34 1.11 4.05 -1.22 -0.31 114.93 117.68 3kcv h MET 216 Ca -0.22 0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.20 3kcv h MET 216 Cb 1.10 0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.95 3kcv h MET 216 CO -0.13 -0.14 -0.16 0.82 0.23 0.00 0.00 176.91 177.52 3kcv h ILE 217 N -0.22 0.66 -0.59 1.77 2.04 -1.59 -1.42 117.51 118.16 3kcv h ILE 217 Ca 0.02 -0.47 -0.01 0.00 1.00 0.00 0.00 64.86 65.39 3kcv h ILE 217 Cb 0.23 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 3kcv h ILE 217 CO -0.06 0.09 0.33 -0.65 0.00 0.00 0.00 178.15 177.86 3kcv h PRO 218 N -0.73 0.80 -0.58 2.37 0.11 -1.74 -0.54 132.00 131.69 3kcv h PRO 218 Ca -0.05 -0.08 -0.05 0.00 0.11 0.00 0.00 66.00 65.94 3kcv h PRO 218 Cb 0.50 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 31.42 3kcv h PRO 218 CO 0.08 0.59 0.17 1.98 -0.21 0.00 0.00 178.00 180.61 3kcv h MET 219 N 0.82 0.88 -0.73 1.05 4.05 -0.99 -0.47 114.93 119.53 3kcv h MET 219 Ca 0.21 -0.17 -0.05 0.00 -0.28 0.00 0.00 59.70 59.42 3kcv h MET 219 Cb 0.01 -0.14 -0.03 0.00 -0.80 0.00 0.00 31.60 30.64 3kcv h MET 219 CO -0.04 0.76 0.27 0.78 0.23 0.00 0.00 176.91 178.92 3kcv h GLY 220 N 0.99 1.17 0.78 1.39 0.00 -0.39 -2.15 103.07 104.86 3kcv h GLY 220 Ca 0.19 -0.64 -0.02 0.00 0.00 0.00 0.00 47.33 46.86 3kcv h GLY 220 CO -0.01 0.61 0.01 -2.22 0.00 0.00 0.00 176.54 174.92 3kcv h ILE 221 N 1.06 1.24 -0.26 2.60 2.04 -0.34 -0.06 117.51 123.79 3kcv h ILE 221 Ca 0.24 -0.78 0.06 0.00 1.00 0.00 0.00 64.86 65.38 3kcv h ILE 221 Cb 0.23 1.52 -0.06 0.00 -0.74 0.00 0.00 36.82 37.77 3kcv h ILE 221 CO -0.02 0.23 -0.13 0.58 0.00 0.00 0.00 178.15 178.81 3kcv h VAL 222 N -0.04 0.60 -0.14 1.67 2.07 -1.11 0.84 116.25 120.14 3kcv h VAL 222 Ca 0.04 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.59 3kcv h VAL 222 Cb 0.34 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 3kcv h VAL 222 CO 0.01 0.00 -0.07 0.40 0.02 0.00 0.00 177.57 177.92 3kcv h ILE 223 N -0.09 0.77 0.06 4.57 2.04 -1.30 -0.09 117.51 123.47 3kcv h ILE 223 Ca 0.14 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.00 3kcv h ILE 223 Cb 0.30 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 37.15 3kcv h ILE 223 CO -0.32 0.00 -0.03 -0.09 0.00 0.00 0.00 178.15 177.71 3kcv h ARG 224 N -0.06 -0.08 0.50 2.37 2.43 -0.70 0.29 114.38 119.13 3kcv h ARG 224 Ca 0.08 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 3kcv h ARG 224 Cb 0.18 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 3kcv h ARG 224 CO -0.18 0.02 -0.24 -0.44 -1.51 0.00 0.00 179.97 177.62 3kcv h ASP 225 N -0.16 -0.57 0.06 -3.80 3.32 -0.72 -3.30 116.42 111.25 3kcv h ASP 225 Ca -0.01 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3kcv h ASP 225 Cb 0.14 0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.84 3kcv h ASP 225 CO 0.01 -0.16 0.00 0.49 -1.72 0.00 0.00 179.24 177.86 3kcv n PHE 226 N -5.17 0.00 -1.74 4.55 3.72 -0.06 -4.85 117.46 113.91 3kcv n PHE 226 Ca -0.08 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.89 3kcv n PHE 226 Cb 0.27 -0.03 -0.03 0.00 -0.94 0.00 0.00 39.48 38.75 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 -2.06 3.45 0.54 4.37 0.00 0.09 -4.93 121.76 123.22 3kcv s ALA 227 Ca 0.45 1.14 -0.21 0.00 0.00 0.00 0.00 51.96 53.34 3kcv s ALA 227 Cb 0.21 -3.86 -0.06 0.00 0.00 0.00 0.00 23.12 19.41 3kcv s ALA 227 CO 0.37 -1.73 1.09 -1.13 0.00 0.00 0.00 175.76 174.36 3kcv n SER 228 N 8.10 1.48 -0.17 0.00 3.41 -1.26 -4.81 113.62 120.36 3kcv n SER 228 Ca 0.21 0.92 0.16 0.00 -0.26 0.00 0.00 58.87 59.89 3kcv n SER 228 Cb 0.42 -1.44 0.51 0.00 -0.26 0.00 0.00 64.21 63.44 3kcv n SER 228 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 3kcv h PRO 229 N 1.07 0.40 -0.29 4.33 0.11 -1.98 0.60 132.00 136.24 3kcv h PRO 229 Ca -0.48 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.64 3kcv h PRO 229 Cb 1.34 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 3kcv h PRO 229 CO 0.54 0.27 0.19 0.93 -0.21 0.00 0.00 178.00 179.72 3kcv h GLU 230 N 0.41 0.23 0.09 1.05 3.07 -1.99 -1.27 114.58 116.18 3kcv h GLU 230 Ca 0.37 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 59.21 3kcv h GLU 230 Cb 0.86 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.72 3kcv h GLU 230 CO -0.12 0.15 -0.04 0.35 -1.40 0.00 0.00 179.01 177.95 3kcv h PHE 231 N 0.24 -0.11 -0.81 4.33 3.57 -1.21 0.15 116.94 123.09 3kcv h PHE 231 Ca 0.12 -0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.74 3kcv h PHE 231 Cb 0.19 0.04 -0.08 0.00 2.79 0.00 0.00 35.95 38.88 3kcv h PHE 231 CO -0.00 0.38 0.43 -1.49 -2.23 0.00 0.00 178.31 175.39 3kcv h TRP 232 N -0.69 0.76 -0.30 0.41 -0.00 -1.41 -1.17 115.95 113.56 3kcv h TRP 232 Ca -0.01 0.03 -0.02 0.00 -0.00 0.00 0.00 58.89 58.89 3kcv h TRP 232 Cb 0.54 -0.22 -0.01 0.00 -0.00 0.00 0.00 29.16 29.47 3kcv h TRP 232 CO 0.10 0.24 0.11 1.15 -0.00 0.00 0.00 178.44 180.04 3kcv h THR 233 N 0.67 1.19 -0.53 1.49 2.02 -1.22 -1.08 112.91 115.45 3kcv h THR 233 Ca 0.42 -0.59 -0.05 0.00 0.77 0.00 0.00 66.41 66.96 3kcv h THR 233 Cb 0.51 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.92 3kcv h THR 233 CO -0.31 0.20 0.14 0.00 0.37 0.00 0.00 175.52 175.92 3kcv h ALA 234 N 0.95 0.70 0.00 6.16 0.00 -0.12 -3.10 119.26 123.85 3kcv h ALA 234 Ca 0.10 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 3kcv h ALA 234 Cb 0.21 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3kcv h ALA 234 CO -0.01 0.39 -0.32 -0.39 0.00 0.00 0.00 179.25 178.92 3kcv h VAL 235 N 0.74 0.44 -1.09 0.00 -1.51 -1.29 -3.48 116.25 110.07 3kcv h VAL 235 Ca 0.17 -1.63 0.00 0.00 -1.23 0.00 0.00 66.70 64.00 3kcv h VAL 235 Cb 0.32 2.20 0.00 0.00 -2.13 0.00 0.00 31.29 31.68 3kcv h VAL 235 CO -0.00 0.25 0.00 0.61 -1.23 0.00 0.00 177.57 177.20 3kcv n GLY 236 N 1.17 0.71 0.00 5.19 0.00 -0.60 -5.09 105.19 106.57 3kcv n GLY 236 Ca 0.03 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 0.16 0.00 -3.47 1.61 2.88 -0.51 -5.06 113.62 109.23 3kcv n SER 237 Ca 0.00 -0.71 -0.11 0.00 -1.33 0.00 0.00 58.87 56.72 3kcv n SER 237 Cb 0.36 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.79 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 -1.80 -1.72 0.44 -1.46 0.00 -1.26 -4.50 121.76 111.47 3kcv s ALA 238 Ca 0.00 0.84 0.20 0.00 0.00 0.00 0.00 51.96 53.00 3kcv s ALA 238 Cb 0.00 0.52 1.17 0.00 0.00 0.00 0.00 23.12 24.81 3kcv s ALA 238 CO 0.00 -0.66 1.86 -1.35 0.00 0.00 0.00 175.76 175.61 3kcv h PRO 239 N 2.16 0.31 -0.84 0.00 0.11 -1.97 0.39 132.00 132.15 3kcv h PRO 239 Ca -0.28 -0.02 0.14 0.00 0.11 0.00 0.00 66.00 65.95 3kcv h PRO 239 Cb 1.26 -0.07 -0.09 0.00 0.11 0.00 0.00 31.00 32.21 3kcv h PRO 239 CO 0.35 0.20 0.44 0.93 -0.21 0.00 0.00 178.00 179.72 3kcv h GLU 240 N 0.32 0.63 -0.57 1.05 3.07 -1.98 -0.81 114.58 116.29 3kcv h GLU 240 Ca 0.46 -0.04 0.17 0.00 -0.50 0.00 0.00 59.36 59.44 3kcv h GLU 240 Cb 1.27 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 29.01 3kcv h GLU 240 CO -0.14 0.42 0.54 -0.91 -1.40 0.00 0.00 179.01 177.52 3kcv h ASN 241 N 0.65 0.00 -1.23 1.42 4.21 -1.31 -2.92 115.58 116.40 3kcv h ASN 241 Ca 0.45 0.00 -0.54 0.00 1.21 0.00 0.00 56.30 57.42 3kcv h ASN 241 Cb 0.60 0.00 -0.42 0.00 -1.12 0.00 0.00 38.32 37.38 3kcv h ASN 241 CO -0.34 0.00 -0.82 0.49 -1.29 0.00 0.00 177.43 175.46 3kcv n PHE 242 N -3.83 2.90 -0.32 1.19 3.72 -0.31 -4.88 117.46 115.94 3kcv n PHE 242 Ca 0.11 -2.83 0.12 0.00 -0.05 0.00 0.00 57.45 54.80 3kcv n PHE 242 Cb 0.76 -0.18 0.29 0.00 -0.94 0.00 0.00 39.48 39.41 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 2.54 0.56 0.17 4.37 4.64 -1.58 -2.24 113.55 122.00 3kcv h SER 243 Ca 0.25 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 3kcv h SER 243 Cb 1.11 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 3kcv h SER 243 CO 0.76 0.16 0.00 1.41 -0.87 0.00 0.00 176.83 178.28 3kcv n HIS 244 N -4.90 0.00 -2.85 4.77 8.25 -1.26 -4.52 115.22 114.71 3kcv n HIS 244 Ca 0.21 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.24 3kcv n HIS 244 Cb 0.57 -0.42 -0.02 0.00 1.12 0.00 0.00 29.99 31.24 3kcv n HIS 244 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3kcv s LEU 245 N -2.84 4.71 0.17 2.41 1.43 -0.84 -4.69 118.68 119.02 3kcv s LEU 245 Ca 0.04 -2.04 -0.02 0.00 -1.03 0.00 0.00 54.13 51.07 3kcv s LEU 245 Cb 0.04 -2.44 -0.04 0.00 0.03 0.00 0.00 46.19 43.78 3kcv s LEU 245 CO 0.10 -1.12 0.12 0.42 0.23 0.00 0.00 176.35 176.10 3kcv s THR 246 N 3.07 0.05 0.19 5.49 -4.23 -1.26 -4.84 115.64 114.10 3kcv s THR 246 Ca 0.37 -1.89 -0.12 0.00 -1.18 0.00 0.00 61.69 58.87 3kcv s THR 246 Cb -0.03 -2.23 0.11 0.00 1.34 0.00 0.00 72.50 71.68 3kcv s THR 246 CO -0.08 -0.23 1.84 -0.37 -0.54 0.00 0.00 174.62 175.24 3kcv h VAL 247 N 2.71 1.18 -0.17 2.29 -1.51 -1.98 -1.19 116.25 117.57 3kcv h VAL 247 Ca -0.35 -0.37 -0.05 0.00 -1.23 0.00 0.00 66.70 64.70 3kcv h VAL 247 Cb 1.23 0.27 -0.00 0.00 -2.13 0.00 0.00 31.29 30.65 3kcv h VAL 247 CO 0.55 0.18 -0.10 -0.03 -1.23 0.00 0.00 177.57 176.94 3kcv h MET 248 N 0.88 0.37 -0.45 5.19 4.05 -1.97 -1.42 114.93 121.58 3kcv h MET 248 Ca 0.23 -0.17 -0.05 0.00 -0.28 0.00 0.00 59.70 59.44 3kcv h MET 248 Cb -0.06 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 30.72 3kcv h MET 248 CO -0.05 0.69 0.09 -0.91 0.23 0.00 0.00 176.91 176.97 3kcv h ASN 249 N 0.04 0.70 0.38 1.39 -0.26 -1.86 -0.84 115.58 115.13 3kcv h ASN 249 Ca 0.04 -0.25 -0.00 0.00 -0.56 0.00 0.00 56.30 55.53 3kcv h ASN 249 Cb 0.59 -0.19 -0.03 0.00 -1.06 0.00 0.00 38.32 37.64 3kcv h ASN 249 CO 0.03 0.77 -0.44 0.15 -1.06 0.00 0.00 177.43 176.88 3kcv h PHE 250 N 0.61 -1.21 -0.81 1.19 3.57 -1.16 0.18 116.94 119.31 3kcv h PHE 250 Ca 0.14 0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.77 3kcv h PHE 250 Cb 0.35 0.48 -0.08 0.00 2.79 0.00 0.00 35.95 39.48 3kcv h PHE 250 CO 0.02 -0.59 0.42 0.82 -2.23 0.00 0.00 178.31 176.76 3kcv h ILE 251 N -0.85 0.79 0.01 1.41 2.04 -1.21 0.41 117.51 120.10 3kcv h ILE 251 Ca -0.03 -0.22 -0.34 0.00 1.00 0.00 0.00 64.86 65.27 3kcv h ILE 251 Cb 0.77 0.09 -0.06 0.00 -0.74 0.00 0.00 36.82 36.88 3kcv h ILE 251 CO -0.10 0.12 -2.08 0.35 0.00 0.00 0.00 178.15 176.44 3kcv n THR 252 N -4.85 1.51 0.62 -0.27 -2.24 -0.33 -1.22 114.28 107.50 3kcv n THR 252 Ca 0.15 -0.81 0.08 0.00 -2.27 0.00 0.00 64.05 61.20 3kcv n THR 252 Cb 0.36 -0.82 0.07 0.00 -2.10 0.00 0.00 70.33 67.84 3kcv n THR 252 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3kcv n ASP 253 N -2.94 2.31 0.00 3.42 10.43 0.62 -4.56 116.55 125.83 3kcv n ASP 253 Ca -0.26 -1.65 0.00 0.00 2.57 0.00 0.00 54.79 55.45 3kcv n ASP 253 Cb 1.10 -0.01 0.00 0.00 1.84 0.00 0.00 41.12 44.05 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 0.86 0.00 -0.16 -2.24 5.15 -0.90 -4.47 115.26 113.51 3kcv n ASN 254 Ca 0.09 0.00 -0.08 0.00 -0.60 0.00 0.00 54.58 54.00 3kcv n ASN 254 Cb 0.39 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.62 3kcv n ASN 254 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 3kcv h LEU 255 N 0.00 -1.28 0.73 1.20 5.85 -1.02 0.13 115.31 120.92 3kcv h LEU 255 Ca 0.00 0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.90 3kcv h LEU 255 Cb 0.00 0.59 0.01 0.00 0.37 0.00 0.00 40.66 41.63 3kcv h LEU 255 CO 0.00 -0.33 -0.35 0.40 -0.34 0.00 0.00 178.44 177.82 3kcv h ILE 256 N -0.24 0.25 -0.42 4.05 2.04 -1.40 -0.30 117.51 121.49 3kcv h ILE 256 Ca 0.18 -0.08 -0.06 0.00 1.00 0.00 0.00 64.86 65.91 3kcv h ILE 256 Cb 0.56 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 3kcv h ILE 256 CO -0.62 0.01 0.02 -0.65 0.00 0.00 0.00 178.15 176.91 3kcv h PRO 257 N -1.04 0.67 -0.36 2.37 0.11 -1.77 -1.86 132.00 130.11 3kcv h PRO 257 Ca -0.10 -0.16 -0.14 0.00 0.11 0.00 0.00 66.00 65.71 3kcv h PRO 257 Cb 0.77 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.78 3kcv h PRO 257 CO 0.16 0.68 -0.35 0.28 -0.21 0.00 0.00 178.00 178.56 3kcv h VAL 258 N 0.64 1.28 -0.49 3.15 2.07 -0.65 -1.10 116.25 121.14 3kcv h VAL 258 Ca 0.13 -1.51 -0.07 0.00 0.82 0.00 0.00 66.70 66.06 3kcv h VAL 258 Cb 0.37 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 3kcv h VAL 258 CO 0.01 0.50 0.01 0.74 0.02 0.00 0.00 177.57 178.86 3kcv h THR 259 N 0.69 1.26 -0.15 2.57 2.02 -0.89 0.97 112.91 119.37 3kcv h THR 259 Ca 0.07 -1.05 0.02 0.00 0.77 0.00 0.00 66.41 66.22 3kcv h THR 259 Cb 0.91 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 68.26 3kcv h THR 259 CO 0.08 0.37 0.03 0.40 0.37 0.00 0.00 175.52 176.77 3kcv h ILE 260 N 0.72 0.93 -0.57 3.11 2.04 -1.12 -1.16 117.51 121.46 3kcv h ILE 260 Ca 0.14 -0.03 -0.08 0.00 1.00 0.00 0.00 64.86 65.89 3kcv h ILE 260 Cb 0.49 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 3kcv h ILE 260 CO 0.02 0.02 0.04 1.23 0.00 0.00 0.00 178.15 179.46 3kcv h GLY 261 N 0.09 1.06 0.13 5.37 0.00 -1.13 -0.78 103.07 107.80 3kcv h GLY 261 Ca 0.07 -0.75 0.07 0.00 0.00 0.00 0.00 47.33 46.72 3kcv h GLY 261 CO -0.09 0.69 -0.22 3.43 0.00 0.00 0.00 176.54 180.35 3kcv h ASN 262 N 0.87 -0.71 -0.83 0.19 -0.26 -0.59 0.90 115.58 115.16 3kcv h ASN 262 Ca 0.17 0.14 0.04 0.00 -0.56 0.00 0.00 56.30 56.08 3kcv h ASN 262 Cb 0.49 0.35 -0.05 0.00 -1.06 0.00 0.00 38.32 38.05 3kcv h ASN 262 CO 0.02 -0.25 0.53 0.40 -1.06 0.00 0.00 177.43 177.07 3kcv h ILE 263 N -0.19 1.12 -0.70 2.81 2.04 -0.98 -1.60 117.51 120.01 3kcv h ILE 263 Ca 0.16 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 3kcv h ILE 263 Cb 0.43 0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.49 3kcv h ILE 263 CO -0.41 0.19 0.37 0.40 0.00 0.00 0.00 178.15 178.69 3kcv h ILE 264 N 1.02 1.21 -0.14 -0.67 2.04 -0.41 0.12 117.51 120.68 3kcv h ILE 264 Ca 0.33 -0.55 -0.10 0.00 1.00 0.00 0.00 64.86 65.54 3kcv h ILE 264 Cb 0.03 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 3kcv h ILE 264 CO -0.12 0.24 -0.36 1.23 0.00 0.00 0.00 178.15 179.15 3kcv h GLY 265 N 1.03 0.33 0.50 5.37 0.00 0.01 -0.12 103.07 110.19 3kcv h GLY 265 Ca 0.25 -0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 3kcv h GLY 265 CO -0.04 0.26 -0.05 -1.33 0.00 0.00 0.00 176.54 175.38 3kcv h GLY 266 N 1.13 0.09 0.70 4.60 0.00 -1.05 -2.56 103.07 105.98 3kcv h GLY 266 Ca 0.03 -0.11 0.05 0.00 0.00 0.00 0.00 47.33 47.30 3kcv h GLY 266 CO 0.06 0.10 0.26 -1.33 0.00 0.00 0.00 176.54 175.63 3kcv h GLY 267 N -0.45 0.74 1.48 4.60 0.00 -0.61 0.25 103.07 109.08 3kcv h GLY 267 Ca 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 47.33 47.11 3kcv h GLY 267 CO 0.01 0.11 0.10 1.41 0.00 0.00 0.00 176.54 178.17 3kcv h LEU 268 N 0.51 0.61 -0.38 3.11 3.38 -1.11 0.82 115.31 122.26 3kcv h LEU 268 Ca 0.23 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 58.03 3kcv h LEU 268 Cb 0.15 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3kcv h LEU 268 CO -0.17 0.61 -0.08 -0.07 0.09 0.00 0.00 178.44 178.83 3kcv h LEU 269 N 0.64 0.72 0.65 1.67 3.38 -0.80 -1.21 115.31 120.35 3kcv h LEU 269 Ca 0.15 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 3kcv h LEU 269 Cb 0.25 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3kcv h LEU 269 CO -0.00 0.91 -0.51 0.58 0.09 0.00 0.00 178.44 179.51 3kcv h VAL 270 N 0.52 0.00 -0.54 1.22 2.07 -0.62 0.24 116.25 119.14 3kcv h VAL 270 Ca 0.10 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.67 3kcv h VAL 270 Cb 0.59 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.29 3kcv h VAL 270 CO 0.03 0.00 -0.39 1.23 0.02 0.00 0.00 177.57 178.47 3kcv h GLY 271 N -1.11 -1.42 0.00 2.17 0.00 -0.80 0.82 103.07 102.73 3kcv h GLY 271 Ca -0.08 0.87 0.00 0.00 0.00 0.00 0.00 47.33 48.12 3kcv h GLY 271 CO 0.01 -0.32 0.00 -0.10 0.00 0.00 0.00 176.54 176.14 3kcv n LEU 272 N -4.50 0.00 -0.31 3.11 7.94 -0.46 -2.12 117.00 120.65 3kcv n LEU 272 Ca 0.00 0.94 0.22 0.00 -1.11 0.00 0.00 56.01 56.07 3kcv n LEU 272 Cb 0.19 -0.44 0.51 0.00 0.53 0.00 0.00 43.42 44.21 3kcv n LEU 272 CO -0.07 -0.44 1.22 0.74 -1.11 0.00 0.00 177.39 177.73 3kcv h THR 273 N 0.00 0.55 -0.34 1.96 2.02 -0.49 0.30 112.91 116.91 3kcv h THR 273 Ca 0.00 -0.13 0.04 0.00 0.77 0.00 0.00 66.41 67.08 3kcv h THR 273 Cb 0.00 0.12 -0.06 0.00 -1.74 0.00 0.00 68.15 66.48 3kcv h THR 273 CO 0.00 0.07 -0.34 0.22 0.37 0.00 0.00 175.52 175.84 3kcv h TYR 274 N 0.39 -1.05 -0.72 3.16 -0.00 -0.71 -0.74 116.97 117.31 3kcv h TYR 274 Ca 0.57 0.06 -0.03 0.00 -0.00 0.00 0.00 58.73 59.33 3kcv h TYR 274 Cb 1.46 0.50 -0.03 0.00 -0.00 0.00 0.00 36.73 38.66 3kcv h TYR 274 CO -0.00 -0.27 0.31 -1.49 -0.00 0.00 0.00 178.16 176.71 3kcv h TRP 275 N -0.17 1.04 0.00 -3.82 4.06 0.10 -0.71 115.95 116.45 3kcv h TRP 275 Ca 0.06 -0.06 0.00 0.00 2.06 0.00 0.00 58.89 60.95 3kcv h TRP 275 Cb 0.32 -0.32 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 3kcv h TRP 275 CO -0.77 0.78 0.00 0.28 -3.56 0.00 0.00 178.44 175.17 3kcv n VAL 276 N -4.31 0.00 0.06 1.49 0.31 -0.60 -0.67 118.33 114.60 3kcv n VAL 276 Ca 0.07 0.92 0.01 0.00 -0.01 0.00 0.00 64.34 65.33 3kcv n VAL 276 Cb 0.16 -1.80 0.03 0.00 -0.91 0.00 0.00 33.84 31.32 3kcv n VAL 276 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3kcv n ILE 277 N -0.53 1.43 -0.03 2.52 5.41 -0.33 -2.07 119.36 125.77 3kcv n ILE 277 Ca 0.00 0.36 -0.15 0.00 1.00 0.00 0.00 62.75 63.95 3kcv n ILE 277 Cb 0.00 -1.33 -0.12 0.00 -0.71 0.00 0.00 39.64 37.48 3kcv n ILE 277 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 176.55 176.77 3kcv h TYR 278 N 0.00 0.20 -0.02 1.39 3.20 -0.78 -3.51 116.97 117.45 3kcv h TYR 278 Ca 0.00 -0.12 0.00 0.00 3.14 0.00 0.00 58.73 61.75 3kcv h TYR 278 Cb 0.02 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.27 3kcv h TYR 278 CO 0.00 0.97 0.00 1.28 -1.64 0.00 0.00 178.16 178.77