#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jpn h LEU 11 N 0.00 0.88 -4.33 3.22 5.85 -1.94 -3.00 115.31 115.99 3jpn h LEU 11 Ca 0.00 -0.12 -0.45 0.00 0.84 0.00 0.00 57.88 58.16 3jpn h LEU 11 Cb 0.00 -0.23 -0.42 0.00 0.37 0.00 0.00 40.66 40.38 3jpn h LEU 11 CO 0.00 0.78 -0.92 0.59 -0.34 0.00 0.00 178.44 178.55 3jpn n ASN 12 N -4.31 3.78 -0.30 1.25 3.02 -1.26 -4.78 115.26 112.66 3jpn n ASN 12 Ca 0.06 -3.17 0.03 0.00 -0.03 0.00 0.00 54.58 51.47 3jpn n ASN 12 Cb 0.17 -0.39 0.17 0.00 -0.61 0.00 0.00 39.78 39.11 3jpn n ASN 12 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 3jpn h GLY 13 N 2.34 1.29 0.45 7.41 0.00 -1.94 -1.70 103.07 110.92 3jpn h GLY 13 Ca 0.20 -0.33 0.01 0.00 0.00 0.00 0.00 47.33 47.21 3jpn h GLY 13 CO 0.57 0.14 -0.35 -1.33 0.00 0.00 0.00 176.54 175.57 3jpn h GLY 14 N 0.82 -0.73 0.99 4.60 0.00 -1.90 0.55 103.07 107.40 3jpn h GLY 14 Ca 0.40 0.42 0.00 0.00 0.00 0.00 0.00 47.33 48.15 3jpn h GLY 14 CO -0.24 -0.27 0.10 -2.22 0.00 0.00 0.00 176.54 173.91 3jpn h ILE 15 N -0.63 1.05 -0.45 2.60 2.04 -1.92 -1.51 117.51 118.71 3jpn h ILE 15 Ca 0.01 -0.11 -0.05 0.00 1.00 0.00 0.00 64.86 65.71 3jpn h ILE 15 Cb 0.63 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 3jpn h ILE 15 CO -0.17 0.05 0.07 0.71 0.00 0.00 0.00 178.15 178.81 3jpn h THR 16 N 0.20 1.21 -0.44 -0.27 1.35 -1.15 -0.65 112.91 113.16 3jpn h THR 16 Ca 0.06 -0.79 -0.02 0.00 -0.55 0.00 0.00 66.41 65.11 3jpn h THR 16 Cb -0.01 0.79 -0.02 0.00 -1.73 0.00 0.00 68.15 67.19 3jpn h THR 16 CO -0.01 0.28 0.21 0.44 -0.25 0.00 0.00 175.52 176.19 3jpn h ASP 17 N 0.66 0.59 -0.48 5.36 3.32 -0.64 -0.43 116.42 124.80 3jpn h ASP 17 Ca 0.14 -0.14 0.01 0.00 0.02 0.00 0.00 57.03 57.06 3jpn h ASP 17 Cb 0.31 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 3jpn h ASP 17 CO 0.00 0.56 0.32 -0.03 -1.72 0.00 0.00 179.24 178.37 3jpn h MET 18 N 0.57 0.62 -0.76 3.56 1.85 -0.58 -0.79 114.93 119.40 3jpn h MET 18 Ca 0.15 -0.04 -0.04 0.00 -0.61 0.00 0.00 59.70 59.16 3jpn h MET 18 Cb 0.13 -0.14 -0.03 0.00 0.43 0.00 0.00 31.60 31.99 3jpn h MET 18 CO -0.02 0.41 0.32 -0.07 -0.40 0.00 0.00 176.91 177.16 3jpn h LEU 19 N 0.64 1.03 -0.62 3.39 3.38 -0.86 -1.24 115.31 121.04 3jpn h LEU 19 Ca 0.18 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 3jpn h LEU 19 Cb -0.07 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 3jpn h LEU 19 CO -0.04 0.90 0.03 0.74 0.09 0.00 0.00 178.44 180.16 3jpn h THR 20 N 1.10 1.26 -0.78 0.22 2.02 -0.55 0.19 112.91 116.37 3jpn h THR 20 Ca 0.26 -1.11 -0.03 0.00 0.77 0.00 0.00 66.41 66.30 3jpn h THR 20 Cb 0.18 0.76 -0.04 0.00 -1.74 0.00 0.00 68.15 67.32 3jpn h THR 20 CO -0.03 0.41 0.38 -0.08 0.37 0.00 0.00 175.52 176.57 3jpn h GLU 21 N 0.97 1.13 -0.58 6.66 4.81 -0.78 0.11 114.58 126.90 3jpn h GLU 21 Ca 0.18 -0.17 -0.10 0.00 -0.13 0.00 0.00 59.36 59.14 3jpn h GLU 21 Cb 0.52 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.68 3jpn h GLU 21 CO 0.02 0.87 -0.04 -0.07 -0.73 0.00 0.00 179.01 179.07 3jpn h LEU 22 N 1.11 1.02 -0.20 1.64 3.38 -0.76 -1.55 115.31 119.94 3jpn h LEU 22 Ca 0.27 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3jpn h LEU 22 Cb 0.12 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 3jpn h LEU 22 CO -0.03 1.09 0.10 0.00 0.09 0.00 0.00 178.44 179.69 3jpn h ALA 23 N 1.00 0.26 -0.71 1.53 0.00 0.05 -1.99 119.26 119.41 3jpn h ALA 23 Ca 0.16 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3jpn h ALA 23 Cb 0.60 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 3jpn h ALA 23 CO 0.04 -0.18 0.44 -0.91 0.00 0.00 0.00 179.25 178.64 3jpn h ASN 24 N 0.20 0.84 -0.24 0.00 2.35 -0.61 -1.86 115.58 116.26 3jpn h ASN 24 Ca 0.07 -0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.76 3jpn h ASN 24 Cb 0.11 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 3jpn h ASN 24 CO -0.01 0.63 0.07 0.15 -1.65 0.00 0.00 177.43 176.62 3jpn h PHE 25 N 0.97 0.40 -0.83 1.19 3.04 -0.99 0.78 116.94 121.49 3jpn h PHE 25 Ca 0.26 -0.04 -0.02 0.00 3.98 0.00 0.00 57.97 62.15 3jpn h PHE 25 Cb -0.06 -0.11 -0.04 0.00 2.56 0.00 0.00 35.95 38.29 3jpn h PHE 25 CO 0.00 0.46 0.45 0.93 -2.02 0.00 0.00 178.31 178.14 3jpn h GLU 26 N 0.22 1.17 0.24 1.11 4.39 -1.04 0.39 114.58 121.05 3jpn h GLU 26 Ca 0.08 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 3jpn h GLU 26 Cb 0.26 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 3jpn h GLU 26 CO -0.00 0.86 -0.12 -0.22 -1.16 0.00 0.00 179.01 178.37 3jpn h LYS 27 N 1.16 -0.31 0.12 2.33 3.64 -1.22 0.65 116.57 122.95 3jpn h LYS 27 Ca 0.29 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.69 3jpn h LYS 27 Cb 0.03 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 3jpn h LYS 27 CO -0.05 0.06 -0.06 -0.91 -2.27 0.00 0.00 179.45 176.23 3jpn h ASN 28 N -0.84 -0.13 0.00 4.20 2.35 -0.84 -3.10 115.58 117.22 3jpn h ASN 28 Ca -0.03 -0.43 -0.02 0.00 -0.55 0.00 0.00 56.30 55.26 3jpn h ASN 28 Cb 0.51 0.03 -0.00 0.00 0.05 0.00 0.00 38.32 38.91 3jpn h ASN 28 CO 0.05 0.45 -0.26 0.58 -1.65 0.00 0.00 177.43 176.61 3jpn h VAL 29 N -0.82 0.38 0.00 2.81 2.07 -1.12 -3.39 116.25 116.18 3jpn h VAL 29 Ca -0.02 -1.33 -0.01 0.00 0.82 0.00 0.00 66.70 66.17 3jpn h VAL 29 Cb 0.56 0.76 -0.00 0.00 -1.52 0.00 0.00 31.29 31.09 3jpn h VAL 29 CO 0.03 0.13 -0.04 0.28 0.02 0.00 0.00 177.57 177.99 3jpn h SER 30 N -1.00 0.00 -6.07 0.57 0.02 -1.26 -3.47 113.55 102.33 3jpn h SER 30 Ca -0.03 0.00 -0.42 0.00 -0.84 0.00 0.00 61.79 60.49 3jpn h SER 30 Cb 0.42 0.00 0.05 0.00 0.14 0.00 0.00 62.40 63.02 3jpn h SER 30 CO -0.02 0.04 -0.79 0.00 -1.14 0.00 0.00 176.83 174.92 3jpn n GLN 31 N -3.13 -5.62 -3.86 3.45 6.02 0.19 -4.93 117.38 109.51 3jpn n GLN 31 Ca 0.02 0.66 -0.30 0.00 -0.01 0.00 0.00 57.00 57.37 3jpn n GLN 31 Cb 0.40 -5.42 -0.11 0.00 1.02 0.00 0.00 30.24 26.13 3jpn n GLN 31 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3jpn s ALA 32 N -3.49 3.85 0.29 -1.58 0.00 0.98 -4.98 121.76 116.83 3jpn s ALA 32 Ca 0.26 -3.80 0.03 0.00 0.00 0.00 0.00 51.96 48.45 3jpn s ALA 32 Cb -0.12 -2.27 0.65 0.00 0.00 0.00 0.00 23.12 21.37 3jpn s ALA 32 CO 0.80 -2.10 1.79 0.97 0.00 0.00 0.00 175.76 177.22 3jpn h ILE 33 N 4.44 0.76 -0.01 0.00 6.09 -1.90 -1.46 117.51 125.42 3jpn h ILE 33 Ca 0.13 -0.27 -0.09 0.00 -1.37 0.00 0.00 64.86 63.25 3jpn h ILE 33 Cb 0.77 -0.10 -0.01 0.00 0.47 0.00 0.00 36.82 37.95 3jpn h ILE 33 CO 0.74 0.14 -0.44 0.45 -3.07 0.00 0.00 178.15 175.97 3jpn h HIS 34 N 0.79 0.02 -0.01 2.19 3.86 -1.96 -0.47 115.15 119.57 3jpn h HIS 34 Ca 0.54 -0.01 -0.23 0.00 -1.16 0.00 0.00 60.37 59.51 3jpn h HIS 34 Cb 0.76 -0.01 0.01 0.00 1.06 0.00 0.00 27.41 29.23 3jpn h HIS 34 CO -0.02 0.46 -0.95 0.87 0.86 0.00 0.00 177.93 179.15 3jpn h LYS 35 N 0.02 0.47 -0.06 2.45 1.57 -1.76 -1.28 116.57 117.97 3jpn h LYS 35 Ca -0.00 -0.50 0.03 0.00 -1.87 0.00 0.00 60.65 58.30 3jpn h LYS 35 Cb 0.78 0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.20 3jpn h LYS 35 CO 0.06 1.14 -0.09 -0.92 -0.57 0.00 0.00 179.45 179.07 3jpn h TYR 36 N 0.27 -0.23 -0.08 -1.35 3.20 -0.80 -1.05 116.97 116.93 3jpn h TYR 36 Ca -0.09 0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.71 3jpn h TYR 36 Cb 1.58 0.11 -0.01 0.00 1.54 0.00 0.00 36.73 39.95 3jpn h TYR 36 CO 0.07 -0.14 -0.36 -0.91 -1.64 0.00 0.00 178.16 175.17 3jpn h ASN 37 N -0.13 0.17 -0.39 -2.11 2.35 -1.06 -1.42 115.58 112.98 3jpn h ASN 37 Ca 0.06 -0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 3jpn h ASN 37 Cb 0.21 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 3jpn h ASN 37 CO -0.14 0.52 0.03 0.00 -1.65 0.00 0.00 177.43 176.19 3jpn h ALA 38 N 1.49 0.53 -0.58 -0.83 0.00 -0.76 0.03 119.26 119.14 3jpn h ALA 38 Ca 0.02 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 3jpn h ALA 38 Cb 0.71 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 3jpn h ALA 38 CO 0.05 0.28 0.06 1.88 0.00 0.00 0.00 179.25 181.52 3jpn h TYR 39 N 0.51 1.07 -0.56 0.00 0.05 -1.00 -1.84 116.97 115.21 3jpn h TYR 39 Ca 0.11 -0.16 -0.02 0.00 0.05 0.00 0.00 58.73 58.71 3jpn h TYR 39 Cb 0.43 -0.29 -0.03 0.00 1.01 0.00 0.00 36.73 37.86 3jpn h TYR 39 CO 0.03 0.94 0.26 0.00 -1.05 0.00 0.00 178.16 178.34 3jpn h ARG 40 N 0.89 0.81 -0.44 4.88 3.08 -1.06 -0.35 114.38 122.18 3jpn h ARG 40 Ca 0.17 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 3jpn h ARG 40 Cb 0.48 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 3jpn h ARG 40 CO 0.02 0.66 0.21 -0.22 -1.07 0.00 0.00 179.97 179.58 3jpn h LYS 41 N 0.75 0.63 -0.57 0.04 3.64 -0.85 0.16 116.57 120.38 3jpn h LYS 41 Ca 0.19 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.46 3jpn h LYS 41 Cb 0.13 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.81 3jpn h LYS 41 CO -0.02 0.54 0.30 0.00 -2.27 0.00 0.00 179.45 178.00 3jpn h ALA 42 N 1.06 0.73 -0.25 5.00 0.00 -1.14 0.19 119.26 124.86 3jpn h ALA 42 Ca 0.15 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3jpn h ALA 42 Cb 0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3jpn h ALA 42 CO -0.02 0.26 0.15 0.00 0.00 0.00 0.00 179.25 179.64 3jpn h ALA 43 N 1.13 0.31 0.10 0.00 0.00 -0.76 -1.11 119.26 118.94 3jpn h ALA 43 Ca 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3jpn h ALA 43 Cb 0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3jpn h ALA 43 CO -0.03 -0.18 -0.08 1.03 0.00 0.00 0.00 179.25 179.99 3jpn h SER 44 N 0.31 -0.21 -0.17 0.00 0.87 -0.18 0.24 113.55 114.41 3jpn h SER 44 Ca 0.09 0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.64 3jpn h SER 44 Cb 0.01 0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 3jpn h SER 44 CO -0.02 -0.13 0.03 1.62 -0.53 0.00 0.00 176.83 177.81 3jpn h VAL 45 N -0.19 1.14 0.02 2.23 3.04 -0.53 -2.76 116.25 119.21 3jpn h VAL 45 Ca -0.00 -0.54 -0.24 0.00 -1.01 0.00 0.00 66.70 64.91 3jpn h VAL 45 Cb 0.17 0.91 0.01 0.00 -2.01 0.00 0.00 31.29 30.38 3jpn h VAL 45 CO -0.01 0.19 -1.01 0.40 -1.01 0.00 0.00 177.57 176.12 3jpn h ILE 46 N 0.37 1.37 0.00 3.17 2.04 -0.88 -3.08 117.51 120.50 3jpn h ILE 46 Ca 0.09 -2.45 -0.02 0.00 1.00 0.00 0.00 64.86 63.48 3jpn h ILE 46 Cb 0.20 2.47 -0.00 0.00 -0.74 0.00 0.00 36.82 38.75 3jpn h ILE 46 CO 0.00 0.74 -0.09 0.00 0.00 0.00 0.00 178.15 178.80 3jpn h ALA 47 N 0.62 1.23 0.00 1.87 0.00 -0.67 -1.84 119.26 120.47 3jpn h ALA 47 Ca -0.10 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3jpn h ALA 47 Cb 1.66 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.43 3jpn h ALA 47 CO 0.18 0.11 -0.76 1.17 0.00 0.00 0.00 179.25 179.95 3jpn n LYS 48 N -3.53 0.29 -1.93 0.00 4.81 -1.11 -4.85 118.16 111.85 3jpn n LYS 48 Ca -0.02 0.06 -0.42 0.00 -0.87 0.00 0.00 58.31 57.06 3jpn n LYS 48 Cb 0.22 -1.66 -0.03 0.00 0.02 0.00 0.00 35.03 33.59 3jpn n LYS 48 CO 0.00 0.00 0.00 -0.47 1.17 0.00 0.00 177.40 178.10 3jpn s TYR 49 N -3.18 1.84 -1.15 5.64 5.04 -0.69 -4.89 117.35 119.96 3jpn s TYR 49 Ca 0.05 0.05 0.00 0.00 -2.44 0.00 0.00 57.07 54.73 3jpn s TYR 49 Cb 0.14 -4.00 0.00 0.00 0.35 0.00 0.00 41.96 38.45 3jpn s TYR 49 CO 0.75 -4.25 0.48 -0.35 -1.34 0.00 0.00 175.55 170.83 3jpn n PRO 50 N 7.13 0.83 -4.15 4.97 -0.04 -1.26 -4.80 135.00 137.69 3jpn n PRO 50 Ca 0.18 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.47 3jpn n PRO 50 Cb 0.42 -1.35 -0.12 0.00 -0.04 0.00 0.00 33.50 32.41 3jpn n PRO 50 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 3jpn s HIS 51 N -1.15 1.05 -0.56 0.54 3.76 -1.26 -5.09 115.29 112.57 3jpn s HIS 51 Ca 0.00 -0.46 -0.28 0.00 -0.15 0.00 0.00 55.06 54.17 3jpn s HIS 51 Cb 0.00 -0.60 0.02 0.00 1.11 0.00 0.00 32.58 33.12 3jpn s HIS 51 CO 0.00 0.01 1.27 0.21 -0.85 0.00 0.00 174.74 175.38 3jpn s LYS 52 N -1.65 3.47 0.18 1.40 2.20 -1.26 -4.84 119.74 119.24 3jpn s LYS 52 Ca -0.04 0.36 -0.33 0.00 -0.36 0.00 0.00 55.97 55.60 3jpn s LYS 52 Cb -0.10 -4.04 -0.15 0.00 -1.51 0.00 0.00 37.83 32.03 3jpn s LYS 52 CO 0.02 -1.74 1.37 -0.89 -0.36 0.00 0.00 175.35 173.75 3jpn n ILE 53 N 6.76 0.61 -0.01 5.43 5.41 -1.26 -4.91 119.36 131.37 3jpn n ILE 53 Ca 0.10 -0.15 0.05 0.00 1.00 0.00 0.00 62.75 63.75 3jpn n ILE 53 Cb 0.49 -1.22 -0.11 0.00 -0.71 0.00 0.00 39.64 38.09 3jpn n ILE 53 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 3jpn n LYS 54 N 2.30 0.64 -3.55 0.38 5.02 -1.26 -5.05 118.16 116.64 3jpn n LYS 54 Ca 0.15 -0.11 -0.12 0.00 -2.02 0.00 0.00 58.31 56.21 3jpn n LYS 54 Cb 0.27 -1.33 -0.04 0.00 -0.02 0.00 0.00 35.03 33.91 3jpn n LYS 54 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3jpn s SER 55 N -3.75 -0.40 0.42 4.39 1.04 -1.26 -5.01 113.70 109.13 3jpn s SER 55 Ca -0.05 -0.06 0.09 0.00 0.48 0.00 0.00 55.95 56.42 3jpn s SER 55 Cb 0.08 0.52 0.92 0.00 0.10 0.00 0.00 66.02 67.63 3jpn s SER 55 CO 0.57 -0.84 2.03 1.23 0.98 0.00 0.00 173.24 177.21 3jpn h GLY 56 N 2.41 0.37 0.99 7.32 0.00 -1.84 -1.84 103.07 110.47 3jpn h GLY 56 Ca -0.33 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 46.84 3jpn h GLY 56 CO 0.42 0.16 0.24 0.00 0.00 0.00 0.00 176.54 177.36 3jpn h ALA 57 N 1.76 0.48 -0.93 3.60 0.00 -1.95 0.23 119.26 122.45 3jpn h ALA 57 Ca 0.09 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3jpn h ALA 57 Cb 0.09 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 3jpn h ALA 57 CO -0.01 -0.04 0.61 1.49 0.00 0.00 0.00 179.25 181.30 3jpn h GLU 58 N 0.51 1.22 -0.24 0.00 4.81 -1.76 -2.72 114.58 116.41 3jpn h GLU 58 Ca 0.14 -0.08 -0.16 0.00 -0.13 0.00 0.00 59.36 59.13 3jpn h GLU 58 Cb -0.03 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 29.07 3jpn h GLU 58 CO -0.03 0.81 -0.50 0.00 -0.73 0.00 0.00 179.01 178.57 3jpn h ALA 59 N 1.42 0.68 0.00 2.92 0.00 -0.63 -3.00 119.26 120.64 3jpn h ALA 59 Ca 0.34 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3jpn h ALA 59 Cb -0.14 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.56 3jpn h ALA 59 CO -0.07 0.68 0.00 -0.22 0.00 0.00 0.00 179.25 179.63 3jpn h LYS 60 N 0.51 0.00 -0.11 0.00 3.64 -0.25 -0.95 116.57 119.41 3jpn h LYS 60 Ca 0.02 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.32 3jpn h LYS 60 Cb 1.05 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 3jpn h LYS 60 CO 0.10 0.00 -0.31 0.87 -2.27 0.00 0.00 179.45 177.84 3jpn h LYS 61 N 0.00 0.20 -6.80 1.90 1.57 -1.49 -3.43 116.57 108.52 3jpn h LYS 61 Ca 0.00 -0.07 -0.51 0.00 -1.87 0.00 0.00 60.65 58.20 3jpn h LYS 61 Cb 0.14 -0.01 0.02 0.00 0.08 0.00 0.00 32.23 32.46 3jpn h LYS 61 CO 0.00 0.50 0.50 -0.51 -0.57 0.00 0.00 179.45 179.37 3jpn s LEU 62 N -8.42 4.53 -0.02 2.94 1.43 -0.36 -4.97 118.68 113.80 3jpn s LEU 62 Ca -0.05 2.31 -0.30 0.00 -1.03 0.00 0.00 54.13 55.07 3jpn s LEU 62 Cb 0.14 -3.63 -0.05 0.00 0.03 0.00 0.00 46.19 42.68 3jpn s LEU 62 CO 0.75 -0.22 1.43 -2.16 0.23 0.00 0.00 176.35 176.39 3jpn s PRO 63 N -1.33 4.26 0.00 1.29 0.04 -1.26 -2.42 135.00 135.57 3jpn s PRO 63 Ca 0.46 1.99 0.00 0.00 0.04 0.00 0.00 61.00 63.49 3jpn s PRO 63 Cb -0.33 -3.64 0.00 0.00 0.04 0.00 0.00 34.50 30.57 3jpn s PRO 63 CO 0.42 -0.63 0.00 0.41 0.04 0.00 0.00 177.00 177.24 3jpn n GLY 64 N 3.72 2.01 3.56 0.56 0.00 -1.26 -4.90 105.19 108.89 3jpn n GLY 64 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 3jpn n GLY 64 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3jpn s VAL 65 N -1.90 4.88 0.00 1.61 1.01 -1.02 -4.39 120.40 120.59 3jpn s VAL 65 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.00 3jpn s VAL 65 Cb 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 33.10 3jpn s VAL 65 CO 0.00 0.34 0.00 0.61 0.00 0.00 0.00 175.10 176.05 3jpn n GLY 66 N 4.60 5.85 0.06 4.51 0.00 -1.26 -4.60 105.19 114.34 3jpn n GLY 66 Ca -0.15 -2.04 -0.12 0.00 0.00 0.00 0.00 46.02 43.71 3jpn n GLY 66 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3jpn h THR 67 N 0.05 1.03 -0.23 2.61 2.02 -1.98 -1.69 112.91 114.72 3jpn h THR 67 Ca 0.00 -0.07 0.03 0.00 0.77 0.00 0.00 66.41 67.14 3jpn h THR 67 Cb 0.00 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.36 3jpn h THR 67 CO 0.00 0.02 0.06 0.11 0.37 0.00 0.00 175.52 176.08 3jpn h LYS 68 N 0.05 0.15 0.00 6.66 1.79 -2.00 -1.59 116.57 121.63 3jpn h LYS 68 Ca 0.02 -0.01 -0.11 0.00 -2.18 0.00 0.00 60.65 58.37 3jpn h LYS 68 Cb 0.01 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.61 3jpn h LYS 68 CO -0.00 0.10 -0.51 0.82 -1.08 0.00 0.00 179.45 178.78 3jpn h ILE 69 N 0.16 1.33 0.11 1.86 2.04 -1.95 -2.63 117.51 118.43 3jpn h ILE 69 Ca 0.10 -1.76 -0.01 0.00 1.00 0.00 0.00 64.86 64.20 3jpn h ILE 69 Cb 0.09 1.96 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 3jpn h ILE 69 CO -0.12 0.50 -0.05 0.00 0.00 0.00 0.00 178.15 178.47 3jpn h ALA 70 N 1.49 -0.15 -0.52 1.87 0.00 -0.81 -0.98 119.26 120.16 3jpn h ALA 70 Ca -0.01 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.89 3jpn h ALA 70 Cb 0.92 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.72 3jpn h ALA 70 CO 0.07 -0.55 0.25 0.93 0.00 0.00 0.00 179.25 179.95 3jpn h GLU 71 N -0.23 0.47 -0.56 0.00 5.08 -1.18 -1.80 114.58 116.36 3jpn h GLU 71 Ca -0.02 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.32 3jpn h GLU 71 Cb 0.18 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 3jpn h GLU 71 CO 0.03 0.31 0.37 0.87 -1.00 0.00 0.00 179.01 179.59 3jpn h LYS 72 N 0.48 0.74 -0.27 2.33 1.57 -1.19 -1.60 116.57 118.63 3jpn h LYS 72 Ca 0.23 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 58.84 3jpn h LYS 72 Cb 0.16 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3jpn h LYS 72 CO -0.18 0.49 -0.37 0.82 -0.57 0.00 0.00 179.45 179.65 3jpn h ILE 73 N 0.76 1.29 -0.37 1.86 2.04 -0.38 -0.44 117.51 122.27 3jpn h ILE 73 Ca 0.21 -1.52 -0.05 0.00 1.00 0.00 0.00 64.86 64.50 3jpn h ILE 73 Cb -0.09 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 3jpn h ILE 73 CO -0.04 0.48 0.03 0.44 0.00 0.00 0.00 178.15 179.06 3jpn h ASP 74 N 0.52 0.61 0.03 1.72 3.32 -0.63 0.17 116.42 122.16 3jpn h ASP 74 Ca 0.05 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 56.82 3jpn h ASP 74 Cb 0.87 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.25 3jpn h ASP 74 CO 0.08 0.74 -0.05 -0.08 -1.72 0.00 0.00 179.24 178.21 3jpn h GLU 75 N 0.46 -0.10 -0.77 3.56 4.81 -1.14 0.20 114.58 121.60 3jpn h GLU 75 Ca 0.11 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.38 3jpn h GLU 75 Cb 0.41 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.76 3jpn h GLU 75 CO 0.01 -0.07 0.49 0.35 -0.73 0.00 0.00 179.01 179.06 3jpn h PHE 76 N -0.10 0.91 -0.37 0.92 3.57 -0.91 0.13 116.94 121.09 3jpn h PHE 76 Ca 0.01 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.47 3jpn h PHE 76 Cb 0.11 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 38.53 3jpn h PHE 76 CO -0.11 0.52 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.39 3jpn h LEU 77 N 0.94 0.56 -0.00 0.59 3.38 -0.19 0.42 115.31 121.01 3jpn h LEU 77 Ca 0.31 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 3jpn h LEU 77 Cb 0.03 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.63 3jpn h LEU 77 CO -0.12 0.66 -0.08 0.00 0.09 0.00 0.00 178.44 178.99 3jpn h ALA 78 N 1.41 0.02 0.00 1.53 0.00 0.35 -3.40 119.26 119.17 3jpn h ALA 78 Ca 0.11 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3jpn h ALA 78 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3jpn h ALA 78 CO 0.02 -0.06 -1.86 0.25 0.00 0.00 0.00 179.25 177.60 3jpn n THR 79 N -4.66 0.00 -0.50 0.00 -2.24 0.37 -4.99 114.28 102.26 3jpn n THR 79 Ca -0.09 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 3jpn n THR 79 Cb 0.41 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 3jpn n THR 79 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3jpn n GLY 80 N 1.43 0.74 3.84 3.38 0.00 0.15 -5.02 105.19 109.70 3jpn n GLY 80 Ca -0.03 -0.07 -0.07 0.00 0.00 0.00 0.00 46.02 45.84 3jpn n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3jpn s LYS 81 N -0.57 1.95 -0.08 1.61 -2.85 -1.24 -5.02 119.74 113.54 3jpn s LYS 81 Ca 0.00 -1.27 0.00 0.00 -1.00 0.00 0.00 55.97 53.70 3jpn s LYS 81 Cb 0.00 0.54 0.02 0.00 -2.06 0.00 0.00 37.83 36.33 3jpn s LYS 81 CO 0.00 -0.92 -0.06 -1.17 0.10 0.00 0.00 175.35 173.30 3jpn s LEU 82 N -3.21 1.13 0.34 2.77 2.96 -1.26 -3.49 118.68 117.92 3jpn s LEU 82 Ca 0.18 -0.22 0.02 0.00 -0.22 0.00 0.00 54.13 53.89 3jpn s LEU 82 Cb -0.04 -0.67 0.60 0.00 0.50 0.00 0.00 46.19 46.57 3jpn s LEU 82 CO 0.10 -0.10 1.99 0.03 -1.32 0.00 0.00 176.35 177.05 3jpn h ARG 83 N 7.86 0.86 -0.61 1.98 3.08 -1.98 -0.98 114.38 124.59 3jpn h ARG 83 Ca -0.29 -0.06 0.06 0.00 0.07 0.00 0.00 59.98 59.76 3jpn h ARG 83 Cb 1.14 -0.19 -0.05 0.00 0.08 0.00 0.00 29.97 30.95 3jpn h ARG 83 CO 0.39 0.58 0.32 -0.22 -1.07 0.00 0.00 179.97 179.97 3jpn h LYS 84 N 0.88 0.57 -0.27 0.04 3.64 -1.99 -0.63 116.57 118.81 3jpn h LYS 84 Ca 0.23 -0.03 -0.19 0.00 -1.27 0.00 0.00 60.65 59.38 3jpn h LYS 84 Cb -0.07 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.62 3jpn h LYS 84 CO -0.05 0.38 -0.60 -0.07 -2.27 0.00 0.00 179.45 176.85 3jpn h LEU 85 N 0.59 0.98 -0.59 5.20 3.38 -1.88 -2.31 115.31 120.68 3jpn h LEU 85 Ca 0.28 -0.55 0.11 0.00 0.09 0.00 0.00 57.88 57.81 3jpn h LEU 85 Cb 0.20 -0.28 -0.09 0.00 0.09 0.00 0.00 40.66 40.58 3jpn h LEU 85 CO -0.19 1.35 0.12 -0.33 0.09 0.00 0.00 178.44 179.48 3jpn h GLU 86 N 0.65 0.24 0.00 1.13 4.39 -0.47 0.81 114.58 121.34 3jpn h GLU 86 Ca 0.00 -0.01 -0.10 0.00 0.34 0.00 0.00 59.36 59.58 3jpn h GLU 86 Cb 1.21 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.79 3jpn h GLU 86 CO 0.13 0.16 -0.49 0.87 -1.16 0.00 0.00 179.01 178.52 3jpn h LYS 87 N 0.25 0.00 -0.34 2.33 1.57 -1.10 -2.74 116.57 116.54 3jpn h LYS 87 Ca 0.31 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.92 3jpn h LYS 87 Cb 0.46 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.77 3jpn h LYS 87 CO -0.40 0.49 -0.45 0.82 -0.57 0.00 0.00 179.45 179.34 3jpn h ILE 88 N 0.00 1.27 -0.14 1.86 2.04 -0.42 -2.51 117.51 119.61 3jpn h ILE 88 Ca -0.00 -1.63 -0.07 0.00 1.00 0.00 0.00 64.86 64.15 3jpn h ILE 88 Cb 0.98 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 38.53 3jpn h ILE 88 CO 0.06 0.54 -0.25 0.03 0.00 0.00 0.00 178.15 178.54 3jpn h ARG 89 N 0.72 0.25 0.00 2.37 3.08 -0.81 -2.39 114.38 117.60 3jpn h ARG 89 Ca 0.04 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 3jpn h ARG 89 Cb 1.05 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 31.08 3jpn h ARG 89 CO 0.11 0.49 -0.03 1.96 -1.07 0.00 0.00 179.97 181.42 3jpn h GLN 90 N 0.23 0.00 -6.20 0.04 4.20 -1.36 -3.44 115.11 108.57 3jpn h GLN 90 Ca 0.04 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.18 3jpn h GLN 90 Cb 0.56 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.30 3jpn h GLN 90 CO 0.04 0.03 0.92 0.34 -0.67 0.00 0.00 178.83 179.49 3jpn s ASP 91 N -6.04 6.87 0.05 1.46 2.15 -0.90 -4.95 116.67 115.32 3jpn s ASP 91 Ca 0.05 1.55 -0.24 0.00 0.43 0.00 0.00 52.55 54.33 3jpn s ASP 91 Cb 0.07 -2.54 -0.17 0.00 -0.30 0.00 0.00 42.92 39.98 3jpn s ASP 91 CO 0.63 -0.85 1.57 0.44 -0.17 0.00 0.00 175.17 176.79 3jpn h ASP 92 N 8.49 -0.02 -0.20 -0.34 3.32 -1.85 -0.67 116.42 125.15 3jpn h ASP 92 Ca -0.26 -0.16 0.03 0.00 0.02 0.00 0.00 57.03 56.66 3jpn h ASP 92 Cb 1.10 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.62 3jpn h ASP 92 CO 0.99 0.15 -0.01 0.74 -1.72 0.00 0.00 179.24 179.39 3jpn h THR 93 N -0.19 0.85 -0.88 0.35 2.02 -1.95 0.71 112.91 113.81 3jpn h THR 93 Ca -0.00 -0.02 -0.01 0.00 0.77 0.00 0.00 66.41 67.15 3jpn h THR 93 Cb 0.18 0.79 -0.04 0.00 -1.74 0.00 0.00 68.15 67.34 3jpn h THR 93 CO 0.00 0.01 0.52 0.28 0.37 0.00 0.00 175.52 176.71 3jpn h SER 94 N 0.05 1.06 -0.26 4.18 0.02 -1.86 -0.49 113.55 116.25 3jpn h SER 94 Ca 0.09 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 3jpn h SER 94 Cb 0.12 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 3jpn h SER 94 CO -0.17 0.82 0.12 0.28 -1.14 0.00 0.00 176.83 176.74 3jpn h SER 95 N 1.21 0.35 -0.49 3.07 0.02 -0.50 -1.39 113.55 115.82 3jpn h SER 95 Ca 0.31 -0.15 -0.05 0.00 -0.84 0.00 0.00 61.79 61.07 3jpn h SER 95 Cb -0.04 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 3jpn h SER 95 CO -0.06 0.40 0.10 0.28 -1.14 0.00 0.00 176.83 176.42 3jpn h SER 96 N 0.28 0.76 -0.57 3.07 0.02 -0.60 -1.40 113.55 115.11 3jpn h SER 96 Ca 0.09 -0.24 -0.02 0.00 -0.84 0.00 0.00 61.79 60.77 3jpn h SER 96 Cb 0.15 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.46 3jpn h SER 96 CO -0.01 0.81 0.26 0.40 -1.14 0.00 0.00 176.83 177.15 3jpn h ILE 97 N 0.68 1.21 -0.50 3.27 2.04 -1.00 -1.06 117.51 122.15 3jpn h ILE 97 Ca 0.15 -0.61 -0.03 0.00 1.00 0.00 0.00 64.86 65.37 3jpn h ILE 97 Cb 0.35 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 3jpn h ILE 97 CO 0.00 0.24 0.19 0.78 0.00 0.00 0.00 178.15 179.37 3jpn h ASN 98 N 0.78 0.70 0.43 1.72 2.35 -1.11 -2.49 115.58 117.96 3jpn h ASN 98 Ca 0.19 -0.18 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 3jpn h ASN 98 Cb 0.14 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 3jpn h ASN 98 CO -0.02 0.69 -0.27 0.15 -1.65 0.00 0.00 177.43 176.33 3jpn h PHE 99 N 0.67 -0.70 -0.70 1.19 3.57 -0.96 -3.03 116.94 116.98 3jpn h PHE 99 Ca 0.17 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.78 3jpn h PHE 99 Cb 0.22 0.25 -0.05 0.00 2.79 0.00 0.00 35.95 39.16 3jpn h PHE 99 CO 0.01 -0.41 0.47 -0.07 -2.23 0.00 0.00 178.31 176.07 3jpn h LEU 100 N -0.67 0.44 0.00 0.59 3.38 -1.11 -0.25 115.31 117.69 3jpn h LEU 100 Ca -0.05 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3jpn h LEU 100 Cb 0.55 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.22 3jpn h LEU 100 CO 0.05 0.25 0.00 0.35 0.09 0.00 0.00 178.44 179.18 3jpn n THR 101 N -4.48 0.97 0.68 0.22 -2.24 -0.95 -1.83 114.28 106.65 3jpn n THR 101 Ca 0.12 0.24 0.12 0.00 -2.27 0.00 0.00 64.05 62.27 3jpn n THR 101 Cb 0.42 -1.03 0.47 0.00 -2.10 0.00 0.00 70.33 68.10 3jpn n THR 101 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3jpn n ARG 102 N -1.43 0.13 -3.01 -0.78 1.74 -0.11 -4.66 116.66 108.55 3jpn n ARG 102 Ca 0.04 0.19 -0.40 0.00 -0.77 0.00 0.00 57.85 56.91 3jpn n ARG 102 Cb 0.13 -1.68 -0.05 0.00 -1.02 0.00 0.00 32.46 29.85 3jpn n ARG 102 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3jpn s VAL 103 N -3.09 5.01 0.09 1.55 1.01 -0.76 -4.99 120.40 119.21 3jpn s VAL 103 Ca 0.10 1.52 -0.31 0.00 0.00 0.00 0.00 61.98 63.29 3jpn s VAL 103 Cb 0.13 -4.07 -0.09 0.00 0.00 0.00 0.00 36.38 32.35 3jpn s VAL 103 CO 0.49 0.25 1.70 -0.55 0.00 0.00 0.00 175.10 176.99 3jpn s SER 104 N 0.75 6.54 0.00 3.32 0.15 -1.26 -1.59 113.70 121.61 3jpn s SER 104 Ca 0.39 2.58 0.00 0.00 0.70 0.00 0.00 55.95 59.62 3jpn s SER 104 Cb -0.18 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 3jpn s SER 104 CO 0.19 -0.92 0.00 0.61 1.20 0.00 0.00 173.24 174.33 3jpn n GLY 105 N 4.05 2.45 3.46 9.45 0.00 -1.26 -3.95 105.19 119.38 3jpn n GLY 105 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 3jpn n GLY 105 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jpn s ILE 106 N -2.52 4.79 0.02 -0.61 1.01 -0.62 -4.76 121.20 118.51 3jpn s ILE 106 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 60.65 60.24 3jpn s ILE 106 Cb 0.00 -3.47 0.00 0.00 0.01 0.00 0.00 42.46 39.00 3jpn s ILE 106 CO 0.00 0.01 0.03 0.61 0.00 0.00 0.00 174.94 175.59 3jpn n GLY 107 N 5.02 2.45 0.30 6.18 0.00 -1.26 -4.34 105.19 113.53 3jpn n GLY 107 Ca -0.13 -2.15 0.04 0.00 0.00 0.00 0.00 46.02 43.77 3jpn n GLY 107 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3jpn h PRO 108 N 0.00 0.72 0.25 1.61 0.11 -1.87 -0.14 132.00 132.68 3jpn h PRO 108 Ca -0.01 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 3jpn h PRO 108 Cb 0.05 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.01 3jpn h PRO 108 CO 0.02 0.47 -0.12 1.03 -0.21 0.00 0.00 178.00 179.20 3jpn h SER 109 N 0.74 -0.28 -0.59 -2.05 0.87 -1.95 -2.31 113.55 107.98 3jpn h SER 109 Ca 0.41 -0.23 -0.02 0.00 -1.23 0.00 0.00 61.79 60.72 3jpn h SER 109 Cb 0.42 0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.42 3jpn h SER 109 CO -0.27 0.12 0.32 0.00 -0.53 0.00 0.00 176.83 176.47 3jpn h ALA 110 N -0.13 1.41 -0.22 6.23 0.00 -1.92 -0.79 119.26 123.84 3jpn h ALA 110 Ca -0.03 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 3jpn h ALA 110 Cb 0.49 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3jpn h ALA 110 CO 0.06 0.48 0.07 0.00 0.00 0.00 0.00 179.25 179.86 3jpn h ALA 111 N 1.49 0.29 -0.39 0.00 0.00 -1.03 0.18 119.26 119.81 3jpn h ALA 111 Ca 0.22 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 3jpn h ALA 111 Cb 0.05 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3jpn h ALA 111 CO -0.03 -0.08 -0.07 -0.09 0.00 0.00 0.00 179.25 178.97 3jpn h ARG 112 N 0.20 0.66 -0.49 0.00 2.43 -1.12 -1.28 114.38 114.77 3jpn h ARG 112 Ca 0.07 -0.19 -0.12 0.00 -0.81 0.00 0.00 59.98 58.93 3jpn h ARG 112 Cb 0.23 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 3jpn h ARG 112 CO -0.00 0.73 -0.16 -0.22 -1.51 0.00 0.00 179.97 178.81 3jpn h LYS 113 N 0.61 0.97 -0.45 0.20 3.64 -0.83 -2.23 116.57 118.48 3jpn h LYS 113 Ca 0.11 -0.39 -0.03 0.00 -1.27 0.00 0.00 60.65 59.07 3jpn h LYS 113 Cb 0.49 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 3jpn h LYS 113 CO 0.03 1.06 0.17 0.74 -2.27 0.00 0.00 179.45 179.17 3jpn h PHE 114 N 0.83 0.70 -0.42 1.91 0.04 -0.27 -2.48 116.94 117.25 3jpn h PHE 114 Ca 0.12 -0.06 -0.00 0.00 2.80 0.00 0.00 57.97 60.83 3jpn h PHE 114 Cb 0.72 -0.21 -0.02 0.00 2.20 0.00 0.00 35.95 38.65 3jpn h PHE 114 CO 0.05 0.61 0.24 0.28 -0.60 0.00 0.00 178.31 178.90 3jpn h VAL 115 N 0.59 1.12 -0.27 -0.55 2.07 -1.15 -0.03 116.25 118.03 3jpn h VAL 115 Ca 0.15 -0.28 -0.07 0.00 0.82 0.00 0.00 66.70 67.31 3jpn h VAL 115 Cb 0.22 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 3jpn h VAL 115 CO -0.01 0.13 -0.15 0.44 0.02 0.00 0.00 177.57 178.00 3jpn h ASP 116 N 0.57 0.46 -0.06 0.57 3.32 -0.96 -2.30 116.42 118.02 3jpn h ASP 116 Ca 0.15 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.08 3jpn h ASP 116 Cb -0.01 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.42 3jpn h ASP 116 CO -0.03 0.63 0.00 -0.62 -1.72 0.00 0.00 179.24 177.51 3jpn n GLU 117 N -4.19 1.27 -0.74 3.56 1.02 -0.47 -4.88 120.64 116.20 3jpn n GLU 117 Ca 0.00 -0.41 0.00 0.00 -0.02 0.00 0.00 57.16 56.74 3jpn n GLU 117 Cb 0.33 -1.33 0.00 0.00 -0.02 0.00 0.00 31.44 30.42 3jpn n GLU 117 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3jpn n GLY 118 N 0.92 0.59 3.27 0.62 0.00 -0.86 -5.01 105.19 104.72 3jpn n GLY 118 Ca 0.15 -0.33 -0.44 0.00 0.00 0.00 0.00 46.02 45.40 3jpn n GLY 118 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jpn s ILE 119 N -2.00 4.91 -0.08 -0.61 1.01 -0.15 -4.85 121.20 119.44 3jpn s ILE 119 Ca 0.00 -2.02 0.02 0.00 0.00 0.00 0.00 60.65 58.65 3jpn s ILE 119 Cb 0.00 -4.13 -0.02 0.00 0.01 0.00 0.00 42.46 38.31 3jpn s ILE 119 CO 0.00 -0.89 0.08 0.29 0.00 0.00 0.00 174.94 174.41 3jpn n LYS 120 N 4.59 5.05 -4.54 2.79 5.02 -1.26 -3.06 118.16 126.75 3jpn n LYS 120 Ca -0.02 -0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.01 3jpn n LYS 120 Cb 0.42 -0.69 -0.09 0.00 -0.02 0.00 0.00 35.03 34.66 3jpn n LYS 120 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3jpn s THR 121 N -1.39 0.83 0.22 -0.18 -4.23 -1.26 -4.83 115.64 104.80 3jpn s THR 121 Ca 0.00 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.44 3jpn s THR 121 Cb 0.01 -2.42 0.15 0.00 1.34 0.00 0.00 72.50 71.58 3jpn s THR 121 CO 0.08 0.00 1.76 0.25 -0.54 0.00 0.00 174.62 176.18 3jpn h LEU 122 N 1.79 1.07 -0.67 4.79 5.85 -1.99 -0.38 115.31 125.76 3jpn h LEU 122 Ca -0.38 -0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.12 3jpn h LEU 122 Cb 1.27 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.99 3jpn h LEU 122 CO 0.62 0.98 0.29 -0.33 -0.34 0.00 0.00 178.44 179.66 3jpn h GLU 123 N 1.11 0.99 -0.58 1.25 3.07 -2.00 -2.00 114.58 116.42 3jpn h GLU 123 Ca 0.24 -0.17 -0.06 0.00 -0.50 0.00 0.00 59.36 58.88 3jpn h GLU 123 Cb 0.28 -0.17 -0.02 0.00 -0.84 0.00 0.00 28.75 28.00 3jpn h GLU 123 CO -0.01 0.82 0.13 -0.44 -1.40 0.00 0.00 179.01 178.11 3jpn h ASP 124 N 0.95 0.89 -0.17 1.42 3.32 -1.79 -2.78 116.42 118.25 3jpn h ASP 124 Ca 0.23 -0.24 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 3jpn h ASP 124 Cb 0.18 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 3jpn h ASP 124 CO -0.02 0.90 0.10 -0.07 -1.72 0.00 0.00 179.24 178.43 3jpn h LEU 125 N 0.84 0.20 -0.98 1.55 3.38 -0.77 -2.67 115.31 116.85 3jpn h LEU 125 Ca 0.18 -0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.15 3jpn h LEU 125 Cb 0.36 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.00 3jpn h LEU 125 CO 0.00 0.18 0.64 0.03 0.09 0.00 0.00 178.44 179.38 3jpn h ARG 126 N 0.20 1.21 -0.18 1.13 3.08 -1.31 -1.16 114.38 117.34 3jpn h ARG 126 Ca 0.06 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3jpn h ARG 126 Cb 0.02 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 29.80 3jpn h ARG 126 CO -0.01 0.80 0.00 0.36 -1.07 0.00 0.00 179.97 180.05 3jpn n LYS 127 N -4.46 1.35 -1.23 0.04 2.85 -1.06 -3.51 118.16 112.15 3jpn n LYS 127 Ca 0.13 -0.52 0.04 0.00 -1.05 0.00 0.00 58.31 56.91 3jpn n LYS 127 Cb 0.09 -1.14 0.05 0.00 -0.65 0.00 0.00 35.03 33.38 3jpn n LYS 127 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3jpn n ASN 128 N -0.07 1.02 -0.31 -5.58 3.02 -0.47 -4.89 115.26 107.98 3jpn n ASN 128 Ca 0.05 -2.29 0.19 0.00 -0.03 0.00 0.00 54.58 52.49 3jpn n ASN 128 Cb 0.14 -0.32 0.45 0.00 -0.61 0.00 0.00 39.78 39.44 3jpn n ASN 128 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3jpn h GLU 129 N 0.86 0.49 -0.62 3.52 5.08 -1.53 0.19 114.58 122.57 3jpn h GLU 129 Ca -0.17 -0.03 0.18 0.00 -1.00 0.00 0.00 59.36 58.34 3jpn h GLU 129 Cb 1.70 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.81 3jpn h GLU 129 CO 0.07 0.33 0.51 0.38 -1.00 0.00 0.00 179.01 179.30 3jpn h ASP 130 N 0.51 0.00 -0.41 1.42 2.03 -1.90 0.11 116.42 118.18 3jpn h ASP 130 Ca 0.56 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.86 3jpn h ASP 130 Cb 1.24 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.74 3jpn h ASP 130 CO -0.29 0.00 0.00 0.29 -1.03 0.00 0.00 179.24 178.21 3jpn n LYS 131 N -4.06 2.05 -4.60 4.15 5.02 0.67 -4.88 118.16 116.51 3jpn n LYS 131 Ca 0.12 -1.51 -0.32 0.00 -2.02 0.00 0.00 58.31 54.58 3jpn n LYS 131 Cb 0.75 -1.36 -0.11 0.00 -0.02 0.00 0.00 35.03 34.28 3jpn n LYS 131 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3jpn s LEU 132 N -1.04 2.98 0.00 -0.35 1.43 0.39 -5.13 118.68 116.96 3jpn s LEU 132 Ca 0.28 -0.20 -0.17 0.00 -1.03 0.00 0.00 54.13 53.01 3jpn s LEU 132 Cb 0.15 -1.70 0.24 0.00 0.03 0.00 0.00 46.19 44.91 3jpn s LEU 132 CO 0.18 0.30 1.13 -0.46 0.23 0.00 0.00 176.35 177.73 3jpn n ASN 133 N 1.76 -0.80 0.07 2.29 0.23 -1.26 -4.75 115.26 112.80 3jpn n ASN 133 Ca -0.16 -1.30 -0.12 0.00 -0.53 0.00 0.00 54.58 52.47 3jpn n ASN 133 Cb 0.52 -0.93 -0.05 0.00 -2.08 0.00 0.00 39.78 37.24 3jpn n ASN 133 CO 0.00 0.00 0.00 -0.74 -0.93 0.00 0.00 177.26 175.59 3jpn h HIS 134 N -2.10 -0.33 -0.37 -2.53 -0.00 -1.97 -1.98 115.15 105.87 3jpn h HIS 134 Ca -0.39 0.01 0.06 0.00 -0.00 0.00 0.00 60.37 60.05 3jpn h HIS 134 Cb 1.11 0.14 -0.05 0.00 -0.00 0.00 0.00 27.41 28.61 3jpn h HIS 134 CO 0.00 -0.19 0.07 1.25 -0.00 0.00 0.00 177.93 179.06 3jpn h HIS 135 N -0.23 0.11 -0.46 5.26 -0.00 -1.89 -1.99 115.15 115.95 3jpn h HIS 135 Ca 0.03 0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.41 3jpn h HIS 135 Cb 0.27 0.01 -0.02 0.00 -0.00 0.00 0.00 27.41 27.66 3jpn h HIS 135 CO -0.17 0.01 0.22 1.96 -0.00 0.00 0.00 177.93 179.95 3jpn h GLN 136 N 0.19 0.63 -0.41 5.26 4.20 -1.64 -0.78 115.11 122.56 3jpn h GLN 136 Ca 0.18 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.76 3jpn h GLN 136 Cb 0.21 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 3jpn h GLN 136 CO -0.24 0.50 0.04 0.00 -0.67 0.00 0.00 178.83 178.46 3jpn h ARG 137 N 0.64 0.69 -0.46 1.46 3.08 -0.64 -0.99 114.38 118.16 3jpn h ARG 137 Ca 0.16 -0.20 -0.10 0.00 0.07 0.00 0.00 59.98 59.91 3jpn h ARG 137 Cb 0.07 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3jpn h ARG 137 CO -0.02 0.75 -0.11 0.82 -1.07 0.00 0.00 179.97 180.34 3jpn h ILE 138 N 0.53 1.26 -0.64 2.04 1.08 -1.06 -0.54 117.51 120.18 3jpn h ILE 138 Ca 0.12 -1.20 0.02 0.00 -0.39 0.00 0.00 64.86 63.41 3jpn h ILE 138 Cb 0.42 1.03 -0.04 0.00 -3.07 0.00 0.00 36.82 35.15 3jpn h ILE 138 CO 0.01 0.41 0.41 1.23 -0.69 0.00 0.00 178.15 179.53 3jpn h GLY 139 N 0.97 0.91 1.31 5.37 0.00 -0.84 -1.75 103.07 109.04 3jpn h GLY 139 Ca 0.13 -0.31 -0.14 0.00 0.00 0.00 0.00 47.33 47.00 3jpn h GLY 139 CO 0.04 0.28 -0.34 -2.00 0.00 0.00 0.00 176.54 174.52 3jpn h LEU 140 N 0.81 0.81 -0.58 3.11 5.85 -0.94 -1.16 115.31 123.20 3jpn h LEU 140 Ca 0.25 -0.34 0.05 0.00 0.84 0.00 0.00 57.88 58.67 3jpn h LEU 140 Cb -0.03 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 40.73 3jpn h LEU 140 CO -0.08 1.07 0.32 0.50 -0.34 0.00 0.00 178.44 179.91 3jpn h LYS 141 N 0.64 0.59 -0.47 1.25 3.64 -0.43 -2.68 116.57 119.12 3jpn h LYS 141 Ca 0.07 -0.04 -0.19 0.00 -1.27 0.00 0.00 60.65 59.21 3jpn h LYS 141 Cb 0.88 -0.13 -0.12 0.00 -0.41 0.00 0.00 32.23 32.45 3jpn h LYS 141 CO 0.08 0.39 0.09 0.66 -2.27 0.00 0.00 179.45 178.40 3jpn n TYR 142 N -4.82 1.50 -0.17 1.91 4.01 -0.72 -4.75 117.16 114.11 3jpn n TYR 142 Ca 0.06 -1.44 -0.08 0.00 -0.16 0.00 0.00 57.90 56.29 3jpn n TYR 142 Cb 0.14 -0.54 -0.02 0.00 -0.31 0.00 0.00 39.34 38.60 3jpn n TYR 142 CO 0.00 0.00 0.00 0.35 -0.46 0.00 0.00 176.86 176.75 3jpn h PHE 143 N 1.35 -1.12 -0.13 -0.72 3.57 -0.84 -0.23 116.94 118.81 3jpn h PHE 143 Ca 0.24 0.07 0.01 0.00 3.53 0.00 0.00 57.97 61.82 3jpn h PHE 143 Cb 1.87 0.56 -0.01 0.00 2.79 0.00 0.00 35.95 41.16 3jpn h PHE 143 CO 1.03 -0.41 0.07 0.78 -2.23 0.00 0.00 178.31 177.55 3jpn h GLY 144 N -0.24 0.17 0.84 2.40 0.00 -1.85 -3.06 103.07 101.34 3jpn h GLY 144 Ca 0.18 -0.05 0.04 0.00 0.00 0.00 0.00 47.33 47.50 3jpn h GLY 144 CO -0.64 0.05 0.56 -0.55 0.00 0.00 0.00 176.54 175.96 3jpn h ASP 145 N 0.15 0.91 0.52 0.19 3.32 -1.68 -2.29 116.42 117.54 3jpn h ASP 145 Ca 0.05 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 3jpn h ASP 145 Cb -0.00 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.35 3jpn h ASP 145 CO -0.03 0.62 0.00 0.49 -1.72 0.00 0.00 179.24 178.60 3jpn n PHE 146 N -4.56 0.41 0.10 4.55 3.72 -0.17 -1.55 117.46 119.96 3jpn n PHE 146 Ca 0.11 0.17 0.01 0.00 -0.05 0.00 0.00 57.45 57.69 3jpn n PHE 146 Cb 0.11 -0.77 -0.02 0.00 -0.94 0.00 0.00 39.48 37.85 3jpn n PHE 146 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 3jpn h GLU 147 N 0.00 0.00 -7.12 -1.08 4.39 -1.37 -3.47 114.58 105.93 3jpn h GLU 147 Ca 0.00 0.00 -0.50 0.00 0.34 0.00 0.00 59.36 59.20 3jpn h GLU 147 Cb 0.26 0.00 0.08 0.00 -0.10 0.00 0.00 28.75 28.99 3jpn h GLU 147 CO 0.00 0.49 0.42 0.15 -1.16 0.00 0.00 179.01 178.91 3jpn s LYS 148 N -2.92 3.18 0.38 2.33 1.02 -0.60 -5.05 119.74 118.09 3jpn s LYS 148 Ca 0.02 1.55 -0.03 0.00 0.02 0.00 0.00 55.97 57.53 3jpn s LYS 148 Cb 0.08 -1.99 -0.04 0.00 -0.52 0.00 0.00 37.83 35.37 3jpn s LYS 148 CO 0.77 -0.98 0.64 1.03 -0.92 0.00 0.00 175.35 175.89 3jpn s ARG 149 N -3.52 3.54 -0.27 1.68 1.81 -1.26 -4.88 118.95 116.05 3jpn s ARG 149 Ca 0.71 -0.07 -0.04 0.00 -1.72 0.00 0.00 55.73 54.61 3jpn s ARG 149 Cb -0.23 -2.55 0.01 0.00 -0.45 0.00 0.00 34.95 31.73 3jpn s ARG 149 CO 0.31 0.04 0.01 0.42 -0.68 0.00 0.00 175.30 175.40 3jpn s ILE 150 N -2.42 3.49 0.35 1.52 1.01 0.53 -4.94 121.20 120.74 3jpn s ILE 150 Ca 0.43 -0.80 -0.28 0.00 0.00 0.00 0.00 60.65 60.00 3jpn s ILE 150 Cb -0.10 -2.77 -0.11 0.00 0.01 0.00 0.00 42.46 39.49 3jpn s ILE 150 CO 0.38 0.16 1.41 -2.84 0.00 0.00 0.00 174.94 174.04 3jpn s PRO 151 N 1.43 4.22 0.46 2.79 0.02 -1.26 -0.86 135.00 141.80 3jpn s PRO 151 Ca 0.02 2.41 0.22 0.00 0.02 0.00 0.00 61.00 63.67 3jpn s PRO 151 Cb -0.17 -3.02 1.22 0.00 0.02 0.00 0.00 34.50 32.56 3jpn s PRO 151 CO -0.01 -0.38 1.88 -0.09 -0.33 0.00 0.00 177.00 178.07 3jpn h ARG 152 N 3.23 0.25 -0.51 5.54 2.43 -1.62 0.29 114.38 124.00 3jpn h ARG 152 Ca -0.50 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 58.71 3jpn h ARG 152 Cb 1.23 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 30.68 3jpn h ARG 152 CO 0.65 0.17 0.23 1.49 -1.51 0.00 0.00 179.97 181.00 3jpn h GLU 153 N 0.26 0.44 -0.20 0.20 4.81 -1.89 0.22 114.58 118.42 3jpn h GLU 153 Ca 0.44 -0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.52 3jpn h GLU 153 Cb 1.31 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.58 3jpn h GLU 153 CO -0.12 0.29 -0.40 0.93 -0.73 0.00 0.00 179.01 178.99 3jpn h GLU 154 N 0.45 0.46 -0.78 1.92 5.08 -0.82 -2.82 114.58 118.08 3jpn h GLU 154 Ca 0.23 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 3jpn h GLU 154 Cb 0.18 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 3jpn h GLU 154 CO -0.18 0.79 0.46 0.52 -1.00 0.00 0.00 179.01 179.59 3jpn h MET 155 N 0.39 1.07 -0.77 2.33 2.86 -0.14 -1.07 114.93 119.59 3jpn h MET 155 Ca 0.04 -0.10 -0.03 0.00 -2.06 0.00 0.00 59.70 57.55 3jpn h MET 155 Cb 0.86 -0.22 -0.04 0.00 0.06 0.00 0.00 31.60 32.27 3jpn h MET 155 CO 0.07 0.75 0.37 -0.07 1.06 0.00 0.00 176.91 179.09 3jpn h LEU 156 N 1.08 1.01 -0.47 1.22 3.38 -0.75 0.21 115.31 121.00 3jpn h LEU 156 Ca 0.28 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 58.00 3jpn h LEU 156 Cb -0.03 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 3jpn h LEU 156 CO -0.05 0.86 -0.15 1.56 0.09 0.00 0.00 178.44 180.75 3jpn h GLN 157 N 1.09 0.93 -0.29 1.13 4.20 -1.29 -1.26 115.11 119.62 3jpn h GLN 157 Ca 0.26 -0.38 -0.02 0.00 0.06 0.00 0.00 58.65 58.58 3jpn h GLN 157 Cb 0.12 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 3jpn h GLN 157 CO -0.03 1.04 0.10 0.52 -0.67 0.00 0.00 178.83 179.79 3jpn h MET 158 N 0.78 0.44 -0.50 1.46 2.86 -0.84 -1.90 114.93 117.24 3jpn h MET 158 Ca 0.11 -0.09 0.07 0.00 -2.06 0.00 0.00 59.70 57.74 3jpn h MET 158 Cb 0.71 -0.07 -0.06 0.00 0.06 0.00 0.00 31.60 32.25 3jpn h MET 158 CO 0.05 0.48 0.16 0.37 1.06 0.00 0.00 176.91 179.03 3jpn h GLN 159 N 0.31 0.32 -0.42 1.72 4.15 -0.42 -1.06 115.11 119.72 3jpn h GLN 159 Ca 0.09 -0.02 0.03 0.00 0.77 0.00 0.00 58.65 59.53 3jpn h GLN 159 Cb 0.21 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.79 3jpn h GLN 159 CO -0.01 0.21 0.21 0.22 -1.93 0.00 0.00 178.83 177.54 3jpn h ASP 160 N 0.33 0.31 0.15 -0.69 -0.00 -0.94 -0.07 116.42 115.50 3jpn h ASP 160 Ca 0.24 0.02 -0.01 0.00 -0.00 0.00 0.00 57.03 57.28 3jpn h ASP 160 Cb 0.27 -0.04 0.00 0.00 -0.00 0.00 0.00 39.33 39.56 3jpn h ASP 160 CO -0.26 0.22 -0.07 0.40 -0.00 0.00 0.00 179.24 179.53 3jpn h ILE 161 N 0.42 0.92 0.08 2.25 2.04 -0.84 -1.38 117.51 121.00 3jpn h ILE 161 Ca 0.18 -0.27 -0.00 0.00 1.00 0.00 0.00 64.86 65.77 3jpn h ILE 161 Cb 0.08 1.09 -0.00 0.00 -0.74 0.00 0.00 36.82 37.25 3jpn h ILE 161 CO -0.12 0.06 -0.05 0.58 0.00 0.00 0.00 178.15 178.63 3jpn h VAL 162 N -0.32 0.90 -0.76 1.67 2.07 -1.01 0.16 116.25 118.96 3jpn h VAL 162 Ca -0.02 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 3jpn h VAL 162 Cb 0.26 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 3jpn h VAL 162 CO 0.03 0.00 0.42 -0.07 0.02 0.00 0.00 177.57 177.97 3jpn h LEU 163 N -0.12 0.96 -0.71 2.57 4.07 -1.04 -0.89 115.31 120.15 3jpn h LEU 163 Ca -0.01 -0.10 -0.13 0.00 0.08 0.00 0.00 57.88 57.72 3jpn h LEU 163 Cb 0.10 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 41.58 3jpn h LEU 163 CO 0.01 0.78 -0.46 0.78 -1.08 0.00 0.00 178.44 178.47 3jpn h ASN 164 N 1.06 0.47 -0.21 -0.43 2.35 -1.02 -1.19 115.58 116.61 3jpn h ASN 164 Ca 0.27 -0.22 -0.20 0.00 -0.55 0.00 0.00 56.30 55.60 3jpn h ASN 164 Cb 0.04 -0.13 0.01 0.00 0.05 0.00 0.00 38.32 38.28 3jpn h ASN 164 CO -0.04 0.87 -0.64 -0.33 -1.65 0.00 0.00 177.43 175.63 3jpn h GLU 165 N 0.36 0.80 -0.66 0.81 4.39 -0.45 -2.57 114.58 117.26 3jpn h GLU 165 Ca 0.02 -0.59 -0.08 0.00 0.34 0.00 0.00 59.36 59.05 3jpn h GLU 165 Cb 0.95 0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.67 3jpn h GLU 165 CO 0.08 1.21 0.09 0.28 -1.16 0.00 0.00 179.01 179.51 3jpn h VAL 166 N 0.55 1.26 -0.77 3.13 2.07 -1.12 -2.19 116.25 119.19 3jpn h VAL 166 Ca -0.02 -1.05 0.04 0.00 0.82 0.00 0.00 66.70 66.48 3jpn h VAL 166 Cb 1.27 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 31.65 3jpn h VAL 166 CO 0.14 0.39 0.50 0.50 0.02 0.00 0.00 177.57 179.13 3jpn h LYS 167 N 1.02 0.89 0.00 1.57 3.64 -1.11 -1.27 116.57 121.31 3jpn h LYS 167 Ca 0.20 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.46 3jpn h LYS 167 Cb 0.46 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 3jpn h LYS 167 CO 0.02 0.59 -0.30 0.87 -2.27 0.00 0.00 179.45 178.35 3jpn h LYS 168 N 0.91 0.00 0.10 1.90 1.57 -0.99 -2.92 116.57 117.15 3jpn h LYS 168 Ca 0.31 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.08 3jpn h LYS 168 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.40 3jpn h LYS 168 CO -0.09 0.30 -0.05 0.28 -0.57 0.00 0.00 179.45 179.32 3jpn h VAL 169 N 0.00 1.03 -2.37 0.50 2.07 -0.98 -3.45 116.25 113.05 3jpn h VAL 169 Ca -0.00 -1.35 -0.05 0.00 0.82 0.00 0.00 66.70 66.12 3jpn h VAL 169 Cb 0.56 1.78 -0.25 0.00 -1.52 0.00 0.00 31.29 31.86 3jpn h VAL 169 CO 0.04 0.29 -0.30 -0.62 0.02 0.00 0.00 177.57 176.99 3jpn s ASP 170 N -5.64 -0.50 0.47 0.57 -1.08 -0.84 -5.02 116.67 104.62 3jpn s ASP 170 Ca -0.13 1.15 0.27 0.00 -0.52 0.00 0.00 52.55 53.33 3jpn s ASP 170 Cb -0.00 1.61 1.49 0.00 -1.46 0.00 0.00 42.92 44.56 3jpn s ASP 170 CO 0.51 -0.23 1.82 0.77 0.52 0.00 0.00 175.17 178.56 3jpn h SER 171 N 8.11 0.00 0.83 -0.34 4.64 -1.76 -1.36 113.55 123.66 3jpn h SER 171 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 3jpn h SER 171 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 3jpn h SER 171 CO 0.12 0.00 -0.28 -0.62 -0.87 0.00 0.00 176.83 175.18 3jpn n GLU 172 N -2.53 0.06 -2.26 4.77 1.02 -1.26 -4.87 120.64 115.57 3jpn n GLU 172 Ca -0.02 0.03 -0.37 0.00 -0.02 0.00 0.00 57.16 56.78 3jpn n GLU 172 Cb 0.15 -1.55 -0.01 0.00 -0.02 0.00 0.00 31.44 30.01 3jpn n GLU 172 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3jpn s TYR 173 N -3.03 2.93 -0.16 -0.32 2.02 -0.51 -4.43 117.35 113.85 3jpn s TYR 173 Ca 0.12 1.54 -0.01 0.00 -0.37 0.00 0.00 57.07 58.35 3jpn s TYR 173 Cb 0.17 -3.39 0.04 0.00 -0.40 0.00 0.00 41.96 38.38 3jpn s TYR 173 CO 0.63 -1.47 -0.05 0.42 -1.57 0.00 0.00 175.55 173.51 3jpn s ILE 174 N -1.50 1.06 -0.14 2.71 1.01 -0.55 -4.87 121.20 118.92 3jpn s ILE 174 Ca 0.61 -0.56 -0.03 0.00 0.00 0.00 0.00 60.65 60.67 3jpn s ILE 174 Cb -0.29 -1.22 -0.03 0.00 0.01 0.00 0.00 42.46 40.92 3jpn s ILE 174 CO 0.36 0.15 -0.03 0.00 0.00 0.00 0.00 174.94 175.43 3jpn s ALA 175 N 1.66 3.07 -0.07 9.38 0.00 -1.26 -1.64 121.76 132.90 3jpn s ALA 175 Ca 0.01 -0.82 0.02 0.00 0.00 0.00 0.00 51.96 51.18 3jpn s ALA 175 Cb -0.15 -1.54 0.01 0.00 0.00 0.00 0.00 23.12 21.44 3jpn s ALA 175 CO -0.08 0.29 -0.13 0.99 0.00 0.00 0.00 175.76 176.84 3jpn s THR 176 N 0.09 1.20 -0.25 0.00 2.01 0.36 -4.94 115.64 114.11 3jpn s THR 176 Ca 0.00 -0.52 -0.23 0.00 0.31 0.00 0.00 61.69 61.25 3jpn s THR 176 Cb -0.13 -1.09 -0.01 0.00 0.01 0.00 0.00 72.50 71.27 3jpn s THR 176 CO 0.03 0.37 0.74 -0.69 -0.69 0.00 0.00 174.62 174.37 3jpn s VAL 177 N 0.63 4.90 0.00 3.82 1.01 -1.26 0.20 120.40 129.69 3jpn s VAL 177 Ca -0.15 1.36 0.00 0.00 0.00 0.00 0.00 61.98 63.19 3jpn s VAL 177 Cb -0.16 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.18 3jpn s VAL 177 CO 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 175.10 175.10 3jpn n GLY 179 N 5.00 0.91 0.31 0.00 0.00 0.20 -2.81 105.19 108.80 3jpn n GLY 179 Ca 0.00 -0.80 0.15 0.00 0.00 0.00 0.00 46.02 45.37 3jpn n GLY 179 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3jpn h SER 180 N 1.44 0.00 -0.39 1.61 4.64 -1.88 -2.08 113.55 116.89 3jpn h SER 180 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 3jpn h SER 180 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 3jpn h SER 180 CO 0.00 0.00 0.18 0.15 -0.87 0.00 0.00 176.83 176.29 3jpn h PHE 181 N 0.00 0.56 0.00 4.77 3.57 -1.84 -0.55 116.94 123.45 3jpn h PHE 181 Ca 0.04 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 3jpn h PHE 181 Cb 0.22 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 38.78 3jpn h PHE 181 CO 0.00 0.48 -0.08 -0.09 -2.23 0.00 0.00 178.31 176.39 3jpn h ARG 182 N 0.49 0.00 -0.13 1.11 2.43 -1.21 -1.42 114.38 115.64 3jpn h ARG 182 Ca 0.13 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 3jpn h ARG 182 Cb 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 3jpn h ARG 182 CO -0.02 0.08 0.00 0.54 -1.51 0.00 0.00 179.97 179.06 3jpn n ARG 183 N -3.24 1.45 -1.00 0.20 1.74 -0.69 -4.53 116.66 110.59 3jpn n ARG 183 Ca -0.00 -0.69 -0.00 0.00 -0.77 0.00 0.00 57.85 56.39 3jpn n ARG 183 Cb 0.32 -1.30 -0.00 0.00 -1.02 0.00 0.00 32.46 30.46 3jpn n ARG 183 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3jpn n GLY 184 N 0.95 0.46 3.76 -0.13 0.00 -0.54 -3.93 105.19 105.77 3jpn n GLY 184 Ca 0.13 -0.35 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 3jpn n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jpn n ALA 185 N 1.00 1.95 1.43 4.61 0.00 -0.30 -4.89 120.51 124.31 3jpn n ALA 185 Ca -0.00 0.22 0.14 0.00 0.00 0.00 0.00 53.44 53.80 3jpn n ALA 185 Cb 0.01 -2.39 0.74 0.00 0.00 0.00 0.00 19.45 17.81 3jpn n ALA 185 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3jpn n GLU 186 N -0.41 0.52 -3.51 0.00 -0.58 -1.26 -4.73 120.64 110.67 3jpn n GLU 186 Ca 0.06 0.02 -0.14 0.00 -0.42 0.00 0.00 57.16 56.68 3jpn n GLU 186 Cb 0.42 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.75 3jpn n GLU 186 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3jpn s SER 187 N -2.43 -0.55 0.08 1.62 1.04 -1.26 -1.72 113.70 110.48 3jpn s SER 187 Ca 0.30 0.44 0.03 0.00 0.48 0.00 0.00 55.95 57.20 3jpn s SER 187 Cb 0.19 0.49 -0.04 0.00 0.10 0.00 0.00 66.02 66.76 3jpn s SER 187 CO 0.40 -0.63 -0.08 -0.44 0.98 0.00 0.00 173.24 173.48 3jpn s SER 188 N -1.62 1.18 0.39 7.02 0.01 -0.04 -4.88 113.70 115.76 3jpn s SER 188 Ca -0.05 -0.82 0.21 0.00 1.31 0.00 0.00 55.95 56.60 3jpn s SER 188 Cb -0.00 0.05 0.36 0.00 0.21 0.00 0.00 66.02 66.64 3jpn s SER 188 CO 0.02 -0.33 1.59 1.23 0.41 0.00 0.00 173.24 176.16 3jpn h GLY 189 N 3.57 0.00 -0.67 3.44 0.00 -1.89 0.15 103.07 107.67 3jpn h GLY 189 Ca -0.36 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.04 3jpn h GLY 189 CO 0.54 0.00 0.28 2.09 0.00 0.00 0.00 176.54 179.45 3jpn n ASP 190 N -3.18 -0.87 -4.42 0.19 5.68 -1.26 -4.72 116.55 107.97 3jpn n ASP 190 Ca 0.03 -1.47 -0.33 0.00 -0.50 0.00 0.00 54.79 52.52 3jpn n ASP 190 Cb 0.58 1.42 -0.13 0.00 -1.14 0.00 0.00 41.12 41.84 3jpn n ASP 190 CO 0.00 0.00 0.00 -0.32 -1.33 0.00 0.00 177.20 175.55 3jpn s MET 191 N -2.03 3.46 -0.17 0.11 -2.45 -0.90 -4.92 119.30 112.41 3jpn s MET 191 Ca 0.11 -0.62 -0.00 0.00 -1.25 0.00 0.00 55.69 53.93 3jpn s MET 191 Cb -0.01 -2.73 0.00 0.00 1.25 0.00 0.00 34.83 33.34 3jpn s MET 191 CO 0.03 0.24 -0.15 -0.51 1.05 0.00 0.00 175.02 175.68 3jpn s ASP 192 N 0.30 3.57 -0.17 1.11 1.01 -1.26 -1.62 116.67 119.61 3jpn s ASP 192 Ca -0.08 -0.52 0.01 0.00 0.71 0.00 0.00 52.55 52.67 3jpn s ASP 192 Cb -0.15 -1.56 0.01 0.00 1.01 0.00 0.00 42.92 42.23 3jpn s ASP 192 CO 0.05 0.04 -0.19 -0.69 0.21 0.00 0.00 175.17 174.59 3jpn s VAL 193 N 1.07 2.22 -0.15 -1.27 1.01 0.35 -0.48 120.40 123.16 3jpn s VAL 193 Ca -0.00 -0.90 -0.15 0.00 0.00 0.00 0.00 61.98 60.93 3jpn s VAL 193 Cb -0.14 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.26 3jpn s VAL 193 CO -0.05 0.53 0.34 -0.22 0.00 0.00 0.00 175.10 175.70 3jpn s LEU 194 N 1.14 4.26 -0.02 3.92 2.96 0.13 -0.64 118.68 130.43 3jpn s LEU 194 Ca 0.01 0.59 0.07 0.00 -0.22 0.00 0.00 54.13 54.58 3jpn s LEU 194 Cb -0.14 -2.46 -0.02 0.00 0.50 0.00 0.00 46.19 44.08 3jpn s LEU 194 CO -0.08 0.08 -0.22 -0.22 -1.32 0.00 0.00 176.35 174.60 3jpn s LEU 195 N 0.45 2.04 0.06 -0.68 2.96 0.32 -0.48 118.68 123.34 3jpn s LEU 195 Ca 0.19 -0.39 0.01 0.00 -0.22 0.00 0.00 54.13 53.71 3jpn s LEU 195 Cb -0.14 -1.12 -0.03 0.00 0.50 0.00 0.00 46.19 45.40 3jpn s LEU 195 CO 0.06 0.26 -0.05 0.42 -1.32 0.00 0.00 176.35 175.72 3jpn s THR 196 N -0.49 0.42 -0.17 3.68 -4.23 -0.65 -1.64 115.64 112.55 3jpn s THR 196 Ca 0.08 -1.50 -0.11 0.00 -1.18 0.00 0.00 61.69 58.98 3jpn s THR 196 Cb -0.09 -1.11 0.06 0.00 1.34 0.00 0.00 72.50 72.70 3jpn s THR 196 CO -0.01 -0.72 0.42 -2.28 -0.54 0.00 0.00 174.62 171.50 3jpn s HIS 197 N -2.74 -0.59 0.64 3.99 2.46 -1.26 -1.48 115.29 116.31 3jpn s HIS 197 Ca -0.00 1.28 0.31 0.00 0.47 0.00 0.00 55.06 57.12 3jpn s HIS 197 Cb -0.01 0.25 1.68 0.00 -0.13 0.00 0.00 32.58 34.38 3jpn s HIS 197 CO -0.04 -0.32 1.98 -1.00 -2.47 0.00 0.00 174.74 172.89 3jpn h PRO 198 N 6.71 0.00 0.00 2.88 0.13 -1.99 -0.91 132.00 138.82 3jpn h PRO 198 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3jpn h PRO 198 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3jpn h PRO 198 CO 0.28 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 176.92 3jpn n SER 199 N -3.16 0.76 -4.14 1.44 3.41 -1.26 -4.56 113.62 106.11 3jpn n SER 199 Ca 0.00 0.59 -0.35 0.00 -0.26 0.00 0.00 58.87 58.85 3jpn n SER 199 Cb 0.39 -0.79 -0.13 0.00 -0.26 0.00 0.00 64.21 63.43 3jpn n SER 199 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3jpn s PHE 200 N -3.13 3.42 0.40 7.33 5.36 -0.35 -0.82 117.98 130.19 3jpn s PHE 200 Ca 0.10 -2.15 0.04 0.00 -0.96 0.00 0.00 56.93 53.95 3jpn s PHE 200 Cb 0.12 -2.56 -0.03 0.00 -0.34 0.00 0.00 43.02 40.22 3jpn s PHE 200 CO 0.56 -0.87 0.11 0.95 -1.46 0.00 0.00 175.22 174.51 3jpn s THR 201 N 1.19 0.73 -0.47 0.12 -4.23 -0.13 -1.28 115.64 111.56 3jpn s THR 201 Ca 0.01 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.75 3jpn s THR 201 Cb -0.21 -2.40 0.24 0.00 1.34 0.00 0.00 72.50 71.47 3jpn s THR 201 CO -0.03 0.00 1.71 -1.54 -0.54 0.00 0.00 174.62 174.22 3jpn n SER 202 N -1.20 0.66 0.03 3.99 3.41 -1.26 -2.38 113.62 116.86 3jpn n SER 202 Ca -0.06 0.67 -0.02 0.00 -0.26 0.00 0.00 58.87 59.19 3jpn n SER 202 Cb 0.65 -0.81 -0.09 0.00 -0.26 0.00 0.00 64.21 63.71 3jpn n SER 202 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3jpn h GLU 203 N 0.00 0.00 -1.22 4.33 4.57 -1.99 -3.49 114.58 116.78 3jpn h GLU 203 Ca 0.00 0.00 0.30 0.00 -1.18 0.00 0.00 59.36 58.48 3jpn h GLU 203 Cb 0.34 0.00 -0.20 0.00 -0.16 0.00 0.00 28.75 28.73 3jpn h GLU 203 CO 0.00 0.41 0.91 -1.54 -1.18 0.00 0.00 179.01 177.61 3jpn s SER 204 N -5.99 -0.06 -0.39 1.04 1.04 -1.00 -5.09 113.70 103.25 3jpn s SER 204 Ca -0.02 -0.00 -0.01 0.00 0.48 0.00 0.00 55.95 56.39 3jpn s SER 204 Cb 0.08 0.07 0.11 0.00 0.10 0.00 0.00 66.02 66.38 3jpn s SER 204 CO 0.81 -0.11 0.17 -0.89 0.98 0.00 0.00 173.24 174.20 3jpn s THR 205 N -2.19 3.07 -0.51 2.02 2.01 -1.26 -0.96 115.64 117.82 3jpn s THR 205 Ca 0.11 -2.11 0.24 0.00 0.31 0.00 0.00 61.69 60.24 3jpn s THR 205 Cb -0.01 -3.13 0.22 0.00 0.01 0.00 0.00 72.50 69.59 3jpn s THR 205 CO -0.03 -0.66 1.50 0.11 -0.69 0.00 0.00 174.62 174.85 3jpn h LYS 206 N 7.96 0.00 -3.68 4.92 1.57 -1.37 -3.45 116.57 122.52 3jpn h LYS 206 Ca -0.11 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.37 3jpn h LYS 206 Cb 1.04 0.00 -0.32 0.00 0.08 0.00 0.00 32.23 33.03 3jpn h LYS 206 CO 0.66 0.00 -0.73 -0.65 -0.57 0.00 0.00 179.45 178.15 3jpn s GLN 207 N -3.20 0.10 0.73 3.15 -0.21 -1.26 -5.09 119.66 113.88 3jpn s GLN 207 Ca 0.06 0.09 -0.06 0.00 0.02 0.00 0.00 55.36 55.48 3jpn s GLN 207 Cb 0.09 -0.27 0.10 0.00 1.00 0.00 0.00 33.01 33.94 3jpn s GLN 207 CO 0.68 -0.10 1.03 -1.25 -2.12 0.00 0.00 175.29 173.53 3jpn s PRO 208 N 0.73 1.82 -1.30 2.91 0.04 -1.26 -4.35 135.00 133.59 3jpn s PRO 208 Ca -0.06 -0.59 0.00 0.00 0.04 0.00 0.00 61.00 60.39 3jpn s PRO 208 Cb -0.09 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.25 3jpn s PRO 208 CO -0.02 -1.44 0.00 1.63 0.04 0.00 0.00 177.00 177.22 3jpn n LYS 209 N -2.97 -1.84 -0.30 4.56 5.02 -1.26 -4.86 118.16 116.51 3jpn n LYS 209 Ca 0.11 0.73 -0.03 0.00 -2.02 0.00 0.00 58.31 57.11 3jpn n LYS 209 Cb 0.60 -5.23 0.09 0.00 -0.02 0.00 0.00 35.03 30.48 3jpn n LYS 209 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3jpn h LEU 210 N 0.00 0.89 0.00 -0.35 3.38 -1.90 -0.20 115.31 117.12 3jpn h LEU 210 Ca -0.32 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.58 3jpn h LEU 210 Cb 1.14 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.68 3jpn h LEU 210 CO 0.40 0.62 -0.24 0.25 0.09 0.00 0.00 178.44 179.57 3jpn h LEU 211 N 1.05 0.21 -0.62 1.67 5.85 -1.89 -3.32 115.31 118.26 3jpn h LEU 211 Ca 0.31 -0.79 0.13 0.00 0.84 0.00 0.00 57.88 58.38 3jpn h LEU 211 Cb -0.04 -0.06 -0.11 0.00 0.37 0.00 0.00 40.66 40.81 3jpn h LEU 211 CO -0.09 0.97 -0.06 -0.74 -0.34 0.00 0.00 178.44 178.17 3jpn h HIS 212 N -0.53 -0.16 -0.56 1.25 2.76 -1.83 -1.23 115.15 114.85 3jpn h HIS 212 Ca -0.03 0.05 0.09 0.00 -2.20 0.00 0.00 60.37 58.27 3jpn h HIS 212 Cb 1.01 0.17 -0.07 0.00 1.55 0.00 0.00 27.41 30.06 3jpn h HIS 212 CO 0.18 -0.21 0.20 1.96 -1.30 0.00 0.00 177.93 178.76 3jpn h GLN 213 N 0.06 0.36 -0.16 5.26 4.20 -1.14 0.23 115.11 123.92 3jpn h GLN 213 Ca 0.31 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.99 3jpn h GLN 213 Cb 0.50 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 3jpn h GLN 213 CO -0.57 0.24 0.06 0.28 -0.67 0.00 0.00 178.83 178.17 3jpn h VAL 214 N 0.37 1.16 -0.47 -0.54 2.07 -1.41 -0.37 116.25 117.06 3jpn h VAL 214 Ca 0.28 -0.49 0.05 0.00 0.82 0.00 0.00 66.70 67.36 3jpn h VAL 214 Cb 0.34 1.18 -0.05 0.00 -1.52 0.00 0.00 31.29 31.25 3jpn h VAL 214 CO -0.29 0.15 0.20 0.58 0.02 0.00 0.00 177.57 178.23 3jpn h VAL 215 N 0.10 0.90 -0.36 2.57 2.07 -0.61 -1.36 116.25 119.56 3jpn h VAL 215 Ca 0.05 -0.14 0.03 0.00 0.82 0.00 0.00 66.70 67.47 3jpn h VAL 215 Cb 0.18 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 3jpn h VAL 215 CO -0.00 0.07 0.15 -0.08 0.02 0.00 0.00 177.57 177.73 3jpn h GLU 216 N 0.40 0.31 -0.91 1.57 4.81 -0.33 -0.70 114.58 119.74 3jpn h GLU 216 Ca 0.21 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 3jpn h GLU 216 Cb 0.17 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.44 3jpn h GLU 216 CO -0.19 0.21 0.53 0.37 -0.73 0.00 0.00 179.01 179.20 3jpn h GLN 217 N 0.32 1.24 0.00 1.92 5.75 -0.55 0.42 115.11 124.22 3jpn h GLN 217 Ca 0.16 -0.12 -0.10 0.00 -0.15 0.00 0.00 58.65 58.43 3jpn h GLN 217 Cb 0.10 -0.25 -0.01 0.00 1.07 0.00 0.00 27.48 28.38 3jpn h GLN 217 CO -0.14 0.88 -0.49 -0.07 -2.65 0.00 0.00 178.83 176.37 3jpn h LEU 218 N 1.26 0.00 -0.09 -2.39 3.38 -0.80 -2.49 115.31 114.18 3jpn h LEU 218 Ca 0.32 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 58.05 3jpn h LEU 218 Cb -0.03 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.73 3jpn h LEU 218 CO -0.06 0.49 -1.02 1.56 0.09 0.00 0.00 178.44 179.50 3jpn h GLN 219 N 0.00 0.47 -0.64 1.13 4.20 -0.71 0.26 115.11 119.81 3jpn h GLN 219 Ca -0.00 -0.54 0.04 0.00 0.06 0.00 0.00 58.65 58.21 3jpn h GLN 219 Cb 1.04 0.16 -0.05 0.00 0.30 0.00 0.00 27.48 28.93 3jpn h GLN 219 CO 0.06 1.18 0.37 -0.22 -0.67 0.00 0.00 178.83 179.56 3jpn h LYS 220 N 0.25 0.69 -0.40 1.46 3.64 -0.66 -0.50 116.57 121.05 3jpn h LYS 220 Ca -0.10 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 3jpn h LYS 220 Cb 1.67 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 33.33 3jpn h LYS 220 CO 0.18 0.45 0.00 1.33 -2.27 0.00 0.00 179.45 179.15 3jpn n VAL 221 N -4.76 0.51 -1.93 2.00 0.24 -0.96 -4.90 118.33 108.52 3jpn n VAL 221 Ca 0.07 -0.39 -0.16 0.00 -2.04 0.00 0.00 64.34 61.82 3jpn n VAL 221 Cb 0.13 0.04 -0.03 0.00 -1.47 0.00 0.00 33.84 32.51 3jpn n VAL 221 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 3jpn n HIS 222 N 0.27 -0.42 -0.08 6.34 8.25 -0.20 -4.91 115.22 124.47 3jpn n HIS 222 Ca 0.09 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.39 3jpn n HIS 222 Cb 0.31 -3.03 -0.12 0.00 1.12 0.00 0.00 29.99 28.28 3jpn n HIS 222 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 3jpn h PHE 223 N 0.00 0.00 -3.34 4.41 3.57 -0.74 -3.44 116.94 117.40 3jpn h PHE 223 Ca -0.35 0.00 -0.59 0.00 3.53 0.00 0.00 57.97 60.56 3jpn h PHE 223 Cb 1.17 0.00 -0.08 0.00 2.79 0.00 0.00 35.95 39.83 3jpn h PHE 223 CO 0.43 1.14 0.30 0.42 -2.23 0.00 0.00 178.31 178.37 3jpn s ILE 224 N -2.25 4.92 -0.09 1.41 1.01 -0.62 -1.04 121.20 124.54 3jpn s ILE 224 Ca -0.22 1.47 0.13 0.00 0.00 0.00 0.00 60.65 62.03 3jpn s ILE 224 Cb 0.00 -4.07 -0.19 0.00 0.01 0.00 0.00 42.46 38.22 3jpn s ILE 224 CO 0.62 0.05 0.15 0.35 0.00 0.00 0.00 174.94 176.11 3jpn n THR 225 N 4.78 0.57 -3.89 2.92 -2.24 0.79 -4.32 114.28 112.87 3jpn n THR 225 Ca 0.03 -0.48 -0.09 0.00 -2.27 0.00 0.00 64.05 61.23 3jpn n THR 225 Cb 0.49 -0.33 -0.06 0.00 -2.10 0.00 0.00 70.33 68.33 3jpn n THR 225 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3jpn s ASP 226 N -4.27 -0.02 -0.06 3.42 1.11 -1.17 -4.98 116.67 110.69 3jpn s ASP 226 Ca -0.06 -0.75 0.02 0.00 0.18 0.00 0.00 52.55 51.95 3jpn s ASP 226 Cb 0.06 0.45 0.01 0.00 1.07 0.00 0.00 42.92 44.51 3jpn s ASP 226 CO 0.57 -0.90 -0.12 -0.89 1.18 0.00 0.00 175.17 175.00 3jpn s THR 227 N -3.93 1.15 -0.16 -1.27 2.01 -1.26 -0.95 115.64 111.23 3jpn s THR 227 Ca 0.14 -0.49 -0.01 0.00 0.31 0.00 0.00 61.69 61.64 3jpn s THR 227 Cb 0.03 -1.05 -0.23 0.00 0.01 0.00 0.00 72.50 71.26 3jpn s THR 227 CO -0.02 0.36 0.18 0.18 -0.69 0.00 0.00 174.62 174.63 3jpn n LEU 228 N 3.79 2.45 -3.53 4.42 4.77 0.18 -4.85 117.00 124.23 3jpn n LEU 228 Ca -0.23 0.10 -0.13 0.00 -0.03 0.00 0.00 56.01 55.73 3jpn n LEU 228 Cb 0.52 -0.85 -0.05 0.00 -2.33 0.00 0.00 43.42 40.72 3jpn n LEU 228 CO 0.25 0.82 0.60 -0.94 -1.33 0.00 0.00 177.39 176.80 3jpn s SER 229 N -6.70 -0.49 -0.23 -1.43 1.04 -0.72 -4.40 113.70 100.77 3jpn s SER 229 Ca -0.24 0.40 -0.11 0.00 0.48 0.00 0.00 55.95 56.47 3jpn s SER 229 Cb 0.07 0.43 0.08 0.00 0.10 0.00 0.00 66.02 66.71 3jpn s SER 229 CO 0.72 -0.55 0.54 -0.75 0.98 0.00 0.00 173.24 174.18 3jpn s LYS 230 N -1.78 0.51 0.00 4.02 2.20 -1.26 -0.88 119.74 122.55 3jpn s LYS 230 Ca -0.03 1.07 0.00 0.00 -0.36 0.00 0.00 55.97 56.64 3jpn s LYS 230 Cb -0.00 0.21 0.00 0.00 -1.51 0.00 0.00 37.83 36.53 3jpn s LYS 230 CO 0.01 -0.18 0.00 0.41 -0.36 0.00 0.00 175.35 175.23 3jpn n GLY 231 N 4.63 5.42 0.21 5.54 0.00 -0.61 -5.02 105.19 115.36 3jpn n GLY 231 Ca -0.18 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.05 3jpn n GLY 231 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3jpn h GLU 232 N 0.00 0.18 0.00 1.61 4.39 -2.02 -3.35 114.58 115.39 3jpn h GLU 232 Ca 0.00 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.63 3jpn h GLU 232 Cb 0.00 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 3jpn h GLU 232 CO 0.00 0.49 0.00 0.25 -1.16 0.00 0.00 179.01 178.59 3jpn n THR 233 N -4.12 0.00 -3.72 1.13 -2.24 -1.26 -4.51 114.28 99.57 3jpn n THR 233 Ca -0.01 -0.34 -0.20 0.00 -2.27 0.00 0.00 64.05 61.22 3jpn n THR 233 Cb 0.40 1.14 -0.18 0.00 -2.10 0.00 0.00 70.33 69.59 3jpn n THR 233 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3jpn s LYS 234 N -0.38 0.11 -0.12 -0.78 2.20 -1.26 0.46 119.74 119.97 3jpn s LYS 234 Ca 0.00 0.29 -0.02 0.00 -0.36 0.00 0.00 55.97 55.88 3jpn s LYS 234 Cb 0.00 -0.60 -0.03 0.00 -1.51 0.00 0.00 37.83 35.69 3jpn s LYS 234 CO 0.00 -0.30 -0.05 0.12 -0.36 0.00 0.00 175.35 174.76 3jpn s PHE 235 N 1.99 3.00 -0.21 4.03 5.36 0.21 -1.58 117.98 130.79 3jpn s PHE 235 Ca 0.03 -0.17 -0.00 0.00 -0.96 0.00 0.00 56.93 55.83 3jpn s PHE 235 Cb -0.12 -1.86 0.06 0.00 -0.34 0.00 0.00 43.02 40.75 3jpn s PHE 235 CO -0.03 0.12 -0.03 1.41 -1.46 0.00 0.00 175.22 175.23 3jpn s MET 236 N -0.12 1.33 0.00 10.12 -2.45 -0.06 -1.27 119.30 126.85 3jpn s MET 236 Ca 0.02 -0.73 0.00 0.00 -1.25 0.00 0.00 55.69 53.73 3jpn s MET 236 Cb -0.13 -2.33 0.00 0.00 1.25 0.00 0.00 34.83 33.62 3jpn s MET 236 CO 0.03 -0.57 0.00 0.41 1.05 0.00 0.00 175.02 175.93 3jpn n GLY 237 N 4.82 3.94 3.16 2.11 0.00 0.13 0.49 105.19 119.84 3jpn n GLY 237 Ca -0.11 -0.79 -0.24 0.00 0.00 0.00 0.00 46.02 44.88 3jpn n GLY 237 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3jpn s VAL 238 N -1.05 1.32 0.24 1.61 1.01 -0.13 -0.88 120.40 122.53 3jpn s VAL 238 Ca 0.00 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.19 3jpn s VAL 238 Cb 0.00 -1.12 -0.05 0.00 0.00 0.00 0.00 36.38 35.22 3jpn s VAL 238 CO 0.00 0.30 0.12 0.00 0.00 0.00 0.00 175.10 175.52 3jpn s GLN 240 N -4.06 0.74 0.43 0.00 0.74 -0.21 0.88 119.66 118.18 3jpn s GLN 240 Ca 0.38 1.11 -0.23 0.00 0.05 0.00 0.00 55.36 56.67 3jpn s GLN 240 Cb 0.07 0.24 -0.08 0.00 1.10 0.00 0.00 33.01 34.34 3jpn s GLN 240 CO 0.14 -0.13 1.10 -0.51 -0.55 0.00 0.00 175.29 175.33 3jpn s LEU 241 N 1.11 4.08 0.30 3.68 1.43 -1.26 -4.61 118.68 123.41 3jpn s LEU 241 Ca -0.06 2.15 -0.28 0.00 -1.03 0.00 0.00 54.13 54.91 3jpn s LEU 241 Cb -0.05 -4.22 -0.09 0.00 0.03 0.00 0.00 46.19 41.86 3jpn s LEU 241 CO -0.11 -0.68 1.04 -2.16 0.23 0.00 0.00 176.35 174.67 3jpn s PRO 242 N -2.60 4.59 0.28 1.29 0.04 -1.26 -4.45 135.00 132.89 3jpn s PRO 242 Ca 0.60 1.64 0.07 0.00 0.04 0.00 0.00 61.00 63.35 3jpn s PRO 242 Cb -0.25 -3.05 -0.03 0.00 0.04 0.00 0.00 34.50 31.21 3jpn s PRO 242 CO 0.30 0.22 0.23 -1.54 0.04 0.00 0.00 177.00 176.25 3jpn s SER 243 N -1.14 5.43 0.71 6.66 1.04 -1.26 -4.96 113.70 120.18 3jpn s SER 243 Ca 0.47 -0.34 -0.06 0.00 0.48 0.00 0.00 55.95 56.49 3jpn s SER 243 Cb -0.28 -1.24 0.07 0.00 0.10 0.00 0.00 66.02 64.67 3jpn s SER 243 CO 0.35 -0.15 1.02 -0.54 0.98 0.00 0.00 173.24 174.89 3jpn s LYS 244 N -3.90 2.15 0.32 4.02 1.02 -1.26 -4.97 119.74 117.12 3jpn s LYS 244 Ca 0.36 -0.29 -0.28 0.00 0.02 0.00 0.00 55.97 55.77 3jpn s LYS 244 Cb -0.07 -2.17 -0.13 0.00 -0.52 0.00 0.00 37.83 34.94 3jpn s LYS 244 CO 0.25 -1.26 1.21 0.09 -0.92 0.00 0.00 175.35 174.72 3jpn n ASN 245 N -2.93 2.29 0.00 2.83 3.02 -1.26 -1.86 115.26 117.36 3jpn n ASN 245 Ca 0.08 1.20 0.00 0.00 -0.03 0.00 0.00 54.58 55.83 3jpn n ASN 245 Cb 0.60 -1.42 0.00 0.00 -0.61 0.00 0.00 39.78 38.36 3jpn n ASN 245 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3jpn n ASP 246 N 1.00 0.00 -4.83 6.41 10.43 -1.26 -4.95 116.55 123.34 3jpn n ASP 246 Ca 0.07 0.00 -0.37 0.00 2.57 0.00 0.00 54.79 57.05 3jpn n ASP 246 Cb 0.34 -1.48 -0.06 0.00 1.84 0.00 0.00 41.12 41.76 3jpn n ASP 246 CO 0.00 0.00 0.00 -1.83 -1.07 0.00 0.00 177.20 174.30 3jpn s GLU 247 N -0.25 4.02 0.45 -1.24 -1.05 -0.78 -5.03 118.70 114.81 3jpn s GLU 247 Ca 0.00 0.52 -0.24 0.00 -0.15 0.00 0.00 54.97 55.10 3jpn s GLU 247 Cb 0.00 -3.14 -0.09 0.00 -0.44 0.00 0.00 34.13 30.46 3jpn s GLU 247 CO 0.00 0.62 1.20 0.36 0.95 0.00 0.00 175.26 178.39 3jpn n LYS 248 N 1.48 1.70 -2.77 -4.83 2.85 -1.26 -4.67 118.16 110.66 3jpn n LYS 248 Ca -0.10 0.61 -0.32 0.00 -1.05 0.00 0.00 58.31 57.45 3jpn n LYS 248 Cb 0.52 -2.32 -0.05 0.00 -0.65 0.00 0.00 35.03 32.53 3jpn n LYS 248 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 177.40 175.52 3jpn s GLU 249 N -2.28 4.06 0.90 -1.58 -1.05 -1.26 -4.87 118.70 112.62 3jpn s GLU 249 Ca 0.64 0.92 -0.11 0.00 -0.15 0.00 0.00 54.97 56.27 3jpn s GLU 249 Cb -0.50 -2.24 0.14 0.00 -0.44 0.00 0.00 34.13 31.08 3jpn s GLU 249 CO 0.56 -0.06 1.12 0.71 0.95 0.00 0.00 175.26 178.54 3jpn s TYR 250 N -2.28 1.89 0.58 4.83 2.02 -1.26 -4.99 117.35 118.13 3jpn s TYR 250 Ca 0.58 1.63 -0.17 0.00 -0.37 0.00 0.00 57.07 58.75 3jpn s TYR 250 Cb -0.10 -3.23 -0.04 0.00 -0.40 0.00 0.00 41.96 38.19 3jpn s TYR 250 CO 0.21 -2.63 1.06 -2.14 -1.57 0.00 0.00 175.55 170.48 3jpn s PRO 251 N -4.72 3.36 0.48 -1.71 0.02 -1.26 -4.88 135.00 126.29 3jpn s PRO 251 Ca 0.65 1.26 -0.21 0.00 0.02 0.00 0.00 61.00 62.72 3jpn s PRO 251 Cb -0.21 -2.04 -0.08 0.00 0.02 0.00 0.00 34.50 32.19 3jpn s PRO 251 CO 0.58 -0.78 1.05 -1.01 -0.33 0.00 0.00 177.00 176.51 3jpn s HIS 252 N -2.34 2.99 0.06 6.54 3.76 -1.26 -4.67 115.29 120.37 3jpn s HIS 252 Ca 0.65 1.58 0.06 0.00 -0.15 0.00 0.00 55.06 57.20 3jpn s HIS 252 Cb -0.17 -3.10 -0.03 0.00 1.11 0.00 0.00 32.58 30.40 3jpn s HIS 252 CO 0.34 -0.89 -0.17 1.03 -0.85 0.00 0.00 174.74 174.20 3jpn s ARG 253 N -3.15 1.06 0.19 1.40 1.81 0.25 -4.47 118.95 116.05 3jpn s ARG 253 Ca 0.67 -0.95 -0.30 0.00 -1.72 0.00 0.00 55.73 53.43 3jpn s ARG 253 Cb -0.18 -1.17 -0.08 0.00 -0.45 0.00 0.00 34.95 33.07 3jpn s ARG 253 CO 0.21 0.28 1.12 1.03 -0.68 0.00 0.00 175.30 177.27 3jpn s ARG 254 N -1.48 4.57 -0.01 3.54 1.81 -1.26 0.18 118.95 126.29 3jpn s ARG 254 Ca 0.03 1.77 0.01 0.00 -1.72 0.00 0.00 55.73 55.82 3jpn s ARG 254 Cb -0.09 -3.26 0.01 0.00 -0.45 0.00 0.00 34.95 31.16 3jpn s ARG 254 CO 0.02 0.05 -0.01 -1.50 -0.68 0.00 0.00 175.30 173.19 3jpn s ILE 255 N -0.32 0.14 -0.07 1.52 2.07 -0.05 -2.11 121.20 122.38 3jpn s ILE 255 Ca 0.50 -0.01 0.04 0.00 -1.41 0.00 0.00 60.65 59.77 3jpn s ILE 255 Cb -0.31 -0.17 -0.00 0.00 0.13 0.00 0.00 42.46 42.11 3jpn s ILE 255 CO 0.36 0.08 -0.21 -1.81 -1.91 0.00 0.00 174.94 171.45 3jpn s ASP 256 N 0.35 2.61 -0.11 4.50 1.01 -0.64 -0.69 116.67 123.70 3jpn s ASP 256 Ca -0.03 -0.45 0.01 0.00 0.71 0.00 0.00 52.55 52.80 3jpn s ASP 256 Cb -0.06 -0.92 0.02 0.00 1.01 0.00 0.00 42.92 42.97 3jpn s ASP 256 CO -0.01 0.16 -0.15 -0.63 0.21 0.00 0.00 175.17 174.76 3jpn s ILE 257 N 0.15 1.46 -0.21 0.77 1.01 -0.40 -0.50 121.20 123.49 3jpn s ILE 257 Ca -0.09 -0.62 0.01 0.00 0.00 0.00 0.00 60.65 59.95 3jpn s ILE 257 Cb -0.15 -1.35 0.03 0.00 0.01 0.00 0.00 42.46 41.01 3jpn s ILE 257 CO 0.05 0.43 -0.15 -0.60 0.00 0.00 0.00 174.94 174.68 3jpn s ARG 258 N 1.06 2.79 -0.26 2.79 6.06 0.19 -0.62 118.95 130.96 3jpn s ARG 258 Ca -0.05 -0.98 -0.22 0.00 -2.50 0.00 0.00 55.73 51.98 3jpn s ARG 258 Cb -0.15 -2.74 -0.01 0.00 0.06 0.00 0.00 34.95 32.11 3jpn s ARG 258 CO -0.03 -0.33 0.72 -1.17 -2.50 0.00 0.00 175.30 171.99 3jpn s LEU 259 N 1.26 4.07 0.09 -0.88 2.96 0.17 -0.52 118.68 125.84 3jpn s LEU 259 Ca 0.01 0.81 0.10 0.00 -0.22 0.00 0.00 54.13 54.83 3jpn s LEU 259 Cb -0.15 -3.00 -0.03 0.00 0.50 0.00 0.00 46.19 43.50 3jpn s LEU 259 CO -0.09 -0.46 -0.25 -0.63 -1.32 0.00 0.00 176.35 173.61 3jpn s ILE 260 N 2.69 2.03 0.22 6.68 1.01 -0.65 -4.76 121.20 128.41 3jpn s ILE 260 Ca 0.30 -1.56 -0.32 0.00 0.00 0.00 0.00 60.65 59.07 3jpn s ILE 260 Cb -0.15 -1.79 -0.14 0.00 0.01 0.00 0.00 42.46 40.39 3jpn s ILE 260 CO 0.09 0.13 1.43 -2.65 0.00 0.00 0.00 174.94 173.94 3jpn n PRO 261 N 1.26 2.00 -0.36 2.79 -0.02 -1.26 -4.57 135.00 134.85 3jpn n PRO 261 Ca -0.18 0.72 0.10 0.00 -2.02 0.00 0.00 63.50 62.12 3jpn n PRO 261 Cb 0.53 -2.39 0.28 0.00 -0.02 0.00 0.00 33.50 31.91 3jpn n PRO 261 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3jpn h LYS 262 N 4.51 0.84 0.00 -0.52 1.63 -1.41 -0.12 116.57 121.49 3jpn h LYS 262 Ca -0.45 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 3jpn h LYS 262 Cb 1.28 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 32.72 3jpn h LYS 262 CO 0.78 0.56 0.00 -0.40 -3.45 0.00 0.00 179.45 176.93 3jpn n ASP 263 N -4.70 0.00 -0.51 4.20 5.75 -1.26 -2.97 116.55 117.05 3jpn n ASP 263 Ca 0.21 -0.46 0.06 0.00 -0.01 0.00 0.00 54.79 54.60 3jpn n ASP 263 Cb 0.48 -0.15 0.19 0.00 -1.03 0.00 0.00 41.12 40.60 3jpn n ASP 263 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3jpn n GLN 264 N -1.15 1.65 -0.04 0.11 6.02 -0.07 -4.82 117.38 119.09 3jpn n GLN 264 Ca 0.16 -2.97 -0.08 0.00 -0.01 0.00 0.00 57.00 54.10 3jpn n GLN 264 Cb 0.16 -1.63 -0.02 0.00 1.02 0.00 0.00 30.24 29.77 3jpn n GLN 264 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 177.06 175.13 3jpn h TYR 265 N 0.71 -0.40 -0.63 1.08 3.20 -1.47 -1.89 116.97 117.57 3jpn h TYR 265 Ca 0.03 0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.98 3jpn h TYR 265 Cb 1.14 0.21 -0.05 0.00 1.54 0.00 0.00 36.73 39.57 3jpn h TYR 265 CO 0.49 -0.23 0.35 1.88 -1.64 0.00 0.00 178.16 179.01 3jpn h TYR 266 N -0.16 0.65 -0.19 -3.82 0.05 -1.88 0.58 116.97 112.19 3jpn h TYR 266 Ca 0.12 0.02 -0.10 0.00 0.05 0.00 0.00 58.73 58.83 3jpn h TYR 266 Cb 0.34 -0.20 -0.01 0.00 1.01 0.00 0.00 36.73 37.87 3jpn h TYR 266 CO -0.31 0.32 -0.30 0.00 -1.05 0.00 0.00 178.16 176.83 3jpn h GLY 268 N 1.06 0.35 2.00 0.00 0.00 -0.25 -1.87 103.07 104.36 3jpn h GLY 268 Ca 0.04 -0.28 -0.09 0.00 0.00 0.00 0.00 47.33 47.00 3jpn h GLY 268 CO 0.05 0.26 -0.42 -0.24 0.00 0.00 0.00 176.54 176.18 3jpn h VAL 269 N 0.03 1.18 0.29 4.60 3.04 0.17 -0.74 116.25 124.81 3jpn h VAL 269 Ca 0.04 -1.52 -0.01 0.00 -1.01 0.00 0.00 66.70 64.20 3jpn h VAL 269 Cb 0.46 1.85 0.00 0.00 -2.01 0.00 0.00 31.29 31.60 3jpn h VAL 269 CO 0.02 0.42 -0.14 0.25 -1.01 0.00 0.00 177.57 177.10 3jpn h LEU 270 N 0.00 -0.33 0.01 3.16 5.85 -1.17 -1.33 115.31 121.51 3jpn h LEU 270 Ca -0.00 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.58 3jpn h LEU 270 Cb 0.82 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.88 3jpn h LEU 270 CO 0.06 -0.00 -0.28 0.22 -0.34 0.00 0.00 178.44 178.10 3jpn h TYR 271 N -0.67 -0.75 0.00 1.25 3.20 -1.16 -2.78 116.97 116.04 3jpn h TYR 271 Ca -0.04 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.85 3jpn h TYR 271 Cb 0.47 0.33 0.00 0.00 1.54 0.00 0.00 36.73 39.07 3jpn h TYR 271 CO 0.01 -0.37 0.00 0.35 -1.64 0.00 0.00 178.16 176.51 3jpn h PHE 272 N -0.43 0.00 0.00 -3.82 3.57 -1.17 -2.90 116.94 112.19 3jpn h PHE 272 Ca 0.06 0.00 -0.20 0.00 3.53 0.00 0.00 57.97 61.36 3jpn h PHE 272 Cb 0.51 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.22 3jpn h PHE 272 CO -0.30 0.00 -0.95 1.15 -2.23 0.00 0.00 178.31 175.98 3jpn h THR 273 N 0.00 1.61 -0.07 4.41 2.02 -0.97 0.61 112.91 120.51 3jpn h THR 273 Ca 0.00 -3.28 0.00 0.00 0.77 0.00 0.00 66.41 63.90 3jpn h THR 273 Cb 0.47 2.80 0.00 0.00 -1.74 0.00 0.00 68.15 69.68 3jpn h THR 273 CO 0.00 0.92 0.00 0.61 0.37 0.00 0.00 175.52 177.42 3jpn n GLY 274 N 1.34 0.88 3.23 2.16 0.00 -1.09 -4.10 105.19 107.60 3jpn n GLY 274 Ca 0.00 -0.67 -0.28 0.00 0.00 0.00 0.00 46.02 45.07 3jpn n GLY 274 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3jpn n SER 275 N -2.61 -2.61 -0.11 1.61 3.41 -0.31 -4.75 113.62 108.25 3jpn n SER 275 Ca 0.00 -1.05 -0.11 0.00 -0.26 0.00 0.00 58.87 57.45 3jpn n SER 275 Cb 0.00 -0.95 -0.03 0.00 -0.26 0.00 0.00 64.21 62.97 3jpn n SER 275 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 3jpn h ASP 276 N -2.90 0.53 -0.11 4.04 2.03 -1.90 0.53 116.42 118.64 3jpn h ASP 276 Ca -0.38 -0.29 -0.09 0.00 -0.73 0.00 0.00 57.03 55.53 3jpn h ASP 276 Cb 1.21 -0.14 -0.01 0.00 -0.83 0.00 0.00 39.33 39.55 3jpn h ASP 276 CO 0.25 0.69 -0.20 0.40 -1.03 0.00 0.00 179.24 179.34 3jpn h ILE 277 N 0.35 1.25 -0.49 4.15 2.04 -1.94 -0.60 117.51 122.27 3jpn h ILE 277 Ca 0.09 -1.19 -0.02 0.00 1.00 0.00 0.00 64.86 64.75 3jpn h ILE 277 Cb 0.41 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 3jpn h ILE 277 CO 0.01 0.38 0.24 0.15 0.00 0.00 0.00 178.15 178.94 3jpn h PHE 278 N 0.46 0.69 -0.59 1.37 3.04 -1.68 0.33 116.94 120.57 3jpn h PHE 278 Ca 0.07 -0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.00 3jpn h PHE 278 Cb 0.61 -0.22 -0.03 0.00 2.56 0.00 0.00 35.95 38.88 3jpn h PHE 278 CO 0.02 0.54 0.37 -0.91 -2.02 0.00 0.00 178.31 176.31 3jpn h ASN 279 N 0.64 0.69 -0.13 0.41 2.35 -0.36 0.58 115.58 119.76 3jpn h ASN 279 Ca 0.17 -0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.88 3jpn h ASN 279 Cb 0.10 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 3jpn h ASN 279 CO -0.02 0.52 0.07 0.11 -1.65 0.00 0.00 177.43 176.46 3jpn h LYS 280 N 0.79 0.18 -0.45 0.81 1.57 -0.63 0.23 116.57 119.08 3jpn h LYS 280 Ca 0.21 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.97 3jpn h LYS 280 Cb -0.06 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 3jpn h LYS 280 CO -0.04 0.20 0.26 -0.91 -0.57 0.00 0.00 179.45 178.39 3jpn h ASN 281 N 0.11 0.55 -0.51 0.86 2.35 -0.72 -0.12 115.58 118.10 3jpn h ASN 281 Ca 0.04 -0.07 -0.05 0.00 -0.55 0.00 0.00 56.30 55.68 3jpn h ASN 281 Cb 0.07 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 3jpn h ASN 281 CO -0.01 0.45 0.13 -0.03 -1.65 0.00 0.00 177.43 176.33 3jpn h MET 282 N 0.59 0.81 -0.37 0.81 4.05 -0.67 -0.71 114.93 119.44 3jpn h MET 282 Ca 0.16 -0.19 -0.08 0.00 -0.28 0.00 0.00 59.70 59.31 3jpn h MET 282 Cb 0.01 -0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 30.69 3jpn h MET 282 CO -0.03 0.77 -0.10 0.00 0.23 0.00 0.00 176.91 177.78 3jpn h ARG 283 N 0.70 0.65 -0.48 0.39 3.08 -0.30 -0.87 114.38 117.54 3jpn h ARG 283 Ca 0.16 -0.20 -0.09 0.00 0.07 0.00 0.00 59.98 59.93 3jpn h ARG 283 Cb 0.32 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 3jpn h ARG 283 CO -0.00 0.74 -0.04 0.00 -1.07 0.00 0.00 179.97 179.59 3jpn h ALA 284 N 1.30 0.66 -0.79 0.04 0.00 -0.73 -2.44 119.26 117.30 3jpn h ALA 284 Ca 0.11 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 3jpn h ALA 284 Cb 0.53 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 3jpn h ALA 284 CO 0.03 0.50 0.30 1.25 0.00 0.00 0.00 179.25 181.33 3jpn h HIS 285 N 0.74 1.21 -0.43 0.00 -0.00 -0.77 -1.86 115.15 114.05 3jpn h HIS 285 Ca 0.13 -0.10 0.04 0.00 -0.00 0.00 0.00 60.37 60.44 3jpn h HIS 285 Cb 0.57 -0.36 -0.04 0.00 -0.00 0.00 0.00 27.41 27.58 3jpn h HIS 285 CO 0.04 0.92 0.20 0.00 -0.00 0.00 0.00 177.93 179.09 3jpn h ALA 286 N 1.17 0.53 0.00 5.26 0.00 -0.98 -0.58 119.26 124.67 3jpn h ALA 286 Ca 0.26 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.22 3jpn h ALA 286 Cb 0.24 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3jpn h ALA 286 CO -0.02 -0.17 -0.16 -0.07 0.00 0.00 0.00 179.25 178.84 3jpn h LEU 287 N 0.40 -0.46 -1.89 0.00 3.38 -0.77 0.57 115.31 116.53 3jpn h LEU 287 Ca 0.19 0.07 0.15 0.00 0.09 0.00 0.00 57.88 58.38 3jpn h LEU 287 Cb 0.12 0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 3jpn h LEU 287 CO -0.15 -0.22 0.42 -0.33 0.09 0.00 0.00 178.44 178.25 3jpn h GLU 288 N -0.27 0.11 -0.10 1.13 5.08 -0.80 0.46 114.58 120.19 3jpn h GLU 288 Ca 0.05 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3jpn h GLU 288 Cb 0.33 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.55 3jpn h GLU 288 CO -0.15 0.07 0.00 1.63 -1.00 0.00 0.00 179.01 179.56 3jpn n LYS 289 N -4.40 1.73 -1.29 2.33 4.76 -0.24 -4.93 118.16 116.12 3jpn n LYS 289 Ca 0.11 -1.09 0.00 0.00 -2.87 0.00 0.00 58.31 54.46 3jpn n LYS 289 Cb 0.59 -1.44 0.00 0.00 -1.84 0.00 0.00 35.03 32.34 3jpn n LYS 289 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3jpn n GLY 290 N 1.17 0.70 3.27 0.72 0.00 0.16 -5.02 105.19 106.19 3jpn n GLY 290 Ca 0.17 -0.72 -0.15 0.00 0.00 0.00 0.00 46.02 45.32 3jpn n GLY 290 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3jpn s PHE 291 N -2.00 1.36 -0.05 1.61 0.40 0.18 -0.91 117.98 118.57 3jpn s PHE 291 Ca 0.00 -0.70 0.02 0.00 -0.60 0.00 0.00 56.93 55.66 3jpn s PHE 291 Cb 0.00 -0.68 0.01 0.00 0.51 0.00 0.00 43.02 42.86 3jpn s PHE 291 CO 0.00 0.14 -0.11 -0.08 0.70 0.00 0.00 175.22 175.87 3jpn s THR 292 N -3.11 1.01 -0.07 0.64 -1.32 0.33 -1.49 115.64 111.63 3jpn s THR 292 Ca 0.17 -0.44 0.04 0.00 -1.21 0.00 0.00 61.69 60.25 3jpn s THR 292 Cb 0.01 -0.92 -0.00 0.00 -1.51 0.00 0.00 72.50 70.08 3jpn s THR 292 CO 0.02 0.32 -0.22 -0.63 -2.21 0.00 0.00 174.62 171.90 3jpn s ILE 293 N 0.50 1.84 0.31 5.08 1.01 -1.26 -1.57 121.20 127.12 3jpn s ILE 293 Ca -0.10 -0.92 0.04 0.00 0.00 0.00 0.00 60.65 59.67 3jpn s ILE 293 Cb -0.13 -1.59 -0.02 0.00 0.01 0.00 0.00 42.46 40.73 3jpn s ILE 293 CO 0.02 0.51 0.15 -0.46 0.00 0.00 0.00 174.94 175.17 3jpn n ASN 294 N 3.34 0.71 0.00 3.58 0.23 -0.64 -4.94 115.26 117.53 3jpn n ASN 294 Ca -0.19 -2.76 0.09 0.00 -0.53 0.00 0.00 54.58 51.18 3jpn n ASN 294 Cb 0.53 0.97 0.50 0.00 -2.08 0.00 0.00 39.78 39.70 3jpn n ASN 294 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 3jpn n GLU 295 N -0.68 0.51 -0.06 -3.83 0.00 -1.26 -3.33 120.64 111.98 3jpn n GLU 295 Ca -0.02 0.01 -0.09 0.00 0.00 0.00 0.00 57.16 57.06 3jpn n GLU 295 Cb 0.49 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 30.37 3jpn n GLU 295 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 3jpn n TYR 296 N -1.03 0.00 -3.82 -1.84 4.01 -1.26 -2.21 117.16 111.01 3jpn n TYR 296 Ca 0.12 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.79 3jpn n TYR 296 Cb 0.07 -0.50 0.03 0.00 -0.31 0.00 0.00 39.34 38.62 3jpn n TYR 296 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3jpn s THR 297 N -2.26 0.00 -0.09 -0.72 -4.23 -1.21 -4.73 115.64 102.40 3jpn s THR 297 Ca -0.17 -0.93 0.01 0.00 -1.18 0.00 0.00 61.69 59.42 3jpn s THR 297 Cb 0.04 -2.94 0.02 0.00 1.34 0.00 0.00 72.50 70.96 3jpn s THR 297 CO 0.30 0.00 -0.11 -0.51 -0.54 0.00 0.00 174.62 173.76 3jpn s ILE 298 N -2.18 1.15 0.08 2.99 2.07 -1.26 -1.63 121.20 122.42 3jpn s ILE 298 Ca 0.17 -0.44 0.06 0.00 -1.41 0.00 0.00 60.65 59.03 3jpn s ILE 298 Cb -0.05 -1.09 -0.03 0.00 0.13 0.00 0.00 42.46 41.42 3jpn s ILE 298 CO 0.11 0.37 -0.15 -0.13 -1.91 0.00 0.00 174.94 173.23 3jpn s ARG 299 N 1.08 0.87 0.67 3.50 0.52 -0.61 -1.60 118.95 123.39 3jpn s ARG 299 Ca -0.06 -1.00 -0.11 0.00 -0.52 0.00 0.00 55.73 54.04 3jpn s ARG 299 Cb -0.14 -0.92 -0.01 0.00 0.52 0.00 0.00 34.95 34.40 3jpn s ARG 299 CO -0.01 0.20 1.05 -1.25 0.02 0.00 0.00 175.30 175.31 3jpn s PRO 300 N -1.80 3.18 -0.26 3.54 0.04 -1.26 -0.51 135.00 137.92 3jpn s PRO 300 Ca -0.00 0.87 -0.10 0.00 0.04 0.00 0.00 61.00 61.81 3jpn s PRO 300 Cb -0.10 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 3jpn s PRO 300 CO 0.03 -0.91 0.15 -0.51 0.04 0.00 0.00 177.00 175.80 3jpn s LEU 301 N -5.41 3.83 1.18 -3.56 1.43 -0.09 -0.48 118.68 115.59 3jpn s LEU 301 Ca 0.57 -0.06 -0.13 0.00 -1.03 0.00 0.00 54.13 53.47 3jpn s LEU 301 Cb -0.13 -2.05 0.28 0.00 0.03 0.00 0.00 46.19 44.32 3jpn s LEU 301 CO 0.55 -0.03 0.92 0.61 0.23 0.00 0.00 176.35 178.62 3jpn n GLY 302 N 4.92 -2.10 0.46 -3.19 0.00 0.15 -4.72 105.19 100.72 3jpn n GLY 302 Ca -0.15 -1.15 0.28 0.00 0.00 0.00 0.00 46.02 45.00 3jpn n GLY 302 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3jpn h VAL 303 N -2.66 0.54 -0.00 1.61 -1.51 -1.98 0.28 116.25 112.53 3jpn h VAL 303 Ca -0.62 -0.03 0.00 0.00 -1.23 0.00 0.00 66.70 64.82 3jpn h VAL 303 Cb 1.34 0.44 0.00 0.00 -2.13 0.00 0.00 31.29 30.94 3jpn h VAL 303 CO 0.48 0.02 -0.62 0.35 -1.23 0.00 0.00 177.57 176.57 3jpn n THR 304 N -4.32 0.00 0.00 7.19 -2.24 -1.26 -4.95 114.28 108.70 3jpn n THR 304 Ca 0.21 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.96 3jpn n THR 304 Cb 0.97 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.71 3jpn n THR 304 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3jpn n GLY 305 N 1.48 0.82 3.75 3.38 0.00 1.00 -5.09 105.19 110.53 3jpn n GLY 305 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 3jpn n GLY 305 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3jpn s VAL 306 N -2.00 4.62 0.59 1.61 0.11 -1.26 -4.63 120.40 119.44 3jpn s VAL 306 Ca 0.00 1.72 -0.20 0.00 -2.93 0.00 0.00 61.98 60.56 3jpn s VAL 306 Cb 0.00 -4.15 -0.03 0.00 -1.53 0.00 0.00 36.38 30.66 3jpn s VAL 306 CO 0.00 0.39 1.34 0.00 -3.33 0.00 0.00 175.10 173.50 3jpn n ALA 307 N 2.57 1.44 -2.27 1.54 0.00 -1.26 0.34 120.51 122.87 3jpn n ALA 307 Ca -0.02 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.50 3jpn n ALA 307 Cb 0.50 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.60 3jpn n ALA 307 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jpn n GLY 308 N 0.81 3.37 3.79 0.00 0.00 0.37 -4.77 105.19 108.77 3jpn n GLY 308 Ca 0.13 -2.01 -0.35 0.00 0.00 0.00 0.00 46.02 43.78 3jpn n GLY 308 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3jpn s GLU 309 N 2.63 4.23 0.32 1.61 0.41 -1.26 -4.72 118.70 121.93 3jpn s GLU 309 Ca 0.00 1.36 -0.28 0.00 -0.41 0.00 0.00 54.97 55.63 3jpn s GLU 309 Cb 0.00 -2.46 -0.13 0.00 -1.78 0.00 0.00 34.13 29.76 3jpn s GLU 309 CO 0.00 -0.05 1.25 -2.30 -0.49 0.00 0.00 175.26 173.67 3jpn n PRO 310 N -0.17 1.97 -3.44 0.39 -0.02 -1.26 -4.38 135.00 128.09 3jpn n PRO 310 Ca 0.05 0.69 -0.31 0.00 -2.02 0.00 0.00 63.50 61.92 3jpn n PRO 310 Cb 0.51 -2.25 -0.05 0.00 -0.02 0.00 0.00 33.50 31.70 3jpn n PRO 310 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3jpn s LEU 311 N -0.62 4.16 0.19 2.45 1.43 -0.62 -5.00 118.68 120.66 3jpn s LEU 311 Ca 0.58 0.81 -0.31 0.00 -1.03 0.00 0.00 54.13 54.18 3jpn s LEU 311 Cb -0.60 -3.58 -0.09 0.00 0.03 0.00 0.00 46.19 41.95 3jpn s LEU 311 CO 0.60 -0.08 1.39 -2.16 0.23 0.00 0.00 176.35 176.34 3jpn s PRO 312 N -2.96 4.32 -0.04 1.29 0.04 -1.26 -4.74 135.00 131.64 3jpn s PRO 312 Ca 0.45 2.16 0.02 0.00 0.04 0.00 0.00 61.00 63.67 3jpn s PRO 312 Cb -0.11 -3.18 0.02 0.00 0.04 0.00 0.00 34.50 31.26 3jpn s PRO 312 CO 0.24 -0.38 -0.07 0.08 0.04 0.00 0.00 177.00 176.91 3jpn s VAL 313 N 0.46 0.68 -0.00 -0.36 1.01 -1.26 -4.98 120.40 115.94 3jpn s VAL 313 Ca 0.61 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.35 3jpn s VAL 313 Cb -0.39 -0.66 0.00 0.00 0.00 0.00 0.00 36.38 35.34 3jpn s VAL 313 CO 0.37 0.24 0.82 0.47 0.00 0.00 0.00 175.10 177.00 3jpn n ASP 314 N 3.78 1.26 -3.61 3.32 9.92 -1.26 -4.99 116.55 124.98 3jpn n ASP 314 Ca -0.23 -1.64 -0.01 0.00 -0.53 0.00 0.00 54.79 52.38 3jpn n ASP 314 Cb 0.52 -0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 40.99 3jpn n ASP 314 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 3jpn s SER 315 N -0.64 -0.07 0.29 -2.24 1.04 -1.26 -4.99 113.70 105.82 3jpn s SER 315 Ca 0.00 -0.07 0.02 0.00 0.48 0.00 0.00 55.95 56.39 3jpn s SER 315 Cb 0.00 0.13 0.44 0.00 0.10 0.00 0.00 66.02 66.69 3jpn s SER 315 CO 0.00 -0.22 1.76 -0.33 0.98 0.00 0.00 173.24 175.43 3jpn h GLU 316 N 2.00 0.53 -0.90 4.02 5.08 -1.98 -2.81 114.58 120.52 3jpn h GLU 316 Ca -0.21 -0.17 0.04 0.00 -1.00 0.00 0.00 59.36 58.02 3jpn h GLU 316 Cb 1.18 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 30.33 3jpn h GLU 316 CO 0.26 0.68 0.58 -0.22 -1.00 0.00 0.00 179.01 179.31 3jpn h LYS 317 N 0.48 1.09 -1.00 2.33 3.64 -1.98 -1.63 116.57 119.51 3jpn h LYS 317 Ca 0.08 -0.07 0.19 0.00 -1.27 0.00 0.00 60.65 59.59 3jpn h LYS 317 Cb 0.56 -0.25 -0.11 0.00 -0.41 0.00 0.00 32.23 32.03 3jpn h LYS 317 CO 0.04 0.72 0.61 -0.44 -2.27 0.00 0.00 179.45 178.11 3jpn h ASP 318 N 1.13 0.77 -0.42 4.20 3.32 -1.88 0.12 116.42 123.65 3jpn h ASP 318 Ca 0.36 0.09 -0.06 0.00 0.02 0.00 0.00 57.03 57.45 3jpn h ASP 318 Cb 0.02 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 3jpn h ASP 318 CO -0.12 0.27 0.02 0.40 -1.72 0.00 0.00 179.24 178.09 3jpn h ILE 319 N 0.75 1.26 -0.76 0.35 2.04 -1.39 -2.16 117.51 117.60 3jpn h ILE 319 Ca 0.58 -0.99 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 3jpn h ILE 319 Cb 0.92 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 38.02 3jpn h ILE 319 CO -0.37 0.34 0.42 -0.26 0.00 0.00 0.00 178.15 178.28 3jpn h PHE 320 N 0.57 1.04 -0.48 1.37 -1.00 -0.68 -2.91 116.94 114.85 3jpn h PHE 320 Ca 0.12 -0.02 -0.01 0.00 2.81 0.00 0.00 57.97 60.87 3jpn h PHE 320 Cb 0.45 -0.33 -0.02 0.00 3.61 0.00 0.00 35.95 39.66 3jpn h PHE 320 CO 0.03 0.73 0.26 -0.44 -1.61 0.00 0.00 178.31 177.28 3jpn h ASP 321 N 1.05 0.61 -0.98 2.17 3.32 -0.68 -0.44 116.42 121.46 3jpn h ASP 321 Ca 0.27 -0.10 0.20 0.00 0.02 0.00 0.00 57.03 57.42 3jpn h ASP 321 Cb 0.03 -0.16 -0.09 0.00 0.22 0.00 0.00 39.33 39.33 3jpn h ASP 321 CO -0.04 0.54 0.62 1.88 -1.72 0.00 0.00 179.24 180.51 3jpn h TYR 322 N 0.64 0.85 -0.69 4.55 0.99 -1.19 0.65 116.97 122.76 3jpn h TYR 322 Ca 0.17 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.93 3jpn h TYR 322 Cb 0.07 -0.26 0.00 0.00 1.00 0.00 0.00 36.73 37.54 3jpn h TYR 322 CO -0.02 0.18 0.00 0.44 -0.00 0.00 0.00 178.16 178.77 3jpn n ILE 323 N -4.66 1.65 -3.52 -2.88 -5.35 -1.03 -4.96 119.36 98.60 3jpn n ILE 323 Ca 0.22 -1.15 -0.20 0.00 -0.27 0.00 0.00 62.75 61.36 3jpn n ILE 323 Cb 0.66 0.22 0.08 0.00 -1.74 0.00 0.00 39.64 38.85 3jpn n ILE 323 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3jpn n GLN 324 N 1.30 -6.78 -5.14 6.28 6.02 0.22 -4.94 117.38 114.34 3jpn n GLN 324 Ca 0.26 0.81 -0.32 0.00 -0.01 0.00 0.00 57.00 57.74 3jpn n GLN 324 Cb 0.84 -5.79 -0.16 0.00 1.02 0.00 0.00 30.24 26.15 3jpn n GLN 324 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 3jpn s TRP 325 N -3.38 2.53 0.44 1.08 0.52 -0.22 -5.02 118.94 114.89 3jpn s TRP 325 Ca 0.19 -0.63 -0.24 0.00 0.02 0.00 0.00 56.10 55.44 3jpn s TRP 325 Cb -0.08 -1.64 -0.08 0.00 -1.15 0.00 0.00 33.47 30.52 3jpn s TRP 325 CO 0.74 -0.15 1.19 0.15 0.02 0.00 0.00 176.95 178.90 3jpn s LYS 326 N -0.18 3.86 0.34 4.98 1.02 -1.26 -4.05 119.74 124.45 3jpn s LYS 326 Ca -0.02 1.85 -0.29 0.00 0.02 0.00 0.00 55.97 57.53 3jpn s LYS 326 Cb -0.14 -2.53 -0.12 0.00 -0.52 0.00 0.00 37.83 34.53 3jpn s LYS 326 CO 0.03 -0.49 1.44 0.98 -0.92 0.00 0.00 175.35 176.39 3jpn n TYR 327 N -0.25 2.68 -4.48 3.18 9.36 -1.26 -4.99 117.16 121.39 3jpn n TYR 327 Ca 0.06 0.44 -0.31 0.00 3.32 0.00 0.00 57.90 61.42 3jpn n TYR 327 Cb 0.47 -2.50 -0.17 0.00 -0.63 0.00 0.00 39.34 36.51 3jpn n TYR 327 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 3jpn s ARG 328 N -1.61 2.63 0.69 2.98 0.52 -1.26 -5.12 118.95 117.78 3jpn s ARG 328 Ca 0.57 -0.71 -0.16 0.00 -0.52 0.00 0.00 55.73 54.92 3jpn s ARG 328 Cb -0.52 -2.20 0.02 0.00 0.52 0.00 0.00 34.95 32.77 3jpn s ARG 328 CO 0.59 -0.07 1.19 -1.21 0.02 0.00 0.00 175.30 175.82 3jpn s GLU 329 N 0.99 2.43 0.26 3.54 0.41 -1.26 -4.88 118.70 120.19 3jpn s GLU 329 Ca -0.05 1.70 -0.02 0.00 -0.41 0.00 0.00 54.97 56.19 3jpn s GLU 329 Cb -0.15 -1.87 0.55 0.00 -1.78 0.00 0.00 34.13 30.88 3jpn s GLU 329 CO -0.04 -1.60 1.67 -1.35 -0.49 0.00 0.00 175.26 173.45 3jpn h PRO 330 N -0.00 0.24 0.00 0.39 0.11 -1.94 0.16 132.00 130.96 3jpn h PRO 330 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3jpn h PRO 330 Cb 1.29 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3jpn h PRO 330 CO 0.52 0.16 0.00 1.57 -0.21 0.00 0.00 178.00 180.03 3jpn h LYS 331 N 0.25 0.00 -0.48 1.05 2.10 -1.80 -1.16 116.57 116.53 3jpn h LYS 331 Ca 0.47 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.12 3jpn h LYS 331 Cb 0.86 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.19 3jpn h LYS 331 CO -0.57 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 176.63 3jpn n ASP 332 N -2.49 4.09 -1.17 7.07 8.00 0.57 -4.41 116.55 128.22 3jpn n ASP 332 Ca -0.02 -2.47 0.08 0.00 0.71 0.00 0.00 54.79 53.09 3jpn n ASP 332 Cb 0.05 -0.48 0.28 0.00 -0.02 0.00 0.00 41.12 40.95 3jpn n ASP 332 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3jpn n ARG 333 N 0.57 3.36 -2.59 -1.24 1.74 -0.44 -4.85 116.66 113.20 3jpn n ARG 333 Ca 0.21 -2.69 -0.43 0.00 -0.77 0.00 0.00 57.85 54.17 3jpn n ARG 333 Cb 0.77 -1.74 0.00 0.00 -1.02 0.00 0.00 32.46 30.47 3jpn n ARG 333 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3jpn n SER 334 N 0.47 4.94 -0.73 0.55 7.64 -1.26 -1.16 113.62 124.06 3jpn n SER 334 Ca 0.21 -2.95 0.09 0.00 1.01 0.00 0.00 58.87 57.23 3jpn n SER 334 Cb 0.79 -1.65 0.08 0.00 -1.01 0.00 0.00 64.21 62.42 3jpn n SER 334 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41