#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n0n s HIS 2 N 0.00 2.61 0.05 5.64 3.76 -1.26 -5.04 115.29 121.05 1n0n s HIS 2 Ca 0.00 1.54 0.00 0.00 -0.15 0.00 0.00 55.06 56.45 1n0n s HIS 2 Cb 0.00 -3.30 -0.03 0.00 1.11 0.00 0.00 32.58 30.36 1n0n s HIS 2 CO 0.00 -1.69 -0.04 -1.54 -0.85 0.00 0.00 174.74 170.62 1n0n s SER 3 N -1.87 0.54 -0.24 1.40 1.04 -1.26 -4.93 113.70 108.38 1n0n s SER 3 Ca 0.73 -0.78 -0.29 0.00 0.48 0.00 0.00 55.95 56.08 1n0n s SER 3 Cb -0.24 0.13 -0.01 0.00 0.10 0.00 0.00 66.02 66.00 1n0n s SER 3 CO 0.30 -0.44 1.35 -0.22 0.98 0.00 0.00 173.24 175.21 1n0n s LEU 4 N -2.30 3.99 0.50 2.42 2.96 -1.26 -5.00 118.68 119.99 1n0n s LEU 4 Ca -0.02 1.46 -0.20 0.00 -0.22 0.00 0.00 54.13 55.15 1n0n s LEU 4 Cb -0.00 -3.54 -0.08 0.00 0.50 0.00 0.00 46.19 43.07 1n0n s LEU 4 CO -0.05 -1.00 1.08 -2.16 -1.32 0.00 0.00 176.35 172.89 1n0n s PRO 5 N 4.03 3.65 0.62 0.98 0.04 -1.26 -5.01 135.00 138.06 1n0n s PRO 5 Ca 0.59 1.47 -0.16 0.00 0.04 0.00 0.00 61.00 62.94 1n0n s PRO 5 Cb -0.20 -2.09 -0.02 0.00 0.04 0.00 0.00 34.50 32.23 1n0n s PRO 5 CO 0.22 -0.57 1.09 -0.51 0.04 0.00 0.00 177.00 177.26 1n0n s ASP 6 N -1.87 5.46 0.47 6.66 -0.00 -1.26 -5.01 116.67 121.12 1n0n s ASP 6 Ca 0.69 1.93 -0.21 0.00 -0.00 0.00 0.00 52.55 54.96 1n0n s ASP 6 Cb -0.20 -2.55 -0.09 0.00 -0.00 0.00 0.00 42.92 40.09 1n0n s ASP 6 CO 0.23 -1.39 1.04 -0.76 -0.00 0.00 0.00 175.17 174.29 1n0n s LEU 7 N -4.61 3.90 0.00 1.23 1.02 -1.26 -4.92 118.68 114.04 1n0n s LEU 7 Ca 0.66 1.93 0.29 0.00 0.02 0.00 0.00 54.13 57.04 1n0n s LEU 7 Cb -0.19 -4.50 1.75 0.00 0.02 0.00 0.00 46.19 43.27 1n0n s LEU 7 CO 0.38 -0.72 2.08 -2.65 0.02 0.00 0.00 176.35 175.47 1n0n n PRO 8 N -0.81 0.91 -3.93 1.29 -0.02 -1.26 -4.85 135.00 126.33 1n0n n PRO 8 Ca 0.09 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.46 1n0n n PRO 8 Cb 0.52 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.49 1n0n n PRO 8 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1n0n s TYR 9 N -2.00 0.36 0.66 6.00 1.13 -1.26 -5.07 117.35 117.16 1n0n s TYR 9 Ca 0.44 -0.82 -0.11 0.00 -1.41 0.00 0.00 57.07 55.17 1n0n s TYR 9 Cb 0.20 0.44 -0.01 0.00 -1.10 0.00 0.00 41.96 41.49 1n0n s TYR 9 CO 0.34 -1.28 1.05 -0.51 -2.51 0.00 0.00 175.55 172.63 1n0n s ASP 10 N -3.08 5.75 0.56 -0.18 1.01 -1.26 -4.95 116.67 114.52 1n0n s ASP 10 Ca 0.20 1.54 0.24 0.00 0.71 0.00 0.00 52.55 55.25 1n0n s ASP 10 Cb -0.03 -2.49 1.54 0.00 1.01 0.00 0.00 42.92 42.96 1n0n s ASP 10 CO 0.12 -1.20 2.15 1.88 0.21 0.00 0.00 175.17 178.34 1n0n h TYR 11 N -0.51 0.00 -0.68 4.23 0.05 -1.96 -1.46 116.97 116.65 1n0n h TYR 11 Ca -0.44 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.34 1n0n h TYR 11 Cb 1.20 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.94 1n0n h TYR 11 CO 0.64 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 178.16 1n0n n GLY 12 N -1.45 2.59 0.12 3.88 0.00 -1.26 -3.95 105.19 105.11 1n0n n GLY 12 Ca -0.00 -0.77 0.12 0.00 0.00 0.00 0.00 46.02 45.37 1n0n n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n0n n ALA 13 N 1.43 1.73 -0.10 4.61 0.00 -0.55 -2.77 120.51 124.86 1n0n n ALA 13 Ca 0.23 0.06 0.10 0.00 0.00 0.00 0.00 53.44 53.84 1n0n n ALA 13 Cb 0.65 -1.38 0.24 0.00 0.00 0.00 0.00 19.45 18.95 1n0n n ALA 13 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1n0n n LEU 14 N -2.17 3.48 -4.76 0.00 4.77 -1.26 -4.37 117.00 112.68 1n0n n LEU 14 Ca 0.03 -1.81 -0.37 0.00 -0.03 0.00 0.00 56.01 53.82 1n0n n LEU 14 Cb 0.25 -0.34 0.01 0.00 -2.33 0.00 0.00 43.42 41.01 1n0n n LEU 14 CO 0.20 0.83 0.87 -1.61 -1.33 0.00 0.00 177.39 176.36 1n0n s GLU 15 N -1.12 3.40 0.00 3.23 0.41 -1.12 -1.56 118.70 121.94 1n0n s GLU 15 Ca 0.38 1.90 0.21 0.00 -0.41 0.00 0.00 54.97 57.06 1n0n s GLU 15 Cb 0.21 -2.24 0.65 0.00 -1.78 0.00 0.00 34.13 30.97 1n0n s GLU 15 CO 0.28 -0.89 1.50 -0.35 -0.49 0.00 0.00 175.26 175.31 1n0n n PRO 16 N -0.92 1.92 -0.04 0.39 -0.04 -1.26 -4.89 135.00 130.16 1n0n n PRO 16 Ca 0.10 -1.39 -0.11 0.00 -0.04 0.00 0.00 63.50 62.06 1n0n n PRO 16 Cb 0.48 -1.42 -0.05 0.00 -0.04 0.00 0.00 33.50 32.47 1n0n n PRO 16 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1n0n h HIS 17 N 2.78 0.26 -3.25 0.54 3.86 -1.63 -3.39 115.15 114.30 1n0n h HIS 17 Ca 0.00 -0.02 -0.52 0.00 -1.16 0.00 0.00 60.37 58.66 1n0n h HIS 17 Cb 0.61 -0.08 -0.38 0.00 1.06 0.00 0.00 27.41 28.63 1n0n h HIS 17 CO 0.14 0.33 -0.79 0.42 0.86 0.00 0.00 177.93 178.89 1n0n s ILE 18 N -5.51 0.94 0.78 2.45 1.01 -0.88 -4.78 121.20 115.20 1n0n s ILE 18 Ca -0.14 -0.38 -0.11 0.00 0.00 0.00 0.00 60.65 60.02 1n0n s ILE 18 Cb 0.07 -1.07 0.06 0.00 0.01 0.00 0.00 42.46 41.53 1n0n s ILE 18 CO 0.70 0.22 1.08 0.54 0.00 0.00 0.00 174.94 177.49 1n0n s ASN 19 N 1.72 4.60 0.27 3.58 2.20 -1.26 -3.40 114.94 122.64 1n0n s ASN 19 Ca 0.03 1.48 -0.02 0.00 -0.94 0.00 0.00 52.86 53.41 1n0n s ASN 19 Cb -0.14 -2.24 0.44 0.00 -2.00 0.00 0.00 41.25 37.30 1n0n s ASN 19 CO -0.08 -1.92 1.86 0.00 -2.94 0.00 0.00 177.10 174.02 1n0n h ALA 20 N -1.05 1.39 -0.62 3.54 0.00 -1.89 -2.51 119.26 118.11 1n0n h ALA 20 Ca -0.46 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 1n0n h ALA 20 Cb 1.25 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 1n0n h ALA 20 CO 0.57 0.35 0.33 0.37 0.00 0.00 0.00 179.25 180.86 1n0n h GLN 21 N 1.08 0.88 -0.23 0.00 4.15 -1.93 0.16 115.11 119.22 1n0n h GLN 21 Ca 0.44 -0.11 -0.01 0.00 0.77 0.00 0.00 58.65 59.74 1n0n h GLN 21 Cb 0.27 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.78 1n0n h GLN 21 CO -0.20 0.68 0.12 0.82 -1.93 0.00 0.00 178.83 178.32 1n0n h ILE 22 N 0.85 1.13 -0.20 2.39 2.04 -1.85 -1.89 117.51 119.99 1n0n h ILE 22 Ca 0.22 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 1n0n h ILE 22 Cb 0.07 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 1n0n h ILE 22 CO -0.03 0.13 0.10 0.24 0.00 0.00 0.00 178.15 178.58 1n0n h MET 23 N 0.25 0.28 -0.22 2.37 2.86 -1.15 0.18 114.93 119.51 1n0n h MET 23 Ca 0.08 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.70 1n0n h MET 23 Cb 0.10 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 1n0n h MET 23 CO -0.01 0.31 0.08 0.37 1.06 0.00 0.00 176.91 178.71 1n0n h GLN 24 N 0.19 0.18 -0.32 1.72 -0.00 -0.63 -1.22 115.11 115.03 1n0n h GLN 24 Ca 0.07 -0.01 -0.09 0.00 -0.00 0.00 0.00 58.65 58.62 1n0n h GLN 24 Cb 0.11 -0.04 -0.01 0.00 0.00 0.00 0.00 27.48 27.55 1n0n h GLN 24 CO -0.01 0.12 -0.15 -0.07 0.00 0.00 0.00 178.83 178.72 1n0n h LEU 25 N 0.18 0.69 -0.95 -2.39 3.38 -1.27 -1.21 115.31 113.75 1n0n h LEU 25 Ca 0.09 -0.41 0.05 0.00 0.09 0.00 0.00 57.88 57.71 1n0n h LEU 25 Cb 0.05 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.55 1n0n h LEU 25 CO -0.09 0.95 0.61 -0.74 0.09 0.00 0.00 178.44 179.26 1n0n h HIS 26 N 0.44 1.14 0.00 1.13 2.76 -0.41 -0.61 115.15 119.60 1n0n h HIS 26 Ca 0.07 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.21 1n0n h HIS 26 Cb 0.68 -0.38 -0.01 0.00 1.55 0.00 0.00 27.41 29.26 1n0n h HIS 26 CO 0.06 0.62 -0.51 1.25 -1.30 0.00 0.00 177.93 178.05 1n0n h HIS 27 N 1.14 0.00 0.00 5.26 -0.00 -1.23 -0.64 115.15 119.69 1n0n h HIS 27 Ca 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.77 1n0n h HIS 27 Cb 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.50 1n0n h HIS 27 CO -0.01 0.51 0.00 0.66 -0.00 0.00 0.00 177.93 179.08 1n0n h SER 28 N -1.00 0.00 0.00 3.26 4.64 -1.30 -2.87 113.55 116.28 1n0n h SER 28 Ca -0.09 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.20 1n0n h SER 28 Cb 0.66 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1n0n h SER 28 CO -0.05 0.00 -0.55 0.29 -0.87 0.00 0.00 176.83 175.65 1n0n n LYS 29 N -2.86 0.14 0.17 4.77 4.76 -0.35 -4.49 118.16 120.30 1n0n n LYS 29 Ca 0.02 0.06 -0.12 0.00 -2.87 0.00 0.00 58.31 55.39 1n0n n LYS 29 Cb 0.37 -0.74 -0.07 0.00 -1.84 0.00 0.00 35.03 32.75 1n0n n LYS 29 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1n0n h VAL 30 N -0.25 0.56 -0.37 -0.18 2.07 -1.26 -2.49 116.25 114.33 1n0n h VAL 30 Ca -0.05 -0.66 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 1n0n h VAL 30 Cb 0.49 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 1n0n h VAL 30 CO -0.03 0.11 0.18 -0.74 0.02 0.00 0.00 177.57 177.11 1n0n h HIS 31 N -0.88 0.54 -0.70 1.57 -0.00 -1.18 -2.94 115.15 111.56 1n0n h HIS 31 Ca -0.05 -0.03 0.15 0.00 -0.00 0.00 0.00 60.37 60.45 1n0n h HIS 31 Cb 0.53 -0.17 -0.11 0.00 -0.00 0.00 0.00 27.41 27.66 1n0n h HIS 31 CO 0.03 0.46 0.12 0.00 -0.00 0.00 0.00 177.93 178.54 1n0n h ALA 32 N 1.03 0.85 -0.72 5.26 0.00 -1.56 -1.15 119.26 122.97 1n0n h ALA 32 Ca 0.13 0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 1n0n h ALA 32 Cb 0.12 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1n0n h ALA 32 CO -0.02 -0.36 0.33 0.00 0.00 0.00 0.00 179.25 179.21 1n0n h ALA 33 N 1.60 0.93 -0.98 0.00 0.00 -1.27 -2.21 119.26 117.33 1n0n h ALA 33 Ca 0.39 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.16 1n0n h ALA 33 Cb 0.66 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1n0n h ALA 33 CO -0.52 0.51 0.65 1.88 0.00 0.00 0.00 179.25 181.77 1n0n h TYR 34 N 1.02 1.23 0.12 0.00 0.99 -1.08 0.17 116.97 119.40 1n0n h TYR 34 Ca 0.25 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 61.00 1n0n h TYR 34 Cb 0.14 -0.41 0.00 0.00 1.00 0.00 0.00 36.73 37.46 1n0n h TYR 34 CO 0.01 0.76 -0.06 0.28 -0.00 0.00 0.00 178.16 179.15 1n0n h VAL 35 N 1.31 1.03 -0.65 -2.88 2.07 -1.00 0.23 116.25 116.36 1n0n h VAL 35 Ca 0.37 -0.60 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 1n0n h VAL 35 Cb -0.12 1.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1n0n h VAL 35 CO -0.09 0.14 0.34 0.78 0.02 0.00 0.00 177.57 178.76 1n0n h ASN 36 N -0.44 0.82 0.26 0.57 2.35 -1.22 -1.48 115.58 116.44 1n0n h ASN 36 Ca -0.02 -0.11 -0.08 0.00 -0.55 0.00 0.00 56.30 55.55 1n0n h ASN 36 Cb 0.36 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1n0n h ASN 36 CO 0.03 0.70 -0.33 0.78 -1.65 0.00 0.00 177.43 176.95 1n0n h ASN 37 N 0.88 0.11 -0.27 5.81 -0.26 -0.58 -2.05 115.58 119.22 1n0n h ASN 37 Ca 0.23 -0.04 -0.07 0.00 -0.56 0.00 0.00 56.30 55.86 1n0n h ASN 37 Cb 0.07 -0.03 -0.01 0.00 -1.06 0.00 0.00 38.32 37.29 1n0n h ASN 37 CO -0.03 0.45 -0.09 0.25 -1.06 0.00 0.00 177.43 176.95 1n0n h LEU 38 N 0.10 0.55 -0.61 1.61 5.85 0.02 -1.36 115.31 121.48 1n0n h LEU 38 Ca 0.01 -0.38 0.02 0.00 0.84 0.00 0.00 57.88 58.37 1n0n h LEU 38 Cb 0.64 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.49 1n0n h LEU 38 CO 0.05 0.80 0.39 0.78 -0.34 0.00 0.00 178.44 180.12 1n0n h ASN 39 N 0.29 0.66 -0.50 1.25 2.35 -0.99 0.12 115.58 118.77 1n0n h ASN 39 Ca 0.07 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 1n0n h ASN 39 Cb 0.57 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.77 1n0n h ASN 39 CO 0.03 0.47 0.29 0.58 -1.65 0.00 0.00 177.43 177.15 1n0n h VAL 40 N 0.78 1.16 -0.60 2.81 2.07 -1.31 -2.02 116.25 119.14 1n0n h VAL 40 Ca 0.23 -0.38 -0.04 0.00 0.82 0.00 0.00 66.70 67.33 1n0n h VAL 40 Cb -0.04 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.21 1n0n h VAL 40 CO -0.07 0.16 0.21 0.74 0.02 0.00 0.00 177.57 178.64 1n0n h THR 41 N 0.66 1.24 -0.74 2.57 2.02 -0.62 -2.34 112.91 115.71 1n0n h THR 41 Ca 0.18 -0.78 -0.01 0.00 0.77 0.00 0.00 66.41 66.57 1n0n h THR 41 Cb 0.01 0.61 -0.04 0.00 -1.74 0.00 0.00 68.15 67.00 1n0n h THR 41 CO -0.03 0.30 0.44 -0.33 0.37 0.00 0.00 175.52 176.26 1n0n h GLU 42 N 0.85 1.01 -0.93 6.66 5.08 -0.56 -1.68 114.58 125.00 1n0n h GLU 42 Ca 0.20 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1n0n h GLU 42 Cb 0.25 -0.21 -0.05 0.00 0.50 0.00 0.00 28.75 29.25 1n0n h GLU 42 CO -0.01 0.72 0.59 1.49 -1.00 0.00 0.00 179.01 180.80 1n0n h GLU 43 N 1.01 1.25 0.00 2.33 4.57 -1.09 -0.79 114.58 121.86 1n0n h GLU 43 Ca 0.26 -0.10 -0.05 0.00 -1.18 0.00 0.00 59.36 58.29 1n0n h GLU 43 Cb -0.02 -0.27 -0.01 0.00 -0.16 0.00 0.00 28.75 28.29 1n0n h GLU 43 CO -0.05 0.86 -0.25 0.87 -1.18 0.00 0.00 179.01 179.26 1n0n h LYS 44 N 1.28 0.00 -0.20 1.92 1.57 -0.91 -2.95 116.57 117.28 1n0n h LYS 44 Ca 0.34 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 59.05 1n0n h LYS 44 Cb -0.09 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 1n0n h LYS 44 CO -0.07 0.25 -0.13 1.88 -0.57 0.00 0.00 179.45 180.82 1n0n h TYR 45 N 0.00 0.51 -0.52 -1.35 0.05 -0.26 -1.73 116.97 113.68 1n0n h TYR 45 Ca -0.00 -0.14 -0.07 0.00 0.05 0.00 0.00 58.73 58.57 1n0n h TYR 45 Cb 0.58 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 38.18 1n0n h TYR 45 CO 0.00 0.75 0.03 0.37 -1.05 0.00 0.00 178.16 178.27 1n0n h GLN 46 N 0.13 0.85 -0.27 4.88 5.75 -1.21 0.19 115.11 125.42 1n0n h GLN 46 Ca 0.04 -0.22 -0.05 0.00 -0.15 0.00 0.00 58.65 58.27 1n0n h GLN 46 Cb 0.64 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.08 1n0n h GLN 46 CO 0.04 0.83 -0.04 1.49 -2.65 0.00 0.00 178.83 178.50 1n0n h GLU 47 N 0.79 0.50 -0.77 1.69 4.81 -1.41 -0.41 114.58 119.79 1n0n h GLU 47 Ca 0.16 -0.18 -0.05 0.00 -0.13 0.00 0.00 59.36 59.16 1n0n h GLU 47 Cb 0.43 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.74 1n0n h GLU 47 CO 0.02 0.69 0.30 0.00 -0.73 0.00 0.00 179.01 179.29 1n0n h ALA 48 N 0.79 1.08 -0.20 2.92 0.00 -0.83 -2.14 119.26 120.88 1n0n h ALA 48 Ca 0.07 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1n0n h ALA 48 Cb 0.49 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1n0n h ALA 48 CO 0.02 0.65 -0.01 1.25 0.00 0.00 0.00 179.25 181.16 1n0n h LEU 49 N 1.12 0.36 -1.48 0.00 5.85 -0.53 0.10 115.31 120.73 1n0n h LEU 49 Ca 0.26 -0.32 0.05 0.00 0.84 0.00 0.00 57.88 58.70 1n0n h LEU 49 Cb 0.22 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 1n0n h LEU 49 CO -0.02 0.59 0.41 0.00 -0.34 0.00 0.00 178.44 179.08 1n0n h ALA 50 N 0.78 1.74 -0.00 1.25 0.00 -0.82 -0.63 119.26 121.58 1n0n h ALA 50 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1n0n h ALA 50 Cb 0.41 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1n0n h ALA 50 CO 0.01 0.18 -0.28 1.63 0.00 0.00 0.00 179.25 180.79 1n0n n LYS 51 N -4.47 0.53 -2.36 0.00 5.02 -0.83 -4.93 118.16 111.12 1n0n n LYS 51 Ca 0.08 -0.28 -0.14 0.00 -2.02 0.00 0.00 58.31 55.96 1n0n n LYS 51 Cb 0.19 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 1n0n n LYS 51 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n0n n GLY 52 N 1.38 -0.16 3.48 0.72 0.00 -0.24 -4.93 105.19 105.44 1n0n n GLY 52 Ca 0.10 -0.30 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 1n0n n GLY 52 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n0n s ASP 53 N -2.49 6.67 0.23 1.61 3.68 0.24 -4.86 116.67 121.75 1n0n s ASP 53 Ca 0.04 -2.07 -0.06 0.00 2.13 0.00 0.00 52.55 52.59 1n0n s ASP 53 Cb -0.02 -2.43 0.22 0.00 -1.45 0.00 0.00 42.92 39.24 1n0n s ASP 53 CO 0.05 -1.11 1.85 0.58 0.13 0.00 0.00 175.17 176.67 1n0n h VAL 54 N 5.85 1.26 -0.30 1.11 2.07 -1.92 -1.78 116.25 122.55 1n0n h VAL 54 Ca 0.19 -0.68 0.01 0.00 0.82 0.00 0.00 66.70 67.04 1n0n h VAL 54 Cb 1.00 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 1n0n h VAL 54 CO 1.19 0.30 0.19 0.74 0.02 0.00 0.00 177.57 180.01 1n0n h THR 55 N 1.23 1.07 -0.57 2.57 2.02 -1.97 0.26 112.91 117.51 1n0n h THR 55 Ca 0.30 -0.14 -0.02 0.00 0.77 0.00 0.00 66.41 67.33 1n0n h THR 55 Cb 0.07 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 1n0n h THR 55 CO -0.04 0.07 0.29 0.00 0.37 0.00 0.00 175.52 176.21 1n0n h ALA 56 N 1.11 0.73 -0.87 6.16 0.00 -1.90 0.13 119.26 124.63 1n0n h ALA 56 Ca 0.11 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 54.95 1n0n h ALA 56 Cb -0.04 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.47 1n0n h ALA 56 CO -0.03 0.27 0.55 1.96 0.00 0.00 0.00 179.25 182.01 1n0n h GLN 57 N 0.77 1.01 -0.31 0.00 4.20 -0.86 -1.15 115.11 118.77 1n0n h GLN 57 Ca 0.20 -0.06 -0.15 0.00 0.06 0.00 0.00 58.65 58.69 1n0n h GLN 57 Cb 0.09 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.63 1n0n h GLN 57 CO -0.03 0.67 -0.42 0.82 -0.67 0.00 0.00 178.83 179.20 1n0n h ILE 58 N 1.05 1.28 0.00 2.54 2.04 -0.46 -2.95 117.51 121.01 1n0n h ILE 58 Ca 0.36 -1.60 -0.04 0.00 1.00 0.00 0.00 64.86 64.58 1n0n h ILE 58 Cb 0.07 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 1n0n h ILE 58 CO -0.14 0.52 -0.18 0.00 0.00 0.00 0.00 178.15 178.35 1n0n h ALA 59 N 0.89 1.34 -0.00 1.87 0.00 -0.32 -2.30 119.26 120.74 1n0n h ALA 59 Ca 0.05 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1n0n h ALA 59 Cb 0.98 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1n0n h ALA 59 CO 0.09 0.23 -0.22 1.28 0.00 0.00 0.00 179.25 180.63 1n0n n LEU 60 N -3.81 0.45 -0.11 0.00 4.77 -0.50 -4.36 117.00 113.44 1n0n n LEU 60 Ca -0.02 0.08 -0.07 0.00 -0.03 0.00 0.00 56.01 55.97 1n0n n LEU 60 Cb 0.28 -0.26 0.01 0.00 -2.33 0.00 0.00 43.42 41.12 1n0n n LEU 60 CO 0.33 0.09 0.97 1.56 -1.33 0.00 0.00 177.39 179.01 1n0n h GLN 61 N 0.35 0.34 -0.70 3.23 4.20 -1.32 -1.47 115.11 119.75 1n0n h GLN 61 Ca 0.00 -0.02 0.06 0.00 0.06 0.00 0.00 58.65 58.75 1n0n h GLN 61 Cb 0.45 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 28.10 1n0n h GLN 61 CO 0.00 0.22 0.39 -1.35 -0.67 0.00 0.00 178.83 177.43 1n0n h PRO 62 N 0.35 0.70 -0.56 1.46 0.11 -1.79 0.12 132.00 132.39 1n0n h PRO 62 Ca 0.16 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.15 1n0n h PRO 62 Cb 0.08 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 31.01 1n0n h PRO 62 CO -0.12 0.47 0.06 0.00 -0.21 0.00 0.00 178.00 178.19 1n0n h ALA 63 N 1.36 1.04 -0.15 -0.75 0.00 -1.77 -0.17 119.26 118.82 1n0n h ALA 63 Ca 0.31 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1n0n h ALA 63 Cb 0.19 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1n0n h ALA 63 CO -0.18 0.61 -0.25 1.25 0.00 0.00 0.00 179.25 180.68 1n0n h LEU 64 N 0.86 0.48 -0.42 0.00 7.12 -0.50 -0.62 115.31 122.24 1n0n h LEU 64 Ca 0.17 -0.54 -0.08 0.00 0.13 0.00 0.00 57.88 57.56 1n0n h LEU 64 Cb 0.43 -0.14 -0.01 0.00 -0.53 0.00 0.00 40.66 40.41 1n0n h LEU 64 CO 0.01 0.92 -0.06 0.50 -0.13 0.00 0.00 178.44 179.68 1n0n h LYS 65 N 0.05 0.78 0.50 1.25 3.64 -0.74 0.16 116.57 122.22 1n0n h LYS 65 Ca 0.01 -0.28 -0.02 0.00 -1.27 0.00 0.00 60.65 59.09 1n0n h LYS 65 Cb 0.83 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1n0n h LYS 65 CO 0.06 0.89 -0.24 0.35 -2.27 0.00 0.00 179.45 178.23 1n0n h PHE 66 N 0.60 -0.63 -0.03 1.91 -0.00 -1.04 0.17 116.94 117.94 1n0n h PHE 66 Ca 0.11 -0.01 -0.23 0.00 -0.00 0.00 0.00 57.97 57.84 1n0n h PHE 66 Cb 0.58 0.21 0.01 0.00 -0.00 0.00 0.00 35.95 36.74 1n0n h PHE 66 CO 0.05 -0.31 -0.91 -0.91 -0.00 0.00 0.00 178.31 176.22 1n0n h ASN 67 N -0.87 0.64 -0.19 0.41 4.21 -1.17 -0.25 115.58 118.34 1n0n h ASN 67 Ca -0.07 -0.49 -0.03 0.00 1.21 0.00 0.00 56.30 56.92 1n0n h ASN 67 Cb 0.59 -0.19 -0.01 0.00 -1.12 0.00 0.00 38.32 37.59 1n0n h ASN 67 CO 0.11 1.28 -0.01 1.23 -1.29 0.00 0.00 177.43 178.76 1n0n h GLY 68 N 1.02 0.37 1.04 2.83 0.00 -0.75 -1.44 103.07 106.14 1n0n h GLY 68 Ca -0.08 -0.28 -0.03 0.00 0.00 0.00 0.00 47.33 46.94 1n0n h GLY 68 CO 0.16 0.26 0.41 -1.33 0.00 0.00 0.00 176.54 176.04 1n0n h GLY 69 N 0.10 1.32 0.72 4.60 0.00 -0.67 -0.55 103.07 108.59 1n0n h GLY 69 Ca 0.05 -0.66 0.06 0.00 0.00 0.00 0.00 47.33 46.79 1n0n h GLY 69 CO 0.01 0.63 0.53 -1.33 0.00 0.00 0.00 176.54 176.38 1n0n h GLY 70 N 1.22 1.29 0.79 4.60 0.00 -0.81 0.34 103.07 110.50 1n0n h GLY 70 Ca 0.29 -0.38 -0.06 0.00 0.00 0.00 0.00 47.33 47.18 1n0n h GLY 70 CO -0.04 0.26 -0.13 0.84 0.00 0.00 0.00 176.54 177.47 1n0n h HIS 71 N 0.96 0.49 0.18 5.60 6.17 -0.60 -2.14 115.15 125.82 1n0n h HIS 71 Ca 0.37 -0.13 -0.01 0.00 0.71 0.00 0.00 60.37 61.32 1n0n h HIS 71 Cb 0.18 -0.11 -0.00 0.00 2.52 0.00 0.00 27.41 30.00 1n0n h HIS 71 CO -0.03 0.75 -0.11 0.82 0.71 0.00 0.00 177.93 180.07 1n0n h ILE 72 N 0.08 0.78 -0.05 6.26 2.04 -0.67 -1.95 117.51 124.01 1n0n h ILE 72 Ca 0.04 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.90 1n0n h ILE 72 Cb 0.64 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 1n0n h ILE 72 CO 0.03 0.00 0.01 0.78 0.00 0.00 0.00 178.15 178.98 1n0n h ASN 73 N -0.28 0.01 0.14 1.72 2.35 -0.35 -2.56 115.58 116.61 1n0n h ASN 73 Ca -0.02 0.01 -0.11 0.00 -0.55 0.00 0.00 56.30 55.63 1n0n h ASN 73 Cb 0.22 0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.59 1n0n h ASN 73 CO 0.02 0.01 -0.39 0.45 -1.65 0.00 0.00 177.43 175.88 1n0n h HIS 74 N 0.03 0.40 -0.54 1.19 3.86 -1.41 -0.83 115.15 117.85 1n0n h HIS 74 Ca 0.02 -0.11 -0.01 0.00 -1.16 0.00 0.00 60.37 59.12 1n0n h HIS 74 Cb 0.01 -0.09 -0.03 0.00 1.06 0.00 0.00 27.41 28.37 1n0n h HIS 74 CO -0.09 0.68 0.30 0.77 0.86 0.00 0.00 177.93 180.45 1n0n h SER 75 N 0.29 0.67 -0.19 2.45 0.02 -1.20 -1.71 113.55 113.86 1n0n h SER 75 Ca 0.03 -0.08 -0.04 0.00 -0.84 0.00 0.00 61.79 60.85 1n0n h SER 75 Cb 0.82 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 63.18 1n0n h SER 75 CO 0.07 0.56 -0.05 0.40 -1.14 0.00 0.00 176.83 176.66 1n0n h ILE 76 N 0.72 1.29 -0.46 3.27 2.04 -1.27 -3.27 117.51 119.83 1n0n h ILE 76 Ca 0.19 -1.04 0.09 0.00 1.00 0.00 0.00 64.86 65.10 1n0n h ILE 76 Cb 0.03 1.58 -0.08 0.00 -0.74 0.00 0.00 36.82 37.61 1n0n h ILE 76 CO -0.03 0.31 -0.04 0.15 0.00 0.00 0.00 178.15 178.54 1n0n h PHE 77 N 0.09 -0.11 -0.99 1.37 3.57 -0.78 -1.52 116.94 118.57 1n0n h PHE 77 Ca 0.05 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.64 1n0n h PHE 77 Cb 0.50 0.12 -0.06 0.00 2.79 0.00 0.00 35.95 39.30 1n0n h PHE 77 CO 0.05 -0.14 0.65 -1.49 -2.23 0.00 0.00 178.31 175.15 1n0n h TRP 78 N 0.07 1.20 0.00 0.41 -0.00 -1.39 -1.37 115.95 114.87 1n0n h TRP 78 Ca 0.23 0.03 -0.01 0.00 -0.00 0.00 0.00 58.89 59.14 1n0n h TRP 78 Cb 0.34 -0.40 -0.00 0.00 -0.00 0.00 0.00 29.16 29.11 1n0n h TRP 78 CO -0.33 0.65 -0.05 1.79 -0.00 0.00 0.00 178.44 180.50 1n0n h THR 79 N 1.20 0.12 0.00 1.49 1.35 -1.36 -2.81 112.91 112.90 1n0n h THR 79 Ca 0.41 -0.76 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 1n0n h THR 79 Cb 0.10 1.68 0.00 0.00 -1.73 0.00 0.00 68.15 68.19 1n0n h THR 79 CO -0.15 0.05 0.00 0.59 -0.25 0.00 0.00 175.52 175.76 1n0n n ASN 80 N -3.15 0.00 -4.47 5.36 5.03 -0.53 -4.73 115.26 112.78 1n0n n ASN 80 Ca 0.01 -0.15 -0.26 0.00 0.87 0.00 0.00 54.58 55.05 1n0n n ASN 80 Cb 0.38 -0.28 -0.11 0.00 -1.02 0.00 0.00 39.78 38.76 1n0n n ASN 80 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1n0n s LEU 81 N -2.56 2.60 -0.15 3.41 1.43 -1.06 -0.21 118.68 122.14 1n0n s LEU 81 Ca 0.28 -0.84 -0.29 0.00 -1.03 0.00 0.00 54.13 52.25 1n0n s LEU 81 Cb 0.20 -1.27 0.08 0.00 0.03 0.00 0.00 46.19 45.23 1n0n s LEU 81 CO 0.45 0.09 0.75 -0.55 0.23 0.00 0.00 176.35 177.31 1n0n s SER 82 N -2.94 -0.65 0.44 2.29 0.15 0.37 -4.62 113.70 108.73 1n0n s SER 82 Ca 0.24 0.95 0.13 0.00 0.70 0.00 0.00 55.95 57.97 1n0n s SER 82 Cb -0.07 0.85 0.97 0.00 -1.71 0.00 0.00 66.02 66.06 1n0n s SER 82 CO 0.12 -0.43 1.99 1.55 1.20 0.00 0.00 173.24 177.67 1n0n h PRO 83 N 3.71 0.08 -0.98 5.44 0.13 -1.86 -1.60 132.00 136.92 1n0n h PRO 83 Ca -0.27 -0.01 -0.48 0.00 -0.87 0.00 0.00 66.00 64.37 1n0n h PRO 83 Cb 1.15 -0.01 -0.29 0.00 0.13 0.00 0.00 31.00 31.98 1n0n h PRO 83 CO 0.25 0.21 0.61 0.27 -0.23 0.00 0.00 178.00 179.11 1n0n n ASN 84 N -4.34 3.83 -2.24 1.44 0.23 -1.26 -4.95 115.26 107.97 1n0n n ASN 84 Ca -0.02 -3.54 0.00 0.00 -0.53 0.00 0.00 54.58 50.49 1n0n n ASN 84 Cb 0.23 -0.82 0.00 0.00 -2.08 0.00 0.00 39.78 37.10 1n0n n ASN 84 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1n0n n GLY 85 N -1.02 -0.46 0.51 4.83 0.00 -0.60 -5.00 105.19 103.44 1n0n n GLY 85 Ca 0.57 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.86 1n0n n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n0n n GLY 86 N 5.00 -2.59 7.00 -0.02 0.00 0.86 -4.61 105.19 110.83 1n0n n GLY 86 Ca 0.00 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.01 1n0n n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n0n n GLY 87 N -0.04 0.45 3.26 -0.02 0.00 -1.26 -4.75 105.19 102.83 1n0n n GLY 87 Ca 0.00 -0.83 -0.15 0.00 0.00 0.00 0.00 46.02 45.03 1n0n n GLY 87 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1n0n s GLU 88 N 0.00 1.08 0.91 1.61 2.02 -1.26 -5.05 118.70 118.01 1n0n s GLU 88 Ca 0.00 -1.43 -0.14 0.00 0.02 0.00 0.00 54.97 53.42 1n0n s GLU 88 Cb 0.00 -0.73 0.15 0.00 0.10 0.00 0.00 34.13 33.66 1n0n s GLU 88 CO 0.00 0.10 1.24 -1.25 0.02 0.00 0.00 175.26 175.37 1n0n s PRO 89 N -3.54 1.11 0.26 0.39 0.04 -1.26 -5.01 135.00 127.00 1n0n s PRO 89 Ca 0.16 -0.12 0.03 0.00 0.04 0.00 0.00 61.00 61.11 1n0n s PRO 89 Cb 0.01 -1.87 -0.01 0.00 0.04 0.00 0.00 34.50 32.66 1n0n s PRO 89 CO 0.02 -2.14 0.11 1.63 0.04 0.00 0.00 177.00 176.66 1n0n n LYS 90 N -3.64 0.64 0.00 4.56 4.01 -1.26 -4.63 118.16 117.84 1n0n n LYS 90 Ca 0.11 -2.26 0.00 0.00 -0.51 0.00 0.00 58.31 55.65 1n0n n LYS 90 Cb 0.60 1.31 0.00 0.00 -0.51 0.00 0.00 35.03 36.43 1n0n n LYS 90 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1n0n n GLY 91 N 0.17 2.11 0.19 0.72 0.00 -1.26 -2.84 105.19 104.28 1n0n n GLY 91 Ca -0.03 -0.36 -0.03 0.00 0.00 0.00 0.00 46.02 45.60 1n0n n GLY 91 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1n0n h GLU 92 N 0.00 0.05 -0.41 1.61 5.08 -1.99 -1.35 114.58 117.58 1n0n h GLU 92 Ca 0.00 -0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.41 1n0n h GLU 92 Cb 0.00 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.19 1n0n h GLU 92 CO 0.00 0.04 0.12 1.25 -1.00 0.00 0.00 179.01 179.41 1n0n h LEU 93 N 0.06 0.10 -0.76 1.33 6.46 -1.94 0.69 115.31 121.24 1n0n h LEU 93 Ca 0.23 0.06 -0.03 0.00 -0.12 0.00 0.00 57.88 58.02 1n0n h LEU 93 Cb 0.36 0.06 -0.03 0.00 -0.73 0.00 0.00 40.66 40.31 1n0n h LEU 93 CO -0.44 0.09 0.36 0.25 -0.62 0.00 0.00 178.44 178.08 1n0n h LEU 94 N 0.27 1.00 -0.80 2.25 5.85 -1.26 -1.23 115.31 121.38 1n0n h LEU 94 Ca 0.19 -0.14 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 1n0n h LEU 94 Cb 0.20 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1n0n h LEU 94 CO -0.22 0.85 0.07 -0.08 -0.34 0.00 0.00 178.44 178.72 1n0n h GLU 95 N 1.07 0.97 -0.44 1.25 4.81 -0.47 -1.16 114.58 120.61 1n0n h GLU 95 Ca 0.26 -0.26 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1n0n h GLU 95 Cb 0.12 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1n0n h GLU 95 CO -0.03 0.92 0.14 0.00 -0.73 0.00 0.00 179.01 179.30 1n0n h ALA 96 N 1.16 0.58 -0.73 2.92 0.00 -0.49 0.15 119.26 122.84 1n0n h ALA 96 Ca 0.18 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1n0n h ALA 96 Cb 0.43 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1n0n h ALA 96 CO 0.01 0.23 0.49 0.82 0.00 0.00 0.00 179.25 180.80 1n0n h ILE 97 N 0.58 1.19 -0.51 0.00 2.04 -0.93 0.27 117.51 120.16 1n0n h ILE 97 Ca 0.14 -0.34 -0.06 0.00 1.00 0.00 0.00 64.86 65.61 1n0n h ILE 97 Cb 0.26 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.43 1n0n h ILE 97 CO -0.01 0.18 0.10 0.11 0.00 0.00 0.00 178.15 178.53 1n0n h LYS 98 N 0.99 0.83 -0.38 2.37 1.57 -0.91 0.10 116.57 121.14 1n0n h LYS 98 Ca 0.27 -0.21 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1n0n h LYS 98 Cb -0.11 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.08 1n0n h LYS 98 CO -0.06 0.81 0.12 -0.09 -0.57 0.00 0.00 179.45 179.66 1n0n h ARG 99 N 0.71 0.59 0.00 3.15 2.43 -0.11 0.17 114.38 121.32 1n0n h ARG 99 Ca 0.16 -0.13 -0.11 0.00 -0.81 0.00 0.00 59.98 59.09 1n0n h ARG 99 Cb 0.38 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 1n0n h ARG 99 CO 0.01 0.60 -1.10 -0.44 -1.51 0.00 0.00 179.97 177.53 1n0n h ASP 100 N 0.47 0.00 0.00 -3.80 3.32 -0.44 -3.39 116.42 112.58 1n0n h ASP 100 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1n0n h ASP 100 Cb 0.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.81 1n0n h ASP 100 CO -0.00 0.39 0.00 0.49 -1.72 0.00 0.00 179.24 178.39 1n0n n PHE 101 N -2.90 0.00 0.00 4.55 3.01 0.34 -5.03 117.46 117.44 1n0n n PHE 101 Ca -0.05 -0.06 0.00 0.00 1.01 0.00 0.00 57.45 58.35 1n0n n PHE 101 Cb 0.73 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 40.20 1n0n n PHE 101 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1n0n n GLY 102 N -0.06 2.60 3.58 1.37 0.00 0.05 -4.41 105.19 108.32 1n0n n GLY 102 Ca 0.00 -0.60 -0.07 0.00 0.00 0.00 0.00 46.02 45.35 1n0n n GLY 102 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1n0n s SER 103 N 0.00 -0.33 0.19 1.61 1.04 -1.25 -4.76 113.70 110.20 1n0n s SER 103 Ca 0.00 -0.15 -0.12 0.00 0.48 0.00 0.00 55.95 56.16 1n0n s SER 103 Cb 0.00 0.46 0.11 0.00 0.10 0.00 0.00 66.02 66.69 1n0n s SER 103 CO 0.00 -0.78 1.85 0.15 0.98 0.00 0.00 173.24 175.44 1n0n h PHE 104 N 2.00 0.74 -0.80 5.02 3.57 -1.91 -1.04 116.94 124.52 1n0n h PHE 104 Ca -0.24 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.25 1n0n h PHE 104 Cb 1.25 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 39.70 1n0n h PHE 104 CO 0.30 0.45 0.40 0.22 -2.23 0.00 0.00 178.31 177.45 1n0n h ASP 105 N 0.79 1.03 -0.62 0.41 3.58 -1.96 -0.69 116.42 118.96 1n0n h ASP 105 Ca 0.23 -0.11 -0.09 0.00 0.42 0.00 0.00 57.03 57.48 1n0n h ASP 105 Cb -0.06 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 40.70 1n0n h ASP 105 CO -0.06 0.86 0.04 0.11 -2.88 0.00 0.00 179.24 177.30 1n0n h LYS 106 N 1.13 1.07 -0.35 0.28 1.57 -1.70 -1.38 116.57 117.19 1n0n h LYS 106 Ca 0.28 -0.32 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1n0n h LYS 106 Cb 0.09 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1n0n h LYS 106 CO -0.04 1.02 0.23 0.35 -0.57 0.00 0.00 179.45 180.45 1n0n h PHE 107 N 0.99 0.45 -0.68 -1.35 3.57 -0.56 -0.14 116.94 119.22 1n0n h PHE 107 Ca 0.18 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.72 1n0n h PHE 107 Cb 0.52 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 39.06 1n0n h PHE 107 CO 0.04 0.29 0.42 0.87 -2.23 0.00 0.00 178.31 177.71 1n0n h LYS 108 N 0.48 0.81 -0.84 1.11 1.57 -0.81 -0.39 116.57 118.48 1n0n h LYS 108 Ca 0.13 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 1n0n h LYS 108 Cb -0.04 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.05 1n0n h LYS 108 CO -0.03 0.53 0.44 1.49 -0.57 0.00 0.00 179.45 181.31 1n0n h GLU 109 N 0.83 1.19 -0.42 3.15 4.81 -0.73 0.13 114.58 123.54 1n0n h GLU 109 Ca 0.27 -0.16 -0.13 0.00 -0.13 0.00 0.00 59.36 59.22 1n0n h GLU 109 Cb 0.02 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.17 1n0n h GLU 109 CO -0.11 0.89 -0.25 0.87 -0.73 0.00 0.00 179.01 179.68 1n0n h LYS 110 N 1.18 0.91 -0.05 1.92 1.57 -0.39 0.18 116.57 121.88 1n0n h LYS 110 Ca 0.29 -0.42 -0.16 0.00 -1.87 0.00 0.00 60.65 58.49 1n0n h LYS 110 Cb 0.07 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 1n0n h LYS 110 CO -0.04 1.07 -0.69 1.25 -0.57 0.00 0.00 179.45 180.47 1n0n h LEU 111 N 0.73 0.30 -0.39 2.94 5.85 -0.95 -1.51 115.31 122.27 1n0n h LEU 111 Ca 0.09 -0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.59 1n0n h LEU 111 Cb 0.83 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 1n0n h LEU 111 CO 0.07 0.89 0.12 0.74 -0.34 0.00 0.00 178.44 179.93 1n0n h THR 112 N 0.18 1.21 -0.47 1.05 2.02 -0.53 -1.02 112.91 115.34 1n0n h THR 112 Ca -0.02 -0.70 0.04 0.00 0.77 0.00 0.00 66.41 66.50 1n0n h THR 112 Cb 1.23 0.94 -0.04 0.00 -1.74 0.00 0.00 68.15 68.53 1n0n h THR 112 CO 0.11 0.25 0.23 0.00 0.37 0.00 0.00 175.52 176.47 1n0n h ALA 113 N 0.97 0.60 -0.76 6.16 0.00 -0.44 0.12 119.26 125.90 1n0n h ALA 113 Ca 0.13 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1n0n h ALA 113 Cb 0.26 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1n0n h ALA 113 CO -0.00 -0.13 0.26 0.00 0.00 0.00 0.00 179.25 179.38 1n0n h ALA 114 N 1.27 1.02 -0.15 0.00 0.00 -1.05 -1.32 119.26 119.03 1n0n h ALA 114 Ca 0.21 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 1n0n h ALA 114 Cb 0.14 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1n0n h ALA 114 CO -0.16 0.67 -0.36 0.77 0.00 0.00 0.00 179.25 180.17 1n0n h SER 115 N 1.13 0.58 0.62 0.00 0.02 -0.67 -3.08 113.55 112.14 1n0n h SER 115 Ca 0.25 -0.57 -0.06 0.00 -0.84 0.00 0.00 61.79 60.57 1n0n h SER 115 Cb 0.27 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 1n0n h SER 115 CO -0.01 1.04 -0.28 0.58 -1.14 0.00 0.00 176.83 177.02 1n0n h VAL 116 N 0.14 0.84 0.00 2.27 2.07 -0.74 -3.05 116.25 117.77 1n0n h VAL 116 Ca -0.00 -1.14 0.00 0.00 0.82 0.00 0.00 66.70 66.38 1n0n h VAL 116 Cb 0.96 1.69 0.00 0.00 -1.52 0.00 0.00 31.29 32.42 1n0n h VAL 116 CO 0.08 0.28 0.00 0.61 0.02 0.00 0.00 177.57 178.56 1n0n n GLY 117 N -0.19 -1.43 3.67 2.17 0.00 -0.50 -4.80 105.19 104.10 1n0n n GLY 117 Ca -0.01 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1n0n n GLY 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n0n s VAL 118 N -3.13 3.09 -0.36 1.61 1.01 -1.15 -4.94 120.40 116.52 1n0n s VAL 118 Ca 0.09 0.28 -0.21 0.00 0.00 0.00 0.00 61.98 62.14 1n0n s VAL 118 Cb 0.12 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.32 1n0n s VAL 118 CO 0.47 -0.02 0.66 -1.10 0.00 0.00 0.00 175.10 175.11 1n0n s GLN 119 N 3.76 3.68 1.46 2.72 -0.21 -1.26 -4.83 119.66 124.98 1n0n s GLN 119 Ca 0.81 0.08 0.00 0.00 0.02 0.00 0.00 55.36 56.27 1n0n s GLN 119 Cb -0.40 -3.81 0.00 0.00 1.00 0.00 0.00 33.01 29.79 1n0n s GLN 119 CO 0.36 -0.76 0.00 0.41 -2.12 0.00 0.00 175.29 173.18 1n0n n GLY 120 N 4.66 0.17 3.86 3.09 0.00 -1.26 -4.92 105.19 110.79 1n0n n GLY 120 Ca -0.01 -1.45 -0.34 0.00 0.00 0.00 0.00 46.02 44.23 1n0n n GLY 120 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1n0n s SER 121 N -4.00 6.71 0.00 1.61 0.01 -1.26 -4.85 113.70 111.92 1n0n s SER 121 Ca 0.00 0.97 0.00 0.00 1.31 0.00 0.00 55.95 58.23 1n0n s SER 121 Cb 0.00 -2.24 0.00 0.00 0.21 0.00 0.00 66.02 63.99 1n0n s SER 121 CO 0.00 0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.29 1n0n n GLY 122 N 0.37 -1.00 3.02 3.44 0.00 -1.26 -0.78 105.19 108.98 1n0n n GLY 122 Ca -0.03 -0.97 -0.09 0.00 0.00 0.00 0.00 46.02 44.92 1n0n n GLY 122 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1n0n s TRP 123 N -3.00 0.22 -0.07 1.61 0.52 -0.11 -1.17 118.94 116.93 1n0n s TRP 123 Ca 0.00 -0.47 -0.00 0.00 0.02 0.00 0.00 56.10 55.65 1n0n s TRP 123 Cb 0.00 -0.17 -0.03 0.00 -1.15 0.00 0.00 33.47 32.12 1n0n s TRP 123 CO 0.00 -0.23 -0.04 0.20 0.02 0.00 0.00 176.95 176.90 1n0n s GLY 124 N -1.55 1.76 0.03 0.98 0.00 -0.24 -0.98 107.32 107.32 1n0n s GLY 124 Ca -0.14 -0.86 0.03 0.00 0.00 0.00 0.00 44.72 43.75 1n0n s GLY 124 CO -0.01 -0.63 -0.10 -0.98 0.00 0.00 0.00 173.10 171.37 1n0n s TRP 125 N -0.85 0.91 -0.25 1.90 0.52 0.14 -0.34 118.94 120.97 1n0n s TRP 125 Ca 0.13 -0.36 -0.06 0.00 0.02 0.00 0.00 56.10 55.83 1n0n s TRP 125 Cb -0.11 -0.54 -0.02 0.00 -1.15 0.00 0.00 33.47 31.65 1n0n s TRP 125 CO 0.02 -0.01 0.05 -1.17 0.02 0.00 0.00 176.95 175.86 1n0n s LEU 126 N -1.12 3.39 0.45 2.99 2.96 0.18 -1.47 118.68 126.06 1n0n s LEU 126 Ca -0.02 -0.34 0.03 0.00 -0.22 0.00 0.00 54.13 53.58 1n0n s LEU 126 Cb -0.08 -1.88 -0.01 0.00 0.50 0.00 0.00 46.19 44.72 1n0n s LEU 126 CO 0.01 -0.06 0.11 -0.83 -1.32 0.00 0.00 176.35 174.26 1n0n s GLY 127 N 1.57 2.80 -0.11 7.98 0.00 0.11 -1.16 107.32 118.51 1n0n s GLY 127 Ca 0.06 -0.90 0.03 0.00 0.00 0.00 0.00 44.72 43.91 1n0n s GLY 127 CO 0.02 -1.93 -0.23 -0.12 0.00 0.00 0.00 173.10 170.84 1n0n s PHE 128 N -3.11 2.57 -0.44 1.90 5.36 0.31 -1.29 117.98 123.28 1n0n s PHE 128 Ca 0.17 -1.14 -0.19 0.00 -0.96 0.00 0.00 56.93 54.81 1n0n s PHE 128 Cb 0.01 -1.73 0.03 0.00 -0.34 0.00 0.00 43.02 40.99 1n0n s PHE 128 CO 0.12 -0.48 0.56 1.21 -1.46 0.00 0.00 175.22 175.16 1n0n s ASN 129 N 0.52 6.26 0.20 6.13 3.84 0.02 -1.29 114.94 130.61 1n0n s ASN 129 Ca -0.15 -0.55 -0.08 0.00 0.21 0.00 0.00 52.86 52.29 1n0n s ASN 129 Cb -0.17 -2.28 0.11 0.00 -0.55 0.00 0.00 41.25 38.36 1n0n s ASN 129 CO 0.05 -0.71 1.69 0.11 -2.79 0.00 0.00 177.10 175.45 1n0n h LYS 130 N 8.83 1.12 -0.15 0.43 1.57 -1.86 0.19 116.57 126.70 1n0n h LYS 130 Ca -0.26 -0.30 -0.02 0.00 -1.87 0.00 0.00 60.65 58.20 1n0n h LYS 130 Cb 1.10 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.27 1n0n h LYS 130 CO 0.86 1.02 0.02 1.49 -0.57 0.00 0.00 179.45 182.27 1n0n h GLU 131 N 1.04 0.25 0.00 3.15 4.81 -1.96 -3.17 114.58 118.70 1n0n h GLU 131 Ca 0.21 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1n0n h GLU 131 Cb 0.44 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.79 1n0n h GLU 131 CO 0.01 0.43 -0.30 0.00 -0.73 0.00 0.00 179.01 178.42 1n0n h ARG 132 N 0.02 0.00 -2.39 1.92 2.47 -1.98 -3.48 114.38 110.95 1n0n h ARG 132 Ca 0.04 0.00 -0.21 0.00 -1.26 0.00 0.00 59.98 58.55 1n0n h ARG 132 Cb 0.30 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 28.65 1n0n h ARG 132 CO 0.00 0.00 -0.31 0.41 0.56 0.00 0.00 179.97 180.63 1n0n n GLY 133 N 1.21 0.03 3.47 0.04 0.00 0.65 -5.03 105.19 105.55 1n0n n GLY 133 Ca 0.03 -0.33 -0.10 0.00 0.00 0.00 0.00 46.02 45.63 1n0n n GLY 133 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1n0n s HIS 134 N -2.81 0.53 0.61 1.61 -3.43 -1.09 -4.99 115.29 105.73 1n0n s HIS 134 Ca 0.13 -0.86 -0.15 0.00 -0.80 0.00 0.00 55.06 53.38 1n0n s HIS 134 Cb -0.06 -0.01 -0.03 0.00 -1.43 0.00 0.00 32.58 31.06 1n0n s HIS 134 CO 0.16 -0.87 1.06 -0.51 -2.00 0.00 0.00 174.74 172.58 1n0n s LEU 135 N -3.04 3.44 -0.15 5.38 1.43 -1.26 -0.80 118.68 123.69 1n0n s LEU 135 Ca 0.25 1.81 -0.19 0.00 -1.03 0.00 0.00 54.13 54.98 1n0n s LEU 135 Cb 0.02 -4.53 0.05 0.00 0.03 0.00 0.00 46.19 41.75 1n0n s LEU 135 CO 0.08 -1.25 0.49 -1.58 0.23 0.00 0.00 176.35 174.32 1n0n s GLN 136 N -4.19 0.65 -0.11 1.70 0.74 -0.41 -4.81 119.66 113.22 1n0n s GLN 136 Ca 0.63 0.51 -0.05 0.00 0.05 0.00 0.00 55.36 56.51 1n0n s GLN 136 Cb -0.16 0.31 -0.04 0.00 1.10 0.00 0.00 33.01 34.22 1n0n s GLN 136 CO 0.40 -0.12 0.07 0.42 -0.55 0.00 0.00 175.29 175.51 1n0n s ILE 137 N -0.14 4.91 0.06 -2.34 1.01 -1.26 0.06 121.20 123.50 1n0n s ILE 137 Ca -0.03 -0.02 -0.11 0.00 0.00 0.00 0.00 60.65 60.49 1n0n s ILE 137 Cb -0.03 -3.12 0.01 0.00 0.01 0.00 0.00 42.46 39.33 1n0n s ILE 137 CO 0.02 0.59 0.24 0.00 0.00 0.00 0.00 174.94 175.80 1n0n s ALA 138 N -0.78 -0.47 0.03 9.38 0.00 -0.54 -4.98 121.76 124.40 1n0n s ALA 138 Ca 0.13 -0.27 0.09 0.00 0.00 0.00 0.00 51.96 51.91 1n0n s ALA 138 Cb -0.12 0.39 -0.03 0.00 0.00 0.00 0.00 23.12 23.36 1n0n s ALA 138 CO 0.03 -0.44 -0.25 0.00 0.00 0.00 0.00 175.76 175.09 1n0n s ALA 139 N -3.03 2.16 -0.01 0.00 0.00 -1.26 0.24 121.76 119.86 1n0n s ALA 139 Ca -0.02 -1.20 0.06 0.00 0.00 0.00 0.00 51.96 50.80 1n0n s ALA 139 Cb 0.01 -0.47 -0.02 0.00 0.00 0.00 0.00 23.12 22.64 1n0n s ALA 139 CO -0.06 0.51 -0.19 0.00 0.00 0.00 0.00 175.76 176.02 1n0n s PRO 141 N -0.52 3.98 2.95 0.00 0.04 -1.26 -0.94 135.00 139.25 1n0n s PRO 141 Ca 0.07 0.79 0.00 0.00 0.04 0.00 0.00 61.00 61.90 1n0n s PRO 141 Cb -0.07 -2.29 0.00 0.00 0.04 0.00 0.00 34.50 32.18 1n0n s PRO 141 CO -0.00 -0.05 0.00 0.09 0.04 0.00 0.00 177.00 177.08 1n0n n ASN 142 N -0.99 0.00 -0.87 6.66 3.02 0.04 -1.10 115.26 122.02 1n0n n ASN 142 Ca 0.05 0.00 0.07 0.00 -0.03 0.00 0.00 54.58 54.67 1n0n n ASN 142 Cb 0.54 0.00 0.22 0.00 -0.61 0.00 0.00 39.78 39.92 1n0n n ASN 142 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n0n n GLN 143 N 14.00 2.98 -1.68 3.52 1.13 -1.26 -4.14 117.38 131.92 1n0n n GLN 143 Ca 0.00 -2.37 -0.49 0.00 -1.94 0.00 0.00 57.00 52.20 1n0n n GLN 143 Cb 0.00 -1.49 -0.05 0.00 0.11 0.00 0.00 30.24 28.82 1n0n n GLN 143 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1n0n n ASP 144 N 0.50 3.36 -4.80 1.08 10.43 -0.26 -3.94 116.55 122.93 1n0n n ASP 144 Ca 0.16 0.98 -0.34 0.00 2.57 0.00 0.00 54.79 58.16 1n0n n ASP 144 Cb 0.59 -1.35 -0.03 0.00 1.84 0.00 0.00 41.12 42.16 1n0n n ASP 144 CO 0.00 0.00 0.00 -2.16 -1.07 0.00 0.00 177.20 173.97 1n0n s PRO 145 N 3.99 3.82 0.06 -0.24 0.04 -1.26 -4.63 135.00 136.78 1n0n s PRO 145 Ca 0.93 1.38 -0.29 0.00 0.04 0.00 0.00 61.00 63.05 1n0n s PRO 145 Cb -0.72 -2.12 -0.18 0.00 0.04 0.00 0.00 34.50 31.52 1n0n s PRO 145 CO 0.53 -0.42 1.55 1.25 0.04 0.00 0.00 177.00 179.95 1n0n h LEU 146 N 1.62 -0.54 -0.32 -3.56 5.85 -1.90 -2.47 115.31 113.99 1n0n h LEU 146 Ca -0.49 -0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.13 1n0n h LEU 146 Cb 1.22 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.38 1n0n h LEU 146 CO 0.59 -0.32 -0.10 -0.61 -0.34 0.00 0.00 178.44 177.66 1n0n h GLN 147 N -0.71 0.64 0.00 1.25 4.15 -1.86 -0.56 115.11 118.02 1n0n h GLN 147 Ca -0.06 -0.26 -0.01 0.00 0.77 0.00 0.00 58.65 59.09 1n0n h GLN 147 Cb 0.53 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.18 1n0n h GLN 147 CO 0.11 0.83 -0.07 0.78 -1.93 0.00 0.00 178.83 178.54 1n0n h GLY 148 N 0.41 0.00 0.00 2.39 0.00 -1.87 -0.66 103.07 103.34 1n0n h GLY 148 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1n0n h GLY 148 CO 0.04 0.00 -0.97 -1.30 0.00 0.00 0.00 176.54 174.30 1n0n n THR 149 N -4.10 0.00 0.00 4.70 -2.24 -0.93 -4.75 114.28 106.96 1n0n n THR 149 Ca -0.03 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 1n0n n THR 149 Cb 0.16 0.63 0.00 0.00 -2.10 0.00 0.00 70.33 69.02 1n0n n THR 149 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1n0n n THR 150 N -1.55 0.00 0.00 4.28 -2.24 -0.23 -5.02 114.28 109.53 1n0n n THR 150 Ca -0.00 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1n0n n THR 150 Cb 0.21 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.92 1n0n n THR 150 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n0n n GLY 151 N 1.56 2.00 3.77 3.38 0.00 -0.26 -5.01 105.19 110.63 1n0n n GLY 151 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1n0n n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n0n s LEU 152 N 0.00 4.28 -0.22 0.99 1.43 -1.26 -4.79 118.68 119.11 1n0n s LEU 152 Ca 0.00 2.17 -0.24 0.00 -1.03 0.00 0.00 54.13 55.03 1n0n s LEU 152 Cb 0.00 -3.98 -0.01 0.00 0.03 0.00 0.00 46.19 42.23 1n0n s LEU 152 CO 0.00 -0.42 0.79 -0.63 0.23 0.00 0.00 176.35 176.32 1n0n s ILE 153 N -1.46 4.88 0.18 -0.59 -1.09 -0.41 -2.81 121.20 119.90 1n0n s ILE 153 Ca 0.54 1.51 -0.31 0.00 -2.23 0.00 0.00 60.65 60.16 1n0n s ILE 153 Cb -0.27 -4.09 -0.09 0.00 -1.58 0.00 0.00 42.46 36.43 1n0n s ILE 153 CO 0.34 -0.02 1.41 -2.16 -1.23 0.00 0.00 174.94 173.28 1n0n s PRO 154 N 2.55 4.31 -0.07 2.79 0.04 -1.26 -0.53 135.00 142.83 1n0n s PRO 154 Ca 0.34 2.17 -0.03 0.00 0.04 0.00 0.00 61.00 63.53 1n0n s PRO 154 Cb -0.16 -3.18 -0.03 0.00 0.04 0.00 0.00 34.50 31.17 1n0n s PRO 154 CO 0.09 -0.41 -0.09 1.28 0.04 0.00 0.00 177.00 177.91 1n0n n LEU 155 N 3.19 0.82 -3.73 -3.56 4.77 -0.31 -4.92 117.00 113.28 1n0n n LEU 155 Ca 0.09 0.07 -0.15 0.00 -0.03 0.00 0.00 56.01 55.99 1n0n n LEU 155 Cb 0.41 -0.21 -0.16 0.00 -2.33 0.00 0.00 43.42 41.13 1n0n n LEU 155 CO 0.59 0.21 -0.28 -0.22 -1.33 0.00 0.00 177.39 176.36 1n0n s LEU 156 N -6.26 0.60 0.03 2.23 2.96 -0.91 -4.57 118.68 112.76 1n0n s LEU 156 Ca -0.10 0.20 0.07 0.00 -0.22 0.00 0.00 54.13 54.09 1n0n s LEU 156 Cb 0.04 0.16 -0.03 0.00 0.50 0.00 0.00 46.19 46.85 1n0n s LEU 156 CO 0.13 -0.17 -0.21 -0.83 -1.32 0.00 0.00 176.35 173.95 1n0n s GLY 157 N 1.48 1.50 -0.25 7.98 0.00 -1.26 -0.65 107.32 116.12 1n0n s GLY 157 Ca -0.05 -1.18 0.02 0.00 0.00 0.00 0.00 44.72 43.51 1n0n s GLY 157 CO -0.05 -1.06 -0.09 -0.42 0.00 0.00 0.00 173.10 171.49 1n0n s ILE 158 N -0.84 1.96 -0.15 0.90 -1.09 0.54 -4.90 121.20 117.62 1n0n s ILE 158 Ca 0.13 -1.49 -0.29 0.00 -2.23 0.00 0.00 60.65 56.76 1n0n s ILE 158 Cb -0.10 -2.12 -0.02 0.00 -1.58 0.00 0.00 42.46 38.64 1n0n s ILE 158 CO 0.03 -0.05 1.27 -0.62 -1.23 0.00 0.00 174.94 174.34 1n0n s ASP 159 N 1.20 6.95 -0.18 3.58 3.68 -1.26 -1.08 116.67 129.56 1n0n s ASP 159 Ca -0.08 1.73 0.16 0.00 2.13 0.00 0.00 52.55 56.49 1n0n s ASP 159 Cb -0.20 -2.54 0.41 0.00 -1.45 0.00 0.00 42.92 39.14 1n0n s ASP 159 CO -0.05 -0.74 1.28 1.33 0.13 0.00 0.00 175.17 177.12 1n0n n VAL 160 N 5.26 2.14 -2.25 1.11 0.24 -0.32 -4.86 118.33 119.66 1n0n n VAL 160 Ca 0.14 -2.36 -0.36 0.00 -2.04 0.00 0.00 64.34 59.71 1n0n n VAL 160 Cb 0.45 -0.26 -0.00 0.00 -1.47 0.00 0.00 33.84 32.56 1n0n n VAL 160 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 1n0n s TRP 161 N -2.97 2.78 0.53 6.34 0.52 -1.20 -4.47 118.94 120.47 1n0n s TRP 161 Ca 0.38 1.54 0.25 0.00 0.02 0.00 0.00 56.10 58.28 1n0n s TRP 161 Cb 0.33 -3.35 1.57 0.00 -1.15 0.00 0.00 33.47 30.86 1n0n s TRP 161 CO 0.03 -1.56 2.17 0.93 0.02 0.00 0.00 176.95 178.54 1n0n h GLU 162 N 1.69 0.00 0.00 4.98 5.08 -1.94 -0.44 114.58 123.95 1n0n h GLU 162 Ca -0.50 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1n0n h GLU 162 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1n0n h GLU 162 CO 0.59 0.04 0.00 -2.39 -1.00 0.00 0.00 179.01 176.25 1n0n n HIS 163 N -3.98 0.56 0.70 4.33 1.44 -1.26 -0.48 115.22 116.52 1n0n n HIS 163 Ca -0.03 0.24 0.12 0.00 -2.01 0.00 0.00 57.72 56.05 1n0n n HIS 163 Cb 0.13 -0.88 0.26 0.00 0.12 0.00 0.00 29.99 29.62 1n0n n HIS 163 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1n0n n ALA 164 N -1.69 2.89 0.00 1.59 0.00 -0.17 -4.69 120.51 118.43 1n0n n ALA 164 Ca 0.01 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1n0n n ALA 164 Cb 0.15 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.37 1n0n n ALA 164 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1n0n n TYR 165 N -1.97 0.00 -0.35 0.00 4.11 -0.77 -4.98 117.16 113.20 1n0n n TYR 165 Ca 0.04 0.00 0.10 0.00 -0.00 0.00 0.00 57.90 58.05 1n0n n TYR 165 Cb 0.41 0.00 0.28 0.00 -0.00 0.00 0.00 39.34 40.03 1n0n n TYR 165 CO 0.00 0.00 0.00 -0.92 -0.00 0.00 0.00 176.86 175.94 1n0n h TYR 166 N 0.00 1.08 -0.83 -3.48 3.20 -0.97 0.25 116.97 116.21 1n0n h TYR 166 Ca 0.00 0.03 0.06 0.00 3.14 0.00 0.00 58.73 61.97 1n0n h TYR 166 Cb 0.00 -0.33 -0.05 0.00 1.54 0.00 0.00 36.73 37.89 1n0n h TYR 166 CO 0.00 0.31 0.54 -0.07 -1.64 0.00 0.00 178.16 177.31 1n0n h LEU 167 N 0.84 0.81 0.01 2.82 3.38 -1.89 -0.33 115.31 120.96 1n0n h LEU 167 Ca 0.54 0.00 -0.39 0.00 0.09 0.00 0.00 57.88 58.13 1n0n h LEU 167 Cb 0.73 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.25 1n0n h LEU 167 CO -0.34 0.53 -2.18 1.67 0.09 0.00 0.00 178.44 178.21 1n0n n GLN 168 N -4.48 0.61 -0.11 1.13 7.27 -0.62 -4.58 117.38 116.60 1n0n n GLN 168 Ca 0.12 0.32 0.12 0.00 0.07 0.00 0.00 57.00 57.63 1n0n n GLN 168 Cb 0.20 -1.58 0.16 0.00 2.41 0.00 0.00 30.24 31.44 1n0n n GLN 168 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1n0n n TYR 169 N -4.05 0.28 -3.07 3.69 4.02 0.77 -5.06 117.16 113.74 1n0n n TYR 169 Ca -0.46 -0.14 0.00 0.00 -0.01 0.00 0.00 57.90 57.29 1n0n n TYR 169 Cb 0.87 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.19 1n0n n TYR 169 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1n0n n LYS 170 N 1.40 0.00 0.00 -0.72 4.01 -0.13 -1.49 118.16 121.23 1n0n n LYS 170 Ca 0.17 0.00 0.09 0.00 -0.51 0.00 0.00 58.31 58.05 1n0n n LYS 170 Cb 0.59 0.00 0.45 0.00 -0.51 0.00 0.00 35.03 35.56 1n0n n LYS 170 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1n0n n ASN 171 N -1.07 0.00 -4.40 4.39 6.94 -1.26 -4.34 115.26 115.52 1n0n n ASN 171 Ca 0.00 0.05 -0.44 0.00 -0.02 0.00 0.00 54.58 54.17 1n0n n ASN 171 Cb 0.00 -0.29 0.00 0.00 -2.36 0.00 0.00 39.78 37.13 1n0n n ASN 171 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 1n0n n VAL 172 N -1.29 4.18 -0.27 3.53 0.31 -0.56 -4.81 118.33 119.42 1n0n n VAL 172 Ca 0.08 -4.52 0.05 0.00 -0.01 0.00 0.00 64.34 59.94 1n0n n VAL 172 Cb 0.14 -2.44 0.28 0.00 -0.91 0.00 0.00 33.84 30.92 1n0n n VAL 172 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1n0n h ARG 173 N 7.03 0.90 0.00 5.55 2.43 -1.82 -1.48 114.38 126.99 1n0n h ARG 173 Ca 0.36 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.48 1n0n h ARG 173 Cb 0.84 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 30.18 1n0n h ARG 173 CO 1.35 0.60 -0.00 -1.35 -1.51 0.00 0.00 179.97 179.05 1n0n h PRO 174 N 0.93 0.00 -0.37 0.20 0.11 -1.97 -0.65 132.00 130.25 1n0n h PRO 174 Ca 0.37 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 66.36 1n0n h PRO 174 Cb 0.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 1n0n h PRO 174 CO -0.14 0.00 -0.25 -0.44 -0.21 0.00 0.00 178.00 176.96 1n0n h ASP 175 N 0.00 0.78 -0.44 -2.05 3.32 -1.64 -0.49 116.42 115.90 1n0n h ASP 175 Ca -0.00 -0.29 -0.07 0.00 0.02 0.00 0.00 57.03 56.69 1n0n h ASP 175 Cb 0.00 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 1n0n h ASP 175 CO 0.00 1.00 -0.00 0.22 -1.72 0.00 0.00 179.24 178.73 1n0n h TYR 176 N 0.66 0.85 -0.74 4.55 -0.00 -1.15 -1.26 116.97 119.86 1n0n h TYR 176 Ca 0.09 -0.15 -0.06 0.00 -0.00 0.00 0.00 58.73 58.60 1n0n h TYR 176 Cb 0.77 -0.22 -0.03 0.00 -0.00 0.00 0.00 36.73 37.25 1n0n h TYR 176 CO 0.04 0.83 0.22 -0.07 -0.00 0.00 0.00 178.16 179.18 1n0n h LEU 177 N 0.62 1.09 -0.83 2.82 -0.00 -1.10 -0.65 115.31 117.26 1n0n h LEU 177 Ca 0.12 -0.21 0.02 0.00 -0.00 0.00 0.00 57.88 57.81 1n0n h LEU 177 Cb 0.50 -0.29 -0.04 0.00 -0.00 0.00 0.00 40.66 40.83 1n0n h LEU 177 CO 0.02 1.02 0.54 0.50 -0.00 0.00 0.00 178.44 180.52 1n0n h LYS 178 N 1.11 1.05 -0.06 1.13 1.63 -0.78 -2.98 116.57 117.67 1n0n h LYS 178 Ca 0.24 -0.06 -0.24 0.00 -0.85 0.00 0.00 60.65 59.73 1n0n h LYS 178 Cb 0.33 -0.24 0.01 0.00 -0.60 0.00 0.00 32.23 31.73 1n0n h LYS 178 CO -0.01 0.70 -0.92 0.00 -3.45 0.00 0.00 179.45 175.77 1n0n h ALA 179 N 1.32 0.25 -0.05 5.00 0.00 -0.54 -3.32 119.26 121.92 1n0n h ALA 179 Ca 0.32 -0.66 0.01 0.00 0.00 0.00 0.00 54.91 54.58 1n0n h ALA 179 Cb -0.07 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1n0n h ALA 179 CO -0.09 0.71 0.04 0.97 0.00 0.00 0.00 179.25 180.88 1n0n h ILE 180 N 0.42 0.83 -0.15 0.00 2.10 -0.98 -1.81 117.51 117.92 1n0n h ILE 180 Ca -0.09 0.00 0.04 0.00 1.08 0.00 0.00 64.86 65.89 1n0n h ILE 180 Cb 1.56 0.97 -0.01 0.00 -1.09 0.00 0.00 36.82 38.25 1n0n h ILE 180 CO 0.18 0.00 0.16 -0.50 -1.08 0.00 0.00 178.15 176.91 1n0n h TRP 181 N 0.00 0.00 0.00 2.19 4.06 -1.66 -0.65 115.95 119.89 1n0n h TRP 181 Ca 0.02 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.97 1n0n h TRP 181 Cb 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.26 1n0n h TRP 181 CO 0.00 0.00 0.00 0.09 -3.56 0.00 0.00 178.44 174.97 1n0n n ASN 182 N -3.89 0.72 -0.05 -3.49 3.02 -0.68 -3.28 115.26 107.62 1n0n n ASN 182 Ca 0.01 0.65 0.06 0.00 -0.03 0.00 0.00 54.58 55.27 1n0n n ASN 182 Cb 0.28 -0.82 0.08 0.00 -0.61 0.00 0.00 39.78 38.71 1n0n n ASN 182 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1n0n n VAL 183 N -2.27 1.48 -2.29 2.41 0.24 -0.26 -2.98 118.33 114.66 1n0n n VAL 183 Ca 0.03 -1.70 -0.42 0.00 -2.04 0.00 0.00 64.34 60.20 1n0n n VAL 183 Cb 0.27 0.08 -0.03 0.00 -1.47 0.00 0.00 33.84 32.69 1n0n n VAL 183 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1n0n s ILE 184 N -2.05 3.74 -1.03 1.34 -1.09 -1.18 -0.48 121.20 120.45 1n0n s ILE 184 Ca 0.18 1.21 -0.19 0.00 -2.23 0.00 0.00 60.65 59.62 1n0n s ILE 184 Cb 0.16 -3.77 0.12 0.00 -1.58 0.00 0.00 42.46 37.38 1n0n s ILE 184 CO 0.02 0.06 1.30 0.21 -1.23 0.00 0.00 174.94 175.30 1n0n s ASN 185 N 1.33 6.70 0.47 3.58 3.84 0.70 -0.10 114.94 131.47 1n0n s ASN 185 Ca 0.62 -2.14 0.32 0.00 0.21 0.00 0.00 52.86 51.87 1n0n s ASN 185 Cb -0.32 -2.45 1.51 0.00 -0.55 0.00 0.00 41.25 39.44 1n0n s ASN 185 CO 0.28 -1.10 1.96 -0.50 -2.79 0.00 0.00 177.10 174.95 1n0n h TRP 186 N 8.61 0.00 -0.34 0.43 4.06 -1.85 -1.68 115.95 125.18 1n0n h TRP 186 Ca 0.22 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 61.04 1n0n h TRP 186 Cb 0.98 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.13 1n0n h TRP 186 CO 1.20 0.00 -0.28 1.49 -3.56 0.00 0.00 178.44 177.29 1n0n h GLU 187 N 0.00 0.79 -0.30 0.49 4.81 -1.97 -0.25 114.58 118.16 1n0n h GLU 187 Ca 0.00 -0.40 -0.17 0.00 -0.13 0.00 0.00 59.36 58.66 1n0n h GLU 187 Cb 0.26 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 1n0n h GLU 187 CO 0.00 1.03 -0.48 -0.97 -0.73 0.00 0.00 179.01 177.85 1n0n h ASN 188 N 0.57 0.94 -0.53 1.04 -0.73 -1.62 -1.72 115.58 113.53 1n0n h ASN 188 Ca 0.06 -0.52 -0.06 0.00 1.87 0.00 0.00 56.30 57.65 1n0n h ASN 188 Cb 0.85 -0.27 -0.03 0.00 0.27 0.00 0.00 38.32 39.15 1n0n h ASN 188 CO 0.07 1.28 0.11 0.58 -0.37 0.00 0.00 177.43 179.10 1n0n h VAL 189 N 0.64 1.24 -0.51 2.57 2.07 -1.31 -1.43 116.25 119.51 1n0n h VAL 189 Ca 0.02 -0.92 -0.08 0.00 0.82 0.00 0.00 66.70 66.55 1n0n h VAL 189 Cb 1.09 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 1n0n h VAL 189 CO 0.11 0.34 0.02 0.74 0.02 0.00 0.00 177.57 178.80 1n0n h THR 190 N 0.87 1.26 -0.65 2.57 2.02 -0.93 -1.48 112.91 116.57 1n0n h THR 190 Ca 0.18 -1.05 0.02 0.00 0.77 0.00 0.00 66.41 66.33 1n0n h THR 190 Cb 0.36 0.93 -0.04 0.00 -1.74 0.00 0.00 68.15 67.67 1n0n h THR 190 CO 0.01 0.37 0.42 -0.33 0.37 0.00 0.00 175.52 176.36 1n0n h GLU 191 N 0.76 0.82 -0.29 6.66 5.08 -0.85 0.11 114.58 126.86 1n0n h GLU 191 Ca 0.15 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.38 1n0n h GLU 191 Cb 0.49 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 1n0n h GLU 191 CO 0.02 0.54 -0.15 0.00 -1.00 0.00 0.00 179.01 178.43 1n0n h ARG 192 N 0.84 0.51 -0.09 2.33 3.08 -1.07 -1.60 114.38 118.38 1n0n h ARG 192 Ca 0.25 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 60.11 1n0n h ARG 192 Cb -0.05 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 29.95 1n0n h ARG 192 CO -0.07 0.64 -0.05 -0.92 -1.07 0.00 0.00 179.97 178.50 1n0n h TYR 193 N 0.46 0.23 0.00 3.04 5.03 -0.64 -2.91 116.97 122.18 1n0n h TYR 193 Ca 0.08 -0.06 -0.02 0.00 2.58 0.00 0.00 58.73 61.32 1n0n h TYR 193 Cb 0.53 -0.05 -0.00 0.00 1.55 0.00 0.00 36.73 38.76 1n0n h TYR 193 CO 0.02 0.57 -0.08 0.52 -1.32 0.00 0.00 178.16 177.86 1n0n h MET 194 N -0.17 0.00 0.00 1.82 2.86 -0.87 -1.91 114.93 116.66 1n0n h MET 194 Ca 0.02 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 1n0n h MET 194 Cb 0.51 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.17 1n0n h MET 194 CO 0.01 0.08 -0.16 0.00 1.06 0.00 0.00 176.91 177.91 1n0n h ALA 195 N 1.92 1.56 -0.60 6.32 0.00 -1.08 -0.52 119.26 126.86 1n0n h ALA 195 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1n0n h ALA 195 Cb 0.22 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1n0n h ALA 195 CO 0.01 0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.46 1n0n n LYS 197 N 0.91 1.76 0.00 0.00 4.76 -0.20 -5.08 118.16 120.31 1n0n n LYS 197 Ca 0.25 -2.11 0.00 0.00 -2.87 0.00 0.00 58.31 53.58 1n0n n LYS 197 Cb 0.96 -3.13 0.00 0.00 -1.84 0.00 0.00 35.03 31.02 1n0n n LYS 197 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66