#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n1c s ASP 5 N 0.00 6.77 0.00 6.55 2.15 -1.26 -4.92 116.67 125.96 1n1c s ASP 5 Ca 0.00 0.81 0.22 0.00 0.43 0.00 0.00 52.55 54.01 1n1c s ASP 5 Cb 0.00 -2.46 -0.01 0.00 -0.30 0.00 0.00 42.92 40.14 1n1c s ASP 5 CO 0.00 -0.73 1.07 2.30 -0.17 0.00 0.00 175.17 177.64 1n1c n ILE 6 N 5.68 0.00 -0.36 4.11 -5.35 -1.26 -4.45 119.36 117.73 1n1c n ILE 6 Ca 0.07 -0.26 -0.01 0.00 -0.27 0.00 0.00 62.75 62.28 1n1c n ILE 6 Cb 0.48 1.25 0.13 0.00 -1.74 0.00 0.00 39.64 39.76 1n1c n ILE 6 CO 0.00 0.00 0.00 0.78 -1.76 0.00 0.00 176.55 175.57 1n1c h ASN 7 N 2.36 1.05 0.67 7.28 2.35 -1.99 -0.14 115.58 127.15 1n1c h ASN 7 Ca 0.00 -0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 55.68 1n1c h ASN 7 Cb 0.74 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.86 1n1c h ASN 7 CO 0.00 0.72 -0.26 1.55 -1.65 0.00 0.00 177.43 177.79 1n1c h PRO 8 N 1.22 0.00 -0.27 0.81 0.13 -2.01 -1.75 132.00 130.13 1n1c h PRO 8 Ca 0.38 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.35 1n1c h PRO 8 Cb -0.01 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.12 1n1c h PRO 8 CO -0.12 0.26 -0.44 0.00 -0.23 0.00 0.00 178.00 177.48 1n1c h ALA 9 N 1.74 0.42 -0.59 -0.56 0.00 -1.52 -2.47 119.26 116.27 1n1c h ALA 9 Ca -0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 1n1c h ALA 9 Cb 0.67 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 1n1c h ALA 9 CO 0.03 0.55 0.25 0.00 0.00 0.00 0.00 179.25 180.08 1n1c h ARG 10 N 0.52 0.88 -0.77 0.00 3.08 -0.83 -2.55 114.38 114.71 1n1c h ARG 10 Ca 0.02 -0.15 0.02 0.00 0.07 0.00 0.00 59.98 59.94 1n1c h ARG 10 Cb 1.03 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.90 1n1c h ARG 10 CO 0.10 0.74 0.50 0.00 -1.07 0.00 0.00 179.97 180.25 1n1c h ALA 11 N 1.09 0.99 -0.84 0.04 0.00 -1.24 -1.23 119.26 118.08 1n1c h ALA 11 Ca 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1n1c h ALA 11 Cb 0.19 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1n1c h ALA 11 CO -0.02 0.35 0.52 -0.07 0.00 0.00 0.00 179.25 180.04 1n1c h LEU 12 N 1.01 0.99 -0.33 0.00 3.38 -1.18 -0.00 115.31 119.17 1n1c h LEU 12 Ca 0.29 -0.05 -0.14 0.00 0.09 0.00 0.00 57.88 58.08 1n1c h LEU 12 Cb -0.06 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.44 1n1c h LEU 12 CO -0.08 0.74 -0.34 0.58 0.09 0.00 0.00 178.44 179.43 1n1c h VAL 13 N 1.15 1.29 -0.56 1.22 2.07 -0.94 -1.35 116.25 119.13 1n1c h VAL 13 Ca 0.30 -1.51 -0.03 0.00 0.82 0.00 0.00 66.70 66.28 1n1c h VAL 13 Cb -0.08 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 1n1c h VAL 13 CO -0.06 0.49 0.21 1.88 0.02 0.00 0.00 177.57 180.11 1n1c h TYR 14 N 0.59 0.82 -0.44 1.57 -1.99 -0.78 -1.22 116.97 115.52 1n1c h TYR 14 Ca 0.05 -0.05 -0.10 0.00 2.00 0.00 0.00 58.73 60.64 1n1c h TYR 14 Cb 0.92 -0.25 -0.02 0.00 2.00 0.00 0.00 36.73 39.38 1n1c h TYR 14 CO 0.07 0.64 -0.13 1.96 -0.00 0.00 0.00 178.16 180.70 1n1c h GLN 15 N 0.80 0.81 -0.18 4.88 4.20 -0.78 0.22 115.11 125.06 1n1c h GLN 15 Ca 0.19 -0.28 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 1n1c h GLN 15 Cb 0.18 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1n1c h GLN 15 CO -0.02 0.90 0.04 1.25 -0.67 0.00 0.00 178.83 180.33 1n1c h LEU 16 N 0.73 0.28 -0.95 1.46 5.85 -0.74 0.20 115.31 122.13 1n1c h LEU 16 Ca 0.12 -0.24 -0.05 0.00 0.84 0.00 0.00 57.88 58.55 1n1c h LEU 16 Cb 0.62 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 1n1c h LEU 16 CO 0.04 0.45 0.22 -0.07 -0.34 0.00 0.00 178.44 178.74 1n1c h LEU 17 N 0.10 0.91 0.13 2.25 3.38 -1.02 -2.51 115.31 118.55 1n1c h LEU 17 Ca 0.06 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1n1c h LEU 17 Cb 0.28 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1n1c h LEU 17 CO 0.00 0.84 -0.12 -1.28 0.09 0.00 0.00 178.44 177.96 1n1c h SER 18 N 0.95 -0.33 -0.92 -0.43 0.87 -0.16 -2.73 113.55 110.80 1n1c h SER 18 Ca 0.21 0.03 0.12 0.00 -1.23 0.00 0.00 61.79 60.93 1n1c h SER 18 Cb 0.25 0.11 -0.07 0.00 -0.44 0.00 0.00 62.40 62.25 1n1c h SER 18 CO -0.01 -0.19 0.59 0.77 -0.53 0.00 0.00 176.83 177.46 1n1c h SER 19 N -0.28 0.79 0.45 6.23 4.64 -0.28 0.13 113.55 125.24 1n1c h SER 19 Ca 0.00 0.04 -0.03 0.00 -0.47 0.00 0.00 61.79 61.33 1n1c h SER 19 Cb 0.26 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1n1c h SER 19 CO -0.03 0.43 -0.13 -0.07 -0.87 0.00 0.00 176.83 176.16 1n1c h LEU 20 N 0.85 0.00 0.00 5.97 3.38 -1.14 -2.30 115.31 122.07 1n1c h LEU 20 Ca 0.45 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.41 1n1c h LEU 20 Cb 0.54 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 1n1c h LEU 20 CO -0.21 0.13 -1.95 0.49 0.09 0.00 0.00 178.44 176.99 1n1c n PHE 21 N -3.57 0.06 -0.21 1.13 3.01 -0.60 -4.51 117.46 112.77 1n1c n PHE 21 Ca -0.01 0.02 -0.08 0.00 1.01 0.00 0.00 57.45 58.39 1n1c n PHE 21 Cb 0.26 -0.54 0.03 0.00 -0.01 0.00 0.00 39.48 39.22 1n1c n PHE 21 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1n1c h ALA 22 N 1.98 0.78 -2.72 4.37 0.00 -0.19 -3.47 119.26 120.01 1n1c h ALA 22 Ca -0.01 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.75 1n1c h ALA 22 Cb 1.02 -0.23 -0.13 0.00 0.00 0.00 0.00 17.79 18.45 1n1c h ALA 22 CO 0.00 0.41 0.32 -0.98 0.00 0.00 0.00 179.25 179.00 1n1c s ARG 23 N -5.49 1.10 0.66 0.00 1.70 -1.15 -1.51 118.95 114.27 1n1c s ARG 23 Ca -0.13 -0.40 -0.18 0.00 -0.47 0.00 0.00 55.73 54.56 1n1c s ARG 23 Cb 0.13 0.51 -0.01 0.00 -0.57 0.00 0.00 34.95 35.01 1n1c s ARG 23 CO 0.80 -0.48 1.25 -0.85 -1.08 0.00 0.00 175.30 174.94 1n1c n GLU 24 N -0.32 1.01 -2.65 3.89 0.28 -1.26 -4.77 120.64 116.83 1n1c n GLU 24 Ca -0.14 0.40 -0.42 0.00 -0.16 0.00 0.00 57.16 56.84 1n1c n GLU 24 Cb 0.64 -2.49 -0.03 0.00 1.43 0.00 0.00 31.44 30.99 1n1c n GLU 24 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1n1c s VAL 25 N -1.46 4.70 0.48 3.84 1.01 -1.26 -5.05 120.40 122.66 1n1c s VAL 25 Ca 0.82 1.95 0.07 0.00 0.00 0.00 0.00 61.98 64.82 1n1c s VAL 25 Cb -0.38 -4.25 0.01 0.00 0.00 0.00 0.00 36.38 31.76 1n1c s VAL 25 CO 0.42 0.06 0.43 1.51 0.00 0.00 0.00 175.10 177.52 1n1c s ASP 26 N 1.11 4.87 0.18 3.32 3.84 -1.26 -4.77 116.67 123.96 1n1c s ASP 26 Ca 0.51 -0.96 -0.15 0.00 -0.00 0.00 0.00 52.55 51.95 1n1c s ASP 26 Cb -0.21 -0.09 0.15 0.00 -1.38 0.00 0.00 42.92 41.39 1n1c s ASP 26 CO 0.23 -0.90 1.65 -0.08 -0.00 0.00 0.00 175.17 176.07 1n1c h GLU 27 N 0.84 0.01 -0.55 2.11 4.81 -1.99 0.15 114.58 119.95 1n1c h GLU 27 Ca -0.38 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.84 1n1c h GLU 27 Cb 1.28 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.63 1n1c h GLU 27 CO 0.56 0.00 0.31 0.37 -0.73 0.00 0.00 179.01 179.52 1n1c h GLN 28 N 0.01 0.77 -0.46 1.92 5.75 -2.00 -1.99 115.11 119.10 1n1c h GLN 28 Ca 0.24 -0.09 -0.06 0.00 -0.15 0.00 0.00 58.65 58.59 1n1c h GLN 28 Cb 0.36 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.74 1n1c h GLN 28 CO -0.51 0.58 0.03 -0.09 -2.65 0.00 0.00 178.83 176.20 1n1c h ARG 29 N 0.74 0.75 -0.74 1.69 9.65 -1.73 -1.65 114.38 123.10 1n1c h ARG 29 Ca 0.19 -0.18 -0.03 0.00 -1.10 0.00 0.00 59.98 58.86 1n1c h ARG 29 Cb 0.04 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.49 1n1c h ARG 29 CO -0.03 0.74 0.33 1.25 2.80 0.00 0.00 179.97 185.06 1n1c h LEU 30 N 0.71 0.98 -0.35 3.80 5.85 -0.38 -0.61 115.31 125.31 1n1c h LEU 30 Ca 0.14 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1n1c h LEU 30 Cb 0.40 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 1n1c h LEU 30 CO 0.01 0.86 0.15 0.11 -0.34 0.00 0.00 178.44 179.23 1n1c h LYS 31 N 1.04 0.51 0.00 1.25 1.57 -0.86 -1.46 116.57 118.63 1n1c h LYS 31 Ca 0.25 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.92 1n1c h LYS 31 Cb 0.15 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 1n1c h LYS 31 CO -0.03 0.49 -0.12 1.05 -0.57 0.00 0.00 179.45 180.27 1n1c h GLU 32 N 0.42 0.00 0.00 3.15 4.11 -1.06 -1.01 114.58 120.18 1n1c h GLU 32 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.55 1n1c h GLU 32 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1n1c h GLU 32 CO -0.01 0.12 -0.36 1.28 0.07 0.00 0.00 179.01 180.11 1n1c n LEU 33 N -3.27 0.48 -0.00 3.06 4.77 -0.26 -3.98 117.00 117.80 1n1c n LEU 33 Ca 0.00 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 1n1c n LEU 33 Cb 0.38 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1n1c n LEU 33 CO 0.31 0.01 0.47 0.35 -1.33 0.00 0.00 177.39 177.19 1n1c n THR 34 N -1.77 0.87 -0.47 -5.08 -2.24 -0.58 -4.72 114.28 100.30 1n1c n THR 34 Ca 0.05 -0.87 -0.28 0.00 -2.27 0.00 0.00 64.05 60.68 1n1c n THR 34 Cb 0.38 0.56 0.26 0.00 -2.10 0.00 0.00 70.33 69.43 1n1c n THR 34 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1n1c n SER 35 N -0.44 -1.79 0.07 3.42 3.41 -0.42 -4.61 113.62 113.27 1n1c n SER 35 Ca 0.00 -0.18 0.02 0.00 -0.26 0.00 0.00 58.87 58.45 1n1c n SER 35 Cb 0.28 -1.26 0.36 0.00 -0.26 0.00 0.00 64.21 63.34 1n1c n SER 35 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1n1c h GLU 36 N -2.73 0.35 -0.20 4.33 4.22 -1.95 0.93 114.58 119.54 1n1c h GLU 36 Ca -0.62 -0.07 -0.19 0.00 0.08 0.00 0.00 59.36 58.55 1n1c h GLU 36 Cb 1.33 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1n1c h GLU 36 CO 0.49 0.43 -0.64 0.00 -2.18 0.00 0.00 179.01 177.11 1n1c h ALA 37 N 1.61 0.49 -0.20 2.92 0.00 -1.96 -3.06 119.26 119.07 1n1c h ALA 37 Ca 0.07 -0.55 -0.11 0.00 0.00 0.00 0.00 54.91 54.32 1n1c h ALA 37 Cb 0.33 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1n1c h ALA 37 CO 0.01 0.70 -0.33 0.00 0.00 0.00 0.00 179.25 179.63 1n1c h ALA 38 N 0.75 1.07 -0.37 0.00 0.00 -1.64 -2.87 119.26 116.20 1n1c h ALA 38 Ca -0.01 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.47 1n1c h ALA 38 Cb 1.24 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1n1c h ALA 38 CO 0.13 0.58 0.03 1.96 0.00 0.00 0.00 179.25 181.95 1n1c h GLN 39 N 0.35 0.56 -0.35 0.00 1.08 -0.76 -1.98 115.11 114.01 1n1c h GLN 39 Ca 0.04 -0.11 -0.05 0.00 -1.45 0.00 0.00 58.65 57.08 1n1c h GLN 39 Cb 0.76 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 28.09 1n1c h GLN 39 CO 0.06 0.56 0.02 0.37 -0.95 0.00 0.00 178.83 178.90 1n1c h GLN 40 N 0.54 0.60 0.16 1.46 4.15 -1.41 -1.92 115.11 118.68 1n1c h GLN 40 Ca 0.12 -0.18 -0.00 0.00 0.77 0.00 0.00 58.65 59.36 1n1c h GLN 40 Cb 0.30 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.93 1n1c h GLN 40 CO 0.01 0.70 -0.11 0.35 -1.93 0.00 0.00 178.83 177.84 1n1c h PHE 41 N 0.42 -0.30 -0.52 3.99 3.57 -1.27 -1.92 116.94 120.91 1n1c h PHE 41 Ca 0.10 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.62 1n1c h PHE 41 Cb 0.42 0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.23 1n1c h PHE 41 CO 0.03 -0.18 0.31 -1.49 -2.23 0.00 0.00 178.31 174.75 1n1c h TRP 42 N -0.28 0.58 -0.21 0.41 4.06 -1.35 0.54 115.95 119.70 1n1c h TRP 42 Ca -0.01 0.02 0.04 0.00 2.06 0.00 0.00 58.89 61.00 1n1c h TRP 42 Cb 0.24 -0.19 -0.04 0.00 -1.00 0.00 0.00 29.16 28.18 1n1c h TRP 42 CO -0.10 0.33 -0.02 1.49 -3.56 0.00 0.00 178.44 176.58 1n1c h GLU 43 N 0.62 0.03 -0.69 0.49 4.57 -1.24 0.26 114.58 118.62 1n1c h GLU 43 Ca 0.21 -0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.35 1n1c h GLU 43 Cb 0.02 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.57 1n1c h GLU 43 CO -0.09 0.02 0.30 0.37 -1.18 0.00 0.00 179.01 178.43 1n1c h GLN 44 N 0.04 1.02 -0.44 1.92 5.75 -1.06 -2.32 115.11 120.01 1n1c h GLN 44 Ca 0.10 -0.17 -0.09 0.00 -0.15 0.00 0.00 58.65 58.34 1n1c h GLN 44 Cb 0.14 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 28.50 1n1c h GLN 44 CO -0.19 0.83 -0.09 1.25 -2.65 0.00 0.00 178.83 177.98 1n1c h LEU 45 N 0.98 0.77 -1.77 -2.39 5.85 -0.30 -2.54 115.31 115.91 1n1c h LEU 45 Ca 0.23 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1n1c h LEU 45 Cb 0.17 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.00 1n1c h LEU 45 CO -0.02 0.90 0.00 0.77 -0.34 0.00 0.00 178.44 179.74 1n1c h SER 46 N 0.72 0.00 0.93 1.25 4.64 0.04 -2.17 113.55 118.95 1n1c h SER 46 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1n1c h SER 46 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1n1c h SER 46 CO 0.04 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.18 1n1c n LEU 47 N -2.80 0.40 -4.67 5.97 4.77 -0.96 -3.69 117.00 116.03 1n1c n LEU 47 Ca -0.00 0.57 -0.43 0.00 -0.03 0.00 0.00 56.01 56.12 1n1c n LEU 47 Cb 0.18 -0.48 -0.02 0.00 -2.33 0.00 0.00 43.42 40.77 1n1c n LEU 47 CO 0.21 -0.27 0.95 -1.61 -1.33 0.00 0.00 177.39 175.34 1n1c s GLU 48 N -3.12 4.31 0.25 3.23 0.41 -0.82 -4.91 118.70 118.06 1n1c s GLU 48 Ca 0.09 1.54 -0.03 0.00 -0.41 0.00 0.00 54.97 56.16 1n1c s GLU 48 Cb 0.12 -3.64 0.49 0.00 -1.78 0.00 0.00 34.13 29.33 1n1c s GLU 48 CO 0.44 -0.54 1.75 0.00 -0.49 0.00 0.00 175.26 176.42 1n1c h ALA 49 N 7.61 1.17 0.00 5.21 0.00 -1.89 -0.90 119.26 130.46 1n1c h ALA 49 Ca -0.28 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1n1c h ALA 49 Cb 1.12 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1n1c h ALA 49 CO 0.93 -0.15 -0.09 -0.91 0.00 0.00 0.00 179.25 179.03 1n1c h ASN 50 N 0.53 0.00 0.07 0.00 2.35 -1.93 -3.24 115.58 113.36 1n1c h ASN 50 Ca 0.44 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 56.08 1n1c h ASN 50 Cb 0.64 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.99 1n1c h ASN 50 CO -0.38 0.09 -2.04 0.49 -1.65 0.00 0.00 177.43 173.94 1n1c n PHE 51 N -3.65 0.08 -0.28 1.19 0.99 -0.41 -4.77 117.46 110.60 1n1c n PHE 51 Ca -0.02 0.02 -0.07 0.00 -0.00 0.00 0.00 57.45 57.38 1n1c n PHE 51 Cb 0.20 -0.67 -0.07 0.00 -1.00 0.00 0.00 39.48 37.94 1n1c n PHE 51 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.76 179.17 1n1c n THR 52 N -2.43 -0.45 -0.01 4.37 -1.04 -0.77 -1.38 114.28 112.56 1n1c n THR 52 Ca -0.12 1.79 -0.10 0.00 -2.04 0.00 0.00 64.05 63.59 1n1c n THR 52 Cb 0.74 -2.23 -0.04 0.00 -1.82 0.00 0.00 70.33 66.97 1n1c n THR 52 CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 1n1c h GLN 53 N 0.00 0.04 -0.40 -2.82 4.15 -1.86 -1.21 115.11 113.01 1n1c h GLN 53 Ca 0.11 -0.00 -0.14 0.00 0.77 0.00 0.00 58.65 59.39 1n1c h GLN 53 Cb 0.27 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.95 1n1c h GLN 53 CO -0.63 0.02 -0.31 0.66 -1.93 0.00 0.00 178.83 176.65 1n1c h SER 54 N 0.04 0.91 -0.29 -0.69 4.64 -1.83 -2.56 113.55 113.77 1n1c h SER 54 Ca 0.06 -0.38 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1n1c h SER 54 Cb 0.08 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 61.90 1n1c h SER 54 CO -0.11 1.14 0.19 0.58 -0.87 0.00 0.00 176.83 177.76 1n1c h VAL 55 N 0.74 1.08 0.00 0.95 2.07 -1.07 0.12 116.25 120.13 1n1c h VAL 55 Ca 0.08 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.43 1n1c h VAL 55 Cb 0.87 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 31.29 1n1c h VAL 55 CO 0.08 0.07 -0.13 0.44 0.02 0.00 0.00 177.57 178.05 1n1c h ASP 56 N 0.38 0.00 0.25 0.57 3.32 -1.18 0.11 116.42 119.88 1n1c h ASP 56 Ca 0.10 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.90 1n1c h ASP 56 Cb -0.04 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.52 1n1c h ASP 56 CO -0.02 0.13 -1.06 0.50 -1.72 0.00 0.00 179.24 177.07 1n1c h LYS 57 N 0.00 0.50 0.42 3.56 1.63 -0.90 -2.05 116.57 119.73 1n1c h LYS 57 Ca -0.00 -0.59 -0.02 0.00 -0.85 0.00 0.00 60.65 59.18 1n1c h LYS 57 Cb 0.30 0.18 0.00 0.00 -0.60 0.00 0.00 32.23 32.12 1n1c h LYS 57 CO 0.02 1.22 -0.20 0.82 -3.45 0.00 0.00 179.45 177.86 1n1c h ILE 58 N 0.26 0.56 -0.01 2.00 1.08 0.62 -2.51 117.51 119.52 1n1c h ILE 58 Ca -0.12 -0.30 -0.15 0.00 -0.39 0.00 0.00 64.86 63.90 1n1c h ILE 58 Cb 1.71 0.71 -0.02 0.00 -3.07 0.00 0.00 36.82 36.15 1n1c h ILE 58 CO 0.19 0.05 -0.69 0.08 -0.69 0.00 0.00 178.15 177.10 1n1c h ARG 59 N -0.75 0.03 -0.29 2.37 0.11 -0.95 -1.88 114.38 113.02 1n1c h ARG 59 Ca -0.06 -0.02 -0.10 0.00 0.10 0.00 0.00 59.98 59.90 1n1c h ARG 59 Cb 0.53 0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.60 1n1c h ARG 59 CO 0.10 0.71 -0.23 0.66 0.10 0.00 0.00 179.97 181.30 1n1c h SER 60 N 0.02 0.55 -0.01 0.08 4.64 -1.42 0.27 113.55 117.68 1n1c h SER 60 Ca -0.01 -0.18 -0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1n1c h SER 60 Cb 1.22 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 63.16 1n1c h SER 60 CO 0.09 0.78 -0.01 0.74 -0.87 0.00 0.00 176.83 177.56 1n1c h THR 61 N 0.49 1.33 -0.58 2.95 2.02 -1.29 -0.80 112.91 117.03 1n1c h THR 61 Ca 0.07 -0.99 -0.08 0.00 0.77 0.00 0.00 66.41 66.18 1n1c h THR 61 Cb 0.66 1.98 -0.02 0.00 -1.74 0.00 0.00 68.15 69.03 1n1c h THR 61 CO 0.05 0.26 0.05 -0.07 0.37 0.00 0.00 175.52 176.18 1n1c h LEU 62 N -0.38 0.92 -0.76 2.58 3.38 -1.17 -2.59 115.31 117.28 1n1c h LEU 62 Ca 0.00 -0.22 -0.09 0.00 0.09 0.00 0.00 57.88 57.66 1n1c h LEU 62 Cb 0.43 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1n1c h LEU 62 CO 0.00 0.95 -0.41 0.78 0.09 0.00 0.00 178.44 179.86 1n1c h ASN 63 N 0.89 0.00 1.20 -0.43 2.35 -0.49 -3.02 115.58 116.09 1n1c h ASN 63 Ca 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 1n1c h ASN 63 Cb 0.46 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.83 1n1c h ASN 63 CO 0.02 0.41 0.00 1.23 -1.65 0.00 0.00 177.43 177.43 1n1c h GLY 64 N 2.34 0.00 -7.42 2.83 0.00 -0.75 -3.42 103.07 96.66 1n1c h GLY 64 Ca -0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 1n1c h GLY 64 CO 0.05 0.00 1.32 -0.42 0.00 0.00 0.00 176.54 177.50 1n1c s ILE 65 N -3.42 3.40 -0.22 2.60 -1.09 -1.12 -4.76 121.20 116.59 1n1c s ILE 65 Ca 0.04 0.25 0.02 0.00 -2.23 0.00 0.00 60.65 58.74 1n1c s ILE 65 Cb 0.09 -3.99 0.01 0.00 -1.58 0.00 0.00 42.46 36.99 1n1c s ILE 65 CO 0.54 -0.93 0.42 0.29 -1.23 0.00 0.00 174.94 174.03 1n1c n LYS 66 N 9.12 1.53 -4.04 2.79 5.02 -1.26 -5.01 118.16 126.31 1n1c n LYS 66 Ca 0.19 -0.43 -0.09 0.00 -2.02 0.00 0.00 58.31 55.96 1n1c n LYS 66 Cb 0.51 -0.90 -0.08 0.00 -0.02 0.00 0.00 35.03 34.54 1n1c n LYS 66 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 1n1c s ASP 67 N -0.50 0.18 0.49 4.39 3.84 -1.26 -5.05 116.67 118.75 1n1c s ASP 67 Ca 0.02 -1.01 0.22 0.00 -0.00 0.00 0.00 52.55 51.78 1n1c s ASP 67 Cb 0.02 0.36 1.26 0.00 -1.38 0.00 0.00 42.92 43.18 1n1c s ASP 67 CO 0.04 -0.80 2.04 0.44 -0.00 0.00 0.00 175.17 176.88 1n1c h ASP 68 N 2.71 0.00 -0.17 2.11 3.32 -1.99 -2.85 116.42 119.55 1n1c h ASP 68 Ca -0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.72 1n1c h ASP 68 Cb 1.21 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 1n1c h ASP 68 CO 0.54 0.15 0.11 -0.08 -1.72 0.00 0.00 179.24 178.24 1n1c h GLU 69 N 0.00 0.23 -0.38 3.56 4.81 -1.98 0.24 114.58 121.06 1n1c h GLU 69 Ca -0.00 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.14 1n1c h GLU 69 Cb 0.34 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 1n1c h GLU 69 CO 0.02 0.18 -0.06 0.00 -0.73 0.00 0.00 179.01 178.42 1n1c h ALA 70 N 1.04 1.18 -0.33 2.92 0.00 -1.93 -0.85 119.26 121.28 1n1c h ALA 70 Ca 0.06 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 1n1c h ALA 70 Cb 0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1n1c h ALA 70 CO -0.01 0.53 -0.04 1.25 0.00 0.00 0.00 179.25 180.97 1n1c h LEU 71 N 0.60 0.61 -1.61 0.00 5.85 -1.21 -2.17 115.31 117.37 1n1c h LEU 71 Ca 0.11 -0.34 -0.04 0.00 0.84 0.00 0.00 57.88 58.45 1n1c h LEU 71 Cb 0.47 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1n1c h LEU 71 CO 0.02 0.80 -0.20 -0.07 -0.34 0.00 0.00 178.44 178.66 1n1c h LEU 72 N 0.40 0.00 -0.57 2.25 3.38 -0.26 -1.59 115.31 118.92 1n1c h LEU 72 Ca 0.09 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.92 1n1c h LEU 72 Cb 0.52 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1n1c h LEU 72 CO 0.03 0.20 -0.35 -0.08 0.09 0.00 0.00 178.44 178.32 1n1c h GLU 73 N 0.00 0.76 -0.27 1.13 4.81 -0.78 -0.60 114.58 119.63 1n1c h GLU 73 Ca -0.00 -0.37 -0.17 0.00 -0.13 0.00 0.00 59.36 58.68 1n1c h GLU 73 Cb 0.35 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.73 1n1c h GLU 73 CO 0.03 0.99 -0.50 1.25 -0.73 0.00 0.00 179.01 180.05 1n1c h LEU 74 N 0.64 0.91 -1.55 1.64 5.85 -0.76 -1.99 115.31 120.04 1n1c h LEU 74 Ca 0.06 -0.53 -0.05 0.00 0.84 0.00 0.00 57.88 58.20 1n1c h LEU 74 Cb 0.89 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 1n1c h LEU 74 CO 0.08 1.27 -0.20 0.00 -0.34 0.00 0.00 178.44 179.25 1n1c h ALA 75 N 0.66 1.63 -0.08 1.25 0.00 -1.20 -0.94 119.26 120.57 1n1c h ALA 75 Ca 0.01 -0.20 -0.18 0.00 0.00 0.00 0.00 54.91 54.55 1n1c h ALA 75 Cb 1.11 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1n1c h ALA 75 CO 0.11 0.28 -0.70 0.00 0.00 0.00 0.00 179.25 178.94 1n1c h ALA 76 N 1.77 0.64 -0.43 0.00 0.00 -0.88 -1.94 119.26 118.42 1n1c h ALA 76 Ca 0.01 -0.59 -0.04 0.00 0.00 0.00 0.00 54.91 54.28 1n1c h ALA 76 Cb 0.38 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1n1c h ALA 76 CO 0.03 0.76 0.09 -0.44 0.00 0.00 0.00 179.25 179.69 1n1c h ASP 77 N 0.26 0.66 0.28 0.00 3.45 -0.52 0.25 116.42 120.81 1n1c h ASP 77 Ca -0.02 -0.24 -0.00 0.00 0.43 0.00 0.00 57.03 57.19 1n1c h ASP 77 Cb 1.26 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 39.85 1n1c h ASP 77 CO 0.12 0.73 -0.21 0.22 -1.57 0.00 0.00 179.24 178.53 1n1c h TYR 78 N 0.56 -0.56 -0.25 4.55 3.20 -1.07 -2.23 116.97 121.16 1n1c h TYR 78 Ca 0.13 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.98 1n1c h TYR 78 Cb 0.34 0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.81 1n1c h TYR 78 CO 0.02 -0.32 0.07 0.00 -1.64 0.00 0.00 178.16 176.28 1n1c n GLY 80 N -0.56 -0.65 0.23 0.00 0.00 0.07 -1.82 105.19 102.46 1n1c n GLY 80 Ca -0.03 -0.12 -0.07 0.00 0.00 0.00 0.00 46.02 45.80 1n1c n GLY 80 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1n1c n LEU 81 N -1.03 2.35 -0.06 0.99 7.94 -0.84 -4.08 117.00 122.26 1n1c n LEU 81 Ca 0.14 -0.00 -0.07 0.00 -1.11 0.00 0.00 56.01 54.97 1n1c n LEU 81 Cb 0.08 -0.27 -0.07 0.00 0.53 0.00 0.00 43.42 43.69 1n1c n LEU 81 CO 0.12 0.51 -0.88 0.49 -1.11 0.00 0.00 177.39 176.51 1n1c n PHE 82 N -2.91 0.00 0.46 1.96 0.99 0.09 -1.52 117.46 116.52 1n1c n PHE 82 Ca -0.15 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.42 1n1c n PHE 82 Cb 0.64 -0.50 0.20 0.00 -1.00 0.00 0.00 39.48 38.82 1n1c n PHE 82 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 1n1c h LEU 83 N 0.00 0.00 0.00 4.37 3.38 -1.46 -3.43 115.31 118.18 1n1c h LEU 83 Ca -0.28 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1n1c h LEU 83 Cb 1.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.27 1n1c h LEU 83 CO -0.02 0.05 0.00 1.33 0.09 0.00 0.00 178.44 179.89 1n1c n VAL 84 N -2.37 0.00 0.00 1.22 0.24 -0.85 -4.70 118.33 111.87 1n1c n VAL 84 Ca 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.33 1n1c n VAL 84 Cb 0.47 -0.55 0.00 0.00 -1.47 0.00 0.00 33.84 32.29 1n1c n VAL 84 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1n1c n GLY 85 N 1.79 0.00 0.00 7.63 0.00 -1.26 -4.96 105.19 108.39 1n1c n GLY 85 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1n1c n GLY 85 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1n1c n THR 86 N 0.00 0.00 -0.56 2.61 -1.04 -1.26 -5.03 114.28 109.01 1n1c n THR 86 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1n1c n THR 86 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1n1c n THR 86 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1n1c n SER 89 N 0.00 0.00 -3.01 8.00 3.41 -1.21 -5.16 113.62 115.65 1n1c n SER 89 Ca 0.00 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.45 1n1c n SER 89 Cb 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 63.94 1n1c n SER 89 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n1c n ALA 90 N 0.00 0.87 -1.75 7.33 0.00 -0.58 -5.09 120.51 121.30 1n1c n ALA 90 Ca 0.00 -2.60 -0.42 0.00 0.00 0.00 0.00 53.44 50.42 1n1c n ALA 90 Cb 0.00 -1.02 -0.01 0.00 0.00 0.00 0.00 19.45 18.41 1n1c n ALA 90 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1n1c n SER 91 N 1.09 3.81 -1.32 0.00 7.64 -1.25 -4.48 113.62 119.10 1n1c n SER 91 Ca 0.17 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.20 1n1c n SER 91 Cb 0.61 -1.59 0.00 0.00 -1.01 0.00 0.00 64.21 62.22 1n1c n SER 91 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1n1c n PRO 92 N 1.95 0.95 -4.01 1.43 -0.04 -1.26 -4.84 135.00 129.17 1n1c n PRO 92 Ca 0.08 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.19 1n1c n PRO 92 Cb 0.37 -1.03 -0.12 0.00 -0.04 0.00 0.00 33.50 32.68 1n1c n PRO 92 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1n1c s TYR 93 N 0.09 3.11 0.21 0.54 1.51 -1.26 -5.01 117.35 116.54 1n1c s TYR 93 Ca 0.00 -0.27 -0.09 0.00 -1.01 0.00 0.00 57.07 55.70 1n1c s TYR 93 Cb 0.00 -2.11 0.30 0.00 -0.11 0.00 0.00 41.96 40.04 1n1c s TYR 93 CO 0.00 -0.14 1.75 0.00 -1.11 0.00 0.00 175.55 176.05 1n1c h ALA 94 N 7.38 0.84 -0.75 3.71 0.00 -2.01 -2.04 119.26 126.40 1n1c h ALA 94 Ca -0.36 0.08 0.19 0.00 0.00 0.00 0.00 54.91 54.82 1n1c h ALA 94 Cb 1.18 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.96 1n1c h ALA 94 CO 0.63 -0.16 0.52 0.66 0.00 0.00 0.00 179.25 180.89 1n1c h SER 95 N 0.45 0.15 0.28 0.00 4.64 -1.95 -0.38 113.55 116.74 1n1c h SER 95 Ca 0.32 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 1n1c h SER 95 Cb 0.39 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1n1c h SER 95 CO -0.30 0.07 0.00 0.18 -0.87 0.00 0.00 176.83 175.90 1n1c n LEU 96 N -4.39 0.00 0.00 5.97 4.77 -0.76 -3.13 117.00 119.46 1n1c n LEU 96 Ca 0.15 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.35 1n1c n LEU 96 Cb 0.71 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 1n1c n LEU 96 CO 0.36 -0.07 0.14 -1.22 -1.33 0.00 0.00 177.39 175.26 1n1c n TYR 97 N -1.22 0.00 -2.45 -1.77 4.02 -0.19 -5.09 117.16 110.46 1n1c n TYR 97 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.00 1n1c n TYR 97 Cb 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.46 1n1c n TYR 97 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1n1c n LEU 98 N -0.01 0.00 -0.12 7.72 4.77 -0.96 -5.13 117.00 123.27 1n1c n LEU 98 Ca 0.00 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.75 1n1c n LEU 98 Cb 0.11 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.11 1n1c n LEU 98 CO 0.00 0.00 -1.28 0.18 -1.33 0.00 0.00 177.39 174.96 1n1c n LEU 105 N 0.00 1.90 -0.55 2.23 4.32 -1.26 -4.82 117.00 118.82 1n1c n LEU 105 Ca 0.00 0.21 0.01 0.00 -0.02 0.00 0.00 56.01 56.21 1n1c n LEU 105 Cb 0.00 -0.70 0.06 0.00 -1.62 0.00 0.00 43.42 41.16 1n1c n LEU 105 CO 0.00 0.56 0.40 0.00 -1.22 0.00 0.00 177.39 177.13 1n1c n LEU 106 N -3.87 1.35 0.08 2.23 -0.00 -1.26 -4.15 117.00 111.39 1n1c n LEU 106 Ca -0.45 -0.68 -0.04 0.00 -0.00 0.00 0.00 56.01 54.85 1n1c n LEU 106 Cb 0.84 -0.39 -0.02 0.00 -0.00 0.00 0.00 43.42 43.86 1n1c n LEU 106 CO 0.06 0.26 0.18 0.15 -0.00 0.00 0.00 177.39 178.04 1n1c h PHE 107 N 0.60 -0.23 -0.21 1.47 3.57 -2.08 -3.29 116.94 116.77 1n1c h PHE 107 Ca 0.00 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.56 1n1c h PHE 107 Cb 0.54 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 1n1c h PHE 107 CO 0.13 -0.14 0.20 0.78 -2.23 0.00 0.00 178.31 177.06 1n1c h GLY 108 N -0.58 0.00 2.00 2.40 0.00 -2.03 -1.81 103.07 103.05 1n1c h GLY 108 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1n1c h GLY 108 CO 0.04 0.00 0.00 -1.84 0.00 0.00 0.00 176.54 174.74 1n1c n GLU 109 N -3.99 0.26 0.00 4.80 0.28 -1.25 -2.86 120.64 117.87 1n1c n GLU 109 Ca 0.02 0.22 0.13 0.00 -0.16 0.00 0.00 57.16 57.37 1n1c n GLU 109 Cb 0.34 -1.80 0.44 0.00 1.43 0.00 0.00 31.44 31.85 1n1c n GLU 109 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1n1c n GLN 110 N -2.26 0.86 0.20 3.44 6.02 -0.68 -3.57 117.38 121.39 1n1c n GLN 110 Ca 0.05 -0.46 0.12 0.00 -0.01 0.00 0.00 57.00 56.70 1n1c n GLN 110 Cb 0.42 -1.49 0.23 0.00 1.02 0.00 0.00 30.24 30.43 1n1c n GLN 110 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1n1c h HIS 111 N 1.13 0.00 -0.39 1.08 3.86 -1.58 -3.22 115.15 116.03 1n1c h HIS 111 Ca 0.00 0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.08 1n1c h HIS 111 Cb 0.47 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.93 1n1c h HIS 111 CO 0.00 0.00 -0.27 1.96 0.86 0.00 0.00 177.93 180.48 1n1c h GLN 112 N 0.00 0.82 -1.63 2.45 7.50 -1.73 -2.86 115.11 119.67 1n1c h GLN 112 Ca 0.00 -0.36 0.00 0.00 0.50 0.00 0.00 58.65 58.79 1n1c h GLN 112 Cb 0.93 -0.02 0.00 0.00 0.05 0.00 0.00 27.48 28.44 1n1c h GLN 112 CO 0.00 1.00 0.00 1.04 -1.50 0.00 0.00 178.83 179.37 1n1c n GLN 113 N -4.09 0.92 0.00 1.46 3.00 -1.22 -3.47 117.38 113.98 1n1c n GLN 113 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1n1c n GLN 113 Cb 0.47 -1.04 0.00 0.00 0.00 0.00 0.00 30.24 29.67 1n1c n GLN 113 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 1n1c n SER 115 N 1.14 0.00 -0.15 1.08 3.41 -1.08 -1.72 113.62 116.30 1n1c n SER 115 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.52 1n1c n SER 115 Cb 0.46 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.41 1n1c n SER 115 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1n1c h GLU 116 N 0.00 0.65 -0.34 4.33 4.57 -1.85 0.68 114.58 122.61 1n1c h GLU 116 Ca 0.00 -0.13 -0.09 0.00 -1.18 0.00 0.00 59.36 57.96 1n1c h GLU 116 Cb 0.00 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.47 1n1c h GLU 116 CO 0.00 0.62 -0.16 0.35 -1.18 0.00 0.00 179.01 178.64 1n1c h PHE 117 N 0.54 0.68 -0.14 0.92 3.57 -1.66 -0.74 116.94 120.11 1n1c h PHE 117 Ca 0.14 -0.13 -0.10 0.00 3.53 0.00 0.00 57.97 61.41 1n1c h PHE 117 Cb 0.23 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 1n1c h PHE 117 CO 0.01 0.75 -0.37 1.25 -2.23 0.00 0.00 178.31 177.72 1n1c h LEU 118 N 0.56 0.30 -0.07 0.59 6.46 -1.70 0.42 115.31 121.86 1n1c h LEU 118 Ca 0.09 -0.12 -0.25 0.00 -0.12 0.00 0.00 57.88 57.49 1n1c h LEU 118 Cb 0.60 -0.08 0.01 0.00 -0.73 0.00 0.00 40.66 40.45 1n1c h LEU 118 CO 0.04 0.65 -1.04 -0.74 -0.62 0.00 0.00 178.44 176.72 1n1c h HIS 119 N 0.25 0.66 0.08 1.25 2.76 -0.50 -3.11 115.15 116.53 1n1c h HIS 119 Ca 0.03 -0.39 -0.13 0.00 -2.20 0.00 0.00 60.37 57.68 1n1c h HIS 119 Cb 0.76 -0.06 0.01 0.00 1.55 0.00 0.00 27.41 29.67 1n1c h HIS 119 CO 0.02 1.23 -0.60 1.96 -1.30 0.00 0.00 177.93 179.23 1n1c h GLN 120 N 0.21 0.17 0.00 5.26 1.08 -0.98 -3.31 115.11 117.55 1n1c h GLN 120 Ca -0.11 -0.29 0.00 0.00 -1.45 0.00 0.00 58.65 56.80 1n1c h GLN 120 Cb 1.70 0.11 0.00 0.00 -0.05 0.00 0.00 27.48 29.24 1n1c h GLN 120 CO 0.18 1.14 0.00 0.66 -0.95 0.00 0.00 178.83 179.86 1n1c h SER 121 N -0.62 0.00 -5.39 1.46 4.64 -0.31 -3.45 113.55 109.88 1n1c h SER 121 Ca -0.12 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.87 1n1c h SER 121 Cb 1.41 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.40 1n1c h SER 121 CO 0.07 0.00 -0.48 0.29 -0.87 0.00 0.00 176.83 175.84 1n1c n LYS 122 N -3.07 -2.88 -2.41 4.77 4.76 -1.18 -4.87 118.16 113.28 1n1c n LYS 122 Ca -0.01 0.37 -0.41 0.00 -2.87 0.00 0.00 58.31 55.39 1n1c n LYS 122 Cb 0.17 -5.02 -0.04 0.00 -1.84 0.00 0.00 35.03 28.30 1n1c n LYS 122 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1n1c s LEU 123 N -6.24 4.51 -0.18 -0.35 1.02 -1.26 -5.02 118.68 111.17 1n1c s LEU 123 Ca 0.34 2.30 -0.03 0.00 0.02 0.00 0.00 54.13 56.76 1n1c s LEU 123 Cb -0.18 -3.62 -0.02 0.00 0.02 0.00 0.00 46.19 42.39 1n1c s LEU 123 CO 0.42 -0.25 -0.07 -1.10 0.02 0.00 0.00 176.35 175.38 1n1c s GLN 124 N -1.13 3.46 -0.21 1.70 -1.52 -1.26 -5.04 119.66 115.66 1n1c s GLN 124 Ca 0.47 -0.61 -0.06 0.00 -1.95 0.00 0.00 55.36 53.21 1n1c s GLN 124 Cb -0.33 -2.88 -0.03 0.00 -0.22 0.00 0.00 33.01 29.55 1n1c s GLN 124 CO 0.41 0.03 0.02 0.08 -0.25 0.00 0.00 175.29 175.59 1n1c s VAL 125 N 0.87 4.15 0.27 1.09 1.01 -1.26 -4.88 120.40 121.65 1n1c s VAL 125 Ca -0.02 -0.25 -0.30 0.00 0.00 0.00 0.00 61.98 61.42 1n1c s VAL 125 Cb -0.15 -2.89 -0.13 0.00 0.00 0.00 0.00 36.38 33.22 1n1c s VAL 125 CO 0.01 0.42 1.37 1.67 0.00 0.00 0.00 175.10 178.57 1n1c n GLN 126 N 4.24 2.06 -3.51 2.72 7.27 -0.57 -4.97 117.38 124.63 1n1c n GLN 126 Ca -0.17 0.73 -0.14 0.00 0.07 0.00 0.00 57.00 57.50 1n1c n GLN 126 Cb 0.52 -2.36 -0.04 0.00 2.41 0.00 0.00 30.24 30.76 1n1c n GLN 126 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 1n1c s SER 127 N 0.11 -0.53 0.00 1.69 0.15 -1.26 -4.93 113.70 108.92 1n1c s SER 127 Ca 0.64 0.38 0.23 0.00 0.70 0.00 0.00 55.95 57.90 1n1c s SER 127 Cb -0.62 0.48 0.08 0.00 -1.71 0.00 0.00 66.02 64.24 1n1c s SER 127 CO 0.53 -0.64 1.15 1.41 1.20 0.00 0.00 173.24 176.90 1n1c n HIS 128 N 0.40 0.00 -2.40 3.44 8.25 -1.26 -4.95 115.22 118.70 1n1c n HIS 128 Ca -0.15 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 56.95 1n1c n HIS 128 Cb 0.60 -0.01 -0.02 0.00 1.12 0.00 0.00 29.99 31.68 1n1c n HIS 128 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1n1c s PHE 129 N -2.42 2.98 0.57 4.41 2.99 -1.26 -5.01 117.98 120.23 1n1c s PHE 129 Ca 0.20 1.58 -0.16 0.00 0.00 0.00 0.00 56.93 58.55 1n1c s PHE 129 Cb 0.18 -3.23 -0.05 0.00 0.00 0.00 0.00 43.02 39.92 1n1c s PHE 129 CO 0.53 -1.13 1.02 -1.25 -0.00 0.00 0.00 175.22 174.40 1n1c s PRO 130 N -2.84 3.59 0.31 0.24 0.04 -1.26 -4.99 135.00 130.10 1n1c s PRO 130 Ca 0.64 1.06 -0.29 0.00 0.04 0.00 0.00 61.00 62.45 1n1c s PRO 130 Cb -0.24 -2.08 -0.10 0.00 0.04 0.00 0.00 34.50 32.12 1n1c s PRO 130 CO 0.28 -0.58 1.36 -1.21 0.04 0.00 0.00 177.00 176.90 1n1c s GLU 131 N -4.18 4.30 0.27 4.56 0.41 -1.26 -4.93 118.70 117.88 1n1c s GLU 131 Ca 0.61 2.28 -0.01 0.00 -0.41 0.00 0.00 54.97 57.44 1n1c s GLU 131 Cb -0.13 -3.07 0.45 0.00 -1.78 0.00 0.00 34.13 29.60 1n1c s GLU 131 CO 0.36 -0.29 1.87 -1.35 -0.49 0.00 0.00 175.26 175.36 1n1c h PRO 132 N 3.77 1.10 0.00 0.39 0.11 -1.99 -0.80 132.00 134.58 1n1c h PRO 132 Ca -0.48 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1n1c h PRO 132 Cb 1.23 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1n1c h PRO 132 CO 0.68 0.73 0.00 0.00 -0.21 0.00 0.00 178.00 179.20 1n1c h ALA 133 N 1.48 1.00 0.00 -0.75 0.00 -1.99 -2.10 119.26 116.90 1n1c h ALA 133 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.36 1n1c h ALA 133 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1n1c h ALA 133 CO -0.20 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 178.80 1n1c n ASP 134 N -2.32 0.47 -4.71 0.00 8.00 -0.31 -4.81 116.55 112.87 1n1c n ASP 134 Ca 0.01 0.55 -0.42 0.00 0.71 0.00 0.00 54.79 55.65 1n1c n ASP 134 Cb 0.20 -0.68 -0.03 0.00 -0.02 0.00 0.00 41.12 40.60 1n1c n ASP 134 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 1n1c s HIS 135 N -3.08 2.95 0.35 1.24 2.46 -0.79 -4.91 115.29 113.51 1n1c s HIS 135 Ca 0.11 0.71 0.11 0.00 0.47 0.00 0.00 55.06 56.46 1n1c s HIS 135 Cb 0.14 -3.80 0.89 0.00 -0.13 0.00 0.00 32.58 29.68 1n1c s HIS 135 CO 0.53 -2.98 1.81 1.25 -2.47 0.00 0.00 174.74 172.88 1n1c h LEU 136 N 7.45 0.62 -1.45 8.88 5.85 -1.89 -0.49 115.31 134.28 1n1c h LEU 136 Ca -0.42 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.34 1n1c h LEU 136 Cb 1.20 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.18 1n1c h LEU 136 CO 0.90 0.23 -0.01 0.00 -0.34 0.00 0.00 178.44 179.22 1n1c h ALA 137 N 1.62 1.55 0.00 1.25 0.00 -1.95 -0.66 119.26 121.08 1n1c h ALA 137 Ca 0.53 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1n1c h ALA 137 Cb 1.02 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1n1c h ALA 137 CO -0.29 0.33 0.00 0.28 0.00 0.00 0.00 179.25 179.57 1n1c n VAL 138 N -4.34 0.91 0.00 0.00 0.31 -0.19 -2.18 118.33 112.84 1n1c n VAL 138 Ca 0.00 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1n1c n VAL 138 Cb 0.21 -0.96 0.00 0.00 -0.91 0.00 0.00 33.84 32.18 1n1c n VAL 138 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1n1c n LEU 140 N 0.61 0.00 -0.11 7.52 4.77 -0.25 -1.23 117.00 128.30 1n1c n LEU 140 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 1n1c n LEU 140 Cb 0.44 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.59 1n1c n LEU 140 CO 0.00 0.00 0.70 0.00 -1.33 0.00 0.00 177.39 176.76 1n1c h ALA 141 N 0.00 0.82 0.00 -1.18 0.00 -1.68 -0.42 119.26 116.80 1n1c h ALA 141 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1n1c h ALA 141 Cb 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1n1c h ALA 141 CO 0.00 0.65 0.00 0.98 0.00 0.00 0.00 179.25 180.88 1n1c n TYR 142 N -4.11 0.00 0.00 0.00 -0.00 -0.37 -1.80 117.16 110.88 1n1c n TYR 142 Ca 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 57.90 57.80 1n1c n TYR 142 Cb 0.44 -0.11 0.00 0.00 -0.00 0.00 0.00 39.34 39.67 1n1c n TYR 142 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1n1c n ALA 144 N 0.71 0.00 -0.01 2.98 0.00 -0.17 -0.98 120.51 123.04 1n1c n ALA 144 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1n1c n ALA 144 Cb 0.12 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.51 1n1c n ALA 144 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1n1c h HIS 145 N 0.00 0.13 -0.79 0.00 6.17 -1.62 -2.83 115.15 116.21 1n1c h HIS 145 Ca 0.00 -0.00 0.07 0.00 0.71 0.00 0.00 60.37 61.15 1n1c h HIS 145 Cb 0.00 -0.04 -0.05 0.00 2.52 0.00 0.00 27.41 29.84 1n1c h HIS 145 CO 0.00 0.18 0.52 -0.07 0.71 0.00 0.00 177.93 179.26 1n1c h LEU 146 N 0.05 0.73 -1.32 0.26 3.38 -1.35 -2.32 115.31 114.74 1n1c h LEU 146 Ca 0.03 0.01 0.28 0.00 0.09 0.00 0.00 57.88 58.29 1n1c h LEU 146 Cb 0.09 -0.15 -0.10 0.00 0.09 0.00 0.00 40.66 40.59 1n1c h LEU 146 CO -0.00 0.46 0.68 0.00 0.09 0.00 0.00 178.44 179.67 1n1c n HIS 149 N 0.30 0.52 -3.46 0.00 8.25 -0.92 -5.09 115.22 114.82 1n1c n HIS 149 Ca 0.03 -1.20 -0.13 0.00 -0.26 0.00 0.00 57.72 56.17 1n1c n HIS 149 Cb 0.15 -0.20 -0.03 0.00 1.12 0.00 0.00 29.99 31.03 1n1c n HIS 149 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1n1c s SER 150 N -2.77 -0.56 0.54 0.41 0.15 -0.90 -4.88 113.70 105.69 1n1c s SER 150 Ca 0.34 0.12 -0.19 0.00 0.70 0.00 0.00 55.95 56.92 1n1c s SER 150 Cb 0.37 0.58 -0.06 0.00 -1.71 0.00 0.00 66.02 65.20 1n1c s SER 150 CO -0.11 -0.89 1.09 -1.61 1.20 0.00 0.00 173.24 172.93 1n1c s GLU 151 N -3.24 3.44 0.42 5.44 0.41 -1.26 -4.87 118.70 119.03 1n1c s GLU 151 Ca -0.01 1.48 0.19 0.00 -0.41 0.00 0.00 54.97 56.22 1n1c s GLU 151 Cb -0.01 -2.03 1.11 0.00 -1.78 0.00 0.00 34.13 31.43 1n1c s GLU 151 CO -0.08 -0.76 1.82 -0.91 -0.49 0.00 0.00 175.26 174.84 1n1c h ASN 152 N 1.14 0.41 0.45 -0.19 2.35 -1.97 -0.29 115.58 117.48 1n1c h ASN 152 Ca -0.49 0.06 -0.11 0.00 -0.55 0.00 0.00 56.30 55.20 1n1c h ASN 152 Cb 1.24 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 39.59 1n1c h ASN 152 CO 0.57 0.13 -0.51 0.77 -1.65 0.00 0.00 177.43 176.74 1n1c h SER 153 N 0.39 0.08 0.18 5.81 4.64 -1.93 -0.43 113.55 122.29 1n1c h SER 153 Ca 0.53 -0.04 -0.16 0.00 -0.47 0.00 0.00 61.79 61.65 1n1c h SER 153 Cb 1.36 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.42 1n1c h SER 153 CO -0.22 0.57 -0.62 0.58 -0.87 0.00 0.00 176.83 176.28 1n1c h VAL 154 N 0.06 1.35 -0.18 0.95 2.07 -1.41 -0.67 116.25 118.42 1n1c h VAL 154 Ca -0.00 -1.94 -0.07 0.00 0.82 0.00 0.00 66.70 65.51 1n1c h VAL 154 Cb 0.92 1.93 -0.00 0.00 -1.52 0.00 0.00 31.29 32.62 1n1c h VAL 154 CO 0.07 0.59 -0.15 1.56 0.02 0.00 0.00 177.57 179.66 1n1c h GLN 155 N 0.31 0.41 0.02 1.57 4.20 -1.23 -1.82 115.11 118.57 1n1c h GLN 155 Ca -0.01 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.49 1n1c h GLN 155 Cb 1.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.94 1n1c h GLN 155 CO 0.11 0.76 -0.01 1.25 -0.67 0.00 0.00 178.83 180.27 1n1c h LEU 156 N 0.07 -0.02 -0.38 1.46 5.85 -1.05 -1.72 115.31 119.53 1n1c h LEU 156 Ca 0.03 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.81 1n1c h LEU 156 Cb 0.67 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.64 1n1c h LEU 156 CO 0.04 0.00 -0.02 -1.28 -0.34 0.00 0.00 178.44 176.84 1n1c h SER 157 N -0.04 -0.19 -0.75 1.25 0.87 -1.10 -1.07 113.55 112.52 1n1c h SER 157 Ca -0.00 0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 60.63 1n1c h SER 157 Cb 0.03 0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 62.12 1n1c h SER 157 CO 0.00 -0.06 0.40 0.15 -0.53 0.00 0.00 176.83 176.80 1n1c h PHE 158 N 0.08 1.06 0.10 2.24 3.04 -1.14 -0.28 116.94 122.03 1n1c h PHE 158 Ca 0.18 -0.03 -0.00 0.00 3.98 0.00 0.00 57.97 62.10 1n1c h PHE 158 Cb 0.26 -0.34 0.00 0.00 2.56 0.00 0.00 35.95 38.44 1n1c h PHE 158 CO -0.27 0.75 -0.05 -0.07 -2.02 0.00 0.00 178.31 176.65 1n1c h LEU 159 N 1.08 -0.11 -0.63 0.59 3.38 -0.42 -0.13 115.31 119.07 1n1c h LEU 159 Ca 0.27 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1n1c h LEU 159 Cb 0.05 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1n1c h LEU 159 CO -0.04 0.21 0.28 1.56 0.09 0.00 0.00 178.44 180.54 1n1c h GLN 160 N -0.44 0.92 0.07 1.13 4.20 -1.16 0.81 115.11 120.64 1n1c h GLN 160 Ca -0.01 -0.15 -0.00 0.00 0.06 0.00 0.00 58.65 58.55 1n1c h GLN 160 Cb 0.37 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.99 1n1c h GLN 160 CO 0.02 0.75 -0.03 1.15 -0.67 0.00 0.00 178.83 180.05 1n1c h THR 161 N 0.87 1.21 0.00 -0.54 2.02 -1.05 -3.28 112.91 112.14 1n1c h THR 161 Ca 0.21 -1.37 0.00 0.00 0.77 0.00 0.00 66.41 66.03 1n1c h THR 161 Cb 0.15 2.05 0.00 0.00 -1.74 0.00 0.00 68.15 68.61 1n1c h THR 161 CO -0.02 0.32 -1.75 0.00 0.37 0.00 0.00 175.52 174.44 1n1c n VAL 163 N -2.07 1.00 0.25 0.00 0.31 -0.90 -4.68 118.33 112.24 1n1c n VAL 163 Ca -0.02 0.27 0.17 0.00 -0.01 0.00 0.00 64.34 64.75 1n1c n VAL 163 Cb 0.49 -1.74 0.89 0.00 -0.91 0.00 0.00 33.84 32.57 1n1c n VAL 163 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 1n1c h ASN 164 N -0.32 0.00 0.87 4.52 -0.73 -1.05 -1.76 115.58 117.10 1n1c h ASN 164 Ca 0.00 0.00 -0.08 0.00 1.87 0.00 0.00 56.30 58.09 1n1c h ASN 164 Cb 0.32 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.90 1n1c h ASN 164 CO 0.00 0.00 -0.36 0.77 -0.37 0.00 0.00 177.43 177.47 1n1c h SER 165 N 0.00 0.00 0.00 1.15 4.64 -1.75 -3.38 113.55 114.21 1n1c h SER 165 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1n1c h SER 165 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1n1c h SER 165 CO 0.00 0.36 0.00 -2.67 -0.87 0.00 0.00 176.83 173.65 1n1c n TRP 166 N -3.51 0.00 -0.35 4.77 4.27 -0.97 -4.88 117.44 116.77 1n1c n TRP 166 Ca -0.00 0.00 0.05 0.00 -3.89 0.00 0.00 57.50 53.66 1n1c n TRP 166 Cb 0.51 0.00 0.22 0.00 -1.36 0.00 0.00 31.31 30.68 1n1c n TRP 166 CO 0.00 0.00 0.00 1.25 -2.29 0.00 0.00 177.69 176.65 1n1c h LEU 167 N 0.00 0.95 -0.73 5.67 5.85 -1.51 -2.19 115.31 123.36 1n1c h LEU 167 Ca 0.00 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.65 1n1c h LEU 167 Cb 0.07 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1n1c h LEU 167 CO 0.00 0.56 -0.10 0.00 -0.34 0.00 0.00 178.44 178.56 1n1c h ALA 168 N 1.51 0.92 -0.50 1.25 0.00 -1.86 0.14 119.26 120.71 1n1c h ALA 168 Ca 0.46 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1n1c h ALA 168 Cb 0.34 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1n1c h ALA 168 CO -0.21 0.63 0.31 0.87 0.00 0.00 0.00 179.25 180.85 1n1c h LYS 169 N 0.79 0.67 -0.19 0.00 1.57 -1.77 -0.87 116.57 116.76 1n1c h LYS 169 Ca 0.13 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1n1c h LYS 169 Cb 0.61 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 1n1c h LYS 169 CO 0.04 0.47 0.10 0.35 -0.57 0.00 0.00 179.45 179.85 1n1c h PHE 170 N 0.67 0.27 -0.49 -1.35 3.04 -0.98 -2.50 116.94 115.60 1n1c h PHE 170 Ca 0.18 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.13 1n1c h PHE 170 Cb -0.03 -0.09 -0.02 0.00 2.56 0.00 0.00 35.95 38.37 1n1c h PHE 170 CO -0.03 0.25 0.32 0.82 -2.02 0.00 0.00 178.31 177.65 1n1c h ILE 171 N 0.21 1.13 -0.25 1.41 2.04 -0.44 0.99 117.51 122.59 1n1c h ILE 171 Ca 0.07 -0.25 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 1n1c h ILE 171 Cb 0.08 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 1n1c h ILE 171 CO -0.01 0.13 0.04 -1.13 0.00 0.00 0.00 178.15 177.18 1n1c h ASN 172 N 0.67 0.40 -0.28 1.72 -1.24 -0.82 -0.09 115.58 115.95 1n1c h ASN 172 Ca 0.18 -0.26 -0.15 0.00 0.71 0.00 0.00 56.30 56.78 1n1c h ASN 172 Cb -0.07 -0.11 -0.00 0.00 0.73 0.00 0.00 38.32 38.88 1n1c h ASN 172 CO -0.04 0.55 -0.42 -0.74 -1.29 0.00 0.00 177.43 175.50 1n1c h HIS 173 N 0.23 0.96 -0.32 0.67 2.76 -1.05 -2.93 115.15 115.48 1n1c h HIS 173 Ca 0.08 -0.32 0.03 0.00 -2.20 0.00 0.00 60.37 57.96 1n1c h HIS 173 Cb 0.32 -0.19 -0.03 0.00 1.55 0.00 0.00 27.41 29.06 1n1c h HIS 173 CO 0.02 1.11 0.11 1.25 -1.30 0.00 0.00 177.93 179.13 1n1c h LEU 174 N 0.53 0.13 -2.17 0.26 5.85 -0.74 -1.12 115.31 118.05 1n1c h LEU 174 Ca 0.03 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.82 1n1c h LEU 174 Cb 1.01 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 1n1c h LEU 174 CO 0.10 0.11 0.14 0.74 -0.34 0.00 0.00 178.44 179.19 1n1c h THR 175 N 0.26 0.67 0.00 1.05 2.02 -0.95 -0.74 112.91 115.22 1n1c h THR 175 Ca 0.14 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.21 1n1c h THR 175 Cb 0.10 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 1n1c h THR 175 CO -0.14 0.00 -0.54 1.56 0.37 0.00 0.00 175.52 176.77 1n1c h GLN 176 N 0.00 0.00 0.00 6.66 4.20 -1.02 -3.34 115.11 121.60 1n1c h GLN 176 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1n1c h GLN 176 Cb 0.36 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.14 1n1c h GLN 176 CO -0.00 0.54 -1.27 0.00 -0.67 0.00 0.00 178.83 177.43 1n1c s ASN 178 N -3.30 6.69 0.10 0.00 3.04 -0.38 -4.91 114.94 116.18 1n1c s ASN 178 Ca 0.01 -2.24 -0.26 0.00 0.04 0.00 0.00 52.86 50.41 1n1c s ASN 178 Cb 0.13 -2.37 -0.12 0.00 -1.54 0.00 0.00 41.25 37.35 1n1c s ASN 178 CO 0.75 -0.95 1.68 0.07 -3.04 0.00 0.00 177.10 175.61 1n1c h LYS 179 N 8.52 -0.35 -0.43 0.43 5.09 -1.88 -3.08 116.57 124.87 1n1c h LYS 179 Ca 0.16 0.02 -0.14 0.00 0.09 0.00 0.00 60.65 60.78 1n1c h LYS 179 Cb 1.01 0.08 -0.01 0.00 0.10 0.00 0.00 32.23 33.41 1n1c h LYS 179 CO 1.06 -0.23 -0.28 -0.91 -2.09 0.00 0.00 179.45 176.99 1n1c h ASN 180 N -0.36 0.97 0.00 7.07 4.21 -2.00 -3.48 115.58 121.99 1n1c h ASN 180 Ca -0.00 -0.39 0.00 0.00 1.21 0.00 0.00 56.30 57.11 1n1c h ASN 180 Cb 0.34 -0.27 0.00 0.00 -1.12 0.00 0.00 38.32 37.27 1n1c h ASN 180 CO -0.03 1.18 0.00 0.61 -1.29 0.00 0.00 177.43 177.90 1n1c n GLY 181 N -0.04 0.85 0.09 2.83 0.00 -1.17 -5.01 105.19 102.74 1n1c n GLY 181 Ca -0.01 -0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 1n1c n GLY 181 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1n1c h PHE 182 N 0.00 0.19 0.00 1.61 3.04 -1.93 -2.58 116.94 117.27 1n1c h PHE 182 Ca 0.00 -0.07 -0.05 0.00 3.98 0.00 0.00 57.97 61.83 1n1c h PHE 182 Cb 0.00 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 38.47 1n1c h PHE 182 CO 0.00 0.67 -0.26 1.88 -2.02 0.00 0.00 178.31 178.58 1n1c h TYR 183 N -0.34 0.00 -0.20 0.41 0.05 -1.96 -1.71 116.97 113.21 1n1c h TYR 183 Ca 0.00 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.64 1n1c h TYR 183 Cb 0.65 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.39 1n1c h TYR 183 CO 0.11 0.26 -0.47 0.77 -1.05 0.00 0.00 178.16 177.78 1n1c h SER 184 N 0.00 0.57 -0.05 3.88 0.02 -1.89 -0.48 113.55 115.59 1n1c h SER 184 Ca -0.00 -0.27 -0.11 0.00 -0.84 0.00 0.00 61.79 60.56 1n1c h SER 184 Cb 0.72 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.08 1n1c h SER 184 CO 0.03 0.95 -0.32 0.00 -1.14 0.00 0.00 176.83 176.35 1n1c h ALA 185 N 1.07 0.98 -0.12 3.77 0.00 -0.97 0.24 119.26 124.23 1n1c h ALA 185 Ca 0.02 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 1n1c h ALA 185 Cb 0.98 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 1n1c h ALA 185 CO 0.09 0.60 -0.09 0.28 0.00 0.00 0.00 179.25 180.13 1n1c h VAL 186 N 0.44 1.34 -0.74 0.00 2.07 -1.01 -1.12 116.25 117.23 1n1c h VAL 186 Ca 0.05 -1.18 -0.02 0.00 0.82 0.00 0.00 66.70 66.37 1n1c h VAL 186 Cb 0.78 1.86 -0.03 0.00 -1.52 0.00 0.00 31.29 32.37 1n1c h VAL 186 CO 0.06 0.34 0.37 0.00 0.02 0.00 0.00 177.57 178.36 1n1c h ALA 187 N 0.62 0.95 -0.55 1.67 0.00 -0.91 -0.31 119.26 120.74 1n1c h ALA 187 Ca 0.02 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1n1c h ALA 187 Cb 0.58 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1n1c h ALA 187 CO 0.02 0.50 0.21 1.15 0.00 0.00 0.00 179.25 181.13 1n1c h THR 188 N 1.03 1.22 -0.27 0.00 2.02 -0.49 -1.93 112.91 114.49 1n1c h THR 188 Ca 0.25 -0.72 -0.09 0.00 0.77 0.00 0.00 66.41 66.62 1n1c h THR 188 Cb 0.10 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 1n1c h THR 188 CO -0.03 0.27 -0.24 0.25 0.37 0.00 0.00 175.52 176.14 1n1c h LEU 189 N 0.75 0.51 -0.01 2.58 5.85 -0.90 -2.40 115.31 121.69 1n1c h LEU 189 Ca 0.18 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1n1c h LEU 189 Cb 0.22 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 1n1c h LEU 189 CO -0.01 0.74 0.00 0.74 -0.34 0.00 0.00 178.44 179.57 1n1c h THR 190 N 0.45 1.11 -0.45 1.05 2.02 -0.64 -0.58 112.91 115.87 1n1c h THR 190 Ca 0.07 -0.31 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 1n1c h THR 190 Cb 0.66 1.31 -0.02 0.00 -1.74 0.00 0.00 68.15 68.35 1n1c h THR 190 CO 0.05 0.08 0.26 0.25 0.37 0.00 0.00 175.52 176.53 1n1c h LEU 191 N -0.12 0.55 -1.71 2.58 6.46 -1.28 0.70 115.31 122.50 1n1c h LEU 191 Ca 0.00 -0.07 -0.04 0.00 -0.12 0.00 0.00 57.88 57.65 1n1c h LEU 191 Cb 0.13 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 39.92 1n1c h LEU 191 CO -0.00 0.47 -0.17 0.00 -0.62 0.00 0.00 178.44 178.11 1n1c h ALA 192 N 1.11 1.56 -0.03 1.25 0.00 -1.35 0.11 119.26 121.91 1n1c h ALA 192 Ca 0.16 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 1n1c h ALA 192 Cb 0.02 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.80 1n1c h ALA 192 CO -0.03 0.22 -0.55 2.35 0.00 0.00 0.00 179.25 181.24 1n1c h TRP 193 N 0.00 0.60 -0.49 0.00 2.91 -0.31 -2.66 115.95 116.01 1n1c h TRP 193 Ca -0.00 -0.31 -0.02 0.00 1.13 0.00 0.00 58.89 59.69 1n1c h TRP 193 Cb 0.34 -0.08 -0.02 0.00 -0.51 0.00 0.00 29.16 28.89 1n1c h TRP 193 CO 0.00 1.11 0.23 0.28 -1.03 0.00 0.00 178.44 179.04 1n1c h VAL 194 N -0.08 1.19 -0.26 2.65 2.07 -0.33 -1.39 116.25 120.10 1n1c h VAL 194 Ca -0.06 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 66.90 1n1c h VAL 194 Cb 1.25 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 1n1c h VAL 194 CO 0.11 0.21 0.12 0.11 0.02 0.00 0.00 177.57 178.14 1n1c h LYS 195 N 0.64 0.38 -0.41 1.57 1.57 -0.86 -0.25 116.57 119.21 1n1c h LYS 195 Ca 0.17 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 1n1c h LYS 195 Cb 0.12 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 1n1c h LYS 195 CO -0.02 0.39 0.16 0.37 -0.57 0.00 0.00 179.45 179.79 1n1c h GLN 196 N 0.28 0.58 -0.32 3.15 4.15 -1.39 -1.18 115.11 120.37 1n1c h GLN 196 Ca 0.09 -0.07 -0.16 0.00 0.77 0.00 0.00 58.65 59.28 1n1c h GLN 196 Cb 0.15 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.72 1n1c h GLN 196 CO -0.01 0.48 -0.42 0.22 -1.93 0.00 0.00 178.83 177.17 1n1c h ASP 197 N 0.57 0.86 0.05 -0.69 3.58 -0.83 -2.37 116.42 117.60 1n1c h ASP 197 Ca 0.14 -0.40 -0.10 0.00 0.42 0.00 0.00 57.03 57.09 1n1c h ASP 197 Cb 0.12 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 40.91 1n1c h ASP 197 CO -0.01 1.16 -0.30 0.40 -2.88 0.00 0.00 179.24 177.60 1n1c h ILE 198 N 0.65 1.27 -0.01 2.25 2.04 -0.59 0.01 117.51 123.14 1n1c h ILE 198 Ca 0.05 -1.33 -0.06 0.00 1.00 0.00 0.00 64.86 64.52 1n1c h ILE 198 Cb 0.98 1.46 -0.01 0.00 -0.74 0.00 0.00 36.82 38.52 1n1c h ILE 198 CO 0.09 0.41 -0.29 0.00 0.00 0.00 0.00 178.15 178.36 1n1c h ALA 199 N 1.35 1.50 0.17 1.87 0.00 -0.94 -1.65 119.26 121.56 1n1c h ALA 199 Ca 0.04 -0.27 -0.34 0.00 0.00 0.00 0.00 54.91 54.34 1n1c h ALA 199 Cb 0.70 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1n1c h ALA 199 CO 0.05 0.38 -1.71 1.96 0.00 0.00 0.00 179.25 179.93 1n1c h GLN 200 N 0.02 0.36 -0.43 0.00 1.08 -0.97 -3.39 115.11 111.79 1n1c h GLN 200 Ca 0.00 -0.61 -0.03 0.00 -1.45 0.00 0.00 58.65 56.56 1n1c h GLN 200 Cb 0.53 0.23 -0.02 0.00 -0.05 0.00 0.00 27.48 28.16 1n1c h GLN 200 CO 0.04 1.26 0.14 -0.07 -0.95 0.00 0.00 178.83 179.25 1n1c h LEU 201 N 0.10 0.62 0.04 1.46 3.38 -0.78 -3.04 115.31 117.09 1n1c h LEU 201 Ca -0.32 -0.20 0.03 0.00 0.09 0.00 0.00 57.88 57.47 1n1c h LEU 201 Cb 2.08 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 42.62 1n1c h LEU 201 CO 0.17 0.66 -0.31 -0.33 0.09 0.00 0.00 178.44 178.72 1n1c h GLU 202 N 0.55 -0.47 -0.72 1.13 5.08 -1.49 0.71 114.58 119.38 1n1c h GLU 202 Ca 0.14 0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.55 1n1c h GLU 202 Cb 0.26 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.57 1n1c h GLU 202 CO -0.01 -0.31 0.47 -1.35 -1.00 0.00 0.00 179.01 176.81 1n1c h PRO 203 N -0.49 0.91 -0.92 2.33 0.11 -1.75 -0.31 132.00 131.87 1n1c h PRO 203 Ca 0.05 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 66.12 1n1c h PRO 203 Cb 0.55 -0.20 -0.05 0.00 0.11 0.00 0.00 31.00 31.41 1n1c h PRO 203 CO -0.23 0.60 0.61 0.00 -0.21 0.00 0.00 178.00 178.77 1n1c h ALA 204 N 1.29 1.17 -0.00 -0.75 0.00 -1.32 -2.74 119.26 116.91 1n1c h ALA 204 Ca 0.28 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1n1c h ALA 204 Cb -0.05 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.37 1n1c h ALA 204 CO -0.08 0.56 -0.03 0.28 0.00 0.00 0.00 179.25 179.98 1n1c h VAL 205 N 1.25 1.56 -1.03 0.00 2.07 -0.43 -3.32 116.25 116.35 1n1c h VAL 205 Ca 0.34 -1.68 0.26 0.00 0.82 0.00 0.00 66.70 66.44 1n1c h VAL 205 Cb -0.14 2.68 -0.11 0.00 -1.52 0.00 0.00 31.29 32.20 1n1c h VAL 205 CO -0.08 0.44 0.63 0.00 0.02 0.00 0.00 177.57 178.58 1n1c h ALA 206 N 0.30 1.99 0.00 1.67 0.00 -1.01 -1.14 119.26 121.07 1n1c h ALA 206 Ca -0.00 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1n1c h ALA 206 Cb 0.73 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 1n1c h ALA 206 CO 0.01 -0.44 -0.01 0.82 0.00 0.00 0.00 179.25 179.62 1n1c h ILE 207 N 0.49 0.42 0.00 0.00 2.04 -1.58 -2.68 117.51 116.20 1n1c h ILE 207 Ca 0.63 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 66.44 1n1c h ILE 207 Cb 1.38 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 38.49 1n1c h ILE 207 CO -0.41 0.01 0.00 2.30 0.00 0.00 0.00 178.15 180.05 1n1c n ILE 208 N -3.67 0.05 1.44 -0.67 -5.35 -0.43 -2.40 119.36 108.33 1n1c n ILE 208 Ca -0.03 0.01 0.14 0.00 -0.27 0.00 0.00 62.75 62.60 1n1c n ILE 208 Cb 0.10 -0.57 0.49 0.00 -1.74 0.00 0.00 39.64 37.92 1n1c n ILE 208 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1n1c n SER 209 N -1.11 1.37 -0.63 7.28 3.41 -1.01 -5.18 113.62 117.74 1n1c n SER 209 Ca 0.18 -1.34 0.13 0.00 -0.26 0.00 0.00 58.87 57.58 1n1c n SER 209 Cb 0.14 0.03 0.39 0.00 -0.26 0.00 0.00 64.21 64.51 1n1c n SER 209 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06