#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h3c s LYS 2 N 0.00 0.42 -0.27 0.03 -0.14 -1.26 -5.15 119.74 113.38 2h3c s LYS 2 Ca 0.00 0.21 -0.03 0.00 -1.36 0.00 0.00 55.97 54.78 2h3c s LYS 2 Cb 0.00 0.20 0.02 0.00 -1.68 0.00 0.00 37.83 36.37 2h3c s LYS 2 CO 0.00 -0.08 -0.01 -1.14 -0.76 0.00 0.00 175.35 173.36 2h3c s GLN 3 N -0.30 2.88 -0.61 1.68 0.74 -1.26 -5.06 119.66 117.73 2h3c s GLN 3 Ca -0.04 -0.97 -0.28 0.00 0.05 0.00 0.00 55.36 54.12 2h3c s GLN 3 Cb -0.03 -3.13 0.03 0.00 1.10 0.00 0.00 33.01 30.97 2h3c s GLN 3 CO 0.01 -0.44 1.24 0.50 -0.55 0.00 0.00 175.29 176.06 2h3c s ARG 4 N 1.38 3.42 -0.17 1.67 3.52 -1.26 -4.97 118.95 122.53 2h3c s ARG 4 Ca 0.00 0.17 -0.04 0.00 -0.13 0.00 0.00 55.73 55.74 2h3c s ARG 4 Cb -0.17 -4.07 -0.02 0.00 -1.56 0.00 0.00 34.95 29.13 2h3c s ARG 4 CO -0.02 -1.82 -0.03 0.96 -0.81 0.00 0.00 175.30 173.58 2h3c s ILE 5 N 5.28 3.82 0.00 4.11 -4.36 -1.26 -5.10 121.20 123.70 2h3c s ILE 5 Ca 0.43 -0.37 0.03 0.00 -0.26 0.00 0.00 60.65 60.47 2h3c s ILE 5 Cb -0.08 -2.69 -0.01 0.00 1.25 0.00 0.00 42.46 40.93 2h3c s ILE 5 CO 0.23 0.47 -0.10 0.28 0.24 0.00 0.00 174.94 176.07 2h3c s THR 6 N 0.60 0.75 -0.51 8.37 -1.32 -1.26 -5.10 115.64 117.17 2h3c s THR 6 Ca -0.02 -0.54 -0.16 0.00 -1.21 0.00 0.00 61.69 59.76 2h3c s THR 6 Cb -0.14 -0.66 0.10 0.00 -1.51 0.00 0.00 72.50 70.29 2h3c s THR 6 CO 0.02 0.12 0.48 -0.69 -2.21 0.00 0.00 174.62 172.34 2h3c s VAL 7 N -0.41 5.18 -1.06 5.08 1.01 -1.26 -4.98 120.40 123.96 2h3c s VAL 7 Ca 0.02 -1.24 -0.22 0.00 0.00 0.00 0.00 61.98 60.53 2h3c s VAL 7 Cb -0.05 -4.26 -0.11 0.00 0.00 0.00 0.00 36.38 31.97 2h3c s VAL 7 CO -0.00 -0.76 1.92 0.35 0.00 0.00 0.00 175.10 176.61 2h3c n THR 8 N 5.27 1.93 0.00 3.92 -2.24 -1.26 -4.76 114.28 117.14 2h3c n THR 8 Ca -0.13 -1.92 0.00 0.00 -2.27 0.00 0.00 64.05 59.73 2h3c n THR 8 Cb 0.42 -2.22 0.00 0.00 -2.10 0.00 0.00 70.33 66.43 2h3c n THR 8 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2h3c n VAL 9 N 7.22 0.00 -0.35 2.28 3.14 -1.26 -4.99 118.33 124.37 2h3c n VAL 9 Ca 0.46 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.84 2h3c n VAL 9 Cb 0.45 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.23 2h3c n VAL 9 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2h3c n ASP 10 N 0.00 -0.60 0.01 6.55 2.03 -1.26 -4.87 116.55 118.41 2h3c n ASP 10 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2h3c n ASP 10 Cb 0.00 -0.13 0.00 0.00 -0.72 0.00 0.00 41.12 40.27 2h3c n ASP 10 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 2h3c n SER 11 N 0.52 -0.11 -1.84 1.67 2.88 -1.26 -4.94 113.62 110.55 2h3c n SER 11 Ca 0.00 0.03 -0.07 0.00 -1.33 0.00 0.00 58.87 57.50 2h3c n SER 11 Cb 0.05 0.35 -0.10 0.00 -0.75 0.00 0.00 64.21 63.76 2h3c n SER 11 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2h3c n ASP 12 N -2.55 5.06 0.00 -3.46 9.92 -1.26 -4.74 116.55 119.53 2h3c n ASP 12 Ca 0.00 -2.41 0.00 0.00 -0.53 0.00 0.00 54.79 51.85 2h3c n ASP 12 Cb 0.00 -1.26 0.00 0.00 -0.64 0.00 0.00 41.12 39.22 2h3c n ASP 12 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2h3c n SER 13 N 2.15 -4.86 0.07 -2.24 7.64 -1.26 -4.90 113.62 110.22 2h3c n SER 13 Ca 0.26 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 60.01 2h3c n SER 13 Cb 0.73 -2.46 -0.07 0.00 -1.01 0.00 0.00 64.21 61.40 2h3c n SER 13 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 2h3c h TYR 14 N 0.00 -0.09 -1.08 1.43 3.20 -1.95 -2.88 116.97 115.60 2h3c h TYR 14 Ca 0.00 -0.00 0.30 0.00 3.14 0.00 0.00 58.73 62.17 2h3c h TYR 14 Cb 0.64 0.03 -0.06 0.00 1.54 0.00 0.00 36.73 38.88 2h3c h TYR 14 CO 0.41 -0.02 0.75 1.96 -1.64 0.00 0.00 178.16 179.61 2h3c h GLN 15 N -0.14 0.15 0.50 1.82 1.08 -1.94 -2.60 115.11 113.98 2h3c h GLN 15 Ca -0.01 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.16 2h3c h GLN 15 Cb 0.11 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.51 2h3c h GLN 15 CO 0.02 0.10 -0.24 -0.07 -0.95 0.00 0.00 178.83 177.68 2h3c h LEU 16 N 0.15 -0.57 -0.33 1.46 3.38 -1.91 0.14 115.31 117.63 2h3c h LEU 16 Ca 0.55 -0.06 0.07 0.00 0.09 0.00 0.00 57.88 58.52 2h3c h LEU 16 Cb 1.88 0.15 -0.08 0.00 0.09 0.00 0.00 40.66 42.69 2h3c h LEU 16 CO -0.12 -0.25 -0.39 -0.07 0.09 0.00 0.00 178.44 177.70 2h3c h LEU 17 N -0.92 -1.28 -1.30 1.67 -0.00 -1.54 0.20 115.31 112.15 2h3c h LEU 17 Ca -0.07 0.20 -0.06 0.00 -0.00 0.00 0.00 57.88 57.95 2h3c h LEU 17 Cb 0.60 0.56 -0.01 0.00 -0.00 0.00 0.00 40.66 41.81 2h3c h LEU 17 CO 0.11 -0.37 -0.28 0.07 -0.00 0.00 0.00 178.44 177.98 2h3c h LYS 18 N -0.35 0.00 0.00 1.13 2.10 -1.56 -2.25 116.57 115.65 2h3c h LYS 18 Ca 0.13 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.72 2h3c h LYS 18 Cb 0.58 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.90 2h3c h LYS 18 CO -0.51 0.28 -0.31 0.00 -2.00 0.00 0.00 179.45 176.90 2h3c h ALA 19 N 1.72 1.17 0.14 0.07 0.00 0.14 -3.06 119.26 119.44 2h3c h ALA 19 Ca -0.00 -0.28 -0.35 0.00 0.00 0.00 0.00 54.91 54.28 2h3c h ALA 19 Cb 0.67 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2h3c h ALA 19 CO 0.04 0.38 -1.81 0.10 0.00 0.00 0.00 179.25 177.96 2h3c h TYR 20 N 0.00 0.53 0.00 0.00 -0.00 -0.26 -3.48 116.97 113.77 2h3c h TYR 20 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 58.73 58.34 2h3c h TYR 20 Cb 0.69 -0.02 0.00 0.00 0.00 0.00 0.00 36.73 37.40 2h3c h TYR 20 CO 0.00 1.63 0.00 -0.25 -0.00 0.00 0.00 178.16 179.54 2h3c n ASP 21 N -3.49 0.00 -3.20 0.10 8.00 -0.95 -5.11 116.55 111.90 2h3c n ASP 21 Ca -0.26 0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.07 2h3c n ASP 21 Cb 1.06 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 42.10 2h3c n ASP 21 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2h3c s VAL 22 N 0.00 -0.23 -0.36 2.53 1.01 -0.89 -4.88 120.40 117.58 2h3c s VAL 22 Ca 0.00 -1.72 -0.12 0.00 0.00 0.00 0.00 61.98 60.14 2h3c s VAL 22 Cb 0.00 -0.73 -0.12 0.00 0.00 0.00 0.00 36.38 35.53 2h3c s VAL 22 CO 0.00 -0.71 1.56 0.59 0.00 0.00 0.00 175.10 176.55 2h3c n ASN 23 N 3.26 1.90 0.00 3.32 4.13 -1.26 -3.19 115.26 123.42 2h3c n ASN 23 Ca 0.21 -2.30 0.00 0.00 1.68 0.00 0.00 54.58 54.17 2h3c n ASN 23 Cb 0.49 -0.76 0.00 0.00 -1.54 0.00 0.00 39.78 37.98 2h3c n ASN 23 CO 0.00 0.00 0.00 2.30 0.28 0.00 0.00 177.26 179.84 2h3c n ILE 24 N 5.39 0.00 -0.32 2.41 -6.64 -1.26 -4.70 119.36 114.24 2h3c n ILE 24 Ca 0.30 0.00 -0.08 0.00 -1.77 0.00 0.00 62.75 61.19 2h3c n ILE 24 Cb 0.19 0.00 -0.08 0.00 -1.44 0.00 0.00 39.64 38.31 2h3c n ILE 24 CO 0.00 0.00 0.00 -0.24 -1.77 0.00 0.00 176.55 174.54 2h3c n SER 25 N 0.00 -0.80 0.10 7.28 2.88 -1.26 0.20 113.62 122.01 2h3c n SER 25 Ca 0.00 1.50 -0.17 0.00 -1.33 0.00 0.00 58.87 58.87 2h3c n SER 25 Cb 0.00 -0.25 -0.12 0.00 -0.75 0.00 0.00 64.21 63.09 2h3c n SER 25 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 2h3c h GLY 26 N 0.00 0.41 0.55 0.46 0.00 -1.92 -2.98 103.07 99.59 2h3c h GLY 26 Ca 0.12 -0.95 -0.02 0.00 0.00 0.00 0.00 47.33 46.48 2h3c h GLY 26 CO -0.71 0.83 -0.41 -2.00 0.00 0.00 0.00 176.54 174.25 2h3c h LEU 27 N 0.13 -1.08 0.02 3.11 5.85 -1.43 0.56 115.31 122.46 2h3c h LEU 27 Ca -0.14 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.66 2h3c h LEU 27 Cb 1.90 0.34 -0.03 0.00 0.37 0.00 0.00 40.66 43.24 2h3c h LEU 27 CO 0.21 -0.59 -0.30 0.58 -0.34 0.00 0.00 178.44 178.00 2h3c h VAL 28 N -0.92 0.00 -0.75 1.05 2.07 0.20 0.80 116.25 118.70 2h3c h VAL 28 Ca -0.07 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.61 2h3c h VAL 28 Cb 0.76 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.43 2h3c h VAL 28 CO 0.02 0.00 0.21 0.77 0.02 0.00 0.00 177.57 178.59 2h3c h SER 29 N -0.38 0.07 -0.26 0.57 4.64 -1.50 1.54 113.55 118.22 2h3c h SER 29 Ca 0.00 0.14 -0.12 0.00 -0.47 0.00 0.00 61.79 61.35 2h3c h SER 29 Cb 0.40 0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.67 2h3c h SER 29 CO -0.19 -0.02 -0.29 0.00 -0.87 0.00 0.00 176.83 175.46 2h3c h THR 30 N 0.30 1.31 -0.66 2.95 1.03 0.47 -2.77 112.91 115.54 2h3c h THR 30 Ca 0.43 -1.47 -0.01 0.00 -0.01 0.00 0.00 66.41 65.34 2h3c h THR 30 Cb 0.73 1.65 -0.03 0.00 -1.07 0.00 0.00 68.15 69.43 2h3c h THR 30 CO -0.50 0.47 0.37 0.74 -0.01 0.00 0.00 175.52 176.58 2h3c h THR 31 N 0.39 1.21 -0.45 0.00 2.02 0.22 -2.58 112.91 113.71 2h3c h THR 31 Ca 0.04 -0.51 0.09 0.00 0.77 0.00 0.00 66.41 66.80 2h3c h THR 31 Cb 0.87 0.34 -0.09 0.00 -1.74 0.00 0.00 68.15 67.53 2h3c h THR 31 CO 0.07 0.22 -0.15 0.24 0.37 0.00 0.00 175.52 176.28 2h3c h MET 32 N 0.90 -0.05 -0.45 6.66 2.86 0.23 0.91 114.93 126.00 2h3c h MET 32 Ca 0.23 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.87 2h3c h MET 32 Cb 0.03 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 2h3c h MET 32 CO -0.04 -0.03 0.25 0.37 1.06 0.00 0.00 176.91 178.52 2h3c h GLN 33 N -0.05 0.62 0.21 1.72 5.75 -1.23 1.92 115.11 124.05 2h3c h GLN 33 Ca 0.22 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.64 2h3c h GLN 33 Cb 0.38 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.81 2h3c h GLN 33 CO -0.49 0.48 -0.10 -0.97 -2.65 0.00 0.00 178.83 175.10 2h3c h ASN 34 N 0.59 -0.24 -0.62 -0.69 -1.24 -0.92 0.42 115.58 112.87 2h3c h ASN 34 Ca 0.16 -0.13 -0.02 0.00 0.71 0.00 0.00 56.30 57.02 2h3c h ASN 34 Cb 0.04 0.06 -0.03 0.00 0.73 0.00 0.00 38.32 39.12 2h3c h ASN 34 CO -0.03 -0.01 0.33 -0.08 -1.29 0.00 0.00 177.43 176.35 2h3c h GLU 35 N -0.48 0.90 -0.55 6.67 4.57 0.99 0.65 114.58 127.33 2h3c h GLU 35 Ca -0.03 -0.11 -0.10 0.00 -1.18 0.00 0.00 59.36 57.95 2h3c h GLU 35 Cb 0.36 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 2h3c h GLU 35 CO 0.05 0.68 -0.04 0.00 -1.18 0.00 0.00 179.01 178.52 2h3c h ALA 36 N 1.46 0.90 0.21 2.92 0.00 0.33 2.74 119.26 127.82 2h3c h ALA 36 Ca 0.23 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2h3c h ALA 36 Cb 0.06 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2h3c h ALA 36 CO -0.03 0.65 -0.10 0.00 0.00 0.00 0.00 179.25 179.76 2h3c h ARG 37 N 0.89 -0.27 0.14 0.00 3.08 0.61 -3.36 114.38 115.46 2h3c h ARG 37 Ca 0.15 0.02 -0.29 0.00 0.07 0.00 0.00 59.98 59.94 2h3c h ARG 37 Cb 0.57 0.06 0.01 0.00 0.08 0.00 0.00 29.97 30.69 2h3c h ARG 37 CO 0.03 0.08 -1.26 -0.09 -1.07 0.00 0.00 179.97 177.66 2h3c h ARG 38 N -0.94 0.38 0.00 0.04 9.65 0.24 -3.47 114.38 120.28 2h3c h ARG 38 Ca -0.03 -0.60 0.00 0.00 -1.10 0.00 0.00 59.98 58.25 2h3c h ARG 38 Cb 0.48 0.22 0.00 0.00 -1.39 0.00 0.00 29.97 29.27 2h3c h ARG 38 CO 0.05 1.27 0.00 1.28 2.80 0.00 0.00 179.97 185.37 2h3c n LEU 39 N -3.62 0.00 -1.73 3.80 4.77 0.92 -4.75 117.00 116.38 2h3c n LEU 39 Ca -0.11 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.67 2h3c n LEU 39 Cb 1.02 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 42.03 2h3c n LEU 39 CO 0.56 0.00 -0.21 -1.14 -1.33 0.00 0.00 177.39 175.26 2h3c n ARG 40 N 0.00 -1.48 -0.55 3.23 0.63 -1.26 -4.70 116.66 112.52 2h3c n ARG 40 Ca 0.00 1.19 0.07 0.00 -0.92 0.00 0.00 57.85 58.19 2h3c n ARG 40 Cb 0.00 -5.62 -0.03 0.00 0.45 0.00 0.00 32.46 27.25 2h3c n ARG 40 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2h3c n ALA 41 N 0.78 -1.45 -1.97 5.13 0.00 -1.26 -5.00 120.51 116.74 2h3c n ALA 41 Ca -0.21 0.34 -0.22 0.00 0.00 0.00 0.00 53.44 53.35 2h3c n ALA 41 Cb 0.68 -0.60 0.06 0.00 0.00 0.00 0.00 19.45 19.60 2h3c n ALA 41 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2h3c s GLU 42 N -3.29 2.28 -0.05 0.00 1.03 -1.26 -5.11 118.70 112.30 2h3c s GLU 42 Ca 0.00 -0.83 0.07 0.00 0.03 0.00 0.00 54.97 54.24 2h3c s GLU 42 Cb 0.00 -2.42 -0.01 0.00 -0.80 0.00 0.00 34.13 30.90 2h3c s GLU 42 CO 0.00 -0.96 -0.25 -0.98 -1.33 0.00 0.00 175.26 171.74 2h3c s ARG 43 N -4.91 2.42 0.59 -4.83 1.04 -1.26 -5.13 118.95 106.87 2h3c s ARG 43 Ca 0.60 -0.90 -0.15 0.00 -1.04 0.00 0.00 55.73 54.24 2h3c s ARG 43 Cb -0.09 -2.14 -0.04 0.00 -2.04 0.00 0.00 34.95 30.64 2h3c s ARG 43 CO 0.41 0.45 1.04 -0.46 -0.04 0.00 0.00 175.30 176.69 2h3c s TRP 44 N -0.33 3.20 -0.00 5.89 -0.00 -1.26 -4.95 118.94 121.49 2h3c s TRP 44 Ca 0.01 1.46 -0.34 0.00 -0.00 0.00 0.00 56.10 57.24 2h3c s TRP 44 Cb -0.12 -2.90 -0.12 0.00 -0.00 0.00 0.00 33.47 30.32 2h3c s TRP 44 CO 0.02 -0.89 1.79 1.17 -0.00 0.00 0.00 176.95 179.04 2h3c n LYS 45 N -2.17 2.22 -3.98 5.86 3.00 -1.26 -4.98 118.16 116.86 2h3c n LYS 45 Ca 0.08 0.81 -0.24 0.00 -0.00 0.00 0.00 58.31 58.96 2h3c n LYS 45 Cb 0.53 -2.64 -0.03 0.00 0.00 0.00 0.00 35.03 32.90 2h3c n LYS 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 2h3c s VAL 46 N 3.08 5.18 0.45 3.15 -7.23 -1.26 -5.09 120.40 118.68 2h3c s VAL 46 Ca 0.88 -0.87 -0.23 0.00 -1.81 0.00 0.00 61.98 59.95 2h3c s VAL 46 Cb -0.67 -3.73 -0.08 0.00 0.56 0.00 0.00 36.38 32.46 2h3c s VAL 46 CO 0.47 -0.20 1.12 -1.61 -0.31 0.00 0.00 175.10 174.57 2h3c s GLU 47 N -3.54 3.85 0.02 4.82 8.01 -1.26 -4.81 118.70 125.80 2h3c s GLU 47 Ca 0.34 1.66 0.00 0.00 0.01 0.00 0.00 54.97 56.98 2h3c s GLU 47 Cb -0.10 -2.40 0.00 0.00 -4.31 0.00 0.00 34.13 27.32 2h3c s GLU 47 CO 0.28 -0.44 0.00 0.27 0.01 0.00 0.00 175.26 175.38 2h3c n ASN 48 N -0.45 -0.17 -2.58 -0.19 0.23 -1.26 -4.99 115.26 105.84 2h3c n ASN 48 Ca 0.07 0.16 -0.09 0.00 -0.53 0.00 0.00 54.58 54.19 2h3c n ASN 48 Cb 0.49 0.33 0.04 0.00 -2.08 0.00 0.00 39.78 38.56 2h3c n ASN 48 CO 0.00 0.00 0.00 1.67 -0.93 0.00 0.00 177.26 178.00 2h3c n GLN 49 N -2.35 -1.48 -3.68 -3.83 7.27 -1.26 -3.68 117.38 108.36 2h3c n GLN 49 Ca 0.00 0.54 -0.26 0.00 0.07 0.00 0.00 57.00 57.35 2h3c n GLN 49 Cb 0.00 -4.21 0.06 0.00 2.41 0.00 0.00 30.24 28.50 2h3c n GLN 49 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 2h3c n GLU 50 N -2.59 -6.96 0.00 3.69 4.71 -1.26 -4.94 120.64 113.30 2h3c n GLU 50 Ca -0.05 0.75 0.00 0.00 -0.01 0.00 0.00 57.16 57.85 2h3c n GLU 50 Cb 0.58 -5.74 0.00 0.00 -1.01 0.00 0.00 31.44 25.27 2h3c n GLU 50 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2h3c n GLY 51 N -1.88 0.83 3.33 0.62 0.00 -1.24 -5.06 105.19 101.79 2h3c n GLY 51 Ca 0.02 -0.83 -0.17 0.00 0.00 0.00 0.00 46.02 45.05 2h3c n GLY 51 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2h3c n MET 52 N -0.21 -1.83 -3.57 1.61 2.81 -1.26 -4.54 117.12 110.12 2h3c n MET 52 Ca 0.00 0.88 -0.14 0.00 -1.81 0.00 0.00 57.70 56.62 2h3c n MET 52 Cb 0.00 -5.33 -0.06 0.00 -0.71 0.00 0.00 33.22 27.12 2h3c n MET 52 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2h3c s VAL 53 N -3.33 0.00 0.06 2.03 0.11 -1.26 -4.83 120.40 113.19 2h3c s VAL 53 Ca 0.38 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.43 2h3c s VAL 53 Cb -0.07 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.78 2h3c s VAL 53 CO 0.77 0.00 0.00 -1.84 -3.33 0.00 0.00 175.10 170.70 2h3c n GLU 54 N 1.37 -0.55 0.00 1.54 0.28 -1.26 -4.99 120.64 117.03 2h3c n GLU 54 Ca -0.15 0.36 0.00 0.00 -0.16 0.00 0.00 57.16 57.21 2h3c n GLU 54 Cb 0.57 -0.67 0.00 0.00 1.43 0.00 0.00 31.44 32.76 2h3c n GLU 54 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 2h3c n VAL 55 N -1.50 0.00 -2.04 3.84 0.31 -1.26 -5.16 118.33 112.52 2h3c n VAL 55 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2h3c n VAL 55 Cb 0.13 -0.02 0.00 0.00 -0.91 0.00 0.00 33.84 33.04 2h3c n VAL 55 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2h3c n ALA 56 N -2.21 -2.02 -3.64 3.52 0.00 -1.26 -5.08 120.51 109.82 2h3c n ALA 56 Ca 0.00 0.49 -0.05 0.00 0.00 0.00 0.00 53.44 53.88 2h3c n ALA 56 Cb 0.00 -1.48 -0.06 0.00 0.00 0.00 0.00 19.45 17.91 2h3c n ALA 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2h3c s ARG 57 N -1.02 0.24 0.00 0.00 6.06 -1.26 -5.00 118.95 117.97 2h3c s ARG 57 Ca 0.00 0.21 0.00 0.00 -2.50 0.00 0.00 55.73 53.44 2h3c s ARG 57 Cb 0.00 0.11 0.00 0.00 0.06 0.00 0.00 34.95 35.12 2h3c s ARG 57 CO 0.00 -0.04 0.00 0.34 -2.50 0.00 0.00 175.30 173.10 2h3c n PHE 58 N 1.47 0.00 -2.32 5.12 7.35 -1.26 -4.89 117.46 122.94 2h3c n PHE 58 Ca -0.09 0.00 -0.42 0.00 -0.76 0.00 0.00 57.45 56.18 2h3c n PHE 58 Cb 0.57 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.37 2h3c n PHE 58 CO 0.00 0.00 0.00 0.96 -0.76 0.00 0.00 176.76 176.96 2h3c s ILE 59 N 0.00 3.87 0.07 -2.13 -4.36 -1.26 -5.03 121.20 112.36 2h3c s ILE 59 Ca 0.00 1.28 0.02 0.00 -0.26 0.00 0.00 60.65 61.68 2h3c s ILE 59 Cb 0.00 -3.82 -0.04 0.00 1.25 0.00 0.00 42.46 39.85 2h3c s ILE 59 CO 0.00 0.03 0.13 -1.61 0.24 0.00 0.00 174.94 173.73 2h3c s GLU 60 N 1.94 3.11 0.00 0.37 8.01 -1.26 -4.97 118.70 125.90 2h3c s GLU 60 Ca 0.61 -0.58 0.00 0.00 0.01 0.00 0.00 54.97 55.01 2h3c s GLU 60 Cb -0.30 -2.86 0.00 0.00 -4.31 0.00 0.00 34.13 26.66 2h3c s GLU 60 CO 0.26 0.59 0.00 -0.12 0.01 0.00 0.00 175.26 176.00 2h3c n MET 61 N 0.43 1.04 -0.83 1.61 1.56 -1.26 -5.05 117.12 114.61 2h3c n MET 61 Ca -0.07 0.00 -0.33 0.00 -0.27 0.00 0.00 57.70 57.02 2h3c n MET 61 Cb 0.51 -0.93 0.12 0.00 2.15 0.00 0.00 33.22 35.08 2h3c n MET 61 CO 0.00 0.00 0.00 0.27 -0.73 0.00 0.00 175.97 175.51 2h3c n ASN 62 N -1.31 -1.82 0.00 6.12 0.23 -1.26 -4.62 115.26 112.60 2h3c n ASN 62 Ca 0.00 0.36 0.00 0.00 -0.53 0.00 0.00 54.58 54.41 2h3c n ASN 62 Cb 0.03 -1.23 0.00 0.00 -2.08 0.00 0.00 39.78 36.50 2h3c n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2h3c n GLY 63 N 1.42 0.08 3.83 4.83 0.00 -1.26 -5.06 105.19 109.03 2h3c n GLY 63 Ca 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.09 2h3c n GLY 63 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2h3c n SER 64 N 0.00 -1.52 -1.05 1.61 3.41 -1.26 -5.00 113.62 109.81 2h3c n SER 64 Ca 0.00 -1.66 -0.10 0.00 -0.26 0.00 0.00 58.87 56.85 2h3c n SER 64 Cb 0.00 2.43 -0.01 0.00 -0.26 0.00 0.00 64.21 66.37 2h3c n SER 64 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2h3c n PHE 65 N -0.78 -0.38 -1.86 7.33 3.72 -1.26 -3.13 117.46 121.09 2h3c n PHE 65 Ca 0.00 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.26 2h3c n PHE 65 Cb 0.57 -2.31 -0.04 0.00 -0.94 0.00 0.00 39.48 36.77 2h3c n PHE 65 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2h3c n ALA 66 N -0.99 -0.45 -2.74 4.37 0.00 -1.26 -4.72 120.51 114.72 2h3c n ALA 66 Ca -0.11 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2h3c n ALA 66 Cb 0.54 -1.55 0.00 0.00 0.00 0.00 0.00 19.45 18.43 2h3c n ALA 66 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2h3c n ASP 67 N -1.16 1.29 -3.60 0.00 2.03 -1.18 -4.96 116.55 108.97 2h3c n ASP 67 Ca -0.15 0.00 -0.09 0.00 0.52 0.00 0.00 54.79 55.07 2h3c n ASP 67 Cb 0.54 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.88 2h3c n ASP 67 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 2h3c s GLU 68 N 4.43 0.50 0.00 -0.67 -1.05 -1.26 -3.99 118.70 116.66 2h3c s GLU 68 Ca 0.00 0.20 0.00 0.00 -0.15 0.00 0.00 54.97 55.02 2h3c s GLU 68 Cb 0.00 0.24 0.00 0.00 -0.44 0.00 0.00 34.13 33.93 2h3c s GLU 68 CO 0.00 -0.14 0.00 -1.71 0.95 0.00 0.00 175.26 174.36 2h3c n ASN 69 N 0.96 0.00 -5.00 0.83 2.85 -1.26 -4.95 115.26 108.70 2h3c n ASN 69 Ca -0.09 0.00 -0.18 0.00 -0.11 0.00 0.00 54.58 54.19 2h3c n ASN 69 Cb 0.58 0.00 0.02 0.00 1.24 0.00 0.00 39.78 41.61 2h3c n ASN 69 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 2h3c s LYS 70 N 0.50 2.64 -0.05 1.20 1.02 -1.26 -4.78 119.74 119.01 2h3c s LYS 70 Ca 0.00 -1.40 0.02 0.00 0.02 0.00 0.00 55.97 54.60 2h3c s LYS 70 Cb 0.00 -2.67 -0.04 0.00 -0.52 0.00 0.00 37.83 34.60 2h3c s LYS 70 CO 0.00 -0.43 -0.02 -0.40 -0.92 0.00 0.00 175.35 173.58 2h3c n ASP 71 N -1.92 3.70 -0.20 2.83 5.68 -1.26 -4.91 116.55 120.48 2h3c n ASP 71 Ca 0.09 -0.02 0.15 0.00 -0.50 0.00 0.00 54.79 54.52 2h3c n ASP 71 Cb 0.60 0.20 0.77 0.00 -1.14 0.00 0.00 41.12 41.55 2h3c n ASP 71 CO 0.00 0.00 0.00 1.87 -1.33 0.00 0.00 177.20 177.74