#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h3c n LYS 2 N 0.00 0.00 -4.16 0.03 4.76 -1.26 -4.85 118.16 112.68 2h3c n LYS 2 Ca 0.00 0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 55.28 2h3c n LYS 2 Cb 0.00 0.00 -0.15 0.00 -1.84 0.00 0.00 35.03 33.04 2h3c n LYS 2 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 2h3c s GLN 3 N 0.00 0.47 -0.78 1.97 2.00 -1.26 -5.09 119.66 116.97 2h3c s GLN 3 Ca 0.00 -0.17 -0.25 0.00 -2.00 0.00 0.00 55.36 52.93 2h3c s GLN 3 Cb 0.00 -0.46 0.04 0.00 0.80 0.00 0.00 33.01 33.39 2h3c s GLN 3 CO 0.00 0.09 1.25 0.50 -0.50 0.00 0.00 175.29 176.63 2h3c s ARG 4 N 0.02 3.25 -0.42 1.67 3.52 -1.26 -4.95 118.95 120.78 2h3c s ARG 4 Ca 0.00 -0.53 -0.17 0.00 -0.13 0.00 0.00 55.73 54.91 2h3c s ARG 4 Cb -0.04 -4.40 0.02 0.00 -1.56 0.00 0.00 34.95 28.98 2h3c s ARG 4 CO -0.00 -2.09 0.41 0.96 -0.81 0.00 0.00 175.30 173.76 2h3c s ILE 5 N 5.25 5.13 -0.18 4.11 -4.36 -1.26 -5.03 121.20 124.86 2h3c s ILE 5 Ca 0.35 -0.47 -0.00 0.00 -0.26 0.00 0.00 60.65 60.26 2h3c s ILE 5 Cb -0.08 -4.02 0.01 0.00 1.25 0.00 0.00 42.46 39.61 2h3c s ILE 5 CO 0.09 -0.42 -0.15 0.28 0.24 0.00 0.00 174.94 174.99 2h3c s THR 6 N 2.01 2.56 -0.52 8.37 -1.32 -1.26 -5.06 115.64 120.42 2h3c s THR 6 Ca 0.10 -0.78 -0.16 0.00 -1.21 0.00 0.00 61.69 59.63 2h3c s THR 6 Cb -0.18 -2.10 0.10 0.00 -1.51 0.00 0.00 72.50 68.81 2h3c s THR 6 CO 0.12 0.50 0.49 -0.69 -2.21 0.00 0.00 174.62 172.84 2h3c s VAL 7 N 1.20 5.15 -0.76 5.08 1.01 -1.26 -4.96 120.40 125.86 2h3c s VAL 7 Ca 0.02 -1.19 -0.18 0.00 0.00 0.00 0.00 61.98 60.64 2h3c s VAL 7 Cb -0.14 -4.27 -0.14 0.00 0.00 0.00 0.00 36.38 31.84 2h3c s VAL 7 CO -0.07 -0.77 1.94 0.35 0.00 0.00 0.00 175.10 176.55 2h3c n THR 8 N 5.29 1.87 0.00 3.92 -2.24 -1.26 -4.63 114.28 117.23 2h3c n THR 8 Ca -0.12 -1.47 0.00 0.00 -2.27 0.00 0.00 64.05 60.19 2h3c n THR 8 Cb 0.42 -2.25 0.00 0.00 -2.10 0.00 0.00 70.33 66.41 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 5.58 0.00 0.00 2.28 3.14 -1.26 -4.82 118.33 123.25 2h3c n VAL 9 Ca 0.47 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.85 2h3c n VAL 9 Cb 0.33 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.11 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 0.00 0.00 6.55 2.03 -1.26 -4.36 116.55 119.51 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 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 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 2.18 0.00 0.37 1.67 2.88 -1.26 -3.13 113.62 116.33 2h3c n SER 11 Ca 0.00 0.82 -0.15 0.00 -1.33 0.00 0.00 58.87 58.21 2h3c n SER 11 Cb 0.00 -0.41 -0.07 0.00 -0.75 0.00 0.00 64.21 62.99 2h3c n SER 11 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 2h3c h ASP 12 N 0.00 -0.80 0.00 -3.46 5.19 -1.95 -3.47 116.42 111.93 2h3c h ASP 12 Ca 0.00 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.44 2h3c h ASP 12 Cb 0.00 0.21 0.00 0.00 0.18 0.00 0.00 39.33 39.72 2h3c h ASP 12 CO 0.00 -0.50 0.00 -1.20 -3.12 0.00 0.00 179.24 174.42 2h3c n SER 13 N -4.98 0.00 -0.07 6.45 7.64 -1.18 -5.06 113.62 116.42 2h3c n SER 13 Ca -0.12 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.62 2h3c n SER 13 Cb 0.37 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.45 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 0.00 -1.01 1.43 3.20 -1.92 -3.35 116.97 115.32 2h3c h TYR 14 Ca 0.00 0.00 0.29 0.00 3.14 0.00 0.00 58.73 62.16 2h3c h TYR 14 Cb 0.00 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.23 2h3c h TYR 14 CO 0.00 1.01 0.73 1.96 -1.64 0.00 0.00 178.16 180.22 2h3c h GLN 15 N -1.00 0.01 0.49 1.82 1.08 -1.97 -2.20 115.11 113.34 2h3c h GLN 15 Ca -0.04 -0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.14 2h3c h GLN 15 Cb 0.99 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.40 2h3c h GLN 15 CO -0.03 0.01 -0.47 -0.07 -0.95 0.00 0.00 178.83 177.32 2h3c h LEU 16 N 0.01 -1.28 -0.14 1.46 3.38 -1.95 0.89 115.31 117.68 2h3c h LEU 16 Ca 0.48 0.10 0.04 0.00 0.09 0.00 0.00 57.88 58.59 2h3c h LEU 16 Cb 1.92 0.42 -0.04 0.00 0.09 0.00 0.00 40.66 43.05 2h3c h LEU 16 CO -0.01 -0.64 -0.12 -0.07 0.09 0.00 0.00 178.44 177.70 2h3c h LEU 17 N -0.96 -0.37 -0.93 1.67 -0.00 -1.60 -2.06 115.31 111.05 2h3c h LEU 17 Ca -0.06 0.08 -0.08 0.00 -0.00 0.00 0.00 57.88 57.83 2h3c h LEU 17 Cb 0.84 0.19 -0.01 0.00 -0.00 0.00 0.00 40.66 41.67 2h3c h LEU 17 CO -0.05 -0.16 -0.36 0.07 -0.00 0.00 0.00 178.44 177.94 2h3c h LYS 18 N -0.13 0.00 -0.14 1.13 2.10 -1.52 -1.62 116.57 116.39 2h3c h LYS 18 Ca 0.09 0.00 0.04 0.00 -2.00 0.00 0.00 60.65 58.78 2h3c h LYS 18 Cb 0.27 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.59 2h3c h LYS 18 CO -0.22 0.36 0.11 0.00 -2.00 0.00 0.00 179.45 177.70 2h3c h ALA 19 N 1.64 2.03 0.12 0.07 0.00 0.16 -1.98 119.26 121.29 2h3c h ALA 19 Ca -0.00 -0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.58 2h3c h ALA 19 Cb 0.89 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2h3c h ALA 19 CO 0.05 -0.18 -1.70 1.88 0.00 0.00 0.00 179.25 179.29 2h3c h TYR 20 N 0.00 0.46 0.00 0.00 0.05 -1.34 -3.49 116.97 112.66 2h3c h TYR 20 Ca 0.07 -0.34 0.00 0.00 0.05 0.00 0.00 58.73 58.51 2h3c h TYR 20 Cb 0.29 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.01 2h3c h TYR 20 CO 0.00 1.67 0.00 -0.25 -1.05 0.00 0.00 178.16 178.53 2h3c n ASP 21 N -3.74 0.00 -3.99 3.88 9.92 -0.74 -4.57 116.55 117.31 2h3c n ASP 21 Ca -0.29 0.00 -0.43 0.00 -0.53 0.00 0.00 54.79 53.54 2h3c n ASP 21 Cb 0.97 0.00 0.01 0.00 -0.64 0.00 0.00 41.12 41.46 2h3c n ASP 21 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2h3c n VAL 22 N 0.00 4.73 -0.06 2.53 0.31 -0.63 -4.88 118.33 120.33 2h3c n VAL 22 Ca 0.00 -5.07 -0.01 0.00 -0.01 0.00 0.00 64.34 59.26 2h3c n VAL 22 Cb 0.00 -2.27 -0.01 0.00 -0.91 0.00 0.00 33.84 30.65 2h3c n VAL 22 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2h3c n ASN 23 N 2.97 0.38 0.00 4.52 3.02 -1.26 -3.56 115.26 121.32 2h3c n ASN 23 Ca 0.33 -1.44 0.00 0.00 -0.03 0.00 0.00 54.58 53.44 2h3c n ASN 23 Cb 0.36 -0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 2h3c n ASN 23 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 2h3c n ILE 24 N 2.69 0.00 -0.36 2.41 -6.64 -1.26 -4.71 119.36 111.48 2h3c n ILE 24 Ca 0.02 0.00 -0.05 0.00 -1.77 0.00 0.00 62.75 60.95 2h3c n ILE 24 Cb 0.06 -0.00 -0.01 0.00 -1.44 0.00 0.00 39.64 38.25 2h3c n ILE 24 CO 0.00 0.00 0.00 0.77 -1.77 0.00 0.00 176.55 175.55 2h3c h SER 25 N 0.00 -1.63 0.72 7.28 4.64 -1.98 0.38 113.55 122.96 2h3c h SER 25 Ca 0.00 0.31 -0.22 0.00 -0.47 0.00 0.00 61.79 61.40 2h3c h SER 25 Cb 0.00 0.80 -0.04 0.00 -0.31 0.00 0.00 62.40 62.85 2h3c h SER 25 CO 0.00 -0.28 -1.41 1.23 -0.87 0.00 0.00 176.83 175.50 2h3c h GLY 26 N -0.04 0.00 0.48 -0.77 0.00 -1.95 -3.22 103.07 97.58 2h3c h GLY 26 Ca 0.27 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.58 2h3c h GLY 26 CO -0.93 0.00 -0.23 -2.00 0.00 0.00 0.00 176.54 173.38 2h3c h LEU 27 N 0.00 -0.54 0.12 3.11 6.46 -1.55 0.16 115.31 123.07 2h3c h LEU 27 Ca -0.18 0.02 0.01 0.00 -0.12 0.00 0.00 57.88 57.61 2h3c h LEU 27 Cb 1.78 0.14 -0.04 0.00 -0.73 0.00 0.00 40.66 41.81 2h3c h LEU 27 CO 0.07 -0.34 -0.47 0.58 -0.62 0.00 0.00 178.44 177.66 2h3c h VAL 28 N -0.74 0.00 -0.82 1.05 2.07 -0.51 0.69 116.25 117.99 2h3c h VAL 28 Ca -0.07 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.69 2h3c h VAL 28 Cb 0.49 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 2h3c h VAL 28 CO 0.11 0.00 0.75 0.77 0.02 0.00 0.00 177.57 179.21 2h3c h SER 29 N -0.68 0.00 0.00 0.57 4.64 -1.63 1.75 113.55 118.21 2h3c h SER 29 Ca -0.01 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.26 2h3c h SER 29 Cb 0.68 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.76 2h3c h SER 29 CO -0.24 0.00 -0.33 0.74 -0.87 0.00 0.00 176.83 176.12 2h3c h THR 30 N 0.00 1.01 -0.17 2.95 2.02 0.16 -2.94 112.91 115.94 2h3c h THR 30 Ca 0.39 -1.87 0.04 0.00 0.77 0.00 0.00 66.41 65.74 2h3c h THR 30 Cb 1.88 2.02 -0.04 0.00 -1.74 0.00 0.00 68.15 70.27 2h3c h THR 30 CO -0.00 0.34 -0.10 0.74 0.37 0.00 0.00 175.52 176.87 2h3c h THR 31 N -1.00 0.70 -0.55 3.16 2.02 0.22 -1.48 112.91 115.98 2h3c h THR 31 Ca -0.08 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.21 2h3c h THR 31 Cb 0.79 0.70 -0.11 0.00 -1.74 0.00 0.00 68.15 67.80 2h3c h THR 31 CO -0.05 0.00 -0.14 0.24 0.37 0.00 0.00 175.52 175.94 2h3c h MET 32 N -0.09 -0.00 -0.24 6.66 2.86 0.24 0.10 114.93 124.46 2h3c h MET 32 Ca 0.10 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 2h3c h MET 32 Cb 0.23 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 2h3c h MET 32 CO -0.22 -0.00 0.13 -0.56 1.06 0.00 0.00 176.91 177.31 2h3c h GLN 33 N -0.01 0.34 0.28 1.72 3.07 -1.24 1.21 115.11 120.48 2h3c h GLN 33 Ca 0.26 -0.04 -0.00 0.00 0.09 0.00 0.00 58.65 58.96 2h3c h GLN 33 Cb 0.41 -0.06 -0.01 0.00 0.08 0.00 0.00 27.48 27.89 2h3c h GLN 33 CO -0.57 0.33 -0.21 -0.91 0.09 0.00 0.00 178.83 177.55 2h3c h ASN 34 N 0.27 -0.55 0.38 0.06 2.35 -0.33 0.92 115.58 118.68 2h3c h ASN 34 Ca 0.08 0.04 -0.10 0.00 -0.55 0.00 0.00 56.30 55.78 2h3c h ASN 34 Cb 0.09 0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 2h3c h ASN 34 CO -0.01 -0.33 -0.45 -0.33 -1.65 0.00 0.00 177.43 174.66 2h3c h GLU 35 N -0.49 0.09 -0.03 0.81 4.39 -0.77 0.80 114.58 119.37 2h3c h GLU 35 Ca -0.02 -0.04 -0.09 0.00 0.34 0.00 0.00 59.36 59.55 2h3c h GLU 35 Cb 0.43 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 2h3c h GLU 35 CO -0.01 0.53 -0.40 0.00 -1.16 0.00 0.00 179.01 177.96 2h3c h ALA 36 N 1.47 1.27 0.00 3.43 0.00 0.20 0.54 119.26 126.17 2h3c h ALA 36 Ca 0.00 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 2h3c h ALA 36 Cb 0.83 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2h3c h ALA 36 CO 0.06 0.53 -0.27 0.00 0.00 0.00 0.00 179.25 179.58 2h3c h ARG 37 N 0.06 0.00 0.00 0.00 2.47 0.15 -3.36 114.38 113.69 2h3c h ARG 37 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2h3c h ARG 37 Cb 0.74 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.06 2h3c h ARG 37 CO 0.06 0.78 0.00 -0.09 0.56 0.00 0.00 179.97 181.28 2h3c h ARG 38 N -1.00 0.00 -6.00 0.04 2.43 0.64 -3.46 114.38 107.02 2h3c h ARG 38 Ca -0.07 0.00 -0.66 0.00 -0.81 0.00 0.00 59.98 58.44 2h3c h ARG 38 Cb 0.87 0.00 0.12 0.00 -0.42 0.00 0.00 29.97 30.53 2h3c h ARG 38 CO -0.04 0.00 -0.57 1.47 -1.51 0.00 0.00 179.97 179.32 2h3c n LEU 39 N -2.88 -1.42 0.00 3.80 -0.00 0.19 -0.67 117.00 116.02 2h3c n LEU 39 Ca 0.01 1.09 0.00 0.00 -0.00 0.00 0.00 56.01 57.12 2h3c n LEU 39 Cb 0.30 -0.94 0.00 0.00 -0.00 0.00 0.00 43.42 42.77 2h3c n LEU 39 CO 0.26 -3.12 0.00 -1.14 -0.00 0.00 0.00 177.39 173.39 2h3c n ARG 40 N 1.04 0.00 -1.09 1.47 3.00 -1.26 -4.95 116.66 114.86 2h3c n ARG 40 Ca 0.17 0.00 -0.29 0.00 -0.00 0.00 0.00 57.85 57.73 2h3c n ARG 40 Cb 0.27 -0.20 0.18 0.00 0.00 0.00 0.00 32.46 32.70 2h3c n ARG 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2h3c s ALA 41 N 0.00 0.93 1.00 5.13 0.00 0.15 -5.05 121.76 123.92 2h3c s ALA 41 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 51.96 51.72 2h3c s ALA 41 Cb 0.00 -3.16 0.00 0.00 0.00 0.00 0.00 23.12 19.96 2h3c s ALA 41 CO 0.00 -2.85 0.00 0.39 0.00 0.00 0.00 175.76 173.30 2h3c n GLU 42 N -4.20 -0.72 -3.77 0.00 -0.58 -1.26 -5.01 120.64 105.10 2h3c n GLU 42 Ca 0.05 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.43 2h3c n GLU 42 Cb 0.56 0.00 -0.12 0.00 -0.57 0.00 0.00 31.44 31.31 2h3c n GLU 42 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 2h3c s ARG 43 N -2.37 3.77 -0.51 3.49 6.06 -1.26 -5.00 118.95 123.13 2h3c s ARG 43 Ca 0.00 -0.42 0.07 0.00 -2.50 0.00 0.00 55.73 52.88 2h3c s ARG 43 Cb 0.00 -3.38 0.27 0.00 0.06 0.00 0.00 34.95 31.90 2h3c s ARG 43 CO 0.00 -0.11 0.68 1.87 -2.50 0.00 0.00 175.30 175.24 2h3c n TRP 44 N 4.73 1.79 -4.05 5.12 -0.00 -1.26 -5.08 117.44 118.69 2h3c n TRP 44 Ca -0.16 -3.88 -0.08 0.00 -0.00 0.00 0.00 57.50 53.39 2h3c n TRP 44 Cb 0.52 -0.46 -0.09 0.00 -0.00 0.00 0.00 31.31 31.28 2h3c n TRP 44 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 177.69 176.10 2h3c s LYS 45 N -2.07 0.75 -0.30 5.87 0.00 -1.26 -5.17 119.74 117.56 2h3c s LYS 45 Ca 0.39 -1.21 -0.25 0.00 0.00 0.00 0.00 55.97 54.90 2h3c s LYS 45 Cb 0.19 0.25 0.20 0.00 0.00 0.00 0.00 37.83 38.47 2h3c s LYS 45 CO -0.07 -0.19 1.47 0.54 0.00 0.00 0.00 175.35 177.11 2h3c s VAL 46 N -3.94 0.00 -0.00 1.79 0.11 -1.26 -5.18 120.40 111.93 2h3c s VAL 46 Ca 0.11 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.18 2h3c s VAL 46 Cb 0.07 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.91 2h3c s VAL 46 CO -0.07 0.00 -0.09 -1.83 -3.33 0.00 0.00 175.10 169.77 2h3c s GLU 47 N 0.03 0.74 0.00 1.54 1.03 -1.26 -5.12 118.70 115.65 2h3c s GLU 47 Ca 0.08 -0.36 0.00 0.00 0.03 0.00 0.00 54.97 54.72 2h3c s GLU 47 Cb -0.05 -0.71 0.00 0.00 -0.80 0.00 0.00 34.13 32.57 2h3c s GLU 47 CO -0.16 0.19 0.00 -1.71 -1.33 0.00 0.00 175.26 172.25 2h3c n ASN 48 N 2.77 0.00 -1.32 0.83 4.05 -1.26 -5.15 115.26 115.17 2h3c n ASN 48 Ca -0.14 0.00 -0.00 0.00 0.45 0.00 0.00 54.58 54.89 2h3c n ASN 48 Cb 0.57 0.00 -0.00 0.00 1.23 0.00 0.00 39.78 41.58 2h3c n ASN 48 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2h3c n GLN 49 N 0.00 -1.05 -3.97 1.20 3.00 -1.26 -5.07 117.38 110.22 2h3c n GLN 49 Ca 0.00 1.16 -0.25 0.00 -0.01 0.00 0.00 57.00 57.90 2h3c n GLN 49 Cb 0.00 -1.41 -0.17 0.00 0.00 0.00 0.00 30.24 28.66 2h3c n GLN 49 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 2h3c s GLU 50 N -1.64 1.24 0.00 -1.09 2.02 -1.26 -5.10 118.70 112.87 2h3c s GLU 50 Ca -0.01 -0.16 0.00 0.00 0.02 0.00 0.00 54.97 54.82 2h3c s GLU 50 Cb 0.00 -1.34 0.00 0.00 0.10 0.00 0.00 34.13 32.89 2h3c s GLU 50 CO 0.02 -0.22 0.00 0.41 0.02 0.00 0.00 175.26 175.48 2h3c n GLY 51 N 4.78 1.41 0.00 -1.39 0.00 -1.26 -5.15 105.19 103.57 2h3c n GLY 51 Ca -0.13 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.65 2h3c n GLY 51 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2h3c n MET 52 N 0.00 0.00 -2.56 1.61 0.00 -1.26 -5.10 117.12 109.81 2h3c n MET 52 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 57.70 57.67 2h3c n MET 52 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 2h3c n MET 52 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2h3c n VAL 53 N 0.00 -9.90 -2.38 3.17 0.31 -1.26 -4.93 118.33 103.34 2h3c n VAL 53 Ca 0.00 1.13 -0.42 0.00 -0.01 0.00 0.00 64.34 65.04 2h3c n VAL 53 Cb 0.00 -6.58 -0.03 0.00 -0.91 0.00 0.00 33.84 26.33 2h3c n VAL 53 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2h3c s GLU 54 N -1.84 4.30 -0.33 5.55 -1.05 -1.26 -4.84 118.70 119.23 2h3c s GLU 54 Ca 0.10 1.75 0.16 0.00 -0.15 0.00 0.00 54.97 56.83 2h3c s GLU 54 Cb -0.03 -3.62 0.44 0.00 -0.44 0.00 0.00 34.13 30.48 2h3c s GLU 54 CO 0.64 -0.55 1.27 1.33 0.95 0.00 0.00 175.26 178.90 2h3c n VAL 55 N 4.82 0.54 -1.65 1.83 0.24 -1.26 -5.05 118.33 117.80 2h3c n VAL 55 Ca 0.12 -2.05 -0.29 0.00 -2.04 0.00 0.00 64.34 60.09 2h3c n VAL 55 Cb 0.45 1.02 -0.08 0.00 -1.47 0.00 0.00 33.84 33.76 2h3c n VAL 55 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2h3c n ALA 56 N -0.78 1.56 -0.00 2.33 0.00 -1.26 -4.47 120.51 117.88 2h3c n ALA 56 Ca -0.02 -2.84 -0.00 0.00 0.00 0.00 0.00 53.44 50.57 2h3c n ALA 56 Cb 0.84 -3.50 -0.00 0.00 0.00 0.00 0.00 19.45 16.79 2h3c n ALA 56 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2h3c n ARG 57 N 8.01 0.03 0.00 0.00 0.63 -1.26 -5.15 116.66 118.91 2h3c n ARG 57 Ca 0.45 0.01 0.00 0.00 -0.92 0.00 0.00 57.85 57.39 2h3c n ARG 57 Cb 0.45 -0.30 0.00 0.00 0.45 0.00 0.00 32.46 33.06 2h3c n ARG 57 CO 0.00 0.00 0.00 1.97 -2.51 0.00 0.00 177.63 177.09 2h3c n PHE 58 N -2.68 0.00 0.01 -0.14 1.16 -1.26 -5.10 117.46 109.44 2h3c n PHE 58 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.57 2h3c n PHE 58 Cb 0.03 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.90 2h3c n PHE 58 CO 0.00 0.00 0.00 1.51 -1.87 0.00 0.00 176.76 176.40 2h3c n ILE 59 N -0.17 0.00 -4.29 1.97 3.06 -1.26 -5.15 119.36 113.52 2h3c n ILE 59 Ca 0.00 0.00 -0.18 0.00 -2.50 0.00 0.00 62.75 60.07 2h3c n ILE 59 Cb 0.00 0.00 -0.13 0.00 0.54 0.00 0.00 39.64 40.05 2h3c n ILE 59 CO 0.00 0.00 0.00 -0.70 -2.50 0.00 0.00 176.55 173.35 2h3c s GLU 60 N -2.00 0.79 -0.88 9.51 2.56 -1.26 -5.06 118.70 122.35 2h3c s GLU 60 Ca 0.00 -0.65 -0.00 0.00 0.00 0.00 0.00 54.97 54.32 2h3c s GLU 60 Cb 0.00 -0.75 0.34 0.00 2.00 0.00 0.00 34.13 35.72 2h3c s GLU 60 CO 0.00 0.18 1.76 -1.33 -0.56 0.00 0.00 175.26 175.32 2h3c n MET 61 N 2.04 4.19 -3.45 4.30 2.81 -1.26 -4.97 117.12 120.77 2h3c n MET 61 Ca -0.18 -4.29 -0.16 0.00 -1.81 0.00 0.00 57.70 51.26 2h3c n MET 61 Cb 0.55 -2.36 -0.04 0.00 -0.71 0.00 0.00 33.22 30.66 2h3c n MET 61 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2h3c n ASN 62 N -0.27 1.63 -0.90 7.83 5.15 -1.26 -5.08 115.26 122.36 2h3c n ASN 62 Ca 0.47 -2.28 0.00 0.00 -0.60 0.00 0.00 54.58 52.17 2h3c n ASN 62 Cb 0.29 0.48 0.00 0.00 -0.53 0.00 0.00 39.78 40.02 2h3c n ASN 62 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2h3c n GLY 63 N 0.80 -1.87 0.08 8.20 0.00 -1.26 -4.92 105.19 106.21 2h3c n GLY 63 Ca -0.06 -0.60 -0.15 0.00 0.00 0.00 0.00 46.02 45.21 2h3c n GLY 63 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2h3c h SER 64 N 0.00 0.05 0.00 1.61 0.87 -1.87 -3.48 113.55 110.73 2h3c h SER 64 Ca 0.00 -0.97 0.00 0.00 -1.23 0.00 0.00 61.79 59.59 2h3c h SER 64 Cb 0.00 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 61.94 2h3c h SER 64 CO 0.00 1.07 0.00 0.33 -0.53 0.00 0.00 176.83 177.70 2h3c n PHE 65 N -4.55 -3.92 0.15 2.24 7.35 -1.26 -4.94 117.46 112.52 2h3c n PHE 65 Ca -0.12 1.09 0.02 0.00 -0.76 0.00 0.00 57.45 57.68 2h3c n PHE 65 Cb 0.53 2.86 0.14 0.00 0.35 0.00 0.00 39.48 43.35 2h3c n PHE 65 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2h3c h ALA 66 N 0.00 0.78 -2.89 3.13 0.00 -1.94 -3.42 119.26 114.91 2h3c h ALA 66 Ca 0.00 -0.50 -0.62 0.00 0.00 0.00 0.00 54.91 53.79 2h3c h ALA 66 Cb 0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 2h3c h ALA 66 CO 0.00 0.69 -0.50 0.16 0.00 0.00 0.00 179.25 179.60 2h3c s ASP 67 N -6.53 6.35 -1.07 0.00 -4.77 -1.26 -4.65 116.67 104.74 2h3c s ASP 67 Ca 0.01 0.28 -0.21 0.00 -3.30 0.00 0.00 52.55 49.34 2h3c s ASP 67 Cb 0.10 -1.96 0.02 0.00 -1.09 0.00 0.00 42.92 39.99 2h3c s ASP 67 CO 0.74 0.19 0.68 -0.62 0.70 0.00 0.00 175.17 176.86 2h3c n GLU 68 N 0.44 -0.84 -0.65 2.11 1.02 -1.26 -3.70 120.64 117.76 2h3c n GLU 68 Ca -0.06 0.41 -0.20 0.00 -0.02 0.00 0.00 57.16 57.29 2h3c n GLU 68 Cb 0.51 -2.87 -0.02 0.00 -0.02 0.00 0.00 31.44 29.05 2h3c n GLU 68 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2h3c n ASN 69 N -2.37 4.24 0.00 1.62 2.85 -1.26 -4.60 115.26 115.74 2h3c n ASN 69 Ca -0.16 -2.29 0.00 0.00 -0.11 0.00 0.00 54.58 52.02 2h3c n ASN 69 Cb 0.60 -1.02 0.00 0.00 1.24 0.00 0.00 39.78 40.61 2h3c n ASN 69 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2h3c n LYS 70 N 4.37 0.00 -0.80 1.20 4.01 -1.26 -4.92 118.16 120.76 2h3c n LYS 70 Ca 0.39 0.00 0.11 0.00 -0.51 0.00 0.00 58.31 58.30 2h3c n LYS 70 Cb 0.12 0.00 -0.03 0.00 -0.51 0.00 0.00 35.03 34.61 2h3c n LYS 70 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 2h3c n ASP 71 N 1.30 -6.64 0.00 4.39 -0.08 -1.26 -5.10 116.55 109.16 2h3c n ASP 71 Ca 0.00 0.86 0.00 0.00 -1.51 0.00 0.00 54.79 54.14 2h3c n ASP 71 Cb 0.00 -2.46 0.00 0.00 2.34 0.00 0.00 41.12 41.00 2h3c n ASP 71 CO 0.00 0.00 0.00 0.79 0.12 0.00 0.00 177.20 178.11