#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 1.78 -0.24 2.12 1.02 -1.26 -5.12 119.74 118.04 2h3c s LYS 2 Ca 0.00 -1.33 0.01 0.00 0.02 0.00 0.00 55.97 54.67 2h3c s LYS 2 Cb 0.00 -2.03 0.04 0.00 -0.52 0.00 0.00 37.83 35.32 2h3c s LYS 2 CO 0.00 0.44 -0.11 -1.14 -0.92 0.00 0.00 175.35 173.61 2h3c s GLN 3 N -2.55 2.59 -0.53 1.68 2.00 -1.26 -5.07 119.66 116.51 2h3c s GLN 3 Ca 0.21 -1.12 -0.29 0.00 -2.00 0.00 0.00 55.36 52.16 2h3c s GLN 3 Cb -0.09 -2.85 0.03 0.00 0.80 0.00 0.00 33.01 30.90 2h3c s GLN 3 CO 0.12 -0.44 1.17 0.50 -0.50 0.00 0.00 175.29 176.14 2h3c s ARG 4 N 1.21 3.61 -0.15 1.67 3.52 -1.26 -4.98 118.95 122.57 2h3c s ARG 4 Ca -0.03 0.40 -0.02 0.00 -0.13 0.00 0.00 55.73 55.96 2h3c s ARG 4 Cb -0.17 -3.97 -0.02 0.00 -1.56 0.00 0.00 34.95 29.24 2h3c s ARG 4 CO -0.07 -1.55 -0.10 0.96 -0.81 0.00 0.00 175.30 173.74 2h3c s ILE 5 N 4.74 3.26 -0.03 4.11 -0.00 -1.26 -5.10 121.20 126.92 2h3c s ILE 5 Ca 0.45 -0.57 0.04 0.00 -0.00 0.00 0.00 60.65 60.57 2h3c s ILE 5 Cb -0.07 -2.40 -0.00 0.00 -0.00 0.00 0.00 42.46 39.98 2h3c s ILE 5 CO 0.29 0.50 -0.15 0.28 -0.00 0.00 0.00 174.94 175.86 2h3c s THR 6 N 0.56 1.24 -0.45 8.37 -1.32 -1.26 -5.09 115.64 117.70 2h3c s THR 6 Ca -0.06 -0.62 -0.15 0.00 -1.21 0.00 0.00 61.69 59.65 2h3c s THR 6 Cb -0.15 -1.06 0.05 0.00 -1.51 0.00 0.00 72.50 69.83 2h3c s THR 6 CO 0.03 0.36 0.35 0.54 -2.21 0.00 0.00 174.62 173.69 2h3c s VAL 7 N 0.00 5.15 -0.86 5.08 0.11 -1.26 -5.01 120.40 123.61 2h3c s VAL 7 Ca -0.02 -0.95 -0.25 0.00 -2.93 0.00 0.00 61.98 57.83 2h3c s VAL 7 Cb -0.10 -4.00 -0.04 0.00 -1.53 0.00 0.00 36.38 30.71 2h3c s VAL 7 CO 0.01 -0.48 1.90 0.42 -3.33 0.00 0.00 175.10 173.63 2h3c s THR 8 N 1.63 3.46 0.00 5.04 -4.23 -1.26 -4.91 115.64 115.37 2h3c s THR 8 Ca 0.04 -0.29 0.00 0.00 -1.18 0.00 0.00 61.69 60.26 2h3c s THR 8 Cb -0.22 -4.06 0.00 0.00 1.34 0.00 0.00 72.50 69.56 2h3c s THR 8 CO 0.07 -1.00 0.00 0.52 -0.54 0.00 0.00 174.62 173.67 2h3c n VAL 9 N 7.71 0.00 0.00 2.29 0.31 -1.26 -4.79 118.33 122.58 2h3c n VAL 9 Ca 0.36 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.69 2h3c n VAL 9 Cb 0.48 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.41 2h3c n VAL 9 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2h3c n ASP 10 N 0.00 0.00 0.04 4.52 2.03 -1.26 -4.70 116.55 117.18 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 -1.20 -1.92 0.00 0.00 177.20 174.08 2h3c n SER 11 N 0.00 0.20 0.00 1.67 7.64 -1.26 -4.98 113.62 116.89 2h3c n SER 11 Ca 0.00 0.13 0.00 0.00 1.01 0.00 0.00 58.87 60.01 2h3c n SER 11 Cb 0.00 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 2h3c n SER 11 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2h3c n ASP 12 N -3.06 0.00 -1.45 6.43 8.00 -1.26 -4.73 116.55 120.47 2h3c n ASP 12 Ca 0.00 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.49 2h3c n ASP 12 Cb 0.15 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.27 2h3c n ASP 12 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2h3c n SER 13 N 0.00 -0.25 0.08 -2.24 2.88 -1.26 -4.78 113.62 108.05 2h3c n SER 13 Ca 0.00 -1.03 -0.16 0.00 -1.33 0.00 0.00 58.87 56.35 2h3c n SER 13 Cb 0.00 0.11 -0.14 0.00 -0.75 0.00 0.00 64.21 63.43 2h3c n SER 13 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 2h3c h TYR 14 N 0.14 0.46 -0.72 0.66 3.20 -1.98 -3.39 116.97 115.33 2h3c h TYR 14 Ca -0.09 -0.33 0.16 0.00 3.14 0.00 0.00 58.73 61.61 2h3c h TYR 14 Cb 0.96 -0.02 -0.11 0.00 1.54 0.00 0.00 36.73 39.11 2h3c h TYR 14 CO -0.17 1.33 0.14 -0.56 -1.64 0.00 0.00 178.16 177.26 2h3c h GLN 15 N 0.07 0.22 -0.96 1.82 3.07 -1.98 -1.60 115.11 115.76 2h3c h GLN 15 Ca -0.20 -0.01 0.25 0.00 0.09 0.00 0.00 58.65 58.77 2h3c h GLN 15 Cb 2.00 -0.05 -0.06 0.00 0.08 0.00 0.00 27.48 29.44 2h3c h GLN 15 CO 0.18 0.15 0.65 -0.07 0.09 0.00 0.00 178.83 179.83 2h3c h LEU 16 N 0.23 0.25 0.28 0.06 3.38 -1.97 1.30 115.31 118.84 2h3c h LEU 16 Ca 0.40 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.40 2h3c h LEU 16 Cb 0.69 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.43 2h3c h LEU 16 CO -0.53 0.08 -0.13 -0.07 0.09 0.00 0.00 178.44 177.88 2h3c h LEU 17 N 0.24 -0.32 -2.02 1.67 3.38 -1.56 -3.04 115.31 113.67 2h3c h LEU 17 Ca 0.49 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.46 2h3c h LEU 17 Cb 1.52 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 42.34 2h3c h LEU 17 CO -0.14 0.13 -0.09 0.07 0.09 0.00 0.00 178.44 178.50 2h3c h LYS 18 N -1.09 0.00 -0.14 1.13 2.10 -1.28 -1.25 116.57 116.03 2h3c h LYS 18 Ca -0.04 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.59 2h3c h LYS 18 Cb 0.29 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.61 2h3c h LYS 18 CO 0.06 0.09 -0.01 0.00 -2.00 0.00 0.00 179.45 177.59 2h3c h ALA 19 N 1.91 1.72 0.13 0.07 0.00 0.16 -2.83 119.26 120.42 2h3c h ALA 19 Ca -0.00 -0.10 -0.35 0.00 0.00 0.00 0.00 54.91 54.46 2h3c h ALA 19 Cb 0.22 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2h3c h ALA 19 CO 0.01 0.22 -1.86 0.10 0.00 0.00 0.00 179.25 177.72 2h3c h TYR 20 N 0.20 0.51 0.00 0.00 -0.00 -1.12 -3.46 116.97 113.11 2h3c h TYR 20 Ca 0.05 -0.37 0.00 0.00 0.00 0.00 0.00 58.73 58.40 2h3c h TYR 20 Cb 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 36.73 36.87 2h3c h TYR 20 CO 0.00 1.65 0.00 -3.47 -0.00 0.00 0.00 178.16 176.34 2h3c n ASP 21 N -3.48 0.00 -3.15 0.10 2.03 -0.96 -4.46 116.55 106.64 2h3c n ASP 21 Ca -0.27 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.08 2h3c n ASP 21 Cb 1.06 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 41.46 2h3c n ASP 21 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2h3c s VAL 22 N 0.00 -0.92 0.00 5.18 1.01 -1.05 -4.99 120.40 119.63 2h3c s VAL 22 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61.98 61.98 2h3c s VAL 22 Cb 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 36.38 35.47 2h3c s VAL 22 CO 0.00 0.00 0.08 0.59 0.00 0.00 0.00 175.10 175.77 2h3c n ASN 23 N 5.37 0.00 0.00 3.32 3.02 -1.26 -2.74 115.26 122.97 2h3c n ASN 23 Ca 0.06 0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.69 2h3c n ASN 23 Cb 0.54 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.71 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 -0.11 0.00 -0.29 2.41 -6.64 -1.26 -4.34 119.36 109.14 2h3c n ILE 24 Ca 0.00 0.00 -0.07 0.00 -1.77 0.00 0.00 62.75 60.91 2h3c n ILE 24 Cb 0.00 0.00 -0.07 0.00 -1.44 0.00 0.00 39.64 38.13 2h3c n ILE 24 CO 0.00 0.00 0.00 -1.54 -1.77 0.00 0.00 176.55 173.24 2h3c n SER 25 N 0.00 -0.72 0.03 7.28 3.41 -1.26 0.68 113.62 123.04 2h3c n SER 25 Ca 0.00 1.47 -0.08 0.00 -0.26 0.00 0.00 58.87 59.99 2h3c n SER 25 Cb 0.41 -0.28 -0.13 0.00 -0.26 0.00 0.00 64.21 63.94 2h3c n SER 25 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2h3c h GLY 26 N 0.00 0.03 1.00 5.00 0.00 -1.98 -3.27 103.07 103.84 2h3c h GLY 26 Ca 0.11 -0.07 -0.05 0.00 0.00 0.00 0.00 47.33 47.32 2h3c h GLY 26 CO -0.64 0.06 -0.49 -2.00 0.00 0.00 0.00 176.54 173.47 2h3c h LEU 27 N 0.01 -1.16 -0.01 3.11 7.12 -1.66 0.17 115.31 122.88 2h3c h LEU 27 Ca -0.13 0.04 0.01 0.00 0.13 0.00 0.00 57.88 57.93 2h3c h LEU 27 Cb 1.88 0.30 -0.03 0.00 -0.53 0.00 0.00 40.66 42.29 2h3c h LEU 27 CO 0.11 -0.82 -0.25 0.58 -0.13 0.00 0.00 178.44 177.94 2h3c h VAL 28 N -1.34 0.00 -0.96 1.05 2.07 0.08 0.26 116.25 117.42 2h3c h VAL 28 Ca -0.14 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.60 2h3c h VAL 28 Cb 1.03 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.69 2h3c h VAL 28 CO 0.22 0.00 0.52 0.77 0.02 0.00 0.00 177.57 179.10 2h3c h SER 29 N -0.31 0.58 0.26 0.57 4.64 -1.61 1.20 113.55 118.88 2h3c h SER 29 Ca 0.01 0.13 -0.01 0.00 -0.47 0.00 0.00 61.79 61.44 2h3c h SER 29 Cb 0.33 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2h3c h SER 29 CO -0.17 0.12 -0.12 0.74 -0.87 0.00 0.00 176.83 176.52 2h3c h THR 30 N 0.56 0.77 -0.88 2.95 2.02 -0.06 -1.76 112.91 116.52 2h3c h THR 30 Ca 0.59 -0.69 -0.02 0.00 0.77 0.00 0.00 66.41 67.05 2h3c h THR 30 Cb 1.06 1.14 -0.04 0.00 -1.74 0.00 0.00 68.15 68.57 2h3c h THR 30 CO -0.46 0.14 0.46 0.00 0.37 0.00 0.00 175.52 176.02 2h3c h THR 31 N -0.73 1.26 0.64 3.16 1.03 0.40 -2.61 112.91 116.06 2h3c h THR 31 Ca -0.04 -0.69 -0.02 0.00 -0.01 0.00 0.00 66.41 65.65 2h3c h THR 31 Cb 0.49 0.10 -0.01 0.00 -1.07 0.00 0.00 68.15 67.66 2h3c h THR 31 CO 0.06 0.31 -0.41 0.24 -0.01 0.00 0.00 175.52 175.71 2h3c h MET 32 N 1.25 -0.96 -0.97 0.00 2.86 0.15 0.68 114.93 117.95 2h3c h MET 32 Ca 0.31 0.07 0.19 0.00 -2.06 0.00 0.00 59.70 58.20 2h3c h MET 32 Cb 0.07 0.22 -0.09 0.00 0.06 0.00 0.00 31.60 31.86 2h3c h MET 32 CO -0.04 -0.64 0.61 0.37 1.06 0.00 0.00 176.91 178.27 2h3c h GLN 33 N -0.99 0.62 0.22 1.72 4.15 -1.25 3.00 115.11 122.59 2h3c h GLN 33 Ca -0.08 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.29 2h3c h GLN 33 Cb 0.81 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 28.36 2h3c h GLN 33 CO 0.07 0.41 -0.10 -0.97 -1.93 0.00 0.00 178.83 176.31 2h3c h ASN 34 N 0.64 -0.25 0.77 -0.69 -1.24 -1.06 0.14 115.58 113.90 2h3c h ASN 34 Ca 0.53 -0.27 -0.01 0.00 0.71 0.00 0.00 56.30 57.26 2h3c h ASN 34 Cb 0.97 0.06 -0.00 0.00 0.73 0.00 0.00 38.32 40.09 2h3c h ASN 34 CO -0.29 0.26 -0.06 -0.33 -1.29 0.00 0.00 177.43 175.73 2h3c h GLU 35 N -0.90 0.00 -0.01 6.67 3.07 0.94 0.16 114.58 124.51 2h3c h GLU 35 Ca -0.03 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.81 2h3c h GLU 35 Cb 0.50 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 2h3c h GLU 35 CO 0.05 0.06 -0.06 0.00 -1.40 0.00 0.00 179.01 177.66 2h3c h ALA 36 N 1.94 0.02 0.10 3.43 0.00 0.55 0.93 119.26 126.23 2h3c h ALA 36 Ca -0.00 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 2h3c h ALA 36 Cb 0.46 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2h3c h ALA 36 CO 0.01 -0.09 -0.05 0.00 0.00 0.00 0.00 179.25 179.11 2h3c h ARG 37 N -0.57 -0.13 -0.07 0.00 3.08 -0.32 -3.12 114.38 113.24 2h3c h ARG 37 Ca -0.00 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 2h3c h ARG 37 Cb 0.73 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.81 2h3c h ARG 37 CO 0.01 -0.00 0.03 0.00 -1.07 0.00 0.00 179.97 178.94 2h3c h ARG 38 N -0.24 0.12 -2.70 0.04 2.47 -0.76 -3.47 114.38 109.84 2h3c h ARG 38 Ca -0.01 -0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 58.68 2h3c h ARG 38 Cb 0.19 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 2h3c h ARG 38 CO 0.02 0.27 -0.00 -0.11 0.56 0.00 0.00 179.97 180.71 2h3c n LEU 39 N -4.93 -0.01 0.05 3.04 0.00 0.32 -4.82 117.00 110.65 2h3c n LEU 39 Ca -0.06 -0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.95 2h3c n LEU 39 Cb 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 43.42 43.54 2h3c n LEU 39 CO 0.34 0.00 -0.08 -1.14 0.00 0.00 0.00 177.39 176.51 2h3c n ARG 40 N -0.12 0.00 0.00 1.96 3.00 -1.26 -5.07 116.66 115.17 2h3c n ARG 40 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2h3c n ARG 40 Cb 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 32.46 32.34 2h3c n ARG 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2h3c n ALA 41 N -2.95 0.00 -1.10 5.13 0.00 -1.26 -5.17 120.51 115.16 2h3c n ALA 41 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2h3c n ALA 41 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.53 2h3c n ALA 41 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2h3c n GLU 42 N 0.00 -3.08 -4.06 0.00 4.07 -1.26 -5.10 120.64 111.21 2h3c n GLU 42 Ca 0.00 2.32 -0.15 0.00 -0.06 0.00 0.00 57.16 59.27 2h3c n GLU 42 Cb 0.00 -2.68 -0.03 0.00 -0.06 0.00 0.00 31.44 28.67 2h3c n GLU 42 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 2h3c s ARG 43 N -4.58 2.01 0.06 5.31 3.00 -1.26 -5.18 118.95 118.31 2h3c s ARG 43 Ca 0.00 -1.77 -0.01 0.00 0.00 0.00 0.00 55.73 53.95 2h3c s ARG 43 Cb 0.00 0.47 0.02 0.00 0.00 0.00 0.00 34.95 35.43 2h3c s ARG 43 CO 0.00 -0.85 0.08 0.91 0.00 0.00 0.00 175.30 175.44 2h3c n TRP 44 N -0.59 -3.76 0.05 -0.53 8.01 -1.26 -5.07 117.44 114.30 2h3c n TRP 44 Ca 0.00 -0.07 0.00 0.00 -1.31 0.00 0.00 57.50 56.12 2h3c n TRP 44 Cb 0.61 -0.06 0.00 0.00 -2.01 0.00 0.00 31.31 29.85 2h3c n TRP 44 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.69 177.85 2h3c n LYS 45 N -1.31 0.00 -3.98 -0.99 3.00 -1.26 -5.12 118.16 108.50 2h3c n LYS 45 Ca 0.01 0.00 -0.23 0.00 -0.00 0.00 0.00 58.31 58.09 2h3c n LYS 45 Cb 0.04 0.00 -0.17 0.00 0.00 0.00 0.00 35.03 34.90 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 -1.26 0.64 0.05 3.15 -7.23 -1.26 -5.06 120.40 109.43 2h3c s VAL 46 Ca 0.00 -0.10 -0.15 0.00 -1.81 0.00 0.00 61.98 59.93 2h3c s VAL 46 Cb 0.00 -0.71 -0.05 0.00 0.56 0.00 0.00 36.38 36.18 2h3c s VAL 46 CO 0.00 0.28 1.24 1.05 -0.31 0.00 0.00 175.10 177.36 2h3c h GLU 47 N 7.85 -0.23 -6.01 4.82 4.11 -2.00 -3.46 114.58 119.67 2h3c h GLU 47 Ca -0.28 0.02 -0.42 0.00 0.07 0.00 0.00 59.36 58.75 2h3c h GLU 47 Cb 1.14 0.05 0.07 0.00 0.50 0.00 0.00 28.75 30.51 2h3c h GLU 47 CO 0.37 -0.15 -0.75 -1.71 0.07 0.00 0.00 179.01 176.85 2h3c n ASN 48 N -3.82 -4.31 -4.44 3.06 4.05 -1.26 -4.87 115.26 103.68 2h3c n ASN 48 Ca -0.02 -0.68 -0.39 0.00 0.45 0.00 0.00 54.58 53.94 2h3c n ASN 48 Cb 0.16 -4.51 -0.02 0.00 1.23 0.00 0.00 39.78 36.64 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 -4.65 2.67 -3.83 1.20 10.64 -1.26 -4.93 117.38 117.22 2h3c n GLN 49 Ca -0.08 -2.93 -0.36 0.00 -1.83 0.00 0.00 57.00 51.81 2h3c n GLN 49 Cb 0.59 -3.51 -0.13 0.00 -0.86 0.00 0.00 30.24 26.33 2h3c n GLN 49 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 2h3c s GLU 50 N 4.72 3.36 0.00 2.61 2.02 -1.26 -5.07 118.70 125.08 2h3c s GLU 50 Ca 0.57 -0.66 0.00 0.00 0.02 0.00 0.00 54.97 54.90 2h3c s GLU 50 Cb 0.04 -3.18 0.00 0.00 0.10 0.00 0.00 34.13 31.10 2h3c s GLU 50 CO 0.08 -0.26 0.00 0.41 0.02 0.00 0.00 175.26 175.51 2h3c n GLY 51 N 4.84 2.75 2.54 -1.39 0.00 -1.26 -4.94 105.19 107.73 2h3c n GLY 51 Ca -0.17 -1.10 -0.20 0.00 0.00 0.00 0.00 46.02 44.56 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 0.00 -1.40 -3.61 1.61 2.81 -1.26 -4.94 117.12 110.33 2h3c n MET 52 Ca 0.00 1.16 -0.02 0.00 -1.81 0.00 0.00 57.70 57.03 2h3c n MET 52 Cb 0.00 -5.53 -0.05 0.00 -0.71 0.00 0.00 33.22 26.93 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 -2.77 -0.58 0.10 2.03 0.11 -1.26 -5.17 120.40 112.85 2h3c s VAL 53 Ca 0.00 0.00 -0.25 0.00 -2.93 0.00 0.00 61.98 58.80 2h3c s VAL 53 Cb 0.00 -1.00 0.08 0.00 -1.53 0.00 0.00 36.38 33.93 2h3c s VAL 53 CO 0.00 0.00 0.66 -1.83 -3.33 0.00 0.00 175.10 170.60 2h3c s GLU 54 N 2.37 1.17 -0.40 1.54 4.04 -1.26 -5.11 118.70 121.05 2h3c s GLU 54 Ca -0.07 -0.31 0.10 0.00 0.04 0.00 0.00 54.97 54.72 2h3c s GLU 54 Cb -0.09 0.54 0.31 0.00 0.02 0.00 0.00 34.13 34.92 2h3c s GLU 54 CO -0.19 -0.49 0.78 1.33 -1.84 0.00 0.00 175.26 174.85 2h3c n VAL 55 N -0.12 -0.23 -1.73 1.83 0.24 -1.26 -5.05 118.33 112.00 2h3c n VAL 55 Ca -0.16 -3.62 -0.30 0.00 -2.04 0.00 0.00 64.34 58.21 2h3c n VAL 55 Cb 0.63 -0.13 -0.07 0.00 -1.47 0.00 0.00 33.84 32.80 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 0.64 1.84 -2.93 2.33 0.00 -1.26 -4.83 120.51 116.30 2h3c n ALA 56 Ca 0.19 -2.96 -0.11 0.00 0.00 0.00 0.00 53.44 50.57 2h3c n ALA 56 Cb 0.64 -3.51 -0.06 0.00 0.00 0.00 0.00 19.45 16.52 2h3c n ALA 56 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2h3c s ARG 57 N 6.48 0.98 0.16 0.00 1.81 -1.26 -5.11 118.95 122.01 2h3c s ARG 57 Ca 0.68 -0.69 0.00 0.00 -1.72 0.00 0.00 55.73 54.00 2h3c s ARG 57 Cb 0.03 0.43 0.00 0.00 -0.45 0.00 0.00 34.95 34.95 2h3c s ARG 57 CO 0.15 -0.36 0.00 1.19 -0.68 0.00 0.00 175.30 175.60 2h3c n PHE 58 N -0.02 -1.11 -3.97 -0.53 3.72 -1.26 -4.94 117.46 109.35 2h3c n PHE 58 Ca -0.16 0.60 -0.31 0.00 -0.05 0.00 0.00 57.45 57.53 2h3c n PHE 58 Cb 0.63 -1.16 -0.15 0.00 -0.94 0.00 0.00 39.48 37.86 2h3c n PHE 58 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2h3c s ILE 59 N -3.90 1.85 -0.42 4.37 1.01 -1.26 -5.02 121.20 117.82 2h3c s ILE 59 Ca 0.00 -1.76 0.05 0.00 0.00 0.00 0.00 60.65 58.93 2h3c s ILE 59 Cb 0.00 -2.22 0.18 0.00 0.01 0.00 0.00 42.46 40.44 2h3c s ILE 59 CO 0.00 -0.36 0.43 1.21 0.00 0.00 0.00 174.94 176.21 2h3c n GLU 60 N 4.49 0.30 -3.67 2.79 0.00 -1.26 -5.10 120.64 118.18 2h3c n GLU 60 Ca -0.05 -2.99 -0.09 0.00 0.00 0.00 0.00 57.16 54.03 2h3c n GLU 60 Cb 0.43 -1.59 -0.10 0.00 0.00 0.00 0.00 31.44 30.18 2h3c n GLU 60 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.13 175.49 2h3c s MET 61 N 0.05 0.40 -0.56 5.31 -1.94 -1.26 -5.07 119.30 116.23 2h3c s MET 61 Ca 0.33 0.94 0.04 0.00 -1.71 0.00 0.00 55.69 55.29 2h3c s MET 61 Cb 0.05 0.16 0.38 0.00 2.01 0.00 0.00 34.83 37.43 2h3c s MET 61 CO -0.17 -0.19 1.22 -1.71 -0.01 0.00 0.00 175.02 174.16 2h3c n ASN 62 N 4.74 5.16 0.02 3.03 5.15 -1.26 -4.82 115.26 127.28 2h3c n ASN 62 Ca -0.17 -3.73 0.00 0.00 -0.60 0.00 0.00 54.58 50.08 2h3c n ASN 62 Cb 0.53 -0.60 0.00 0.00 -0.53 0.00 0.00 39.78 39.18 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 -0.40 -1.77 5.40 8.20 0.00 -1.26 -5.08 105.19 110.27 2h3c n GLY 63 Ca 0.39 0.63 0.00 0.00 0.00 0.00 0.00 46.02 47.04 2h3c n GLY 63 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2h3c n SER 64 N -2.44 0.00 -1.89 1.61 7.64 -1.26 -4.78 113.62 112.50 2h3c n SER 64 Ca 0.00 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 59.72 2h3c n SER 64 Cb 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 2h3c n SER 64 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2h3c n PHE 65 N 0.00 -0.66 -2.11 1.43 3.01 -1.26 -4.73 117.46 113.13 2h3c n PHE 65 Ca 0.00 0.00 -0.04 0.00 1.01 0.00 0.00 57.45 58.42 2h3c n PHE 65 Cb 0.00 -3.11 -0.04 0.00 -0.01 0.00 0.00 39.48 36.32 2h3c n PHE 65 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2h3c n ALA 66 N -0.45 3.22 -0.99 4.37 0.00 -1.26 -5.14 120.51 120.25 2h3c n ALA 66 Ca -0.18 -1.01 0.00 0.00 0.00 0.00 0.00 53.44 52.25 2h3c n ALA 66 Cb 0.58 -0.40 0.00 0.00 0.00 0.00 0.00 19.45 19.64 2h3c n ALA 66 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2h3c n ASP 67 N 0.11 -5.39 -1.12 0.00 8.00 -1.26 -4.72 116.55 112.17 2h3c n ASP 67 Ca -0.17 1.13 0.07 0.00 0.71 0.00 0.00 54.79 56.54 2h3c n ASP 67 Cb 0.78 -2.81 -0.02 0.00 -0.02 0.00 0.00 41.12 39.05 2h3c n ASP 67 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2h3c n GLU 68 N -2.04 -1.04 -3.04 -1.24 -0.58 -1.26 -4.76 120.64 106.67 2h3c n GLU 68 Ca 0.00 0.69 -0.15 0.00 -0.42 0.00 0.00 57.16 57.27 2h3c n GLU 68 Cb 0.27 -1.27 0.00 0.00 -0.57 0.00 0.00 31.44 29.87 2h3c n GLU 68 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 2h3c n ASN 69 N -3.30 -0.23 -4.15 1.62 0.23 -1.26 -4.87 115.26 103.29 2h3c n ASN 69 Ca 0.00 -3.20 -0.14 0.00 -0.53 0.00 0.00 54.58 50.71 2h3c n ASN 69 Cb 0.24 0.19 -0.11 0.00 -2.08 0.00 0.00 39.78 38.02 2h3c n ASN 69 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 2h3c s LYS 70 N -1.49 0.79 -0.29 -3.83 -0.14 -1.26 -4.93 119.74 108.58 2h3c s LYS 70 Ca 0.34 -1.10 -0.38 0.00 -1.36 0.00 0.00 55.97 53.47 2h3c s LYS 70 Cb 0.32 -0.46 0.16 0.00 -1.68 0.00 0.00 37.83 36.17 2h3c s LYS 70 CO -0.08 0.07 1.38 0.34 -0.76 0.00 0.00 175.35 176.30 2h3c s ASP 71 N -2.34 -0.02 0.00 2.83 -1.08 -1.26 -4.88 116.67 109.92 2h3c s ASP 71 Ca 0.03 0.00 0.00 0.00 -0.52 0.00 0.00 52.55 52.06 2h3c s ASP 71 Cb -0.03 0.02 0.00 0.00 -1.46 0.00 0.00 42.92 41.44 2h3c s ASP 71 CO -0.00 -0.03 0.00 -2.67 0.52 0.00 0.00 175.17 172.99