#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h3a s LYS 2 N 0.00 2.33 -0.12 0.03 1.02 -1.26 -5.13 119.74 116.62 2h3a s LYS 2 Ca 0.00 -1.77 0.01 0.00 0.02 0.00 0.00 55.97 54.22 2h3a s LYS 2 Cb 0.00 -2.39 0.02 0.00 -0.52 0.00 0.00 37.83 34.94 2h3a s LYS 2 CO 0.00 -0.65 -0.12 -1.14 -0.92 0.00 0.00 175.35 172.51 2h3a s GLN 3 N -4.42 1.99 -0.43 1.68 0.74 -1.26 -5.08 119.66 112.88 2h3a s GLN 3 Ca 0.48 -0.46 -0.29 0.00 0.05 0.00 0.00 55.36 55.14 2h3a s GLN 3 Cb -0.04 -1.82 0.02 0.00 1.10 0.00 0.00 33.01 32.28 2h3a s GLN 3 CO 0.30 -0.16 1.19 0.50 -0.55 0.00 0.00 175.29 176.57 2h3a s ARG 4 N 1.31 3.76 -0.20 1.67 3.52 -1.26 -4.98 118.95 122.77 2h3a s ARG 4 Ca -0.01 0.77 -0.03 0.00 -0.13 0.00 0.00 55.73 56.33 2h3a s ARG 4 Cb -0.14 -3.90 -0.01 0.00 -1.56 0.00 0.00 34.95 29.34 2h3a s ARG 4 CO -0.06 -1.32 -0.05 0.96 -0.81 0.00 0.00 175.30 174.02 2h3a s ILE 5 N 4.51 3.41 -0.06 4.11 -4.36 -1.26 -5.10 121.20 122.45 2h3a s ILE 5 Ca 0.51 -0.49 0.01 0.00 -0.26 0.00 0.00 60.65 60.42 2h3a s ILE 5 Cb -0.10 -2.53 0.02 0.00 1.25 0.00 0.00 42.46 41.10 2h3a s ILE 5 CO 0.29 0.45 -0.09 0.28 0.24 0.00 0.00 174.94 176.11 2h3a s THR 6 N 1.15 0.89 -0.40 8.37 -1.32 -1.26 -5.10 115.64 117.96 2h3a s THR 6 Ca 0.02 -0.32 -0.14 0.00 -1.21 0.00 0.00 61.69 60.04 2h3a s THR 6 Cb -0.14 -0.85 0.02 0.00 -1.51 0.00 0.00 72.50 70.02 2h3a s THR 6 CO -0.01 0.31 0.28 0.54 -2.21 0.00 0.00 174.62 173.53 2h3a s VAL 7 N 0.87 5.13 -1.09 5.08 0.11 -1.26 -4.98 120.40 124.25 2h3a s VAL 7 Ca -0.11 -0.71 -0.22 0.00 -2.93 0.00 0.00 61.98 58.01 2h3a s VAL 7 Cb -0.15 -3.86 -0.10 0.00 -1.53 0.00 0.00 36.38 30.74 2h3a s VAL 7 CO 0.01 -0.30 1.92 0.35 -3.33 0.00 0.00 175.10 173.75 2h3a n THR 8 N 5.13 2.02 -0.47 5.04 -2.24 -1.26 -4.83 114.28 117.68 2h3a n THR 8 Ca -0.11 -2.03 0.00 0.00 -2.27 0.00 0.00 64.05 59.64 2h3a n THR 8 Cb 0.47 -2.22 0.00 0.00 -2.10 0.00 0.00 70.33 66.48 2h3a n THR 8 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2h3a n VAL 9 N 7.26 0.00 0.00 2.28 3.14 -1.26 -4.93 118.33 124.82 2h3a n VAL 9 Ca 0.46 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.84 2h3a n VAL 9 Cb 0.45 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.23 2h3a n VAL 9 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2h3a n ASP 10 N 0.00 0.00 0.00 6.55 2.03 -1.26 -4.82 116.55 119.05 2h3a n ASP 10 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2h3a n ASP 10 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2h3a n ASP 10 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 2h3a n SER 11 N 0.00 0.00 -1.39 1.67 2.88 -1.26 -4.96 113.62 110.57 2h3a n SER 11 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2h3a n SER 11 Cb 0.00 0.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.47 2h3a n SER 11 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2h3a n ASP 12 N -1.52 2.06 0.00 -3.46 9.92 -1.26 -4.67 116.55 117.62 2h3a n ASP 12 Ca 0.00 -1.34 0.00 0.00 -0.53 0.00 0.00 54.79 52.92 2h3a n ASP 12 Cb 0.00 -0.40 0.00 0.00 -0.64 0.00 0.00 41.12 40.08 2h3a n ASP 12 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2h3a n SER 13 N 1.27 -1.70 0.23 -2.24 7.64 -1.26 -4.91 113.62 112.64 2h3a n SER 13 Ca 0.00 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 59.73 2h3a n SER 13 Cb 0.25 -1.26 -0.07 0.00 -1.01 0.00 0.00 64.21 62.11 2h3a n SER 13 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 2h3a h TYR 14 N 0.00 -0.70 -0.99 1.43 3.20 -1.96 -3.09 116.97 114.86 2h3a h TYR 14 Ca 0.00 -0.00 0.22 0.00 3.14 0.00 0.00 58.73 62.08 2h3a h TYR 14 Cb 0.16 0.26 -0.12 0.00 1.54 0.00 0.00 36.73 38.57 2h3a h TYR 14 CO 0.10 -0.40 0.58 1.96 -1.64 0.00 0.00 178.16 178.75 2h3a h GLN 15 N -0.63 0.62 -0.64 1.82 4.20 -1.94 -0.70 115.11 117.85 2h3a h GLN 15 Ca -0.03 -0.04 0.14 0.00 0.06 0.00 0.00 58.65 58.78 2h3a h GLN 15 Cb 0.54 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 28.14 2h3a h GLN 15 CO 0.01 0.41 0.44 1.25 -0.67 0.00 0.00 178.83 180.26 2h3a h LEU 16 N 0.64 0.23 0.02 1.46 6.46 -1.95 1.44 115.31 123.62 2h3a h LEU 16 Ca 0.60 0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 58.37 2h3a h LEU 16 Cb 1.05 -0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.94 2h3a h LEU 16 CO -0.44 0.13 -0.01 0.25 -0.62 0.00 0.00 178.44 177.75 2h3a h LEU 17 N 0.25 -0.03 -1.41 2.25 6.46 -1.24 -3.16 115.31 118.43 2h3a h LEU 17 Ca 0.31 -0.71 -0.05 0.00 -0.12 0.00 0.00 57.88 57.30 2h3a h LEU 17 Cb 0.85 0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.78 2h3a h LEU 17 CO -0.07 0.77 -0.25 0.07 -0.62 0.00 0.00 178.44 178.35 2h3a h LYS 18 N -0.90 0.00 -0.06 1.25 2.10 -1.15 -1.83 116.57 115.98 2h3a h LYS 18 Ca -0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 2h3a h LYS 18 Cb 0.74 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.06 2h3a h LYS 18 CO 0.01 0.25 0.01 0.00 -2.00 0.00 0.00 179.45 177.71 2h3a h ALA 19 N 1.75 1.90 0.09 0.07 0.00 0.19 -2.71 119.26 120.55 2h3a h ALA 19 Ca -0.00 -0.03 -0.29 0.00 0.00 0.00 0.00 54.91 54.59 2h3a h ALA 19 Cb 0.60 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2h3a h ALA 19 CO 0.03 0.08 -1.54 0.10 0.00 0.00 0.00 179.25 177.92 2h3a h TYR 20 N 0.08 0.33 0.00 0.00 -0.00 -1.32 -3.48 116.97 112.58 2h3a h TYR 20 Ca 0.02 -0.24 0.00 0.00 0.00 0.00 0.00 58.73 58.51 2h3a h TYR 20 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 36.73 36.76 2h3a h TYR 20 CO 0.00 1.61 0.00 -3.47 -0.00 0.00 0.00 178.16 176.30 2h3a n ASP 21 N -3.93 0.00 -3.15 0.10 2.03 -0.85 -5.13 116.55 105.62 2h3a n ASP 21 Ca -0.29 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.06 2h3a n ASP 21 Cb 0.88 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 41.28 2h3a n ASP 21 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2h3a s VAL 22 N 0.00 -0.97 0.00 5.18 1.01 -0.96 -4.96 120.40 119.70 2h3a s VAL 22 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61.98 61.98 2h3a s VAL 22 Cb 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.41 2h3a s VAL 22 CO 0.00 0.00 0.35 0.59 0.00 0.00 0.00 175.10 176.04 2h3a n ASN 23 N 5.41 0.00 0.00 3.32 4.13 -1.26 -2.35 115.26 124.51 2h3a n ASN 23 Ca 0.04 0.35 0.00 0.00 1.68 0.00 0.00 54.58 56.66 2h3a n ASN 23 Cb 0.54 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.78 2h3a n ASN 23 CO 0.00 0.00 0.00 2.30 0.28 0.00 0.00 177.26 179.84 2h3a n ILE 24 N -0.38 0.00 -0.28 2.41 -6.64 -1.26 -4.45 119.36 108.76 2h3a n ILE 24 Ca 0.00 0.00 -0.07 0.00 -1.77 0.00 0.00 62.75 60.91 2h3a n ILE 24 Cb 0.00 0.00 -0.07 0.00 -1.44 0.00 0.00 39.64 38.13 2h3a n ILE 24 CO 0.00 0.00 0.00 -0.24 -1.77 0.00 0.00 176.55 174.54 2h3a n SER 25 N 0.00 -0.71 0.09 7.28 2.88 -1.26 0.11 113.62 122.01 2h3a n SER 25 Ca 0.00 1.46 -0.13 0.00 -1.33 0.00 0.00 58.87 58.87 2h3a n SER 25 Cb 0.20 -0.29 -0.13 0.00 -0.75 0.00 0.00 64.21 63.24 2h3a n SER 25 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 2h3a h GLY 26 N 0.00 0.21 0.85 0.46 0.00 -1.97 -3.26 103.07 99.36 2h3a h GLY 26 Ca 0.11 -0.54 -0.04 0.00 0.00 0.00 0.00 47.33 46.85 2h3a h GLY 26 CO -0.63 0.48 -0.45 -2.00 0.00 0.00 0.00 176.54 173.94 2h3a h LEU 27 N 0.05 -1.09 -0.02 3.11 5.85 -1.55 0.96 115.31 122.63 2h3a h LEU 27 Ca -0.10 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.67 2h3a h LEU 27 Cb 1.91 0.30 -0.01 0.00 0.37 0.00 0.00 40.66 43.23 2h3a h LEU 27 CO 0.18 -0.73 -0.08 0.58 -0.34 0.00 0.00 178.44 178.05 2h3a h VAL 28 N -1.19 0.00 -0.95 1.05 2.07 0.62 1.15 116.25 119.00 2h3a h VAL 28 Ca -0.12 0.00 0.25 0.00 0.82 0.00 0.00 66.70 67.66 2h3a h VAL 28 Cb 0.93 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.57 2h3a h VAL 28 CO 0.16 0.00 0.48 0.77 0.02 0.00 0.00 177.57 179.00 2h3a h SER 29 N -0.09 0.44 0.00 0.57 4.64 -1.62 2.36 113.55 119.85 2h3a h SER 29 Ca 0.00 0.16 -0.00 0.00 -0.47 0.00 0.00 61.79 61.49 2h3a h SER 29 Cb 0.10 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2h3a h SER 29 CO -0.06 -0.02 -0.00 0.74 -0.87 0.00 0.00 176.83 176.62 2h3a h THR 30 N 0.42 1.39 0.00 2.95 2.02 -0.21 -3.04 112.91 116.44 2h3a h THR 30 Ca 0.62 -1.16 -0.03 0.00 0.77 0.00 0.00 66.41 66.60 2h3a h THR 30 Cb 1.25 2.18 -0.00 0.00 -1.74 0.00 0.00 68.15 69.84 2h3a h THR 30 CO -0.54 0.30 -0.17 0.74 0.37 0.00 0.00 175.52 176.22 2h3a h THR 31 N -0.50 1.00 -0.41 3.16 2.02 0.33 -2.98 112.91 115.54 2h3a h THR 31 Ca -0.00 -0.59 0.05 0.00 0.77 0.00 0.00 66.41 66.64 2h3a h THR 31 Cb 0.50 1.33 -0.05 0.00 -1.74 0.00 0.00 68.15 68.19 2h3a h THR 31 CO 0.00 0.16 0.13 0.24 0.37 0.00 0.00 175.52 176.42 2h3a h MET 32 N 0.00 0.27 0.42 6.66 2.86 0.40 0.38 114.93 125.92 2h3a h MET 32 Ca -0.00 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 2h3a h MET 32 Cb 0.32 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.90 2h3a h MET 32 CO 0.02 0.18 -0.38 1.96 1.06 0.00 0.00 176.91 179.75 2h3a h GLN 33 N 0.28 -0.78 -0.40 1.72 4.20 -1.55 2.03 115.11 120.61 2h3a h GLN 33 Ca 0.19 0.05 0.08 0.00 0.06 0.00 0.00 58.65 59.04 2h3a h GLN 33 Cb 0.20 0.18 -0.08 0.00 0.30 0.00 0.00 27.48 28.07 2h3a h GLN 33 CO -0.21 -0.52 -0.17 -0.97 -0.67 0.00 0.00 178.83 176.28 2h3a h ASN 34 N -0.81 -0.59 -0.19 1.46 -0.73 -1.53 1.23 115.58 114.42 2h3a h ASN 34 Ca -0.04 0.14 -0.12 0.00 1.87 0.00 0.00 56.30 58.15 2h3a h ASN 34 Cb 0.71 0.33 -0.01 0.00 0.27 0.00 0.00 38.32 39.62 2h3a h ASN 34 CO -0.04 -0.21 -0.31 -0.08 -0.37 0.00 0.00 177.43 176.43 2h3a h GLU 35 N -0.10 0.69 -0.74 6.67 4.57 0.02 1.10 114.58 126.80 2h3a h GLU 35 Ca 0.20 -0.31 0.04 0.00 -1.18 0.00 0.00 59.36 58.11 2h3a h GLU 35 Cb 0.40 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 28.92 2h3a h GLU 35 CO -0.46 0.91 0.46 0.00 -1.18 0.00 0.00 179.01 178.74 2h3a h ALA 36 N 1.07 0.99 0.09 2.92 0.00 0.51 0.37 119.26 125.20 2h3a h ALA 36 Ca 0.07 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2h3a h ALA 36 Cb 0.82 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2h3a h ALA 36 CO 0.07 0.21 -0.04 0.00 0.00 0.00 0.00 179.25 179.49 2h3a h ARG 37 N 0.87 -0.11 -0.94 0.00 2.47 0.19 -3.28 114.38 113.58 2h3a h ARG 37 Ca 0.31 0.01 0.17 0.00 -1.26 0.00 0.00 59.98 59.20 2h3a h ARG 37 Cb 0.09 0.03 -0.08 0.00 -1.65 0.00 0.00 29.97 28.35 2h3a h ARG 37 CO -0.14 0.39 0.60 -0.09 0.56 0.00 0.00 179.97 181.29 2h3a h ARG 38 N -0.71 0.67 -1.47 0.04 2.43 0.16 -3.43 114.38 112.08 2h3a h ARG 38 Ca -0.01 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.01 2h3a h ARG 38 Cb 0.56 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.92 2h3a h ARG 38 CO 0.02 0.44 0.59 1.28 -1.51 0.00 0.00 179.97 180.80 2h3a n LEU 39 N -4.61 -0.44 -3.91 3.80 7.99 0.13 -4.73 117.00 115.24 2h3a n LEU 39 Ca 0.20 -0.17 -0.03 0.00 -0.01 0.00 0.00 56.01 56.00 2h3a n LEU 39 Cb 0.53 -0.16 0.02 0.00 -0.11 0.00 0.00 43.42 43.71 2h3a n LEU 39 CO 0.27 -0.42 0.84 0.00 -1.51 0.00 0.00 177.39 176.57 2h3a s ARG 40 N 2.04 1.27 0.00 3.23 1.70 -1.26 -5.09 118.95 120.85 2h3a s ARG 40 Ca 0.38 -0.83 0.00 0.00 -0.47 0.00 0.00 55.73 54.81 2h3a s ARG 40 Cb -0.25 0.35 0.00 0.00 -0.57 0.00 0.00 34.95 34.49 2h3a s ARG 40 CO 0.16 -0.60 0.00 0.00 -1.08 0.00 0.00 175.30 173.79 2h3a n ALA 41 N -0.74 0.00 -0.90 7.88 0.00 -1.26 -5.04 120.51 120.45 2h3a n ALA 41 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2h3a n ALA 41 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 2h3a n ALA 41 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2h3a n GLU 42 N 0.00 0.00 0.00 0.00 2.13 -1.26 -4.97 120.64 116.54 2h3a n GLU 42 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2h3a n GLU 42 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 2h3a n GLU 42 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2h3a n ARG 43 N -0.96 0.00 -3.12 5.31 3.00 -1.26 -5.07 116.66 114.57 2h3a n ARG 43 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 57.85 57.71 2h3a n ARG 43 Cb 0.00 0.00 0.07 0.00 0.00 0.00 0.00 32.46 32.53 2h3a n ARG 43 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.63 179.50 2h3a n TRP 44 N -2.22 -1.81 -1.28 -1.55 -0.00 -1.26 -4.88 117.44 104.45 2h3a n TRP 44 Ca 0.00 0.75 -0.38 0.00 -0.00 0.00 0.00 57.50 57.87 2h3a n TRP 44 Cb 0.00 -4.39 -0.03 0.00 -0.00 0.00 0.00 31.31 26.89 2h3a n TRP 44 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 177.69 178.86 2h3a n LYS 45 N -3.43 2.47 -3.59 5.87 4.81 -1.26 -4.78 118.16 118.25 2h3a n LYS 45 Ca -0.21 -2.07 -0.27 0.00 -0.87 0.00 0.00 58.31 54.90 2h3a n LYS 45 Cb 0.63 -2.91 -0.16 0.00 0.02 0.00 0.00 35.03 32.60 2h3a n LYS 45 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2h3a s VAL 46 N 3.56 -0.09 0.10 3.15 0.11 -1.26 -5.14 120.40 120.83 2h3a s VAL 46 Ca 0.53 -0.32 -0.07 0.00 -2.93 0.00 0.00 61.98 59.19 2h3a s VAL 46 Cb 0.14 -0.69 -0.01 0.00 -1.53 0.00 0.00 36.38 34.29 2h3a s VAL 46 CO -0.01 -0.40 0.16 -1.61 -3.33 0.00 0.00 175.10 169.90 2h3a s GLU 47 N 2.13 0.87 -0.10 1.54 2.02 -1.26 -5.07 118.70 118.84 2h3a s GLU 47 Ca 0.04 -1.09 0.21 0.00 0.02 0.00 0.00 54.97 54.15 2h3a s GLU 47 Cb -0.16 0.32 0.44 0.00 0.10 0.00 0.00 34.13 34.82 2h3a s GLU 47 CO -0.17 -0.27 1.18 -1.71 0.02 0.00 0.00 175.26 174.31 2h3a n ASN 48 N -0.06 1.44 -4.38 -0.19 5.15 -1.26 -5.02 115.26 110.94 2h3a n ASN 48 Ca -0.13 -2.59 -0.45 0.00 -0.60 0.00 0.00 54.58 50.81 2h3a n ASN 48 Cb 0.62 -0.38 -0.03 0.00 -0.53 0.00 0.00 39.78 39.46 2h3a n ASN 48 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2h3a s GLN 49 N -1.44 3.31 0.00 1.20 -2.07 -1.26 -4.75 119.66 114.65 2h3a s GLN 49 Ca 0.35 -1.69 0.00 0.00 -1.82 0.00 0.00 55.36 52.20 2h3a s GLN 49 Cb 0.38 -4.46 0.00 0.00 -1.09 0.00 0.00 33.01 27.84 2h3a s GLN 49 CO -0.12 -1.54 0.00 0.39 -1.32 0.00 0.00 175.29 172.70 2h3a n GLU 50 N 5.83 0.00 -3.81 9.60 1.02 -1.26 -5.16 120.64 126.86 2h3a n GLU 50 Ca 0.04 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.08 2h3a n GLU 50 Cb 0.45 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.80 2h3a n GLU 50 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2h3a s GLY 51 N -2.71 0.00 -0.06 0.62 0.00 -1.26 -5.18 107.32 98.73 2h3a s GLY 51 Ca 0.00 -0.44 -0.27 0.00 0.00 0.00 0.00 44.72 44.01 2h3a s GLY 51 CO 0.00 -0.64 0.61 -0.29 0.00 0.00 0.00 173.10 172.78 2h3a s MET 52 N -3.65 0.96 0.42 2.90 1.75 -1.26 -5.16 119.30 115.26 2h3a s MET 52 Ca 0.03 0.24 -0.24 0.00 -1.25 0.00 0.00 55.69 54.47 2h3a s MET 52 Cb 0.03 0.45 -0.08 0.00 2.84 0.00 0.00 34.83 38.07 2h3a s MET 52 CO -0.10 -0.28 1.17 0.54 -0.65 0.00 0.00 175.02 175.70 2h3a s VAL 53 N -1.06 3.11 -0.77 10.11 0.11 -1.26 -4.90 120.40 125.74 2h3a s VAL 53 Ca -0.10 0.90 -0.25 0.00 -2.93 0.00 0.00 61.98 59.59 2h3a s VAL 53 Cb -0.01 -3.49 -0.06 0.00 -1.53 0.00 0.00 36.38 31.29 2h3a s VAL 53 CO 0.08 0.05 2.04 -0.70 -3.33 0.00 0.00 175.10 173.24 2h3a s GLU 54 N -2.45 2.38 0.00 1.54 2.12 -1.26 -4.76 118.70 116.27 2h3a s GLU 54 Ca 0.59 0.23 0.00 0.00 0.36 0.00 0.00 54.97 56.16 2h3a s GLU 54 Cb -0.30 -4.79 0.00 0.00 0.26 0.00 0.00 34.13 29.30 2h3a s GLU 54 CO 0.37 -3.36 0.00 0.28 -0.54 0.00 0.00 175.26 172.02 2h3a n VAL 55 N 7.85 0.00 -3.51 3.70 0.31 -1.26 -5.05 118.33 120.36 2h3a n VAL 55 Ca 0.35 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 64.30 2h3a n VAL 55 Cb 0.48 0.00 0.04 0.00 -0.91 0.00 0.00 33.84 33.45 2h3a n VAL 55 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2h3a n ALA 56 N -3.00 -2.31 -1.46 3.52 0.00 -1.26 -4.58 120.51 111.42 2h3a n ALA 56 Ca 0.00 0.27 -0.45 0.00 0.00 0.00 0.00 53.44 53.26 2h3a n ALA 56 Cb 0.00 -2.05 -0.11 0.00 0.00 0.00 0.00 19.45 17.29 2h3a n ALA 56 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2h3a n ARG 57 N -0.41 0.37 -0.34 0.00 5.12 -1.26 -4.77 116.66 115.38 2h3a n ARG 57 Ca -0.11 0.05 0.11 0.00 -1.93 0.00 0.00 57.85 55.97 2h3a n ARG 57 Cb 0.68 -2.03 0.30 0.00 -1.16 0.00 0.00 32.46 30.25 2h3a n ARG 57 CO 0.00 0.00 0.00 1.97 -1.93 0.00 0.00 177.63 177.67 2h3a n PHE 58 N 10.97 0.88 -1.73 -1.55 1.16 -1.26 -4.72 117.46 121.21 2h3a n PHE 58 Ca 0.55 -0.44 -0.41 0.00 -1.87 0.00 0.00 57.45 55.27 2h3a n PHE 58 Cb 0.15 0.00 -0.01 0.00 -1.61 0.00 0.00 39.48 38.01 2h3a n PHE 58 CO 0.00 0.00 0.00 -0.89 -1.87 0.00 0.00 176.76 174.00 2h3a n ILE 59 N 1.54 3.88 -2.16 1.97 2.08 -1.26 -4.81 119.36 120.61 2h3a n ILE 59 Ca 0.23 -3.18 0.00 0.00 0.56 0.00 0.00 62.75 60.36 2h3a n ILE 59 Cb 0.59 -2.55 0.00 0.00 -0.75 0.00 0.00 39.64 36.94 2h3a n ILE 59 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 2h3a n GLU 60 N 4.96 0.59 -4.18 0.38 4.07 -1.26 -5.18 120.64 120.01 2h3a n GLU 60 Ca 0.57 0.00 -0.16 0.00 -0.06 0.00 0.00 57.16 57.51 2h3a n GLU 60 Cb 0.34 0.00 -0.12 0.00 -0.06 0.00 0.00 31.44 31.60 2h3a n GLU 60 CO 0.00 0.00 0.00 -1.64 -0.06 0.00 0.00 177.13 175.43 2h3a s MET 61 N 1.84 0.68 0.16 5.31 -1.94 -1.26 -5.09 119.30 118.99 2h3a s MET 61 Ca 0.00 -0.71 0.00 0.00 -1.71 0.00 0.00 55.69 53.27 2h3a s MET 61 Cb 0.00 -0.59 0.00 0.00 2.01 0.00 0.00 34.83 36.25 2h3a s MET 61 CO 0.00 0.13 0.00 0.09 -0.01 0.00 0.00 175.02 175.23 2h3a n ASN 62 N 1.77 -2.25 -2.88 3.03 4.13 -1.26 -5.00 115.26 112.80 2h3a n ASN 62 Ca -0.20 0.50 -0.12 0.00 1.68 0.00 0.00 54.58 56.44 2h3a n ASN 62 Cb 0.55 -0.61 0.05 0.00 -1.54 0.00 0.00 39.78 38.22 2h3a n ASN 62 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2h3a n GLY 63 N -1.79 1.85 0.00 7.41 0.00 -1.26 -5.13 105.19 106.27 2h3a n GLY 63 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.27 2h3a n GLY 63 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2h3a n SER 64 N 0.15 0.00 -3.77 1.61 2.88 -1.26 -5.14 113.62 108.09 2h3a n SER 64 Ca 0.12 -0.32 -0.17 0.00 -1.33 0.00 0.00 58.87 57.17 2h3a n SER 64 Cb 0.72 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 64.02 2h3a n SER 64 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 2h3a s PHE 65 N 1.53 0.18 -0.18 0.66 5.36 -1.26 -5.15 117.98 119.13 2h3a s PHE 65 Ca 0.00 0.09 -0.29 0.00 -0.96 0.00 0.00 56.93 55.77 2h3a s PHE 65 Cb 0.00 -0.38 0.11 0.00 -0.34 0.00 0.00 43.02 42.41 2h3a s PHE 65 CO 0.00 -0.14 0.94 0.00 -1.46 0.00 0.00 175.22 174.56 2h3a s ALA 66 N 1.32 -1.91 -0.13 11.12 0.00 -1.26 -5.14 121.76 125.75 2h3a s ALA 66 Ca -0.06 1.64 -0.25 0.00 0.00 0.00 0.00 51.96 53.30 2h3a s ALA 66 Cb -0.13 -0.81 -0.02 0.00 0.00 0.00 0.00 23.12 22.16 2h3a s ALA 66 CO -0.03 -0.30 0.78 0.34 0.00 0.00 0.00 175.76 176.56 2h3a s ASP 67 N -0.71 6.96 0.50 0.00 2.15 -1.26 -5.04 116.67 119.27 2h3a s ASP 67 Ca -0.02 1.17 -0.20 0.00 0.43 0.00 0.00 52.55 53.93 2h3a s ASP 67 Cb -0.02 -2.44 -0.08 0.00 -0.30 0.00 0.00 42.92 40.08 2h3a s ASP 67 CO 0.01 -0.30 1.05 -0.70 -0.17 0.00 0.00 175.17 175.05 2h3a s GLU 68 N 1.70 3.74 0.00 4.34 2.56 -1.26 -5.01 118.70 124.78 2h3a s GLU 68 Ca 0.38 1.37 -0.09 0.00 0.00 0.00 0.00 54.97 56.62 2h3a s GLU 68 Cb -0.17 -2.08 -0.05 0.00 2.00 0.00 0.00 34.13 33.82 2h3a s GLU 68 CO 0.15 -0.48 0.85 -0.91 -0.56 0.00 0.00 175.26 174.31 2h3a h ASN 69 N 1.47 -0.29 0.00 -1.70 2.35 -2.09 -3.48 115.58 111.85 2h3a h ASN 69 Ca -0.49 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.27 2h3a h ASN 69 Cb 1.22 0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.67 2h3a h ASN 69 CO 0.59 -0.16 0.00 2.29 -1.65 0.00 0.00 177.43 178.50 2h3a n LYS 70 N -3.19 0.00 0.00 0.81 2.85 -1.26 -5.14 118.16 112.23 2h3a n LYS 70 Ca -0.04 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.22 2h3a n LYS 70 Cb 0.13 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.51 2h3a n LYS 70 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2h3a n ASP 71 N 0.00 -0.63 0.00 -5.58 -0.08 -1.26 -5.35 116.55 103.65 2h3a n ASP 71 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2h3a n ASP 71 Cb 0.00 0.63 0.00 0.00 2.34 0.00 0.00 41.12 44.09 2h3a n ASP 71 CO 0.00 0.00 0.00 0.79 0.12 0.00 0.00 177.20 178.11