#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h3a n LYS 2 N 0.00 0.60 -3.74 3.17 4.76 -1.26 -5.08 118.16 116.60 2h3a n LYS 2 Ca 0.00 -1.12 -0.38 0.00 -2.87 0.00 0.00 58.31 53.95 2h3a n LYS 2 Cb 0.00 -0.17 -0.12 0.00 -1.84 0.00 0.00 35.03 32.90 2h3a n LYS 2 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 2h3a s GLN 3 N -3.21 2.45 -0.66 1.97 0.74 -1.26 -5.04 119.66 114.64 2h3a s GLN 3 Ca 0.24 -1.41 -0.27 0.00 0.05 0.00 0.00 55.36 53.97 2h3a s GLN 3 Cb -0.02 -3.53 0.02 0.00 1.10 0.00 0.00 33.01 30.59 2h3a s GLN 3 CO 0.16 -0.83 1.33 0.50 -0.55 0.00 0.00 175.29 175.90 2h3a s ARG 4 N 1.33 3.24 -0.18 1.67 3.52 -1.26 -4.97 118.95 122.30 2h3a s ARG 4 Ca 0.01 0.06 -0.07 0.00 -0.13 0.00 0.00 55.73 55.60 2h3a s ARG 4 Cb -0.21 -4.15 -0.04 0.00 -1.56 0.00 0.00 34.95 28.99 2h3a s ARG 4 CO 0.00 -2.05 0.06 0.96 -0.81 0.00 0.00 175.30 173.46 2h3a s ILE 5 N 5.86 4.74 -0.07 4.11 -4.36 -1.26 -5.09 121.20 125.13 2h3a s ILE 5 Ca 0.42 -0.05 0.01 0.00 -0.26 0.00 0.00 60.65 60.77 2h3a s ILE 5 Cb -0.09 -3.13 0.02 0.00 1.25 0.00 0.00 42.46 40.51 2h3a s ILE 5 CO 0.20 0.47 -0.08 0.28 0.24 0.00 0.00 174.94 176.04 2h3a s THR 6 N 0.34 0.88 -0.45 8.37 -1.32 -1.26 -5.10 115.64 117.09 2h3a s THR 6 Ca 0.03 -0.27 -0.16 0.00 -1.21 0.00 0.00 61.69 60.08 2h3a s THR 6 Cb -0.12 -0.87 0.06 0.00 -1.51 0.00 0.00 72.50 70.05 2h3a s THR 6 CO 0.00 0.32 0.38 0.54 -2.21 0.00 0.00 174.62 173.65 2h3a s VAL 7 N 1.15 5.22 -0.92 5.08 0.11 -1.26 -4.97 120.40 124.81 2h3a s VAL 7 Ca -0.06 -0.91 -0.22 0.00 -2.93 0.00 0.00 61.98 57.86 2h3a s VAL 7 Cb -0.14 -4.08 -0.13 0.00 -1.53 0.00 0.00 36.38 30.50 2h3a s VAL 7 CO -0.01 -0.51 1.92 0.35 -3.33 0.00 0.00 175.10 173.52 2h3a n THR 8 N 5.21 1.86 0.00 5.04 -2.24 -1.26 -4.84 114.28 118.06 2h3a n THR 8 Ca -0.12 -1.76 0.00 0.00 -2.27 0.00 0.00 64.05 59.91 2h3a n THR 8 Cb 0.45 -2.26 0.00 0.00 -2.10 0.00 0.00 70.33 66.42 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 6.70 0.00 -0.15 2.28 3.14 -1.26 -4.78 118.33 124.27 2h3a n VAL 9 Ca 0.48 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.86 2h3a n VAL 9 Cb 0.43 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.21 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 0.05 6.55 2.03 -1.26 -4.68 116.55 119.25 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 -1.20 -1.92 0.00 0.00 177.20 174.08 2h3a n SER 11 N 0.00 0.15 0.00 1.67 7.64 -1.26 -5.01 113.62 116.81 2h3a n SER 11 Ca 0.00 0.17 0.00 0.00 1.01 0.00 0.00 58.87 60.05 2h3a n SER 11 Cb 0.00 0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.26 2h3a n SER 11 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2h3a n ASP 12 N -3.08 0.00 -1.44 6.43 9.92 -1.26 -4.91 116.55 122.22 2h3a n ASP 12 Ca 0.00 0.00 -0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2h3a n ASP 12 Cb 0.10 0.00 0.01 0.00 -0.64 0.00 0.00 41.12 40.59 2h3a n ASP 12 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 2h3a n SER 13 N 0.00 -0.12 0.07 -2.24 2.88 -1.26 -5.04 113.62 107.92 2h3a n SER 13 Ca 0.00 -0.96 -0.23 0.00 -1.33 0.00 0.00 58.87 56.36 2h3a n SER 13 Cb 0.00 0.05 -0.15 0.00 -0.75 0.00 0.00 64.21 63.36 2h3a n SER 13 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 2h3a h TYR 14 N 0.07 0.68 -0.98 0.66 5.03 -1.98 -3.40 116.97 117.06 2h3a h TYR 14 Ca -0.04 -0.50 0.23 0.00 2.58 0.00 0.00 58.73 61.00 2h3a h TYR 14 Cb 0.96 -0.03 -0.12 0.00 1.55 0.00 0.00 36.73 39.09 2h3a h TYR 14 CO -0.19 1.55 0.55 1.96 -1.32 0.00 0.00 178.16 180.71 2h3a h GLN 15 N -0.08 0.55 0.07 1.82 1.08 -1.98 -2.21 115.11 114.36 2h3a h GLN 15 Ca -0.27 -0.03 0.01 0.00 -1.45 0.00 0.00 58.65 56.90 2h3a h GLN 15 Cb 1.94 -0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 29.23 2h3a h GLN 15 CO 0.17 0.36 -0.13 -0.07 -0.95 0.00 0.00 178.83 178.21 2h3a h LEU 16 N 0.57 -0.36 -1.23 1.46 3.38 -1.97 0.64 115.31 117.79 2h3a h LEU 16 Ca 0.62 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.61 2h3a h LEU 16 Cb 1.14 0.14 -0.03 0.00 0.09 0.00 0.00 40.66 42.01 2h3a h LEU 16 CO -0.47 -0.19 0.29 0.25 0.09 0.00 0.00 178.44 178.40 2h3a h LEU 17 N -0.26 0.74 -0.01 1.67 5.85 -1.64 0.28 115.31 121.94 2h3a h LEU 17 Ca 0.02 -0.07 -0.19 0.00 0.84 0.00 0.00 57.88 58.48 2h3a h LEU 17 Cb 0.28 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 2h3a h LEU 17 CO -0.08 0.62 -0.92 0.07 -0.34 0.00 0.00 178.44 177.79 2h3a h LYS 18 N 0.82 0.00 -0.01 1.25 2.10 -1.33 1.48 116.57 120.88 2h3a h LYS 18 Ca 0.21 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.68 2h3a h LYS 18 Cb 0.07 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.39 2h3a h LYS 18 CO -0.03 0.92 -0.80 0.00 -2.00 0.00 0.00 179.45 177.54 2h3a h ALA 19 N 1.08 0.62 0.13 0.07 0.00 0.10 -3.33 119.26 117.93 2h3a h ALA 19 Ca -0.01 -0.69 -0.32 0.00 0.00 0.00 0.00 54.91 53.89 2h3a h ALA 19 Cb 1.71 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.40 2h3a h ALA 19 CO 0.12 0.89 -1.70 0.10 0.00 0.00 0.00 179.25 178.67 2h3a h TYR 20 N 0.10 0.50 0.00 0.00 -0.00 -0.53 -3.48 116.97 113.55 2h3a h TYR 20 Ca -0.03 -0.36 0.00 0.00 -0.00 0.00 0.00 58.73 58.34 2h3a h TYR 20 Cb 1.40 -0.02 0.00 0.00 -0.00 0.00 0.00 36.73 38.11 2h3a h TYR 20 CO 0.02 1.67 0.00 -3.47 -0.00 0.00 0.00 178.16 176.38 2h3a n ASP 21 N -3.72 0.00 -3.14 0.10 2.03 -0.97 -5.11 116.55 105.74 2h3a n ASP 21 Ca -0.28 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 54.97 2h3a n ASP 21 Cb 0.98 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 41.36 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 -0.75 0.00 5.18 1.01 0.50 -4.98 120.40 121.36 2h3a s VAL 22 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.28 2h3a s VAL 22 Cb 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 36.38 36.14 2h3a s VAL 22 CO 0.00 -0.23 0.00 -0.46 0.00 0.00 0.00 175.10 174.41 2h3a n ASN 23 N 3.85 0.00 0.00 3.32 0.23 -1.17 -3.23 115.26 118.26 2h3a n ASN 23 Ca 0.14 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.19 2h3a n ASN 23 Cb 0.53 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.23 2h3a n ASN 23 CO 0.00 0.00 0.00 2.30 -0.93 0.00 0.00 177.26 178.63 2h3a n ILE 24 N 0.00 0.00 -0.20 1.53 -6.64 -1.26 -4.48 119.36 108.31 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 0.91 -0.06 0.00 -1.44 0.00 0.00 39.64 39.05 2h3a n ILE 24 CO 0.00 0.00 0.00 0.77 -1.77 0.00 0.00 176.55 175.55 2h3a h SER 25 N 0.00 -1.18 0.71 7.28 4.64 -2.00 0.26 113.55 123.27 2h3a h SER 25 Ca 0.00 0.17 -0.24 0.00 -0.47 0.00 0.00 61.79 61.26 2h3a h SER 25 Cb 0.48 0.52 -0.04 0.00 -0.31 0.00 0.00 62.40 63.05 2h3a h SER 25 CO 0.00 -0.15 -1.41 1.23 -0.87 0.00 0.00 176.83 175.63 2h3a h GLY 26 N -0.05 0.00 0.51 -0.77 0.00 -1.97 -3.29 103.07 97.49 2h3a h GLY 26 Ca 0.08 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.39 2h3a h GLY 26 CO -0.48 0.00 -0.41 -2.00 0.00 0.00 0.00 176.54 173.64 2h3a h LEU 27 N 0.00 -1.11 0.21 3.11 7.12 -1.72 0.66 115.31 123.58 2h3a h LEU 27 Ca -0.18 0.08 0.00 0.00 0.13 0.00 0.00 57.88 57.91 2h3a h LEU 27 Cb 1.85 0.35 -0.03 0.00 -0.53 0.00 0.00 40.66 42.29 2h3a h LEU 27 CO 0.09 -0.58 -0.44 0.58 -0.13 0.00 0.00 178.44 177.95 2h3a h VAL 28 N -0.90 0.00 -0.56 1.05 2.07 -0.67 1.44 116.25 118.68 2h3a h VAL 28 Ca -0.07 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.57 2h3a h VAL 28 Cb 0.75 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.43 2h3a h VAL 28 CO -0.00 0.00 -0.02 0.77 0.02 0.00 0.00 177.57 178.34 2h3a h SER 29 N -0.71 -0.29 0.06 0.57 4.64 -1.62 1.35 113.55 117.56 2h3a h SER 29 Ca -0.02 0.14 -0.00 0.00 -0.47 0.00 0.00 61.79 61.44 2h3a h SER 29 Cb 0.68 0.26 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 2h3a h SER 29 CO -0.18 -0.11 -0.03 0.74 -0.87 0.00 0.00 176.83 176.38 2h3a h THR 30 N 0.10 1.26 -0.66 2.95 2.02 0.63 -1.44 112.91 117.77 2h3a h THR 30 Ca 0.29 -1.21 0.10 0.00 0.77 0.00 0.00 66.41 66.36 2h3a h THR 30 Cb 0.45 2.03 -0.08 0.00 -1.74 0.00 0.00 68.15 68.81 2h3a h THR 30 CO -0.49 0.29 0.27 0.74 0.37 0.00 0.00 175.52 176.70 2h3a h THR 31 N -0.63 0.77 -0.00 3.16 2.02 0.24 0.95 112.91 119.41 2h3a h THR 31 Ca -0.01 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.01 2h3a h THR 31 Cb 0.54 0.27 -0.00 0.00 -1.74 0.00 0.00 68.15 67.22 2h3a h THR 31 CO 0.01 0.08 0.00 0.24 0.37 0.00 0.00 175.52 176.23 2h3a h MET 32 N 0.46 0.01 -0.71 6.66 2.86 0.18 1.22 114.93 125.61 2h3a h MET 32 Ca 0.34 -0.00 0.06 0.00 -2.06 0.00 0.00 59.70 58.04 2h3a h MET 32 Cb 0.42 -0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.02 2h3a h MET 32 CO -0.31 0.09 0.40 -0.56 1.06 0.00 0.00 176.91 177.58 2h3a h GLN 33 N -0.08 0.71 -0.12 1.72 -0.00 -0.47 2.64 115.11 119.52 2h3a h GLN 33 Ca 0.00 -0.04 -0.02 0.00 -0.00 0.00 0.00 58.65 58.59 2h3a h GLN 33 Cb 0.08 -0.16 -0.00 0.00 -0.00 0.00 0.00 27.48 27.40 2h3a h GLN 33 CO -0.00 0.47 0.00 -0.97 -0.00 0.00 0.00 178.83 178.33 2h3a h ASN 34 N 0.73 0.21 0.21 0.06 -1.24 -0.50 0.34 115.58 115.39 2h3a h ASN 34 Ca 0.32 -0.30 -0.05 0.00 0.71 0.00 0.00 56.30 56.98 2h3a h ASN 34 Cb 0.20 -0.06 -0.01 0.00 0.73 0.00 0.00 38.32 39.18 2h3a h ASN 34 CO -0.19 0.46 -0.22 -0.08 -1.29 0.00 0.00 177.43 176.12 2h3a h GLU 35 N -0.05 0.01 -0.02 6.67 4.57 0.23 0.28 114.58 126.26 2h3a h GLU 35 Ca 0.03 -0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.21 2h3a h GLU 35 Cb 0.35 -0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.94 2h3a h GLU 35 CO 0.01 0.22 -0.02 0.00 -1.18 0.00 0.00 179.01 178.04 2h3a h ALA 36 N 1.78 0.03 -0.12 2.92 0.00 0.50 1.43 119.26 125.81 2h3a h ALA 36 Ca -0.00 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.70 2h3a h ALA 36 Cb 0.39 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 2h3a h ALA 36 CO 0.03 -0.22 -0.12 0.00 0.00 0.00 0.00 179.25 178.94 2h3a h ARG 37 N -0.41 -0.15 0.72 0.00 2.47 0.15 -3.04 114.38 114.12 2h3a h ARG 37 Ca 0.00 0.01 -0.04 0.00 -1.26 0.00 0.00 59.98 58.70 2h3a h ARG 37 Cb 0.50 0.03 0.01 0.00 -1.65 0.00 0.00 29.97 28.86 2h3a h ARG 37 CO 0.00 -0.10 -0.35 0.00 0.56 0.00 0.00 179.97 180.09 2h3a h ARG 38 N -0.16 -0.94 -4.72 0.04 3.08 -0.39 -3.46 114.38 107.84 2h3a h ARG 38 Ca 0.08 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.20 2h3a h ARG 38 Cb 0.28 0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.54 2h3a h ARG 38 CO -0.21 -0.60 0.00 -0.11 -1.07 0.00 0.00 179.97 177.98 2h3a n LEU 39 N -5.46 0.00 0.00 3.04 0.00 0.49 -4.54 117.00 110.53 2h3a n LEU 39 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.88 2h3a n LEU 39 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.82 2h3a n LEU 39 CO 0.35 0.00 0.00 -2.11 0.00 0.00 0.00 177.39 175.63 2h3a n ARG 40 N -0.54 0.00 -5.05 1.96 -4.01 -1.26 -5.07 116.66 102.68 2h3a n ARG 40 Ca 0.00 0.00 -0.32 0.00 -1.04 0.00 0.00 57.85 56.49 2h3a n ARG 40 Cb 0.00 0.00 -0.15 0.00 -3.04 0.00 0.00 32.46 29.27 2h3a n ARG 40 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2h3a s ALA 41 N 0.00 2.40 -0.05 2.89 0.00 -1.26 -5.13 121.76 120.61 2h3a s ALA 41 Ca 0.00 -0.99 0.05 0.00 0.00 0.00 0.00 51.96 51.02 2h3a s ALA 41 Cb 0.00 -0.88 -0.00 0.00 0.00 0.00 0.00 23.12 22.24 2h3a s ALA 41 CO 0.00 0.41 -0.20 -1.21 0.00 0.00 0.00 175.76 174.77 2h3a s GLU 42 N -0.18 2.09 -0.10 0.00 8.01 -1.26 -5.13 118.70 122.14 2h3a s GLU 42 Ca -0.02 -0.70 -0.33 0.00 0.01 0.00 0.00 54.97 53.94 2h3a s GLU 42 Cb -0.14 -1.77 0.13 0.00 -4.31 0.00 0.00 34.13 28.04 2h3a s GLU 42 CO 0.03 0.26 1.25 0.50 0.01 0.00 0.00 175.26 177.32 2h3a s ARG 43 N 0.04 0.36 0.00 1.61 3.52 -1.26 -5.19 118.95 118.03 2h3a s ARG 43 Ca -0.06 -0.17 0.00 0.00 -0.13 0.00 0.00 55.73 55.37 2h3a s ARG 43 Cb -0.13 0.14 0.00 0.00 -1.56 0.00 0.00 34.95 33.40 2h3a s ARG 43 CO 0.03 -0.16 0.00 1.87 -0.81 0.00 0.00 175.30 176.23 2h3a n TRP 44 N -0.31 -0.74 -3.35 5.12 -0.00 -1.26 -5.11 117.44 111.79 2h3a n TRP 44 Ca -0.04 0.00 -0.38 0.00 -0.00 0.00 0.00 57.50 57.07 2h3a n TRP 44 Cb 0.61 0.00 -0.06 0.00 -0.00 0.00 0.00 31.31 31.86 2h3a n TRP 44 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 177.69 176.10 2h3a s LYS 45 N 1.11 4.14 -0.25 5.87 0.00 -1.26 -5.07 119.74 124.29 2h3a s LYS 45 Ca 0.00 0.56 -0.26 0.00 0.00 0.00 0.00 55.97 56.27 2h3a s LYS 45 Cb 0.00 -3.28 0.12 0.00 0.00 0.00 0.00 37.83 34.66 2h3a s LYS 45 CO 0.00 0.53 0.98 0.54 0.00 0.00 0.00 175.35 177.40 2h3a s VAL 46 N -0.63 0.00 0.39 1.79 0.11 -1.26 -5.16 120.40 115.64 2h3a s VAL 46 Ca 0.27 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.32 2h3a s VAL 46 Cb -0.17 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.68 2h3a s VAL 46 CO 0.15 0.00 0.00 1.21 -3.33 0.00 0.00 175.10 173.13 2h3a n GLU 47 N 1.95 -2.18 0.01 1.54 2.13 -1.26 -5.08 120.64 117.75 2h3a n GLU 47 Ca -0.12 1.75 0.00 0.00 0.66 0.00 0.00 57.16 59.44 2h3a n GLU 47 Cb 0.56 -2.56 0.00 0.00 0.27 0.00 0.00 31.44 29.71 2h3a n GLU 47 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2h3a n ASN 48 N -3.60 -0.13 -0.83 4.31 3.02 -1.26 -5.18 115.26 111.59 2h3a n ASN 48 Ca -0.05 0.08 0.11 0.00 -0.03 0.00 0.00 54.58 54.68 2h3a n ASN 48 Cb 0.45 0.27 -0.04 0.00 -0.61 0.00 0.00 39.78 39.85 2h3a n ASN 48 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2h3a n GLN 49 N -1.90 -1.83 -4.43 3.52 6.02 -1.26 -5.05 117.38 112.45 2h3a n GLN 49 Ca 0.00 1.40 -0.23 0.00 -0.01 0.00 0.00 57.00 58.16 2h3a n GLN 49 Cb 0.00 -2.18 -0.08 0.00 1.02 0.00 0.00 30.24 29.00 2h3a n GLN 49 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 2h3a s GLU 50 N -2.92 1.81 1.66 -1.09 1.03 -1.26 -5.12 118.70 112.81 2h3a s GLU 50 Ca 0.00 -2.07 0.00 0.00 0.03 0.00 0.00 54.97 52.93 2h3a s GLU 50 Cb 0.00 -0.32 0.00 0.00 -0.80 0.00 0.00 34.13 33.01 2h3a s GLU 50 CO 0.00 -0.49 0.00 0.41 -1.33 0.00 0.00 175.26 173.85 2h3a n GLY 51 N -0.77 -1.32 3.15 -3.83 0.00 -1.26 -4.96 105.19 96.20 2h3a n GLY 51 Ca -0.02 -1.18 -0.12 0.00 0.00 0.00 0.00 46.02 44.70 2h3a n GLY 51 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2h3a s MET 52 N 0.00 0.44 0.07 1.61 1.75 -1.26 -5.17 119.30 116.74 2h3a s MET 52 Ca 0.00 -0.02 0.08 0.00 -1.25 0.00 0.00 55.69 54.50 2h3a s MET 52 Cb 0.00 0.20 -0.03 0.00 2.84 0.00 0.00 34.83 37.84 2h3a s MET 52 CO 0.00 -0.10 -0.23 0.08 -0.65 0.00 0.00 175.02 174.13 2h3a s VAL 53 N -0.69 1.85 0.84 10.11 1.01 -1.26 -5.15 120.40 127.10 2h3a s VAL 53 Ca -0.08 -1.40 -0.10 0.00 0.00 0.00 0.00 61.98 60.40 2h3a s VAL 53 Cb -0.04 -1.62 0.19 0.00 0.00 0.00 0.00 36.38 34.90 2h3a s VAL 53 CO 0.02 0.15 1.15 1.21 0.00 0.00 0.00 175.10 177.63 2h3a n GLU 54 N 1.51 -0.82 0.00 2.72 0.00 -1.26 -5.12 120.64 117.68 2h3a n GLU 54 Ca -0.18 -2.18 0.00 0.00 0.00 0.00 0.00 57.16 54.80 2h3a n GLU 54 Cb 0.53 -1.06 0.00 0.00 0.00 0.00 0.00 31.44 30.91 2h3a n GLU 54 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 2h3a n VAL 55 N -3.40 0.00 0.00 6.31 0.31 -1.26 -4.90 118.33 115.39 2h3a n VAL 55 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.49 2h3a n VAL 55 Cb 0.55 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.48 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 0.00 -3.00 3.52 0.00 -1.26 -4.77 120.51 112.00 2h3a n ALA 56 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2h3a n ALA 56 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2h3a n ALA 56 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2h3a n ARG 57 N 0.00 0.00 0.00 0.00 0.00 -1.26 -5.12 116.66 110.28 2h3a n ARG 57 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2h3a n ARG 57 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 2h3a n ARG 57 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2h3a n PHE 58 N 0.00 0.00 -2.71 -0.14 -0.00 -1.26 -5.06 117.46 108.29 2h3a n PHE 58 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.45 57.26 2h3a n PHE 58 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.48 2h3a n PHE 58 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.76 175.87 2h3a n ILE 59 N 0.00 1.59 -1.32 -2.13 2.08 -1.26 -5.11 119.36 113.21 2h3a n ILE 59 Ca 0.00 -4.28 0.10 0.00 0.56 0.00 0.00 62.75 59.13 2h3a n ILE 59 Cb 0.00 -0.42 -0.05 0.00 -0.75 0.00 0.00 39.64 38.42 2h3a n ILE 59 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 2h3a n GLU 60 N -0.18 -2.83 -0.74 0.38 4.71 -1.26 -5.04 120.64 115.68 2h3a n GLU 60 Ca 0.25 2.28 0.00 0.00 -0.01 0.00 0.00 57.16 59.67 2h3a n GLU 60 Cb 0.68 -3.23 0.00 0.00 -1.01 0.00 0.00 31.44 27.89 2h3a n GLU 60 CO 0.00 0.00 0.00 -0.12 0.09 0.00 0.00 177.13 177.10 2h3a n MET 61 N -3.60 -2.01 -2.96 3.49 1.56 -1.26 -4.96 117.12 107.39 2h3a n MET 61 Ca -0.05 1.54 -0.33 0.00 -0.27 0.00 0.00 57.70 58.59 2h3a n MET 61 Cb 0.49 -1.86 -0.07 0.00 2.15 0.00 0.00 33.22 33.93 2h3a n MET 61 CO 0.00 0.00 0.00 -0.80 -0.73 0.00 0.00 175.97 174.44 2h3a s ASN 62 N -3.70 6.89 0.63 6.12 -0.87 -1.26 -5.05 114.94 117.70 2h3a s ASN 62 Ca 0.00 1.52 0.01 0.00 -1.57 0.00 0.00 52.86 52.82 2h3a s ASN 62 Cb 0.00 -2.47 0.08 0.00 -0.02 0.00 0.00 41.25 38.84 2h3a s ASN 62 CO 0.00 -0.28 0.88 -0.83 -2.57 0.00 0.00 177.10 174.30 2h3a s GLY 63 N -2.19 1.79 -0.29 0.66 0.00 -1.26 -5.13 107.32 100.91 2h3a s GLY 63 Ca 0.58 -1.60 -0.17 0.00 0.00 0.00 0.00 44.72 43.53 2h3a s GLY 63 CO 0.15 -1.16 0.89 -0.45 0.00 0.00 0.00 173.10 172.53 2h3a s SER 64 N -4.60 -0.64 0.26 1.64 0.15 -1.26 -5.16 113.70 104.09 2h3a s SER 64 Ca 0.62 1.04 0.00 0.00 0.70 0.00 0.00 55.95 58.31 2h3a s SER 64 Cb -0.07 1.24 0.00 0.00 -1.71 0.00 0.00 66.02 65.48 2h3a s SER 64 CO 0.41 -0.17 0.00 0.49 1.20 0.00 0.00 173.24 175.18 2h3a n PHE 65 N 3.76 -2.92 -0.01 3.44 3.01 -1.26 -5.09 117.46 118.39 2h3a n PHE 65 Ca -0.18 1.04 0.00 0.00 1.01 0.00 0.00 57.45 59.32 2h3a n PHE 65 Cb 0.58 -1.92 0.00 0.00 -0.01 0.00 0.00 39.48 38.13 2h3a n PHE 65 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2h3a n ALA 66 N -1.64 -0.22 0.19 4.37 0.00 -1.26 -5.12 120.51 116.83 2h3a n ALA 66 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2h3a n ALA 66 Cb 0.38 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.80 2h3a n ALA 66 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2h3a n ASP 67 N -0.03 -2.40 -2.93 0.00 5.68 -1.26 -5.17 116.55 110.44 2h3a n ASP 67 Ca 0.00 0.70 -0.16 0.00 -0.50 0.00 0.00 54.79 54.83 2h3a n ASP 67 Cb 0.00 2.34 -0.05 0.00 -1.14 0.00 0.00 41.12 42.27 2h3a n ASP 67 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2h3a n GLU 68 N -3.42 0.48 0.00 0.11 0.28 -1.26 -5.13 120.64 111.70 2h3a n GLU 68 Ca 0.00 -2.82 0.00 0.00 -0.16 0.00 0.00 57.16 54.18 2h3a n GLU 68 Cb 0.00 2.46 0.00 0.00 1.43 0.00 0.00 31.44 35.33 2h3a n GLU 68 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 2h3a n ASN 69 N -1.76 0.00 0.00 -1.84 0.23 -1.26 -5.07 115.26 105.56 2h3a n ASN 69 Ca 0.04 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.09 2h3a n ASN 69 Cb 0.54 0.12 0.00 0.00 -2.08 0.00 0.00 39.78 38.36 2h3a n ASN 69 CO 0.00 0.00 0.00 1.17 -0.93 0.00 0.00 177.26 177.50 2h3a n LYS 70 N -1.72 0.00 0.00 -3.83 0.00 -1.26 -5.06 118.16 106.29 2h3a n LYS 70 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.31 2h3a n LYS 70 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 2h3a n LYS 70 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2h3a n ASP 71 N -0.27 0.00 0.00 3.14 2.03 -1.26 -5.36 116.55 114.83 2h3a n ASP 71 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2h3a n ASP 71 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2h3a n ASP 71 CO 0.00 0.00 0.00 1.87 -1.92 0.00 0.00 177.20 177.15