#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 0.18 -0.21 2.12 1.02 -1.26 -5.14 119.74 116.46 2h3a s LYS 2 Ca 0.00 0.59 -0.01 0.00 0.02 0.00 0.00 55.97 56.57 2h3a s LYS 2 Cb 0.00 -0.10 0.01 0.00 -0.52 0.00 0.00 37.83 37.22 2h3a s LYS 2 CO 0.00 -0.20 -0.11 -1.14 -0.92 0.00 0.00 175.35 172.97 2h3a s GLN 3 N 1.60 3.07 -0.58 1.68 0.74 -1.26 -5.07 119.66 119.86 2h3a s GLN 3 Ca -0.06 -0.80 -0.28 0.00 0.05 0.00 0.00 55.36 54.27 2h3a s GLN 3 Cb -0.11 -2.82 0.03 0.00 1.10 0.00 0.00 33.01 31.21 2h3a s GLN 3 CO -0.08 -0.25 1.24 0.50 -0.55 0.00 0.00 175.29 176.14 2h3a s ARG 4 N 1.36 3.47 -0.38 1.67 3.52 -1.26 -4.96 118.95 122.36 2h3a s ARG 4 Ca 0.04 0.30 -0.11 0.00 -0.13 0.00 0.00 55.73 55.82 2h3a s ARG 4 Cb -0.14 -4.04 0.03 0.00 -1.56 0.00 0.00 34.95 29.24 2h3a s ARG 4 CO -0.08 -1.74 0.22 0.96 -0.81 0.00 0.00 175.30 173.85 2h3a s ILE 5 N 5.20 4.63 -0.19 4.11 -4.36 -1.26 -5.06 121.20 124.27 2h3a s ILE 5 Ca 0.45 -0.87 -0.01 0.00 -0.26 0.00 0.00 60.65 59.96 2h3a s ILE 5 Cb -0.08 -3.60 0.00 0.00 1.25 0.00 0.00 42.46 40.03 2h3a s ILE 5 CO 0.25 -0.26 -0.11 0.42 0.24 0.00 0.00 174.94 175.48 2h3a s THR 6 N 1.56 2.85 -0.45 8.37 -4.23 -1.26 -5.07 115.64 117.41 2h3a s THR 6 Ca 0.02 -0.68 -0.15 0.00 -1.18 0.00 0.00 61.69 59.70 2h3a s THR 6 Cb -0.19 -2.25 0.06 0.00 1.34 0.00 0.00 72.50 71.45 2h3a s THR 6 CO 0.07 0.48 0.37 0.54 -0.54 0.00 0.00 174.62 175.54 2h3a s VAL 7 N 1.20 5.21 -1.17 2.29 0.11 -1.26 -4.99 120.40 121.80 2h3a s VAL 7 Ca 0.02 -0.97 -0.23 0.00 -2.93 0.00 0.00 61.98 57.88 2h3a s VAL 7 Cb -0.14 -4.06 -0.08 0.00 -1.53 0.00 0.00 36.38 30.57 2h3a s VAL 7 CO -0.05 -0.51 1.93 0.42 -3.33 0.00 0.00 175.10 173.57 2h3a s THR 8 N 1.64 3.55 0.00 5.04 -4.23 -1.26 -4.89 115.64 115.50 2h3a s THR 8 Ca 0.04 -0.91 0.00 0.00 -1.18 0.00 0.00 61.69 59.65 2h3a s THR 8 Cb -0.23 -4.55 0.00 0.00 1.34 0.00 0.00 72.50 69.06 2h3a s THR 8 CO 0.07 -1.02 0.00 1.33 -0.54 0.00 0.00 174.62 174.47 2h3a n VAL 9 N 7.77 0.00 0.00 2.29 0.24 -1.26 -4.72 118.33 122.65 2h3a n VAL 9 Ca 0.45 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.75 2h3a n VAL 9 Cb 0.47 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.84 2h3a n VAL 9 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2h3a n ASP 10 N 0.00 0.00 0.06 -1.34 2.03 -1.26 -4.66 116.55 111.39 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 0.74 0.00 1.67 7.64 -1.26 -5.01 113.62 117.40 2h3a n SER 11 Ca 0.00 0.20 0.00 0.00 1.01 0.00 0.00 58.87 60.08 2h3a n SER 11 Cb 0.00 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 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 -3.43 0.00 -1.85 6.43 9.92 -1.26 -4.93 116.55 121.43 2h3a n ASP 12 Ca 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.25 2h3a n ASP 12 Cb 0.04 0.00 0.02 0.00 -0.64 0.00 0.00 41.12 40.54 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 0.00 -0.40 0.09 -2.24 7.64 -1.26 -5.03 113.62 112.42 2h3a n SER 13 Ca 0.00 -1.30 -0.23 0.00 1.01 0.00 0.00 58.87 58.35 2h3a n SER 13 Cb 0.00 0.25 -0.15 0.00 -1.01 0.00 0.00 64.21 63.30 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 0.33 0.77 -0.69 1.43 5.03 -1.98 -3.39 116.97 118.47 2h3a h TYR 14 Ca -0.15 -0.56 0.15 0.00 2.58 0.00 0.00 58.73 60.75 2h3a h TYR 14 Cb 1.08 -0.03 -0.11 0.00 1.55 0.00 0.00 36.73 39.23 2h3a h TYR 14 CO -0.18 1.54 0.12 1.96 -1.32 0.00 0.00 178.16 180.28 2h3a h GLN 15 N -0.03 0.21 -1.00 1.82 7.50 -1.98 -0.26 115.11 121.37 2h3a h GLN 15 Ca -0.26 -0.01 0.28 0.00 0.50 0.00 0.00 58.65 59.16 2h3a h GLN 15 Cb 1.99 -0.05 -0.05 0.00 0.05 0.00 0.00 27.48 29.43 2h3a h GLN 15 CO 0.20 0.14 0.71 1.25 -1.50 0.00 0.00 178.83 179.63 2h3a h LEU 16 N 0.22 0.06 0.05 1.46 6.46 -1.99 1.81 115.31 123.38 2h3a h LEU 16 Ca 0.38 0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 58.15 2h3a h LEU 16 Cb 0.63 -0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.56 2h3a h LEU 16 CO -0.51 0.02 -0.02 -0.07 -0.62 0.00 0.00 178.44 177.23 2h3a h LEU 17 N 0.05 -0.06 -1.34 2.25 3.38 -1.29 -3.34 115.31 114.97 2h3a h LEU 17 Ca 0.48 -0.44 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 2h3a h LEU 17 Cb 1.84 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.60 2h3a h LEU 17 CO -0.04 0.63 -0.25 0.07 0.09 0.00 0.00 178.44 178.95 2h3a h LYS 18 N -0.97 0.00 -0.69 1.13 2.10 -1.02 -1.85 116.57 115.27 2h3a h LYS 18 Ca -0.01 0.00 0.15 0.00 -2.00 0.00 0.00 60.65 58.79 2h3a h LYS 18 Cb 0.49 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.78 2h3a h LYS 18 CO 0.01 0.25 0.47 0.00 -2.00 0.00 0.00 179.45 178.18 2h3a h ALA 19 N 1.75 2.20 0.06 0.07 0.00 0.26 -2.07 119.26 121.54 2h3a h ALA 19 Ca -0.00 -0.01 -0.27 0.00 0.00 0.00 0.00 54.91 54.63 2h3a h ALA 19 Cb 0.65 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2h3a h ALA 19 CO 0.03 -0.39 -1.45 1.88 0.00 0.00 0.00 179.25 179.32 2h3a h TYR 20 N 0.32 0.22 0.00 0.00 0.05 -1.62 -3.49 116.97 112.45 2h3a h TYR 20 Ca 0.34 -0.16 0.00 0.00 0.05 0.00 0.00 58.73 58.95 2h3a h TYR 20 Cb 0.87 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.60 2h3a h TYR 20 CO -0.00 1.57 0.00 -0.25 -1.05 0.00 0.00 178.16 178.43 2h3a n ASP 21 N -4.08 0.00 -3.45 3.88 9.92 -0.78 -5.12 116.55 116.93 2h3a n ASP 21 Ca -0.30 0.00 -0.26 0.00 -0.53 0.00 0.00 54.79 53.70 2h3a n ASP 21 Cb 0.82 0.00 -0.09 0.00 -0.64 0.00 0.00 41.12 41.21 2h3a n ASP 21 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2h3a n VAL 22 N 0.00 0.89 -0.62 2.53 0.31 -0.73 -4.95 118.33 115.77 2h3a n VAL 22 Ca 0.00 -4.57 -0.05 0.00 -0.01 0.00 0.00 64.34 59.71 2h3a n VAL 22 Cb 0.00 -2.02 -0.07 0.00 -0.91 0.00 0.00 33.84 30.84 2h3a n VAL 22 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 2h3a n ASN 23 N 1.50 4.27 0.00 4.52 6.94 -1.26 -3.60 115.26 127.63 2h3a n ASN 23 Ca 0.26 -2.22 0.00 0.00 -0.02 0.00 0.00 54.58 52.60 2h3a n ASN 23 Cb 0.44 -1.04 0.00 0.00 -2.36 0.00 0.00 39.78 36.82 2h3a n ASN 23 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 2h3a n ILE 24 N 2.13 0.00 -0.21 1.53 -6.64 -1.26 -4.76 119.36 110.15 2h3a n ILE 24 Ca 0.19 0.00 -0.05 0.00 -1.77 0.00 0.00 62.75 61.11 2h3a n ILE 24 Cb 0.58 0.00 -0.05 0.00 -1.44 0.00 0.00 39.64 38.74 2h3a n ILE 24 CO 0.00 0.00 0.00 -1.54 -1.77 0.00 0.00 176.55 173.24 2h3a n SER 25 N 0.09 -0.52 0.11 7.28 3.41 -1.26 0.17 113.62 122.89 2h3a n SER 25 Ca 0.00 1.35 -0.01 0.00 -0.26 0.00 0.00 58.87 59.96 2h3a n SER 25 Cb 0.00 -0.35 -0.03 0.00 -0.26 0.00 0.00 64.21 63.57 2h3a n SER 25 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2h3a h GLY 26 N 0.00 0.00 0.61 5.00 0.00 -1.99 -3.32 103.07 103.37 2h3a h GLY 26 Ca 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.38 2h3a h GLY 26 CO -0.46 0.00 -0.29 -2.00 0.00 0.00 0.00 176.54 173.78 2h3a h LEU 27 N 0.00 -0.69 -0.19 3.11 5.85 -1.43 0.15 115.31 122.11 2h3a h LEU 27 Ca -0.02 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.75 2h3a h LEU 27 Cb 1.52 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 42.70 2h3a h LEU 27 CO 0.08 -0.36 -0.19 0.58 -0.34 0.00 0.00 178.44 178.22 2h3a h VAL 28 N -1.09 0.00 -1.00 1.05 2.07 0.15 1.47 116.25 118.90 2h3a h VAL 28 Ca -0.08 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.67 2h3a h VAL 28 Cb 0.63 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.30 2h3a h VAL 28 CO 0.14 0.00 0.63 0.28 0.02 0.00 0.00 177.57 178.64 2h3a h SER 29 N -0.10 0.55 0.35 0.57 0.02 -1.67 0.71 113.55 113.99 2h3a h SER 29 Ca 0.03 0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 2h3a h SER 29 Cb 0.18 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.72 2h3a h SER 29 CO -0.23 0.15 -0.17 0.74 -1.14 0.00 0.00 176.83 176.18 2h3a h THR 30 N 0.51 0.22 -0.63 -2.27 2.02 0.14 -2.85 112.91 110.05 2h3a h THR 30 Ca 0.57 -0.72 0.15 0.00 0.77 0.00 0.00 66.41 67.19 2h3a h THR 30 Cb 1.26 0.36 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 2h3a h THR 30 CO -0.32 0.05 0.44 0.74 0.37 0.00 0.00 175.52 176.80 2h3a h THR 31 N -1.07 0.75 0.42 3.16 2.02 0.23 -1.45 112.91 116.98 2h3a h THR 31 Ca -0.05 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 2h3a h THR 31 Cb 0.45 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 2h3a h THR 31 CO 0.08 0.03 -0.38 0.24 0.37 0.00 0.00 175.52 175.86 2h3a h MET 32 N 0.16 -0.78 -0.99 6.66 2.86 0.48 -1.37 114.93 121.94 2h3a h MET 32 Ca 0.30 0.05 0.26 0.00 -2.06 0.00 0.00 59.70 58.25 2h3a h MET 32 Cb 0.97 0.18 -0.07 0.00 0.06 0.00 0.00 31.60 32.73 2h3a h MET 32 CO -0.05 -0.52 0.67 0.37 1.06 0.00 0.00 176.91 178.44 2h3a h GLN 33 N -0.81 0.28 -0.02 1.72 4.15 -1.02 3.03 115.11 122.43 2h3a h GLN 33 Ca -0.04 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.34 2h3a h GLN 33 Cb 0.71 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.34 2h3a h GLN 33 CO -0.04 0.19 -0.07 -0.97 -1.93 0.00 0.00 178.83 176.01 2h3a h ASN 34 N 0.29 0.10 1.50 -0.69 -0.73 -1.33 0.63 115.58 115.34 2h3a h ASN 34 Ca 0.53 -0.61 0.00 0.00 1.87 0.00 0.00 56.30 58.08 2h3a h ASN 34 Cb 1.53 -0.03 0.00 0.00 0.27 0.00 0.00 38.32 40.09 2h3a h ASN 34 CO -0.18 0.69 0.00 -0.33 -0.37 0.00 0.00 177.43 177.25 2h3a h GLU 35 N -0.49 0.00 0.00 6.67 4.39 -0.07 -2.51 114.58 122.57 2h3a h GLU 35 Ca -0.00 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.42 2h3a h GLU 35 Cb 0.68 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.29 2h3a h GLU 35 CO 0.01 0.00 -1.56 0.00 -1.16 0.00 0.00 179.01 176.31 2h3a h ALA 36 N 2.47 0.69 0.12 3.43 0.00 0.55 -0.40 119.26 126.11 2h3a h ALA 36 Ca 0.00 -1.35 -0.01 0.00 0.00 0.00 0.00 54.91 53.56 2h3a h ALA 36 Cb 0.75 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2h3a h ALA 36 CO 0.00 1.51 -0.06 0.00 0.00 0.00 0.00 179.25 180.71 2h3a h ARG 37 N 0.00 -0.15 0.12 0.00 2.47 0.35 -3.37 114.38 113.80 2h3a h ARG 37 Ca -0.23 0.01 -0.30 0.00 -1.26 0.00 0.00 59.98 58.20 2h3a h ARG 37 Cb 1.96 0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 30.31 2h3a h ARG 37 CO 0.09 0.26 -1.47 0.00 0.56 0.00 0.00 179.97 179.40 2h3a h ARG 38 N -0.94 0.26 -3.94 0.04 3.08 -1.64 -3.48 114.38 107.76 2h3a h ARG 38 Ca -0.02 -0.44 -0.13 0.00 0.07 0.00 0.00 59.98 59.46 2h3a h ARG 38 Cb 0.48 0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 2h3a h ARG 38 CO 0.03 1.14 -0.16 1.28 -1.07 0.00 0.00 179.97 181.19 2h3a n LEU 39 N -3.47 -0.58 0.00 3.04 4.32 -0.16 -4.78 117.00 115.37 2h3a n LEU 39 Ca -0.15 0.31 0.00 0.00 -0.02 0.00 0.00 56.01 56.15 2h3a n LEU 39 Cb 1.04 -1.54 0.00 0.00 -1.62 0.00 0.00 43.42 41.30 2h3a n LEU 39 CO 0.51 -0.11 0.00 -1.14 -1.22 0.00 0.00 177.39 175.43 2h3a n ARG 40 N -2.45 0.00 0.08 3.23 0.00 -1.26 -5.05 116.66 111.20 2h3a n ARG 40 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.78 2h3a n ARG 40 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.96 2h3a n ARG 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2h3a n ALA 41 N 0.00 0.00 -1.31 5.13 0.00 -1.26 -5.16 120.51 117.90 2h3a n ALA 41 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.61 2h3a n ALA 41 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 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 -2.89 -2.76 0.16 0.00 0.00 -1.26 -5.02 120.64 108.87 2h3a n GLU 42 Ca 0.00 1.96 0.00 0.00 0.00 0.00 0.00 57.16 59.12 2h3a n GLU 42 Cb 0.00 -3.33 0.00 0.00 0.00 0.00 0.00 31.44 28.11 2h3a n GLU 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2h3a n ARG 43 N -4.06 0.00 -3.86 5.31 3.00 -1.26 -5.07 116.66 110.72 2h3a n ARG 43 Ca -0.02 0.00 -0.35 0.00 -0.01 0.00 0.00 57.85 57.48 2h3a n ARG 43 Cb 0.61 0.00 0.02 0.00 0.00 0.00 0.00 32.46 33.09 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 -3.41 -1.78 -3.64 -1.55 -0.00 -1.26 -4.98 117.44 100.82 2h3a n TRP 44 Ca 0.00 0.43 -0.16 0.00 -0.00 0.00 0.00 57.50 57.77 2h3a n TRP 44 Cb 0.00 -2.99 -0.07 0.00 -0.00 0.00 0.00 31.31 28.25 2h3a n TRP 44 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 177.69 177.90 2h3a s LYS 45 N -6.17 0.86 0.32 5.87 2.47 -1.26 -5.16 119.74 116.67 2h3a s LYS 45 Ca 0.32 0.04 -0.26 0.00 -1.56 0.00 0.00 55.97 54.51 2h3a s LYS 45 Cb -0.16 0.39 -0.10 0.00 -1.46 0.00 0.00 37.83 36.51 2h3a s LYS 45 CO 0.92 -0.25 0.95 0.54 0.16 0.00 0.00 175.35 177.67 2h3a s VAL 46 N -1.24 4.15 0.63 4.02 0.11 -1.26 -5.02 120.40 121.79 2h3a s VAL 46 Ca -0.12 1.81 -0.18 0.00 -2.93 0.00 0.00 61.98 60.56 2h3a s VAL 46 Cb -0.03 -4.02 -0.02 0.00 -1.53 0.00 0.00 36.38 30.79 2h3a s VAL 46 CO 0.07 0.17 1.26 -1.61 -3.33 0.00 0.00 175.10 171.66 2h3a s GLU 47 N -1.99 2.69 0.49 1.54 8.01 -1.26 -5.05 118.70 123.13 2h3a s GLU 47 Ca 0.50 1.97 0.01 0.00 0.01 0.00 0.00 54.97 57.46 2h3a s GLU 47 Cb -0.20 -1.87 0.01 0.00 -4.31 0.00 0.00 34.13 27.76 2h3a s GLU 47 CO 0.25 -1.46 0.11 -1.71 0.01 0.00 0.00 175.26 172.46 2h3a n ASN 48 N -1.82 3.11 0.00 -0.19 2.85 -1.26 -5.16 115.26 112.79 2h3a n ASN 48 Ca 0.15 -2.98 0.00 0.00 -0.11 0.00 0.00 54.58 51.64 2h3a n ASN 48 Cb 0.49 0.22 0.00 0.00 1.24 0.00 0.00 39.78 41.73 2h3a n ASN 48 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2h3a n GLN 49 N -1.34 0.00 -0.65 1.20 10.64 -1.26 -5.16 117.38 120.81 2h3a n GLN 49 Ca -0.14 0.00 0.09 0.00 -1.83 0.00 0.00 57.00 55.11 2h3a n GLN 49 Cb 0.59 0.00 -0.03 0.00 -0.86 0.00 0.00 30.24 29.95 2h3a n GLN 49 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 2h3a n GLU 50 N 0.00 -1.35 0.00 2.61 1.02 -1.26 -4.94 120.64 116.72 2h3a n GLU 50 Ca 0.00 0.94 0.00 0.00 -0.02 0.00 0.00 57.16 58.08 2h3a n GLU 50 Cb 0.00 -1.63 0.00 0.00 -0.02 0.00 0.00 31.44 29.79 2h3a n GLU 50 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2h3a n GLY 51 N -2.83 0.59 3.00 0.62 0.00 -1.26 -4.95 105.19 100.36 2h3a n GLY 51 Ca -0.01 -1.17 -0.12 0.00 0.00 0.00 0.00 46.02 44.72 2h3a n GLY 51 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2h3a n MET 52 N 0.00 -2.17 -2.14 1.61 0.00 -1.26 -5.01 117.12 108.15 2h3a n MET 52 Ca 0.00 1.91 -0.28 0.00 0.00 0.00 0.00 57.70 59.34 2h3a n MET 52 Cb 0.00 -5.06 0.15 0.00 0.00 0.00 0.00 33.22 28.31 2h3a n MET 52 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 175.97 176.11 2h3a s VAL 53 N -2.49 2.06 0.00 1.12 -7.23 -1.26 -5.07 120.40 107.52 2h3a s VAL 53 Ca 0.23 -0.19 0.00 0.00 -1.81 0.00 0.00 61.98 60.22 2h3a s VAL 53 Cb -0.06 -2.87 0.00 0.00 0.56 0.00 0.00 36.38 34.02 2h3a s VAL 53 CO 0.79 0.00 0.10 1.21 -0.31 0.00 0.00 175.10 176.89 2h3a n GLU 54 N -3.42 0.00 0.00 4.82 0.00 -1.26 -5.07 120.64 115.71 2h3a n GLU 54 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.30 2h3a n GLU 54 Cb 0.60 -0.54 0.00 0.00 0.00 0.00 0.00 31.44 31.50 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 -0.42 0.00 -1.32 6.31 0.31 -1.26 -5.14 118.33 116.82 2h3a n VAL 55 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2h3a n VAL 55 Cb 0.00 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 32.93 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 -2.94 -2.78 3.52 0.00 -1.26 -5.05 120.51 109.00 2h3a n ALA 56 Ca 0.00 0.14 -0.36 0.00 0.00 0.00 0.00 53.44 53.22 2h3a n ALA 56 Cb 0.00 -0.32 -0.08 0.00 0.00 0.00 0.00 19.45 19.05 2h3a n ALA 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2h3a s ARG 57 N -1.56 3.28 -0.30 0.00 3.52 -1.26 -5.07 118.95 117.57 2h3a s ARG 57 Ca -0.01 -0.30 -0.11 0.00 -0.13 0.00 0.00 55.73 55.19 2h3a s ARG 57 Cb 0.00 -3.00 0.18 0.00 -1.56 0.00 0.00 34.95 30.58 2h3a s ARG 57 CO 0.03 0.68 1.02 0.12 -0.81 0.00 0.00 175.30 176.34 2h3a s PHE 58 N -0.77 -0.57 -1.22 5.12 2.19 -1.26 -5.09 117.98 116.38 2h3a s PHE 58 Ca 0.13 0.40 -0.12 0.00 0.33 0.00 0.00 56.93 57.66 2h3a s PHE 58 Cb -0.12 0.12 0.18 0.00 -1.31 0.00 0.00 43.02 41.90 2h3a s PHE 58 CO 0.03 -0.32 1.52 -0.89 1.83 0.00 0.00 175.22 177.39 2h3a n ILE 59 N 5.23 4.32 -3.74 3.12 2.08 -1.26 -4.92 119.36 124.19 2h3a n ILE 59 Ca 0.04 -4.72 -0.08 0.00 0.56 0.00 0.00 62.75 58.55 2h3a n ILE 59 Cb 0.56 -2.44 -0.02 0.00 -0.75 0.00 0.00 39.64 37.00 2h3a n ILE 59 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 2h3a s GLU 60 N 1.00 1.58 0.28 0.38 -6.30 -1.26 -5.16 118.70 109.23 2h3a s GLU 60 Ca 0.41 -0.82 0.00 0.00 -2.50 0.00 0.00 54.97 52.06 2h3a s GLU 60 Cb -0.00 0.58 0.00 0.00 0.00 0.00 0.00 34.13 34.71 2h3a s GLU 60 CO 0.00 -0.72 0.00 -1.33 0.02 0.00 0.00 175.26 173.23 2h3a n MET 61 N -0.44 -1.37 -3.83 4.30 2.81 -1.26 -5.07 117.12 112.26 2h3a n MET 61 Ca -0.07 0.90 -0.07 0.00 -1.81 0.00 0.00 57.70 56.65 2h3a n MET 61 Cb 0.61 -1.67 0.03 0.00 -0.71 0.00 0.00 33.22 31.47 2h3a n MET 61 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 2h3a s ASN 62 N -4.59 0.03 0.00 7.83 0.02 -1.26 -5.18 114.94 111.79 2h3a s ASN 62 Ca 0.00 -1.08 0.00 0.00 -1.02 0.00 0.00 52.86 50.76 2h3a s ASN 62 Cb 0.00 0.77 0.00 0.00 0.02 0.00 0.00 41.25 42.04 2h3a s ASN 62 CO 0.00 -1.55 0.00 0.61 0.02 0.00 0.00 177.10 176.18 2h3a n GLY 63 N -0.59 2.82 2.54 0.66 0.00 -1.26 -5.00 105.19 104.36 2h3a n GLY 63 Ca -0.07 -2.02 -0.27 0.00 0.00 0.00 0.00 46.02 43.66 2h3a n GLY 63 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2h3a n SER 64 N 0.00 1.49 -3.65 1.61 7.64 -1.26 -5.05 113.62 114.40 2h3a n SER 64 Ca 0.00 -2.88 -0.03 0.00 1.01 0.00 0.00 58.87 56.97 2h3a n SER 64 Cb 0.00 -0.66 -0.06 0.00 -1.01 0.00 0.00 64.21 62.49 2h3a n SER 64 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 2h3a s PHE 65 N -1.05 -1.19 0.70 1.43 2.19 -1.26 -5.17 117.98 113.62 2h3a s PHE 65 Ca 0.32 2.12 -0.04 0.00 0.33 0.00 0.00 56.93 59.65 2h3a s PHE 65 Cb 0.05 0.67 0.09 0.00 -1.31 0.00 0.00 43.02 42.52 2h3a s PHE 65 CO -0.15 -0.61 0.98 0.00 1.83 0.00 0.00 175.22 177.27 2h3a s ALA 66 N 2.77 3.41 0.17 11.12 0.00 -1.26 -5.01 121.76 132.96 2h3a s ALA 66 Ca -0.05 -1.31 0.00 0.00 0.00 0.00 0.00 51.96 50.60 2h3a s ALA 66 Cb -0.12 -2.30 0.00 0.00 0.00 0.00 0.00 23.12 20.70 2h3a s ALA 66 CO -0.17 -1.34 0.00 -3.47 0.00 0.00 0.00 175.76 170.78 2h3a n ASP 67 N -2.84 -1.55 0.00 0.00 -0.08 -1.26 -5.15 116.55 105.67 2h3a n ASP 67 Ca 0.11 0.42 0.00 0.00 -1.51 0.00 0.00 54.79 53.81 2h3a n ASP 67 Cb 0.60 1.67 0.00 0.00 2.34 0.00 0.00 41.12 45.74 2h3a n ASP 67 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 2h3a n GLU 68 N -2.85 0.00 -1.41 -0.67 2.13 -1.26 -4.91 120.64 111.67 2h3a n GLU 68 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2h3a n GLU 68 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 2h3a n GLU 68 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 2h3a n ASN 69 N 4.16 -1.87 0.00 4.31 2.85 -1.26 -5.06 115.26 118.39 2h3a n ASN 69 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2h3a n ASN 69 Cb 0.00 -0.94 0.00 0.00 1.24 0.00 0.00 39.78 40.08 2h3a n ASN 69 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2h3a n LYS 70 N 0.05 0.00 0.00 1.20 4.76 -1.26 -5.06 118.16 117.85 2h3a n LYS 70 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2h3a n LYS 70 Cb 0.00 -0.18 0.00 0.00 -1.84 0.00 0.00 35.03 33.01 2h3a n LYS 70 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2h3a n ASP 71 N -1.62 0.00 0.00 4.39 2.03 -1.26 -5.22 116.55 114.87 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