#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 -2.37 -3.87 3.17 4.01 -1.26 -4.96 118.16 112.88 2h3a n LYS 2 Ca 0.00 1.84 -0.28 0.00 -0.51 0.00 0.00 58.31 59.36 2h3a n LYS 2 Cb 0.00 -2.31 -0.16 0.00 -0.51 0.00 0.00 35.03 32.05 2h3a n LYS 2 CO 0.00 0.00 0.00 -1.14 -1.11 0.00 0.00 177.40 175.15 2h3a s GLN 3 N -4.81 1.29 -0.47 1.97 0.74 -1.26 -5.09 119.66 112.04 2h3a s GLN 3 Ca 0.00 -0.59 -0.29 0.00 0.05 0.00 0.00 55.36 54.53 2h3a s GLN 3 Cb 0.00 -2.13 0.03 0.00 1.10 0.00 0.00 33.01 32.00 2h3a s GLN 3 CO 0.00 -0.51 1.21 0.50 -0.55 0.00 0.00 175.29 175.94 2h3a s ARG 4 N 1.63 3.67 -0.39 1.67 3.52 -1.26 -4.97 118.95 122.82 2h3a s ARG 4 Ca -0.01 0.64 -0.13 0.00 -0.13 0.00 0.00 55.73 56.10 2h3a s ARG 4 Cb -0.16 -3.94 0.03 0.00 -1.56 0.00 0.00 34.95 29.31 2h3a s ARG 4 CO -0.07 -1.45 0.25 0.96 -0.81 0.00 0.00 175.30 174.18 2h3a s ILE 5 N 4.74 4.87 -0.21 4.11 -4.36 -1.26 -5.04 121.20 124.05 2h3a s ILE 5 Ca 0.51 -0.80 -0.00 0.00 -0.26 0.00 0.00 60.65 60.10 2h3a s ILE 5 Cb -0.09 -3.73 0.02 0.00 1.25 0.00 0.00 42.46 39.91 2h3a s ILE 5 CO 0.32 -0.28 -0.13 -0.89 0.24 0.00 0.00 174.94 174.19 2h3a s THR 6 N 1.60 2.52 -0.44 8.37 2.01 -1.26 -5.07 115.64 123.37 2h3a s THR 6 Ca 0.03 -0.89 -0.14 0.00 0.31 0.00 0.00 61.69 61.00 2h3a s THR 6 Cb -0.19 -2.15 0.06 0.00 0.01 0.00 0.00 72.50 70.23 2h3a s THR 6 CO 0.08 0.42 0.34 0.54 -0.69 0.00 0.00 174.62 175.31 2h3a s VAL 7 N 1.33 4.98 -1.20 3.82 0.11 -1.26 -5.00 120.40 123.18 2h3a s VAL 7 Ca 0.03 -1.06 -0.22 0.00 -2.93 0.00 0.00 61.98 57.80 2h3a s VAL 7 Cb -0.14 -3.94 -0.07 0.00 -1.53 0.00 0.00 36.38 30.69 2h3a s VAL 7 CO -0.09 -0.50 1.91 0.35 -3.33 0.00 0.00 175.10 173.45 2h3a n THR 8 N 5.12 2.14 0.00 5.04 -2.24 -1.26 -4.91 114.28 118.17 2h3a n THR 8 Ca -0.12 -2.22 0.00 0.00 -2.27 0.00 0.00 64.05 59.44 2h3a n THR 8 Cb 0.44 -2.19 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 1.33 -0.57 0.00 0.00 175.07 175.83 2h3a n VAL 9 N 7.64 0.00 0.00 2.28 0.24 -1.26 -4.57 118.33 122.66 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 0.46 -1.10 0.00 0.00 -1.47 0.00 0.00 33.84 31.73 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 -0.15 -1.34 -0.08 -1.26 -4.68 116.55 109.04 2h3a n ASP 10 Ca 0.00 0.00 0.02 0.00 -1.51 0.00 0.00 54.79 53.30 2h3a n ASP 10 Cb 0.00 0.00 0.01 0.00 2.34 0.00 0.00 41.12 43.47 2h3a n ASP 10 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2h3a n SER 11 N 0.09 1.18 0.00 1.67 7.64 -1.26 -4.93 113.62 118.00 2h3a n SER 11 Ca 0.00 -1.09 0.00 0.00 1.01 0.00 0.00 58.87 58.79 2h3a n SER 11 Cb 0.00 0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 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 0.03 0.00 -0.69 6.43 9.92 -1.26 -5.08 116.55 125.89 2h3a n ASP 12 Ca 0.02 0.00 -0.02 0.00 -0.53 0.00 0.00 54.79 54.26 2h3a n ASP 12 Cb 0.10 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.56 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 -0.31 -0.08 -2.24 7.64 -1.26 -5.01 113.62 112.36 2h3a n SER 13 Ca 0.00 -0.64 -0.13 0.00 1.01 0.00 0.00 58.87 59.11 2h3a n SER 13 Cb 0.00 0.10 -0.00 0.00 -1.01 0.00 0.00 64.21 63.29 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 0.01 1.03 -0.61 1.43 5.03 -1.97 -3.31 116.97 118.57 2h3a h TYR 14 Ca -0.17 -0.33 0.13 0.00 2.58 0.00 0.00 58.73 60.93 2h3a h TYR 14 Cb 0.79 -0.21 -0.10 0.00 1.55 0.00 0.00 36.73 38.76 2h3a h TYR 14 CO -0.06 1.14 0.02 1.96 -1.32 0.00 0.00 178.16 179.90 2h3a h GLN 15 N 0.67 0.13 -0.94 1.82 4.20 -1.98 -0.80 115.11 118.22 2h3a h GLN 15 Ca 0.04 -0.01 0.27 0.00 0.06 0.00 0.00 58.65 59.01 2h3a h GLN 15 Cb 1.04 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.75 2h3a h GLN 15 CO 0.10 0.09 0.73 1.25 -0.67 0.00 0.00 178.83 180.33 2h3a h LEU 16 N 0.14 0.00 0.09 1.46 6.46 -1.98 1.53 115.31 123.01 2h3a h LEU 16 Ca 0.32 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 58.08 2h3a h LEU 16 Cb 0.52 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.45 2h3a h LEU 16 CO -0.51 0.00 -0.04 -0.07 -0.62 0.00 0.00 178.44 177.20 2h3a h LEU 17 N 0.00 -0.10 -2.12 2.25 3.38 -1.35 -3.33 115.31 114.03 2h3a h LEU 17 Ca 0.45 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.40 2h3a h LEU 17 Cb 1.90 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 42.67 2h3a h LEU 17 CO -0.00 0.38 -0.07 0.07 0.09 0.00 0.00 178.44 178.90 2h3a h LYS 18 N -1.02 0.00 -0.40 1.13 2.10 -1.25 -1.37 116.57 115.76 2h3a h LYS 18 Ca -0.01 0.00 0.12 0.00 -2.00 0.00 0.00 60.65 58.75 2h3a h LYS 18 Cb 0.09 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.40 2h3a h LYS 18 CO 0.02 0.07 0.37 0.00 -2.00 0.00 0.00 179.45 177.91 2h3a h ALA 19 N 1.93 2.17 0.00 0.07 0.00 0.21 -1.77 119.26 121.86 2h3a h ALA 19 Ca -0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 2h3a h ALA 19 Cb 0.19 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2h3a h ALA 19 CO 0.01 -0.57 -0.94 1.88 0.00 0.00 0.00 179.25 179.62 2h3a h TYR 20 N 0.00 0.00 0.00 0.00 0.05 -1.39 -3.49 116.97 112.14 2h3a h TYR 20 Ca 0.19 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.97 2h3a h TYR 20 Cb 0.92 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.66 2h3a h TYR 20 CO 0.00 1.10 0.00 -0.40 -1.05 0.00 0.00 178.16 177.81 2h3a n ASP 21 N -4.50 0.00 -3.50 3.88 5.75 -0.66 -5.14 116.55 112.38 2h3a n ASP 21 Ca -0.24 0.00 -0.29 0.00 -0.01 0.00 0.00 54.79 54.25 2h3a n ASP 21 Cb 0.56 0.00 -0.12 0.00 -1.03 0.00 0.00 41.12 40.52 2h3a n ASP 21 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2h3a s VAL 22 N 0.00 0.38 -0.12 2.12 0.11 -1.21 -4.98 120.40 116.69 2h3a s VAL 22 Ca 0.00 -1.92 -0.05 0.00 -2.93 0.00 0.00 61.98 57.08 2h3a s VAL 22 Cb 0.00 -1.28 -0.21 0.00 -1.53 0.00 0.00 36.38 33.36 2h3a s VAL 22 CO 0.00 -0.99 3.08 0.59 -3.33 0.00 0.00 175.10 174.46 2h3a n ASN 23 N 3.88 4.66 0.00 3.54 4.13 -1.26 -3.49 115.26 126.71 2h3a n ASN 23 Ca 0.13 -2.34 0.00 0.00 1.68 0.00 0.00 54.58 54.05 2h3a n ASN 23 Cb 0.37 -1.21 0.00 0.00 -1.54 0.00 0.00 39.78 37.40 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 2.69 0.00 -0.24 2.41 -6.64 -1.26 -4.76 119.36 111.56 2h3a n ILE 24 Ca 0.39 0.00 -0.06 0.00 -1.77 0.00 0.00 62.75 61.31 2h3a n ILE 24 Cb 0.72 0.00 -0.06 0.00 -1.44 0.00 0.00 39.64 38.86 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 1.04 -0.60 0.16 7.28 3.41 -1.26 0.19 113.62 123.84 2h3a n SER 25 Ca 0.00 1.31 0.04 0.00 -0.26 0.00 0.00 58.87 59.96 2h3a n SER 25 Cb 0.00 -0.28 0.16 0.00 -0.26 0.00 0.00 64.21 63.83 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 0.71 5.00 0.00 -1.99 -3.31 103.07 103.48 2h3a h GLY 26 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.39 2h3a h GLY 26 CO -0.53 0.00 -0.34 -2.00 0.00 0.00 0.00 176.54 173.67 2h3a h LEU 27 N 0.00 -0.80 0.00 3.11 7.12 -0.68 -1.58 115.31 122.47 2h3a h LEU 27 Ca -0.00 0.03 0.00 0.00 0.13 0.00 0.00 57.88 58.03 2h3a h LEU 27 Cb 1.18 0.21 0.00 0.00 -0.53 0.00 0.00 40.66 41.52 2h3a h LEU 27 CO 0.06 -0.43 0.00 0.52 -0.13 0.00 0.00 178.44 178.46 2h3a n VAL 28 N -5.35 0.00 -0.29 1.05 0.31 0.50 0.12 118.33 114.68 2h3a n VAL 28 Ca -0.12 1.42 0.25 0.00 -0.01 0.00 0.00 64.34 65.88 2h3a n VAL 28 Cb 0.37 -1.97 0.58 0.00 -0.91 0.00 0.00 33.84 31.91 2h3a n VAL 28 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2h3a h SER 29 N 0.00 0.30 0.05 4.52 4.64 -1.68 0.12 113.55 121.50 2h3a h SER 29 Ca 0.00 0.05 -0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2h3a h SER 29 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2h3a h SER 29 CO 0.00 0.07 -0.03 0.74 -0.87 0.00 0.00 176.83 176.75 2h3a h THR 30 N 0.27 1.26 -0.27 2.95 2.02 0.10 -3.18 112.91 116.07 2h3a h THR 30 Ca 0.55 -1.57 0.08 0.00 0.77 0.00 0.00 66.41 66.24 2h3a h THR 30 Cb 1.62 2.22 -0.01 0.00 -1.74 0.00 0.00 68.15 70.24 2h3a h THR 30 CO -0.19 0.36 0.22 0.74 0.37 0.00 0.00 175.52 177.03 2h3a h THR 31 N -0.83 0.71 0.03 3.16 2.02 0.18 -2.19 112.91 115.98 2h3a h THR 31 Ca -0.01 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.20 2h3a h THR 31 Cb 0.65 0.84 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 2h3a h THR 31 CO 0.01 0.00 -0.27 0.24 0.37 0.00 0.00 175.52 175.87 2h3a h MET 32 N 0.00 -0.42 -0.55 6.66 2.86 -0.78 0.57 114.93 123.27 2h3a h MET 32 Ca 0.13 0.03 0.09 0.00 -2.06 0.00 0.00 59.70 57.89 2h3a h MET 32 Cb 0.57 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.29 2h3a h MET 32 CO -0.00 -0.28 0.37 -0.56 1.06 0.00 0.00 176.91 177.51 2h3a h GLN 33 N -0.43 0.35 0.01 1.72 -0.00 -1.44 2.28 115.11 117.58 2h3a h GLN 33 Ca 0.05 -0.02 -0.06 0.00 -0.00 0.00 0.00 58.65 58.62 2h3a h GLN 33 Cb 0.50 -0.08 0.01 0.00 -0.00 0.00 0.00 27.48 27.91 2h3a h GLN 33 CO -0.21 0.23 -0.25 -0.97 -0.00 0.00 0.00 178.83 177.62 2h3a h ASN 34 N 0.36 0.21 0.24 0.06 -0.73 -1.33 -0.91 115.58 113.47 2h3a h ASN 34 Ca 0.25 -0.80 -0.08 0.00 1.87 0.00 0.00 56.30 57.54 2h3a h ASN 34 Cb 0.53 -0.07 -0.01 0.00 0.27 0.00 0.00 38.32 39.04 2h3a h ASN 34 CO -0.06 0.99 -0.34 -0.08 -0.37 0.00 0.00 177.43 177.57 2h3a h GLU 35 N -0.54 0.15 -0.21 6.67 4.57 0.88 -0.85 114.58 125.26 2h3a h GLU 35 Ca -0.03 -0.06 -0.20 0.00 -1.18 0.00 0.00 59.36 57.88 2h3a h GLU 35 Cb 1.03 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.62 2h3a h GLU 35 CO 0.05 0.48 -0.67 0.00 -1.18 0.00 0.00 179.01 177.69 2h3a h ALA 36 N 1.52 0.41 0.31 2.92 0.00 0.38 1.39 119.26 126.19 2h3a h ALA 36 Ca 0.02 -0.56 -0.02 0.00 0.00 0.00 0.00 54.91 54.35 2h3a h ALA 36 Cb 0.66 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2h3a h ALA 36 CO 0.05 0.69 -0.15 0.00 0.00 0.00 0.00 179.25 179.84 2h3a h ARG 37 N 0.58 -0.40 0.14 0.00 2.47 -0.92 -3.35 114.38 112.90 2h3a h ARG 37 Ca -0.02 0.03 -0.29 0.00 -1.26 0.00 0.00 59.98 58.44 2h3a h ARG 37 Cb 1.28 0.09 0.02 0.00 -1.65 0.00 0.00 29.97 29.71 2h3a h ARG 37 CO 0.14 -0.08 -1.26 0.00 0.56 0.00 0.00 179.97 179.33 2h3a h ARG 38 N -0.93 0.42 -6.74 0.04 2.47 -1.25 -3.49 114.38 104.90 2h3a h ARG 38 Ca -0.04 -0.64 -0.47 0.00 -1.26 0.00 0.00 59.98 57.56 2h3a h ARG 38 Cb 0.51 0.23 -0.01 0.00 -1.65 0.00 0.00 29.97 29.05 2h3a h ARG 38 CO 0.07 1.29 -0.95 1.28 0.56 0.00 0.00 179.97 182.22 2h3a n LEU 39 N -3.65 -0.99 -3.59 3.04 4.77 0.48 -4.96 117.00 112.08 2h3a n LEU 39 Ca -0.11 -0.98 -0.03 0.00 -0.03 0.00 0.00 56.01 54.87 2h3a n LEU 39 Cb 1.01 -1.39 -0.05 0.00 -2.33 0.00 0.00 43.42 40.66 2h3a n LEU 39 CO 0.56 0.51 0.46 -0.60 -1.33 0.00 0.00 177.39 176.99 2h3a s ARG 40 N -5.61 0.51 -0.20 3.23 3.52 -1.26 -5.04 118.95 114.09 2h3a s ARG 40 Ca 0.17 1.05 -0.03 0.00 -0.13 0.00 0.00 55.73 56.78 2h3a s ARG 40 Cb -0.09 0.38 -0.10 0.00 -1.56 0.00 0.00 34.95 33.58 2h3a s ARG 40 CO 0.81 -0.14 1.87 0.00 -0.81 0.00 0.00 175.30 177.04 2h3a n ALA 41 N 4.60 3.51 -3.20 6.12 0.00 -1.26 -4.79 120.51 125.49 2h3a n ALA 41 Ca -0.15 -1.01 -0.34 0.00 0.00 0.00 0.00 53.44 51.94 2h3a n ALA 41 Cb 0.55 -2.45 -0.14 0.00 0.00 0.00 0.00 19.45 17.41 2h3a n ALA 41 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2h3a s GLU 42 N 2.58 3.42 0.00 0.00 2.02 -1.26 -5.08 118.70 120.38 2h3a s GLU 42 Ca 0.30 -0.65 0.00 0.00 0.02 0.00 0.00 54.97 54.64 2h3a s GLU 42 Cb 0.12 -2.77 0.00 0.00 0.10 0.00 0.00 34.13 31.58 2h3a s GLU 42 CO -0.01 0.10 0.00 0.54 0.02 0.00 0.00 175.26 175.91 2h3a n ARG 43 N 3.88 -0.61 -3.56 1.61 1.74 -1.26 -5.16 116.66 113.30 2h3a n ARG 43 Ca -0.18 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 56.82 2h3a n ARG 43 Cb 0.52 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.94 2h3a n ARG 43 CO 0.00 0.00 0.00 1.67 -1.52 0.00 0.00 177.63 177.78 2h3a s TRP 44 N -2.00 -0.32 -0.16 -1.55 -2.14 -1.26 -5.18 118.94 106.33 2h3a s TRP 44 Ca 0.00 0.12 -0.14 0.00 2.66 0.00 0.00 56.10 58.74 2h3a s TRP 44 Cb 0.00 0.57 0.04 0.00 -3.10 0.00 0.00 33.47 30.98 2h3a s TRP 44 CO 0.00 -0.68 0.41 -1.59 -2.66 0.00 0.00 176.95 172.43 2h3a s LYS 45 N -3.29 0.48 -0.05 3.25 0.00 -1.26 -5.16 119.74 113.72 2h3a s LYS 45 Ca 0.06 0.59 -0.02 0.00 0.00 0.00 0.00 55.97 56.61 2h3a s LYS 45 Cb -0.01 0.22 0.03 0.00 0.00 0.00 0.00 37.83 38.07 2h3a s LYS 45 CO -0.06 -0.07 0.08 0.14 0.00 0.00 0.00 175.35 175.44 2h3a s VAL 46 N 0.31 -0.11 -0.04 1.79 -7.23 -1.26 -5.15 120.40 108.71 2h3a s VAL 46 Ca -0.01 0.30 0.06 0.00 -1.81 0.00 0.00 61.98 60.52 2h3a s VAL 46 Cb -0.03 -0.17 -0.01 0.00 0.56 0.00 0.00 36.38 36.73 2h3a s VAL 46 CO -0.00 0.12 -0.23 -1.83 -0.31 0.00 0.00 175.10 172.85 2h3a s GLU 47 N 1.64 2.14 -0.09 4.82 1.03 -1.26 -5.14 118.70 121.84 2h3a s GLU 47 Ca -0.03 -0.81 -0.16 0.00 0.03 0.00 0.00 54.97 54.01 2h3a s GLU 47 Cb -0.12 -1.90 0.04 0.00 -0.80 0.00 0.00 34.13 31.34 2h3a s GLU 47 CO -0.04 0.39 0.39 1.21 -1.33 0.00 0.00 175.26 175.88 2h3a s ASN 48 N -0.25 -0.35 -0.18 0.83 2.47 -1.26 -5.17 114.94 111.04 2h3a s ASN 48 Ca 0.01 0.51 -0.21 0.00 0.42 0.00 0.00 52.86 53.59 2h3a s ASN 48 Cb -0.12 0.60 0.05 0.00 -1.45 0.00 0.00 41.25 40.34 2h3a s ASN 48 CO 0.02 -0.30 0.57 0.00 -3.72 0.00 0.00 177.10 173.66 2h3a s GLN 49 N -0.53 0.72 0.00 0.43 -2.07 -1.26 -5.04 119.66 111.91 2h3a s GLN 49 Ca -0.06 0.64 0.00 0.00 -1.82 0.00 0.00 55.36 54.12 2h3a s GLN 49 Cb -0.04 0.35 0.00 0.00 -1.09 0.00 0.00 33.01 32.23 2h3a s GLN 49 CO 0.03 -0.12 0.00 -0.85 -1.32 0.00 0.00 175.29 173.03 2h3a n GLU 50 N 2.40 0.00 -3.63 9.60 -0.00 -1.26 -5.16 120.64 122.60 2h3a n GLU 50 Ca -0.15 0.00 -0.10 0.00 -0.00 0.00 0.00 57.16 56.91 2h3a n GLU 50 Cb 0.56 0.00 -0.07 0.00 -0.00 0.00 0.00 31.44 31.93 2h3a n GLU 50 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 2h3a s GLY 51 N -1.35 -0.24 -0.29 -1.84 0.00 -1.26 -5.17 107.32 97.17 2h3a s GLY 51 Ca 0.00 2.46 -0.22 0.00 0.00 0.00 0.00 44.72 46.96 2h3a s GLY 51 CO 0.00 1.72 1.11 -0.29 0.00 0.00 0.00 173.10 175.63 2h3a s MET 52 N 0.08 0.36 0.35 2.90 1.75 -1.26 -5.09 119.30 118.39 2h3a s MET 52 Ca 0.02 0.49 0.00 0.00 -1.25 0.00 0.00 55.69 54.94 2h3a s MET 52 Cb -0.04 0.14 0.00 0.00 2.84 0.00 0.00 34.83 37.77 2h3a s MET 52 CO -0.04 -0.05 0.00 1.33 -0.65 0.00 0.00 175.02 175.61 2h3a n VAL 53 N 2.59 0.00 -2.29 10.11 0.24 -1.26 -5.14 118.33 122.58 2h3a n VAL 53 Ca -0.14 0.00 -0.32 0.00 -2.04 0.00 0.00 64.34 61.84 2h3a n VAL 53 Cb 0.57 -0.09 -0.02 0.00 -1.47 0.00 0.00 33.84 32.83 2h3a n VAL 53 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2h3a s GLU 54 N -1.77 3.84 0.00 7.34 2.56 -1.26 -4.98 118.70 124.43 2h3a s GLU 54 Ca 0.00 0.86 0.28 0.00 0.00 0.00 0.00 54.97 56.10 2h3a s GLU 54 Cb 0.00 -2.14 0.98 0.00 2.00 0.00 0.00 34.13 34.97 2h3a s GLU 54 CO 0.00 -0.33 1.71 0.28 -0.56 0.00 0.00 175.26 176.35 2h3a n VAL 55 N -1.88 0.00 0.00 3.70 0.31 -1.26 -4.94 118.33 114.26 2h3a n VAL 55 Ca 0.06 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 2h3a n VAL 55 Cb 0.54 0.16 0.00 0.00 -0.91 0.00 0.00 33.84 33.63 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 -0.79 0.00 -1.82 3.52 0.00 -1.26 -4.83 120.51 115.33 2h3a n ALA 56 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.25 2h3a n ALA 56 Cb 0.31 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.73 2h3a n ALA 56 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2h3a s ARG 57 N 0.00 2.30 0.00 0.00 0.52 -1.26 -4.78 118.95 115.73 2h3a s ARG 57 Ca 0.00 0.72 0.00 0.00 -0.52 0.00 0.00 55.73 55.93 2h3a s ARG 57 Cb 0.00 -4.61 0.00 0.00 0.52 0.00 0.00 34.95 30.86 2h3a s ARG 57 CO 0.00 -3.24 0.00 0.34 0.02 0.00 0.00 175.30 172.42 2h3a n PHE 58 N 14.78 0.00 0.00 -0.53 -0.00 -1.26 -5.16 117.46 125.29 2h3a n PHE 58 Ca 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.77 2h3a n PHE 58 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.99 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 0.00 -3.83 -2.13 2.08 -1.26 -5.16 119.36 109.06 2h3a n ILE 59 Ca 0.00 0.00 -0.24 0.00 0.56 0.00 0.00 62.75 63.07 2h3a n ILE 59 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 39.64 38.85 2h3a n ILE 59 CO 0.00 0.00 0.00 -1.83 0.56 0.00 0.00 176.55 175.28 2h3a s GLU 60 N 2.66 2.36 0.48 0.38 -1.05 -1.26 -5.12 118.70 117.14 2h3a s GLU 60 Ca 0.00 -1.78 -0.19 0.00 -0.15 0.00 0.00 54.97 52.85 2h3a s GLU 60 Cb 0.00 -2.17 -0.09 0.00 -0.44 0.00 0.00 34.13 31.43 2h3a s GLU 60 CO 0.00 -0.30 0.98 1.41 0.95 0.00 0.00 175.26 178.30 2h3a s MET 61 N -4.11 4.01 0.09 -4.83 1.75 -1.26 -4.99 119.30 109.97 2h3a s MET 61 Ca 0.42 1.10 -0.21 0.00 -1.25 0.00 0.00 55.69 55.74 2h3a s MET 61 Cb -0.01 -2.14 -0.11 0.00 2.84 0.00 0.00 34.83 35.40 2h3a s MET 61 CO 0.24 -0.22 1.69 -0.97 -0.65 0.00 0.00 175.02 175.11 2h3a h ASN 62 N 1.41 0.13 0.00 1.11 -0.73 -2.09 -3.49 115.58 111.93 2h3a h ASN 62 Ca -0.48 -0.08 0.00 0.00 1.87 0.00 0.00 56.30 57.61 2h3a h ASN 62 Cb 1.19 -0.03 0.00 0.00 0.27 0.00 0.00 38.32 39.75 2h3a h ASN 62 CO 0.61 0.17 0.00 0.61 -0.37 0.00 0.00 177.43 178.45 2h3a n GLY 63 N -0.92 0.38 0.00 1.57 0.00 -1.26 -5.11 105.19 99.85 2h3a n GLY 63 Ca -0.05 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.90 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 0.00 0.00 -4.21 1.61 2.88 -1.26 -5.19 113.62 107.45 2h3a n SER 64 Ca 0.00 -0.07 -0.16 0.00 -1.33 0.00 0.00 58.87 57.30 2h3a n SER 64 Cb 0.00 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.35 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 -3.11 1.25 0.17 0.66 2.19 -1.26 -5.17 117.98 112.71 2h3a s PHE 65 Ca 0.00 -0.59 0.09 0.00 0.33 0.00 0.00 56.93 56.76 2h3a s PHE 65 Cb 0.00 -0.66 -0.04 0.00 -1.31 0.00 0.00 43.02 41.00 2h3a s PHE 65 CO 0.00 0.08 -0.20 0.00 1.83 0.00 0.00 175.22 176.93 2h3a s ALA 66 N -2.21 2.16 -0.00 11.12 0.00 -1.26 -5.09 121.76 126.48 2h3a s ALA 66 Ca 0.07 -1.53 -0.05 0.00 0.00 0.00 0.00 51.96 50.45 2h3a s ALA 66 Cb -0.04 -0.23 -0.03 0.00 0.00 0.00 0.00 23.12 22.82 2h3a s ALA 66 CO 0.02 0.30 0.62 -0.44 0.00 0.00 0.00 175.76 176.25 2h3a h ASP 67 N 3.26 -0.15 -4.28 0.00 5.19 -2.09 -3.50 116.42 114.85 2h3a h ASP 67 Ca -0.44 0.01 0.01 0.00 -0.62 0.00 0.00 57.03 55.99 2h3a h ASP 67 Cb 1.21 0.04 -0.08 0.00 0.18 0.00 0.00 39.33 40.68 2h3a h ASP 67 CO 0.50 -0.05 -1.02 1.21 -3.12 0.00 0.00 179.24 176.75 2h3a n GLU 68 N -2.80 -3.10 -0.60 3.56 0.00 -1.26 -4.94 120.64 111.51 2h3a n GLU 68 Ca -0.02 2.49 0.08 0.00 0.00 0.00 0.00 57.16 59.71 2h3a n GLU 68 Cb 0.07 -3.64 -0.02 0.00 0.00 0.00 0.00 31.44 27.85 2h3a n GLU 68 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 2h3a n ASN 69 N 1.14 -4.04 0.00 4.31 2.85 -1.26 -5.01 115.26 113.24 2h3a n ASN 69 Ca -0.25 0.64 0.00 0.00 -0.11 0.00 0.00 54.58 54.86 2h3a n ASN 69 Cb 0.39 -1.80 0.00 0.00 1.24 0.00 0.00 39.78 39.61 2h3a n ASN 69 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 2h3a n LYS 70 N -2.34 0.00 -0.86 1.20 3.00 -1.26 -5.11 118.16 112.79 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 0.27 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.30 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 -0.25 -1.30 0.00 3.14 -0.08 -1.26 -5.31 116.55 111.49 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 -0.65 0.00 0.00 2.34 0.00 0.00 41.12 42.81 2h3a n ASP 71 CO 0.00 0.00 0.00 1.87 0.12 0.00 0.00 177.20 179.19