#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 0.00 -3.85 3.17 -0.00 -1.26 -4.90 118.16 111.33 2h3a n LYS 2 Ca 0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 58.31 57.95 2h3a n LYS 2 Cb 0.00 -0.27 -0.13 0.00 -0.00 0.00 0.00 35.03 34.63 2h3a n LYS 2 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.40 176.26 2h3a s GLN 3 N 0.71 2.54 -0.30 -1.58 2.00 -1.26 -5.07 119.66 116.69 2h3a s GLN 3 Ca 0.20 -1.21 -0.29 0.00 -2.00 0.00 0.00 55.36 52.06 2h3a s GLN 3 Cb -0.27 -3.28 0.02 0.00 0.80 0.00 0.00 33.01 30.27 2h3a s GLN 3 CO 0.14 -0.62 1.07 0.50 -0.50 0.00 0.00 175.29 175.88 2h3a s ARG 4 N 1.32 4.10 -0.15 1.67 3.52 -1.26 -5.01 118.95 123.14 2h3a s ARG 4 Ca -0.03 1.12 -0.04 0.00 -0.13 0.00 0.00 55.73 56.64 2h3a s ARG 4 Cb -0.19 -3.72 -0.03 0.00 -1.56 0.00 0.00 34.95 29.44 2h3a s ARG 4 CO 0.00 -0.86 0.00 0.96 -0.81 0.00 0.00 175.30 174.60 2h3a s ILE 5 N 3.58 4.26 -0.12 4.11 -4.36 -1.26 -5.09 121.20 122.31 2h3a s ILE 5 Ca 0.45 -0.23 0.00 0.00 -0.26 0.00 0.00 60.65 60.61 2h3a s ILE 5 Cb -0.13 -2.87 0.02 0.00 1.25 0.00 0.00 42.46 40.74 2h3a s ILE 5 CO 0.14 0.51 -0.11 0.28 0.24 0.00 0.00 174.94 175.99 2h3a s THR 6 N 0.11 1.25 -0.60 8.37 -1.32 -1.26 -5.07 115.64 117.12 2h3a s THR 6 Ca 0.01 -0.45 -0.13 0.00 -1.21 0.00 0.00 61.69 59.91 2h3a s THR 6 Cb -0.13 -1.21 0.15 0.00 -1.51 0.00 0.00 72.50 69.81 2h3a s THR 6 CO 0.02 0.40 0.52 -0.69 -2.21 0.00 0.00 174.62 172.66 2h3a s VAL 7 N 1.43 4.93 -0.99 5.08 1.01 -1.26 -5.01 120.40 125.58 2h3a s VAL 7 Ca 0.01 -1.92 -0.24 0.00 0.00 0.00 0.00 61.98 59.84 2h3a s VAL 7 Cb -0.13 -4.15 -0.05 0.00 0.00 0.00 0.00 36.38 32.05 2h3a s VAL 7 CO -0.07 -0.88 1.90 0.42 0.00 0.00 0.00 175.10 176.47 2h3a s THR 8 N 1.07 3.53 -0.37 3.92 -4.23 -1.26 -4.76 115.64 113.55 2h3a s THR 8 Ca 0.08 -0.58 0.13 0.00 -1.18 0.00 0.00 61.69 60.14 2h3a s THR 8 Cb -0.24 -4.27 0.39 0.00 1.34 0.00 0.00 72.50 69.73 2h3a s THR 8 CO -0.01 -1.07 0.93 1.33 -0.54 0.00 0.00 174.62 175.25 2h3a n VAL 9 N 7.73 0.27 -0.79 2.29 0.24 -1.26 -4.95 118.33 121.86 2h3a n VAL 9 Ca 0.41 -3.31 -0.17 0.00 -2.04 0.00 0.00 64.34 59.23 2h3a n VAL 9 Cb 0.47 0.43 -0.08 0.00 -1.47 0.00 0.00 33.84 33.20 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 0.08 4.74 0.00 -1.34 -0.08 -1.26 -1.48 116.55 117.20 2h3a n ASP 10 Ca 0.14 -2.28 0.00 0.00 -1.51 0.00 0.00 54.79 51.14 2h3a n ASP 10 Cb 0.74 -1.10 0.00 0.00 2.34 0.00 0.00 41.12 43.10 2h3a n ASP 10 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 2h3a n SER 11 N 3.24 0.00 -2.03 1.67 2.88 -1.26 -4.10 113.62 114.02 2h3a n SER 11 Ca 0.41 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.89 2h3a n SER 11 Cb 0.43 0.30 -0.08 0.00 -0.75 0.00 0.00 64.21 64.11 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 -2.14 3.53 0.00 -3.46 8.00 -0.55 -3.94 116.55 118.00 2h3a n ASP 12 Ca 0.00 -2.10 0.00 0.00 0.71 0.00 0.00 54.79 53.40 2h3a n ASP 12 Cb 0.00 -0.90 0.00 0.00 -0.02 0.00 0.00 41.12 40.20 2h3a n ASP 12 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2h3a n SER 13 N 2.39 0.00 -0.14 -2.24 7.64 -1.25 -4.83 113.62 115.18 2h3a n SER 13 Ca 0.21 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 60.01 2h3a n SER 13 Cb 0.54 -1.15 0.00 0.00 -1.01 0.00 0.00 64.21 62.59 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 0.60 -0.81 1.43 3.20 -1.80 -3.12 116.97 116.47 2h3a h TYR 14 Ca 0.00 -0.02 0.19 0.00 3.14 0.00 0.00 58.73 62.04 2h3a h TYR 14 Cb 0.00 -0.19 -0.12 0.00 1.54 0.00 0.00 36.73 37.96 2h3a h TYR 14 CO 0.00 0.45 0.25 1.96 -1.64 0.00 0.00 178.16 179.18 2h3a h GLN 15 N 0.56 0.29 -0.10 1.82 7.50 -1.88 -2.34 115.11 120.96 2h3a h GLN 15 Ca 0.15 -0.02 0.00 0.00 0.50 0.00 0.00 58.65 59.29 2h3a h GLN 15 Cb 0.06 -0.07 -0.00 0.00 0.05 0.00 0.00 27.48 27.52 2h3a h GLN 15 CO -0.02 0.19 0.06 -0.07 -1.50 0.00 0.00 178.83 177.49 2h3a h LEU 16 N 0.30 0.11 -0.76 1.46 3.38 -1.89 0.57 115.31 118.47 2h3a h LEU 16 Ca 0.48 -0.02 0.16 0.00 0.09 0.00 0.00 57.88 58.59 2h3a h LEU 16 Cb 0.88 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 41.49 2h3a h LEU 16 CO -0.54 0.10 0.26 0.25 0.09 0.00 0.00 178.44 178.59 2h3a h LEU 17 N 0.12 0.17 0.07 1.67 7.12 -1.52 0.42 115.31 123.35 2h3a h LEU 17 Ca 0.04 0.13 -0.26 0.00 0.13 0.00 0.00 57.88 57.92 2h3a h LEU 17 Cb 0.00 0.14 -0.00 0.00 -0.53 0.00 0.00 40.66 40.27 2h3a h LEU 17 CO -0.01 0.03 -1.16 0.07 -0.13 0.00 0.00 178.44 177.24 2h3a h LYS 18 N 0.36 0.22 0.00 1.25 2.10 -1.41 -0.76 116.57 118.33 2h3a h LYS 18 Ca 0.43 -0.36 -0.02 0.00 -2.00 0.00 0.00 60.65 58.71 2h3a h LYS 18 Cb 0.71 0.13 -0.00 0.00 -0.90 0.00 0.00 32.23 32.17 2h3a h LYS 18 CO -0.46 1.16 -0.09 0.00 -2.00 0.00 0.00 179.45 178.05 2h3a h ALA 19 N 0.69 1.75 0.07 0.07 0.00 0.20 -2.96 119.26 119.08 2h3a h ALA 19 Ca -0.10 -0.08 -0.27 0.00 0.00 0.00 0.00 54.91 54.45 2h3a h ALA 19 Cb 1.89 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.65 2h3a h ALA 19 CO 0.18 0.12 -1.44 0.10 0.00 0.00 0.00 179.25 178.21 2h3a h TYR 20 N 0.00 0.28 0.00 0.00 -0.00 -0.26 -3.48 116.97 113.50 2h3a h TYR 20 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 58.73 58.53 2h3a h TYR 20 Cb 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 36.73 36.89 2h3a h TYR 20 CO 0.00 1.57 0.00 -0.25 -0.00 0.00 0.00 178.16 179.48 2h3a n ASP 21 N -4.03 0.00 0.00 0.10 8.00 -0.97 -5.07 116.55 114.59 2h3a n ASP 21 Ca -0.29 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.21 2h3a n ASP 21 Cb 0.84 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.94 2h3a n ASP 21 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2h3a n VAL 22 N 0.00 0.00 0.00 2.53 0.31 -0.37 -4.87 118.33 115.92 2h3a n VAL 22 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2h3a n VAL 22 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 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 -0.87 0.00 0.00 4.52 0.23 -0.70 -3.46 115.26 114.98 2h3a n ASN 23 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 2h3a n ASN 23 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 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 -0.23 1.53 -6.64 -1.26 -4.48 119.36 108.28 2h3a n ILE 24 Ca 0.00 0.00 -0.06 0.00 -1.77 0.00 0.00 62.75 60.92 2h3a n ILE 24 Cb 0.00 0.62 -0.05 0.00 -1.44 0.00 0.00 39.64 38.77 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 0.00 -0.57 0.02 7.28 3.41 -1.23 0.44 113.62 122.97 2h3a n SER 25 Ca 0.00 1.37 -0.05 0.00 -0.26 0.00 0.00 58.87 59.93 2h3a n SER 25 Cb 0.24 -0.33 -0.11 0.00 -0.26 0.00 0.00 64.21 63.75 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 0.66 5.00 0.00 -1.94 -3.30 103.07 103.49 2h3a h GLY 26 Ca 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.40 2h3a h GLY 26 CO -0.51 0.00 -0.43 -2.00 0.00 0.00 0.00 176.54 173.60 2h3a h LEU 27 N 0.00 -1.14 0.31 3.11 5.85 -1.65 0.32 115.31 122.11 2h3a h LEU 27 Ca -0.18 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 2h3a h LEU 27 Cb 1.82 0.36 -0.02 0.00 0.37 0.00 0.00 40.66 43.19 2h3a h LEU 27 CO 0.08 -0.61 -0.38 0.58 -0.34 0.00 0.00 178.44 177.77 2h3a h VAL 28 N -0.93 0.00 -0.76 1.05 2.07 -0.18 1.50 116.25 118.99 2h3a h VAL 28 Ca -0.06 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.63 2h3a h VAL 28 Cb 0.80 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.46 2h3a h VAL 28 CO -0.01 0.00 0.22 0.77 0.02 0.00 0.00 177.57 178.57 2h3a h SER 29 N -0.71 0.09 0.02 0.57 4.64 -1.62 1.34 113.55 117.88 2h3a h SER 29 Ca -0.04 0.14 -0.11 0.00 -0.47 0.00 0.00 61.79 61.31 2h3a h SER 29 Cb 0.63 0.17 0.01 0.00 -0.31 0.00 0.00 62.40 62.91 2h3a h SER 29 CO -0.09 -0.01 -0.45 0.00 -0.87 0.00 0.00 176.83 175.41 2h3a h THR 30 N 0.31 1.51 -0.80 2.95 1.03 -0.11 -3.25 112.91 114.56 2h3a h THR 30 Ca 0.43 -2.11 -0.01 0.00 -0.01 0.00 0.00 66.41 64.71 2h3a h THR 30 Cb 0.74 2.81 -0.04 0.00 -1.07 0.00 0.00 68.15 70.59 2h3a h THR 30 CO -0.50 0.59 0.45 0.74 -0.01 0.00 0.00 175.52 176.80 2h3a h THR 31 N -0.37 1.23 -0.82 0.00 2.02 0.27 -2.21 112.91 113.03 2h3a h THR 31 Ca -0.06 -0.54 0.15 0.00 0.77 0.00 0.00 66.41 66.73 2h3a h THR 31 Cb 1.21 0.14 -0.10 0.00 -1.74 0.00 0.00 68.15 67.66 2h3a h THR 31 CO 0.09 0.25 0.37 0.24 0.37 0.00 0.00 175.52 176.84 2h3a h MET 32 N 1.10 0.50 -0.30 6.66 2.86 0.17 0.77 114.93 126.69 2h3a h MET 32 Ca 0.28 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.87 2h3a h MET 32 Cb -0.00 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.53 2h3a h MET 32 CO -0.05 0.33 0.11 0.37 1.06 0.00 0.00 176.91 178.73 2h3a h GLN 33 N 0.52 0.45 -0.15 1.72 5.75 -1.43 2.21 115.11 124.18 2h3a h GLN 33 Ca 0.46 -0.09 -0.01 0.00 -0.15 0.00 0.00 58.65 58.86 2h3a h GLN 33 Cb 0.70 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 29.17 2h3a h GLN 33 CO -0.40 0.48 0.06 -2.95 -2.65 0.00 0.00 178.83 173.37 2h3a h ASN 34 N 0.33 0.20 -0.26 -0.69 7.08 -0.97 0.15 115.58 121.43 2h3a h ASN 34 Ca 0.10 -0.17 -0.09 0.00 -3.08 0.00 0.00 56.30 53.07 2h3a h ASN 34 Cb 0.20 -0.05 -0.02 0.00 -2.08 0.00 0.00 38.32 36.37 2h3a h ASN 34 CO -0.01 0.31 -0.12 -0.33 -2.08 0.00 0.00 177.43 175.20 2h3a h GLU 35 N 0.08 0.67 -0.74 4.14 4.39 0.63 1.04 114.58 124.80 2h3a h GLU 35 Ca 0.05 -0.21 0.02 0.00 0.34 0.00 0.00 59.36 59.55 2h3a h GLU 35 Cb 0.17 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 28.72 2h3a h GLU 35 CO -0.00 0.77 0.48 0.00 -1.16 0.00 0.00 179.01 179.10 2h3a h ALA 36 N 1.26 0.95 0.05 3.43 0.00 0.41 2.91 119.26 128.28 2h3a h ALA 36 Ca 0.11 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2h3a h ALA 36 Cb 0.56 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2h3a h ALA 36 CO 0.04 0.31 -0.03 0.00 0.00 0.00 0.00 179.25 179.57 2h3a h ARG 37 N 0.96 -0.07 0.00 0.00 3.08 -0.22 -3.38 114.38 114.74 2h3a h ARG 37 Ca 0.28 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 60.11 2h3a h ARG 37 Cb -0.06 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 29.98 2h3a h ARG 37 CO -0.08 0.28 -1.16 0.00 -1.07 0.00 0.00 179.97 177.94 2h3a h ARG 38 N -0.99 0.00 -3.63 0.04 -0.00 0.11 -3.49 114.38 106.43 2h3a h ARG 38 Ca -0.01 0.00 -0.14 0.00 -0.50 0.00 0.00 59.98 59.34 2h3a h ARG 38 Cb 0.38 0.00 0.01 0.00 0.00 0.00 0.00 29.97 30.36 2h3a h ARG 38 CO 0.01 0.84 -0.41 1.28 0.00 0.00 0.00 179.97 181.70 2h3a n LEU 39 N -3.26 -0.81 -2.90 3.04 4.77 0.97 -4.94 117.00 113.87 2h3a n LEU 39 Ca -0.04 -0.07 0.01 0.00 -0.03 0.00 0.00 56.01 55.87 2h3a n LEU 39 Cb 0.96 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 2h3a n LEU 39 CO 0.46 0.01 0.32 -0.60 -1.33 0.00 0.00 177.39 176.25 2h3a s ARG 40 N -0.92 0.45 -0.28 3.23 6.06 -1.26 -5.07 118.95 121.16 2h3a s ARG 40 Ca 0.12 -0.21 -0.26 0.00 -2.50 0.00 0.00 55.73 52.89 2h3a s ARG 40 Cb -0.01 0.04 0.17 0.00 0.06 0.00 0.00 34.95 35.20 2h3a s ARG 40 CO 0.29 -0.63 1.29 0.00 -2.50 0.00 0.00 175.30 173.75 2h3a s ALA 41 N 1.75 -2.12 -0.33 6.12 0.00 -1.26 -5.13 121.76 120.80 2h3a s ALA 41 Ca 0.17 1.75 -0.03 0.00 0.00 0.00 0.00 51.96 53.85 2h3a s ALA 41 Cb 0.02 -1.58 0.19 0.00 0.00 0.00 0.00 23.12 21.75 2h3a s ALA 41 CO -0.11 -0.17 0.87 -2.00 0.00 0.00 0.00 175.76 174.35 2h3a s GLU 42 N -0.12 0.37 0.16 0.00 -6.30 -1.26 -5.18 118.70 106.38 2h3a s GLU 42 Ca 0.06 0.06 -0.17 0.00 -2.50 0.00 0.00 54.97 52.43 2h3a s GLU 42 Cb -0.04 0.09 0.03 0.00 0.00 0.00 0.00 34.13 34.21 2h3a s GLU 42 CO -0.11 -0.60 0.46 1.03 0.02 0.00 0.00 175.26 176.06 2h3a s ARG 43 N 2.38 1.24 0.34 4.30 1.81 -1.26 -5.19 118.95 122.57 2h3a s ARG 43 Ca 0.18 -0.81 0.01 0.00 -1.72 0.00 0.00 55.73 53.39 2h3a s ARG 43 Cb -0.02 0.49 -0.00 0.00 -0.45 0.00 0.00 34.95 34.97 2h3a s ARG 43 CO -0.17 -0.51 0.43 -2.67 -0.68 0.00 0.00 175.30 171.69 2h3a n TRP 44 N -0.29 -1.26 0.17 -0.53 4.27 -1.26 -4.85 117.44 113.69 2h3a n TRP 44 Ca -0.12 -2.40 0.00 0.00 -3.89 0.00 0.00 57.50 51.09 2h3a n TRP 44 Cb 0.63 0.47 0.00 0.00 -1.36 0.00 0.00 31.31 31.05 2h3a n TRP 44 CO 0.00 0.00 0.00 1.17 -2.29 0.00 0.00 177.69 176.57 2h3a n LYS 45 N -0.58 0.00 -3.74 -2.67 3.00 -1.26 -4.99 118.16 107.92 2h3a n LYS 45 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.33 2h3a n LYS 45 Cb 0.57 0.00 -0.00 0.00 0.00 0.00 0.00 35.03 35.60 2h3a n LYS 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 2h3a s VAL 46 N -1.82 0.00 0.00 3.15 -7.23 -1.25 -5.05 120.40 108.20 2h3a s VAL 46 Ca 0.00 -0.36 0.00 0.00 -1.81 0.00 0.00 61.98 59.81 2h3a s VAL 46 Cb 0.00 -2.27 0.00 0.00 0.56 0.00 0.00 36.38 34.67 2h3a s VAL 46 CO 0.00 0.00 0.00 -1.84 -0.31 0.00 0.00 175.10 172.95 2h3a n GLU 47 N -0.58 0.89 0.00 4.82 0.28 -1.26 -3.94 120.64 120.85 2h3a n GLU 47 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.95 2h3a n GLU 47 Cb 0.61 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.48 2h3a n GLU 47 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 2h3a n ASN 48 N -2.19 0.00 0.00 -1.84 2.85 -1.26 -4.93 115.26 107.89 2h3a n ASN 48 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2h3a n ASN 48 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 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 0.00 3.16 0.00 1.20 10.64 -1.26 -5.00 117.38 126.12 2h3a n GLN 49 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 2h3a n GLN 49 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 2h3a n GLN 49 CO 0.00 0.00 0.00 -0.85 -1.83 0.00 0.00 177.06 174.38 2h3a n GLU 50 N 0.00 0.00 0.00 2.61 0.28 -1.26 -4.84 120.64 117.42 2h3a n GLU 50 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2h3a n GLU 50 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 2h3a n GLU 50 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2h3a n GLY 51 N 0.00 0.76 3.50 -1.84 0.00 -1.26 -4.99 105.19 101.37 2h3a n GLY 51 Ca 0.00 -0.69 -0.16 0.00 0.00 0.00 0.00 46.02 45.17 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 -1.42 0.92 -0.30 1.61 -2.45 -1.26 -4.97 119.30 111.43 2h3a s MET 52 Ca 0.00 0.42 -0.16 0.00 -1.25 0.00 0.00 55.69 54.70 2h3a s MET 52 Cb 0.00 0.44 0.17 0.00 1.25 0.00 0.00 34.83 36.69 2h3a s MET 52 CO 0.00 -0.24 1.08 0.54 1.05 0.00 0.00 175.02 177.45 2h3a s VAL 53 N -0.71 -0.20 0.00 10.11 0.11 -1.26 -5.09 120.40 123.36 2h3a s VAL 53 Ca -0.08 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 58.97 2h3a s VAL 53 Cb -0.02 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.83 2h3a s VAL 53 CO 0.06 0.00 0.00 -1.84 -3.33 0.00 0.00 175.10 169.99 2h3a n GLU 54 N 4.22 0.88 0.00 1.54 0.28 -1.26 -5.15 120.64 121.14 2h3a n GLU 54 Ca -0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.87 2h3a n GLU 54 Cb 0.55 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.42 2h3a n GLU 54 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 2h3a n VAL 55 N 0.00 0.00 -3.34 3.84 0.31 -1.26 -5.11 118.33 112.77 2h3a n VAL 55 Ca 0.00 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.11 2h3a n VAL 55 Cb 0.00 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 32.84 2h3a n VAL 55 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2h3a s ALA 56 N -2.29 0.30 -0.42 3.52 0.00 -1.26 -5.10 121.76 116.51 2h3a s ALA 56 Ca 0.00 -1.60 -0.11 0.00 0.00 0.00 0.00 51.96 50.24 2h3a s ALA 56 Cb 0.00 -1.87 0.07 0.00 0.00 0.00 0.00 23.12 21.32 2h3a s ALA 56 CO 0.00 -2.10 0.29 -0.98 0.00 0.00 0.00 175.76 172.97 2h3a s ARG 57 N 0.86 2.75 -0.39 0.00 1.04 -1.26 -4.98 118.95 116.96 2h3a s ARG 57 Ca 0.23 -1.35 0.04 0.00 -1.04 0.00 0.00 55.73 53.61 2h3a s ARG 57 Cb -0.10 -3.87 0.18 0.00 -2.04 0.00 0.00 34.95 29.13 2h3a s ARG 57 CO -0.07 -0.92 0.73 -0.59 -0.04 0.00 0.00 175.30 174.40 2h3a s PHE 58 N 1.51 -1.43 0.00 5.89 -0.12 -1.26 -5.15 117.98 117.43 2h3a s PHE 58 Ca 0.03 0.18 0.00 0.00 -0.05 0.00 0.00 56.93 57.09 2h3a s PHE 58 Cb -0.23 0.26 0.00 0.00 -0.63 0.00 0.00 43.02 42.43 2h3a s PHE 58 CO 0.04 -0.97 0.00 -0.89 -0.05 0.00 0.00 175.22 173.35 2h3a n ILE 59 N 4.20 0.00 -4.09 -4.49 -0.00 -1.26 -5.18 119.36 108.53 2h3a n ILE 59 Ca 0.10 0.00 -0.11 0.00 -0.00 0.00 0.00 62.75 62.74 2h3a n ILE 59 Cb 0.58 0.00 -0.07 0.00 -0.00 0.00 0.00 39.64 40.15 2h3a n ILE 59 CO 0.00 0.00 0.00 -1.61 -0.00 0.00 0.00 176.55 174.94 2h3a s GLU 60 N 4.34 1.45 -0.07 0.38 0.41 -1.26 -5.17 118.70 118.78 2h3a s GLU 60 Ca 0.00 -1.47 -0.03 0.00 -0.41 0.00 0.00 54.97 53.06 2h3a s GLU 60 Cb 0.00 0.39 0.04 0.00 -1.78 0.00 0.00 34.13 32.78 2h3a s GLU 60 CO 0.00 -0.56 0.14 1.41 -0.49 0.00 0.00 175.26 175.76 2h3a s MET 61 N -3.97 0.04 0.24 1.61 -2.45 -1.26 -5.16 119.30 108.35 2h3a s MET 61 Ca 0.30 0.45 -0.05 0.00 -1.25 0.00 0.00 55.69 55.15 2h3a s MET 61 Cb 0.02 -0.26 -0.02 0.00 1.25 0.00 0.00 34.83 35.82 2h3a s MET 61 CO 0.12 -0.25 0.28 1.21 1.05 0.00 0.00 175.02 177.43 2h3a s ASN 62 N 1.82 0.22 0.00 1.11 3.84 -1.26 -5.18 114.94 115.48 2h3a s ASN 62 Ca -0.02 -1.26 0.00 0.00 0.21 0.00 0.00 52.86 51.79 2h3a s ASN 62 Cb -0.12 0.48 0.00 0.00 -0.55 0.00 0.00 41.25 41.06 2h3a s ASN 62 CO -0.05 -0.99 0.00 0.61 -2.79 0.00 0.00 177.10 173.87 2h3a n GLY 63 N -0.35 1.92 3.63 1.21 0.00 -1.26 -5.19 105.19 105.15 2h3a n GLY 63 Ca 0.01 -0.49 -0.09 0.00 0.00 0.00 0.00 46.02 45.45 2h3a n GLY 63 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2h3a s SER 64 N 0.00 -0.30 -0.21 1.61 0.15 -1.26 -5.19 113.70 108.51 2h3a s SER 64 Ca 0.00 -0.48 -0.29 0.00 0.70 0.00 0.00 55.95 55.88 2h3a s SER 64 Cb 0.00 0.64 0.14 0.00 -1.71 0.00 0.00 66.02 65.09 2h3a s SER 64 CO 0.00 -1.15 1.09 0.12 1.20 0.00 0.00 173.24 174.49 2h3a s PHE 65 N -3.88 -0.31 -0.25 3.44 5.36 -1.26 -5.15 117.98 115.94 2h3a s PHE 65 Ca 0.10 0.58 -0.02 0.00 -0.96 0.00 0.00 56.93 56.63 2h3a s PHE 65 Cb -0.03 0.45 0.08 0.00 -0.34 0.00 0.00 43.02 43.18 2h3a s PHE 65 CO -0.00 -0.26 0.06 0.00 -1.46 0.00 0.00 175.22 173.56 2h3a s ALA 66 N -0.85 1.19 -0.20 11.12 0.00 -1.26 -5.11 121.76 126.65 2h3a s ALA 66 Ca 0.01 -1.10 0.02 0.00 0.00 0.00 0.00 51.96 50.89 2h3a s ALA 66 Cb -0.01 -1.36 0.03 0.00 0.00 0.00 0.00 23.12 21.77 2h3a s ALA 66 CO -0.02 -1.39 -0.17 0.34 0.00 0.00 0.00 175.76 174.52 2h3a s ASP 67 N 1.78 3.50 -0.36 0.00 -1.08 -1.26 -5.06 116.67 114.19 2h3a s ASP 67 Ca 0.03 -0.87 0.03 0.00 -0.52 0.00 0.00 52.55 51.23 2h3a s ASP 67 Cb -0.17 -1.48 0.16 0.00 -1.46 0.00 0.00 42.92 39.96 2h3a s ASP 67 CO -0.17 -0.06 0.39 -0.70 0.52 0.00 0.00 175.17 175.15 2h3a s GLU 68 N 1.25 0.62 -0.18 4.34 2.12 -1.26 -5.13 118.70 120.45 2h3a s GLU 68 Ca 0.01 -0.71 -0.25 0.00 0.36 0.00 0.00 54.97 54.37 2h3a s GLU 68 Cb -0.15 -0.64 0.06 0.00 0.26 0.00 0.00 34.13 33.66 2h3a s GLU 68 CO -0.10 -1.17 0.66 0.54 -0.54 0.00 0.00 175.26 174.64 2h3a s ASN 69 N 1.59 -0.66 0.00 -1.70 4.22 -1.26 -5.01 114.94 112.11 2h3a s ASN 69 Ca 0.16 1.09 0.00 0.00 -2.14 0.00 0.00 52.86 51.97 2h3a s ASN 69 Cb -0.14 1.06 0.00 0.00 1.28 0.00 0.00 41.25 43.45 2h3a s ASN 69 CO -0.07 -0.36 0.00 1.17 -2.04 0.00 0.00 177.10 175.79 2h3a n LYS 70 N 2.08 0.00 -0.13 3.55 0.00 -1.26 -5.17 118.16 117.23 2h3a n LYS 70 Ca -0.16 0.00 0.02 0.00 0.00 0.00 0.00 58.31 58.17 2h3a n LYS 70 Cb 0.56 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.58 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 -0.46 -0.79 0.00 3.14 -0.08 -1.26 -5.40 116.55 111.70 2h3a n ASP 71 Ca 0.00 0.07 0.00 0.00 -1.51 0.00 0.00 54.79 53.35 2h3a n ASP 71 Cb 0.00 -0.41 0.00 0.00 2.34 0.00 0.00 41.12 43.05 2h3a n ASP 71 CO 0.00 0.00 0.00 -2.67 0.12 0.00 0.00 177.20 174.65