#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2or1 n ILE 2 N 0.00 -0.44 0.19 2.46 2.08 -1.26 -0.40 119.36 122.00 2or1 n ILE 2 Ca 0.00 1.97 0.07 0.00 0.56 0.00 0.00 62.75 65.36 2or1 n ILE 2 Cb 0.00 -2.62 0.32 0.00 -0.75 0.00 0.00 39.64 36.59 2or1 n ILE 2 CO 0.00 0.00 0.00 0.77 0.56 0.00 0.00 176.55 177.88 2or1 h SER 3 N 0.00 0.00 0.00 4.38 4.64 -1.83 -2.31 113.55 118.43 2or1 h SER 3 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 2or1 h SER 3 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 2or1 h SER 3 CO -0.84 0.32 0.00 -1.20 -0.87 0.00 0.00 176.83 174.24 2or1 n SER 4 N -3.39 0.00 -0.26 4.97 7.64 0.47 -1.45 113.62 121.60 2or1 n SER 4 Ca 0.01 0.47 -0.04 0.00 1.01 0.00 0.00 58.87 60.32 2or1 n SER 4 Cb 0.52 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.70 2or1 n SER 4 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2or1 n ARG 5 N -0.55 -0.22 0.01 1.43 1.74 -0.83 0.08 116.66 118.32 2or1 n ARG 5 Ca 0.00 0.99 -0.10 0.00 -0.77 0.00 0.00 57.85 57.97 2or1 n ARG 5 Cb 0.00 -1.46 -0.06 0.00 -1.02 0.00 0.00 32.46 29.92 2or1 n ARG 5 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 2or1 h VAL 6 N 0.00 0.00 -0.39 1.55 3.04 -1.47 -0.88 116.25 118.10 2or1 h VAL 6 Ca 0.16 0.00 0.04 0.00 -1.01 0.00 0.00 66.70 65.90 2or1 h VAL 6 Cb 0.32 0.00 -0.07 0.00 -2.01 0.00 0.00 31.29 29.53 2or1 h VAL 6 CO -0.62 0.00 -0.48 0.50 -1.01 0.00 0.00 177.57 175.96 2or1 h LYS 7 N -0.38 -0.30 -1.16 4.17 3.64 0.81 -0.16 116.57 123.19 2or1 h LYS 7 Ca 0.01 0.02 0.33 0.00 -1.27 0.00 0.00 60.65 59.75 2or1 h LYS 7 Cb 0.43 0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.27 2or1 h LYS 7 CO -0.25 -0.20 0.83 1.03 -2.27 0.00 0.00 179.45 178.59 2or1 h SER 8 N -0.31 0.02 0.02 4.20 0.87 -0.22 -1.24 113.55 116.90 2or1 h SER 8 Ca 0.07 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.47 2or1 h SER 8 Cb 0.49 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.47 2or1 h SER 8 CO -0.53 0.00 -0.63 0.11 -0.53 0.00 0.00 176.83 175.25 2or1 h LYS 9 N 0.02 0.39 -0.82 2.24 1.57 0.40 -2.72 116.57 117.65 2or1 h LYS 9 Ca 0.55 -0.45 0.14 0.00 -1.87 0.00 0.00 60.65 59.03 2or1 h LYS 9 Cb 2.18 0.13 -0.09 0.00 0.08 0.00 0.00 32.23 34.54 2or1 h LYS 9 CO -0.02 1.12 0.40 0.07 -0.57 0.00 0.00 179.45 180.46 2or1 h ARG 10 N -0.15 0.57 -0.41 3.15 0.11 -1.06 0.28 114.38 116.87 2or1 h ARG 10 Ca -0.09 -0.03 -0.01 0.00 0.10 0.00 0.00 59.98 59.96 2or1 h ARG 10 Cb 1.36 -0.13 -0.02 0.00 1.11 0.00 0.00 29.97 32.30 2or1 h ARG 10 CO 0.12 0.38 0.23 0.82 0.10 0.00 0.00 179.97 181.62 2or1 h ILE 11 N 0.58 1.14 0.00 0.08 1.08 -1.47 -2.11 117.51 116.81 2or1 h ILE 11 Ca 0.45 -0.35 0.00 0.00 -0.39 0.00 0.00 64.86 64.57 2or1 h ILE 11 Cb 0.63 0.64 0.00 0.00 -3.07 0.00 0.00 36.82 35.02 2or1 h ILE 11 CO -0.37 0.15 0.00 0.00 -0.69 0.00 0.00 178.15 177.24 2or1 n GLN 12 N -4.75 0.00 0.03 2.37 1.13 0.66 -2.11 117.38 114.72 2or1 n GLN 12 Ca 0.00 0.51 0.00 0.00 -1.94 0.00 0.00 57.00 55.57 2or1 n GLN 12 Cb 0.07 -1.14 0.02 0.00 0.11 0.00 0.00 30.24 29.30 2or1 n GLN 12 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2or1 n LEU 13 N -1.40 0.02 0.00 1.08 4.77 0.64 -4.80 117.00 117.31 2or1 n LEU 13 Ca 0.00 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 2or1 n LEU 13 Cb 0.00 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 2or1 n LEU 13 CO 0.00 -0.16 0.00 0.61 -1.33 0.00 0.00 177.39 176.51 2or1 n GLY 14 N -1.14 0.69 3.99 -0.72 0.00 -0.83 -5.05 105.19 102.13 2or1 n GLY 14 Ca -0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 2or1 n GLY 14 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2or1 s LEU 15 N 0.00 3.96 0.00 0.99 2.34 -0.98 -5.02 118.68 119.98 2or1 s LEU 15 Ca 0.00 -0.15 0.00 0.00 0.06 0.00 0.00 54.13 54.04 2or1 s LEU 15 Cb 0.00 -2.78 0.00 0.00 -0.56 0.00 0.00 46.19 42.85 2or1 s LEU 15 CO 0.00 -0.44 0.00 -0.46 -1.06 0.00 0.00 176.35 174.39 2or1 n ASN 16 N -1.66 0.00 0.00 1.48 0.23 -1.26 -4.37 115.26 109.68 2or1 n ASN 16 Ca -0.00 -0.25 0.00 0.00 -0.53 0.00 0.00 54.58 53.79 2or1 n ASN 16 Cb 0.58 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.28 2or1 n ASN 16 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2or1 n GLN 17 N -0.25 0.00 -0.04 -3.83 6.02 -1.26 -3.69 117.38 114.32 2or1 n GLN 17 Ca 0.00 0.12 -0.01 0.00 -0.01 0.00 0.00 57.00 57.09 2or1 n GLN 17 Cb 0.00 -1.10 -0.01 0.00 1.02 0.00 0.00 30.24 30.15 2or1 n GLN 17 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2or1 n ALA 18 N -0.85 -0.07 -0.35 -1.58 0.00 -1.26 -1.00 120.51 115.41 2or1 n ALA 18 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2or1 n ALA 18 Cb 0.00 0.17 0.00 0.00 0.00 0.00 0.00 19.45 19.62 2or1 n ALA 18 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2or1 n GLU 19 N -2.94 0.00 -0.25 0.00 1.02 -1.26 0.20 120.64 117.41 2or1 n GLU 19 Ca 0.00 0.00 0.09 0.00 -0.02 0.00 0.00 57.16 57.23 2or1 n GLU 19 Cb 0.03 -0.17 0.18 0.00 -0.02 0.00 0.00 31.44 31.46 2or1 n GLU 19 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2or1 n LEU 20 N 0.00 -0.14 0.18 -4.62 7.94 -1.15 0.20 117.00 119.42 2or1 n LEU 20 Ca 0.00 1.22 -0.16 0.00 -1.11 0.00 0.00 56.01 55.96 2or1 n LEU 20 Cb 0.00 -0.42 -0.08 0.00 0.53 0.00 0.00 43.42 43.45 2or1 n LEU 20 CO 0.00 -1.21 0.58 0.00 -1.11 0.00 0.00 177.39 175.65 2or1 h ALA 21 N 1.43 -0.84 0.00 1.96 0.00 0.40 1.43 119.26 123.64 2or1 h ALA 21 Ca 0.41 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2or1 h ALA 21 Cb 0.78 0.67 0.00 0.00 0.00 0.00 0.00 17.79 19.24 2or1 h ALA 21 CO -0.69 -1.03 0.22 0.37 0.00 0.00 0.00 179.25 178.12 2or1 h GLN 22 N -0.75 0.00 0.06 0.00 4.15 1.37 0.58 115.11 120.52 2or1 h GLN 22 Ca -0.01 0.00 -0.21 0.00 0.77 0.00 0.00 58.65 59.20 2or1 h GLN 22 Cb 0.72 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.40 2or1 h GLN 22 CO -0.16 0.00 -1.12 -0.22 -1.93 0.00 0.00 178.83 175.40 2or1 h LYS 23 N 0.00 0.14 0.00 1.69 3.11 0.57 -3.36 116.57 118.71 2or1 h LYS 23 Ca 0.00 -0.23 0.00 0.00 -2.81 0.00 0.00 60.65 57.61 2or1 h LYS 23 Cb 0.44 0.09 0.00 0.00 -1.00 0.00 0.00 32.23 31.76 2or1 h LYS 23 CO 0.00 1.11 0.00 0.28 -2.81 0.00 0.00 179.45 178.03 2or1 h VAL 24 N -0.61 0.00 0.00 2.00 2.07 0.59 -3.48 116.25 116.82 2or1 h VAL 24 Ca -0.26 -0.76 0.00 0.00 0.82 0.00 0.00 66.70 66.50 2or1 h VAL 24 Cb 1.50 1.75 0.00 0.00 -1.52 0.00 0.00 31.29 33.02 2or1 h VAL 24 CO -0.02 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.18 2or1 n GLY 25 N 1.10 0.73 0.00 2.17 0.00 0.16 -4.73 105.19 104.62 2or1 n GLY 25 Ca 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2or1 n GLY 25 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2or1 n THR 26 N -2.54 0.00 -3.76 2.61 5.66 -0.78 -4.95 114.28 110.52 2or1 n THR 26 Ca 0.00 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.87 2or1 n THR 26 Cb 0.00 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 68.69 2or1 n THR 26 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2or1 s THR 27 N 2.94 0.04 0.30 1.09 -4.23 -1.26 -4.68 115.64 109.84 2or1 s THR 27 Ca 0.00 -0.30 0.06 0.00 -1.18 0.00 0.00 61.69 60.27 2or1 s THR 27 Cb 0.00 -0.55 0.30 0.00 1.34 0.00 0.00 72.50 73.59 2or1 s THR 27 CO 0.00 -0.17 1.75 -0.61 -0.54 0.00 0.00 174.62 175.06 2or1 h GLN 28 N 4.54 0.65 0.00 3.99 -0.00 -1.90 0.51 115.11 122.90 2or1 h GLN 28 Ca -0.28 -0.04 0.00 0.00 -0.00 0.00 0.00 58.65 58.33 2or1 h GLN 28 Cb 1.18 -0.15 0.00 0.00 0.00 0.00 0.00 27.48 28.51 2or1 h GLN 28 CO 0.36 0.43 0.00 1.04 0.00 0.00 0.00 178.83 180.66 2or1 n GLN 29 N -4.83 0.21 -0.05 1.69 3.00 -1.26 -2.84 117.38 113.30 2or1 n GLN 29 Ca 0.24 0.31 -0.10 0.00 -0.01 0.00 0.00 57.00 57.45 2or1 n GLN 29 Cb 0.62 -1.82 -0.15 0.00 0.00 0.00 0.00 30.24 28.90 2or1 n GLN 29 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 2or1 n SER 30 N -2.19 0.72 0.14 1.08 7.64 0.16 -3.04 113.62 118.12 2or1 n SER 30 Ca 0.04 0.27 0.13 0.00 1.01 0.00 0.00 58.87 60.32 2or1 n SER 30 Cb 0.31 0.19 0.49 0.00 -1.01 0.00 0.00 64.21 64.19 2or1 n SER 30 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2or1 h ILE 31 N 0.00 0.00 0.11 0.44 1.08 -0.77 -2.59 117.51 115.79 2or1 h ILE 31 Ca -0.38 -0.33 -0.28 0.00 -0.39 0.00 0.00 64.86 63.49 2or1 h ILE 31 Cb 2.08 1.15 -0.00 0.00 -3.07 0.00 0.00 36.82 36.98 2or1 h ILE 31 CO 0.06 0.00 -1.42 -0.08 -0.69 0.00 0.00 178.15 176.02 2or1 h GLU 32 N 0.00 0.24 -0.63 2.37 4.22 -1.63 -2.64 114.58 116.52 2or1 h GLU 32 Ca 0.00 -0.41 -0.07 0.00 0.08 0.00 0.00 59.36 58.97 2or1 h GLU 32 Cb 0.47 0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 2or1 h GLU 32 CO 0.00 1.19 0.13 1.96 -2.18 0.00 0.00 179.01 180.12 2or1 h GLN 33 N -0.31 1.02 0.00 1.92 4.20 -1.43 0.25 115.11 120.76 2or1 h GLN 33 Ca -0.31 -0.26 0.00 0.00 0.06 0.00 0.00 58.65 58.15 2or1 h GLN 33 Cb 1.76 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 29.41 2or1 h GLN 33 CO 0.05 0.93 0.00 -0.11 -0.67 0.00 0.00 178.83 179.04 2or1 n LEU 34 N -4.30 0.53 -0.17 1.46 7.94 -0.99 0.29 117.00 121.76 2or1 n LEU 34 Ca 0.04 0.54 0.12 0.00 -1.11 0.00 0.00 56.01 55.59 2or1 n LEU 34 Cb 0.26 -0.17 0.22 0.00 0.53 0.00 0.00 43.42 44.26 2or1 n LEU 34 CO 0.42 -0.17 0.47 -0.62 -1.11 0.00 0.00 177.39 176.38 2or1 n GLU 35 N -1.02 -0.04 -1.92 1.96 1.02 -0.99 0.29 120.64 119.94 2or1 n GLU 35 Ca 0.00 0.75 -0.38 0.00 -0.02 0.00 0.00 57.16 57.51 2or1 n GLU 35 Cb 0.00 -1.26 0.03 0.00 -0.02 0.00 0.00 31.44 30.19 2or1 n GLU 35 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2or1 n ASN 36 N -4.42 7.40 -0.52 1.62 3.02 0.86 -4.62 115.26 118.59 2or1 n ASN 36 Ca 0.16 -3.74 0.00 0.00 -0.03 0.00 0.00 54.58 50.97 2or1 n ASN 36 Cb 0.52 -1.10 0.00 0.00 -0.61 0.00 0.00 39.78 38.59 2or1 n ASN 36 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2or1 n GLY 37 N -0.30 0.00 0.00 7.41 0.00 0.15 -4.66 105.19 107.79 2or1 n GLY 37 Ca 0.53 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.68 2or1 n GLY 37 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2or1 n LYS 38 N -0.52 0.01 -4.15 1.61 3.00 0.85 -4.84 118.16 114.12 2or1 n LYS 38 Ca 0.00 -0.01 -0.15 0.00 -0.00 0.00 0.00 58.31 58.15 2or1 n LYS 38 Cb 0.00 -1.50 -0.14 0.00 0.00 0.00 0.00 35.03 33.39 2or1 n LYS 38 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2or1 s THR 39 N -2.99 0.46 -0.08 3.15 -4.23 0.25 -4.79 115.64 107.42 2or1 s THR 39 Ca 0.13 -0.41 -0.05 0.00 -1.18 0.00 0.00 61.69 60.18 2or1 s THR 39 Cb 0.18 -0.42 -0.04 0.00 1.34 0.00 0.00 72.50 73.57 2or1 s THR 39 CO 0.62 0.02 -0.12 2.29 -0.54 0.00 0.00 174.62 176.89 2or1 n LYS 40 N 2.64 0.20 -3.78 3.99 2.85 -1.26 -4.57 118.16 118.24 2or1 n LYS 40 Ca -0.15 0.09 -0.32 0.00 -1.05 0.00 0.00 58.31 56.88 2or1 n LYS 40 Cb 0.57 -0.84 -0.09 0.00 -0.65 0.00 0.00 35.03 34.02 2or1 n LYS 40 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 2or1 s ARG 41 N -2.21 2.81 0.48 -1.58 0.52 -1.26 -5.03 118.95 112.68 2or1 s ARG 41 Ca -0.13 -3.24 -0.23 0.00 -0.52 0.00 0.00 55.73 51.61 2or1 s ARG 41 Cb 0.04 -3.68 -0.07 0.00 0.52 0.00 0.00 34.95 31.77 2or1 s ARG 41 CO 0.17 -1.26 1.29 -2.14 0.02 0.00 0.00 175.30 173.38 2or1 s PRO 42 N -1.28 3.58 0.00 3.54 0.01 -1.26 -4.89 135.00 134.70 2or1 s PRO 42 Ca 0.25 2.10 0.13 0.00 0.01 0.00 0.00 61.00 63.49 2or1 s PRO 42 Cb -0.08 -2.47 0.80 0.00 0.01 0.00 0.00 34.50 32.77 2or1 s PRO 42 CO -0.13 -0.79 1.26 -2.13 0.01 0.00 0.00 177.00 175.21 2or1 n ARG 43 N -0.50 0.60 -0.09 5.54 0.63 -1.26 -1.27 116.66 120.31 2or1 n ARG 43 Ca 0.07 0.00 0.06 0.00 -0.92 0.00 0.00 57.85 57.06 2or1 n ARG 43 Cb 0.45 -1.35 0.09 0.00 0.45 0.00 0.00 32.46 32.10 2or1 n ARG 43 CO 0.00 0.00 0.00 1.97 -2.51 0.00 0.00 177.63 177.09 2or1 n PHE 44 N -0.85 0.00 -0.12 -0.14 1.16 -1.26 -4.78 117.46 111.47 2or1 n PHE 44 Ca 0.10 -0.74 -0.13 0.00 -1.87 0.00 0.00 57.45 54.81 2or1 n PHE 44 Cb 0.05 -0.11 -0.09 0.00 -1.61 0.00 0.00 39.48 37.72 2or1 n PHE 44 CO 0.00 0.00 0.00 1.25 -1.87 0.00 0.00 176.76 176.14 2or1 h LEU 45 N 0.00 -1.78 0.13 5.98 6.46 -1.55 0.75 115.31 125.29 2or1 h LEU 45 Ca 0.00 0.24 -0.00 0.00 -0.12 0.00 0.00 57.88 58.00 2or1 h LEU 45 Cb 0.91 0.73 -0.01 0.00 -0.73 0.00 0.00 40.66 41.57 2or1 h LEU 45 CO 0.00 -0.41 -0.09 -0.65 -0.62 0.00 0.00 178.44 176.67 2or1 h PRO 46 N -0.41 -0.21 0.00 5.25 0.11 -1.86 -2.17 132.00 132.71 2or1 h PRO 46 Ca 0.08 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2or1 h PRO 46 Cb 0.61 0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.76 2or1 h PRO 46 CO -0.58 -0.14 0.00 0.93 -0.21 0.00 0.00 178.00 178.00 2or1 h GLU 47 N -0.22 0.00 0.21 1.05 5.08 -1.73 -2.70 114.58 116.27 2or1 h GLU 47 Ca -0.01 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.02 2or1 h GLU 47 Cb 0.19 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.47 2or1 h GLU 47 CO -0.00 0.00 -1.58 1.25 -1.00 0.00 0.00 179.01 177.68 2or1 h LEU 48 N 0.00 0.70 -1.44 1.33 5.85 -0.26 -3.09 115.31 118.40 2or1 h LEU 48 Ca 0.00 -0.86 -0.01 0.00 0.84 0.00 0.00 57.88 57.85 2or1 h LEU 48 Cb 0.08 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 40.88 2or1 h LEU 48 CO 0.00 1.70 -0.06 0.00 -0.34 0.00 0.00 178.44 179.74 2or1 h ALA 49 N 0.20 1.02 0.20 1.25 0.00 -1.10 3.81 119.26 124.64 2or1 h ALA 49 Ca -0.28 -0.05 -0.34 0.00 0.00 0.00 0.00 54.91 54.23 2or1 h ALA 49 Cb 2.12 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 19.92 2or1 h ALA 49 CO 0.23 0.07 -1.67 0.66 0.00 0.00 0.00 179.25 178.54 2or1 h SER 50 N 0.00 0.66 0.00 0.00 4.64 -1.66 0.43 113.55 117.62 2or1 h SER 50 Ca -0.00 -0.93 0.00 0.00 -0.47 0.00 0.00 61.79 60.39 2or1 h SER 50 Cb 0.54 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 2or1 h SER 50 CO 0.01 1.76 0.00 0.00 -0.87 0.00 0.00 176.83 177.73 2or1 n ALA 51 N -2.84 -0.13 0.00 5.18 0.00 -0.90 -0.85 120.51 120.97 2or1 n ALA 51 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.21 2or1 n ALA 51 Cb 1.07 0.02 0.00 0.00 0.00 0.00 0.00 19.45 20.54 2or1 n ALA 51 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2or1 n LEU 52 N -0.96 0.00 -2.17 0.00 4.77 1.25 -4.71 117.00 115.19 2or1 n LEU 52 Ca 0.00 0.05 -0.05 0.00 -0.03 0.00 0.00 56.01 55.97 2or1 n LEU 52 Cb 0.00 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.04 2or1 n LEU 52 CO 0.00 -0.05 -0.06 0.61 -1.33 0.00 0.00 177.39 176.56 2or1 n GLY 53 N -0.81 -0.27 2.62 -0.72 0.00 0.13 -4.93 105.19 101.22 2or1 n GLY 53 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2or1 n GLY 53 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2or1 n VAL 54 N -2.52 0.00 -3.28 1.61 0.24 -0.08 -4.98 118.33 109.32 2or1 n VAL 54 Ca -0.06 -1.76 -0.38 0.00 -2.04 0.00 0.00 64.34 60.10 2or1 n VAL 54 Cb 0.46 0.42 -0.06 0.00 -1.47 0.00 0.00 33.84 33.19 2or1 n VAL 54 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2or1 s SER 55 N -3.00 6.84 0.46 -1.34 1.04 -1.26 -4.41 113.70 112.04 2or1 s SER 55 Ca 0.04 1.01 0.25 0.00 0.48 0.00 0.00 55.95 57.72 2or1 s SER 55 Cb 0.00 -2.32 1.27 0.00 0.10 0.00 0.00 66.02 65.07 2or1 s SER 55 CO 0.03 0.09 1.83 0.58 0.98 0.00 0.00 173.24 176.75 2or1 h VAL 56 N 4.31 0.56 0.27 5.02 2.07 -1.94 0.64 116.25 127.18 2or1 h VAL 56 Ca -0.44 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 2or1 h VAL 56 Cb 1.20 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 2or1 h VAL 56 CO 0.71 0.04 -0.13 0.44 0.02 0.00 0.00 177.57 178.65 2or1 h ASP 57 N 0.23 -0.31 -0.53 0.57 3.45 -1.96 -2.87 116.42 115.00 2or1 h ASP 57 Ca 0.51 0.01 0.19 0.00 0.43 0.00 0.00 57.03 58.17 2or1 h ASP 57 Cb 1.58 0.08 -0.10 0.00 -0.56 0.00 0.00 39.33 40.33 2or1 h ASP 57 CO -0.14 -0.17 0.17 1.87 -1.57 0.00 0.00 179.24 179.40 2or1 n TRP 58 N -3.26 0.50 0.15 4.55 -0.00 0.20 -0.33 117.44 119.24 2or1 n TRP 58 Ca -0.05 0.63 -0.06 0.00 -0.00 0.00 0.00 57.50 58.03 2or1 n TRP 58 Cb 0.14 -1.00 -0.03 0.00 -0.00 0.00 0.00 31.31 30.43 2or1 n TRP 58 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 2or1 h LEU 59 N 0.00 -0.32 0.00 5.87 3.38 -0.64 0.32 115.31 123.92 2or1 h LEU 59 Ca 0.40 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.38 2or1 h LEU 59 Cb 0.97 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.80 2or1 h LEU 59 CO -0.45 -0.22 0.00 0.18 0.09 0.00 0.00 178.44 178.05 2or1 n LEU 60 N -3.06 0.00 0.17 1.67 4.77 0.56 -3.65 117.00 117.46 2or1 n LEU 60 Ca -0.05 0.84 0.02 0.00 -0.03 0.00 0.00 56.01 56.79 2or1 n LEU 60 Cb 0.15 -0.34 0.31 0.00 -2.33 0.00 0.00 43.42 41.21 2or1 n LEU 60 CO 0.11 -0.34 0.66 -0.55 -1.33 0.00 0.00 177.39 175.94 2or1 h ASN 61 N 0.00 0.00 -4.93 -1.43 -0.00 -1.43 -3.43 115.58 104.35 2or1 h ASN 61 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 56.30 56.01 2or1 h ASN 61 Cb 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 38.32 38.45 2or1 h ASN 61 CO 0.00 0.44 -0.60 0.61 -0.00 0.00 0.00 177.43 177.88 2or1 n GLY 62 N -0.22 -0.22 0.00 9.14 0.00 0.11 -4.92 105.19 109.08 2or1 n GLY 62 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2or1 n GLY 62 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73