#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hs2 s SER 3 N 0.00 6.95 0.03 1.69 0.15 -1.26 -0.57 113.70 120.69 3hs2 s SER 3 Ca 0.00 1.64 -0.26 0.00 0.70 0.00 0.00 55.95 58.03 3hs2 s SER 3 Cb 0.00 -2.52 0.06 0.00 -1.71 0.00 0.00 66.02 61.85 3hs2 s SER 3 CO 0.00 -0.31 0.60 -0.63 1.20 0.00 0.00 173.24 174.10 3hs2 s ILE 4 N -2.10 0.01 0.40 6.45 1.09 0.73 -4.88 121.20 122.90 3hs2 s ILE 4 Ca 0.60 -0.08 0.07 0.00 -1.10 0.00 0.00 60.65 60.13 3hs2 s ILE 4 Cb -0.10 -0.98 0.00 0.00 -1.06 0.00 0.00 42.46 40.32 3hs2 s ILE 4 CO 0.14 -0.05 0.55 0.54 -0.10 0.00 0.00 174.94 176.03 3hs2 s ASN 5 N -1.78 5.75 0.09 3.58 4.22 -1.26 -0.64 114.94 124.90 3hs2 s ASN 5 Ca -0.07 -0.27 -0.19 0.00 -2.14 0.00 0.00 52.86 50.20 3hs2 s ASN 5 Cb -0.01 -0.93 -0.08 0.00 1.28 0.00 0.00 41.25 41.52 3hs2 s ASN 5 CO 0.01 -0.67 1.57 0.15 -2.04 0.00 0.00 177.10 176.13 3hs2 h PHE 6 N 0.67 0.42 -0.67 1.54 3.57 -0.84 -0.93 116.94 120.71 3hs2 h PHE 6 Ca -0.43 -0.05 0.07 0.00 3.53 0.00 0.00 57.97 61.09 3hs2 h PHE 6 Cb 1.27 -0.12 -0.06 0.00 2.79 0.00 0.00 35.95 39.84 3hs2 h PHE 6 CO 0.41 0.50 0.36 0.00 -2.23 0.00 0.00 178.31 177.35 3hs2 h ARG 7 N 0.22 0.64 -0.63 1.11 -0.00 -1.96 0.22 114.38 113.97 3hs2 h ARG 7 Ca 0.08 -0.04 -0.04 0.00 -0.50 0.00 0.00 59.98 59.48 3hs2 h ARG 7 Cb 0.30 -0.14 -0.03 0.00 0.00 0.00 0.00 29.97 30.10 3hs2 h ARG 7 CO 0.00 0.42 0.24 1.15 0.00 0.00 0.00 179.97 181.78 3hs2 h THR 8 N 0.66 1.24 -0.16 2.04 2.02 -1.92 -2.76 112.91 114.03 3hs2 h THR 8 Ca 0.31 -0.76 -0.03 0.00 0.77 0.00 0.00 66.41 66.70 3hs2 h THR 8 Cb 0.22 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 3hs2 h THR 8 CO -0.20 0.30 -0.01 0.00 0.37 0.00 0.00 175.52 175.98 3hs2 h ALA 9 N 1.09 0.22 0.00 6.16 0.00 -0.19 -1.47 119.26 125.07 3hs2 h ALA 9 Ca 0.21 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hs2 h ALA 9 Cb 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3hs2 h ALA 9 CO -0.01 -0.07 0.00 -0.09 0.00 0.00 0.00 179.25 179.07 3hs2 h ARG 10 N 0.02 0.00 0.00 0.00 2.43 -0.61 -1.89 114.38 114.33 3hs2 h ARG 10 Ca 0.04 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3hs2 h ARG 10 Cb 0.39 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 3hs2 h ARG 10 CO 0.01 0.00 -1.67 0.41 -1.51 0.00 0.00 179.97 177.20 3hs2 n GLY 11 N -0.30 -0.91 2.77 2.80 0.00 -1.04 -4.60 105.19 103.90 3hs2 n GLY 11 Ca 0.00 -0.50 -0.04 0.00 0.00 0.00 0.00 46.02 45.49 3hs2 n GLY 11 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hs2 n ASN 12 N -2.02 1.54 -0.32 1.61 4.13 -0.57 -4.95 115.26 114.68 3hs2 n ASN 12 Ca -0.02 -2.30 -0.04 0.00 1.68 0.00 0.00 54.58 53.91 3hs2 n ASN 12 Cb 0.47 -0.50 0.10 0.00 -1.54 0.00 0.00 39.78 38.31 3hs2 n ASN 12 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 3hs2 h LEU 13 N 2.76 1.11 -1.04 3.41 5.85 -1.58 -0.96 115.31 124.86 3hs2 h LEU 13 Ca -0.12 -0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.43 3hs2 h LEU 13 Cb 1.24 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.96 3hs2 h LEU 13 CO 0.31 0.89 -0.03 0.77 -0.34 0.00 0.00 178.44 180.04 3hs2 h SER 14 N 1.24 0.63 -0.11 1.25 4.64 -1.92 0.33 113.55 119.61 3hs2 h SER 14 Ca 0.31 -0.15 -0.17 0.00 -0.47 0.00 0.00 61.79 61.32 3hs2 h SER 14 Cb 0.03 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 61.95 3hs2 h SER 14 CO -0.05 0.72 -0.52 -0.33 -0.87 0.00 0.00 176.83 175.78 3hs2 h GLU 15 N 0.62 0.69 -0.57 4.77 3.07 -1.85 -1.40 114.58 119.90 3hs2 h GLU 15 Ca 0.12 -0.42 -0.06 0.00 -0.50 0.00 0.00 59.36 58.51 3hs2 h GLU 15 Cb 0.43 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.36 3hs2 h GLU 15 CO 0.02 1.04 0.14 0.28 -1.40 0.00 0.00 179.01 179.08 3hs2 h VAL 16 N 0.53 1.25 -0.43 3.13 2.07 -0.51 -1.71 116.25 120.59 3hs2 h VAL 16 Ca 0.02 -0.90 -0.01 0.00 0.82 0.00 0.00 66.70 66.63 3hs2 h VAL 16 Cb 1.09 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.57 3hs2 h VAL 16 CO 0.11 0.33 0.22 -0.07 0.02 0.00 0.00 177.57 178.18 3hs2 h LEU 17 N 0.83 0.53 -0.35 2.57 3.38 -0.27 -0.61 115.31 121.39 3hs2 h LEU 17 Ca 0.18 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 3hs2 h LEU 17 Cb 0.35 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3hs2 h LEU 17 CO 0.00 0.44 0.12 0.78 0.09 0.00 0.00 178.44 179.87 3hs2 h ASN 18 N 0.60 0.50 -0.70 -0.43 2.35 -0.63 0.11 115.58 117.38 3hs2 h ASN 18 Ca 0.15 -0.20 -0.01 0.00 -0.55 0.00 0.00 56.30 55.70 3hs2 h ASN 18 Cb 0.04 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.25 3hs2 h ASN 18 CO -0.02 0.56 0.40 0.78 -1.65 0.00 0.00 177.43 177.49 3hs2 h ASN 19 N 0.41 0.87 0.21 5.81 2.35 -0.88 -1.38 115.58 122.96 3hs2 h ASN 19 Ca 0.11 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 3hs2 h ASN 19 Cb 0.24 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 3hs2 h ASN 19 CO -0.00 0.71 -0.16 0.58 -1.65 0.00 0.00 177.43 176.90 3hs2 h VAL 20 N 0.97 0.65 -0.28 2.81 2.07 -0.96 -1.69 116.25 119.81 3hs2 h VAL 20 Ca 0.25 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.85 3hs2 h VAL 20 Cb 0.02 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 3hs2 h VAL 20 CO -0.04 0.00 0.25 -0.08 0.02 0.00 0.00 177.57 177.72 3hs2 h GLU 21 N -0.38 0.00 0.00 1.57 4.81 -0.52 0.32 114.58 120.38 3hs2 h GLU 21 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3hs2 h GLU 21 Cb 0.34 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.72 3hs2 h GLU 21 CO -0.01 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.27 3hs2 n ALA 22 N -2.44 2.30 -0.55 2.92 0.00 -0.54 -4.79 120.51 117.40 3hs2 n ALA 22 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.42 3hs2 n ALA 22 Cb 0.41 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.71 3hs2 n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hs2 n GLY 23 N 0.34 0.72 3.81 0.00 0.00 0.11 -5.05 105.19 105.12 3hs2 n GLY 23 Ca 0.07 -0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 3hs2 n GLY 23 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hs2 s GLU 24 N -0.47 4.29 -0.44 1.61 2.12 -0.86 -5.01 118.70 119.94 3hs2 s GLU 24 Ca 0.00 0.85 -0.14 0.00 0.36 0.00 0.00 54.97 56.05 3hs2 s GLU 24 Cb 0.00 -3.12 0.06 0.00 0.26 0.00 0.00 34.13 31.33 3hs2 s GLU 24 CO 0.00 0.54 0.33 -1.21 -0.54 0.00 0.00 175.26 174.38 3hs2 s GLU 25 N -1.43 2.88 -0.29 4.30 2.02 -1.26 -4.18 118.70 120.75 3hs2 s GLU 25 Ca 0.35 -1.27 -0.10 0.00 0.02 0.00 0.00 54.97 53.96 3hs2 s GLU 25 Cb -0.19 -3.98 -0.04 0.00 0.10 0.00 0.00 34.13 30.02 3hs2 s GLU 25 CO 0.21 -0.92 0.17 0.08 0.02 0.00 0.00 175.26 174.82 3hs2 s VAL 26 N 1.60 5.01 -0.14 2.63 1.01 -0.94 -3.79 120.40 125.77 3hs2 s VAL 26 Ca 0.04 -0.03 -0.23 0.00 0.00 0.00 0.00 61.98 61.76 3hs2 s VAL 26 Cb -0.22 -3.42 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 3hs2 s VAL 26 CO 0.06 0.21 0.69 -0.70 0.00 0.00 0.00 175.10 175.36 3hs2 s GLU 27 N 1.71 4.32 -0.10 2.72 2.12 0.27 -1.53 118.70 128.20 3hs2 s GLU 27 Ca 0.06 0.79 -0.03 0.00 0.36 0.00 0.00 54.97 56.16 3hs2 s GLU 27 Cb -0.16 -3.52 -0.03 0.00 0.26 0.00 0.00 34.13 30.67 3hs2 s GLU 27 CO 0.09 -0.13 -0.00 0.42 -0.54 0.00 0.00 175.26 175.10 3hs2 s ILE 28 N 1.49 4.27 -0.03 -3.70 1.01 0.14 -0.19 121.20 124.18 3hs2 s ILE 28 Ca 0.34 -0.25 0.03 0.00 0.00 0.00 0.00 60.65 60.76 3hs2 s ILE 28 Cb -0.17 -2.82 0.00 0.00 0.01 0.00 0.00 42.46 39.49 3hs2 s ILE 28 CO 0.14 0.58 -0.11 0.42 0.00 0.00 0.00 174.94 175.96 3hs2 s THR 29 N -0.59 0.97 -0.14 2.92 -4.23 0.19 -1.27 115.64 113.49 3hs2 s THR 29 Ca 0.10 -0.45 -0.02 0.00 -1.18 0.00 0.00 61.69 60.13 3hs2 s THR 29 Cb -0.12 -0.86 -0.03 0.00 1.34 0.00 0.00 72.50 72.84 3hs2 s THR 29 CO 0.02 0.30 -0.06 -0.13 -0.54 0.00 0.00 174.62 174.21 3hs2 s ARG 30 N 0.21 3.47 0.09 3.99 0.52 -1.26 -0.06 118.95 125.91 3hs2 s ARG 30 Ca -0.04 -0.55 -0.31 0.00 -0.52 0.00 0.00 55.73 54.31 3hs2 s ARG 30 Cb -0.10 -2.82 -0.09 0.00 0.52 0.00 0.00 34.95 32.46 3hs2 s ARG 30 CO 0.01 0.32 1.70 0.50 0.02 0.00 0.00 175.30 177.85 3hs2 s ARG 31 N 0.14 4.18 0.00 3.54 3.00 -1.26 -1.43 118.95 127.13 3hs2 s ARG 31 Ca -0.02 2.41 0.00 0.00 -1.00 0.00 0.00 55.73 57.11 3hs2 s ARG 31 Cb -0.14 -3.58 0.00 0.00 0.00 0.00 0.00 34.95 31.23 3hs2 s ARG 31 CO 0.03 -0.76 0.00 0.41 0.00 0.00 0.00 175.30 174.98 3hs2 n GLY 32 N 4.05 0.49 3.15 8.12 0.00 -1.26 -5.05 105.19 114.69 3hs2 n GLY 32 Ca 0.16 -0.89 -0.10 0.00 0.00 0.00 0.00 46.02 45.20 3hs2 n GLY 32 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hs2 s ARG 33 N -1.62 0.79 -0.08 1.61 1.81 -0.51 -5.13 118.95 115.82 3hs2 s ARG 33 Ca 0.00 -1.32 -0.30 0.00 -1.72 0.00 0.00 55.73 52.39 3hs2 s ARG 33 Cb 0.00 -0.04 -0.02 0.00 -0.45 0.00 0.00 34.95 34.43 3hs2 s ARG 33 CO 0.00 -0.07 1.14 -1.83 -0.68 0.00 0.00 175.30 173.86 3hs2 s GLU 34 N -3.88 4.37 0.77 3.54 -1.05 -1.26 -4.64 118.70 116.54 3hs2 s GLU 34 Ca 0.12 1.58 -0.14 0.00 -0.15 0.00 0.00 54.97 56.38 3hs2 s GLU 34 Cb 0.06 -3.56 0.05 0.00 -0.44 0.00 0.00 34.13 30.24 3hs2 s GLU 34 CO -0.05 -0.42 1.12 -2.30 0.95 0.00 0.00 175.26 174.55 3hs2 n PRO 35 N 5.22 0.35 -4.23 -4.83 -0.02 -1.26 -4.81 135.00 125.41 3hs2 n PRO 35 Ca 0.10 0.19 -0.20 0.00 -2.02 0.00 0.00 63.50 61.58 3hs2 n PRO 35 Cb 0.47 -2.37 -0.12 0.00 -0.02 0.00 0.00 33.50 31.46 3hs2 n PRO 35 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hs2 s ALA 36 N -1.97 1.49 -0.09 3.55 0.00 -0.40 -4.99 121.76 119.35 3hs2 s ALA 36 Ca 0.74 -1.20 0.03 0.00 0.00 0.00 0.00 51.96 51.53 3hs2 s ALA 36 Cb -0.31 -0.12 -0.01 0.00 0.00 0.00 0.00 23.12 22.67 3hs2 s ALA 36 CO 0.50 0.18 -0.19 0.08 0.00 0.00 0.00 175.76 176.34 3hs2 s VAL 37 N -1.66 2.61 -0.13 0.00 1.01 -1.26 0.24 120.40 121.21 3hs2 s VAL 37 Ca 0.05 -0.85 -0.01 0.00 0.00 0.00 0.00 61.98 61.18 3hs2 s VAL 37 Cb -0.08 -2.03 -0.02 0.00 0.00 0.00 0.00 36.38 34.26 3hs2 s VAL 37 CO 0.03 0.56 -0.10 -0.51 0.00 0.00 0.00 175.10 175.08 3hs2 s ILE 38 N -0.03 3.35 0.14 2.22 2.07 -0.58 -4.99 121.20 123.37 3hs2 s ILE 38 Ca -0.05 -0.56 -0.13 0.00 -1.41 0.00 0.00 60.65 58.50 3hs2 s ILE 38 Cb -0.14 -2.42 0.01 0.00 0.13 0.00 0.00 42.46 40.04 3hs2 s ILE 38 CO 0.05 0.53 0.34 0.54 -1.91 0.00 0.00 174.94 174.48 3hs2 s VAL 39 N 0.19 0.08 0.30 4.00 0.11 -1.26 -2.21 120.40 121.61 3hs2 s VAL 39 Ca -0.06 -0.98 -0.29 0.00 -2.93 0.00 0.00 61.98 57.73 3hs2 s VAL 39 Cb -0.15 -1.45 -0.10 0.00 -1.53 0.00 0.00 36.38 33.15 3hs2 s VAL 39 CO 0.04 -0.37 1.30 -0.94 -3.33 0.00 0.00 175.10 171.81 3hs2 s SER 40 N -2.87 6.82 0.32 3.54 1.04 -1.26 -4.88 113.70 116.41 3hs2 s SER 40 Ca 0.08 2.61 0.06 0.00 0.48 0.00 0.00 55.95 59.19 3hs2 s SER 40 Cb 0.03 -2.64 0.74 0.00 0.10 0.00 0.00 66.02 64.24 3hs2 s SER 40 CO -0.07 -0.52 1.83 0.50 0.98 0.00 0.00 173.24 175.96 3hs2 h LYS 41 N 3.89 0.76 -0.25 4.02 3.64 -1.99 -1.25 116.57 125.39 3hs2 h LYS 41 Ca -0.48 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 58.85 3hs2 h LYS 41 Cb 1.22 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 3hs2 h LYS 41 CO 0.69 0.50 0.13 0.00 -2.27 0.00 0.00 179.45 178.50 3hs2 h ALA 42 N 1.60 0.32 -0.57 5.00 0.00 -1.99 0.38 119.26 123.99 3hs2 h ALA 42 Ca 0.51 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.32 3hs2 h ALA 42 Cb 0.75 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 3hs2 h ALA 42 CO -0.28 -0.14 0.25 1.15 0.00 0.00 0.00 179.25 180.24 3hs2 h THR 43 N 0.28 1.21 0.09 0.00 2.02 -1.73 -1.47 112.91 113.32 3hs2 h THR 43 Ca 0.09 -0.63 -0.00 0.00 0.77 0.00 0.00 66.41 66.63 3hs2 h THR 43 Cb 0.08 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.07 3hs2 h THR 43 CO -0.01 0.25 -0.04 0.15 0.37 0.00 0.00 175.52 176.23 3hs2 h PHE 44 N 0.78 -0.11 -0.74 3.16 3.57 -0.99 -1.32 116.94 121.28 3hs2 h PHE 44 Ca 0.19 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.72 3hs2 h PHE 44 Cb 0.15 0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.88 3hs2 h PHE 44 CO 0.00 -0.03 0.47 0.93 -2.23 0.00 0.00 178.31 177.45 3hs2 h GLU 45 N -0.16 0.90 -0.40 1.11 4.39 -0.85 0.16 114.58 119.72 3hs2 h GLU 45 Ca -0.01 -0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.65 3hs2 h GLU 45 Cb 0.13 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 28.55 3hs2 h GLU 45 CO 0.02 0.59 0.24 0.00 -1.16 0.00 0.00 179.01 178.70 3hs2 h ALA 46 N 1.31 0.51 -0.41 3.43 0.00 -1.02 -0.04 119.26 123.04 3hs2 h ALA 46 Ca 0.29 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.09 3hs2 h ALA 46 Cb 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3hs2 h ALA 46 CO -0.10 -0.09 -0.15 1.88 0.00 0.00 0.00 179.25 180.78 3hs2 h TYR 47 N 0.48 0.93 -0.55 0.00 0.05 -0.87 -2.33 116.97 114.69 3hs2 h TYR 47 Ca 0.16 -0.22 0.06 0.00 0.05 0.00 0.00 58.73 58.78 3hs2 h TYR 47 Cb 0.00 -0.22 -0.05 0.00 1.01 0.00 0.00 36.73 37.47 3hs2 h TYR 47 CO -0.07 0.97 0.26 -0.22 -1.05 0.00 0.00 178.16 178.05 3hs2 h LYS 48 N 0.63 0.49 -0.56 4.88 3.64 -0.35 0.14 116.57 125.44 3hs2 h LYS 48 Ca 0.10 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.36 3hs2 h LYS 48 Cb 0.70 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.39 3hs2 h LYS 48 CO 0.05 0.32 0.02 0.87 -2.27 0.00 0.00 179.45 178.44 3hs2 h LYS 49 N 0.50 0.98 -0.54 1.90 1.57 -0.97 -1.64 116.57 118.37 3hs2 h LYS 49 Ca 0.25 -0.30 -0.09 0.00 -1.87 0.00 0.00 60.65 58.64 3hs2 h LYS 49 Cb 0.19 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 3hs2 h LYS 49 CO -0.19 0.97 -0.01 0.00 -0.57 0.00 0.00 179.45 179.65 3hs2 h ALA 50 N 0.97 0.95 -0.50 3.86 0.00 -0.83 -0.21 119.26 123.50 3hs2 h ALA 50 Ca 0.16 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 3hs2 h ALA 50 Cb 0.52 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3hs2 h ALA 50 CO 0.03 0.63 0.22 0.00 0.00 0.00 0.00 179.25 180.13 3hs2 h ALA 51 N 1.12 0.65 -0.65 0.00 0.00 -0.60 -2.43 119.26 117.34 3hs2 h ALA 51 Ca 0.16 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3hs2 h ALA 51 Cb 0.52 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 3hs2 h ALA 51 CO 0.03 0.23 0.27 -0.07 0.00 0.00 0.00 179.25 179.71 3hs2 h LEU 52 N 0.67 0.88 -1.61 0.00 3.38 -0.87 -2.21 115.31 115.54 3hs2 h LEU 52 Ca 0.17 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 3hs2 h LEU 52 Cb 0.15 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3hs2 h LEU 52 CO -0.02 0.80 0.05 0.44 0.09 0.00 0.00 178.44 179.80 3hs2 h ASP 53 N 0.90 0.27 0.22 -0.43 3.32 -0.94 0.12 116.42 119.89 3hs2 h ASP 53 Ca 0.22 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.23 3hs2 h ASP 53 Cb 0.18 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.67 3hs2 h ASP 53 CO -0.02 0.28 -0.11 0.00 -1.72 0.00 0.00 179.24 177.68 3hs2 h ALA 54 N 1.76 -0.29 0.20 3.45 0.00 -0.90 -3.31 119.26 120.16 3hs2 h ALA 54 Ca 0.07 -0.08 -0.31 0.00 0.00 0.00 0.00 54.91 54.59 3hs2 h ALA 54 Cb 0.13 0.11 0.02 0.00 0.00 0.00 0.00 17.79 18.05 3hs2 h ALA 54 CO -0.00 -0.64 -1.40 1.05 0.00 0.00 0.00 179.25 178.25 3hs2 h GLU 55 N -0.34 0.41 -0.01 0.00 4.11 -1.19 -3.52 114.58 114.04 3hs2 h GLU 55 Ca -0.03 -0.71 0.00 0.00 0.07 0.00 0.00 59.36 58.69 3hs2 h GLU 55 Cb 0.26 0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.77 3hs2 h GLU 55 CO 0.05 1.33 0.00 1.19 0.07 0.00 0.00 179.01 181.65