#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sn4 s ARG 2 N 0.00 0.89 -0.25 7.34 3.03 0.10 -4.87 118.95 125.19 1sn4 s ARG 2 Ca 0.00 -0.04 -0.11 0.00 2.03 0.00 0.00 55.73 57.61 1sn4 s ARG 2 Cb 0.00 0.41 -0.05 0.00 -1.03 0.00 0.00 34.95 34.28 1sn4 s ARG 2 CO 0.00 -0.28 0.19 -0.51 -1.13 0.00 0.00 175.30 173.57 1sn4 s ASP 3 N -1.43 6.11 0.12 -2.89 1.01 -1.26 -0.36 116.67 117.98 1sn4 s ASP 3 Ca -0.11 0.10 -0.25 0.00 0.71 0.00 0.00 52.55 53.01 1sn4 s ASP 3 Cb -0.02 -2.12 0.08 0.00 1.01 0.00 0.00 42.92 41.87 1sn4 s ASP 3 CO 0.05 0.02 1.10 0.00 0.21 0.00 0.00 175.17 176.55 1sn4 s ALA 4 N 1.31 -1.83 -0.27 5.23 0.00 -0.91 -4.99 121.76 120.30 1sn4 s ALA 4 Ca 0.08 -0.09 -0.26 0.00 0.00 0.00 0.00 51.96 51.70 1sn4 s ALA 4 Cb -0.14 0.72 0.00 0.00 0.00 0.00 0.00 23.12 23.70 1sn4 s ALA 4 CO 0.07 -1.08 0.91 0.71 0.00 0.00 0.00 175.76 176.37 1sn4 s TYR 5 N -2.34 3.26 0.39 0.00 2.02 -1.26 -0.71 117.35 118.71 1sn4 s TYR 5 Ca 0.21 1.14 -0.26 0.00 -0.37 0.00 0.00 57.07 57.79 1sn4 s TYR 5 Cb -0.01 -3.25 -0.09 0.00 -0.40 0.00 0.00 41.96 38.21 1sn4 s TYR 5 CO 0.03 -0.52 1.30 -1.50 -1.57 0.00 0.00 175.55 173.29 1sn4 s ILE 6 N 3.09 2.64 0.13 2.71 2.07 -1.21 -0.23 121.20 130.40 1sn4 s ILE 6 Ca 0.38 0.58 0.08 0.00 -1.41 0.00 0.00 60.65 60.29 1sn4 s ILE 6 Cb -0.14 -3.35 -0.04 0.00 0.13 0.00 0.00 42.46 39.06 1sn4 s ILE 6 CO 0.10 0.09 -0.19 0.00 -1.91 0.00 0.00 174.94 173.03 1sn4 s ALA 7 N -1.25 1.88 0.29 1.50 0.00 -0.67 -4.09 121.76 119.42 1sn4 s ALA 7 Ca 0.56 -1.36 0.09 0.00 0.00 0.00 0.00 51.96 51.25 1sn4 s ALA 7 Cb -0.38 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 22.48 1sn4 s ALA 7 CO 0.49 0.29 0.01 -1.59 0.00 0.00 0.00 175.76 174.96 1sn4 s LYS 8 N -2.35 2.25 0.27 0.00 -2.85 0.38 -4.64 119.74 112.79 1sn4 s LYS 8 Ca 0.11 -1.50 -0.31 0.00 -1.00 0.00 0.00 55.97 53.27 1sn4 s LYS 8 Cb -0.08 -2.11 -0.12 0.00 -2.06 0.00 0.00 37.83 33.46 1sn4 s LYS 8 CO 0.05 0.30 1.61 -2.30 0.10 0.00 0.00 175.35 175.11 1sn4 n PRO 9 N -0.93 2.64 -3.99 1.78 -0.02 -1.26 -1.54 135.00 131.69 1sn4 n PRO 9 Ca -0.06 0.94 -0.33 0.00 -2.02 0.00 0.00 63.50 62.04 1sn4 n PRO 9 Cb 0.60 -2.73 -0.14 0.00 -0.02 0.00 0.00 33.50 31.21 1sn4 n PRO 9 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1sn4 s GLU 10 N -0.12 2.10 -0.76 -0.52 2.02 -1.26 -4.73 118.70 115.42 1sn4 s GLU 10 Ca 0.67 -1.49 -0.00 0.00 0.02 0.00 0.00 54.97 54.16 1sn4 s GLU 10 Cb -0.52 -3.11 -0.00 0.00 0.10 0.00 0.00 34.13 30.60 1sn4 s GLU 10 CO 0.45 -0.72 0.63 -1.71 0.02 0.00 0.00 175.26 173.94 1sn4 n ASN 11 N 4.46 -2.22 -4.12 -0.19 5.15 -1.08 -0.71 115.26 116.55 1sn4 n ASN 11 Ca -0.09 -0.40 -0.28 0.00 -0.60 0.00 0.00 54.58 53.22 1sn4 n ASN 11 Cb 0.42 -3.45 -0.17 0.00 -0.53 0.00 0.00 39.78 36.05 1sn4 n ASN 11 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1sn4 s VAL 13 N 0.47 2.07 -0.34 0.00 -7.23 -1.26 -0.47 120.40 113.63 1sn4 s VAL 13 Ca -0.16 -0.11 -0.11 0.00 -1.81 0.00 0.00 61.98 59.79 1sn4 s VAL 13 Cb -0.16 -2.96 0.00 0.00 0.56 0.00 0.00 36.38 33.82 1sn4 s VAL 13 CO 0.06 0.00 0.20 -0.31 -0.31 0.00 0.00 175.10 174.74 1sn4 s TYR 14 N -3.60 3.21 0.43 2.82 1.51 -1.26 -4.82 117.35 115.65 1sn4 s TYR 14 Ca 0.67 -0.58 -0.25 0.00 -1.01 0.00 0.00 57.07 55.91 1sn4 s TYR 14 Cb -0.07 -2.43 -0.08 0.00 -0.11 0.00 0.00 41.96 39.27 1sn4 s TYR 14 CO 0.49 -0.49 1.25 -1.58 -1.11 0.00 0.00 175.55 174.12 1sn4 s HIS 15 N 1.63 2.82 0.09 2.71 5.65 -1.26 -1.92 115.29 125.01 1sn4 s HIS 15 Ca 0.04 1.46 -0.06 0.00 0.25 0.00 0.00 55.06 56.75 1sn4 s HIS 15 Cb -0.18 -3.57 -0.01 0.00 -1.18 0.00 0.00 32.58 27.64 1sn4 s HIS 15 CO 0.08 -1.91 0.14 0.00 -0.65 0.00 0.00 174.74 172.39 1sn4 n ALA 17 N -0.04 1.71 -3.57 0.00 0.00 -1.26 -4.65 120.51 112.70 1sn4 n ALA 17 Ca -0.13 -0.86 -0.13 0.00 0.00 0.00 0.00 53.44 52.32 1sn4 n ALA 17 Cb 0.62 -0.36 -0.06 0.00 0.00 0.00 0.00 19.45 19.66 1sn4 n ALA 17 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1sn4 s GLY 18 N -0.71 -0.39 0.16 0.00 0.00 -1.26 -5.05 107.32 100.07 1sn4 s GLY 18 Ca 0.00 1.86 -0.08 0.00 0.00 0.00 0.00 44.72 46.50 1sn4 s GLY 18 CO 0.00 1.18 1.47 3.43 0.00 0.00 0.00 173.10 179.18 1sn4 h ASN 19 N 3.16 0.84 -0.56 1.64 2.35 -1.94 -3.33 115.58 117.75 1sn4 h ASN 19 Ca -0.24 -0.43 0.10 0.00 -0.55 0.00 0.00 56.30 55.18 1sn4 h ASN 19 Cb 1.16 -0.24 -0.08 0.00 0.05 0.00 0.00 38.32 39.21 1sn4 h ASN 19 CO 0.29 1.19 0.11 -0.08 -1.65 0.00 0.00 177.43 177.29 1sn4 h GLU 20 N 0.60 0.24 -0.85 0.81 4.22 -1.97 -0.09 114.58 117.55 1sn4 h GLU 20 Ca 0.03 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.45 1sn4 h GLU 20 Cb 1.08 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.23 1sn4 h GLU 20 CO 0.11 0.16 0.53 0.78 -2.18 0.00 0.00 179.01 178.41 1sn4 h GLY 21 N 0.25 1.21 1.23 1.92 0.00 -1.97 -0.28 103.07 105.43 1sn4 h GLY 21 Ca 0.29 -0.48 -0.19 0.00 0.00 0.00 0.00 47.33 46.95 1sn4 h GLY 21 CO -0.37 0.47 -0.59 0.00 0.00 0.00 0.00 176.54 176.05 1sn4 h ASN 23 N 0.60 0.25 -0.34 0.00 -1.24 -0.41 0.19 115.58 114.63 1sn4 h ASN 23 Ca 0.00 -0.01 -0.05 0.00 0.71 0.00 0.00 56.30 56.95 1sn4 h ASN 23 Cb 1.19 -0.06 -0.01 0.00 0.73 0.00 0.00 38.32 40.17 1sn4 h ASN 23 CO 0.13 0.19 0.01 0.50 -1.29 0.00 0.00 177.43 176.97 1sn4 h LYS 24 N 0.29 0.60 -0.31 6.67 1.63 -1.04 -0.75 116.57 123.65 1sn4 h LYS 24 Ca 0.08 -0.18 0.02 0.00 -0.85 0.00 0.00 60.65 59.72 1sn4 h LYS 24 Cb -0.03 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.52 1sn4 h LYS 24 CO -0.02 0.71 0.16 1.25 -3.45 0.00 0.00 179.45 178.10 1sn4 h LEU 25 N 0.41 0.25 0.07 5.20 5.85 -0.75 -0.54 115.31 125.79 1sn4 h LEU 25 Ca 0.10 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 1sn4 h LEU 25 Cb 0.43 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1sn4 h LEU 25 CO 0.01 0.18 -0.03 0.00 -0.34 0.00 0.00 178.44 178.27 1sn4 h THR 27 N -0.27 1.22 0.00 0.00 1.35 -1.06 -0.72 112.91 113.43 1sn4 h THR 27 Ca -0.01 -1.06 0.00 0.00 -0.55 0.00 0.00 66.41 64.79 1sn4 h THR 27 Cb 0.23 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 68.20 1sn4 h THR 27 CO 0.02 0.30 0.00 0.44 -0.25 0.00 0.00 175.52 176.03 1sn4 h ASP 28 N 0.02 0.00 -0.30 5.36 3.32 -1.03 -1.65 116.42 122.14 1sn4 h ASP 28 Ca 0.00 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 1sn4 h ASP 28 Cb 0.55 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.04 1sn4 h ASP 28 CO 0.04 0.00 -0.02 0.59 -1.72 0.00 0.00 179.24 178.13 1sn4 n ASN 29 N -2.78 3.16 0.00 6.45 3.02 -0.44 -4.95 115.26 119.71 1sn4 n ASN 29 Ca -0.00 -3.37 0.00 0.00 -0.03 0.00 0.00 54.58 51.17 1sn4 n ASN 29 Cb 0.19 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 38.77 1sn4 n ASN 29 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1sn4 n GLY 30 N -0.86 0.79 3.78 7.41 0.00 -0.62 -4.53 105.19 111.16 1sn4 n GLY 30 Ca 0.27 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.00 1sn4 n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sn4 s ALA 31 N -2.35 1.98 0.07 4.61 0.00 -0.41 -4.50 121.76 121.17 1sn4 s ALA 31 Ca 0.00 -0.27 0.03 0.00 0.00 0.00 0.00 51.96 51.72 1sn4 s ALA 31 Cb 0.00 -3.10 -0.24 0.00 0.00 0.00 0.00 23.12 19.78 1sn4 s ALA 31 CO 0.00 -2.00 1.12 1.49 0.00 0.00 0.00 175.76 176.37 1sn4 h GLU 32 N -1.29 0.10 -2.51 0.00 4.81 -1.20 -3.37 114.58 111.13 1sn4 h GLU 32 Ca -0.49 -0.18 0.17 0.00 -0.13 0.00 0.00 59.36 58.74 1sn4 h GLU 32 Cb 1.29 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.70 1sn4 h GLU 32 CO 0.59 1.02 0.60 -1.54 -0.73 0.00 0.00 179.01 178.95 1sn4 s SER 33 N -6.79 -0.00 0.12 1.04 1.04 -1.23 -4.86 113.70 103.02 1sn4 s SER 33 Ca -0.02 -0.65 -0.25 0.00 0.48 0.00 0.00 55.95 55.51 1sn4 s SER 33 Cb 0.09 0.49 0.07 0.00 0.10 0.00 0.00 66.02 66.76 1sn4 s SER 33 CO 0.84 -0.96 0.83 -0.83 0.98 0.00 0.00 173.24 174.10 1sn4 s GLY 34 N -3.41 -0.35 0.20 7.32 0.00 -1.26 -0.53 107.32 109.29 1sn4 s GLY 34 Ca 0.22 0.40 -0.19 0.00 0.00 0.00 0.00 44.72 45.15 1sn4 s GLY 34 CO 0.05 0.12 0.57 -2.52 0.00 0.00 0.00 173.10 171.32 1sn4 s TYR 35 N -3.42 -0.22 -0.16 1.90 -0.85 -0.54 -3.45 117.35 110.61 1sn4 s TYR 35 Ca 0.08 -0.11 -0.23 0.00 -0.52 0.00 0.00 57.07 56.28 1sn4 s TYR 35 Cb -0.02 0.48 -0.02 0.00 0.38 0.00 0.00 41.96 42.78 1sn4 s TYR 35 CO -0.03 -0.96 0.73 0.00 -1.52 0.00 0.00 175.55 173.76 1sn4 s GLN 37 N 1.74 3.28 0.29 0.00 2.00 0.53 -4.89 119.66 122.61 1sn4 s GLN 37 Ca 0.35 -0.79 -0.28 0.00 -2.00 0.00 0.00 55.36 52.64 1sn4 s GLN 37 Cb -0.17 -3.84 -0.10 0.00 0.80 0.00 0.00 33.01 29.71 1sn4 s GLN 37 CO 0.13 -0.55 0.95 -1.58 -0.50 0.00 0.00 175.29 173.73 1sn4 s TRP 38 N 1.69 3.80 -1.47 1.67 0.51 -1.26 -1.20 118.94 122.68 1sn4 s TRP 38 Ca 0.05 1.83 -0.06 0.00 -2.12 0.00 0.00 56.10 55.81 1sn4 s TRP 38 Cb -0.18 -2.96 0.02 0.00 -0.81 0.00 0.00 33.47 29.55 1sn4 s TRP 38 CO 0.10 0.28 0.52 0.41 -0.51 0.00 0.00 176.95 177.74 1sn4 n GLY 39 N 0.93 -0.51 0.68 0.98 0.00 -1.25 -4.94 105.19 101.09 1sn4 n GLY 39 Ca 0.00 0.11 -0.05 0.00 0.00 0.00 0.00 46.02 46.08 1sn4 n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sn4 n GLY 40 N -1.37 -0.31 0.24 -0.02 0.00 -0.82 -4.90 105.19 98.01 1sn4 n GLY 40 Ca -0.09 -1.81 0.16 0.00 0.00 0.00 0.00 46.02 44.28 1sn4 n GLY 40 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1sn4 h ARG 41 N 0.00 0.00 -0.03 1.61 2.43 -1.95 -2.65 114.38 113.79 1sn4 h ARG 41 Ca -0.07 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 1sn4 h ARG 41 Cb 0.21 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1sn4 h ARG 41 CO 0.06 0.00 -0.50 0.66 -1.51 0.00 0.00 179.97 178.68 1sn4 n TYR 42 N -2.76 0.11 -2.88 2.20 4.01 -1.26 -5.09 117.16 111.49 1sn4 n TYR 42 Ca -0.00 -1.52 0.00 0.00 -0.16 0.00 0.00 57.90 56.22 1sn4 n TYR 42 Cb 0.20 -0.26 0.00 0.00 -0.31 0.00 0.00 39.34 38.97 1sn4 n TYR 42 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1sn4 n GLY 43 N -1.11 -0.63 3.55 2.72 0.00 -1.00 -4.63 105.19 104.09 1sn4 n GLY 43 Ca 0.20 -1.36 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 1sn4 n GLY 43 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1sn4 s ASN 44 N -4.00 6.32 0.13 1.61 0.01 -1.26 -1.95 114.94 115.80 1sn4 s ASN 44 Ca 0.00 -0.10 -0.08 0.00 -0.71 0.00 0.00 52.86 51.97 1sn4 s ASN 44 Cb 0.00 -2.28 -0.01 0.00 0.41 0.00 0.00 41.25 39.37 1sn4 s ASN 44 CO 0.00 -0.53 0.21 0.00 -1.51 0.00 0.00 177.10 175.27 1sn4 s ALA 45 N 2.45 0.03 -0.04 0.60 0.00 -0.34 -1.88 121.76 122.58 1sn4 s ALA 45 Ca 0.19 -0.86 -0.30 0.00 0.00 0.00 0.00 51.96 50.99 1sn4 s ALA 45 Cb -0.15 0.70 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 1sn4 s ALA 45 CO 0.14 -0.57 1.27 0.00 0.00 0.00 0.00 175.76 176.60 1sn4 s TRP 47 N 2.25 3.07 -0.02 0.00 -0.11 0.39 -3.35 118.94 121.17 1sn4 s TRP 47 Ca 0.58 -0.29 0.03 0.00 1.22 0.00 0.00 56.10 57.64 1sn4 s TRP 47 Cb -0.27 -2.03 -0.03 0.00 -1.50 0.00 0.00 33.47 29.64 1sn4 s TRP 47 CO 0.23 -0.08 -0.07 0.00 -4.62 0.00 0.00 176.95 172.41 1sn4 s ILE 49 N -0.92 5.38 -1.27 0.00 -1.09 0.31 -2.14 121.20 121.47 1sn4 s ILE 49 Ca 0.15 0.18 -0.02 0.00 -2.23 0.00 0.00 60.65 58.73 1sn4 s ILE 49 Cb -0.11 -3.46 0.01 0.00 -1.58 0.00 0.00 42.46 37.31 1sn4 s ILE 49 CO 0.05 0.43 0.97 0.29 -1.23 0.00 0.00 174.94 175.45 1sn4 n LYS 50 N 3.65 -6.48 -2.45 2.79 5.02 -1.18 -1.09 118.16 118.42 1sn4 n LYS 50 Ca -0.16 0.79 -0.41 0.00 -2.02 0.00 0.00 58.31 56.51 1sn4 n LYS 50 Cb 0.52 -5.72 -0.04 0.00 -0.02 0.00 0.00 35.03 29.77 1sn4 n LYS 50 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1sn4 s LEU 51 N -6.64 4.52 0.73 -0.35 2.96 0.51 -3.80 118.68 116.61 1sn4 s LEU 51 Ca 0.14 2.25 -0.16 0.00 -0.22 0.00 0.00 54.13 56.14 1sn4 s LEU 51 Cb -0.06 -3.62 0.02 0.00 0.50 0.00 0.00 46.19 43.03 1sn4 s LEU 51 CO 0.75 -0.21 1.12 -2.65 -1.32 0.00 0.00 176.35 174.04 1sn4 n PRO 52 N 1.64 0.58 0.29 0.98 -0.02 -1.26 -0.73 135.00 136.49 1sn4 n PRO 52 Ca 0.01 0.26 0.16 0.00 -2.02 0.00 0.00 63.50 61.91 1sn4 n PRO 52 Cb 0.45 -2.37 0.89 0.00 -0.02 0.00 0.00 33.50 32.46 1sn4 n PRO 52 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1sn4 h ASP 53 N -0.23 0.00 -0.29 2.55 3.32 -1.94 -1.58 116.42 118.26 1sn4 h ASP 53 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1sn4 h ASP 53 Cb 1.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.88 1sn4 h ASP 53 CO 0.48 0.05 0.00 -0.90 -1.72 0.00 0.00 179.24 177.15 1sn4 n ASP 54 N -3.48 2.12 -4.64 6.45 5.75 -1.26 -4.80 116.55 116.68 1sn4 n ASP 54 Ca -0.02 -1.85 -0.35 0.00 -0.01 0.00 0.00 54.79 52.55 1sn4 n ASP 54 Cb 0.17 -0.19 -0.10 0.00 -1.03 0.00 0.00 41.12 39.97 1sn4 n ASP 54 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1sn4 s VAL 55 N -1.62 4.99 0.61 2.12 1.01 -0.60 -5.06 120.40 121.85 1sn4 s VAL 55 Ca 0.32 0.04 -0.19 0.00 0.00 0.00 0.00 61.98 62.15 1sn4 s VAL 55 Cb 0.17 -3.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.24 1sn4 s VAL 55 CO 0.24 0.41 1.26 -2.65 0.00 0.00 0.00 175.10 174.36 1sn4 n PRO 56 N 3.88 1.24 -4.34 2.72 -0.02 -1.26 -4.90 135.00 132.32 1sn4 n PRO 56 Ca -0.16 0.48 -0.18 0.00 -2.02 0.00 0.00 63.50 61.61 1sn4 n PRO 56 Cb 0.52 -2.48 -0.10 0.00 -0.02 0.00 0.00 33.50 31.42 1sn4 n PRO 56 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1sn4 s ILE 57 N -1.38 1.48 0.09 4.25 -4.36 -1.26 -1.68 121.20 118.35 1sn4 s ILE 57 Ca 0.79 -2.13 -0.30 0.00 -0.26 0.00 0.00 60.65 58.74 1sn4 s ILE 57 Cb -0.40 -2.16 -0.06 0.00 1.25 0.00 0.00 42.46 41.09 1sn4 s ILE 57 CO 0.44 -0.50 1.15 -0.60 0.24 0.00 0.00 174.94 175.66 1sn4 s ARG 58 N -3.72 4.49 0.30 0.37 6.06 0.69 -4.65 118.95 122.49 1sn4 s ARG 58 Ca 0.24 1.72 0.06 0.00 -2.50 0.00 0.00 55.73 55.25 1sn4 s ARG 58 Cb 0.02 -3.34 -0.06 0.00 0.06 0.00 0.00 34.95 31.63 1sn4 s ARG 58 CO 0.07 -0.13 -0.03 0.14 -2.50 0.00 0.00 175.30 172.84 1sn4 s VAL 59 N 0.65 1.62 0.34 7.11 -7.23 -1.26 -4.78 120.40 116.85 1sn4 s VAL 59 Ca 0.55 -2.10 -0.28 0.00 -1.81 0.00 0.00 61.98 58.34 1sn4 s VAL 59 Cb -0.29 -2.56 -0.12 0.00 0.56 0.00 0.00 36.38 33.97 1sn4 s VAL 59 CO 0.31 -0.22 1.28 -2.65 -0.31 0.00 0.00 175.10 173.51 1sn4 n PRO 60 N -0.64 2.10 0.00 4.82 -0.02 -1.26 -4.79 135.00 135.20 1sn4 n PRO 60 Ca -0.05 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1sn4 n PRO 60 Cb 0.64 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 1sn4 n PRO 60 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1sn4 n GLY 61 N 0.80 0.79 3.96 -1.23 0.00 -1.26 -5.09 105.19 103.15 1sn4 n GLY 61 Ca 0.05 -2.03 -0.19 0.00 0.00 0.00 0.00 46.02 43.85 1sn4 n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sn4 s LYS 62 N -1.31 2.75 -0.13 1.61 1.02 -1.26 -5.10 119.74 117.32 1sn4 s LYS 62 Ca 0.00 -1.33 -0.11 0.00 0.02 0.00 0.00 55.97 54.55 1sn4 s LYS 62 Cb 0.00 -2.62 -0.05 0.00 -0.52 0.00 0.00 37.83 34.64 1sn4 s LYS 62 CO 0.00 -0.20 0.24 0.00 -0.92 0.00 0.00 175.35 174.47