#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ss6 n SER 2 N 0.00 -3.12 -4.77 1.61 3.41 -1.26 -4.87 113.62 104.62 1ss6 n SER 2 Ca 0.00 -0.75 -0.40 0.00 -0.26 0.00 0.00 58.87 57.45 1ss6 n SER 2 Cb 0.00 -2.59 -0.01 0.00 -0.26 0.00 0.00 64.21 61.36 1ss6 n SER 2 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1ss6 s GLU 3 N -6.57 4.11 -0.83 4.33 2.12 -1.26 -4.85 118.70 115.76 1ss6 s GLU 3 Ca 0.61 2.38 -0.25 0.00 0.36 0.00 0.00 54.97 58.07 1ss6 s GLU 3 Cb -0.33 -2.93 -0.02 0.00 0.26 0.00 0.00 34.13 31.11 1ss6 s GLU 3 CO 0.75 -0.46 1.78 0.15 -0.54 0.00 0.00 175.26 176.94 1ss6 s LYS 4 N -2.07 2.80 0.22 4.30 1.02 -1.26 -4.36 119.74 120.39 1ss6 s LYS 4 Ca 0.53 -0.17 0.00 0.00 0.02 0.00 0.00 55.97 56.35 1ss6 s LYS 4 Cb -0.43 -4.84 0.00 0.00 -0.52 0.00 0.00 37.83 32.04 1ss6 s LYS 4 CO 0.57 -2.90 0.00 -2.13 -0.92 0.00 0.00 175.35 169.98 1ss6 n ARG 5 N 9.00 0.00 0.00 1.68 0.63 -1.26 -5.04 116.66 121.67 1ss6 n ARG 5 Ca 0.30 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.23 1ss6 n ARG 5 Cb 0.49 -0.14 0.00 0.00 0.45 0.00 0.00 32.46 33.26 1ss6 n ARG 5 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 1ss6 n GLN 6 N -3.43 0.00 -0.44 -0.14 1.13 -1.26 -0.55 117.38 112.69 1ss6 n GLN 6 Ca 0.00 0.00 0.09 0.00 -1.94 0.00 0.00 57.00 55.15 1ss6 n GLN 6 Cb 0.00 0.00 0.29 0.00 0.11 0.00 0.00 30.24 30.64 1ss6 n GLN 6 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1ss6 n HIS 7 N 0.00 1.10 -1.23 1.08 8.25 -1.26 -4.47 115.22 118.69 1ss6 n HIS 7 Ca 0.00 -0.47 -0.37 0.00 -0.26 0.00 0.00 57.72 56.63 1ss6 n HIS 7 Cb 0.00 -0.14 -0.03 0.00 1.12 0.00 0.00 29.99 30.95 1ss6 n HIS 7 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1ss6 n SER 8 N 1.05 8.23 -0.01 0.41 7.64 0.29 -3.72 113.62 127.52 1ss6 n SER 8 Ca 0.21 -2.53 0.10 0.00 1.01 0.00 0.00 58.87 57.66 1ss6 n SER 8 Cb 0.67 -1.49 -0.15 0.00 -1.01 0.00 0.00 64.21 62.23 1ss6 n SER 8 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1ss6 n SER 9 N 3.67 0.42 -0.52 6.43 7.64 -0.96 -4.98 113.62 125.32 1ss6 n SER 9 Ca 0.74 -0.30 0.00 0.00 1.01 0.00 0.00 58.87 60.32 1ss6 n SER 9 Cb 0.22 1.67 0.00 0.00 -1.01 0.00 0.00 64.21 65.08 1ss6 n SER 9 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ss6 n GLN 10 N -2.00 0.00 -3.84 1.43 6.02 0.74 -1.51 117.38 118.22 1ss6 n GLN 10 Ca -0.01 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.61 1ss6 n GLN 10 Cb 0.48 -1.80 -0.13 0.00 1.02 0.00 0.00 30.24 29.80 1ss6 n GLN 10 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1ss6 s ASP 11 N -2.59 4.76 -0.13 1.08 2.15 -1.24 0.31 116.67 121.00 1ss6 s ASP 11 Ca 0.00 -0.61 -0.19 0.00 0.43 0.00 0.00 52.55 52.18 1ss6 s ASP 11 Cb 0.00 -1.81 0.05 0.00 -0.30 0.00 0.00 42.92 40.86 1ss6 s ASP 11 CO 0.00 -0.12 0.50 0.68 -0.17 0.00 0.00 175.17 176.06 1ss6 s VAL 12 N 1.47 0.01 -0.52 1.11 -7.23 0.80 -2.00 120.40 114.04 1ss6 s VAL 12 Ca 0.03 -0.09 -0.13 0.00 -1.81 0.00 0.00 61.98 59.98 1ss6 s VAL 12 Cb -0.16 -0.75 0.13 0.00 0.56 0.00 0.00 36.38 36.16 1ss6 s VAL 12 CO -0.00 -0.05 0.44 -1.00 -0.31 0.00 0.00 175.10 174.17 1ss6 s HIS 13 N -0.29 3.35 -0.44 2.82 3.76 -1.26 -1.84 115.29 121.39 1ss6 s HIS 13 Ca -0.05 -1.59 -0.10 0.00 -0.15 0.00 0.00 55.06 53.17 1ss6 s HIS 13 Cb -0.03 -3.66 0.09 0.00 1.11 0.00 0.00 32.58 30.09 1ss6 s HIS 13 CO 0.03 -1.01 0.29 0.08 -0.85 0.00 0.00 174.74 173.28 1ss6 s VAL 14 N 1.43 4.30 -0.32 -0.90 1.01 -0.33 -4.74 120.40 120.85 1ss6 s VAL 14 Ca 0.05 -1.47 -0.21 0.00 0.00 0.00 0.00 61.98 60.35 1ss6 s VAL 14 Cb -0.28 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 1ss6 s VAL 14 CO 0.01 -0.58 0.65 0.54 0.00 0.00 0.00 175.10 175.72 1ss6 s VAL 15 N 1.43 4.91 -0.30 2.92 0.11 -1.26 -0.04 120.40 128.16 1ss6 s VAL 15 Ca 0.04 0.82 -0.10 0.00 -2.93 0.00 0.00 61.98 59.80 1ss6 s VAL 15 Cb -0.24 -4.03 -0.02 0.00 -1.53 0.00 0.00 36.38 30.56 1ss6 s VAL 15 CO 0.02 -0.20 0.17 -0.22 -3.33 0.00 0.00 175.10 171.54 1ss6 s LEU 16 N 2.67 4.09 -0.06 2.54 0.20 0.11 -2.74 118.68 125.49 1ss6 s LEU 16 Ca 0.26 -0.35 -0.00 0.00 0.69 0.00 0.00 54.13 54.72 1ss6 s LEU 16 Cb -0.15 -2.05 -0.03 0.00 -0.43 0.00 0.00 46.19 43.53 1ss6 s LEU 16 CO 0.13 -0.15 -0.02 -0.54 -0.29 0.00 0.00 176.35 175.48 1ss6 s LYS 17 N 1.67 2.85 -0.24 1.98 1.02 0.71 0.04 119.74 127.77 1ss6 s LYS 17 Ca 0.06 -0.51 -0.10 0.00 0.02 0.00 0.00 55.97 55.44 1ss6 s LYS 17 Cb -0.17 -2.70 -0.05 0.00 -0.52 0.00 0.00 37.83 34.40 1ss6 s LYS 17 CO 0.08 0.67 0.16 -1.17 -0.92 0.00 0.00 175.35 174.17 1ss6 s LEU 18 N -1.05 4.08 0.00 3.17 2.96 0.43 -0.79 118.68 127.48 1ss6 s LEU 18 Ca 0.15 0.08 0.00 0.00 -0.22 0.00 0.00 54.13 54.14 1ss6 s LEU 18 Cb -0.11 -2.10 0.00 0.00 0.50 0.00 0.00 46.19 44.48 1ss6 s LEU 18 CO 0.04 0.05 0.00 0.79 -1.32 0.00 0.00 176.35 175.91 1ss6 n TRP 19 N 4.40 -0.40 0.07 5.38 7.02 0.20 0.56 117.44 134.67 1ss6 n TRP 19 Ca -0.15 0.00 -0.11 0.00 -1.02 0.00 0.00 57.50 56.22 1ss6 n TRP 19 Cb 0.52 0.00 -0.13 0.00 -2.42 0.00 0.00 31.31 29.28 1ss6 n TRP 19 CO 0.00 0.00 0.00 1.57 -2.02 0.00 0.00 177.69 177.24 1ss6 h LYS 20 N 0.00 0.12 0.14 -0.99 5.09 -1.67 -3.36 116.57 115.90 1ss6 h LYS 20 Ca 0.00 -0.20 -0.33 0.00 0.09 0.00 0.00 60.65 60.20 1ss6 h LYS 20 Cb 0.00 0.08 -0.00 0.00 0.10 0.00 0.00 32.23 32.40 1ss6 h LYS 20 CO 0.00 1.06 -1.73 0.77 -2.09 0.00 0.00 179.45 177.46 1ss6 h SER 21 N 0.03 0.47 0.00 7.07 0.02 -1.95 -3.48 113.55 115.71 1ss6 h SER 21 Ca -0.09 -0.91 0.00 0.00 -0.84 0.00 0.00 61.79 59.95 1ss6 h SER 21 Cb 1.88 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 64.27 1ss6 h SER 21 CO 0.16 1.76 0.00 0.61 -1.14 0.00 0.00 176.83 178.22 1ss6 n GLY 22 N 1.86 2.16 2.84 -3.77 0.00 -1.26 0.13 105.19 107.14 1ss6 n GLY 22 Ca -0.28 -0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 1ss6 n GLY 22 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ss6 s PHE 23 N 0.62 0.02 -0.09 1.61 -0.71 0.87 0.61 117.98 120.91 1ss6 s PHE 23 Ca 0.00 0.04 0.03 0.00 -1.04 0.00 0.00 56.93 55.96 1ss6 s PHE 23 Cb 0.00 -0.09 -0.01 0.00 -1.21 0.00 0.00 43.02 41.70 1ss6 s PHE 23 CO 0.00 -0.03 -0.18 -1.54 -1.34 0.00 0.00 175.22 172.13 1ss6 s SER 24 N 0.38 3.68 0.47 1.98 1.04 0.03 0.65 113.70 121.94 1ss6 s SER 24 Ca -0.03 -0.37 0.08 0.00 0.48 0.00 0.00 55.95 56.11 1ss6 s SER 24 Cb -0.05 -1.21 0.02 0.00 0.10 0.00 0.00 66.02 64.89 1ss6 s SER 24 CO -0.01 0.23 0.52 -0.76 0.98 0.00 0.00 173.24 174.20 1ss6 s LEU 25 N -0.05 3.27 0.36 2.42 1.02 -1.26 -0.21 118.68 124.23 1ss6 s LEU 25 Ca -0.04 -0.78 0.04 0.00 0.02 0.00 0.00 54.13 53.37 1ss6 s LEU 25 Cb -0.14 -1.96 0.69 0.00 0.02 0.00 0.00 46.19 44.80 1ss6 s LEU 25 CO 0.04 -0.91 1.99 -0.78 0.02 0.00 0.00 176.35 176.71 1ss6 h ASP 26 N 0.70 0.70 -0.18 2.29 3.58 -1.81 -3.20 116.42 118.50 1ss6 h ASP 26 Ca -0.38 -0.01 -0.47 0.00 0.42 0.00 0.00 57.03 56.59 1ss6 h ASP 26 Cb 1.28 -0.16 -0.04 0.00 1.72 0.00 0.00 39.33 42.13 1ss6 h ASP 26 CO 0.51 0.48 1.79 -0.46 -2.88 0.00 0.00 179.24 178.68 1ss6 n ASN 27 N -4.46 7.14 0.00 2.28 6.94 -1.26 -4.88 115.26 121.02 1ss6 n ASN 27 Ca 0.08 -2.63 0.00 0.00 -0.02 0.00 0.00 54.58 52.01 1ss6 n ASN 27 Cb 0.13 -1.46 0.00 0.00 -2.36 0.00 0.00 39.78 36.08 1ss6 n ASN 27 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ss6 n GLY 28 N 2.78 0.80 0.00 4.83 0.00 -1.21 -4.99 105.19 107.40 1ss6 n GLY 28 Ca 0.61 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 44.59 1ss6 n GLY 28 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ss6 n GLU 29 N 0.00 1.50 -1.80 1.61 1.02 -1.26 -4.26 120.64 117.44 1ss6 n GLU 29 Ca 0.00 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.71 1ss6 n GLU 29 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.39 1ss6 n GLU 29 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1ss6 s LEU 30 N 0.00 3.46 -0.53 -4.62 0.20 -1.26 -4.08 118.68 111.85 1ss6 s LEU 30 Ca 0.00 1.53 -0.22 0.00 0.69 0.00 0.00 54.13 56.13 1ss6 s LEU 30 Cb 0.00 -3.44 0.05 0.00 -0.43 0.00 0.00 46.19 42.36 1ss6 s LEU 30 CO 0.00 -1.90 0.83 -0.13 -0.29 0.00 0.00 176.35 174.86 1ss6 s ARG 31 N 6.13 3.26 0.46 1.98 1.81 0.21 -4.80 118.95 128.00 1ss6 s ARG 31 Ca 0.90 -0.47 -0.25 0.00 -1.72 0.00 0.00 55.73 54.19 1ss6 s ARG 31 Cb -0.27 -4.06 -0.08 0.00 -0.45 0.00 0.00 34.95 30.09 1ss6 s ARG 31 CO 0.34 -1.38 1.39 -1.12 -0.68 0.00 0.00 175.30 173.85 1ss6 s SER 32 N 2.76 5.82 0.47 0.23 0.01 -1.26 -0.09 113.70 121.64 1ss6 s SER 32 Ca 0.25 2.84 0.31 0.00 1.31 0.00 0.00 55.95 60.66 1ss6 s SER 32 Cb -0.15 -2.65 1.31 0.00 0.21 0.00 0.00 66.02 64.75 1ss6 s SER 32 CO 0.17 -1.21 1.92 1.88 0.41 0.00 0.00 173.24 176.41 1ss6 h TYR 33 N 2.19 0.00 0.00 2.43 0.05 -0.65 -2.96 116.97 118.03 1ss6 h TYR 33 Ca -0.51 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 58.04 1ss6 h TYR 33 Cb 1.27 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.97 1ss6 h TYR 33 CO 0.50 0.00 -1.21 1.96 -1.05 0.00 0.00 178.16 178.36 1ss6 h GLN 34 N 0.00 0.00 -6.66 4.88 4.20 -1.90 -3.44 115.11 112.18 1ss6 h GLN 34 Ca 0.00 -0.01 -0.52 0.00 0.06 0.00 0.00 58.65 58.18 1ss6 h GLN 34 Cb 0.44 0.00 0.06 0.00 0.30 0.00 0.00 27.48 28.28 1ss6 h GLN 34 CO 0.00 0.86 0.98 0.34 -0.67 0.00 0.00 178.83 180.34 1ss6 s ASP 35 N -6.54 6.41 0.56 1.46 2.15 -1.12 -4.89 116.67 114.70 1ss6 s ASP 35 Ca -0.01 2.84 0.37 0.00 0.43 0.00 0.00 52.55 56.18 1ss6 s ASP 35 Cb 0.09 -2.60 1.81 0.00 -0.30 0.00 0.00 42.92 41.93 1ss6 s ASP 35 CO 0.82 -0.95 2.11 -0.65 -0.17 0.00 0.00 175.17 176.33 1ss6 h PRO 36 N 6.62 0.00 0.00 4.34 0.11 -1.90 -2.07 132.00 139.09 1ss6 h PRO 36 Ca -0.43 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.43 1ss6 h PRO 36 Cb 1.20 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 1ss6 h PRO 36 CO 0.94 0.00 -1.41 1.03 -0.21 0.00 0.00 178.00 178.35 1ss6 h SER 37 N 0.00 0.00 1.95 -2.05 0.87 -1.95 -3.26 113.55 109.12 1ss6 h SER 37 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 1ss6 h SER 37 Cb 0.20 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.16 1ss6 h SER 37 CO 0.00 0.92 -0.03 0.78 -0.53 0.00 0.00 176.83 177.97 1ss6 h ASN 38 N 0.00 0.00 -0.11 6.23 2.35 -1.69 -2.93 115.58 119.43 1ss6 h ASN 38 Ca -0.18 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.60 1ss6 h ASN 38 Cb 1.86 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 40.22 1ss6 h ASN 38 CO 0.09 0.03 0.09 0.00 -1.65 0.00 0.00 177.43 175.99 1ss6 h ALA 39 N 1.97 1.92 -0.04 -0.83 0.00 -1.46 -1.38 119.26 119.45 1ss6 h ALA 39 Ca -0.00 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1ss6 h ALA 39 Cb 1.01 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 1ss6 h ALA 39 CO 0.00 -0.15 -0.14 0.37 0.00 0.00 0.00 179.25 179.33 1ss6 h GLN 40 N 0.00 -0.21 0.57 0.00 -0.00 -1.66 -1.38 115.11 112.42 1ss6 h GLN 40 Ca 0.05 0.01 -0.03 0.00 -0.00 0.00 0.00 58.65 58.69 1ss6 h GLN 40 Cb 0.24 0.05 0.01 0.00 0.00 0.00 0.00 27.48 27.77 1ss6 h GLN 40 CO -0.00 -0.14 -0.27 0.74 0.00 0.00 0.00 178.83 179.16 1ss6 h PHE 41 N -0.22 -0.71 -0.56 3.99 0.04 -1.45 -2.00 116.94 116.03 1ss6 h PHE 41 Ca 0.06 -0.02 0.11 0.00 2.80 0.00 0.00 57.97 60.93 1ss6 h PHE 41 Cb 0.30 0.23 -0.11 0.00 2.20 0.00 0.00 35.95 38.57 1ss6 h PHE 41 CO -0.22 -0.43 -0.18 -0.07 -0.60 0.00 0.00 178.31 176.80 1ss6 h LEU 42 N -0.77 -0.66 -0.10 1.54 3.38 -1.24 0.11 115.31 117.57 1ss6 h LEU 42 Ca -0.08 0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 1ss6 h LEU 42 Cb 0.59 0.40 0.00 0.00 0.09 0.00 0.00 40.66 41.74 1ss6 h LEU 42 CO 0.13 -0.22 -0.26 -0.08 0.09 0.00 0.00 178.44 178.09 1ss6 h GLU 43 N -0.05 0.35 -0.78 1.13 4.81 -1.24 -0.66 114.58 118.15 1ss6 h GLU 43 Ca 0.26 -0.25 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1ss6 h GLU 43 Cb 0.46 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 1ss6 h GLU 43 CO -0.60 0.86 0.46 0.77 -0.73 0.00 0.00 179.01 179.77 1ss6 h SER 44 N -0.10 0.94 0.99 1.04 0.02 -0.86 0.13 113.55 115.70 1ss6 h SER 44 Ca -0.01 -0.06 -0.17 0.00 -0.84 0.00 0.00 61.79 60.72 1ss6 h SER 44 Cb 0.88 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 1ss6 h SER 44 CO 0.06 0.73 -0.80 0.40 -1.14 0.00 0.00 176.83 176.08 1ss6 h ILE 45 N 1.07 1.47 -0.32 3.27 2.04 -0.80 0.47 117.51 124.72 1ss6 h ILE 45 Ca 0.28 -2.83 -0.12 0.00 1.00 0.00 0.00 64.86 63.19 1ss6 h ILE 45 Cb -0.03 2.57 -0.01 0.00 -0.74 0.00 0.00 36.82 38.62 1ss6 h ILE 45 CO -0.05 0.78 -0.25 -0.09 0.00 0.00 0.00 178.15 178.54 1ss6 h ARG 46 N 0.00 0.74 0.01 2.37 2.43 -0.29 -3.28 114.38 116.36 1ss6 h ARG 46 Ca -0.01 -0.36 -0.00 0.00 -0.81 0.00 0.00 59.98 58.80 1ss6 h ARG 46 Cb 1.51 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.06 1ss6 h ARG 46 CO 0.10 0.98 -0.00 0.00 -1.51 0.00 0.00 179.97 179.54 1ss6 h ARG 47 N 0.50 -0.01 0.00 0.20 2.47 -0.69 -3.48 114.38 113.38 1ss6 h ARG 47 Ca 0.06 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.78 1ss6 h ARG 47 Cb 0.81 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.13 1ss6 h ARG 47 CO 0.07 0.55 0.00 0.41 0.56 0.00 0.00 179.97 181.56 1ss6 n GLY 48 N 0.44 0.67 4.00 0.04 0.00 -0.27 -5.11 105.19 104.96 1ss6 n GLY 48 Ca -0.09 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.76 1ss6 n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ss6 s GLU 49 N 0.00 2.77 -0.27 1.61 2.02 0.15 -5.00 118.70 119.98 1ss6 s GLU 49 Ca 0.00 -1.29 -0.08 0.00 0.02 0.00 0.00 54.97 53.61 1ss6 s GLU 49 Cb 0.00 -2.72 -0.02 0.00 0.10 0.00 0.00 34.13 31.48 1ss6 s GLU 49 CO 0.00 -0.31 0.10 0.08 0.02 0.00 0.00 175.26 175.15 1ss6 s VAL 50 N -2.38 4.46 0.45 2.63 1.01 -1.26 -4.07 120.40 121.22 1ss6 s VAL 50 Ca 0.55 -0.23 -0.25 0.00 0.00 0.00 0.00 61.98 62.05 1ss6 s VAL 50 Cb -0.09 -3.15 -0.09 0.00 0.00 0.00 0.00 36.38 33.05 1ss6 s VAL 50 CO 0.33 0.25 1.35 -2.65 0.00 0.00 0.00 175.10 174.38 1ss6 n PRO 51 N 4.95 2.05 0.16 2.72 -0.02 -1.26 -4.86 135.00 138.73 1ss6 n PRO 51 Ca -0.15 0.73 0.03 0.00 -2.02 0.00 0.00 63.50 62.09 1ss6 n PRO 51 Cb 0.51 -2.51 0.43 0.00 -0.02 0.00 0.00 33.50 31.90 1ss6 n PRO 51 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ss6 h ALA 52 N 2.10 1.56 -0.95 3.55 0.00 -1.97 -2.60 119.26 120.95 1ss6 h ALA 52 Ca -0.49 -0.20 0.11 0.00 0.00 0.00 0.00 54.91 54.32 1ss6 h ALA 52 Cb 1.28 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.94 1ss6 h ALA 52 CO 0.60 0.32 0.61 0.93 0.00 0.00 0.00 179.25 181.71 1ss6 h GLU 53 N 0.13 0.92 0.00 0.00 4.39 -1.92 0.47 114.58 118.58 1ss6 h GLU 53 Ca 0.03 -0.06 -0.13 0.00 0.34 0.00 0.00 59.36 59.54 1ss6 h GLU 53 Cb 0.37 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 1ss6 h GLU 53 CO 0.02 0.61 -0.80 1.37 -1.16 0.00 0.00 179.01 179.05 1ss6 h LEU 54 N 0.95 0.00 -0.63 1.33 -0.00 -1.89 -3.35 115.31 111.72 1ss6 h LEU 54 Ca 0.45 -0.49 -0.10 0.00 -0.00 0.00 0.00 57.88 57.74 1ss6 h LEU 54 Cb 0.44 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.08 1ss6 h LEU 54 CO -0.22 1.21 -0.04 -0.09 -0.00 0.00 0.00 178.44 179.30 1ss6 h ARG 55 N -1.00 1.03 -0.94 0.17 1.12 -1.40 0.54 114.38 113.90 1ss6 h ARG 55 Ca -0.20 -0.34 -0.06 0.00 -1.11 0.00 0.00 59.98 58.27 1ss6 h ARG 55 Cb 1.03 -0.08 -0.04 0.00 -0.01 0.00 0.00 29.97 30.87 1ss6 h ARG 55 CO -0.12 1.03 0.08 0.54 -3.11 0.00 0.00 179.97 178.38 1ss6 n ARG 56 N -4.17 1.74 0.00 0.20 5.12 0.17 -3.67 116.66 116.04 1ss6 n ARG 56 Ca 0.02 -0.82 0.00 0.00 -1.93 0.00 0.00 57.85 55.12 1ss6 n ARG 56 Cb 0.37 -1.54 0.00 0.00 -1.16 0.00 0.00 32.46 30.13 1ss6 n ARG 56 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 1ss6 n LEU 57 N 0.12 0.05 -4.61 0.55 -0.00 -0.88 -4.95 117.00 107.29 1ss6 n LEU 57 Ca 0.11 0.00 -0.42 0.00 -0.00 0.00 0.00 56.01 55.70 1ss6 n LEU 57 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.06 1ss6 n LEU 57 CO 0.12 -0.12 0.60 0.00 -0.00 0.00 0.00 177.39 177.98 1ss6 n ALA 58 N -1.79 0.15 -3.55 1.96 0.00 0.18 -4.84 120.51 112.62 1ss6 n ALA 58 Ca 0.00 0.28 -0.25 0.00 0.00 0.00 0.00 53.44 53.47 1ss6 n ALA 58 Cb 0.01 -2.08 -0.15 0.00 0.00 0.00 0.00 19.45 17.24 1ss6 n ALA 58 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1ss6 s HIS 59 N -1.21 0.09 0.00 0.00 -3.43 -0.85 -0.18 115.29 109.71 1ss6 s HIS 59 Ca 0.61 -0.36 0.00 0.00 -0.80 0.00 0.00 55.06 54.52 1ss6 s HIS 59 Cb -0.59 -0.67 0.00 0.00 -1.43 0.00 0.00 32.58 29.89 1ss6 s HIS 59 CO 0.58 -0.65 0.00 0.41 -2.00 0.00 0.00 174.74 173.09 1ss6 n GLY 60 N 5.28 3.11 0.00 -1.38 0.00 -1.25 -4.06 105.19 106.88 1ss6 n GLY 60 Ca -0.06 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1ss6 n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ss6 n GLY 61 N 0.00 1.33 2.82 -0.02 0.00 -0.57 -4.69 105.19 104.06 1ss6 n GLY 61 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1ss6 n GLY 61 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1ss6 n GLN 62 N -1.28 2.73 -3.02 1.61 7.27 0.99 -4.75 117.38 120.93 1ss6 n GLN 62 Ca 0.00 -4.56 -0.44 0.00 0.07 0.00 0.00 57.00 52.07 1ss6 n GLN 62 Cb 0.00 -2.35 -0.05 0.00 2.41 0.00 0.00 30.24 30.25 1ss6 n GLN 62 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1ss6 s VAL 63 N -1.99 4.65 0.08 1.69 0.11 0.15 -0.14 120.40 124.94 1ss6 s VAL 63 Ca 0.32 -0.46 0.08 0.00 -2.93 0.00 0.00 61.98 58.99 1ss6 s VAL 63 Cb 0.03 -4.48 -0.03 0.00 -1.53 0.00 0.00 36.38 30.37 1ss6 s VAL 63 CO -0.06 -1.10 -0.22 0.21 -3.33 0.00 0.00 175.10 170.60 1ss6 s ASN 64 N 3.20 2.63 -0.09 3.54 2.47 -0.77 -4.92 114.94 120.99 1ss6 s ASN 64 Ca 0.18 -0.62 -0.00 0.00 0.42 0.00 0.00 52.86 52.84 1ss6 s ASN 64 Cb -0.19 -0.19 0.02 0.00 -1.45 0.00 0.00 41.25 39.45 1ss6 s ASN 64 CO 0.11 0.13 -0.06 -0.22 -3.72 0.00 0.00 177.10 173.34 1ss6 s LEU 65 N -1.57 1.06 0.33 3.21 2.96 -1.26 -1.18 118.68 122.23 1ss6 s LEU 65 Ca 0.08 -0.23 0.07 0.00 -0.22 0.00 0.00 54.13 53.83 1ss6 s LEU 65 Cb -0.09 -0.70 -0.02 0.00 0.50 0.00 0.00 46.19 45.87 1ss6 s LEU 65 CO 0.03 -0.12 0.33 -0.62 -1.32 0.00 0.00 176.35 174.64 1ss6 s ASP 66 N 1.65 5.47 -0.02 3.68 2.15 0.94 -4.95 116.67 125.57 1ss6 s ASP 66 Ca 0.02 -0.41 0.01 0.00 0.43 0.00 0.00 52.55 52.60 1ss6 s ASP 66 Cb -0.13 -1.07 0.02 0.00 -0.30 0.00 0.00 42.92 41.44 1ss6 s ASP 66 CO -0.06 -0.35 -0.01 -0.04 -0.17 0.00 0.00 175.17 174.54 1ss6 s MET 67 N -4.02 0.28 0.27 4.34 -1.94 -1.25 0.04 119.30 117.02 1ss6 s MET 67 Ca 0.41 0.00 0.04 0.00 -1.71 0.00 0.00 55.69 54.44 1ss6 s MET 67 Cb -0.07 -0.39 -0.06 0.00 2.01 0.00 0.00 34.83 36.33 1ss6 s MET 67 CO 0.27 -0.06 -0.00 -1.21 -0.01 0.00 0.00 175.02 174.02 1ss6 s GLU 68 N 0.59 1.47 -0.18 2.03 2.02 0.11 -4.95 118.70 119.78 1ss6 s GLU 68 Ca -0.06 -1.76 0.01 0.00 0.02 0.00 0.00 54.97 53.18 1ss6 s GLU 68 Cb -0.09 -0.80 0.03 0.00 0.10 0.00 0.00 34.13 33.37 1ss6 s GLU 68 CO -0.01 -0.09 -0.14 0.34 0.02 0.00 0.00 175.26 175.38 1ss6 s ASP 69 N -3.38 3.14 -0.30 -0.19 2.15 -1.26 -0.43 116.67 116.40 1ss6 s ASP 69 Ca 0.31 -0.72 0.20 0.00 0.43 0.00 0.00 52.55 52.77 1ss6 s ASP 69 Cb 0.06 -1.30 0.48 0.00 -0.30 0.00 0.00 42.92 41.85 1ss6 s ASP 69 CO 0.11 -0.08 1.12 1.41 -0.17 0.00 0.00 175.17 177.57 1ss6 n HIS 70 N 4.68 0.64 0.05 -5.34 8.25 0.19 -4.88 115.22 118.81 1ss6 n HIS 70 Ca -0.17 -2.29 -0.12 0.00 -0.26 0.00 0.00 57.72 54.88 1ss6 n HIS 70 Cb 0.48 0.03 -0.06 0.00 1.12 0.00 0.00 29.99 31.57 1ss6 n HIS 70 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ss6 h ARG 71 N 2.52 -0.48 -0.15 -0.41 3.08 -1.62 -1.67 114.38 115.65 1ss6 h ARG 71 Ca -0.17 0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.91 1ss6 h ARG 71 Cb 1.25 0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.41 1ss6 h ARG 71 CO 0.23 -0.32 0.00 -0.40 -1.07 0.00 0.00 179.97 178.40 1ss6 n ASP 72 N -5.43 1.05 -0.03 7.04 5.68 -1.26 -2.21 116.55 121.39 1ss6 n ASP 72 Ca -0.05 -1.77 -0.04 0.00 -0.50 0.00 0.00 54.79 52.43 1ss6 n ASP 72 Cb 0.35 -0.10 -0.13 0.00 -1.14 0.00 0.00 41.12 40.10 1ss6 n ASP 72 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1ss6 n GLU 73 N -0.02 0.65 -0.97 0.11 1.02 -0.68 -4.95 120.64 115.80 1ss6 n GLU 73 Ca 0.12 0.10 0.12 0.00 -0.02 0.00 0.00 57.16 57.48 1ss6 n GLU 73 Cb 0.20 -1.67 -0.05 0.00 -0.02 0.00 0.00 31.44 29.91 1ss6 n GLU 73 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1ss6 n ASP 74 N -2.79 -5.83 -4.66 1.62 -0.08 -0.87 -4.86 116.55 99.07 1ss6 n ASP 74 Ca -0.19 0.68 -0.46 0.00 -1.51 0.00 0.00 54.79 53.32 1ss6 n ASP 74 Cb 0.96 -3.13 -0.03 0.00 2.34 0.00 0.00 41.12 41.26 1ss6 n ASP 74 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 1ss6 n PHE 75 N -3.69 2.16 -2.75 -0.67 7.35 -1.26 -4.96 117.46 113.64 1ss6 n PHE 75 Ca -0.02 0.39 -0.03 0.00 -0.76 0.00 0.00 57.45 57.02 1ss6 n PHE 75 Cb 0.45 -2.48 0.02 0.00 0.35 0.00 0.00 39.48 37.82 1ss6 n PHE 75 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1ss6 s VAL 76 N 0.29 -0.73 0.00 -2.13 0.11 -1.26 -5.04 120.40 111.65 1ss6 s VAL 76 Ca 0.73 -0.69 0.00 0.00 -2.93 0.00 0.00 61.98 59.09 1ss6 s VAL 76 Cb -0.68 0.00 0.00 0.00 -1.53 0.00 0.00 36.38 34.17 1ss6 s VAL 76 CO 0.45 0.00 0.00 2.29 -3.33 0.00 0.00 175.10 174.51 1ss6 n LYS 77 N 2.90 0.00 -0.17 1.54 2.85 -1.26 -2.14 118.16 121.88 1ss6 n LYS 77 Ca 0.15 0.00 0.08 0.00 -1.05 0.00 0.00 58.31 57.50 1ss6 n LYS 77 Cb 0.59 0.00 0.39 0.00 -0.65 0.00 0.00 35.03 35.36 1ss6 n LYS 77 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 177.40 176.00 1ss6 h PRO 78 N 0.00 0.65 -0.73 -1.58 0.11 -1.89 0.99 132.00 129.55 1ss6 h PRO 78 Ca 0.00 -0.04 0.09 0.00 0.11 0.00 0.00 66.00 66.17 1ss6 h PRO 78 Cb 0.00 -0.15 -0.11 0.00 0.11 0.00 0.00 31.00 30.86 1ss6 h PRO 78 CO 0.00 0.43 -0.34 1.63 -0.21 0.00 0.00 178.00 179.51 1ss6 n LYS 79 N -4.49 -0.23 -1.37 1.05 5.02 -1.26 -4.33 118.16 112.55 1ss6 n LYS 79 Ca 0.11 1.12 -0.00 0.00 -2.02 0.00 0.00 58.31 57.52 1ss6 n LYS 79 Cb 0.29 -1.66 0.00 0.00 -0.02 0.00 0.00 35.03 33.65 1ss6 n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ss6 n GLY 80 N -1.28 -0.79 5.29 0.72 0.00 -1.16 -5.04 105.19 102.93 1ss6 n GLY 80 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1ss6 n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ss6 n ALA 81 N -0.06 0.00 -0.88 4.61 0.00 0.33 -4.88 120.51 119.64 1ss6 n ALA 81 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1ss6 n ALA 81 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 1ss6 n ALA 81 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1ss6 n PHE 82 N 0.00 0.00 0.00 0.00 3.72 -1.26 -2.66 117.46 117.26 1ss6 n PHE 82 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1ss6 n PHE 82 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 1ss6 n PHE 82 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1ss6 n LYS 83 N 0.00 0.00 0.00 -1.08 4.76 -1.26 -4.95 118.16 115.62 1ss6 n LYS 83 Ca 0.00 0.04 0.00 0.00 -2.87 0.00 0.00 58.31 55.48 1ss6 n LYS 83 Cb 0.00 -0.36 0.00 0.00 -1.84 0.00 0.00 35.03 32.83 1ss6 n LYS 83 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ss6 n ALA 84 N -1.98 0.00 -3.39 7.82 0.00 -0.91 -4.04 120.51 118.02 1ss6 n ALA 84 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 1ss6 n ALA 84 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1ss6 n ALA 84 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1ss6 s PHE 85 N 0.00 -0.97 -0.24 0.00 -0.71 -1.26 -5.00 117.98 109.80 1ss6 s PHE 85 Ca 0.00 1.47 0.18 0.00 -1.04 0.00 0.00 56.93 57.54 1ss6 s PHE 85 Cb 0.00 0.50 -0.26 0.00 -1.21 0.00 0.00 43.02 42.05 1ss6 s PHE 85 CO 0.00 -0.50 0.50 0.25 -1.34 0.00 0.00 175.22 174.13 1ss6 n THR 86 N 5.24 0.00 0.00 -4.49 -2.24 -1.26 -4.93 114.28 106.61 1ss6 n THR 86 Ca -0.08 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1ss6 n THR 86 Cb 0.52 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 69.07 1ss6 n THR 86 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ss6 n GLY 87 N 1.45 0.63 3.65 3.38 0.00 -1.26 -5.13 105.19 107.91 1ss6 n GLY 87 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 1ss6 n GLY 87 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ss6 s GLU 88 N 0.00 4.13 -0.10 1.61 1.03 -1.26 -5.01 118.70 119.09 1ss6 s GLU 88 Ca 0.00 0.25 -0.31 0.00 0.03 0.00 0.00 54.97 54.93 1ss6 s GLU 88 Cb 0.00 -3.59 -0.09 0.00 -0.80 0.00 0.00 34.13 29.65 1ss6 s GLU 88 CO 0.00 -0.17 2.04 0.41 -1.33 0.00 0.00 175.26 176.21 1ss6 n GLY 89 N 4.14 1.40 3.66 -3.83 0.00 -1.26 -4.90 105.19 104.41 1ss6 n GLY 89 Ca -0.07 0.83 -0.42 0.00 0.00 0.00 0.00 46.02 46.36 1ss6 n GLY 89 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ss6 s GLN 90 N 5.03 4.20 -1.32 1.61 -1.52 -1.26 -2.05 119.66 124.36 1ss6 s GLN 90 Ca 0.95 2.06 0.00 0.00 -1.95 0.00 0.00 55.36 56.42 1ss6 s GLN 90 Cb -0.52 -3.89 0.00 0.00 -0.22 0.00 0.00 33.01 28.38 1ss6 s GLN 90 CO 0.44 -0.79 0.00 1.17 -0.25 0.00 0.00 175.29 175.86 1ss6 n LYS 91 N 6.81 -0.90 -1.97 2.91 3.00 -1.26 -4.91 118.16 121.84 1ss6 n LYS 91 Ca 0.16 0.90 -0.41 0.00 -0.00 0.00 0.00 58.31 58.97 1ss6 n LYS 91 Cb 0.43 -4.97 -0.01 0.00 0.00 0.00 0.00 35.03 30.49 1ss6 n LYS 91 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1ss6 n LEU 92 N -1.50 7.67 0.00 3.14 7.94 -0.87 -4.81 117.00 128.57 1ss6 n LEU 92 Ca -0.13 -4.69 0.00 0.00 -1.11 0.00 0.00 56.01 50.08 1ss6 n LEU 92 Cb 0.45 -1.45 0.00 0.00 0.53 0.00 0.00 43.42 42.95 1ss6 n LEU 92 CO 0.19 1.79 0.00 0.61 -1.11 0.00 0.00 177.39 178.88 1ss6 n GLY 93 N 2.49 -0.78 3.63 -3.96 0.00 -1.26 -4.91 105.19 100.40 1ss6 n GLY 93 Ca 0.57 -1.19 -0.43 0.00 0.00 0.00 0.00 46.02 44.98 1ss6 n GLY 93 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ss6 s SER 94 N -0.53 6.33 -1.39 1.61 0.01 -1.26 -4.91 113.70 113.56 1ss6 s SER 94 Ca 0.00 1.74 -0.15 0.00 1.31 0.00 0.00 55.95 58.85 1ss6 s SER 94 Cb 0.00 -2.53 0.06 0.00 0.21 0.00 0.00 66.02 63.76 1ss6 s SER 94 CO 0.00 -1.28 2.02 0.35 0.41 0.00 0.00 173.24 174.75 1ss6 n THR 95 N 6.39 3.67 -3.91 1.44 -2.24 -1.26 -4.86 114.28 113.51 1ss6 n THR 95 Ca 0.20 -3.49 -0.30 0.00 -2.27 0.00 0.00 64.05 58.19 1ss6 n THR 95 Cb 0.45 -2.50 -0.14 0.00 -2.10 0.00 0.00 70.33 66.04 1ss6 n THR 95 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ss6 s ALA 96 N 3.52 3.09 -0.92 6.98 0.00 -1.26 -1.26 121.76 131.90 1ss6 s ALA 96 Ca 0.49 -3.12 -0.24 0.00 0.00 0.00 0.00 51.96 49.09 1ss6 s ALA 96 Cb 0.10 -2.10 -0.00 0.00 0.00 0.00 0.00 23.12 21.11 1ss6 s ALA 96 CO -0.02 -2.01 1.72 -1.25 0.00 0.00 0.00 175.76 174.20 1ss6 s PRO 97 N -0.13 2.99 0.10 0.00 0.04 -1.20 -4.71 135.00 132.09 1ss6 s PRO 97 Ca 0.17 -0.56 0.00 0.00 0.04 0.00 0.00 61.00 60.65 1ss6 s PRO 97 Cb -0.25 -5.10 0.00 0.00 0.04 0.00 0.00 34.50 29.19 1ss6 s PRO 97 CO -0.00 -2.83 0.00 1.04 0.04 0.00 0.00 177.00 175.24 1ss6 n GLN 98 N 8.91 0.00 -0.35 4.56 6.02 -1.26 -2.09 117.38 133.17 1ss6 n GLN 98 Ca 0.35 0.00 0.02 0.00 -0.01 0.00 0.00 57.00 57.35 1ss6 n GLN 98 Cb 0.49 0.00 0.02 0.00 1.02 0.00 0.00 30.24 31.77 1ss6 n GLN 98 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1ss6 n VAL 99 N 0.00 0.37 -4.48 5.09 0.24 -1.26 -5.09 118.33 113.20 1ss6 n VAL 99 Ca 0.00 -0.44 -0.21 0.00 -2.04 0.00 0.00 64.34 61.65 1ss6 n VAL 99 Cb 0.00 0.43 -0.05 0.00 -1.47 0.00 0.00 33.84 32.75 1ss6 n VAL 99 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 1ss6 n LEU 100 N -0.27 0.00 -3.80 1.34 7.94 -0.89 -5.13 117.00 116.19 1ss6 n LEU 100 Ca 0.03 -2.15 -0.30 0.00 -1.11 0.00 0.00 56.01 52.48 1ss6 n LEU 100 Cb 0.65 0.33 -0.15 0.00 0.53 0.00 0.00 43.42 44.78 1ss6 n LEU 100 CO 0.00 -0.31 -0.36 -0.44 -1.11 0.00 0.00 177.39 175.18 1ss6 s SER 101 N -2.85 3.83 0.00 1.96 0.01 -1.26 -3.22 113.70 112.17 1ss6 s SER 101 Ca 0.03 -1.43 0.00 0.00 1.31 0.00 0.00 55.95 55.86 1ss6 s SER 101 Cb 0.00 -0.94 0.00 0.00 0.21 0.00 0.00 66.02 65.30 1ss6 s SER 101 CO 0.02 -0.36 0.00 1.07 0.41 0.00 0.00 173.24 174.38