#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o6s h PRO -2 N 0.00 0.36 -0.35 1.61 0.11 -1.99 -2.14 132.00 129.59 1o6s h PRO -2 Ca 0.00 -0.02 0.07 0.00 0.11 0.00 0.00 66.00 66.16 1o6s h PRO -2 Cb 0.00 -0.08 -0.06 0.00 0.11 0.00 0.00 31.00 30.97 1o6s h PRO -2 CO 0.00 0.24 -0.03 1.25 -0.21 0.00 0.00 178.00 179.24 1o6s h LEU -1 N 0.37 -0.22 0.00 2.35 5.85 -1.97 -3.42 115.31 118.27 1o6s h LEU -1 Ca 0.22 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.03 1o6s h LEU -1 Cb 0.40 0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.60 1o6s h LEU -1 CO -0.05 -0.07 0.00 0.61 -0.34 0.00 0.00 178.44 178.59 1o6s n GLY 0 N -1.26 4.05 0.59 3.75 0.00 -0.81 -1.86 105.19 109.64 1o6s n GLY 0 Ca 0.01 0.05 0.06 0.00 0.00 0.00 0.00 46.02 46.15 1o6s n GLY 0 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1o6s n SER 1 N 7.91 1.68 -4.77 1.61 7.64 -1.26 -4.98 113.62 121.46 1o6s n SER 1 Ca 0.00 -3.39 -0.40 0.00 1.01 0.00 0.00 58.87 56.10 1o6s n SER 1 Cb 0.00 -0.46 -0.02 0.00 -1.01 0.00 0.00 64.21 62.72 1o6s n SER 1 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1o6s s TRP 2 N -2.59 3.06 -0.22 1.43 0.52 -0.78 -0.49 118.94 119.87 1o6s s TRP 2 Ca 0.34 1.49 -0.03 0.00 0.02 0.00 0.00 56.10 57.93 1o6s s TRP 2 Cb 0.33 -3.54 0.07 0.00 -1.15 0.00 0.00 33.47 29.19 1o6s s TRP 2 CO -0.06 -1.59 0.07 0.08 0.02 0.00 0.00 176.95 175.47 1o6s s VAL 3 N -1.26 0.39 -0.05 4.03 1.01 -0.44 -4.92 120.40 119.15 1o6s s VAL 3 Ca 0.53 -0.64 -0.02 0.00 0.00 0.00 0.00 61.98 61.85 1o6s s VAL 3 Cb -0.35 -1.04 0.04 0.00 0.00 0.00 0.00 36.38 35.02 1o6s s VAL 3 CO 0.46 -0.36 0.11 -0.63 0.00 0.00 0.00 175.10 174.68 1o6s s ILE 4 N 1.90 -0.09 0.55 2.22 1.01 -1.26 -2.52 121.20 123.01 1o6s s ILE 4 Ca 0.02 0.24 -0.06 0.00 0.00 0.00 0.00 60.65 60.85 1o6s s ILE 4 Cb -0.17 -0.20 -0.02 0.00 0.01 0.00 0.00 42.46 42.09 1o6s s ILE 4 CO -0.14 0.10 0.87 -2.16 0.00 0.00 0.00 174.94 173.61 1o6s s PRO 5 N 1.40 3.28 0.62 2.79 0.04 -1.26 -5.05 135.00 136.80 1o6s s PRO 5 Ca -0.06 0.19 -0.18 0.00 0.04 0.00 0.00 61.00 60.98 1o6s s PRO 5 Cb -0.12 -2.29 -0.03 0.00 0.04 0.00 0.00 34.50 32.11 1o6s s PRO 5 CO -0.05 -0.47 1.23 -1.25 0.04 0.00 0.00 177.00 176.50 1o6s s PRO 6 N -4.91 2.81 -0.23 0.56 0.04 -1.26 -4.98 135.00 127.02 1o6s s PRO 6 Ca 0.51 1.89 0.02 0.00 0.04 0.00 0.00 61.00 63.46 1o6s s PRO 6 Cb -0.10 -1.90 0.05 0.00 0.04 0.00 0.00 34.50 32.59 1o6s s PRO 6 CO 0.46 -1.35 -0.11 0.42 0.04 0.00 0.00 177.00 176.46 1o6s s ILE 7 N -1.56 1.92 0.19 0.56 1.01 -1.26 -5.01 121.20 117.06 1o6s s ILE 7 Ca 0.79 -1.34 0.09 0.00 0.00 0.00 0.00 60.65 60.19 1o6s s ILE 7 Cb -0.32 -2.02 -0.04 0.00 0.01 0.00 0.00 42.46 40.09 1o6s s ILE 7 CO 0.36 0.07 -0.11 -0.55 0.00 0.00 0.00 174.94 174.71 1o6s s SER 8 N 1.24 4.16 -0.09 3.58 0.15 -1.26 -2.68 113.70 118.80 1o6s s SER 8 Ca -0.05 -0.63 -0.03 0.00 0.70 0.00 0.00 55.95 55.93 1o6s s SER 8 Cb -0.18 -0.66 0.05 0.00 -1.71 0.00 0.00 66.02 63.51 1o6s s SER 8 CO -0.07 0.10 0.17 0.00 1.20 0.00 0.00 173.24 174.64 1o6s s PRO 10 N 2.17 3.08 0.78 0.00 0.02 -1.26 -1.96 135.00 137.83 1o6s s PRO 10 Ca 0.01 2.21 -0.11 0.00 0.02 0.00 0.00 61.00 63.13 1o6s s PRO 10 Cb -0.12 -2.21 0.06 0.00 0.02 0.00 0.00 34.50 32.25 1o6s s PRO 10 CO -0.06 -1.23 1.08 -1.83 -0.33 0.00 0.00 177.00 174.63 1o6s s GLU 11 N -2.96 2.25 -1.66 5.54 -1.05 -1.01 -4.19 118.70 115.62 1o6s s GLU 11 Ca 0.73 0.94 0.00 0.00 -0.15 0.00 0.00 54.97 56.48 1o6s s GLU 11 Cb -0.40 -1.91 0.00 0.00 -0.44 0.00 0.00 34.13 31.38 1o6s s GLU 11 CO 0.47 -1.58 0.00 0.09 0.95 0.00 0.00 175.26 175.19 1o6s n ASN 12 N -3.45 -5.46 -4.74 0.83 3.02 -0.79 -4.83 115.26 99.84 1o6s n ASN 12 Ca 0.08 0.02 -0.32 0.00 -0.03 0.00 0.00 54.58 54.33 1o6s n ASN 12 Cb 0.54 -4.52 0.10 0.00 -0.61 0.00 0.00 39.78 35.29 1o6s n ASN 12 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1o6s s GLU 13 N -4.83 2.08 0.24 3.52 0.41 -1.26 -5.02 118.70 113.84 1o6s s GLU 13 Ca 0.00 1.43 -0.06 0.00 -0.41 0.00 0.00 54.97 55.93 1o6s s GLU 13 Cb 0.00 -1.86 -0.06 0.00 -1.78 0.00 0.00 34.13 30.44 1o6s s GLU 13 CO 0.00 -1.82 0.51 0.15 -0.49 0.00 0.00 175.26 173.62 1o6s s LYS 14 N -4.45 3.67 0.00 1.61 1.02 -1.26 -4.70 119.74 115.62 1o6s s LYS 14 Ca 0.66 0.04 0.00 0.00 0.02 0.00 0.00 55.97 56.70 1o6s s LYS 14 Cb -0.22 -2.69 0.00 0.00 -0.52 0.00 0.00 37.83 34.40 1o6s s LYS 14 CO 0.51 0.29 0.00 0.41 -0.92 0.00 0.00 175.35 175.64 1o6s n GLY 15 N -0.54 -1.61 3.77 -3.33 0.00 -1.26 -4.82 105.19 97.40 1o6s n GLY 15 Ca -0.01 -1.54 -0.38 0.00 0.00 0.00 0.00 46.02 44.09 1o6s n GLY 15 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1o6s s PRO 16 N -1.63 4.01 0.19 1.61 0.04 -1.26 -5.15 135.00 132.81 1o6s s PRO 16 Ca 0.00 1.76 0.00 0.00 0.04 0.00 0.00 61.00 62.81 1o6s s PRO 16 Cb 0.00 -2.59 -0.04 0.00 0.04 0.00 0.00 34.50 31.91 1o6s s PRO 16 CO 0.00 -0.34 0.36 -0.06 0.04 0.00 0.00 177.00 177.00 1o6s s PHE 17 N -1.49 3.48 0.65 0.56 0.08 -1.26 -4.24 117.98 115.77 1o6s s PHE 17 Ca 0.59 0.26 -0.13 0.00 0.12 0.00 0.00 56.93 57.77 1o6s s PHE 17 Cb -0.29 -1.79 -0.01 0.00 -0.57 0.00 0.00 43.02 40.37 1o6s s PHE 17 CO 0.36 0.42 1.06 -1.25 -0.10 0.00 0.00 175.22 175.71 1o6s s PRO 18 N -3.31 3.06 -0.13 0.24 0.04 -1.26 -5.07 135.00 128.56 1o6s s PRO 18 Ca 0.37 1.10 0.02 0.00 0.04 0.00 0.00 61.00 62.53 1o6s s PRO 18 Cb -0.11 -2.00 0.01 0.00 0.04 0.00 0.00 34.50 32.44 1o6s s PRO 18 CO 0.29 -1.01 -0.19 0.21 0.04 0.00 0.00 177.00 176.33 1o6s s LYS 19 N -4.56 2.70 0.23 4.56 2.20 -0.09 -4.93 119.74 119.86 1o6s s LYS 19 Ca 0.61 -0.74 -0.31 0.00 -0.36 0.00 0.00 55.97 55.18 1o6s s LYS 19 Cb -0.15 -2.21 -0.11 0.00 -1.51 0.00 0.00 37.83 33.85 1o6s s LYS 19 CO 0.46 -0.03 1.58 -0.80 -0.36 0.00 0.00 175.35 176.21 1o6s s ASN 20 N 0.87 6.49 -0.02 1.43 0.01 -1.26 -1.24 114.94 121.21 1o6s s ASN 20 Ca -0.07 2.79 -0.02 0.00 -0.71 0.00 0.00 52.86 54.85 1o6s s ASN 20 Cb -0.15 -2.61 -0.01 0.00 0.41 0.00 0.00 41.25 38.89 1o6s s ASN 20 CO -0.01 -0.86 -0.03 0.18 -1.51 0.00 0.00 177.10 174.86 1o6s n LEU 21 N 3.03 0.19 -4.11 0.60 4.77 0.86 -4.90 117.00 117.43 1o6s n LEU 21 Ca 0.11 0.05 -0.10 0.00 -0.03 0.00 0.00 56.01 56.04 1o6s n LEU 21 Cb 0.38 -0.52 -0.09 0.00 -2.33 0.00 0.00 43.42 40.85 1o6s n LEU 21 CO 0.62 -0.48 -0.19 0.68 -1.33 0.00 0.00 177.39 176.69 1o6s s VAL 22 N -1.18 0.07 -0.30 4.08 -7.23 -1.19 -5.01 120.40 109.63 1o6s s VAL 22 Ca -0.03 -1.78 -0.10 0.00 -1.81 0.00 0.00 61.98 58.26 1o6s s VAL 22 Cb 0.00 -2.11 -0.02 0.00 0.56 0.00 0.00 36.38 34.81 1o6s s VAL 22 CO 0.04 -0.30 0.16 -1.58 -0.31 0.00 0.00 175.10 173.11 1o6s s GLN 23 N -4.05 3.58 0.08 4.82 0.74 -1.26 -0.42 119.66 123.14 1o6s s GLN 23 Ca 0.26 -0.56 -0.22 0.00 0.05 0.00 0.00 55.36 54.89 1o6s s GLN 23 Cb 0.06 -3.58 -0.07 0.00 1.10 0.00 0.00 33.01 30.52 1o6s s GLN 23 CO 0.04 -0.32 0.66 0.42 -0.55 0.00 0.00 175.29 175.55 1o6s s ILE 24 N 1.67 4.66 -0.02 -2.34 1.01 0.41 -4.70 121.20 121.88 1o6s s ILE 24 Ca 0.06 1.43 -0.03 0.00 0.00 0.00 0.00 60.65 62.11 1o6s s ILE 24 Cb -0.16 -4.01 0.00 0.00 0.01 0.00 0.00 42.46 38.30 1o6s s ILE 24 CO 0.08 0.49 0.08 -0.54 0.00 0.00 0.00 174.94 175.04 1o6s s LYS 25 N -0.79 0.16 -0.09 2.79 1.02 -1.05 -4.29 119.74 117.50 1o6s s LYS 25 Ca 0.33 -0.02 0.03 0.00 0.02 0.00 0.00 55.97 56.33 1o6s s LYS 25 Cb -0.20 0.07 -0.02 0.00 -0.52 0.00 0.00 37.83 37.16 1o6s s LYS 25 CO 0.21 -0.03 -0.17 0.45 -0.92 0.00 0.00 175.35 174.90 1o6s s SER 26 N -0.27 3.75 0.00 2.83 0.15 -1.26 -1.33 113.70 117.57 1o6s s SER 26 Ca -0.03 -0.34 0.24 0.00 0.70 0.00 0.00 55.95 56.52 1o6s s SER 26 Cb -0.02 -1.17 1.30 0.00 -1.71 0.00 0.00 66.02 64.42 1o6s s SER 26 CO 0.00 0.24 1.80 0.59 1.20 0.00 0.00 173.24 177.08 1o6s n ASN 27 N 2.99 0.00 0.17 5.45 3.02 0.36 -2.06 115.26 125.20 1o6s n ASN 27 Ca -0.18 -0.33 0.11 0.00 -0.03 0.00 0.00 54.58 54.15 1o6s n ASN 27 Cb 0.52 -0.17 0.59 0.00 -0.61 0.00 0.00 39.78 40.11 1o6s n ASN 27 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1o6s n LYS 28 N -1.17 0.14 0.00 3.52 4.76 -1.26 -2.07 118.16 122.07 1o6s n LYS 28 Ca 0.14 0.64 0.05 0.00 -2.87 0.00 0.00 58.31 56.26 1o6s n LYS 28 Cb 0.15 -1.99 0.20 0.00 -1.84 0.00 0.00 35.03 31.55 1o6s n LYS 28 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1o6s n ASP 29 N -2.27 0.00 0.27 4.39 5.68 -0.87 -1.86 116.55 121.88 1o6s n ASP 29 Ca -0.01 0.49 0.17 0.00 -0.50 0.00 0.00 54.79 54.93 1o6s n ASP 29 Cb 0.06 -0.49 0.63 0.00 -1.14 0.00 0.00 41.12 40.17 1o6s n ASP 29 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 1o6s h LYS 30 N 0.00 0.00 -0.01 0.11 1.79 -1.69 -3.31 116.57 113.46 1o6s h LYS 30 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1o6s h LYS 30 Cb 0.16 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.81 1o6s h LYS 30 CO 0.00 0.00 0.00 -0.85 -1.08 0.00 0.00 179.45 177.52 1o6s n GLU 31 N -3.05 2.20 0.00 3.15 0.28 -0.78 -5.08 120.64 117.36 1o6s n GLU 31 Ca 0.01 -2.02 0.00 0.00 -0.16 0.00 0.00 57.16 54.99 1o6s n GLU 31 Cb 0.33 -1.24 0.00 0.00 1.43 0.00 0.00 31.44 31.95 1o6s n GLU 31 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1o6s n GLY 32 N -0.93 2.96 3.77 -1.84 0.00 -1.22 -5.12 105.19 102.81 1o6s n GLY 32 Ca 0.08 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.81 1o6s n GLY 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o6s s LYS 33 N -2.00 4.11 0.01 1.61 -0.14 -1.26 -4.11 119.74 117.95 1o6s s LYS 33 Ca 0.00 2.57 0.08 0.00 -1.36 0.00 0.00 55.97 57.26 1o6s s LYS 33 Cb 0.00 -2.98 -0.03 0.00 -1.68 0.00 0.00 37.83 33.14 1o6s s LYS 33 CO 0.00 -0.56 -0.24 0.08 -0.76 0.00 0.00 175.35 173.88 1o6s s VAL 34 N -0.85 2.31 -0.07 3.17 1.01 -1.26 -3.95 120.40 120.75 1o6s s VAL 34 Ca 0.55 -1.16 0.03 0.00 0.00 0.00 0.00 61.98 61.40 1o6s s VAL 34 Cb -0.47 -1.87 0.01 0.00 0.00 0.00 0.00 36.38 34.05 1o6s s VAL 34 CO 0.59 0.48 -0.16 -0.36 0.00 0.00 0.00 175.10 175.65 1o6s s PHE 35 N -0.73 1.82 0.02 5.22 0.08 -0.28 -4.78 117.98 119.33 1o6s s PHE 35 Ca 0.11 -0.70 0.01 0.00 0.12 0.00 0.00 56.93 56.48 1o6s s PHE 35 Cb -0.10 -1.28 -0.04 0.00 -0.57 0.00 0.00 43.02 41.03 1o6s s PHE 35 CO 0.01 -0.31 0.04 0.71 -0.10 0.00 0.00 175.22 175.57 1o6s s TYR 36 N 0.52 3.15 0.13 0.36 2.02 -0.03 -1.07 117.35 122.44 1o6s s TYR 36 Ca -0.15 0.11 -0.09 0.00 -0.37 0.00 0.00 57.07 56.56 1o6s s TYR 36 Cb -0.16 -1.67 -0.00 0.00 -0.40 0.00 0.00 41.96 39.73 1o6s s TYR 36 CO 0.05 0.50 0.25 -1.54 -1.57 0.00 0.00 175.55 173.25 1o6s s SER 37 N -1.84 0.06 0.08 2.29 1.04 -0.81 -4.17 113.70 110.35 1o6s s SER 37 Ca 0.23 -0.75 0.06 0.00 0.48 0.00 0.00 55.95 55.97 1o6s s SER 37 Cb -0.12 0.40 -0.03 0.00 0.10 0.00 0.00 66.02 66.37 1o6s s SER 37 CO 0.14 -0.82 -0.16 0.27 0.98 0.00 0.00 173.24 173.64 1o6s s ILE 38 N -3.91 1.31 0.33 -1.02 -4.36 -1.26 -0.27 121.20 112.01 1o6s s ILE 38 Ca 0.11 -1.36 0.04 0.00 -0.26 0.00 0.00 60.65 59.18 1o6s s ILE 38 Cb 0.04 -1.23 -0.06 0.00 1.25 0.00 0.00 42.46 42.46 1o6s s ILE 38 CO -0.05 -0.15 0.06 0.42 0.24 0.00 0.00 174.94 175.46 1o6s s THR 39 N -1.20 1.17 0.00 8.37 -4.23 -0.30 -4.54 115.64 114.91 1o6s s THR 39 Ca 0.01 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.52 1o6s s THR 39 Cb -0.10 -2.79 0.00 0.00 1.34 0.00 0.00 72.50 70.96 1o6s s THR 39 CO 0.03 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 1o6s n GLY 40 N -0.69 2.20 3.65 3.99 0.00 -1.26 -0.90 105.19 112.18 1o6s n GLY 40 Ca -0.02 -2.16 -0.43 0.00 0.00 0.00 0.00 46.02 43.41 1o6s n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1o6s s GLN 41 N -1.85 4.08 0.00 1.61 1.11 -1.25 -1.13 119.66 122.23 1o6s s GLN 41 Ca 0.00 1.74 0.00 0.00 0.01 0.00 0.00 55.36 57.11 1o6s s GLN 41 Cb 0.00 -3.90 0.00 0.00 -1.01 0.00 0.00 33.01 28.10 1o6s s GLN 41 CO 0.00 -0.93 0.00 0.41 0.01 0.00 0.00 175.29 174.78 1o6s n GLY 42 N 4.07 1.31 0.00 3.09 0.00 -0.54 -4.52 105.19 108.60 1o6s n GLY 42 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1o6s n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o6s n ALA 43 N -1.13 1.16 0.92 4.61 0.00 -0.28 -1.03 120.51 124.76 1o6s n ALA 43 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.54 1o6s n ALA 43 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1o6s n ALA 43 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1o6s n ASP 44 N -0.56 1.83 -4.45 0.00 5.75 -0.70 -0.50 116.55 117.91 1o6s n ASP 44 Ca 0.00 -1.41 -0.23 0.00 -0.01 0.00 0.00 54.79 53.14 1o6s n ASP 44 Cb 0.00 0.53 -0.10 0.00 -1.03 0.00 0.00 41.12 40.52 1o6s n ASP 44 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1o6s s THR 45 N -2.37 2.32 0.22 2.12 -4.23 -0.89 -4.90 115.64 107.91 1o6s s THR 45 Ca 0.16 -2.36 -0.31 0.00 -1.18 0.00 0.00 61.69 58.00 1o6s s THR 45 Cb 0.16 -2.28 -0.14 0.00 1.34 0.00 0.00 72.50 71.59 1o6s s THR 45 CO 0.55 -0.42 1.29 -2.65 -0.54 0.00 0.00 174.62 172.85 1o6s n PRO 46 N -0.59 1.67 -2.51 3.99 -0.02 -1.26 -1.46 135.00 134.81 1o6s n PRO 46 Ca -0.06 0.59 -0.43 0.00 -2.02 0.00 0.00 63.50 61.59 1o6s n PRO 46 Cb 0.60 -2.17 -0.02 0.00 -0.02 0.00 0.00 33.50 31.89 1o6s n PRO 46 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1o6s s PRO 47 N -0.52 4.10 0.25 0.52 0.04 -1.26 -3.98 135.00 134.14 1o6s s PRO 47 Ca 0.69 1.35 -0.30 0.00 0.04 0.00 0.00 61.00 62.78 1o6s s PRO 47 Cb -0.73 -3.77 -0.09 0.00 0.04 0.00 0.00 34.50 29.95 1o6s s PRO 47 CO 0.52 -0.86 1.29 0.14 0.04 0.00 0.00 177.00 178.13 1o6s s VAL 48 N 3.75 3.08 -0.16 -0.36 -7.23 -1.20 -3.12 120.40 115.15 1o6s s VAL 48 Ca 0.51 0.95 0.00 0.00 -1.81 0.00 0.00 61.98 61.64 1o6s s VAL 48 Cb -0.17 -3.61 0.00 0.00 0.56 0.00 0.00 36.38 33.16 1o6s s VAL 48 CO 0.16 0.18 0.00 0.61 -0.31 0.00 0.00 175.10 175.73 1o6s n GLY 49 N 1.81 0.52 0.30 2.32 0.00 0.35 -4.87 105.19 105.62 1o6s n GLY 49 Ca 0.04 -0.61 -0.09 0.00 0.00 0.00 0.00 46.02 45.36 1o6s n GLY 49 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1o6s h VAL 50 N 0.00 1.26 -3.93 1.61 2.07 -1.34 -3.41 116.25 112.52 1o6s h VAL 50 Ca -0.03 -1.10 -0.68 0.00 0.82 0.00 0.00 66.70 65.71 1o6s h VAL 50 Cb 0.14 0.78 -0.26 0.00 -1.52 0.00 0.00 31.29 30.43 1o6s h VAL 50 CO 0.04 0.40 -0.80 -0.36 0.02 0.00 0.00 177.57 176.88 1o6s s PHE 51 N -5.09 2.65 0.13 1.57 0.08 -0.19 -0.57 117.98 116.55 1o6s s PHE 51 Ca -0.12 -0.37 0.03 0.00 0.12 0.00 0.00 56.93 56.59 1o6s s PHE 51 Cb 0.13 -1.66 -0.04 0.00 -0.57 0.00 0.00 43.02 40.88 1o6s s PHE 51 CO 0.85 0.02 -0.06 0.96 -0.10 0.00 0.00 175.22 176.89 1o6s s ILE 52 N -0.41 0.83 -0.02 0.64 -4.36 -0.48 -4.38 121.20 113.01 1o6s s ILE 52 Ca 0.04 -1.98 0.03 0.00 -0.26 0.00 0.00 60.65 58.48 1o6s s ILE 52 Cb -0.12 -1.82 -0.00 0.00 1.25 0.00 0.00 42.46 41.77 1o6s s ILE 52 CO 0.02 -0.76 -0.11 -0.51 0.24 0.00 0.00 174.94 173.82 1o6s s ILE 53 N -3.54 0.95 -0.26 8.37 2.07 -1.26 -0.59 121.20 126.94 1o6s s ILE 53 Ca 0.16 -0.47 -0.29 0.00 -1.41 0.00 0.00 60.65 58.63 1o6s s ILE 53 Cb 0.05 -0.83 0.00 0.00 0.13 0.00 0.00 42.46 41.81 1o6s s ILE 53 CO -0.02 0.28 1.21 -0.70 -1.91 0.00 0.00 174.94 173.81 1o6s s GLU 54 N 0.03 4.07 0.53 3.50 2.12 -0.32 -4.90 118.70 123.73 1o6s s GLU 54 Ca -0.01 1.32 0.26 0.00 0.36 0.00 0.00 54.97 56.91 1o6s s GLU 54 Cb -0.08 -3.79 1.50 0.00 0.26 0.00 0.00 34.13 32.02 1o6s s GLU 54 CO 0.00 -0.91 2.11 0.07 -0.54 0.00 0.00 175.26 176.00 1o6s h ARG 55 N 8.53 0.00 0.16 4.30 0.11 -1.91 -0.68 114.38 124.89 1o6s h ARG 55 Ca -0.24 0.00 -0.36 0.00 0.10 0.00 0.00 59.98 59.48 1o6s h ARG 55 Cb 1.09 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.16 1o6s h ARG 55 CO 1.01 0.09 -1.89 0.93 0.10 0.00 0.00 179.97 180.22 1o6s h GLU 56 N 0.00 0.33 0.00 0.08 3.07 -1.86 -0.04 114.58 116.16 1o6s h GLU 56 Ca -0.00 -0.56 0.00 0.00 -0.50 0.00 0.00 59.36 58.30 1o6s h GLU 56 Cb 0.24 0.21 0.00 0.00 -0.84 0.00 0.00 28.75 28.36 1o6s h GLU 56 CO 0.01 1.27 -1.71 0.25 -1.40 0.00 0.00 179.01 177.43 1o6s n THR 57 N -3.54 0.13 -0.98 1.13 -2.24 -1.14 -4.92 114.28 102.72 1o6s n THR 57 Ca -0.29 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 1o6s n THR 57 Cb 1.06 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.28 1o6s n THR 57 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1o6s n GLY 58 N 1.26 0.38 3.64 3.38 0.00 -0.27 -4.76 105.19 108.81 1o6s n GLY 58 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 1o6s n GLY 58 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1o6s s TRP 59 N -1.82 2.06 -0.17 1.61 0.52 -1.25 -0.44 118.94 119.44 1o6s s TRP 59 Ca 0.00 0.45 -0.23 0.00 0.02 0.00 0.00 56.10 56.34 1o6s s TRP 59 Cb 0.00 -3.94 -0.02 0.00 -1.15 0.00 0.00 33.47 28.36 1o6s s TRP 59 CO 0.00 -3.23 0.70 -1.17 0.02 0.00 0.00 176.95 173.28 1o6s s LEU 60 N 4.83 4.18 0.08 2.99 2.96 0.44 -1.17 118.68 132.99 1o6s s LEU 60 Ca 0.72 1.00 0.07 0.00 -0.22 0.00 0.00 54.13 55.70 1o6s s LEU 60 Cb -0.28 -3.03 -0.03 0.00 0.50 0.00 0.00 46.19 43.35 1o6s s LEU 60 CO 0.29 -0.29 -0.20 -0.54 -1.32 0.00 0.00 176.35 174.30 1o6s s LYS 61 N 1.80 1.15 -0.08 1.98 1.02 0.24 -0.10 119.74 125.75 1o6s s LYS 61 Ca 0.33 -1.04 -0.07 0.00 0.02 0.00 0.00 55.97 55.20 1o6s s LYS 61 Cb -0.16 -1.32 -0.04 0.00 -0.52 0.00 0.00 37.83 35.78 1o6s s LYS 61 CO 0.12 0.32 0.19 0.54 -0.92 0.00 0.00 175.35 175.59 1o6s s VAL 62 N -1.05 5.43 -1.70 3.17 0.11 -0.38 -1.39 120.40 124.61 1o6s s VAL 62 Ca 0.05 0.23 0.19 0.00 -2.93 0.00 0.00 61.98 59.52 1o6s s VAL 62 Cb -0.09 -3.47 -0.00 0.00 -1.53 0.00 0.00 36.38 31.29 1o6s s VAL 62 CO 0.03 0.56 0.94 0.35 -3.33 0.00 0.00 175.10 173.65 1o6s n THR 63 N 1.77 0.00 -3.62 5.04 -2.24 0.26 -0.91 114.28 114.58 1o6s n THR 63 Ca -0.17 -0.31 -0.11 0.00 -2.27 0.00 0.00 64.05 61.19 1o6s n THR 63 Cb 0.54 1.22 -0.04 0.00 -2.10 0.00 0.00 70.33 69.95 1o6s n THR 63 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1o6s s GLU 64 N -2.11 1.20 0.37 -0.78 -1.05 -1.26 -4.70 118.70 110.37 1o6s s GLU 64 Ca 0.15 -0.70 -0.28 0.00 -0.15 0.00 0.00 54.97 53.99 1o6s s GLU 64 Cb 0.15 0.51 -0.11 0.00 -0.44 0.00 0.00 34.13 34.24 1o6s s GLU 64 CO 0.46 -0.49 1.49 -2.14 0.95 0.00 0.00 175.26 175.53 1o6s s PRO 65 N -3.81 4.12 0.49 -4.83 0.02 -1.26 -4.98 135.00 124.74 1o6s s PRO 65 Ca 0.04 2.57 0.02 0.00 0.02 0.00 0.00 61.00 63.65 1o6s s PRO 65 Cb 0.00 -2.98 0.02 0.00 0.02 0.00 0.00 34.50 31.57 1o6s s PRO 65 CO -0.10 -0.54 0.70 -0.51 -0.33 0.00 0.00 177.00 176.23 1o6s s LEU 66 N -1.94 3.48 -0.23 -5.54 1.43 -1.26 -4.87 118.68 109.74 1o6s s LEU 66 Ca 0.54 0.02 -0.04 0.00 -1.03 0.00 0.00 54.13 53.62 1o6s s LEU 66 Cb -0.46 -2.93 0.09 0.00 0.03 0.00 0.00 46.19 42.92 1o6s s LEU 66 CO 0.62 -0.92 0.16 -0.62 0.23 0.00 0.00 176.35 175.82 1o6s s ASP 67 N -4.34 2.32 0.24 2.29 -1.08 -1.26 -1.89 116.67 112.95 1o6s s ASP 67 Ca 0.53 -0.71 -0.05 0.00 -0.52 0.00 0.00 52.55 51.81 1o6s s ASP 67 Cb -0.10 -0.01 0.25 0.00 -1.46 0.00 0.00 42.92 41.60 1o6s s ASP 67 CO 0.37 -0.37 1.76 -0.09 0.52 0.00 0.00 175.17 177.35 1o6s h ARG 68 N 8.37 0.97 0.00 4.34 2.43 -1.89 -2.03 114.38 126.57 1o6s h ARG 68 Ca -0.17 -0.23 -0.00 0.00 -0.81 0.00 0.00 59.98 58.77 1o6s h ARG 68 Cb 1.10 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.52 1o6s h ARG 68 CO 0.33 0.88 -0.00 0.93 -1.51 0.00 0.00 179.97 180.60 1o6s h GLU 69 N 0.92 0.00 0.00 0.20 3.07 -1.97 -3.00 114.58 113.79 1o6s h GLU 69 Ca 0.19 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 59.02 1o6s h GLU 69 Cb 0.38 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.28 1o6s h GLU 69 CO 0.01 0.00 -0.26 0.00 -1.40 0.00 0.00 179.01 177.37 1o6s h ARG 70 N 0.00 0.00 -2.63 2.33 2.47 -1.85 -3.47 114.38 111.24 1o6s h ARG 70 Ca -0.00 0.00 -0.22 0.00 -1.26 0.00 0.00 59.98 58.49 1o6s h ARG 70 Cb 0.44 0.00 -0.33 0.00 -1.65 0.00 0.00 29.97 28.44 1o6s h ARG 70 CO 0.00 0.51 -0.54 0.42 0.56 0.00 0.00 179.97 180.92 1o6s s ILE 71 N -2.01 -0.43 -0.52 2.04 1.01 -0.82 -5.06 121.20 115.41 1o6s s ILE 71 Ca -0.13 0.13 0.23 0.00 0.00 0.00 0.00 60.65 60.88 1o6s s ILE 71 Cb 0.00 -0.56 -0.08 0.00 0.01 0.00 0.00 42.46 41.83 1o6s s ILE 71 CO 0.37 0.00 1.05 0.00 0.00 0.00 0.00 174.94 176.36 1o6s n ALA 72 N 5.35 3.14 -3.09 9.38 0.00 -1.14 -4.36 120.51 129.79 1o6s n ALA 72 Ca -0.06 -0.36 -0.12 0.00 0.00 0.00 0.00 53.44 52.90 1o6s n ALA 72 Cb 0.50 -1.02 -0.11 0.00 0.00 0.00 0.00 19.45 18.82 1o6s n ALA 72 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1o6s s THR 73 N -3.24 0.02 0.04 0.00 2.01 -1.26 -0.58 115.64 112.63 1o6s s THR 73 Ca 0.03 -0.17 0.04 0.00 0.31 0.00 0.00 61.69 61.90 1o6s s THR 73 Cb 0.13 -0.32 -0.02 0.00 0.01 0.00 0.00 72.50 72.30 1o6s s THR 73 CO 0.79 -0.09 -0.12 -0.31 -0.69 0.00 0.00 174.62 174.20 1o6s s TYR 74 N -0.27 1.04 -0.25 4.92 1.51 -0.47 -4.99 117.35 118.84 1o6s s TYR 74 Ca -0.04 -0.37 0.01 0.00 -1.01 0.00 0.00 57.07 55.66 1o6s s TYR 74 Cb -0.03 -0.62 0.04 0.00 -0.11 0.00 0.00 41.96 41.25 1o6s s TYR 74 CO 0.01 0.01 -0.09 0.99 -1.11 0.00 0.00 175.55 175.36 1o6s s THR 75 N -0.92 2.49 0.36 -0.71 2.01 -1.26 -1.03 115.64 116.56 1o6s s THR 75 Ca -0.01 -1.31 0.09 0.00 0.31 0.00 0.00 61.69 60.76 1o6s s THR 75 Cb -0.08 -2.34 -0.05 0.00 0.01 0.00 0.00 72.50 70.04 1o6s s THR 75 CO 0.01 0.11 0.05 -0.76 -0.69 0.00 0.00 174.62 173.34 1o6s s LEU 76 N 1.22 3.02 -0.07 4.42 1.43 -0.78 -3.91 118.68 124.01 1o6s s LEU 76 Ca -0.04 -1.01 0.04 0.00 -1.03 0.00 0.00 54.13 52.09 1o6s s LEU 76 Cb -0.18 -1.37 0.00 0.00 0.03 0.00 0.00 46.19 44.67 1o6s s LEU 76 CO -0.05 -0.31 -0.19 -0.36 0.23 0.00 0.00 176.35 175.67 1o6s s PHE 77 N -2.53 1.97 0.03 0.29 0.40 -0.08 -0.67 117.98 117.40 1o6s s PHE 77 Ca 0.36 -0.69 -0.08 0.00 -0.60 0.00 0.00 56.93 55.92 1o6s s PHE 77 Cb 0.01 -1.34 -0.05 0.00 0.51 0.00 0.00 43.02 42.15 1o6s s PHE 77 CO 0.20 -0.27 0.33 -1.54 0.70 0.00 0.00 175.22 174.64 1o6s s SER 78 N 0.26 6.57 0.08 1.36 1.04 0.37 -1.15 113.70 122.23 1o6s s SER 78 Ca -0.11 0.68 0.07 0.00 0.48 0.00 0.00 55.95 57.07 1o6s s SER 78 Cb -0.15 -2.14 -0.03 0.00 0.10 0.00 0.00 66.02 63.81 1o6s s SER 78 CO 0.05 0.23 -0.19 -1.00 0.98 0.00 0.00 173.24 173.31 1o6s s HIS 79 N -1.32 1.62 -0.07 5.02 3.76 0.63 -1.82 115.29 123.11 1o6s s HIS 79 Ca 0.29 -0.41 0.00 0.00 -0.15 0.00 0.00 55.06 54.80 1o6s s HIS 79 Cb -0.14 -0.92 0.02 0.00 1.11 0.00 0.00 32.58 32.66 1o6s s HIS 79 CO 0.16 0.13 -0.05 0.00 -0.85 0.00 0.00 174.74 174.13 1o6s s ALA 80 N -1.06 0.94 0.16 -1.40 0.00 -1.26 -1.92 121.76 117.21 1o6s s ALA 80 Ca 0.05 -0.25 0.06 0.00 0.00 0.00 0.00 51.96 51.81 1o6s s ALA 80 Cb -0.09 -0.65 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 1o6s s ALA 80 CO 0.03 -0.20 -0.13 0.14 0.00 0.00 0.00 175.76 175.59 1o6s s VAL 81 N 1.33 1.46 0.73 0.00 -7.23 -0.23 -1.35 120.40 115.11 1o6s s VAL 81 Ca -0.04 -1.98 -0.07 0.00 -1.81 0.00 0.00 61.98 58.09 1o6s s VAL 81 Cb -0.14 -1.80 0.08 0.00 0.56 0.00 0.00 36.38 35.08 1o6s s VAL 81 CO -0.03 -0.55 1.04 -0.94 -0.31 0.00 0.00 175.10 174.31 1o6s s SER 82 N -2.93 4.63 0.45 4.85 1.04 0.21 -1.13 113.70 120.82 1o6s s SER 82 Ca 0.16 0.38 0.21 0.00 0.48 0.00 0.00 55.95 57.18 1o6s s SER 82 Cb -0.02 -0.96 1.19 0.00 0.10 0.00 0.00 66.02 66.33 1o6s s SER 82 CO 0.04 -1.72 1.86 -1.28 0.98 0.00 0.00 173.24 173.12 1o6s h SER 83 N -0.69 0.30 -0.09 7.02 0.87 -1.90 -1.14 113.55 117.92 1o6s h SER 83 Ca -0.44 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.16 1o6s h SER 83 Cb 1.31 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.24 1o6s h SER 83 CO 0.57 0.11 0.00 0.59 -0.53 0.00 0.00 176.83 177.58 1o6s n ASN 84 N -4.46 0.88 0.00 6.23 3.02 -1.26 -4.92 115.26 114.75 1o6s n ASN 84 Ca 0.19 -1.58 0.00 0.00 -0.03 0.00 0.00 54.58 53.16 1o6s n ASN 84 Cb 0.77 -0.06 0.00 0.00 -0.61 0.00 0.00 39.78 39.88 1o6s n ASN 84 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1o6s n GLY 85 N 0.96 0.86 3.79 7.41 0.00 -0.43 -5.06 105.19 112.72 1o6s n GLY 85 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1o6s n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1o6s s ASN 86 N -2.80 7.28 0.14 1.61 0.01 -1.26 -4.71 114.94 115.21 1o6s s ASN 86 Ca 0.00 1.54 -0.31 0.00 -0.71 0.00 0.00 52.86 53.38 1o6s s ASN 86 Cb 0.00 -2.46 -0.09 0.00 0.41 0.00 0.00 41.25 39.11 1o6s s ASN 86 CO 0.00 0.20 1.43 0.00 -1.51 0.00 0.00 177.10 177.21 1o6s s ALA 87 N -1.20 3.63 -1.20 0.60 0.00 -1.26 -0.62 121.76 121.71 1o6s s ALA 87 Ca 0.35 1.19 0.14 0.00 0.00 0.00 0.00 51.96 53.65 1o6s s ALA 87 Cb -0.21 -3.55 -0.03 0.00 0.00 0.00 0.00 23.12 19.32 1o6s s ALA 87 CO 0.24 -0.65 0.76 1.33 0.00 0.00 0.00 175.76 177.44 1o6s n VAL 88 N 3.73 0.00 -4.17 0.00 0.24 -0.46 -4.89 118.33 112.78 1o6s n VAL 88 Ca 0.11 -0.32 -0.11 0.00 -2.04 0.00 0.00 64.34 61.99 1o6s n VAL 88 Cb 0.41 1.14 -0.10 0.00 -1.47 0.00 0.00 33.84 33.82 1o6s n VAL 88 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1o6s s GLU 89 N -1.85 0.87 0.25 7.34 0.41 -1.24 -4.87 118.70 119.61 1o6s s GLU 89 Ca 0.11 -1.37 -0.30 0.00 -0.41 0.00 0.00 54.97 53.00 1o6s s GLU 89 Cb 0.11 -0.10 -0.09 0.00 -1.78 0.00 0.00 34.13 32.27 1o6s s GLU 89 CO 0.40 -0.08 1.00 -0.51 -0.49 0.00 0.00 175.26 175.58 1o6s s ASP 90 N -3.05 7.49 0.03 -0.19 1.01 -1.26 -4.68 116.67 116.02 1o6s s ASP 90 Ca 0.15 2.07 -0.38 0.00 0.71 0.00 0.00 52.55 55.09 1o6s s ASP 90 Cb 0.06 -2.62 -0.18 0.00 1.01 0.00 0.00 42.92 41.20 1o6s s ASP 90 CO -0.03 0.03 1.29 -2.65 0.21 0.00 0.00 175.17 174.02 1o6s n PRO 91 N 1.47 0.79 -3.92 8.23 -0.02 -1.26 -4.93 135.00 135.35 1o6s n PRO 91 Ca -0.01 0.29 -0.35 0.00 -2.02 0.00 0.00 63.50 61.40 1o6s n PRO 91 Cb 0.46 -1.89 -0.10 0.00 -0.02 0.00 0.00 33.50 31.96 1o6s n PRO 91 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1o6s s MET 92 N 0.57 3.96 -0.07 -0.52 1.75 -0.76 -4.91 119.30 119.33 1o6s s MET 92 Ca 0.88 -0.35 -0.30 0.00 -1.25 0.00 0.00 55.69 54.67 1o6s s MET 92 Cb -1.06 -3.28 -0.03 0.00 2.84 0.00 0.00 34.83 33.30 1o6s s MET 92 CO 0.52 0.19 1.16 -2.00 -0.65 0.00 0.00 175.02 174.23 1o6s s GLU 93 N 0.62 4.37 -0.13 4.11 2.12 -1.26 -0.48 118.70 128.05 1o6s s GLU 93 Ca 0.04 1.61 0.01 0.00 0.36 0.00 0.00 54.97 56.99 1o6s s GLU 93 Cb -0.13 -3.55 0.02 0.00 0.26 0.00 0.00 34.13 30.73 1o6s s GLU 93 CO 0.01 -0.42 -0.13 0.96 -0.54 0.00 0.00 175.26 175.14 1o6s s ILE 94 N 2.16 1.43 -0.04 -3.70 -4.36 0.16 -4.97 121.20 111.89 1o6s s ILE 94 Ca 0.54 -0.57 -0.27 0.00 -0.26 0.00 0.00 60.65 60.09 1o6s s ILE 94 Cb -0.23 -1.35 -0.03 0.00 1.25 0.00 0.00 42.46 42.10 1o6s s ILE 94 CO 0.21 0.43 0.85 -0.22 0.24 0.00 0.00 174.94 176.45 1o6s s LEU 95 N 1.32 4.34 -0.24 0.37 0.20 -1.26 -1.86 118.68 121.55 1o6s s LEU 95 Ca 0.00 1.43 -0.04 0.00 0.69 0.00 0.00 54.13 56.20 1o6s s LEU 95 Cb -0.14 -3.34 -0.01 0.00 -0.43 0.00 0.00 46.19 42.28 1o6s s LEU 95 CO -0.07 -0.20 -0.02 -0.63 -0.29 0.00 0.00 176.35 175.15 1o6s s ILE 96 N 0.97 3.50 -0.19 6.68 1.01 -0.20 -4.29 121.20 128.68 1o6s s ILE 96 Ca 0.45 -0.53 -0.07 0.00 0.00 0.00 0.00 60.65 60.50 1o6s s ILE 96 Cb -0.19 -2.64 -0.04 0.00 0.01 0.00 0.00 42.46 39.59 1o6s s ILE 96 CO 0.23 0.35 0.06 -0.89 0.00 0.00 0.00 174.94 174.69 1o6s s THR 97 N 1.48 4.72 -0.16 2.92 2.01 -1.09 -1.37 115.64 124.15 1o6s s THR 97 Ca 0.05 -0.06 -0.16 0.00 0.31 0.00 0.00 61.69 61.83 1o6s s THR 97 Cb -0.15 -3.14 -0.04 0.00 0.01 0.00 0.00 72.50 69.19 1o6s s THR 97 CO -0.02 0.45 0.41 -0.69 -0.69 0.00 0.00 174.62 174.08 1o6s s VAL 98 N 0.51 5.21 0.00 3.82 1.01 0.26 -2.05 120.40 129.16 1o6s s VAL 98 Ca 0.03 0.77 0.00 0.00 0.00 0.00 0.00 61.98 62.78 1o6s s VAL 98 Cb -0.13 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.51 1o6s s VAL 98 CO 0.01 0.30 0.00 0.35 0.00 0.00 0.00 175.10 175.76 1o6s n THR 99 N 3.96 0.00 -1.87 3.92 -2.24 -0.83 -4.91 114.28 112.31 1o6s n THR 99 Ca -0.08 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.29 1o6s n THR 99 Cb 0.51 -0.45 -0.01 0.00 -2.10 0.00 0.00 70.33 68.28 1o6s n THR 99 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1o6s s ASP 100 N -0.63 6.45 0.00 3.42 1.01 -1.26 -2.40 116.67 123.26 1o6s s ASP 100 Ca 0.00 2.92 0.00 0.00 0.71 0.00 0.00 52.55 56.18 1o6s s ASP 100 Cb 0.00 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 41.28 1o6s s ASP 100 CO 0.00 -0.81 0.00 1.67 0.21 0.00 0.00 175.17 176.24