#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p6s n ASN 2 N 0.00 -1.45 -1.96 6.12 0.23 -1.26 -4.98 115.26 111.97 1p6s n ASN 2 Ca 0.00 -2.15 -0.14 0.00 -0.53 0.00 0.00 54.58 51.76 1p6s n ASN 2 Cb 0.00 0.73 0.05 0.00 -2.08 0.00 0.00 39.78 38.48 1p6s n ASN 2 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 1p6s n GLU 3 N -1.13 2.81 -3.10 -3.83 0.00 -1.26 -5.04 120.64 109.09 1p6s n GLU 3 Ca -0.13 -3.83 -0.40 0.00 0.00 0.00 0.00 57.16 52.80 1p6s n GLU 3 Cb 0.83 -1.96 -0.06 0.00 0.00 0.00 0.00 31.44 30.25 1p6s n GLU 3 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1p6s s VAL 4 N -4.06 5.01 0.51 3.84 1.01 -1.26 -5.06 120.40 120.40 1p6s s VAL 4 Ca 0.44 1.20 0.09 0.00 0.00 0.00 0.00 61.98 63.71 1p6s s VAL 4 Cb 0.39 -3.95 0.05 0.00 0.00 0.00 0.00 36.38 32.87 1p6s s VAL 4 CO -0.00 0.09 0.67 -0.44 0.00 0.00 0.00 175.10 175.42 1p6s s SER 5 N 1.23 5.24 0.03 3.32 0.01 -1.26 -4.80 113.70 117.47 1p6s s SER 5 Ca 0.29 -0.74 -0.27 0.00 1.31 0.00 0.00 55.95 56.54 1p6s s SER 5 Cb -0.16 -0.05 -0.05 0.00 0.21 0.00 0.00 66.02 65.98 1p6s s SER 5 CO 0.10 -1.10 0.85 -0.69 0.41 0.00 0.00 173.24 172.82 1p6s s VAL 6 N -2.56 4.77 -0.19 3.43 1.01 -1.26 -0.31 120.40 125.28 1p6s s VAL 6 Ca 0.57 1.81 -0.12 0.00 0.00 0.00 0.00 61.98 64.24 1p6s s VAL 6 Cb -0.07 -4.20 -0.21 0.00 0.00 0.00 0.00 36.38 31.90 1p6s s VAL 6 CO 0.35 0.28 0.15 -0.38 0.00 0.00 0.00 175.10 175.50 1p6s n ILE 7 N 3.25 1.63 -3.72 2.22 2.08 0.20 -4.82 119.36 120.19 1p6s n ILE 7 Ca 0.01 -0.40 -0.12 0.00 0.56 0.00 0.00 62.75 62.80 1p6s n ILE 7 Cb 0.50 -1.82 -0.10 0.00 -0.75 0.00 0.00 39.64 37.47 1p6s n ILE 7 CO 0.00 0.00 0.00 -0.75 0.56 0.00 0.00 176.55 176.36 1p6s s LYS 8 N -2.48 0.45 -0.09 0.38 2.47 -1.03 -5.01 119.74 114.43 1p6s s LYS 8 Ca -0.28 0.63 0.03 0.00 -1.56 0.00 0.00 55.97 54.79 1p6s s LYS 8 Cb 0.08 0.15 0.01 0.00 -1.46 0.00 0.00 37.83 36.60 1p6s s LYS 8 CO 0.65 -0.09 -0.20 -1.21 0.16 0.00 0.00 175.35 174.67 1p6s s GLU 9 N 0.58 2.58 0.27 4.03 2.02 -1.26 0.26 118.70 127.17 1p6s s GLU 9 Ca -0.03 -0.71 -0.21 0.00 0.02 0.00 0.00 54.97 54.03 1p6s s GLU 9 Cb -0.05 -2.00 0.02 0.00 0.10 0.00 0.00 34.13 32.21 1p6s s GLU 9 CO -0.04 0.12 0.73 0.20 0.02 0.00 0.00 175.26 176.29 1p6s s GLY 10 N 0.48 -0.11 -0.01 -1.39 0.00 -0.12 -5.01 107.32 101.17 1p6s s GLY 10 Ca -0.17 -0.27 -0.16 0.00 0.00 0.00 0.00 44.72 44.13 1p6s s GLY 10 CO 0.07 -0.08 0.44 -0.98 0.00 0.00 0.00 173.10 172.55 1p6s s TRP 11 N -3.88 3.71 0.12 1.90 0.52 -1.26 0.15 118.94 120.20 1p6s s TRP 11 Ca 0.11 1.02 0.08 0.00 0.02 0.00 0.00 56.10 57.33 1p6s s TRP 11 Cb -0.06 -2.36 -0.04 0.00 -1.15 0.00 0.00 33.47 29.87 1p6s s TRP 11 CO 0.06 0.56 -0.20 -0.51 0.02 0.00 0.00 176.95 176.88 1p6s s LEU 12 N -0.80 2.34 -0.28 2.99 1.43 0.12 -2.92 118.68 121.56 1p6s s LEU 12 Ca 0.25 -0.74 -0.11 0.00 -1.03 0.00 0.00 54.13 52.50 1p6s s LEU 12 Cb -0.17 -0.89 -0.05 0.00 0.03 0.00 0.00 46.19 45.12 1p6s s LEU 12 CO 0.14 0.04 0.18 -1.00 0.23 0.00 0.00 176.35 175.94 1p6s s HIS 13 N -1.40 3.21 -0.03 0.29 3.76 0.20 0.91 115.29 122.23 1p6s s HIS 13 Ca 0.09 0.06 0.06 0.00 -0.15 0.00 0.00 55.06 55.13 1p6s s HIS 13 Cb -0.09 -2.37 -0.01 0.00 1.11 0.00 0.00 32.58 31.22 1p6s s HIS 13 CO 0.05 -0.18 -0.22 0.21 -0.85 0.00 0.00 174.74 173.75 1p6s s LYS 14 N 1.75 2.00 0.33 1.40 2.47 0.07 -0.14 119.74 127.62 1p6s s LYS 14 Ca 0.07 -0.79 -0.29 0.00 -1.56 0.00 0.00 55.97 53.40 1p6s s LYS 14 Cb -0.16 -1.82 -0.11 0.00 -1.46 0.00 0.00 37.83 34.28 1p6s s LYS 14 CO 0.10 0.41 1.49 0.50 0.16 0.00 0.00 175.35 178.01 1p6s s ARG 15 N -0.32 4.16 -0.41 4.03 3.00 -1.26 -0.20 118.95 127.94 1p6s s ARG 15 Ca 0.03 2.50 0.06 0.00 -1.00 0.00 0.00 55.73 57.32 1p6s s ARG 15 Cb -0.11 -3.01 0.32 0.00 0.00 0.00 0.00 34.95 32.15 1p6s s ARG 15 CO 0.01 -0.51 1.22 0.41 0.00 0.00 0.00 175.30 176.43 1p6s n GLY 16 N 1.21 0.03 3.47 8.12 0.00 -0.97 -4.84 105.19 112.21 1p6s n GLY 16 Ca 0.04 0.24 -0.11 0.00 0.00 0.00 0.00 46.02 46.19 1p6s n GLY 16 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1p6s s GLU 17 N 0.19 1.32 0.62 1.61 2.56 -1.26 -4.93 118.70 118.81 1p6s s GLU 17 Ca 0.21 -0.61 0.36 0.00 0.00 0.00 0.00 54.97 54.92 1p6s s GLU 17 Cb 0.29 0.57 2.06 0.00 2.00 0.00 0.00 34.13 39.05 1p6s s GLU 17 CO -0.09 -0.57 2.30 0.10 -0.56 0.00 0.00 175.26 176.43 1p6s h TYR 18 N 2.08 0.00 -3.10 5.30 -0.00 -2.01 -3.43 116.97 115.81 1p6s h TYR 18 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.41 1p6s h TYR 18 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.02 1p6s h TYR 18 CO 0.28 0.00 0.00 1.51 -0.00 0.00 0.00 178.16 179.96 1p6s n ILE 19 N -3.53 0.00 -2.58 -0.90 0.13 -1.26 -5.02 119.36 106.21 1p6s n ILE 19 Ca -0.03 0.00 -0.42 0.00 -1.10 0.00 0.00 62.75 61.20 1p6s n ILE 19 Cb 0.08 -0.60 0.01 0.00 -0.84 0.00 0.00 39.64 38.30 1p6s n ILE 19 CO 0.00 0.00 0.00 0.29 2.80 0.00 0.00 176.55 179.64 1p6s n LYS 20 N -0.06 4.18 -4.77 9.51 5.02 -1.26 -4.87 118.16 125.91 1p6s n LYS 20 Ca 0.00 -4.00 -0.30 0.00 -2.02 0.00 0.00 58.31 51.99 1p6s n LYS 20 Cb 0.00 -2.70 -0.14 0.00 -0.02 0.00 0.00 35.03 32.17 1p6s n LYS 20 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1p6s s THR 21 N -1.34 2.48 -0.11 -0.18 2.01 -1.26 -5.08 115.64 112.15 1p6s s THR 21 Ca 0.38 -1.29 0.02 0.00 0.31 0.00 0.00 61.69 61.10 1p6s s THR 21 Cb 0.09 -2.01 -0.01 0.00 0.01 0.00 0.00 72.50 70.58 1p6s s THR 21 CO 0.03 0.35 -0.17 0.26 -0.69 0.00 0.00 174.62 174.40 1p6s s TRP 22 N -0.87 2.72 -0.04 4.92 0.52 -1.26 -2.28 118.94 122.64 1p6s s TRP 22 Ca 0.13 -0.73 -0.02 0.00 0.02 0.00 0.00 56.10 55.50 1p6s s TRP 22 Cb -0.10 -1.78 -0.04 0.00 -1.15 0.00 0.00 33.47 30.40 1p6s s TRP 22 CO 0.04 -0.25 0.10 1.03 0.02 0.00 0.00 176.95 177.89 1p6s s ARG 23 N 0.26 3.19 0.16 4.98 0.52 0.72 -4.71 118.95 124.08 1p6s s ARG 23 Ca -0.12 -0.37 -0.30 0.00 -0.52 0.00 0.00 55.73 54.42 1p6s s ARG 23 Cb -0.16 -2.96 -0.08 0.00 0.52 0.00 0.00 34.95 32.28 1p6s s ARG 23 CO 0.06 0.69 1.17 -1.25 0.02 0.00 0.00 175.30 175.99 1p6s s PRO 24 N -1.50 4.51 -0.01 3.54 0.04 -1.26 -0.76 135.00 139.56 1p6s s PRO 24 Ca 0.21 1.82 0.03 0.00 0.04 0.00 0.00 61.00 63.09 1p6s s PRO 24 Cb -0.12 -3.27 -0.01 0.00 0.04 0.00 0.00 34.50 31.15 1p6s s PRO 24 CO 0.11 -0.07 -0.10 0.50 0.04 0.00 0.00 177.00 177.48 1p6s s ARG 25 N -0.08 0.88 -0.51 4.56 6.06 0.26 -4.89 118.95 125.23 1p6s s ARG 25 Ca 0.53 -0.37 -0.28 0.00 -2.50 0.00 0.00 55.73 53.11 1p6s s ARG 25 Cb -0.31 -0.84 0.02 0.00 0.06 0.00 0.00 34.95 33.87 1p6s s ARG 25 CO 0.35 0.21 1.36 -0.47 -2.50 0.00 0.00 175.30 174.24 1p6s s TYR 26 N -0.17 2.42 -0.09 5.12 5.04 0.10 0.16 117.35 129.93 1p6s s TYR 26 Ca 0.03 0.55 -0.05 0.00 -2.44 0.00 0.00 57.07 55.17 1p6s s TYR 26 Cb -0.05 -4.39 -0.04 0.00 0.35 0.00 0.00 41.96 37.83 1p6s s TYR 26 CO -0.00 -1.85 0.10 -0.06 -1.34 0.00 0.00 175.55 172.40 1p6s s PHE 27 N 5.57 3.45 -0.13 4.97 0.40 0.12 0.51 117.98 132.87 1p6s s PHE 27 Ca 0.53 0.40 0.01 0.00 -0.60 0.00 0.00 56.93 57.28 1p6s s PHE 27 Cb -0.11 -1.87 0.02 0.00 0.51 0.00 0.00 43.02 41.57 1p6s s PHE 27 CO 0.28 0.65 -0.17 -0.51 0.70 0.00 0.00 175.22 176.17 1p6s s LEU 28 N -1.16 1.84 -0.16 -0.37 1.02 0.63 -0.94 118.68 119.54 1p6s s LEU 28 Ca 0.17 -0.51 -0.08 0.00 0.02 0.00 0.00 54.13 53.72 1p6s s LEU 28 Cb -0.12 -1.24 -0.04 0.00 0.02 0.00 0.00 46.19 44.81 1p6s s LEU 28 CO 0.06 0.01 0.12 -0.22 0.02 0.00 0.00 176.35 176.34 1p6s s LEU 29 N 1.13 4.19 0.47 1.79 0.20 0.14 -0.90 118.68 125.70 1p6s s LEU 29 Ca -0.02 0.29 0.08 0.00 0.69 0.00 0.00 54.13 55.17 1p6s s LEU 29 Cb -0.14 -2.05 0.02 0.00 -0.43 0.00 0.00 46.19 43.58 1p6s s LEU 29 CO -0.06 0.27 0.49 -0.54 -0.29 0.00 0.00 176.35 176.22 1p6s s LYS 30 N -0.18 2.48 0.00 1.98 -0.14 -0.22 0.59 119.74 124.25 1p6s s LYS 30 Ca 0.10 -1.61 0.20 0.00 -1.36 0.00 0.00 55.97 53.30 1p6s s LYS 30 Cb -0.12 -2.43 1.17 0.00 -1.68 0.00 0.00 37.83 34.77 1p6s s LYS 30 CO 0.01 -0.42 1.72 0.45 -0.76 0.00 0.00 175.35 176.35 1p6s n SER 31 N -1.77 0.00 -0.67 2.83 2.88 0.57 -3.30 113.62 114.16 1p6s n SER 31 Ca 0.05 -1.30 0.10 0.00 -1.33 0.00 0.00 58.87 56.39 1p6s n SER 31 Cb 0.62 0.00 0.31 0.00 -0.75 0.00 0.00 64.21 64.39 1p6s n SER 31 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1p6s n ASP 32 N -0.82 1.99 -0.50 -3.46 2.03 -1.26 -4.83 116.55 109.70 1p6s n ASP 32 Ca 0.15 -1.81 -0.01 0.00 0.52 0.00 0.00 54.79 53.63 1p6s n ASP 32 Cb 0.07 -0.16 0.00 0.00 -0.72 0.00 0.00 41.12 40.31 1p6s n ASP 32 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1p6s n GLY 33 N 1.18 0.77 3.36 0.27 0.00 -1.21 -4.79 105.19 104.76 1p6s n GLY 33 Ca 0.16 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.36 1p6s n GLY 33 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1p6s s SER 34 N -3.00 -0.51 -0.01 1.61 0.15 -1.26 -0.44 113.70 110.24 1p6s s SER 34 Ca 0.02 0.96 0.03 0.00 0.70 0.00 0.00 55.95 57.65 1p6s s SER 34 Cb -0.01 0.94 -0.00 0.00 -1.71 0.00 0.00 66.02 65.24 1p6s s SER 34 CO 0.02 -0.17 -0.09 0.72 1.20 0.00 0.00 173.24 174.92 1p6s s PHE 35 N 0.46 0.88 -0.02 3.44 -0.71 0.11 -1.06 117.98 121.08 1p6s s PHE 35 Ca -0.02 -0.18 -0.01 0.00 -1.04 0.00 0.00 56.93 55.68 1p6s s PHE 35 Cb -0.04 -0.59 -0.04 0.00 -1.21 0.00 0.00 43.02 41.14 1p6s s PHE 35 CO -0.02 -0.04 0.06 0.42 -1.34 0.00 0.00 175.22 174.30 1p6s s ILE 36 N -0.08 4.62 -0.16 -4.49 1.09 -0.08 -0.68 121.20 121.42 1p6s s ILE 36 Ca 0.01 -0.38 -0.07 0.00 -1.10 0.00 0.00 60.65 59.12 1p6s s ILE 36 Cb -0.05 -3.08 -0.04 0.00 -1.06 0.00 0.00 42.46 38.23 1p6s s ILE 36 CO -0.00 0.41 0.07 -0.83 -0.10 0.00 0.00 174.94 174.48 1p6s s GLY 37 N -1.54 1.94 -0.04 6.18 0.00 0.14 -0.27 107.32 113.74 1p6s s GLY 37 Ca 0.20 -0.73 0.06 0.00 0.00 0.00 0.00 44.72 44.25 1p6s s GLY 37 CO 0.11 -0.10 -0.22 -0.19 0.00 0.00 0.00 173.10 172.69 1p6s s TYR 38 N -0.04 2.47 0.15 1.90 2.02 0.18 -0.75 117.35 123.28 1p6s s TYR 38 Ca 0.07 -0.44 -0.16 0.00 -0.37 0.00 0.00 57.07 56.17 1p6s s TYR 38 Cb -0.12 -1.57 0.03 0.00 -0.40 0.00 0.00 41.96 39.91 1p6s s TYR 38 CO 0.01 -0.03 1.79 -0.22 -1.57 0.00 0.00 175.55 175.53 1p6s h LYS 39 N 5.63 0.42 0.00 -0.62 3.64 -1.92 0.29 116.57 124.00 1p6s h LYS 39 Ca -0.41 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 1p6s h LYS 39 Cb 1.14 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1p6s h LYS 39 CO 0.48 0.28 0.00 0.39 -2.27 0.00 0.00 179.45 178.33 1p6s n GLU 40 N -4.89 3.05 -3.25 1.90 -0.58 -1.26 -4.33 120.64 111.27 1p6s n GLU 40 Ca 0.01 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.46 1p6s n GLU 40 Cb 0.07 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 30.88 1p6s n GLU 40 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1p6s n ARG 41 N 0.00 2.94 -2.43 3.49 1.74 -1.26 -4.50 116.66 116.64 1p6s n ARG 41 Ca 0.00 -4.72 -0.35 0.00 -0.77 0.00 0.00 57.85 52.02 1p6s n ARG 41 Cb 0.00 -2.28 -0.02 0.00 -1.02 0.00 0.00 32.46 29.14 1p6s n ARG 41 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1p6s s PRO 42 N -2.81 3.67 -0.21 5.56 0.04 -1.26 -4.97 135.00 135.02 1p6s s PRO 42 Ca 0.42 1.48 0.08 0.00 0.04 0.00 0.00 61.00 63.02 1p6s s PRO 42 Cb 0.18 -2.11 0.26 0.00 0.04 0.00 0.00 34.50 32.86 1p6s s PRO 42 CO -0.04 -0.56 1.16 -1.91 0.04 0.00 0.00 177.00 175.69 1p6s n GLU 43 N -1.00 0.86 -2.52 4.56 4.07 -1.26 -4.93 120.64 120.42 1p6s n GLU 43 Ca 0.10 -0.76 -0.42 0.00 -0.06 0.00 0.00 57.16 56.01 1p6s n GLU 43 Cb 0.52 0.27 -0.03 0.00 -0.06 0.00 0.00 31.44 32.14 1p6s n GLU 43 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1p6s s ALA 44 N 0.08 3.35 -0.29 4.31 0.00 -1.26 -4.92 121.76 123.04 1p6s s ALA 44 Ca 0.06 0.69 0.24 0.00 0.00 0.00 0.00 51.96 52.95 1p6s s ALA 44 Cb 0.28 -3.43 0.50 0.00 0.00 0.00 0.00 23.12 20.47 1p6s s ALA 44 CO -0.08 -0.46 1.66 -1.00 0.00 0.00 0.00 175.76 175.88 1p6s h PRO 45 N 6.96 0.00 0.00 0.00 0.13 -2.00 -2.52 132.00 134.57 1p6s h PRO 45 Ca -0.39 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.70 1p6s h PRO 45 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 1p6s h PRO 45 CO 0.81 0.08 -1.30 -0.25 -0.23 0.00 0.00 178.00 177.11 1p6s n ASP 46 N -3.13 0.68 -3.09 1.44 8.00 -1.26 -4.56 116.55 114.62 1p6s n ASP 46 Ca 0.03 0.27 -0.19 0.00 0.71 0.00 0.00 54.79 55.61 1p6s n ASP 46 Cb 0.52 0.69 -0.03 0.00 -0.02 0.00 0.00 41.12 42.28 1p6s n ASP 46 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1p6s n GLN 47 N -2.64 0.83 -1.54 -1.24 10.64 -1.22 -5.12 117.38 117.09 1p6s n GLN 47 Ca -0.03 -2.96 -0.53 0.00 -1.83 0.00 0.00 57.00 51.65 1p6s n GLN 47 Cb 0.62 -1.38 -0.06 0.00 -0.86 0.00 0.00 30.24 28.56 1p6s n GLN 47 CO 0.00 0.00 0.00 -2.37 -1.83 0.00 0.00 177.06 172.86 1p6s n THR 48 N 1.00 0.49 -3.48 -0.39 5.66 -0.95 -4.60 114.28 112.01 1p6s n THR 48 Ca 0.19 -0.12 -0.38 0.00 -3.05 0.00 0.00 64.05 60.69 1p6s n THR 48 Cb 0.60 -0.52 -0.06 0.00 -1.55 0.00 0.00 70.33 68.80 1p6s n THR 48 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1p6s s LEU 49 N 0.64 4.41 0.67 1.09 1.02 -1.26 -5.02 118.68 120.23 1p6s s LEU 49 Ca 0.81 0.87 -0.14 0.00 0.02 0.00 0.00 54.13 55.69 1p6s s LEU 49 Cb -1.01 -2.57 0.01 0.00 0.02 0.00 0.00 46.19 42.64 1p6s s LEU 49 CO 0.52 0.24 1.09 -2.16 0.02 0.00 0.00 176.35 176.06 1p6s s PRO 50 N -0.58 2.80 0.19 1.29 0.04 -1.26 -5.00 135.00 132.49 1p6s s PRO 50 Ca 0.23 1.26 -0.30 0.00 0.04 0.00 0.00 61.00 62.23 1p6s s PRO 50 Cb -0.16 -1.96 -0.08 0.00 0.04 0.00 0.00 34.50 32.34 1p6s s PRO 50 CO 0.11 -1.23 1.18 -1.25 0.04 0.00 0.00 177.00 175.85 1p6s s PRO 51 N -4.36 4.51 -0.17 0.56 0.04 -1.26 -4.98 135.00 129.34 1p6s s PRO 51 Ca 0.64 1.85 -0.25 0.00 0.04 0.00 0.00 61.00 63.28 1p6s s PRO 51 Cb -0.18 -3.24 -0.23 0.00 0.04 0.00 0.00 34.50 30.89 1p6s s PRO 51 CO 0.45 -0.06 0.50 -0.07 0.04 0.00 0.00 177.00 177.87 1p6s h LEU 52 N 5.16 0.00 -8.85 -3.56 4.07 -1.94 -3.46 115.31 106.74 1p6s h LEU 52 Ca -0.45 -0.76 -0.66 0.00 0.08 0.00 0.00 57.88 56.09 1p6s h LEU 52 Cb 1.21 -0.00 -0.23 0.00 1.08 0.00 0.00 40.66 42.73 1p6s h LEU 52 CO 0.74 1.24 -0.72 0.20 -1.08 0.00 0.00 178.44 178.82 1p6s s ASN 53 N -6.53 4.43 -0.27 -0.43 -0.87 0.07 -4.94 114.94 106.39 1p6s s ASN 53 Ca -0.24 -0.17 0.03 0.00 -1.57 0.00 0.00 52.86 50.91 1p6s s ASN 53 Cb 0.01 -1.45 0.06 0.00 -0.02 0.00 0.00 41.25 39.85 1p6s s ASN 53 CO 0.64 0.24 -0.09 0.21 -2.57 0.00 0.00 177.10 175.53 1p6s s ASN 54 N -0.09 4.50 -0.21 -1.22 2.47 -1.26 0.28 114.94 119.41 1p6s s ASN 54 Ca -0.00 -1.42 -0.05 0.00 0.42 0.00 0.00 52.86 51.82 1p6s s ASN 54 Cb -0.13 -1.57 -0.02 0.00 -1.45 0.00 0.00 41.25 38.08 1p6s s ASN 54 CO 0.03 -0.20 -0.02 0.12 -3.72 0.00 0.00 177.10 173.31 1p6s s PHE 55 N 1.11 2.99 -0.09 0.43 2.19 0.14 -4.95 117.98 119.80 1p6s s PHE 55 Ca -0.08 -0.69 0.02 0.00 0.33 0.00 0.00 56.93 56.51 1p6s s PHE 55 Cb -0.20 -2.10 -0.02 0.00 -1.31 0.00 0.00 43.02 39.39 1p6s s PHE 55 CO -0.05 -0.40 -0.15 0.45 1.83 0.00 0.00 175.22 176.90 1p6s s SER 56 N 1.29 3.93 -0.20 6.13 0.15 -1.26 0.04 113.70 123.78 1p6s s SER 56 Ca 0.04 -0.29 0.12 0.00 0.70 0.00 0.00 55.95 56.52 1p6s s SER 56 Cb -0.14 -1.23 0.41 0.00 -1.71 0.00 0.00 66.02 63.34 1p6s s SER 56 CO -0.00 0.25 1.21 0.55 1.20 0.00 0.00 173.24 176.45 1p6s n VAL 57 N 2.98 2.11 -0.09 4.45 3.14 0.41 -4.76 118.33 126.57 1p6s n VAL 57 Ca -0.18 -3.09 -0.13 0.00 -2.96 0.00 0.00 64.34 57.98 1p6s n VAL 57 Cb 0.52 -0.20 -0.04 0.00 -1.06 0.00 0.00 33.84 33.06 1p6s n VAL 57 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1p6s h ALA 58 N 0.91 0.43 -1.43 1.55 0.00 -1.85 -3.46 119.26 115.41 1p6s h ALA 58 Ca -0.01 -0.39 -0.54 0.00 0.00 0.00 0.00 54.91 53.97 1p6s h ALA 58 Cb 1.03 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.66 1p6s h ALA 58 CO 0.00 0.43 -0.43 -1.21 0.00 0.00 0.00 179.25 178.04 1p6s s GLU 59 N -4.38 2.34 2.33 0.00 2.02 -1.26 -4.98 118.70 114.76 1p6s s GLU 59 Ca -0.12 -1.76 0.00 0.00 0.02 0.00 0.00 54.97 53.11 1p6s s GLU 59 Cb 0.09 -2.13 0.00 0.00 0.10 0.00 0.00 34.13 32.18 1p6s s GLU 59 CO 0.83 -0.20 0.00 0.00 0.02 0.00 0.00 175.26 175.90 1p6s s GLN 61 N 0.00 1.13 0.24 0.00 0.00 -1.26 -5.08 119.66 114.69 1p6s s GLN 61 Ca 0.00 -0.94 0.10 0.00 -0.00 0.00 0.00 55.36 54.51 1p6s s GLN 61 Cb 0.00 0.43 -0.04 0.00 0.00 0.00 0.00 33.01 33.39 1p6s s GLN 61 CO 0.00 -0.43 -0.08 -0.51 0.00 0.00 0.00 175.29 174.27 1p6s s LEU 62 N -2.88 2.99 -0.01 2.60 1.02 -1.26 -4.31 118.68 116.82 1p6s s LEU 62 Ca 0.09 -0.70 0.05 0.00 0.02 0.00 0.00 54.13 53.60 1p6s s LEU 62 Cb 0.02 -1.57 -0.01 0.00 0.02 0.00 0.00 46.19 44.65 1p6s s LEU 62 CO -0.06 0.05 -0.15 0.00 0.02 0.00 0.00 176.35 176.21 1p6s s MET 63 N -3.32 1.25 -0.01 1.70 0.23 0.88 -4.95 119.30 115.08 1p6s s MET 63 Ca 0.29 -0.55 -0.26 0.00 -1.03 0.00 0.00 55.69 54.14 1p6s s MET 63 Cb -0.07 -1.20 -0.04 0.00 -1.53 0.00 0.00 34.83 31.99 1p6s s MET 63 CO 0.17 0.33 0.81 0.15 -2.03 0.00 0.00 175.02 174.45 1p6s s LYS 64 N -0.35 4.50 0.41 3.16 1.02 -1.26 -0.40 119.74 126.83 1p6s s LYS 64 Ca 0.06 1.12 0.05 0.00 0.02 0.00 0.00 55.97 57.21 1p6s s LYS 64 Cb -0.06 -3.42 -0.02 0.00 -0.52 0.00 0.00 37.83 33.81 1p6s s LYS 64 CO -0.01 0.10 0.17 -2.37 -0.92 0.00 0.00 175.35 172.32 1p6s n THR 65 N 3.50 0.00 -1.40 2.17 5.66 0.11 -4.94 114.28 119.38 1p6s n THR 65 Ca 0.01 -2.47 0.07 0.00 -3.05 0.00 0.00 64.05 58.60 1p6s n THR 65 Cb 0.51 0.94 0.10 0.00 -1.55 0.00 0.00 70.33 70.33 1p6s n THR 65 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1p6s n GLU 66 N -0.91 0.88 -4.59 1.09 0.00 -1.26 -0.87 120.64 115.00 1p6s n GLU 66 Ca -0.04 -2.13 -0.22 0.00 0.00 0.00 0.00 57.16 54.78 1p6s n GLU 66 Cb 0.63 -1.18 -0.15 0.00 0.00 0.00 0.00 31.44 30.74 1p6s n GLU 66 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 1p6s s ARG 67 N -1.98 1.11 0.40 3.44 0.52 -1.26 -3.33 118.95 117.85 1p6s s ARG 67 Ca 0.23 -0.46 0.21 0.00 -0.52 0.00 0.00 55.73 55.19 1p6s s ARG 67 Cb 0.20 -1.05 0.73 0.00 0.52 0.00 0.00 34.95 35.35 1p6s s ARG 67 CO 0.01 0.25 1.75 -1.00 0.02 0.00 0.00 175.30 176.34 1p6s h PRO 68 N 5.94 0.00 -6.19 3.54 0.13 -2.01 -3.48 132.00 129.93 1p6s h PRO 68 Ca -0.33 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.25 1p6s h PRO 68 Cb 1.17 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.21 1p6s h PRO 68 CO 0.49 0.31 -0.62 1.03 -0.23 0.00 0.00 178.00 178.99 1p6s s ARG 69 N -3.58 2.38 0.77 0.86 0.52 -1.21 -5.12 118.95 113.58 1p6s s ARG 69 Ca 0.01 -1.39 -0.11 0.00 -0.52 0.00 0.00 55.73 53.71 1p6s s ARG 69 Cb 0.10 -2.21 0.06 0.00 0.52 0.00 0.00 34.95 33.42 1p6s s ARG 69 CO 0.67 0.34 1.11 -1.25 0.02 0.00 0.00 175.30 176.18 1p6s s PRO 70 N -3.72 2.15 -0.94 3.54 0.04 -1.21 -4.12 135.00 130.74 1p6s s PRO 70 Ca 0.32 1.29 -0.06 0.00 0.04 0.00 0.00 61.00 62.59 1p6s s PRO 70 Cb -0.06 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.57 1p6s s PRO 70 CO 0.21 -1.74 0.81 0.09 0.04 0.00 0.00 177.00 176.41 1p6s n ASN 71 N -3.42 -6.74 -4.35 6.66 3.02 -1.20 -4.87 115.26 104.37 1p6s n ASN 71 Ca 0.10 -0.55 -0.22 0.00 -0.03 0.00 0.00 54.58 53.88 1p6s n ASN 71 Cb 0.53 -4.76 -0.11 0.00 -0.61 0.00 0.00 39.78 34.83 1p6s n ASN 71 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1p6s s THR 72 N -3.24 1.87 -0.11 3.41 2.01 -0.04 -3.31 115.64 116.21 1p6s s THR 72 Ca 0.28 -2.00 0.03 0.00 0.31 0.00 0.00 61.69 60.31 1p6s s THR 72 Cb -0.05 -1.91 -0.00 0.00 0.01 0.00 0.00 72.50 70.54 1p6s s THR 72 CO 0.77 -0.35 -0.21 -0.36 -0.69 0.00 0.00 174.62 173.77 1p6s s PHE 73 N -2.20 2.63 0.00 4.92 0.08 0.84 0.05 117.98 124.31 1p6s s PHE 73 Ca 0.18 -1.03 0.08 0.00 0.12 0.00 0.00 56.93 56.28 1p6s s PHE 73 Cb -0.05 -1.76 -0.02 0.00 -0.57 0.00 0.00 43.02 40.62 1p6s s PHE 73 CO 0.07 -0.42 -0.25 0.08 -0.10 0.00 0.00 175.22 174.61 1p6s s VAL 74 N 0.45 1.95 -0.00 -0.44 1.01 0.47 -0.06 120.40 123.78 1p6s s VAL 74 Ca -0.15 -1.15 0.02 0.00 0.00 0.00 0.00 61.98 60.70 1p6s s VAL 74 Cb -0.17 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.56 1p6s s VAL 74 CO 0.06 0.46 -0.06 -0.51 0.00 0.00 0.00 175.10 175.05 1p6s s ILE 75 N -0.66 0.50 -0.66 2.22 2.07 0.49 -0.09 121.20 125.08 1p6s s ILE 75 Ca 0.10 -0.31 0.06 0.00 -1.41 0.00 0.00 60.65 59.08 1p6s s ILE 75 Cb -0.09 -0.43 0.23 0.00 0.13 0.00 0.00 42.46 42.30 1p6s s ILE 75 CO 0.00 0.12 0.71 -1.14 -1.91 0.00 0.00 174.94 172.71 1p6s n ARG 76 N 2.85 2.42 -3.13 3.50 0.63 -1.26 -4.70 116.66 116.96 1p6s n ARG 76 Ca -0.13 -4.64 0.03 0.00 -0.92 0.00 0.00 57.85 52.18 1p6s n ARG 76 Cb 0.58 -2.27 -0.00 0.00 0.45 0.00 0.00 32.46 31.21 1p6s n ARG 76 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1p6s s LEU 78 N 2.43 4.16 -0.04 0.00 2.01 -1.26 -4.97 118.68 121.02 1p6s s LEU 78 Ca 0.15 -0.05 -0.05 0.00 0.01 0.00 0.00 54.13 54.19 1p6s s LEU 78 Cb -0.05 -2.21 -0.02 0.00 0.01 0.00 0.00 46.19 43.92 1p6s s LEU 78 CO -0.18 -0.14 -0.10 0.00 1.01 0.00 0.00 176.35 176.94 1p6s n GLN 79 N 5.16 0.15 -2.80 1.70 1.13 -1.26 -4.99 117.38 116.47 1p6s n GLN 79 Ca -0.12 0.06 -0.10 0.00 -1.94 0.00 0.00 57.00 54.89 1p6s n GLN 79 Cb 0.51 -0.66 0.06 0.00 0.11 0.00 0.00 30.24 30.25 1p6s n GLN 79 CO 0.00 0.00 0.00 1.87 -1.44 0.00 0.00 177.06 177.49 1p6s n TRP 80 N -3.17 -2.69 -4.55 1.08 -0.00 -1.26 -5.14 117.44 101.72 1p6s n TRP 80 Ca -0.04 -2.19 -0.32 0.00 -0.00 0.00 0.00 57.50 54.95 1p6s n TRP 80 Cb 0.14 1.34 -0.11 0.00 -0.00 0.00 0.00 31.31 32.68 1p6s n TRP 80 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 177.69 178.64 1p6s s THR 81 N 0.15 3.52 0.30 5.87 -4.23 -1.26 -5.01 115.64 114.98 1p6s s THR 81 Ca 0.28 -0.76 0.04 0.00 -1.18 0.00 0.00 61.69 60.07 1p6s s THR 81 Cb 0.26 -2.50 0.08 0.00 1.34 0.00 0.00 72.50 71.69 1p6s s THR 81 CO -0.13 0.44 1.76 0.71 -0.54 0.00 0.00 174.62 176.85 1p6s h THR 82 N 3.91 1.26 -3.06 3.99 1.35 -1.96 -3.43 112.91 114.96 1p6s h THR 82 Ca -0.48 -1.21 -0.63 0.00 -0.55 0.00 0.00 66.41 63.55 1p6s h THR 82 Cb 1.17 1.35 -0.08 0.00 -1.73 0.00 0.00 68.15 68.86 1p6s h THR 82 CO 0.53 0.38 -0.57 0.54 -0.25 0.00 0.00 175.52 176.14 1p6s s VAL 83 N -4.51 4.73 -0.77 6.82 0.11 -1.26 -5.06 120.40 120.46 1p6s s VAL 83 Ca -0.06 -0.71 -0.14 0.00 -2.93 0.00 0.00 61.98 58.13 1p6s s VAL 83 Cb 0.14 -3.30 0.20 0.00 -1.53 0.00 0.00 36.38 31.89 1p6s s VAL 83 CO 0.78 0.10 0.71 -0.63 -3.33 0.00 0.00 175.10 172.72 1p6s s ILE 84 N -1.46 5.46 -0.47 7.04 1.09 -1.26 -5.02 121.20 126.58 1p6s s ILE 84 Ca 0.31 -2.32 -0.16 0.00 -1.10 0.00 0.00 60.65 57.38 1p6s s ILE 84 Cb -0.12 -4.40 0.07 0.00 -1.06 0.00 0.00 42.46 36.95 1p6s s ILE 84 CO 0.24 -0.99 0.42 -1.61 -0.10 0.00 0.00 174.94 172.89 1p6s s GLU 85 N 0.40 3.00 -0.21 2.79 2.02 -1.26 -4.92 118.70 120.52 1p6s s GLU 85 Ca 0.15 -1.27 -0.21 0.00 0.02 0.00 0.00 54.97 53.66 1p6s s GLU 85 Cb -0.14 -4.12 -0.19 0.00 0.10 0.00 0.00 34.13 29.78 1p6s s GLU 85 CO -0.07 -1.03 0.20 -2.13 0.02 0.00 0.00 175.26 172.25 1p6s n ARG 86 N 5.32 0.57 -4.26 1.61 3.00 -1.26 -4.79 116.66 116.84 1p6s n ARG 86 Ca -0.12 0.56 -0.17 0.00 -0.00 0.00 0.00 57.85 58.12 1p6s n ARG 86 Cb 0.44 -1.74 -0.14 0.00 0.00 0.00 0.00 32.46 31.02 1p6s n ARG 86 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.63 177.55 1p6s s THR 87 N -2.37 0.66 0.06 5.15 -1.32 -1.26 -0.38 115.64 116.17 1p6s s THR 87 Ca -0.29 -0.52 0.03 0.00 -1.21 0.00 0.00 61.69 59.70 1p6s s THR 87 Cb 0.06 -0.58 -0.03 0.00 -1.51 0.00 0.00 72.50 70.44 1p6s s THR 87 CO 0.59 0.07 -0.09 0.72 -2.21 0.00 0.00 174.62 173.70 1p6s s PHE 88 N -0.44 0.83 0.18 9.09 -0.12 0.91 -4.80 117.98 123.64 1p6s s PHE 88 Ca 0.01 -0.52 0.05 0.00 -0.05 0.00 0.00 56.93 56.42 1p6s s PHE 88 Cb -0.05 -0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 41.82 1p6s s PHE 88 CO 0.00 -0.05 0.17 -1.01 -0.05 0.00 0.00 175.22 174.28 1p6s s HIS 89 N -1.54 3.18 0.28 3.49 3.76 0.80 -0.11 115.29 125.14 1p6s s HIS 89 Ca -0.06 -0.02 0.07 0.00 -0.15 0.00 0.00 55.06 54.90 1p6s s HIS 89 Cb -0.09 -1.50 -0.03 0.00 1.11 0.00 0.00 32.58 32.07 1p6s s HIS 89 CO 0.01 0.52 0.23 0.14 -0.85 0.00 0.00 174.74 174.78 1p6s s VAL 90 N -1.83 4.18 0.32 -0.90 -7.23 -1.21 0.62 120.40 114.35 1p6s s VAL 90 Ca 0.32 -1.38 0.03 0.00 -1.81 0.00 0.00 61.98 59.13 1p6s s VAL 90 Cb -0.10 -3.34 0.16 0.00 0.56 0.00 0.00 36.38 33.66 1p6s s VAL 90 CO 0.24 -0.29 1.86 -0.78 -0.31 0.00 0.00 175.10 175.82 1p6s h ASP 91 N 1.40 0.57 -5.29 4.85 1.82 -1.88 -3.42 116.42 114.48 1p6s h ASP 91 Ca -0.47 -0.11 -0.09 0.00 -0.39 0.00 0.00 57.03 55.97 1p6s h ASP 91 Cb 1.24 -0.15 -0.09 0.00 0.68 0.00 0.00 39.33 41.01 1p6s h ASP 91 CO 0.60 0.62 -0.15 -0.55 -1.61 0.00 0.00 179.24 178.15 1p6s s SER 92 N -6.70 0.02 0.15 2.28 0.15 -1.26 -5.02 113.70 103.32 1p6s s SER 92 Ca -0.08 -1.02 -0.11 0.00 0.70 0.00 0.00 55.95 55.44 1p6s s SER 92 Cb 0.15 0.59 0.00 0.00 -1.71 0.00 0.00 66.02 65.05 1p6s s SER 92 CO 0.77 -1.15 1.56 1.55 1.20 0.00 0.00 173.24 177.17 1p6s h PRO 93 N 2.26 0.93 -0.48 5.44 0.13 -1.93 -1.73 132.00 136.62 1p6s h PRO 93 Ca -0.27 -0.37 -0.02 0.00 -0.87 0.00 0.00 66.00 64.47 1p6s h PRO 93 Cb 1.25 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 1p6s h PRO 93 CO 0.37 1.03 0.20 0.38 -0.23 0.00 0.00 178.00 179.75 1p6s h ASP 94 N 0.78 0.61 -0.38 1.44 3.04 -2.00 -2.24 116.42 117.68 1p6s h ASP 94 Ca 0.12 -0.06 -0.12 0.00 -3.24 0.00 0.00 57.03 53.72 1p6s h ASP 94 Cb 0.70 -0.16 -0.01 0.00 -1.04 0.00 0.00 39.33 38.82 1p6s h ASP 94 CO 0.05 0.55 -0.24 -0.08 -2.04 0.00 0.00 179.24 177.47 1p6s h GLU 95 N 0.68 0.83 -0.91 4.15 4.81 -1.87 -2.01 114.58 120.26 1p6s h GLU 95 Ca 0.17 -0.39 0.11 0.00 -0.13 0.00 0.00 59.36 59.11 1p6s h GLU 95 Cb 0.12 -0.01 -0.08 0.00 0.63 0.00 0.00 28.75 29.41 1p6s h GLU 95 CO -0.02 1.03 0.54 -0.09 -0.73 0.00 0.00 179.01 179.74 1p6s h ARG 96 N 0.64 0.85 -0.17 1.92 2.43 -0.73 -0.39 114.38 118.92 1p6s h ARG 96 Ca 0.08 -0.05 -0.16 0.00 -0.81 0.00 0.00 59.98 59.03 1p6s h ARG 96 Cb 0.81 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.16 1p6s h ARG 96 CO 0.07 0.56 -0.57 0.93 -1.51 0.00 0.00 179.97 179.45 1p6s h GLU 97 N 0.87 0.52 -0.85 0.20 4.39 -1.32 -2.71 114.58 115.69 1p6s h GLU 97 Ca 0.45 -0.34 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 1p6s h GLU 97 Cb 0.44 0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.09 1p6s h GLU 97 CO -0.26 0.95 0.42 0.93 -1.16 0.00 0.00 179.01 179.89 1p6s h GLU 98 N 0.40 1.21 -0.03 2.33 5.08 -0.36 0.79 114.58 123.99 1p6s h GLU 98 Ca 0.00 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 1p6s h GLU 98 Cb 1.11 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 30.14 1p6s h GLU 98 CO 0.10 0.92 -0.00 -1.49 -1.00 0.00 0.00 179.01 177.54 1p6s h TRP 99 N 1.20 0.06 -0.91 4.33 -0.00 -1.14 -1.41 115.95 118.09 1p6s h TRP 99 Ca 0.29 -0.01 0.03 0.00 -0.00 0.00 0.00 58.89 59.20 1p6s h TRP 99 Cb 0.09 -0.02 -0.05 0.00 -0.00 0.00 0.00 29.16 29.19 1p6s h TRP 99 CO 0.01 0.36 0.59 1.98 -0.00 0.00 0.00 178.44 181.38 1p6s h MET 100 N -0.25 1.14 -0.49 0.49 4.05 -1.28 -1.43 114.93 117.15 1p6s h MET 100 Ca 0.01 -0.07 -0.03 0.00 -0.28 0.00 0.00 59.70 59.33 1p6s h MET 100 Cb 0.33 -0.26 -0.02 0.00 -0.80 0.00 0.00 31.60 30.85 1p6s h MET 100 CO 0.00 0.75 0.20 -0.09 0.23 0.00 0.00 176.91 178.01 1p6s h ARG 101 N 1.17 0.73 -0.47 0.39 9.65 -0.72 -2.24 114.38 122.90 1p6s h ARG 101 Ca 0.35 -0.13 -0.02 0.00 -1.10 0.00 0.00 59.98 59.08 1p6s h ARG 101 Cb -0.05 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.39 1p6s h ARG 101 CO -0.10 0.65 0.21 0.00 2.80 0.00 0.00 179.97 183.52 1p6s h ALA 102 N 1.05 0.61 -0.71 2.80 0.00 -0.75 -0.64 119.26 121.62 1p6s h ALA 102 Ca 0.17 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.98 1p6s h ALA 102 Cb 0.18 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 1p6s h ALA 102 CO -0.01 0.20 0.43 0.82 0.00 0.00 0.00 179.25 180.68 1p6s h ILE 103 N 0.62 1.05 -0.34 0.00 2.04 -1.09 0.36 117.51 120.15 1p6s h ILE 103 Ca 0.16 -0.28 -0.08 0.00 1.00 0.00 0.00 64.86 65.66 1p6s h ILE 103 Cb 0.16 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.39 1p6s h ILE 103 CO -0.02 0.15 -0.09 -0.61 0.00 0.00 0.00 178.15 177.58 1p6s h GLN 104 N 0.82 0.66 -0.39 2.37 -0.00 -1.11 0.18 115.11 117.65 1p6s h GLN 104 Ca 0.30 -0.26 -0.07 0.00 -0.00 0.00 0.00 58.65 58.62 1p6s h GLN 104 Cb 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 27.48 27.52 1p6s h GLN 104 CO -0.14 0.84 -0.03 0.52 0.00 0.00 0.00 178.83 180.02 1p6s h MET 105 N 0.45 0.70 -0.14 1.69 2.86 -0.64 -2.86 114.93 116.99 1p6s h MET 105 Ca 0.09 -0.24 -0.13 0.00 -2.06 0.00 0.00 59.70 57.36 1p6s h MET 105 Cb 0.60 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 1p6s h MET 105 CO 0.04 0.81 -0.48 0.28 1.06 0.00 0.00 176.91 178.62 1p6s h VAL 106 N 0.52 1.33 -0.46 -2.22 2.07 -0.26 -2.91 116.25 114.31 1p6s h VAL 106 Ca 0.11 -1.69 0.05 0.00 0.82 0.00 0.00 66.70 65.98 1p6s h VAL 106 Cb 0.51 1.75 -0.03 0.00 -1.52 0.00 0.00 31.29 32.01 1p6s h VAL 106 CO 0.02 0.51 0.31 0.00 0.02 0.00 0.00 177.57 178.44 1p6s h ALA 107 N 1.21 1.88 -0.79 1.67 0.00 -0.42 0.34 119.26 123.16 1p6s h ALA 107 Ca 0.02 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1p6s h ALA 107 Cb 0.95 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.57 1p6s h ALA 107 CO 0.08 0.05 0.48 -0.91 0.00 0.00 0.00 179.25 178.95 1p6s h ASN 108 N 0.44 0.77 0.68 0.00 2.35 -1.30 -0.08 115.58 118.45 1p6s h ASN 108 Ca 0.20 0.01 -0.24 0.00 -0.55 0.00 0.00 56.30 55.72 1p6s h ASN 108 Cb 0.23 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.41 1p6s h ASN 108 CO -0.05 0.51 -1.45 -1.28 -1.65 0.00 0.00 177.43 173.51 1p6s h SER 109 N 0.91 0.00 -0.28 5.81 0.87 -1.46 -3.35 113.55 116.05 1p6s h SER 109 Ca 0.33 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.88 1p6s h SER 109 Cb 0.11 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 1p6s h SER 109 CO -0.15 0.89 0.11 0.25 -0.53 0.00 0.00 176.83 177.40 1p6s h LEU 110 N 0.00 0.40 0.00 2.23 5.85 0.07 -3.53 115.31 120.33 1p6s h LEU 110 Ca -0.19 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.35 1p6s h LEU 110 Cb 1.85 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.78 1p6s h LEU 110 CO 0.08 0.46 0.00 0.29 -0.34 0.00 0.00 178.44 178.93