#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p6s s ASN 2 N 0.00 -0.71 -0.38 6.12 2.20 -1.26 -5.07 114.94 115.84 1p6s s ASN 2 Ca 0.00 1.22 0.10 0.00 -0.94 0.00 0.00 52.86 53.25 1p6s s ASN 2 Cb 0.00 1.15 0.40 0.00 -2.00 0.00 0.00 41.25 40.79 1p6s s ASN 2 CO 0.00 -0.21 1.38 -1.84 -2.94 0.00 0.00 177.10 173.48 1p6s n GLU 3 N 3.79 1.24 -3.98 3.55 0.00 -1.26 -5.11 120.64 118.86 1p6s n GLU 3 Ca -0.19 -1.78 -0.29 0.00 0.00 0.00 0.00 57.16 54.90 1p6s n GLU 3 Cb 0.57 -0.02 -0.17 0.00 0.00 0.00 0.00 31.44 31.83 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 -0.00 1.43 0.39 3.84 1.01 -1.26 -5.00 120.40 120.81 1p6s s VAL 4 Ca 0.20 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.62 1p6s s VAL 4 Cb 0.41 -1.40 0.04 0.00 0.00 0.00 0.00 36.38 35.44 1p6s s VAL 4 CO -0.09 0.39 0.33 -1.54 0.00 0.00 0.00 175.10 174.18 1p6s n SER 5 N 4.81 2.13 -4.73 3.32 3.41 -1.26 -4.80 113.62 116.50 1p6s n SER 5 Ca -0.15 -2.30 -0.39 0.00 -0.26 0.00 0.00 58.87 55.77 1p6s n SER 5 Cb 0.50 -0.06 -0.05 0.00 -0.26 0.00 0.00 64.21 64.33 1p6s n SER 5 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1p6s s VAL 6 N -1.86 4.99 -0.20 -3.33 1.01 -1.26 -0.21 120.40 119.54 1p6s s VAL 6 Ca 0.25 1.38 0.03 0.00 0.00 0.00 0.00 61.98 63.63 1p6s s VAL 6 Cb -0.02 -4.00 -0.14 0.00 0.00 0.00 0.00 36.38 32.22 1p6s s VAL 6 CO 0.16 0.31 -0.15 -0.38 0.00 0.00 0.00 175.10 175.04 1p6s n ILE 7 N 3.39 1.15 -3.89 2.22 -0.00 0.15 -4.85 119.36 117.53 1p6s n ILE 7 Ca -0.03 -0.47 -0.13 0.00 -0.00 0.00 0.00 62.75 62.11 1p6s n ILE 7 Cb 0.51 -1.14 -0.15 0.00 -0.00 0.00 0.00 39.64 38.86 1p6s n ILE 7 CO 0.00 0.00 0.00 -0.54 -0.00 0.00 0.00 176.55 176.01 1p6s s LYS 8 N -2.40 0.07 0.00 0.38 1.02 -1.09 -5.01 119.74 112.70 1p6s s LYS 8 Ca -0.25 0.02 0.04 0.00 0.02 0.00 0.00 55.97 55.80 1p6s s LYS 8 Cb 0.07 -0.13 -0.01 0.00 -0.52 0.00 0.00 37.83 37.23 1p6s s LYS 8 CO 0.49 -0.03 -0.13 -1.83 -0.92 0.00 0.00 175.35 172.93 1p6s s GLU 9 N 0.27 1.01 0.12 1.68 -1.05 -1.26 0.53 118.70 120.00 1p6s s GLU 9 Ca -0.02 -0.53 -0.25 0.00 -0.15 0.00 0.00 54.97 54.01 1p6s s GLU 9 Cb -0.04 -0.98 0.08 0.00 -0.44 0.00 0.00 34.13 32.75 1p6s s GLU 9 CO -0.01 0.26 1.06 0.20 0.95 0.00 0.00 175.26 177.73 1p6s s GLY 10 N -0.51 -0.17 -0.06 -3.83 0.00 -0.38 -5.01 107.32 97.36 1p6s s GLY 10 Ca 0.04 0.10 -0.11 0.00 0.00 0.00 0.00 44.72 44.75 1p6s s GLY 10 CO -0.00 0.94 0.28 -0.98 0.00 0.00 0.00 173.10 173.34 1p6s s TRP 11 N -2.74 3.66 0.16 1.90 0.52 -1.26 0.22 118.94 121.40 1p6s s TRP 11 Ca 0.16 0.76 0.04 0.00 0.02 0.00 0.00 56.10 57.08 1p6s s TRP 11 Cb -0.00 -2.13 -0.05 0.00 -1.15 0.00 0.00 33.47 30.15 1p6s s TRP 11 CO 0.02 0.67 -0.07 -0.51 0.02 0.00 0.00 176.95 177.08 1p6s s LEU 12 N -0.99 2.44 -0.19 2.99 1.43 0.56 -3.43 118.68 121.48 1p6s s LEU 12 Ca 0.19 -1.06 -0.07 0.00 -1.03 0.00 0.00 54.13 52.16 1p6s s LEU 12 Cb -0.14 -0.31 -0.04 0.00 0.03 0.00 0.00 46.19 45.73 1p6s s LEU 12 CO 0.09 -0.39 0.06 -1.00 0.23 0.00 0.00 176.35 175.34 1p6s s HIS 13 N -3.37 3.22 -0.05 0.29 3.76 0.22 0.30 115.29 119.65 1p6s s HIS 13 Ca 0.19 -0.00 0.05 0.00 -0.15 0.00 0.00 55.06 55.15 1p6s s HIS 13 Cb 0.03 -2.11 -0.01 0.00 1.11 0.00 0.00 32.58 31.61 1p6s s HIS 13 CO 0.02 0.07 -0.21 0.21 -0.85 0.00 0.00 174.74 173.98 1p6s s LYS 14 N 0.59 2.17 0.12 1.40 2.36 0.00 -1.07 119.74 125.31 1p6s s LYS 14 Ca 0.03 -0.77 -0.30 0.00 -2.55 0.00 0.00 55.97 52.39 1p6s s LYS 14 Cb -0.13 -1.87 -0.06 0.00 -1.05 0.00 0.00 37.83 34.72 1p6s s LYS 14 CO 0.01 0.32 0.95 0.50 1.55 0.00 0.00 175.35 178.68 1p6s s ARG 15 N -0.08 4.71 0.00 4.03 3.00 -1.26 -0.28 118.95 129.07 1p6s s ARG 15 Ca -0.03 1.44 0.00 0.00 -1.00 0.00 0.00 55.73 56.13 1p6s s ARG 15 Cb -0.13 -3.36 0.00 0.00 0.00 0.00 0.00 34.95 31.46 1p6s s ARG 15 CO 0.03 0.25 0.00 0.41 0.00 0.00 0.00 175.30 175.99 1p6s n GLY 16 N 2.16 2.38 4.63 8.12 0.00 -0.82 -4.95 105.19 116.70 1p6s n GLY 16 Ca 0.02 -0.44 0.07 0.00 0.00 0.00 0.00 46.02 45.67 1p6s n GLY 16 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1p6s n GLU 17 N 0.00 -1.11 0.00 1.61 2.13 -1.26 -3.56 120.64 118.45 1p6s n GLU 17 Ca 0.00 0.73 0.10 0.00 0.66 0.00 0.00 57.16 58.65 1p6s n GLU 17 Cb 0.00 -1.35 -0.09 0.00 0.27 0.00 0.00 31.44 30.27 1p6s n GLU 17 CO 0.00 0.00 0.00 2.48 -0.41 0.00 0.00 177.13 179.20 1p6s n TYR 18 N -2.70 0.00 1.41 4.31 0.18 -1.26 -4.24 117.16 114.87 1p6s n TYR 18 Ca 0.00 0.00 0.13 0.00 1.88 0.00 0.00 57.90 59.92 1p6s n TYR 18 Cb 0.25 0.00 0.48 0.00 -0.38 0.00 0.00 39.34 39.69 1p6s n TYR 18 CO 0.00 0.00 0.00 1.51 -2.08 0.00 0.00 176.86 176.29 1p6s n ILE 19 N -1.19 0.05 -3.05 -3.48 0.13 -1.26 -4.98 119.36 105.58 1p6s n ILE 19 Ca 0.05 -0.28 -0.01 0.00 -1.10 0.00 0.00 62.75 61.41 1p6s n ILE 19 Cb 0.34 0.50 0.00 0.00 -0.84 0.00 0.00 39.64 39.64 1p6s n ILE 19 CO 0.00 0.00 0.00 1.17 2.80 0.00 0.00 176.55 180.52 1p6s n LYS 20 N 0.25 -1.39 -3.97 9.51 4.81 -1.25 -5.05 118.16 121.07 1p6s n LYS 20 Ca 0.18 1.54 -0.09 0.00 -0.87 0.00 0.00 58.31 59.07 1p6s n LYS 20 Cb 0.36 -5.73 -0.10 0.00 0.02 0.00 0.00 35.03 29.58 1p6s n LYS 20 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1p6s s THR 21 N -2.97 0.15 -0.22 3.15 2.01 -1.23 -4.98 115.64 111.54 1p6s s THR 21 Ca 0.02 -1.26 -0.18 0.00 0.31 0.00 0.00 61.69 60.58 1p6s s THR 21 Cb -0.00 -1.01 -0.03 0.00 0.01 0.00 0.00 72.50 71.46 1p6s s THR 21 CO 0.75 -0.69 0.49 0.26 -0.69 0.00 0.00 174.62 174.74 1p6s s TRP 22 N -2.91 3.33 -0.06 4.92 0.52 -1.26 -1.95 118.94 121.53 1p6s s TRP 22 Ca -0.02 0.68 -0.01 0.00 0.02 0.00 0.00 56.10 56.76 1p6s s TRP 22 Cb 0.01 -2.66 -0.03 0.00 -1.15 0.00 0.00 33.47 29.64 1p6s s TRP 22 CO -0.06 -0.15 0.02 0.50 0.02 0.00 0.00 176.95 177.28 1p6s s ARG 23 N 1.83 2.98 -0.21 4.98 6.06 0.62 -4.76 118.95 130.44 1p6s s ARG 23 Ca 0.22 -0.44 -0.29 0.00 -2.50 0.00 0.00 55.73 52.71 1p6s s ARG 23 Cb -0.15 -2.80 -0.02 0.00 0.06 0.00 0.00 34.95 32.04 1p6s s ARG 23 CO 0.09 0.68 1.44 -1.25 -2.50 0.00 0.00 175.30 173.77 1p6s s PRO 24 N -1.16 3.98 0.03 5.12 0.04 -1.26 -0.82 135.00 140.93 1p6s s PRO 24 Ca 0.16 1.59 0.06 0.00 0.04 0.00 0.00 61.00 62.86 1p6s s PRO 24 Cb -0.11 -3.92 -0.02 0.00 0.04 0.00 0.00 34.50 30.49 1p6s s PRO 24 CO 0.06 -1.05 -0.19 1.03 0.04 0.00 0.00 177.00 176.89 1p6s s ARG 25 N 4.17 1.33 0.24 4.56 3.00 0.15 -4.88 118.95 127.52 1p6s s ARG 25 Ca 0.63 -0.82 -0.30 0.00 0.00 0.00 0.00 55.73 55.24 1p6s s ARG 25 Cb -0.23 -1.38 -0.09 0.00 0.00 0.00 0.00 34.95 33.26 1p6s s ARG 25 CO 0.24 0.36 1.09 -0.47 0.00 0.00 0.00 175.30 176.52 1p6s s TYR 26 N -0.70 3.61 -0.01 -0.53 5.04 -0.44 -0.32 117.35 124.01 1p6s s TYR 26 Ca 0.06 1.67 0.05 0.00 -2.44 0.00 0.00 57.07 56.42 1p6s s TYR 26 Cb -0.08 -3.27 -0.01 0.00 0.35 0.00 0.00 41.96 38.95 1p6s s TYR 26 CO 0.01 -0.52 -0.17 -0.06 -1.34 0.00 0.00 175.55 173.47 1p6s s PHE 27 N -0.81 1.51 -0.14 4.97 0.40 0.13 0.88 117.98 124.93 1p6s s PHE 27 Ca 0.46 -0.29 0.02 0.00 -0.60 0.00 0.00 56.93 56.52 1p6s s PHE 27 Cb -0.31 -0.96 0.01 0.00 0.51 0.00 0.00 43.02 42.27 1p6s s PHE 27 CO 0.38 -0.02 -0.20 -0.51 0.70 0.00 0.00 175.22 175.58 1p6s s LEU 28 N -0.48 2.00 -0.18 -0.37 1.02 0.29 -1.25 118.68 119.71 1p6s s LEU 28 Ca 0.06 -0.56 -0.11 0.00 0.02 0.00 0.00 54.13 53.54 1p6s s LEU 28 Cb -0.07 -1.35 -0.05 0.00 0.02 0.00 0.00 46.19 44.74 1p6s s LEU 28 CO -0.00 0.05 0.18 -0.22 0.02 0.00 0.00 176.35 176.38 1p6s s LEU 29 N 0.91 4.23 0.48 1.79 0.20 0.19 -1.23 118.68 125.25 1p6s s LEU 29 Ca -0.06 0.32 0.09 0.00 0.69 0.00 0.00 54.13 55.17 1p6s s LEU 29 Cb -0.15 -2.17 0.04 0.00 -0.43 0.00 0.00 46.19 43.48 1p6s s LEU 29 CO -0.03 0.17 0.66 -0.54 -0.29 0.00 0.00 176.35 176.32 1p6s s LYS 30 N 0.29 2.63 0.00 1.98 -0.14 -0.13 0.31 119.74 124.67 1p6s s LYS 30 Ca 0.11 -1.40 0.29 0.00 -1.36 0.00 0.00 55.97 53.61 1p6s s LYS 30 Cb -0.12 -2.71 1.73 0.00 -1.68 0.00 0.00 37.83 35.05 1p6s s LYS 30 CO 0.00 -0.50 2.08 0.45 -0.76 0.00 0.00 175.35 176.62 1p6s n SER 31 N -2.00 0.00 -0.03 2.83 2.88 0.71 -3.17 113.62 114.84 1p6s n SER 31 Ca 0.11 -0.88 0.14 0.00 -1.33 0.00 0.00 58.87 56.91 1p6s n SER 31 Cb 0.60 -0.01 0.59 0.00 -0.75 0.00 0.00 64.21 64.64 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 -1.01 0.18 0.00 -3.46 2.03 -1.26 -4.83 116.55 108.20 1p6s n ASP 32 Ca 0.22 0.01 0.00 0.00 0.52 0.00 0.00 54.79 55.53 1p6s n ASP 32 Cb 0.11 -0.24 0.00 0.00 -0.72 0.00 0.00 41.12 40.26 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 1.41 1.31 3.14 0.27 0.00 -1.19 -4.62 105.19 105.51 1p6s n GLY 33 Ca 0.10 -0.34 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 1p6s n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1p6s s SER 34 N -2.37 -0.12 -0.03 1.61 0.01 -1.26 0.08 113.70 111.62 1p6s s SER 34 Ca 0.00 0.10 0.03 0.00 1.31 0.00 0.00 55.95 57.39 1p6s s SER 34 Cb 0.00 0.33 0.00 0.00 0.21 0.00 0.00 66.02 66.56 1p6s s SER 34 CO 0.00 -0.29 -0.09 0.72 0.41 0.00 0.00 173.24 173.99 1p6s s PHE 35 N -0.85 1.01 0.02 2.43 -0.71 0.42 -0.96 117.98 119.35 1p6s s PHE 35 Ca -0.09 -0.26 -0.00 0.00 -1.04 0.00 0.00 56.93 55.53 1p6s s PHE 35 Cb -0.05 -0.73 -0.04 0.00 -1.21 0.00 0.00 43.02 41.00 1p6s s PHE 35 CO 0.02 -0.12 0.14 0.42 -1.34 0.00 0.00 175.22 174.34 1p6s s ILE 36 N 0.24 5.04 -0.02 -4.49 -1.09 -0.37 -1.56 121.20 118.94 1p6s s ILE 36 Ca -0.04 -0.40 0.03 0.00 -2.23 0.00 0.00 60.65 58.01 1p6s s ILE 36 Cb -0.09 -3.38 -0.03 0.00 -1.58 0.00 0.00 42.46 37.38 1p6s s ILE 36 CO 0.01 0.26 -0.09 -0.83 -1.23 0.00 0.00 174.94 173.05 1p6s s GLY 37 N -2.08 1.68 0.17 6.18 0.00 0.16 -0.55 107.32 112.88 1p6s s GLY 37 Ca 0.28 -0.99 0.11 0.00 0.00 0.00 0.00 44.72 44.12 1p6s s GLY 37 CO 0.20 -0.82 -0.23 -0.19 0.00 0.00 0.00 173.10 172.06 1p6s s TYR 38 N -0.89 2.35 0.51 1.90 1.51 0.25 -0.07 117.35 122.92 1p6s s TYR 38 Ca 0.14 -0.34 0.19 0.00 -1.01 0.00 0.00 57.07 56.05 1p6s s TYR 38 Cb -0.11 -1.19 1.28 0.00 -0.11 0.00 0.00 41.96 41.83 1p6s s TYR 38 CO 0.04 0.46 2.08 1.57 -1.11 0.00 0.00 175.55 178.59 1p6s h LYS 39 N 3.36 0.05 0.00 -0.62 2.10 -1.87 -1.15 116.57 118.43 1p6s h LYS 39 Ca -0.48 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1p6s h LYS 39 Cb 1.20 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1p6s h LYS 39 CO 0.46 0.03 0.00 -1.91 -2.00 0.00 0.00 179.45 176.03 1p6s n GLU 40 N -4.47 0.00 -2.76 0.07 2.13 -1.26 -4.43 120.64 109.92 1p6s n GLU 40 Ca 0.03 0.00 -0.29 0.00 0.66 0.00 0.00 57.16 57.55 1p6s n GLU 40 Cb 0.29 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 31.98 1p6s n GLU 40 CO 0.00 0.00 0.00 2.89 -0.41 0.00 0.00 177.13 179.61 1p6s n ARG 41 N 0.00 3.54 -1.95 5.31 1.85 -1.26 -4.10 116.66 120.04 1p6s n ARG 41 Ca 0.00 -4.71 -0.32 0.00 -1.00 0.00 0.00 57.85 51.82 1p6s n ARG 41 Cb 0.00 -2.27 0.02 0.00 -1.05 0.00 0.00 32.46 29.16 1p6s n ARG 41 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1p6s s PRO 42 N -3.62 3.26 0.00 2.89 0.04 -1.26 -4.99 135.00 131.31 1p6s s PRO 42 Ca 0.48 1.14 0.00 0.00 0.04 0.00 0.00 61.00 62.65 1p6s s PRO 42 Cb 0.30 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.82 1p6s s PRO 42 CO -0.16 -0.85 0.00 -0.85 0.04 0.00 0.00 177.00 175.17 1p6s n GLU 43 N -2.26 0.00 -1.03 4.56 0.28 -1.26 -5.07 120.64 115.87 1p6s n GLU 43 Ca 0.08 0.00 0.13 0.00 -0.16 0.00 0.00 57.16 57.21 1p6s n GLU 43 Cb 0.53 -0.72 -0.05 0.00 1.43 0.00 0.00 31.44 32.63 1p6s n GLU 43 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1p6s n ALA 44 N -1.95 -2.68 -0.07 -1.84 0.00 -1.26 -4.45 120.51 108.27 1p6s n ALA 44 Ca 0.00 0.53 -0.12 0.00 0.00 0.00 0.00 53.44 53.84 1p6s n ALA 44 Cb 0.22 -1.04 -0.06 0.00 0.00 0.00 0.00 19.45 18.57 1p6s n ALA 44 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1p6s h PRO 45 N -0.99 0.39 0.00 0.00 0.13 -2.02 -3.43 132.00 126.08 1p6s h PRO 45 Ca -0.08 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1p6s h PRO 45 Cb 0.97 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.08 1p6s h PRO 45 CO 0.04 0.69 0.00 -0.25 -0.23 0.00 0.00 178.00 178.25 1p6s n ASP 46 N -4.59 0.00 -2.66 1.44 8.00 -1.26 -5.09 116.55 112.39 1p6s n ASP 46 Ca -0.05 0.00 -0.04 0.00 0.71 0.00 0.00 54.79 55.41 1p6s n ASP 46 Cb 0.31 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.47 1p6s n ASP 46 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 1p6s n GLN 47 N 0.00 0.06 -2.79 -1.24 -0.06 -1.26 -5.06 117.38 107.03 1p6s n GLN 47 Ca 0.00 -0.62 -0.24 0.00 -2.00 0.00 0.00 57.00 54.13 1p6s n GLN 47 Cb 0.00 0.08 -0.02 0.00 -4.06 0.00 0.00 30.24 26.24 1p6s n GLN 47 CO 0.00 0.00 0.00 -2.37 -0.20 0.00 0.00 177.06 174.49 1p6s n THR 48 N 1.98 2.28 -4.73 1.69 5.66 -1.26 -5.05 114.28 114.85 1p6s n THR 48 Ca 0.05 -5.02 -0.33 0.00 -3.05 0.00 0.00 64.05 55.70 1p6s n THR 48 Cb 0.69 -1.04 -0.14 0.00 -1.55 0.00 0.00 70.33 68.29 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 -3.35 2.82 -0.03 1.09 1.43 -1.26 -5.09 118.68 114.30 1p6s s LEU 49 Ca 0.46 -0.27 -0.30 0.00 -1.03 0.00 0.00 54.13 52.99 1p6s s LEU 49 Cb 0.35 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.89 1p6s s LEU 49 CO -0.13 0.20 1.19 -2.16 0.23 0.00 0.00 176.35 175.67 1p6s s PRO 50 N 0.17 4.38 0.34 1.29 0.04 -1.26 -5.01 135.00 134.95 1p6s s PRO 50 Ca -0.06 1.68 -0.27 0.00 0.04 0.00 0.00 61.00 62.39 1p6s s PRO 50 Cb -0.15 -3.51 -0.09 0.00 0.04 0.00 0.00 34.50 30.79 1p6s s PRO 50 CO 0.05 -0.39 1.11 -1.25 0.04 0.00 0.00 177.00 176.56 1p6s s PRO 51 N 1.90 4.39 -0.25 0.56 0.04 -1.26 -4.82 135.00 135.56 1p6s s PRO 51 Ca 0.56 1.75 0.04 0.00 0.04 0.00 0.00 61.00 63.40 1p6s s PRO 51 Cb -0.26 -2.91 -0.19 0.00 0.04 0.00 0.00 34.50 31.19 1p6s s PRO 51 CO 0.24 -0.00 -0.16 1.28 0.04 0.00 0.00 177.00 178.39 1p6s n LEU 52 N 0.62 2.50 -4.31 -3.56 7.99 0.65 -4.97 117.00 115.92 1p6s n LEU 52 Ca 0.02 -0.11 -0.30 0.00 -0.01 0.00 0.00 56.01 55.61 1p6s n LEU 52 Cb 0.46 -0.69 -0.15 0.00 -0.11 0.00 0.00 43.42 42.92 1p6s n LEU 52 CO 0.51 0.87 -0.56 0.20 -1.51 0.00 0.00 177.39 176.90 1p6s s ASN 53 N -6.37 2.96 -0.14 -1.43 0.02 0.90 -4.93 114.94 105.96 1p6s s ASN 53 Ca -0.31 -0.50 0.01 0.00 -1.02 0.00 0.00 52.86 51.05 1p6s s ASN 53 Cb 0.08 -0.30 0.02 0.00 0.02 0.00 0.00 41.25 41.07 1p6s s ASN 53 CO 0.64 0.28 -0.17 0.21 0.02 0.00 0.00 177.10 178.08 1p6s s ASN 54 N -0.84 2.75 -0.06 -1.22 2.47 -1.26 0.37 114.94 117.15 1p6s s ASN 54 Ca 0.10 -0.51 0.02 0.00 0.42 0.00 0.00 52.86 52.89 1p6s s ASN 54 Cb -0.10 -1.24 0.02 0.00 -1.45 0.00 0.00 41.25 38.47 1p6s s ASN 54 CO 0.00 0.01 -0.10 0.12 -3.72 0.00 0.00 177.10 173.41 1p6s s PHE 55 N 1.14 1.25 -0.09 0.43 2.19 -0.60 -4.79 117.98 117.50 1p6s s PHE 55 Ca -0.02 -0.44 0.01 0.00 0.33 0.00 0.00 56.93 56.81 1p6s s PHE 55 Cb -0.14 -0.95 0.02 0.00 -1.31 0.00 0.00 43.02 40.63 1p6s s PHE 55 CO -0.06 -0.26 -0.11 -1.12 1.83 0.00 0.00 175.22 175.51 1p6s s SER 56 N 0.77 1.97 -0.11 6.13 0.01 -1.26 -0.43 113.70 120.78 1p6s s SER 56 Ca -0.13 -0.31 0.15 0.00 1.31 0.00 0.00 55.95 56.97 1p6s s SER 56 Cb -0.15 -0.85 0.24 0.00 0.21 0.00 0.00 66.02 65.46 1p6s s SER 56 CO 0.02 -0.03 1.12 0.55 0.41 0.00 0.00 173.24 175.32 1p6s n VAL 57 N 4.28 1.71 0.17 3.43 3.14 0.11 -4.40 118.33 126.78 1p6s n VAL 57 Ca -0.19 -2.02 -0.10 0.00 -2.96 0.00 0.00 64.34 59.08 1p6s n VAL 57 Cb 0.51 -0.10 -0.05 0.00 -1.06 0.00 0.00 33.84 33.14 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 0.00 -0.49 0.00 1.55 0.00 -1.73 -3.38 119.26 115.21 1p6s h ALA 58 Ca 0.00 -0.16 -0.31 0.00 0.00 0.00 0.00 54.91 54.45 1p6s h ALA 58 Cb 0.92 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.84 1p6s h ALA 58 CO 0.00 -0.49 -2.03 0.39 0.00 0.00 0.00 179.25 177.12 1p6s n GLU 59 N -5.11 0.66 -2.95 0.00 1.02 -1.26 -4.92 120.64 108.07 1p6s n GLU 59 Ca -0.08 0.12 -0.35 0.00 -0.02 0.00 0.00 57.16 56.84 1p6s n GLU 59 Cb 0.24 -1.65 -0.06 0.00 -0.02 0.00 0.00 31.44 29.95 1p6s n GLU 59 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1p6s s GLN 61 N -2.56 3.86 -0.11 0.00 -2.07 -1.26 -4.55 119.66 112.98 1p6s s GLN 61 Ca 0.53 0.24 -0.03 0.00 -1.82 0.00 0.00 55.36 54.28 1p6s s GLN 61 Cb -0.14 -3.25 -0.03 0.00 -1.09 0.00 0.00 33.01 28.50 1p6s s GLN 61 CO 0.19 0.63 0.01 -1.17 -1.32 0.00 0.00 175.29 173.63 1p6s s LEU 62 N -0.80 3.61 -0.05 2.60 0.20 -1.26 -2.80 118.68 120.18 1p6s s LEU 62 Ca 0.21 0.12 0.05 0.00 0.69 0.00 0.00 54.13 55.19 1p6s s LEU 62 Cb -0.15 -1.85 -0.01 0.00 -0.43 0.00 0.00 46.19 43.76 1p6s s LEU 62 CO 0.10 0.32 -0.21 -0.32 -0.29 0.00 0.00 176.35 175.95 1p6s s MET 63 N -0.54 2.22 0.32 1.98 -2.45 0.11 -4.95 119.30 115.99 1p6s s MET 63 Ca 0.09 -0.76 -0.20 0.00 -1.25 0.00 0.00 55.69 53.56 1p6s s MET 63 Cb -0.12 -1.88 -0.10 0.00 1.25 0.00 0.00 34.83 33.98 1p6s s MET 63 CO 0.02 0.30 0.84 -1.59 1.05 0.00 0.00 175.02 175.65 1p6s s LYS 64 N -0.03 4.27 0.31 4.11 -2.85 -1.26 -0.41 119.74 123.87 1p6s s LYS 64 Ca -0.05 1.00 -0.11 0.00 -1.00 0.00 0.00 55.97 55.82 1p6s s LYS 64 Cb -0.13 -2.57 0.01 0.00 -2.06 0.00 0.00 37.83 33.08 1p6s s LYS 64 CO 0.03 0.20 0.56 -0.08 0.10 0.00 0.00 175.35 176.16 1p6s s THR 65 N -1.82 0.00 -0.16 3.79 -1.32 0.07 -4.90 115.64 111.30 1p6s s THR 65 Ca 0.52 -1.35 0.09 0.00 -1.21 0.00 0.00 61.69 59.74 1p6s s THR 65 Cb -0.14 -2.45 0.17 0.00 -1.51 0.00 0.00 72.50 68.57 1p6s s THR 65 CO 0.19 0.00 1.11 1.21 -2.21 0.00 0.00 174.62 174.92 1p6s n GLU 66 N -0.47 2.42 -4.52 7.08 4.07 -1.26 -1.09 120.64 126.87 1p6s n GLU 66 Ca -0.02 -2.01 -0.21 0.00 -0.06 0.00 0.00 57.16 54.85 1p6s n GLU 66 Cb 0.61 -1.26 -0.15 0.00 -0.06 0.00 0.00 31.44 30.59 1p6s n GLU 66 CO 0.00 0.00 0.00 0.50 -0.06 0.00 0.00 177.13 177.57 1p6s s ARG 67 N -1.75 1.01 0.28 5.31 6.06 -1.26 -3.31 118.95 125.28 1p6s s ARG 67 Ca 0.16 -0.52 0.09 0.00 -2.50 0.00 0.00 55.73 52.97 1p6s s ARG 67 Cb 0.13 -0.98 0.39 0.00 0.06 0.00 0.00 34.95 34.55 1p6s s ARG 67 CO 0.03 0.26 1.64 -1.00 -2.50 0.00 0.00 175.30 173.73 1p6s h PRO 68 N 5.63 0.07 -6.19 5.12 0.13 -2.01 -3.48 132.00 131.27 1p6s h PRO 68 Ca -0.34 -0.04 -0.52 0.00 -0.87 0.00 0.00 66.00 64.23 1p6s h PRO 68 Cb 1.17 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 32.24 1p6s h PRO 68 CO 0.48 0.62 -0.55 1.03 -0.23 0.00 0.00 178.00 179.34 1p6s s ARG 69 N -3.76 2.74 0.68 0.86 0.52 -1.23 -5.10 118.95 113.65 1p6s s ARG 69 Ca -0.02 -1.17 -0.14 0.00 -0.52 0.00 0.00 55.73 53.87 1p6s s ARG 69 Cb 0.13 -2.45 0.01 0.00 0.52 0.00 0.00 34.95 33.16 1p6s s ARG 69 CO 0.77 0.36 1.12 -1.25 0.02 0.00 0.00 175.30 176.32 1p6s s PRO 70 N -3.81 2.65 -1.05 3.54 0.04 -1.21 -4.00 135.00 131.15 1p6s s PRO 70 Ca 0.33 1.40 -0.11 0.00 0.04 0.00 0.00 61.00 62.66 1p6s s PRO 70 Cb -0.07 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 1p6s s PRO 70 CO 0.24 -1.37 0.85 0.09 0.04 0.00 0.00 177.00 176.85 1p6s n ASN 71 N -2.59 -6.22 -4.42 6.66 3.02 -1.23 -4.88 115.26 105.60 1p6s n ASN 71 Ca 0.11 -0.78 -0.24 0.00 -0.03 0.00 0.00 54.58 53.63 1p6s n ASN 71 Cb 0.52 -4.46 -0.11 0.00 -0.61 0.00 0.00 39.78 35.12 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 -3.38 2.28 -0.07 3.41 2.01 -0.25 -3.69 115.64 115.95 1p6s s THR 72 Ca 0.42 -2.18 0.05 0.00 0.31 0.00 0.00 61.69 60.29 1p6s s THR 72 Cb -0.10 -2.15 -0.00 0.00 0.01 0.00 0.00 72.50 70.26 1p6s s THR 72 CO 0.79 -0.30 -0.22 -0.36 -0.69 0.00 0.00 174.62 173.84 1p6s s PHE 73 N -2.16 2.27 -0.07 4.92 0.08 0.17 -0.75 117.98 122.45 1p6s s PHE 73 Ca 0.24 -0.78 0.01 0.00 0.12 0.00 0.00 56.93 56.52 1p6s s PHE 73 Cb -0.06 -1.52 0.02 0.00 -0.57 0.00 0.00 43.02 40.89 1p6s s PHE 73 CO 0.11 -0.28 -0.08 0.08 -0.10 0.00 0.00 175.22 174.94 1p6s s VAL 74 N 0.11 0.92 -0.12 -0.44 1.01 0.45 -0.33 120.40 122.00 1p6s s VAL 74 Ca -0.10 -0.31 -0.02 0.00 0.00 0.00 0.00 61.98 61.55 1p6s s VAL 74 Cb -0.15 -0.90 -0.03 0.00 0.00 0.00 0.00 36.38 35.30 1p6s s VAL 74 CO 0.05 0.32 -0.04 -0.51 0.00 0.00 0.00 175.10 174.93 1p6s s ILE 75 N 1.08 3.94 -0.03 2.22 2.07 -0.30 0.09 121.20 130.26 1p6s s ILE 75 Ca -0.07 -0.36 0.03 0.00 -1.41 0.00 0.00 60.65 58.83 1p6s s ILE 75 Cb -0.14 -2.69 0.00 0.00 0.13 0.00 0.00 42.46 39.76 1p6s s ILE 75 CO -0.01 0.54 -0.10 -0.13 -1.91 0.00 0.00 174.94 173.32 1p6s s ARG 76 N -0.11 1.17 0.07 3.50 0.52 -1.12 -4.74 118.95 118.24 1p6s s ARG 76 Ca 0.02 -0.35 0.02 0.00 -0.52 0.00 0.00 55.73 54.91 1p6s s ARG 76 Cb -0.13 -1.06 -0.03 0.00 0.52 0.00 0.00 34.95 34.25 1p6s s ARG 76 CO 0.02 0.11 -0.08 0.00 0.02 0.00 0.00 175.30 175.38 1p6s n LEU 78 N 0.80 5.35 0.03 0.00 4.32 -1.26 -4.68 117.00 121.56 1p6s n LEU 78 Ca -0.18 -5.57 0.00 0.00 -0.02 0.00 0.00 56.01 50.24 1p6s n LEU 78 Cb 0.57 -0.77 0.00 0.00 -1.62 0.00 0.00 43.42 41.60 1p6s n LEU 78 CO 0.25 2.22 0.00 0.00 -1.22 0.00 0.00 177.39 178.64 1p6s n GLN 79 N -0.05 0.00 -3.36 3.23 6.02 -1.26 -5.06 117.38 116.90 1p6s n GLN 79 Ca 0.35 0.00 -0.44 0.00 -0.01 0.00 0.00 57.00 56.91 1p6s n GLN 79 Cb 0.35 0.00 -0.08 0.00 1.02 0.00 0.00 30.24 31.53 1p6s n GLN 79 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1p6s s TRP 80 N -2.00 3.20 -1.24 1.08 0.51 -1.26 -4.98 118.94 114.25 1p6s s TRP 80 Ca 0.00 -0.71 -0.08 0.00 -2.12 0.00 0.00 56.10 53.19 1p6s s TRP 80 Cb 0.00 -3.05 0.20 0.00 -0.81 0.00 0.00 33.47 29.80 1p6s s TRP 80 CO 0.00 -0.77 1.83 0.25 -0.51 0.00 0.00 176.95 177.75 1p6s n THR 81 N 5.29 4.64 -4.45 2.01 -2.24 -1.26 -4.95 114.28 113.33 1p6s n THR 81 Ca -0.10 -4.74 -0.22 0.00 -2.27 0.00 0.00 64.05 56.71 1p6s n THR 81 Cb 0.45 -2.27 -0.09 0.00 -2.10 0.00 0.00 70.33 66.32 1p6s n THR 81 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1p6s s THR 82 N -0.46 0.74 -0.41 4.28 2.01 -1.26 -5.04 115.64 115.51 1p6s s THR 82 Ca 0.39 -2.00 -0.01 0.00 0.31 0.00 0.00 61.69 60.37 1p6s s THR 82 Cb 0.09 -2.55 0.28 0.00 0.01 0.00 0.00 72.50 70.33 1p6s s THR 82 CO 0.02 0.00 2.02 0.55 -0.69 0.00 0.00 174.62 176.52 1p6s n VAL 83 N -0.74 3.00 -2.51 3.82 3.14 -1.26 -4.80 118.33 118.97 1p6s n VAL 83 Ca -0.03 -1.98 -0.43 0.00 -2.96 0.00 0.00 64.34 58.94 1p6s n VAL 83 Cb 0.66 -1.29 0.00 0.00 -1.06 0.00 0.00 33.84 32.15 1p6s n VAL 83 CO 0.00 0.00 0.00 -0.38 -6.46 0.00 0.00 176.83 169.99 1p6s n ILE 84 N 0.02 4.10 -1.22 1.55 2.08 -1.26 -4.94 119.36 119.69 1p6s n ILE 84 Ca 0.38 -4.25 0.16 0.00 0.56 0.00 0.00 62.75 59.60 1p6s n ILE 84 Cb 0.60 -2.43 -0.04 0.00 -0.75 0.00 0.00 39.64 37.01 1p6s n ILE 84 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1p6s n GLU 85 N 5.73 -2.47 0.01 0.38 1.02 -1.26 -4.98 120.64 119.08 1p6s n GLU 85 Ca 0.42 1.67 0.00 0.00 -0.02 0.00 0.00 57.16 59.24 1p6s n GLU 85 Cb 0.41 -3.01 0.00 0.00 -0.02 0.00 0.00 31.44 28.82 1p6s n GLU 85 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1p6s n ARG 86 N -3.68 0.00 -5.16 3.49 3.00 -1.26 -5.08 116.66 107.97 1p6s n ARG 86 Ca -0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 57.85 57.53 1p6s n ARG 86 Cb 0.64 0.00 -0.15 0.00 0.00 0.00 0.00 32.46 32.95 1p6s n ARG 86 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1p6s s THR 87 N -2.00 2.40 0.00 5.15 -4.23 -1.26 -1.15 115.64 114.55 1p6s s THR 87 Ca 0.00 -0.97 0.00 0.00 -1.18 0.00 0.00 61.69 59.54 1p6s s THR 87 Cb 0.00 -1.87 -0.00 0.00 1.34 0.00 0.00 72.50 71.96 1p6s s THR 87 CO 0.00 0.58 -0.00 0.72 -0.54 0.00 0.00 174.62 175.38 1p6s s PHE 88 N -0.64 0.01 0.19 3.99 -0.12 0.55 -4.72 117.98 117.23 1p6s s PHE 88 Ca 0.10 -0.01 0.05 0.00 -0.05 0.00 0.00 56.93 57.02 1p6s s PHE 88 Cb -0.10 -0.01 -0.04 0.00 -0.63 0.00 0.00 43.02 42.24 1p6s s PHE 88 CO -0.00 -0.00 0.18 -1.01 -0.05 0.00 0.00 175.22 174.33 1p6s s HIS 89 N -0.03 3.19 0.21 3.49 3.76 -0.23 -0.65 115.29 125.02 1p6s s HIS 89 Ca -0.00 -0.03 0.05 0.00 -0.15 0.00 0.00 55.06 54.93 1p6s s HIS 89 Cb -0.00 -1.50 -0.03 0.00 1.11 0.00 0.00 32.58 32.15 1p6s s HIS 89 CO -0.00 0.51 0.25 0.14 -0.85 0.00 0.00 174.74 174.79 1p6s s VAL 90 N -1.88 4.88 0.22 -0.90 -7.23 -1.24 0.73 120.40 114.98 1p6s s VAL 90 Ca 0.32 -1.07 0.12 0.00 -1.81 0.00 0.00 61.98 59.55 1p6s s VAL 90 Cb -0.09 -3.59 -0.01 0.00 0.56 0.00 0.00 36.38 33.25 1p6s s VAL 90 CO 0.25 -0.24 1.60 -2.24 -0.31 0.00 0.00 175.10 174.16 1p6s h ASP 91 N 1.72 0.00 -4.78 4.85 2.03 -1.88 -3.42 116.42 114.94 1p6s h ASP 91 Ca -0.49 0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 55.58 1p6s h ASP 91 Cb 1.22 0.00 -0.18 0.00 -0.83 0.00 0.00 39.33 39.54 1p6s h ASP 91 CO 0.63 0.60 -0.71 -0.44 -1.03 0.00 0.00 179.24 178.29 1p6s s SER 92 N -6.73 0.87 0.22 4.15 0.01 -1.26 -5.04 113.70 105.92 1p6s s SER 92 Ca -0.01 -0.79 -0.04 0.00 1.31 0.00 0.00 55.95 56.42 1p6s s SER 92 Cb 0.12 0.09 0.20 0.00 0.21 0.00 0.00 66.02 66.63 1p6s s SER 92 CO 0.75 -0.37 1.63 1.55 0.41 0.00 0.00 173.24 177.21 1p6s h PRO 93 N 3.70 0.76 -0.52 12.44 0.13 -1.93 -2.37 132.00 144.21 1p6s h PRO 93 Ca -0.35 -0.31 -0.08 0.00 -0.87 0.00 0.00 66.00 64.40 1p6s h PRO 93 Cb 1.18 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.25 1p6s h PRO 93 CO 0.54 0.91 0.01 -0.44 -0.23 0.00 0.00 178.00 178.79 1p6s h ASP 94 N 0.66 0.83 -0.50 1.44 5.19 -2.00 -2.77 116.42 119.26 1p6s h ASP 94 Ca 0.09 -0.21 -0.02 0.00 -0.62 0.00 0.00 57.03 56.27 1p6s h ASP 94 Cb 0.73 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 40.00 1p6s h ASP 94 CO 0.06 0.89 0.24 -0.33 -3.12 0.00 0.00 179.24 176.97 1p6s h GLU 95 N 0.80 0.73 -0.65 3.56 3.07 -1.88 -2.19 114.58 118.03 1p6s h GLU 95 Ca 0.15 -0.11 0.08 0.00 -0.50 0.00 0.00 59.36 58.98 1p6s h GLU 95 Cb 0.47 -0.13 -0.06 0.00 -0.84 0.00 0.00 28.75 28.19 1p6s h GLU 95 CO 0.02 0.61 0.32 -0.09 -1.40 0.00 0.00 179.01 178.47 1p6s h ARG 96 N 0.67 0.55 -0.72 2.33 2.43 -1.16 0.94 114.38 119.43 1p6s h ARG 96 Ca 0.17 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.26 1p6s h ARG 96 Cb 0.13 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.52 1p6s h ARG 96 CO -0.02 0.37 0.25 1.49 -1.51 0.00 0.00 179.97 180.55 1p6s h GLU 97 N 0.57 1.08 -0.52 0.20 4.81 -1.29 -2.42 114.58 117.01 1p6s h GLU 97 Ca 0.31 -0.21 -0.10 0.00 -0.13 0.00 0.00 59.36 59.22 1p6s h GLU 97 Cb 0.28 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 1p6s h GLU 97 CO -0.23 0.90 -0.09 0.93 -0.73 0.00 0.00 179.01 179.79 1p6s h GLU 98 N 1.05 0.96 -0.35 1.92 4.39 -0.60 -2.57 114.58 119.38 1p6s h GLU 98 Ca 0.24 -0.33 0.02 0.00 0.34 0.00 0.00 59.36 59.62 1p6s h GLU 98 Cb 0.25 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.81 1p6s h GLU 98 CO -0.01 1.00 0.19 -1.49 -1.16 0.00 0.00 179.01 177.54 1p6s h TRP 99 N 0.86 0.36 -0.40 4.33 -0.00 -0.47 -0.65 115.95 119.99 1p6s h TRP 99 Ca 0.14 0.01 0.02 0.00 -0.00 0.00 0.00 58.89 59.06 1p6s h TRP 99 Cb 0.63 -0.11 -0.03 0.00 -0.00 0.00 0.00 29.16 29.65 1p6s h TRP 99 CO 0.04 0.21 0.23 1.98 -0.00 0.00 0.00 178.44 180.89 1p6s h MET 100 N 0.40 0.45 -0.68 0.49 4.05 -1.30 -1.20 114.93 117.14 1p6s h MET 100 Ca 0.14 -0.03 0.02 0.00 -0.28 0.00 0.00 59.70 59.56 1p6s h MET 100 Cb 0.02 -0.10 -0.04 0.00 -0.80 0.00 0.00 31.60 30.68 1p6s h MET 100 CO -0.08 0.30 0.43 0.00 0.23 0.00 0.00 176.91 177.79 1p6s h ARG 101 N 0.46 0.84 -0.81 0.39 -0.00 -1.05 -1.98 114.38 112.23 1p6s h ARG 101 Ca 0.16 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.98 59.57 1p6s h ARG 101 Cb 0.02 -0.19 -0.04 0.00 0.00 0.00 0.00 29.97 29.76 1p6s h ARG 101 CO -0.08 0.56 0.43 0.00 0.00 0.00 0.00 179.97 180.88 1p6s h ALA 102 N 1.27 1.03 -0.86 0.04 0.00 -0.59 -1.50 119.26 118.66 1p6s h ALA 102 Ca 0.26 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1p6s h ALA 102 Cb -0.03 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.39 1p6s h ALA 102 CO -0.08 0.56 0.43 0.82 0.00 0.00 0.00 179.25 180.97 1p6s h ILE 103 N 1.12 1.26 -0.57 0.00 2.04 -0.68 -1.90 117.51 118.79 1p6s h ILE 103 Ca 0.28 -0.72 -0.10 0.00 1.00 0.00 0.00 64.86 65.32 1p6s h ILE 103 Cb 0.05 0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.25 1p6s h ILE 103 CO -0.04 0.31 -0.04 1.56 0.00 0.00 0.00 178.15 179.94 1p6s h GLN 104 N 1.23 1.03 -0.73 2.37 1.08 -0.89 0.17 115.11 119.37 1p6s h GLN 104 Ca 0.30 -0.35 -0.02 0.00 -1.45 0.00 0.00 58.65 57.13 1p6s h GLN 104 Cb 0.10 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.42 1p6s h GLN 104 CO -0.04 1.04 0.40 0.52 -0.95 0.00 0.00 178.83 179.79 1p6s h MET 105 N 0.91 1.03 -0.10 1.46 2.86 -0.89 -1.96 114.93 118.24 1p6s h MET 105 Ca 0.15 -0.12 -0.18 0.00 -2.06 0.00 0.00 59.70 57.49 1p6s h MET 105 Cb 0.60 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 32.06 1p6s h MET 105 CO 0.04 0.77 -0.71 0.28 1.06 0.00 0.00 176.91 178.35 1p6s h VAL 106 N 1.01 1.36 -0.50 -2.22 2.07 -1.17 -3.09 116.25 113.71 1p6s h VAL 106 Ca 0.26 -2.08 0.05 0.00 0.82 0.00 0.00 66.70 65.75 1p6s h VAL 106 Cb 0.05 2.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.84 1p6s h VAL 106 CO -0.04 0.63 0.34 0.00 0.02 0.00 0.00 177.57 178.52 1p6s h ALA 107 N 0.90 1.83 -0.56 1.67 0.00 -0.12 0.60 119.26 123.59 1p6s h ALA 107 Ca -0.03 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.91 1p6s h ALA 107 Cb 1.29 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.89 1p6s h ALA 107 CO 0.13 0.10 0.29 -0.91 0.00 0.00 0.00 179.25 178.85 1p6s h ASN 108 N 0.51 0.42 0.79 0.00 2.35 -1.28 -0.81 115.58 117.56 1p6s h ASN 108 Ca 0.21 0.03 -0.15 0.00 -0.55 0.00 0.00 56.30 55.84 1p6s h ASN 108 Cb 0.20 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.49 1p6s h ASN 108 CO -0.06 0.28 -1.30 0.28 -1.65 0.00 0.00 177.43 174.98 1p6s h SER 109 N 0.55 0.00 -0.32 5.81 0.02 -1.52 -3.35 113.55 114.74 1p6s h SER 109 Ca 0.25 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.18 1p6s h SER 109 Cb 0.15 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 1p6s h SER 109 CO -0.17 0.53 0.12 0.25 -1.14 0.00 0.00 176.83 176.42 1p6s h LEU 110 N 0.00 0.45 0.00 5.07 6.46 0.60 -3.52 115.31 124.36 1p6s h LEU 110 Ca -0.14 -0.17 0.00 0.00 -0.12 0.00 0.00 57.88 57.45 1p6s h LEU 110 Cb 1.52 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 41.34 1p6s h LEU 110 CO 0.04 0.50 0.00 0.29 -0.62 0.00 0.00 178.44 178.65