#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ocs s GLU 31 N 0.00 4.28 0.42 0.00 8.01 -1.26 -4.91 118.70 125.24 1ocs s GLU 31 Ca 0.00 2.23 0.30 0.00 0.01 0.00 0.00 54.97 57.50 1ocs s GLU 31 Cb 0.00 -3.18 1.40 0.00 -4.31 0.00 0.00 34.13 28.04 1ocs s GLU 31 CO 0.00 -0.48 1.89 -1.00 0.01 0.00 0.00 175.26 175.68 1ocs h PRO 32 N 6.25 0.00 -6.83 0.39 0.13 -2.07 -3.43 132.00 126.44 1ocs h PRO 32 Ca -0.43 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.02 1ocs h PRO 32 Cb 1.21 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.11 1ocs h PRO 32 CO 0.85 0.00 -0.87 -1.21 -0.23 0.00 0.00 178.00 176.55 1ocs s GLU 33 N -3.62 1.43 0.62 0.86 2.02 -1.26 -5.12 118.70 113.63 1ocs s GLU 33 Ca 0.00 -1.30 -0.18 0.00 0.02 0.00 0.00 54.97 53.51 1ocs s GLU 33 Cb 0.09 -1.87 -0.02 0.00 0.10 0.00 0.00 34.13 32.43 1ocs s GLU 33 CO 0.38 0.45 1.19 -0.80 0.02 0.00 0.00 175.26 176.50 1ocs s ASN 34 N -1.94 5.05 0.03 -0.19 0.02 -1.26 -4.99 114.94 111.66 1ocs s ASN 34 Ca 0.13 2.32 -0.27 0.00 -1.02 0.00 0.00 52.86 54.03 1ocs s ASN 34 Cb -0.10 -2.59 0.07 0.00 0.02 0.00 0.00 41.25 38.65 1ocs s ASN 34 CO 0.05 -1.68 0.62 0.72 0.02 0.00 0.00 177.10 176.82 1ocs s PHE 35 N -1.76 -0.57 -0.17 2.20 -0.12 -1.26 -5.04 117.98 111.26 1ocs s PHE 35 Ca 0.75 0.75 -0.06 0.00 -0.05 0.00 0.00 56.93 58.32 1ocs s PHE 35 Cb -0.29 0.43 0.08 0.00 -0.63 0.00 0.00 43.02 42.61 1ocs s PHE 35 CO 0.36 -0.68 0.36 -1.17 -0.05 0.00 0.00 175.22 174.03 1ocs s LEU 36 N -1.80 -0.41 -0.08 -1.99 0.20 -1.26 -2.88 118.68 110.46 1ocs s LEU 36 Ca -0.06 0.83 0.01 0.00 0.69 0.00 0.00 54.13 55.60 1ocs s LEU 36 Cb -0.01 1.11 -0.03 0.00 -0.43 0.00 0.00 46.19 46.84 1ocs s LEU 36 CO 0.01 -0.23 -0.11 -1.61 -0.29 0.00 0.00 176.35 174.13 1ocs s GLU 37 N 2.34 2.84 -0.11 1.98 2.02 0.19 -4.98 118.70 122.97 1ocs s GLU 37 Ca -0.02 -0.63 -0.19 0.00 0.02 0.00 0.00 54.97 54.15 1ocs s GLU 37 Cb -0.11 -2.54 0.05 0.00 0.10 0.00 0.00 34.13 31.62 1ocs s GLU 37 CO -0.11 0.53 0.48 -1.50 0.02 0.00 0.00 175.26 174.68 1ocs s ILE 38 N -0.47 0.02 -0.05 -1.63 2.07 -1.26 -1.48 121.20 118.39 1ocs s ILE 38 Ca 0.06 -0.13 -0.12 0.00 -1.41 0.00 0.00 60.65 59.05 1ocs s ILE 38 Cb -0.12 -0.73 0.02 0.00 0.13 0.00 0.00 42.46 41.76 1ocs s ILE 38 CO 0.02 -0.07 0.28 -0.70 -1.91 0.00 0.00 174.94 172.56 1ocs s GLU 39 N -0.45 0.52 -0.18 3.50 2.12 -0.66 -4.76 118.70 118.79 1ocs s GLU 39 Ca -0.06 0.03 -0.01 0.00 0.36 0.00 0.00 54.97 55.29 1ocs s GLU 39 Cb -0.03 0.23 -0.00 0.00 0.26 0.00 0.00 34.13 34.59 1ocs s GLU 39 CO 0.03 -0.12 -0.12 0.08 -0.54 0.00 0.00 175.26 174.60 1ocs s VAL 40 N -0.74 2.84 0.00 3.70 1.01 -1.26 -1.49 120.40 124.46 1ocs s VAL 40 Ca -0.08 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.21 1ocs s VAL 40 Cb -0.04 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.10 1ocs s VAL 40 CO 0.02 0.49 0.00 0.00 0.00 0.00 0.00 175.10 175.61 1ocs n HIS 41 N 4.38 -0.18 -3.85 5.22 -0.00 -0.45 -4.55 115.22 115.78 1ocs n HIS 41 Ca -0.19 0.00 -0.27 0.00 -0.00 0.00 0.00 57.72 57.26 1ocs n HIS 41 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.50 1ocs n HIS 41 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.34 174.63 1ocs n ASN 42 N -0.18 -1.79 -4.77 4.39 4.05 -1.26 -1.07 115.26 114.63 1ocs n ASN 42 Ca 0.00 -0.99 -0.38 0.00 0.45 0.00 0.00 54.58 53.66 1ocs n ASN 42 Cb 0.00 -3.24 0.00 0.00 1.23 0.00 0.00 39.78 37.77 1ocs n ASN 42 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1ocs s PRO 43 N -6.34 3.74 -0.05 1.20 0.04 -1.26 -3.93 135.00 128.40 1ocs s PRO 43 Ca 0.13 2.02 -0.02 0.00 0.04 0.00 0.00 61.00 63.17 1ocs s PRO 43 Cb -0.05 -2.54 0.04 0.00 0.04 0.00 0.00 34.50 31.99 1ocs s PRO 43 CO 0.87 -0.63 0.10 0.15 0.04 0.00 0.00 177.00 177.53 1ocs s LYS 44 N -2.53 0.02 -0.29 4.56 1.02 -0.45 -5.00 119.74 117.07 1ocs s LYS 44 Ca 0.62 0.32 -0.11 0.00 0.02 0.00 0.00 55.97 56.82 1ocs s LYS 44 Cb -0.35 -0.24 -0.04 0.00 -0.52 0.00 0.00 37.83 36.68 1ocs s LYS 44 CO 0.43 -0.19 0.19 0.99 -0.92 0.00 0.00 175.35 175.84 1ocs s THR 45 N 1.32 5.17 -0.54 2.17 2.01 -1.26 -1.51 115.64 123.00 1ocs s THR 45 Ca -0.07 0.02 -0.25 0.00 0.31 0.00 0.00 61.69 61.70 1ocs s THR 45 Cb -0.12 -3.51 0.04 0.00 0.01 0.00 0.00 72.50 68.92 1ocs s THR 45 CO -0.05 0.19 0.98 -1.00 -0.69 0.00 0.00 174.62 174.06 1ocs s HIS 46 N 1.73 2.78 -0.06 4.92 0.09 0.18 -4.94 115.29 119.98 1ocs s HIS 46 Ca 0.07 0.11 -0.29 0.00 -0.00 0.00 0.00 55.06 54.95 1ocs s HIS 46 Cb -0.16 -4.14 -0.02 0.00 -0.00 0.00 0.00 32.58 28.26 1ocs s HIS 46 CO 0.10 -1.36 0.98 0.42 -0.00 0.00 0.00 174.74 174.88 1ocs s ILE 47 N 4.10 4.83 0.30 0.60 1.01 -1.26 -3.31 121.20 127.47 1ocs s ILE 47 Ca 0.33 2.01 -0.29 0.00 0.00 0.00 0.00 60.65 62.71 1ocs s ILE 47 Cb -0.11 -4.30 -0.10 0.00 0.01 0.00 0.00 42.46 37.96 1ocs s ILE 47 CO 0.21 0.08 1.19 -2.16 0.00 0.00 0.00 174.94 174.27 1ocs s PRO 48 N 1.56 4.51 -0.01 2.79 0.04 -1.26 -4.93 135.00 137.69 1ocs s PRO 48 Ca 0.49 1.99 0.13 0.00 0.04 0.00 0.00 61.00 63.65 1ocs s PRO 48 Cb -0.19 -3.14 -0.19 0.00 0.04 0.00 0.00 34.50 31.02 1ocs s PRO 48 CO 0.22 0.03 0.33 0.09 0.04 0.00 0.00 177.00 177.70 1ocs n ASN 49 N 1.04 1.79 -4.42 6.66 3.02 -1.26 -5.01 115.26 117.08 1ocs n ASN 49 Ca -0.01 -0.15 -0.22 0.00 -0.03 0.00 0.00 54.58 54.18 1ocs n ASN 49 Cb 0.43 1.47 -0.10 0.00 -0.61 0.00 0.00 39.78 40.98 1ocs n ASN 49 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1ocs s GLY 50 N -3.22 1.70 0.05 7.41 0.00 -1.26 -5.02 107.32 106.98 1ocs s GLY 50 Ca -0.03 -1.79 0.20 0.00 0.00 0.00 0.00 44.72 43.09 1ocs s GLY 50 CO 0.53 -1.88 1.62 -0.13 0.00 0.00 0.00 173.10 173.24 1ocs n MET 51 N -0.52 0.05 0.00 2.90 1.56 -1.26 -2.87 117.12 116.97 1ocs n MET 51 Ca -0.06 0.22 0.03 0.00 -0.27 0.00 0.00 57.70 57.62 1ocs n MET 51 Cb 0.60 -1.58 0.01 0.00 2.15 0.00 0.00 33.22 34.40 1ocs n MET 51 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 1ocs n ASP 52 N -1.66 1.08 -4.64 6.12 8.00 -1.26 -5.04 116.55 119.14 1ocs n ASP 52 Ca 0.04 -1.04 -0.29 0.00 0.71 0.00 0.00 54.79 54.21 1ocs n ASP 52 Cb 0.23 0.35 0.18 0.00 -0.02 0.00 0.00 41.12 41.86 1ocs n ASP 52 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1ocs s SER 53 N -0.88 2.58 0.57 -2.24 1.04 -1.14 -4.95 113.70 108.68 1ocs s SER 53 Ca 0.06 1.52 -0.20 0.00 0.48 0.00 0.00 55.95 57.81 1ocs s SER 53 Cb 0.05 -2.19 -0.06 0.00 0.10 0.00 0.00 66.02 63.92 1ocs s SER 53 CO 0.13 -3.20 1.00 0.29 0.98 0.00 0.00 173.24 172.44 1ocs n LYS 54 N -4.26 1.03 -1.81 4.02 5.02 -1.26 -4.91 118.16 115.99 1ocs n LYS 54 Ca 0.06 0.39 -0.38 0.00 -2.02 0.00 0.00 58.31 56.36 1ocs n LYS 54 Cb 0.55 -2.18 0.04 0.00 -0.02 0.00 0.00 35.03 33.42 1ocs n LYS 54 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1ocs s GLY 55 N -1.14 2.88 0.28 0.72 0.00 -1.26 -4.65 107.32 104.14 1ocs s GLY 55 Ca 0.73 1.31 -0.30 0.00 0.00 0.00 0.00 44.72 46.47 1ocs s GLY 55 CO 0.49 1.83 1.24 -0.13 0.00 0.00 0.00 173.10 176.53 1ocs n MET 56 N -1.01 1.80 -3.61 2.90 1.56 -1.26 -4.95 117.12 112.55 1ocs n MET 56 Ca 0.10 0.63 -0.10 0.00 -0.27 0.00 0.00 57.70 58.07 1ocs n MET 56 Cb 0.45 -2.18 -0.02 0.00 2.15 0.00 0.00 33.22 33.63 1ocs n MET 56 CO 0.00 0.00 0.00 -0.59 -0.73 0.00 0.00 175.97 174.65 1ocs s PHE 57 N -0.66 -0.38 0.03 1.12 -0.12 -1.21 -4.99 117.98 111.77 1ocs s PHE 57 Ca 0.62 0.07 0.06 0.00 -0.05 0.00 0.00 56.93 57.63 1ocs s PHE 57 Cb -0.66 0.62 -0.02 0.00 -0.63 0.00 0.00 43.02 42.33 1ocs s PHE 57 CO 0.57 -0.99 -0.17 0.95 -0.05 0.00 0.00 175.22 175.53 1ocs s THR 58 N -3.77 1.33 0.23 -4.49 -4.23 -1.26 0.50 115.64 103.95 1ocs s THR 58 Ca 0.06 -0.97 0.01 0.00 -1.18 0.00 0.00 61.69 59.61 1ocs s THR 58 Cb -0.03 -1.16 -0.05 0.00 1.34 0.00 0.00 72.50 72.60 1ocs s THR 58 CO -0.04 0.17 0.07 1.51 -0.54 0.00 0.00 174.62 175.79 1ocs s ASP 59 N -0.93 1.11 0.08 3.99 3.84 -0.57 -4.36 116.67 119.84 1ocs s ASP 59 Ca 0.05 -1.32 0.08 0.00 -0.00 0.00 0.00 52.55 51.36 1ocs s ASP 59 Cb -0.08 0.17 -0.03 0.00 -1.38 0.00 0.00 42.92 41.60 1ocs s ASP 59 CO 0.01 -0.69 -0.20 -0.31 -0.00 0.00 0.00 175.17 173.98 1ocs s TYR 60 N -3.76 1.75 -0.02 2.11 1.51 0.99 -1.35 117.35 118.58 1ocs s TYR 60 Ca 0.34 -0.40 -0.19 0.00 -1.01 0.00 0.00 57.07 55.81 1ocs s TYR 60 Cb 0.07 -0.99 -0.05 0.00 -0.11 0.00 0.00 41.96 40.88 1ocs s TYR 60 CO 0.10 0.16 0.53 -2.00 -1.11 0.00 0.00 175.55 173.23 1ocs s GLU 61 N -1.64 4.23 -0.19 -0.62 2.12 -0.23 0.15 118.70 122.53 1ocs s GLU 61 Ca 0.06 0.61 -0.02 0.00 0.36 0.00 0.00 54.97 55.98 1ocs s GLU 61 Cb -0.10 -3.33 -0.01 0.00 0.26 0.00 0.00 34.13 30.96 1ocs s GLU 61 CO 0.03 0.42 -0.08 0.42 -0.54 0.00 0.00 175.26 175.51 1ocs s ILE 62 N -0.30 3.17 -0.13 -3.70 1.01 0.98 -1.35 121.20 120.88 1ocs s ILE 62 Ca 0.28 -0.58 0.02 0.00 0.00 0.00 0.00 60.65 60.37 1ocs s ILE 62 Cb -0.17 -2.40 -0.00 0.00 0.01 0.00 0.00 42.46 39.89 1ocs s ILE 62 CO 0.15 0.47 -0.18 -0.51 0.00 0.00 0.00 174.94 174.87 1ocs s ILE 63 N 1.08 2.46 0.00 2.92 2.07 -0.55 -1.84 121.20 127.34 1ocs s ILE 63 Ca 0.00 -0.86 0.02 0.00 -1.41 0.00 0.00 60.65 58.41 1ocs s ILE 63 Cb -0.15 -2.01 -0.01 0.00 0.13 0.00 0.00 42.46 40.43 1ocs s ILE 63 CO -0.01 0.54 -0.06 0.00 -1.91 0.00 0.00 174.94 173.49 1ocs s ARG 65 N -0.30 1.46 0.19 0.00 0.52 -0.55 -1.10 118.95 119.18 1ocs s ARG 65 Ca 0.01 -0.43 -0.23 0.00 -0.52 0.00 0.00 55.73 54.55 1ocs s ARG 65 Cb -0.03 -1.27 0.05 0.00 0.52 0.00 0.00 34.95 34.22 1ocs s ARG 65 CO -0.00 0.12 0.71 -0.08 0.02 0.00 0.00 175.30 176.07 1ocs s THR 66 N 0.31 0.00 -0.03 0.02 -1.32 -0.20 -0.64 115.64 113.79 1ocs s THR 66 Ca -0.07 -0.44 0.04 0.00 -1.21 0.00 0.00 61.69 60.00 1ocs s THR 66 Cb -0.12 -1.48 0.06 0.00 -1.51 0.00 0.00 72.50 69.46 1ocs s THR 66 CO 0.02 0.00 0.89 -0.46 -2.21 0.00 0.00 174.62 172.86 1ocs n ASN 67 N -0.41 1.16 -4.74 8.08 6.94 -1.14 -4.33 115.26 120.82 1ocs n ASN 67 Ca -0.10 -1.96 -0.42 0.00 -0.02 0.00 0.00 54.58 52.08 1ocs n ASN 67 Cb 0.62 -0.13 -0.02 0.00 -2.36 0.00 0.00 39.78 37.89 1ocs n ASN 67 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1ocs s LEU 68 N -0.94 4.36 0.63 -4.53 1.43 -1.26 -4.89 118.68 113.48 1ocs s LEU 68 Ca 0.07 2.87 0.41 0.00 -1.03 0.00 0.00 54.13 56.46 1ocs s LEU 68 Cb 0.06 -3.63 2.25 0.00 0.03 0.00 0.00 46.19 44.91 1ocs s LEU 68 CO 0.01 -0.88 2.27 1.55 0.23 0.00 0.00 176.35 179.52 1ocs h PRO 69 N 5.23 0.00 0.00 1.29 0.13 -1.98 -1.62 132.00 135.06 1ocs h PRO 69 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1ocs h PRO 69 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1ocs h PRO 69 CO 0.82 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.25 1ocs h SER 70 N 0.00 0.00 -3.08 1.44 4.64 -1.90 -3.45 113.55 111.20 1ocs h SER 70 Ca 0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 1ocs h SER 70 Cb 0.05 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1ocs h SER 70 CO 0.00 0.00 -0.10 -0.36 -0.87 0.00 0.00 176.83 175.50 1ocs s PHE 71 N -3.17 3.52 -0.76 4.77 0.40 -0.61 -4.97 117.98 117.15 1ocs s PHE 71 Ca 0.09 0.53 0.17 0.00 -0.60 0.00 0.00 56.93 57.11 1ocs s PHE 71 Cb 0.10 -2.04 -0.18 0.00 0.51 0.00 0.00 43.02 41.40 1ocs s PHE 71 CO 0.60 0.01 0.70 0.72 0.70 0.00 0.00 175.22 177.95 1ocs n HIS 72 N -1.80 0.00 -3.70 0.36 8.25 -1.26 -4.93 115.22 112.14 1ocs n HIS 72 Ca -0.03 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.33 1ocs n HIS 72 Cb 0.56 -0.01 -0.05 0.00 1.12 0.00 0.00 29.99 31.60 1ocs n HIS 72 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 1ocs s LYS 73 N -2.60 1.00 0.01 -0.41 -2.85 -1.26 -5.08 119.74 108.54 1ocs s LYS 73 Ca 0.06 -0.76 -0.22 0.00 -1.00 0.00 0.00 55.97 54.05 1ocs s LYS 73 Cb 0.13 0.43 -0.18 0.00 -2.06 0.00 0.00 37.83 36.15 1ocs s LYS 73 CO 0.69 -0.37 1.24 -0.09 0.10 0.00 0.00 175.35 176.91 1ocs h ARG 74 N 2.51 0.29 -5.63 1.78 2.43 -1.95 -3.43 114.38 110.38 1ocs h ARG 74 Ca -0.34 -0.19 -0.67 0.00 -0.81 0.00 0.00 59.98 57.97 1ocs h ARG 74 Cb 1.24 0.03 -0.27 0.00 -0.42 0.00 0.00 29.97 30.54 1ocs h ARG 74 CO 0.49 0.80 -0.79 0.08 -1.51 0.00 0.00 179.97 179.04 1ocs s VAL 75 N -3.90 2.85 -0.05 0.20 1.01 -1.26 -1.03 120.40 118.22 1ocs s VAL 75 Ca -0.15 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.10 1ocs s VAL 75 Cb 0.04 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.28 1ocs s VAL 75 CO 0.75 0.55 -0.09 -0.44 0.00 0.00 0.00 175.10 175.87 1ocs s SER 76 N 0.04 1.34 -0.18 3.32 0.01 -0.26 -5.01 113.70 112.98 1ocs s SER 76 Ca -0.06 -0.21 -0.02 0.00 1.31 0.00 0.00 55.95 56.97 1ocs s SER 76 Cb -0.15 -0.55 0.05 0.00 0.21 0.00 0.00 66.02 65.58 1ocs s SER 76 CO 0.05 0.02 0.01 -0.75 0.41 0.00 0.00 173.24 172.97 1ocs s LYS 77 N 0.58 0.89 0.15 12.44 2.20 -1.26 -1.12 119.74 133.62 1ocs s LYS 77 Ca -0.10 -0.42 0.00 0.00 -0.36 0.00 0.00 55.97 55.09 1ocs s LYS 77 Cb -0.13 -1.98 -0.04 0.00 -1.51 0.00 0.00 37.83 34.16 1ocs s LYS 77 CO 0.02 -0.55 0.02 0.14 -0.36 0.00 0.00 175.35 174.62 1ocs s VAL 78 N 1.79 0.42 0.01 4.02 -7.23 -0.77 -4.98 120.40 113.65 1ocs s VAL 78 Ca -0.00 -1.94 0.05 0.00 -1.81 0.00 0.00 61.98 58.28 1ocs s VAL 78 Cb -0.16 -2.05 -0.03 0.00 0.56 0.00 0.00 36.38 34.69 1ocs s VAL 78 CO -0.07 -0.50 -0.14 -0.13 -0.31 0.00 0.00 175.10 173.94 1ocs s ARG 79 N -3.97 2.32 -0.02 4.82 0.52 -1.26 -0.01 118.95 121.34 1ocs s ARG 79 Ca 0.23 -0.83 -0.01 0.00 -0.52 0.00 0.00 55.73 54.59 1ocs s ARG 79 Cb 0.07 -2.32 0.02 0.00 0.52 0.00 0.00 34.95 33.23 1ocs s ARG 79 CO 0.02 0.58 0.06 1.03 0.02 0.00 0.00 175.30 177.01 1ocs s ARG 80 N -1.23 0.04 0.62 3.54 1.81 0.12 -4.91 118.95 118.94 1ocs s ARG 80 Ca 0.14 0.14 -0.10 0.00 -1.72 0.00 0.00 55.73 54.19 1ocs s ARG 80 Cb -0.11 -0.07 -0.03 0.00 -0.45 0.00 0.00 34.95 34.30 1ocs s ARG 80 CO 0.05 -0.07 1.01 1.03 -0.68 0.00 0.00 175.30 176.63 1ocs s ARG 81 N 0.44 3.42 0.37 3.54 0.52 -1.26 -0.01 118.95 125.97 1ocs s ARG 81 Ca -0.03 0.59 0.06 0.00 -0.52 0.00 0.00 55.73 55.82 1ocs s ARG 81 Cb -0.05 -2.11 0.74 0.00 0.52 0.00 0.00 34.95 34.05 1ocs s ARG 81 CO -0.02 -0.62 1.99 -0.92 0.02 0.00 0.00 175.30 175.75 1ocs h TYR 82 N -0.31 0.72 0.00 -0.53 5.03 -1.97 0.54 116.97 120.45 1ocs h TYR 82 Ca -0.45 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 60.85 1ocs h TYR 82 Cb 1.21 -0.24 -0.01 0.00 1.55 0.00 0.00 36.73 39.24 1ocs h TYR 82 CO 0.61 0.41 -0.18 0.66 -1.32 0.00 0.00 178.16 178.35 1ocs h SER 83 N 0.74 0.00 -0.28 -2.11 4.64 -1.93 -1.76 113.55 112.84 1ocs h SER 83 Ca 0.27 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.46 1ocs h SER 83 Cb 0.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 1ocs h SER 83 CO -0.08 0.18 -0.30 0.44 -0.87 0.00 0.00 176.83 176.19 1ocs h ASP 84 N 0.00 0.82 -0.65 4.97 3.32 -1.25 -1.05 116.42 122.58 1ocs h ASP 84 Ca -0.00 -0.33 -0.08 0.00 0.02 0.00 0.00 57.03 56.64 1ocs h ASP 84 Cb 0.35 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 1ocs h ASP 84 CO 0.02 1.06 0.11 -0.26 -1.72 0.00 0.00 179.24 178.46 1ocs h PHE 85 N 0.67 1.15 -0.54 4.55 0.04 -1.11 0.98 116.94 122.68 1ocs h PHE 85 Ca 0.08 -0.15 -0.04 0.00 2.80 0.00 0.00 57.97 60.66 1ocs h PHE 85 Cb 0.84 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 38.65 1ocs h PHE 85 CO 0.05 0.96 0.19 0.93 -0.60 0.00 0.00 178.31 179.84 1ocs h GLU 86 N 1.02 0.82 -0.54 1.51 5.08 -1.05 0.08 114.58 121.51 1ocs h GLU 86 Ca 0.20 -0.16 -0.09 0.00 -1.00 0.00 0.00 59.36 58.31 1ocs h GLU 86 Cb 0.43 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 1ocs h GLU 86 CO 0.01 0.73 -0.02 0.35 -1.00 0.00 0.00 179.01 179.08 1ocs h PHE 87 N 0.74 1.06 -0.59 4.33 3.57 -0.95 -2.72 116.94 122.38 1ocs h PHE 87 Ca 0.18 -0.19 0.01 0.00 3.53 0.00 0.00 57.97 61.49 1ocs h PHE 87 Cb 0.24 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.67 1ocs h PHE 87 CO 0.01 0.98 0.39 0.35 -2.23 0.00 0.00 178.31 177.81 1ocs h PHE 88 N 0.85 0.75 -0.59 0.41 3.57 -0.43 -2.67 116.94 118.83 1ocs h PHE 88 Ca 0.15 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.67 1ocs h PHE 88 Cb 0.57 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 1ocs h PHE 88 CO 0.04 0.48 0.39 -0.09 -2.23 0.00 0.00 178.31 176.90 1ocs h ARG 89 N 0.80 0.77 -0.02 1.11 2.43 -0.86 0.35 114.38 118.97 1ocs h ARG 89 Ca 0.22 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1ocs h ARG 89 Cb -0.09 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.29 1ocs h ARG 89 CO -0.05 0.51 0.00 1.63 -1.51 0.00 0.00 179.97 180.55 1ocs n LYS 90 N -4.68 0.02 0.00 0.20 5.02 -1.01 -0.99 118.16 116.73 1ocs n LYS 90 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 1ocs n LYS 90 Cb 0.02 -1.01 0.00 0.00 -0.02 0.00 0.00 35.03 34.02 1ocs n LYS 90 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1ocs n LEU 92 N 0.46 0.00 -0.36 -0.35 7.94 0.12 -1.94 117.00 122.88 1ocs n LEU 92 Ca 0.00 0.00 0.01 0.00 -1.11 0.00 0.00 56.01 54.91 1ocs n LEU 92 Cb 0.00 0.00 0.16 0.00 0.53 0.00 0.00 43.42 44.11 1ocs n LEU 92 CO 0.00 0.00 1.28 0.40 -1.11 0.00 0.00 177.39 177.96 1ocs h ILE 93 N 0.00 1.17 -0.43 1.96 2.04 -1.30 -0.23 117.51 120.73 1ocs h ILE 93 Ca 0.00 -0.43 -0.10 0.00 1.00 0.00 0.00 64.86 65.33 1ocs h ILE 93 Cb 0.00 -0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 35.89 1ocs h ILE 93 CO 0.00 0.23 -0.12 0.50 0.00 0.00 0.00 178.15 178.75 1ocs h LYS 94 N 1.24 0.84 -0.65 2.37 3.64 -1.63 -2.97 116.57 119.41 1ocs h LYS 94 Ca 0.39 -0.33 -0.06 0.00 -1.27 0.00 0.00 60.65 59.38 1ocs h LYS 94 Cb 0.00 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.75 1ocs h LYS 94 CO -0.12 0.96 0.18 1.49 -2.27 0.00 0.00 179.45 179.69 1ocs h GLU 95 N 0.67 1.03 -0.91 1.90 4.81 -1.68 -2.74 114.58 117.66 1ocs h GLU 95 Ca 0.11 -0.24 0.07 0.00 -0.13 0.00 0.00 59.36 59.17 1ocs h GLU 95 Cb 0.67 -0.14 -0.06 0.00 0.63 0.00 0.00 28.75 29.84 1ocs h GLU 95 CO 0.05 0.91 0.59 0.82 -0.73 0.00 0.00 179.01 180.65 1ocs h ILE 96 N 0.96 1.05 -0.01 2.32 2.04 -0.98 0.10 117.51 122.98 1ocs h ILE 96 Ca 0.21 -0.35 -0.11 0.00 1.00 0.00 0.00 64.86 65.60 1ocs h ILE 96 Cb 0.33 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.34 1ocs h ILE 96 CO -0.00 0.19 -0.53 0.77 0.00 0.00 0.00 178.15 178.58 1ocs h SER 97 N 1.02 0.04 0.38 1.72 4.64 -1.34 -2.56 113.55 117.45 1ocs h SER 97 Ca 0.40 -0.02 -0.19 0.00 -0.47 0.00 0.00 61.79 61.51 1ocs h SER 97 Cb 0.23 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 1ocs h SER 97 CO -0.15 0.56 -0.78 0.24 -0.87 0.00 0.00 176.83 175.82 1ocs h MET 98 N 0.03 0.32 0.00 4.77 2.86 -0.88 -2.70 114.93 119.32 1ocs h MET 98 Ca -0.00 -0.29 0.00 0.00 -2.06 0.00 0.00 59.70 57.35 1ocs h MET 98 Cb 0.94 0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.67 1ocs h MET 98 CO 0.07 0.95 0.00 1.28 1.06 0.00 0.00 176.91 180.27 1ocs n LEU 99 N -3.78 0.00 -3.14 1.22 4.77 0.20 -4.87 117.00 111.41 1ocs n LEU 99 Ca -0.04 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.79 1ocs n LEU 99 Cb 0.74 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.90 1ocs n LEU 99 CO 0.48 0.00 0.06 0.59 -1.33 0.00 0.00 177.39 177.19 1ocs n ASN 100 N -0.87 -4.32 -3.08 -1.43 3.02 -1.02 -4.98 115.26 102.58 1ocs n ASN 100 Ca 0.12 -0.61 -0.22 0.00 -0.03 0.00 0.00 54.58 53.84 1ocs n ASN 100 Cb 0.05 -4.75 -0.03 0.00 -0.61 0.00 0.00 39.78 34.44 1ocs n ASN 100 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1ocs n HIS 101 N -3.42 1.89 0.00 3.10 8.25 -0.99 -4.95 115.22 119.10 1ocs n HIS 101 Ca -0.15 -3.90 0.00 0.00 -0.26 0.00 0.00 57.72 53.41 1ocs n HIS 101 Cb 0.63 -0.45 0.00 0.00 1.12 0.00 0.00 29.99 31.29 1ocs n HIS 101 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1ocs n PRO 102 N 0.05 0.00 -0.00 -0.41 -0.04 -1.26 -1.75 135.00 131.59 1ocs n PRO 102 Ca 0.28 0.12 0.04 0.00 -0.04 0.00 0.00 63.50 63.90 1ocs n PRO 102 Cb 0.54 -1.52 -0.07 0.00 -0.04 0.00 0.00 33.50 32.41 1ocs n PRO 102 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1ocs n LYS 103 N -1.06 0.76 -2.02 0.54 5.02 -1.26 -4.99 118.16 115.15 1ocs n LYS 103 Ca 0.00 -0.07 -0.42 0.00 -2.02 0.00 0.00 58.31 55.80 1ocs n LYS 103 Cb 0.02 -1.17 -0.03 0.00 -0.02 0.00 0.00 35.03 33.83 1ocs n LYS 103 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ocs s VAL 104 N -2.51 2.86 -0.08 -0.18 1.01 -0.72 -5.00 120.40 115.78 1ocs s VAL 104 Ca -0.02 0.62 0.04 0.00 0.00 0.00 0.00 61.98 62.61 1ocs s VAL 104 Cb 0.06 -3.39 -0.01 0.00 0.00 0.00 0.00 36.38 33.03 1ocs s VAL 104 CO 0.37 0.05 -0.21 -0.04 0.00 0.00 0.00 175.10 175.26 1ocs s MET 105 N 1.11 2.77 -0.22 2.72 -1.94 -1.26 -5.04 119.30 117.44 1ocs s MET 105 Ca 0.68 -0.83 -0.12 0.00 -1.71 0.00 0.00 55.69 53.71 1ocs s MET 105 Cb -0.41 -2.30 -0.05 0.00 2.01 0.00 0.00 34.83 34.08 1ocs s MET 105 CO 0.31 0.36 0.20 0.08 -0.01 0.00 0.00 175.02 175.96 1ocs s VAL 106 N -0.08 5.34 0.79 -6.03 1.01 -1.26 -5.07 120.40 115.10 1ocs s VAL 106 Ca -0.05 0.30 -0.14 0.00 0.00 0.00 0.00 61.98 62.09 1ocs s VAL 106 Cb -0.14 -3.54 0.07 0.00 0.00 0.00 0.00 36.38 32.76 1ocs s VAL 106 CO 0.04 0.35 1.17 -2.65 0.00 0.00 0.00 175.10 174.01 1ocs n PRO 107 N 4.10 0.27 -1.90 2.72 -0.02 -1.26 -4.96 135.00 133.96 1ocs n PRO 107 Ca -0.14 0.16 -0.38 0.00 -2.02 0.00 0.00 63.50 61.13 1ocs n PRO 107 Cb 0.52 -2.41 0.04 0.00 -0.02 0.00 0.00 33.50 31.63 1ocs n PRO 107 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1ocs s HIS 108 N -2.05 2.37 0.07 6.00 3.76 -1.26 -4.95 115.29 119.23 1ocs s HIS 108 Ca 0.74 1.44 -0.30 0.00 -0.15 0.00 0.00 55.06 56.79 1ocs s HIS 108 Cb -0.30 -3.66 -0.05 0.00 1.11 0.00 0.00 32.58 29.68 1ocs s HIS 108 CO 0.50 -2.56 1.07 -0.51 -0.85 0.00 0.00 174.74 172.39 1ocs s LEU 109 N -3.67 4.42 0.84 0.89 1.43 -1.26 -5.02 118.68 116.31 1ocs s LEU 109 Ca 0.73 1.88 -0.12 0.00 -1.03 0.00 0.00 54.13 55.59 1ocs s LEU 109 Cb -0.36 -3.58 0.10 0.00 0.03 0.00 0.00 46.19 42.37 1ocs s LEU 109 CO 0.42 -0.28 1.12 -2.84 0.23 0.00 0.00 176.35 174.99 1ocs s PRO 110 N 0.57 1.71 -1.94 1.29 0.02 -1.26 -4.11 135.00 131.27 1ocs s PRO 110 Ca 0.53 0.45 0.00 0.00 0.02 0.00 0.00 61.00 62.00 1ocs s PRO 110 Cb -0.26 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.37 1ocs s PRO 110 CO 0.30 -1.84 0.00 0.41 -0.33 0.00 0.00 177.00 175.54 1ocs n GLY 111 N -2.25 0.79 0.22 0.52 0.00 -1.26 -4.87 105.19 98.34 1ocs n GLY 111 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 1ocs n GLY 111 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ocs h LYS 112 N 0.00 -0.46 -6.90 1.61 1.57 -2.01 -3.45 116.57 106.94 1ocs h LYS 112 Ca -0.44 0.03 -0.56 0.00 -1.87 0.00 0.00 60.65 57.81 1ocs h LYS 112 Cb 1.33 0.10 0.13 0.00 0.08 0.00 0.00 32.23 33.88 1ocs h LYS 112 CO 0.58 -0.16 0.49 -0.89 -0.57 0.00 0.00 179.45 178.90 1ocs n ILE 113 N -5.11 3.08 -3.72 1.86 2.08 -1.26 -5.01 119.36 111.27 1ocs n ILE 113 Ca -0.08 -0.50 -0.21 0.00 0.56 0.00 0.00 62.75 62.51 1ocs n ILE 113 Cb 0.26 -1.56 -0.18 0.00 -0.75 0.00 0.00 39.64 37.42 1ocs n ILE 113 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 1ocs s LEU 114 N -2.28 0.37 0.00 1.39 2.96 -1.26 -4.95 118.68 114.90 1ocs s LEU 114 Ca 0.66 0.00 0.00 0.00 -0.22 0.00 0.00 54.13 54.57 1ocs s LEU 114 Cb -0.47 -0.28 0.00 0.00 0.50 0.00 0.00 46.19 45.94 1ocs s LEU 114 CO 0.54 -0.22 0.34 -0.11 -1.32 0.00 0.00 176.35 175.58 1ocs n LEU 115 N 5.21 0.63 -4.35 -0.68 7.94 -1.26 -5.05 117.00 119.44 1ocs n LEU 115 Ca -0.05 -0.63 -0.19 0.00 -1.11 0.00 0.00 56.01 54.03 1ocs n LEU 115 Cb 0.50 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.35 1ocs n LEU 115 CO 0.08 0.16 -0.45 -0.55 -1.11 0.00 0.00 177.39 175.53 1ocs s SER 116 N -0.07 2.62 -0.08 1.96 0.15 -1.26 -5.09 113.70 111.92 1ocs s SER 116 Ca 0.00 -1.00 -0.35 0.00 0.70 0.00 0.00 55.95 55.30 1ocs s SER 116 Cb 0.00 -0.14 -0.13 0.00 -1.71 0.00 0.00 66.02 64.04 1ocs s SER 116 CO 0.00 -0.15 1.82 -3.20 1.20 0.00 0.00 173.24 172.91 1ocs n ASN 117 N -0.31 3.24 0.27 5.45 4.05 -1.26 -4.83 115.26 121.87 1ocs n ASN 117 Ca -0.08 1.00 0.18 0.00 0.45 0.00 0.00 54.58 56.13 1ocs n ASN 117 Cb 0.60 -1.34 0.92 0.00 1.23 0.00 0.00 39.78 41.18 1ocs n ASN 117 CO 0.00 0.00 0.00 0.08 -3.05 0.00 0.00 177.26 174.29 1ocs h ARG 118 N 8.51 0.00 -0.36 1.20 0.11 -1.99 -0.50 114.38 121.35 1ocs h ARG 118 Ca -0.48 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.60 1ocs h ARG 118 Cb 1.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.36 1ocs h ARG 118 CO 0.94 0.00 0.00 1.19 0.10 0.00 0.00 179.97 182.20 1ocs n PHE 119 N -3.31 0.46 -2.37 4.08 3.01 -1.26 -4.47 117.46 113.59 1ocs n PHE 119 Ca -0.00 -0.23 -0.34 0.00 1.01 0.00 0.00 57.45 57.89 1ocs n PHE 119 Cb 0.30 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.76 1ocs n PHE 119 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1ocs s SER 120 N -1.49 6.10 0.38 4.37 1.04 -0.20 -4.91 113.70 119.00 1ocs s SER 120 Ca 0.38 1.93 0.05 0.00 0.48 0.00 0.00 55.95 58.79 1ocs s SER 120 Cb 0.22 -2.56 0.75 0.00 0.10 0.00 0.00 66.02 64.53 1ocs s SER 120 CO 0.31 -0.95 2.03 0.78 0.98 0.00 0.00 173.24 176.39 1ocs h ASN 121 N 1.21 0.58 0.37 7.02 -0.26 -1.92 -2.05 115.58 120.53 1ocs h ASN 121 Ca -0.49 -0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.23 1ocs h ASN 121 Cb 1.23 -0.15 -0.03 0.00 -1.06 0.00 0.00 38.32 38.31 1ocs h ASN 121 CO 0.58 0.43 -0.51 -0.33 -1.06 0.00 0.00 177.43 176.55 1ocs h GLU 122 N 0.69 -0.88 -0.24 0.81 5.08 -1.92 0.17 114.58 118.28 1ocs h GLU 122 Ca 0.18 0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.60 1ocs h GLU 122 Cb -0.06 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1ocs h GLU 122 CO -0.04 -0.59 0.13 0.28 -1.00 0.00 0.00 179.01 177.80 1ocs h VAL 123 N -0.91 1.12 -0.59 3.13 2.07 -1.77 -1.70 116.25 117.61 1ocs h VAL 123 Ca -0.04 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 1ocs h VAL 123 Cb 0.82 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 1ocs h VAL 123 CO -0.14 0.12 0.33 0.40 0.02 0.00 0.00 177.57 178.30 1ocs h ILE 124 N 0.28 1.19 -0.46 4.57 2.04 -1.29 0.68 117.51 124.52 1ocs h ILE 124 Ca 0.09 -0.47 -0.10 0.00 1.00 0.00 0.00 64.86 65.37 1ocs h ILE 124 Cb 0.08 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 1ocs h ILE 124 CO -0.01 0.20 -0.12 -0.08 0.00 0.00 0.00 178.15 178.14 1ocs h GLU 125 N 0.79 0.86 -0.53 2.37 4.57 -0.91 0.71 114.58 122.44 1ocs h GLU 125 Ca 0.21 -0.30 -0.09 0.00 -1.18 0.00 0.00 59.36 58.00 1ocs h GLU 125 Cb 0.04 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.54 1ocs h GLU 125 CO -0.03 0.93 -0.03 0.93 -1.18 0.00 0.00 179.01 179.63 1ocs h GLU 126 N 0.77 0.92 -0.35 1.92 5.08 -0.92 -1.42 114.58 120.58 1ocs h GLU 126 Ca 0.12 -0.28 -0.13 0.00 -1.00 0.00 0.00 59.36 58.07 1ocs h GLU 126 Cb 0.63 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 1ocs h GLU 126 CO 0.04 0.93 -0.30 0.00 -1.00 0.00 0.00 179.01 178.69 1ocs h ARG 127 N 0.84 0.82 0.13 2.33 3.08 -0.55 -0.82 114.38 120.21 1ocs h ARG 127 Ca 0.15 -0.41 0.01 0.00 0.07 0.00 0.00 59.98 59.80 1ocs h ARG 127 Cb 0.54 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 1ocs h ARG 127 CO 0.03 1.05 -0.21 -0.09 -1.07 0.00 0.00 179.97 179.68 1ocs h ARG 128 N 0.60 -0.39 -0.21 0.04 2.43 -0.60 0.56 114.38 116.81 1ocs h ARG 128 Ca 0.06 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1ocs h ARG 128 Cb 0.87 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.50 1ocs h ARG 128 CO 0.08 -0.26 0.13 1.96 -1.51 0.00 0.00 179.97 180.37 1ocs h GLN 129 N -0.41 0.27 -0.20 0.20 4.20 -1.26 -0.18 115.11 117.73 1ocs h GLN 129 Ca 0.02 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 1ocs h GLN 129 Cb 0.42 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 1ocs h GLN 129 CO -0.11 0.19 0.12 0.78 -0.67 0.00 0.00 178.83 179.14 1ocs h GLY 130 N 0.27 0.30 1.34 3.46 0.00 -0.87 -2.02 103.07 105.56 1ocs h GLY 130 Ca 0.08 -0.13 -0.03 0.00 0.00 0.00 0.00 47.33 47.25 1ocs h GLY 130 CO -0.02 0.13 0.25 1.41 0.00 0.00 0.00 176.54 178.31 1ocs h LEU 131 N 0.23 0.78 0.09 3.11 3.38 0.28 0.02 115.31 123.20 1ocs h LEU 131 Ca 0.07 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1ocs h LEU 131 Cb 0.05 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.60 1ocs h LEU 131 CO -0.01 0.69 -0.04 -1.13 0.09 0.00 0.00 178.44 178.03 1ocs h ASN 132 N 0.85 -0.10 -0.56 -0.43 -1.24 -0.76 0.82 115.58 114.15 1ocs h ASN 132 Ca 0.20 -0.07 -0.00 0.00 0.71 0.00 0.00 56.30 57.14 1ocs h ASN 132 Cb 0.14 0.03 -0.03 0.00 0.73 0.00 0.00 38.32 39.19 1ocs h ASN 132 CO -0.02 -0.00 0.34 0.74 -1.29 0.00 0.00 177.43 177.19 1ocs h THR 133 N -0.20 1.17 -0.22 -3.57 2.02 -1.08 -1.86 112.91 109.16 1ocs h THR 133 Ca -0.01 -0.38 -0.00 0.00 0.77 0.00 0.00 66.41 66.78 1ocs h THR 133 Cb 0.17 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 1ocs h THR 133 CO 0.02 0.17 0.13 -0.25 0.37 0.00 0.00 175.52 175.96 1ocs h TRP 134 N 0.75 0.30 -0.77 3.16 7.01 -0.82 -1.89 115.95 123.69 1ocs h TRP 134 Ca 0.20 -0.00 -0.03 0.00 2.11 0.00 0.00 58.89 61.17 1ocs h TRP 134 Cb -0.01 -0.10 -0.04 0.00 -2.10 0.00 0.00 29.16 26.92 1ocs h TRP 134 CO -0.02 0.25 0.36 1.98 -2.79 0.00 0.00 178.44 178.22 1ocs h MET 135 N 0.27 1.11 -0.18 2.65 4.05 -0.65 0.01 114.93 122.20 1ocs h MET 135 Ca 0.08 -0.17 -0.09 0.00 -0.28 0.00 0.00 59.70 59.24 1ocs h MET 135 Cb 0.04 -0.20 -0.01 0.00 -0.80 0.00 0.00 31.60 30.63 1ocs h MET 135 CO -0.01 0.87 -0.29 1.96 0.23 0.00 0.00 176.91 179.67 1ocs h GLN 136 N 1.09 0.34 -0.14 0.39 4.20 -1.21 0.19 115.11 119.96 1ocs h GLN 136 Ca 0.26 -0.13 -0.06 0.00 0.06 0.00 0.00 58.65 58.78 1ocs h GLN 136 Cb 0.13 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.89 1ocs h GLN 136 CO -0.03 0.60 -0.15 1.03 -0.67 0.00 0.00 178.83 179.61 1ocs h SER 137 N 0.30 0.38 0.08 1.46 0.87 -0.82 -1.49 113.55 114.33 1ocs h SER 137 Ca 0.04 -0.49 -0.00 0.00 -1.23 0.00 0.00 61.79 60.11 1ocs h SER 137 Cb 0.66 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.52 1ocs h SER 137 CO 0.05 0.79 -0.04 0.58 -0.53 0.00 0.00 176.83 177.68 1ocs h VAL 138 N -0.02 1.20 0.00 2.23 2.07 -0.85 -3.17 116.25 117.71 1ocs h VAL 138 Ca 0.02 -1.21 0.00 0.00 0.82 0.00 0.00 66.70 66.33 1ocs h VAL 138 Cb 0.69 1.95 0.00 0.00 -1.52 0.00 0.00 31.29 32.41 1ocs h VAL 138 CO 0.04 0.29 0.00 0.00 0.02 0.00 0.00 177.57 177.92 1ocs h ALA 139 N 0.14 1.00 -0.00 1.67 0.00 -0.74 -2.62 119.26 118.71 1ocs h ALA 139 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ocs h ALA 139 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1ocs h ALA 139 CO 0.02 0.00 -0.29 0.41 0.00 0.00 0.00 179.25 179.39 1ocs n GLY 140 N -0.37 -1.29 3.67 0.00 0.00 -0.56 -4.69 105.19 101.95 1ocs n GLY 140 Ca 0.00 -0.26 -0.43 0.00 0.00 0.00 0.00 46.02 45.34 1ocs n GLY 140 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ocs s HIS 141 N -2.94 2.81 0.27 1.61 2.46 -0.99 -4.93 115.29 113.58 1ocs s HIS 141 Ca 0.14 0.91 -0.00 0.00 0.47 0.00 0.00 55.06 56.58 1ocs s HIS 141 Cb 0.18 -3.57 0.59 0.00 -0.13 0.00 0.00 32.58 29.65 1ocs s HIS 141 CO 0.62 -2.05 1.72 -1.35 -2.47 0.00 0.00 174.74 171.21 1ocs h PRO 142 N 8.14 0.43 -0.31 2.88 0.11 -1.90 -0.66 132.00 140.69 1ocs h PRO 142 Ca -0.32 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.64 1ocs h PRO 142 Cb 1.14 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1ocs h PRO 142 CO 0.93 0.29 -0.33 -0.07 -0.21 0.00 0.00 178.00 178.61 1ocs h LEU 143 N 0.45 0.70 -0.47 2.35 3.38 -1.97 -2.06 115.31 117.68 1ocs h LEU 143 Ca 0.49 -0.28 -0.17 0.00 0.09 0.00 0.00 57.88 58.01 1ocs h LEU 143 Cb 0.82 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.38 1ocs h LEU 143 CO -0.46 0.97 -0.57 -0.07 0.09 0.00 0.00 178.44 178.40 1ocs h LEU 144 N 0.57 0.66 -1.16 1.67 3.38 -1.67 -0.99 115.31 117.76 1ocs h LEU 144 Ca 0.06 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.64 1ocs h LEU 144 Cb 0.84 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 1ocs h LEU 144 CO 0.07 1.09 0.16 1.56 0.09 0.00 0.00 178.44 181.41 1ocs h GLN 145 N 0.45 0.75 0.09 1.13 4.20 -0.97 -1.11 115.11 119.65 1ocs h GLN 145 Ca 0.00 -0.13 -0.32 0.00 0.06 0.00 0.00 58.65 58.27 1ocs h GLN 145 Cb 1.12 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.76 1ocs h GLN 145 CO 0.11 0.65 -1.71 0.66 -0.67 0.00 0.00 178.83 177.87 1ocs h SER 146 N 0.73 0.31 -0.00 1.46 4.64 -1.26 -3.43 113.55 116.00 1ocs h SER 146 Ca 0.17 -0.54 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 1ocs h SER 146 Cb 0.21 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1ocs h SER 146 CO -0.01 1.47 -0.00 0.61 -0.87 0.00 0.00 176.83 178.03 1ocs n GLY 147 N 1.74 -1.21 3.58 -0.77 0.00 -0.39 -4.89 105.19 103.25 1ocs n GLY 147 Ca -0.21 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.39 1ocs n GLY 147 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ocs s SER 148 N -0.14 6.41 0.10 1.61 0.15 -0.42 -4.92 113.70 116.50 1ocs s SER 148 Ca 0.00 0.20 -0.02 0.00 0.70 0.00 0.00 55.95 56.84 1ocs s SER 148 Cb 0.00 -2.31 -0.21 0.00 -1.71 0.00 0.00 66.02 61.79 1ocs s SER 148 CO 0.01 -0.51 1.21 0.11 1.20 0.00 0.00 173.24 175.26 1ocs h LYS 149 N 8.36 0.24 -0.69 5.44 1.79 -1.95 -3.26 116.57 126.50 1ocs h LYS 149 Ca -0.27 -0.36 -0.07 0.00 -2.18 0.00 0.00 60.65 57.77 1ocs h LYS 149 Cb 1.12 0.13 -0.03 0.00 -1.58 0.00 0.00 32.23 31.87 1ocs h LYS 149 CO 0.80 1.14 0.16 0.28 -1.08 0.00 0.00 179.45 180.75 1ocs h VAL 150 N 0.08 1.26 -0.22 0.50 2.07 -1.97 -2.02 116.25 115.96 1ocs h VAL 150 Ca -0.10 -0.97 0.04 0.00 0.82 0.00 0.00 66.70 66.49 1ocs h VAL 150 Cb 1.83 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 32.12 1ocs h VAL 150 CO 0.18 0.37 -0.03 0.25 0.02 0.00 0.00 177.57 178.36 1ocs h LEU 151 N 1.05 -0.15 -0.19 2.57 6.46 -1.92 0.03 115.31 123.17 1ocs h LEU 151 Ca 0.22 0.06 0.01 0.00 -0.12 0.00 0.00 57.88 58.04 1ocs h LEU 151 Cb 0.38 0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.40 1ocs h LEU 151 CO 0.00 -0.05 0.10 0.58 -0.62 0.00 0.00 178.44 178.46 1ocs h VAL 152 N 0.03 1.02 -0.68 1.05 2.07 -1.54 -2.35 116.25 115.85 1ocs h VAL 152 Ca 0.10 -0.07 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 1ocs h VAL 152 Cb 0.15 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 1ocs h VAL 152 CO -0.20 0.04 0.32 -0.09 0.02 0.00 0.00 177.57 177.66 1ocs h ARG 153 N 0.22 0.98 -0.41 1.57 2.43 -1.07 0.86 114.38 118.97 1ocs h ARG 153 Ca 0.07 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1ocs h ARG 153 Cb -0.00 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.35 1ocs h ARG 153 CO -0.04 0.78 0.24 0.35 -1.51 0.00 0.00 179.97 179.80 1ocs h PHE 154 N 0.95 0.52 0.15 2.20 3.57 -0.81 -0.93 116.94 122.60 1ocs h PHE 154 Ca 0.23 0.01 -0.33 0.00 3.53 0.00 0.00 57.97 61.41 1ocs h PHE 154 Cb 0.13 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 38.69 1ocs h PHE 154 CO 0.01 0.35 -1.61 0.82 -2.23 0.00 0.00 178.31 175.64 1ocs h ILE 155 N 0.56 1.08 0.10 1.41 2.04 -0.99 -3.42 117.51 118.29 1ocs h ILE 155 Ca 0.15 -2.68 -0.35 0.00 1.00 0.00 0.00 64.86 62.97 1ocs h ILE 155 Cb -0.02 2.78 -0.02 0.00 -0.74 0.00 0.00 36.82 38.82 1ocs h ILE 155 CO -0.03 0.83 -1.94 -0.62 0.00 0.00 0.00 178.15 176.39 1ocs n GLU 156 N -3.52 0.73 -1.77 2.37 1.02 0.26 -4.60 120.64 115.13 1ocs n GLU 156 Ca -0.20 0.30 -0.41 0.00 -0.02 0.00 0.00 57.16 56.83 1ocs n GLU 156 Cb 1.06 -1.70 -0.00 0.00 -0.02 0.00 0.00 31.44 30.78 1ocs n GLU 156 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ocs n ALA 157 N -3.08 2.39 -0.22 0.62 0.00 -0.37 -4.90 120.51 114.95 1ocs n ALA 157 Ca -0.33 0.35 -0.07 0.00 0.00 0.00 0.00 53.44 53.38 1ocs n ALA 157 Cb 1.00 -2.43 0.03 0.00 0.00 0.00 0.00 19.45 18.05 1ocs n ALA 157 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1ocs h GLU 158 N 3.29 0.92 -4.66 0.00 4.81 -1.93 -3.40 114.58 113.62 1ocs h GLU 158 Ca -0.50 -0.17 -0.60 0.00 -0.13 0.00 0.00 59.36 57.96 1ocs h GLU 158 Cb 1.24 -0.15 -0.36 0.00 0.63 0.00 0.00 28.75 30.11 1ocs h GLU 158 CO 0.67 0.78 -0.83 0.21 -0.73 0.00 0.00 179.01 179.11 1ocs s LYS 159 N -5.55 2.27 -0.25 1.92 2.20 -1.26 -4.66 119.74 114.41 1ocs s LYS 159 Ca -0.13 -0.55 -0.26 0.00 -0.36 0.00 0.00 55.97 54.67 1ocs s LYS 159 Cb 0.13 -2.08 0.00 0.00 -1.51 0.00 0.00 37.83 34.37 1ocs s LYS 159 CO 0.80 -0.23 0.90 0.12 -0.36 0.00 0.00 175.35 176.58 1ocs s PHE 160 N 1.47 3.30 0.00 4.03 5.36 -1.26 -5.10 117.98 125.78 1ocs s PHE 160 Ca 0.04 1.21 0.00 0.00 -0.96 0.00 0.00 56.93 57.22 1ocs s PHE 160 Cb -0.13 -3.17 0.00 0.00 -0.34 0.00 0.00 43.02 39.38 1ocs s PHE 160 CO -0.10 -0.46 0.00 1.55 -1.46 0.00 0.00 175.22 174.75