#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dty s THR 2 N 0.00 -0.06 0.16 3.15 2.01 -1.26 -1.68 115.64 117.97 2dty s THR 2 Ca 0.00 -0.85 -0.21 0.00 0.31 0.00 0.00 61.69 60.94 2dty s THR 2 Cb 0.00 -0.99 -0.08 0.00 0.01 0.00 0.00 72.50 71.44 2dty s THR 2 CO 0.00 -0.75 0.70 -0.51 -0.69 0.00 0.00 174.62 173.37 2dty s ILE 3 N 2.00 4.55 -0.20 1.82 2.07 -0.96 -4.90 121.20 125.58 2dty s ILE 3 Ca 0.10 1.39 -0.27 0.00 -1.41 0.00 0.00 60.65 60.46 2dty s ILE 3 Cb -0.17 -3.96 0.08 0.00 0.13 0.00 0.00 42.46 38.54 2dty s ILE 3 CO -0.33 0.40 0.77 -0.94 -1.91 0.00 0.00 174.94 172.93 2dty s SER 4 N -1.35 -0.66 0.27 4.50 1.04 -1.26 -0.94 113.70 115.29 2dty s SER 4 Ca 0.37 1.10 -0.01 0.00 0.48 0.00 0.00 55.95 57.89 2dty s SER 4 Cb -0.19 1.06 -0.02 0.00 0.10 0.00 0.00 66.02 66.96 2dty s SER 4 CO 0.22 -0.34 0.30 0.72 0.98 0.00 0.00 173.24 175.12 2dty s PHE 5 N -0.18 1.14 -0.20 5.02 -0.12 -0.74 -5.00 117.98 117.91 2dty s PHE 5 Ca -0.03 -1.32 -0.27 0.00 -0.05 0.00 0.00 56.93 55.27 2dty s PHE 5 Cb -0.03 -0.37 0.07 0.00 -0.63 0.00 0.00 43.02 42.06 2dty s PHE 5 CO 0.03 -0.86 0.71 1.21 -0.05 0.00 0.00 175.22 176.26 2dty s ASN 6 N -3.20 -0.71 -0.37 1.98 2.47 -1.26 -1.27 114.94 112.58 2dty s ASN 6 Ca 0.35 1.19 0.01 0.00 0.42 0.00 0.00 52.86 54.83 2dty s ASN 6 Cb 0.03 1.14 0.12 0.00 -1.45 0.00 0.00 41.25 41.09 2dty s ASN 6 CO 0.17 -0.37 0.16 -0.36 -3.72 0.00 0.00 177.10 172.98 2dty s PHE 7 N -0.15 1.80 0.47 0.43 0.08 0.23 -4.96 117.98 115.88 2dty s PHE 7 Ca -0.04 -2.05 0.16 0.00 0.12 0.00 0.00 56.93 55.13 2dty s PHE 7 Cb -0.03 -1.76 1.13 0.00 -0.57 0.00 0.00 43.02 41.79 2dty s PHE 7 CO 0.04 -0.84 2.05 -0.91 -0.10 0.00 0.00 175.22 175.46 2dty h ASN 8 N 7.42 0.00 -5.02 1.36 4.21 -1.91 -1.39 115.58 120.25 2dty h ASN 8 Ca -0.07 0.00 0.02 0.00 1.21 0.00 0.00 56.30 57.47 2dty h ASN 8 Cb 0.97 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 38.14 2dty h ASN 8 CO 0.46 0.12 0.23 0.00 -1.29 0.00 0.00 177.43 176.95 2dty s GLN 9 N -4.74 1.96 -0.26 0.81 0.00 -1.26 -4.60 119.66 111.58 2dty s GLN 9 Ca -0.04 -1.19 -0.06 0.00 -0.00 0.00 0.00 55.36 54.06 2dty s GLN 9 Cb 0.16 0.61 -0.01 0.00 0.00 0.00 0.00 33.01 33.77 2dty s GLN 9 CO 0.68 -0.91 0.04 -0.06 0.00 0.00 0.00 175.29 175.05 2dty s PHE 10 N -3.26 3.07 -0.33 9.60 0.08 -0.18 -4.98 117.98 121.98 2dty s PHE 10 Ca 0.14 -0.75 -0.28 0.00 0.12 0.00 0.00 56.93 56.15 2dty s PHE 10 Cb -0.05 -2.21 0.02 0.00 -0.57 0.00 0.00 43.02 40.20 2dty s PHE 10 CO 0.09 -0.48 1.04 -3.38 -0.10 0.00 0.00 175.22 172.38 2dty s HIS 11 N 1.54 3.13 0.21 0.36 -0.00 -1.26 -4.32 115.29 114.95 2dty s HIS 11 Ca 0.05 1.09 -0.31 0.00 -0.00 0.00 0.00 55.06 55.89 2dty s HIS 11 Cb -0.16 -3.68 -0.15 0.00 -0.00 0.00 0.00 32.58 28.59 2dty s HIS 11 CO 0.01 -0.78 1.05 0.94 -0.00 0.00 0.00 174.74 175.96 2dty n GLN 12 N 6.85 1.09 -2.90 -0.38 7.27 -1.26 -2.09 117.38 125.96 2dty n GLN 12 Ca 0.11 0.39 -0.04 0.00 0.07 0.00 0.00 57.00 57.53 2dty n GLN 12 Cb 0.47 -1.79 0.02 0.00 2.41 0.00 0.00 30.24 31.35 2dty n GLN 12 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2dty n ASN 13 N 1.74 -6.77 -4.80 1.69 5.03 -1.26 -4.99 115.26 105.90 2dty n ASN 13 Ca 0.14 -0.22 -0.36 0.00 0.87 0.00 0.00 54.58 55.01 2dty n ASN 13 Cb 0.27 -4.71 -0.07 0.00 -1.02 0.00 0.00 39.78 34.24 2dty n ASN 13 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 2dty s GLU 14 N -3.34 3.87 0.40 3.52 2.56 -0.89 -5.01 118.70 119.81 2dty s GLU 14 Ca 0.11 -0.12 0.21 0.00 0.00 0.00 0.00 54.97 55.17 2dty s GLU 14 Cb -0.01 -3.31 0.34 0.00 2.00 0.00 0.00 34.13 33.14 2dty s GLU 14 CO 0.65 0.51 1.59 1.05 -0.56 0.00 0.00 175.26 178.51 2dty h GLU 15 N 5.87 0.00 -0.01 4.30 4.11 -1.94 -3.28 114.58 123.62 2dty h GLU 15 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 2dty h GLU 15 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 2dty h GLU 15 CO 0.68 0.15 -0.05 1.04 0.07 0.00 0.00 179.01 180.89 2dty n GLN 16 N -3.14 1.48 -4.37 1.06 1.13 -1.26 -4.80 117.38 107.48 2dty n GLN 16 Ca 0.03 -0.85 -0.26 0.00 -1.94 0.00 0.00 57.00 53.98 2dty n GLN 16 Cb 0.57 -1.48 -0.10 0.00 0.11 0.00 0.00 30.24 29.34 2dty n GLN 16 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2dty s LEU 17 N -2.10 2.73 -0.30 1.08 1.43 -1.24 0.21 118.68 120.49 2dty s LEU 17 Ca 0.35 -0.75 0.02 0.00 -1.03 0.00 0.00 54.13 52.72 2dty s LEU 17 Cb 0.21 -1.40 0.09 0.00 0.03 0.00 0.00 46.19 45.11 2dty s LEU 17 CO 0.37 0.09 0.03 -0.54 0.23 0.00 0.00 176.35 176.54 2dty s LYS 18 N -2.92 1.33 0.08 1.70 -0.14 0.68 -4.68 119.74 115.79 2dty s LYS 18 Ca 0.24 -1.37 -0.18 0.00 -1.36 0.00 0.00 55.97 53.30 2dty s LYS 18 Cb -0.08 -2.67 -0.07 0.00 -1.68 0.00 0.00 37.83 33.34 2dty s LYS 18 CO 0.13 -0.84 0.56 -0.51 -0.76 0.00 0.00 175.35 173.93 2dty s LEU 19 N 1.25 4.49 0.02 3.17 1.02 -1.26 -1.26 118.68 126.11 2dty s LEU 19 Ca 0.05 1.22 0.03 0.00 0.02 0.00 0.00 54.13 55.45 2dty s LEU 19 Cb -0.18 -2.94 -0.02 0.00 0.02 0.00 0.00 46.19 43.07 2dty s LEU 19 CO -0.12 0.25 -0.10 -1.10 0.02 0.00 0.00 176.35 175.30 2dty s GLN 20 N -1.25 0.72 7.06 1.70 -0.21 -0.61 -4.99 119.66 122.07 2dty s GLN 20 Ca 0.30 -0.55 0.00 0.00 0.02 0.00 0.00 55.36 55.14 2dty s GLN 20 Cb -0.19 -0.66 0.00 0.00 1.00 0.00 0.00 33.01 33.16 2dty s GLN 20 CO 0.19 0.17 0.00 0.54 -2.12 0.00 0.00 175.29 174.06 2dty n ARG 21 N 2.25 0.00 0.00 2.91 5.12 -1.26 -2.19 116.66 123.49 2dty n ARG 21 Ca -0.17 0.00 0.07 0.00 -1.93 0.00 0.00 57.85 55.82 2dty n ARG 21 Cb 0.56 0.00 0.34 0.00 -1.16 0.00 0.00 32.46 32.20 2dty n ARG 21 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2dty n ASP 22 N 3.31 0.00 -4.75 0.55 9.92 -0.02 -4.84 116.55 120.72 2dty n ASP 22 Ca 0.00 0.28 -0.41 0.00 -0.53 0.00 0.00 54.79 54.13 2dty n ASP 22 Cb 0.00 -0.39 -0.02 0.00 -0.64 0.00 0.00 41.12 40.07 2dty n ASP 22 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dty s ALA 23 N -2.78 3.75 0.06 2.24 0.00 -1.04 -4.42 121.76 119.56 2dty s ALA 23 Ca 0.11 1.57 -0.26 0.00 0.00 0.00 0.00 51.96 53.37 2dty s ALA 23 Cb 0.10 -3.65 0.08 0.00 0.00 0.00 0.00 23.12 19.65 2dty s ALA 23 CO 0.24 -0.98 0.71 -0.98 0.00 0.00 0.00 175.76 174.76 2dty s ARG 24 N -0.47 1.08 -0.25 0.00 1.70 -0.74 -4.60 118.95 115.67 2dty s ARG 24 Ca 0.63 -0.24 -0.10 0.00 -0.47 0.00 0.00 55.73 55.55 2dty s ARG 24 Cb -0.48 0.50 -0.05 0.00 -0.57 0.00 0.00 34.95 34.36 2dty s ARG 24 CO 0.48 -0.44 0.15 0.42 -1.08 0.00 0.00 175.30 174.82 2dty s ILE 25 N -2.92 5.08 0.84 4.99 1.01 -1.26 -1.07 121.20 127.88 2dty s ILE 25 Ca -0.01 0.09 -0.11 0.00 0.00 0.00 0.00 60.65 60.62 2dty s ILE 25 Cb -0.01 -3.39 0.09 0.00 0.01 0.00 0.00 42.46 39.17 2dty s ILE 25 CO -0.07 0.32 1.09 -0.94 0.00 0.00 0.00 174.94 175.34 2dty s SER 26 N 1.38 4.05 0.46 3.58 1.04 -0.40 -4.85 113.70 118.96 2dty s SER 26 Ca 0.07 1.42 0.13 0.00 0.48 0.00 0.00 55.95 58.05 2dty s SER 26 Cb -0.15 -2.13 1.04 0.00 0.10 0.00 0.00 66.02 64.88 2dty s SER 26 CO 0.07 -2.27 2.04 0.77 0.98 0.00 0.00 173.24 174.83 2dty h SER 27 N -1.29 0.08 -0.50 7.02 4.64 -1.97 -2.64 113.55 118.90 2dty h SER 27 Ca -0.48 -0.01 -0.24 0.00 -0.47 0.00 0.00 61.79 60.59 2dty h SER 27 Cb 1.27 -0.02 -0.15 0.00 -0.31 0.00 0.00 62.40 63.19 2dty h SER 27 CO 0.57 0.17 0.31 -0.46 -0.87 0.00 0.00 176.83 176.55 2dty n ASN 28 N -4.40 3.40 0.00 4.97 6.94 -1.26 -4.91 115.26 120.00 2dty n ASN 28 Ca -0.02 -2.81 0.00 0.00 -0.02 0.00 0.00 54.58 51.74 2dty n ASN 28 Cb 0.18 -0.67 0.00 0.00 -2.36 0.00 0.00 39.78 36.93 2dty n ASN 28 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 2dty n SER 29 N -0.29 0.00 -4.87 0.53 2.88 -0.99 -4.99 113.62 105.88 2dty n SER 29 Ca 0.30 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.50 2dty n SER 29 Cb 1.08 -0.19 -0.05 0.00 -0.75 0.00 0.00 64.21 64.29 2dty n SER 29 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 2dty s VAL 30 N -3.58 5.07 -0.53 2.46 -7.23 -1.26 -1.01 120.40 114.33 2dty s VAL 30 Ca 0.00 0.40 -0.21 0.00 -1.81 0.00 0.00 61.98 60.36 2dty s VAL 30 Cb 0.00 -3.64 0.05 0.00 0.56 0.00 0.00 36.38 33.35 2dty s VAL 30 CO 0.00 0.20 0.76 -0.22 -0.31 0.00 0.00 175.10 175.53 2dty s LEU 31 N -2.16 4.60 -0.49 1.32 2.96 -0.92 -1.28 118.68 122.72 2dty s LEU 31 Ca 0.36 -0.68 -0.19 0.00 -0.22 0.00 0.00 54.13 53.40 2dty s LEU 31 Cb -0.13 -2.61 0.05 0.00 0.50 0.00 0.00 46.19 44.00 2dty s LEU 31 CO 0.20 -1.04 0.61 -1.61 -1.32 0.00 0.00 176.35 173.19 2dty s GLU 32 N 3.19 3.13 0.15 1.98 2.02 -0.23 -1.02 118.70 127.92 2dty s GLU 32 Ca 0.22 -0.84 -0.13 0.00 0.02 0.00 0.00 54.97 54.24 2dty s GLU 32 Cb -0.16 -4.08 0.02 0.00 0.10 0.00 0.00 34.13 30.01 2dty s GLU 32 CO 0.15 -1.17 1.61 -0.07 0.02 0.00 0.00 175.26 175.80 2dty h LEU 33 N 9.64 0.82 -9.47 1.80 3.38 -1.67 -1.97 115.31 117.84 2dty h LEU 33 Ca -0.27 -0.29 -0.62 0.00 0.09 0.00 0.00 57.88 56.79 2dty h LEU 33 Cb 1.10 -0.22 -0.12 0.00 0.09 0.00 0.00 40.66 41.51 2dty h LEU 33 CO 0.94 0.91 -0.67 0.42 0.09 0.00 0.00 178.44 180.13 2dty s THR 34 N -5.07 3.74 0.23 0.22 -4.23 -1.26 -2.97 115.64 106.29 2dty s THR 34 Ca -0.13 -1.32 -0.32 0.00 -1.18 0.00 0.00 61.69 58.74 2dty s THR 34 Cb 0.11 -2.85 -0.13 0.00 1.34 0.00 0.00 72.50 70.98 2dty s THR 34 CO 0.81 -0.04 1.55 1.17 -0.54 0.00 0.00 174.62 177.57 2dty n LYS 35 N 0.10 2.36 -3.63 3.99 4.81 -1.26 -4.79 118.16 119.73 2dty n LYS 35 Ca -0.10 0.84 -0.20 0.00 -0.87 0.00 0.00 58.31 57.99 2dty n LYS 35 Cb 0.54 -2.59 -0.16 0.00 0.02 0.00 0.00 35.03 32.84 2dty n LYS 35 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2dty s VAL 36 N 0.42 -0.21 -0.17 3.15 0.11 -1.26 -1.86 120.40 120.58 2dty s VAL 36 Ca 0.71 0.19 -0.01 0.00 -2.93 0.00 0.00 61.98 59.94 2dty s VAL 36 Cb -0.60 -0.38 -0.01 0.00 -1.53 0.00 0.00 36.38 33.87 2dty s VAL 36 CO 0.43 0.01 -0.11 0.68 -3.33 0.00 0.00 175.10 172.79 2dty s VAL 37 N 2.24 3.05 -1.36 2.04 -7.23 0.10 -4.63 120.40 114.62 2dty s VAL 37 Ca 0.04 -0.63 -0.07 0.00 -1.81 0.00 0.00 61.98 59.51 2dty s VAL 37 Cb -0.13 -2.33 0.02 0.00 0.56 0.00 0.00 36.38 34.50 2dty s VAL 37 CO -0.07 0.49 1.07 0.59 -0.31 0.00 0.00 175.10 176.87 2dty n ASN 38 N 4.14 -4.73 -0.37 4.85 5.03 -1.26 -1.45 115.26 121.46 2dty n ASN 38 Ca -0.18 -0.63 -0.05 0.00 0.87 0.00 0.00 54.58 54.59 2dty n ASN 38 Cb 0.52 -4.75 -0.02 0.00 -1.02 0.00 0.00 39.78 34.50 2dty n ASN 38 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2dty n GLY 39 N -1.73 0.71 3.09 7.41 0.00 -1.26 -5.00 105.19 108.40 2dty n GLY 39 Ca -0.07 -0.32 -0.30 0.00 0.00 0.00 0.00 46.02 45.33 2dty n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dty s VAL 40 N -1.97 1.66 0.19 1.61 1.01 -0.53 -5.11 120.40 117.26 2dty s VAL 40 Ca 0.00 -0.75 -0.30 0.00 0.00 0.00 0.00 61.98 60.93 2dty s VAL 40 Cb 0.00 -1.50 -0.08 0.00 0.00 0.00 0.00 36.38 34.80 2dty s VAL 40 CO 0.00 0.47 1.17 -2.16 0.00 0.00 0.00 175.10 174.58 2dty s PRO 41 N 0.89 4.52 0.29 2.72 0.04 -1.26 0.00 135.00 142.21 2dty s PRO 41 Ca -0.08 1.83 0.04 0.00 0.04 0.00 0.00 61.00 62.83 2dty s PRO 41 Cb -0.15 -3.25 -0.03 0.00 0.04 0.00 0.00 34.50 31.12 2dty s PRO 41 CO -0.01 -0.03 0.44 0.99 0.04 0.00 0.00 177.00 178.43 2dty s THR 42 N -0.16 4.94 0.59 1.26 2.01 -0.78 -4.76 115.64 118.74 2dty s THR 42 Ca 0.51 -0.85 0.01 0.00 0.31 0.00 0.00 61.69 61.68 2dty s THR 42 Cb -0.32 -3.76 0.11 0.00 0.01 0.00 0.00 72.50 68.55 2dty s THR 42 CO 0.36 -0.35 0.81 -2.67 -0.69 0.00 0.00 174.62 172.08 2dty n TRP 43 N -1.57 -2.92 -3.36 4.92 4.27 -1.26 -4.46 117.44 113.06 2dty n TRP 43 Ca -0.06 -1.51 -0.24 0.00 -3.89 0.00 0.00 57.50 51.80 2dty n TRP 43 Cb 0.57 -0.59 0.01 0.00 -1.36 0.00 0.00 31.31 29.95 2dty n TRP 43 CO 0.00 0.00 0.00 -1.71 -2.29 0.00 0.00 177.69 173.69 2dty n ASN 44 N -2.85 -4.64 -4.38 -0.67 5.15 0.14 -4.92 115.26 103.10 2dty n ASN 44 Ca 0.14 -0.42 -0.32 0.00 -0.60 0.00 0.00 54.58 53.38 2dty n ASN 44 Cb 0.49 -3.78 -0.15 0.00 -0.53 0.00 0.00 39.78 35.82 2dty n ASN 44 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2dty s SER 45 N -2.82 3.46 -0.10 1.20 0.15 -1.26 -5.00 113.70 109.33 2dty s SER 45 Ca 0.42 -0.36 -0.05 0.00 0.70 0.00 0.00 55.95 56.66 2dty s SER 45 Cb -0.21 -0.58 0.04 0.00 -1.71 0.00 0.00 66.02 63.56 2dty s SER 45 CO 0.52 0.33 0.23 -0.89 1.20 0.00 0.00 173.24 174.62 2dty s THR 46 N -0.63 -0.04 0.03 6.45 2.01 -1.26 -1.51 115.64 120.69 2dty s THR 46 Ca 0.10 0.15 -0.14 0.00 0.31 0.00 0.00 61.69 62.11 2dty s THR 46 Cb -0.10 -0.35 0.02 0.00 0.01 0.00 0.00 72.50 72.07 2dty s THR 46 CO -0.00 0.06 0.30 -0.83 -0.69 0.00 0.00 174.62 173.46 2dty s GLY 47 N 1.20 -0.12 0.07 4.40 0.00 -1.13 -0.84 107.32 110.90 2dty s GLY 47 Ca -0.09 0.07 -0.01 0.00 0.00 0.00 0.00 44.72 44.70 2dty s GLY 47 CO -0.08 -0.14 -0.02 0.50 0.00 0.00 0.00 173.10 173.37 2dty s ARG 48 N -2.26 0.68 -0.10 2.90 0.52 -0.93 -2.00 118.95 117.76 2dty s ARG 48 Ca -0.07 -1.27 -0.04 0.00 -0.52 0.00 0.00 55.73 53.83 2dty s ARG 48 Cb -0.02 0.19 0.05 0.00 0.52 0.00 0.00 34.95 35.69 2dty s ARG 48 CO -0.01 -0.13 0.20 0.00 0.02 0.00 0.00 175.30 175.38 2dty s ALA 49 N -3.92 -0.34 0.12 2.13 0.00 -0.61 -1.58 121.76 117.55 2dty s ALA 49 Ca 0.10 0.73 0.09 0.00 0.00 0.00 0.00 51.96 52.89 2dty s ALA 49 Cb 0.08 -0.88 -0.04 0.00 0.00 0.00 0.00 23.12 22.28 2dty s ALA 49 CO -0.08 -0.57 -0.20 -0.51 0.00 0.00 0.00 175.76 174.40 2dty s LEU 50 N 2.27 2.59 0.02 0.00 2.01 -0.39 -1.51 118.68 123.66 2dty s LEU 50 Ca 0.01 -0.60 -0.30 0.00 0.01 0.00 0.00 54.13 53.25 2dty s LEU 50 Cb -0.12 -1.46 -0.05 0.00 0.01 0.00 0.00 46.19 44.57 2dty s LEU 50 CO -0.07 0.18 1.33 -0.47 1.01 0.00 0.00 176.35 178.34 2dty s TYR 51 N -1.11 3.06 0.32 0.29 5.04 -0.82 -0.23 117.35 123.90 2dty s TYR 51 Ca 0.17 0.98 0.10 0.00 -2.44 0.00 0.00 57.07 55.88 2dty s TYR 51 Cb -0.10 -3.59 0.92 0.00 0.35 0.00 0.00 41.96 39.54 2dty s TYR 51 CO 0.09 -2.06 1.71 0.00 -1.34 0.00 0.00 175.55 173.95 2dty h ALA 52 N 7.47 1.79 -2.70 3.97 0.00 0.23 -3.42 119.26 126.59 2dty h ALA 52 Ca -0.38 0.15 -0.63 0.00 0.00 0.00 0.00 54.91 54.04 2dty h ALA 52 Cb 1.19 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.99 2dty h ALA 52 CO 0.88 -0.35 -0.38 0.15 0.00 0.00 0.00 179.25 179.55 2dty s LYS 53 N -5.76 3.59 0.59 0.00 1.02 -1.26 -5.01 119.74 112.91 2dty s LYS 53 Ca -0.11 -0.03 -0.15 0.00 0.02 0.00 0.00 55.97 55.70 2dty s LYS 53 Cb 0.28 -3.11 -0.04 0.00 -0.52 0.00 0.00 37.83 34.43 2dty s LYS 53 CO 0.79 0.67 1.04 -1.25 -0.92 0.00 0.00 175.35 175.69 2dty s PRO 54 N -1.57 3.42 0.07 -1.68 0.04 -1.26 -4.86 135.00 129.15 2dty s PRO 54 Ca 0.25 1.11 0.09 0.00 0.04 0.00 0.00 61.00 62.50 2dty s PRO 54 Cb -0.13 -2.05 -0.03 0.00 0.04 0.00 0.00 34.50 32.32 2dty s PRO 54 CO 0.14 -0.72 -0.25 0.14 0.04 0.00 0.00 177.00 176.34 2dty s VAL 55 N -2.57 2.27 -0.42 -0.36 -7.23 -0.53 -4.94 120.40 106.61 2dty s VAL 55 Ca 0.62 -1.47 -0.17 0.00 -1.81 0.00 0.00 61.98 59.14 2dty s VAL 55 Cb -0.14 -1.93 0.02 0.00 0.56 0.00 0.00 36.38 34.89 2dty s VAL 55 CO 0.38 0.28 0.45 -1.58 -0.31 0.00 0.00 175.10 174.32 2dty s GLN 56 N -1.51 3.10 0.35 4.82 0.74 -1.26 -1.33 119.66 124.57 2dty s GLN 56 Ca 0.13 -0.76 0.22 0.00 0.05 0.00 0.00 55.36 55.00 2dty s GLN 56 Cb -0.10 -3.97 0.21 0.00 1.10 0.00 0.00 33.01 30.25 2dty s GLN 56 CO 0.04 -0.87 1.42 -0.39 -0.55 0.00 0.00 175.29 174.93 2dty h VAL 57 N 5.74 0.07 -2.80 1.34 -1.51 -1.44 -3.45 116.25 114.19 2dty h VAL 57 Ca -0.26 -1.10 -0.04 0.00 -1.23 0.00 0.00 66.70 64.06 2dty h VAL 57 Cb 1.11 1.88 -0.15 0.00 -2.13 0.00 0.00 31.29 32.01 2dty h VAL 57 CO 0.80 0.04 0.11 -1.66 -1.23 0.00 0.00 177.57 175.64 2dty s TRP 58 N -3.23 -0.48 -0.20 5.19 1.48 -1.21 0.85 118.94 121.33 2dty s TRP 58 Ca 0.04 0.46 0.01 0.00 -1.06 0.00 0.00 56.10 55.56 2dty s TRP 58 Cb 0.07 0.42 0.03 0.00 -1.16 0.00 0.00 33.47 32.83 2dty s TRP 58 CO 0.71 -0.72 -0.16 0.34 -4.06 0.00 0.00 176.95 173.06 2dty s ASP 59 N -2.22 3.56 0.49 -2.66 2.15 -0.61 -4.65 116.67 112.72 2dty s ASP 59 Ca -0.03 -0.83 0.20 0.00 0.43 0.00 0.00 52.55 52.32 2dty s ASP 59 Cb -0.00 -1.52 1.23 0.00 -0.30 0.00 0.00 42.92 42.33 2dty s ASP 59 CO -0.05 -0.05 2.04 0.77 -0.17 0.00 0.00 175.17 177.71 2dty h SER 60 N 7.91 0.00 0.04 -0.34 4.64 -1.93 0.73 113.55 124.60 2dty h SER 60 Ca -0.39 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.93 2dty h SER 60 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 2dty h SER 60 CO 0.59 0.14 -0.02 0.74 -0.87 0.00 0.00 176.83 177.42 2dty h THR 61 N 0.00 1.10 0.00 2.95 2.02 -1.97 -3.28 112.91 113.73 2dty h THR 61 Ca -0.00 -0.44 0.00 0.00 0.77 0.00 0.00 66.41 66.74 2dty h THR 61 Cb 0.29 1.40 0.00 0.00 -1.74 0.00 0.00 68.15 68.10 2dty h THR 61 CO 0.02 0.11 -1.42 0.35 0.37 0.00 0.00 175.52 174.95 2dty n THR 62 N -5.02 0.08 -0.73 3.16 -2.24 -1.16 -4.97 114.28 103.40 2dty n THR 62 Ca -0.08 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 2dty n THR 62 Cb 0.13 0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.65 2dty n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dty n GLY 63 N 1.35 1.32 3.77 3.38 0.00 0.25 -5.00 105.19 110.27 2dty n GLY 63 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2dty n GLY 63 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2dty s ASN 64 N -3.11 6.28 0.06 1.61 0.02 -1.20 -4.81 114.94 113.78 2dty s ASN 64 Ca 0.00 2.26 0.07 0.00 -1.02 0.00 0.00 52.86 54.17 2dty s ASN 64 Cb 0.00 -2.60 -0.04 0.00 0.02 0.00 0.00 41.25 38.64 2dty s ASN 64 CO 0.00 -0.84 -0.15 -0.69 0.02 0.00 0.00 177.10 175.44 2dty s VAL 65 N -1.57 3.00 0.45 1.60 1.01 -1.26 -1.58 120.40 122.06 2dty s VAL 65 Ca 0.62 -1.22 -0.14 0.00 0.00 0.00 0.00 61.98 61.24 2dty s VAL 65 Cb -0.27 -2.32 -0.08 0.00 0.00 0.00 0.00 36.38 33.71 2dty s VAL 65 CO 0.33 0.25 0.88 0.00 0.00 0.00 0.00 175.10 176.57 2dty s ALA 66 N -1.03 3.19 0.03 5.51 0.00 0.25 -4.67 121.76 125.04 2dty s ALA 66 Ca 0.17 0.04 0.04 0.00 0.00 0.00 0.00 51.96 52.20 2dty s ALA 66 Cb -0.11 -2.93 -0.04 0.00 0.00 0.00 0.00 23.12 20.04 2dty s ALA 66 CO 0.08 -0.08 -0.06 -1.12 0.00 0.00 0.00 175.76 174.58 2dty s SER 67 N -2.99 4.66 0.12 0.00 0.01 -0.98 -4.40 113.70 110.13 2dty s SER 67 Ca 0.56 -0.18 -0.10 0.00 1.31 0.00 0.00 55.95 57.54 2dty s SER 67 Cb -0.10 -1.07 0.00 0.00 0.21 0.00 0.00 66.02 65.06 2dty s SER 67 CO 0.29 0.26 0.26 0.72 0.41 0.00 0.00 173.24 175.18 2dty s PHE 68 N -1.07 0.17 -0.01 2.43 -0.12 -0.80 -0.67 117.98 117.92 2dty s PHE 68 Ca 0.19 -0.56 0.00 0.00 -0.05 0.00 0.00 56.93 56.51 2dty s PHE 68 Cb -0.11 0.00 0.01 0.00 -0.63 0.00 0.00 43.02 42.29 2dty s PHE 68 CO 0.10 -0.64 0.01 -2.00 -0.05 0.00 0.00 175.22 172.64 2dty s GLU 69 N -3.89 0.02 -0.01 1.99 2.12 0.35 -0.72 118.70 118.56 2dty s GLU 69 Ca 0.09 0.05 -0.01 0.00 0.36 0.00 0.00 54.97 55.46 2dty s GLU 69 Cb 0.04 -0.11 0.01 0.00 0.26 0.00 0.00 34.13 34.33 2dty s GLU 69 CO -0.07 -0.05 0.03 -0.08 -0.54 0.00 0.00 175.26 174.55 2dty s THR 70 N 0.35 -0.01 0.01 -1.70 -1.32 0.12 -0.94 115.64 112.15 2dty s THR 70 Ca -0.03 0.02 0.04 0.00 -1.21 0.00 0.00 61.69 60.52 2dty s THR 70 Cb -0.04 -0.06 -0.01 0.00 -1.51 0.00 0.00 72.50 70.87 2dty s THR 70 CO -0.01 0.01 -0.13 -0.13 -2.21 0.00 0.00 174.62 172.15 2dty s ARG 71 N 0.14 1.00 0.17 7.08 0.52 -0.62 -0.69 118.95 126.56 2dty s ARG 71 Ca -0.01 -0.57 -0.20 0.00 -0.52 0.00 0.00 55.73 54.42 2dty s ARG 71 Cb -0.02 -0.98 0.05 0.00 0.52 0.00 0.00 34.95 34.52 2dty s ARG 71 CO -0.00 0.26 0.55 -0.59 0.02 0.00 0.00 175.30 175.53 2dty s PHE 72 N -0.51 -0.35 -0.05 -0.53 -0.71 -0.82 -0.75 117.98 114.26 2dty s PHE 72 Ca 0.04 0.07 0.05 0.00 -1.04 0.00 0.00 56.93 56.04 2dty s PHE 72 Cb -0.06 0.47 -0.00 0.00 -1.21 0.00 0.00 43.02 42.21 2dty s PHE 72 CO 0.00 -0.86 -0.19 -1.12 -1.34 0.00 0.00 175.22 171.71 2dty s SER 73 N -2.80 2.38 0.29 1.98 0.01 -0.83 -0.82 113.70 113.91 2dty s SER 73 Ca 0.04 -0.39 0.02 0.00 1.31 0.00 0.00 55.95 56.93 2dty s SER 73 Cb -0.01 -0.70 -0.05 0.00 0.21 0.00 0.00 66.02 65.48 2dty s SER 73 CO -0.09 0.17 0.11 0.72 0.41 0.00 0.00 173.24 174.56 2dty s PHE 74 N 0.04 1.61 -0.12 2.43 -0.12 -0.93 0.72 117.98 121.61 2dty s PHE 74 Ca -0.05 -1.23 -0.09 0.00 -0.05 0.00 0.00 56.93 55.52 2dty s PHE 74 Cb -0.12 -0.94 0.04 0.00 -0.63 0.00 0.00 43.02 41.37 2dty s PHE 74 CO 0.03 -0.36 0.31 0.45 -0.05 0.00 0.00 175.22 175.60 2dty s SER 75 N -3.37 -0.34 -0.20 1.98 0.15 0.43 -1.57 113.70 110.79 2dty s SER 75 Ca 0.36 0.65 0.01 0.00 0.70 0.00 0.00 55.95 57.67 2dty s SER 75 Cb 0.07 0.59 0.04 0.00 -1.71 0.00 0.00 66.02 65.01 2dty s SER 75 CO 0.15 -0.14 -0.11 -0.63 1.20 0.00 0.00 173.24 173.70 2dty s ILE 76 N 0.79 1.72 -0.18 6.45 1.01 -1.26 -1.32 121.20 128.41 2dty s ILE 76 Ca -0.05 -1.05 -0.08 0.00 0.00 0.00 0.00 60.65 59.47 2dty s ILE 76 Cb -0.06 -1.77 -0.04 0.00 0.01 0.00 0.00 42.46 40.59 2dty s ILE 76 CO -0.05 0.19 0.08 -0.60 0.00 0.00 0.00 174.94 174.56 2dty s ARG 77 N 1.36 3.99 -0.77 2.79 3.52 -1.25 -1.62 118.95 126.97 2dty s ARG 77 Ca -0.01 -0.30 -0.00 0.00 -0.13 0.00 0.00 55.73 55.28 2dty s ARG 77 Cb -0.16 -3.26 0.19 0.00 -1.56 0.00 0.00 34.95 30.16 2dty s ARG 77 CO -0.08 0.32 0.62 -0.65 -0.81 0.00 0.00 175.30 174.69 2dty s GLN 78 N 0.26 2.88 0.15 5.12 -0.21 -1.26 -1.45 119.66 125.16 2dty s GLN 78 Ca 0.05 -3.09 -0.17 0.00 0.02 0.00 0.00 55.36 52.17 2dty s GLN 78 Cb -0.12 -3.77 0.05 0.00 1.00 0.00 0.00 33.01 30.18 2dty s GLN 78 CO -0.00 -1.24 1.72 -1.35 -2.12 0.00 0.00 175.29 172.29 2dty h PRO 79 N 6.15 0.12 -4.00 2.91 0.11 -1.96 -3.37 132.00 131.96 2dty h PRO 79 Ca 0.10 -0.01 -0.77 0.00 0.11 0.00 0.00 66.00 65.43 2dty h PRO 79 Cb 0.84 -0.03 -0.25 0.00 0.11 0.00 0.00 31.00 31.67 2dty h PRO 79 CO 0.78 0.08 -0.08 -0.06 -0.21 0.00 0.00 178.00 178.51 2dty s PHE 80 N -6.18 3.45 -0.74 0.65 0.08 -1.26 -4.93 117.98 109.06 2dty s PHE 80 Ca -0.13 -1.57 0.13 0.00 0.12 0.00 0.00 56.93 55.48 2dty s PHE 80 Cb 0.12 -3.81 0.62 0.00 -0.57 0.00 0.00 43.02 39.37 2dty s PHE 80 CO 0.70 -1.01 1.42 -0.35 -0.10 0.00 0.00 175.22 175.87 2dty n PRO 81 N 4.76 0.07 -4.16 0.24 -0.04 -1.26 -4.39 135.00 130.22 2dty n PRO 81 Ca -0.03 0.44 -0.15 0.00 -0.04 0.00 0.00 63.50 63.72 2dty n PRO 81 Cb 0.43 -1.67 -0.13 0.00 -0.04 0.00 0.00 33.50 32.09 2dty n PRO 81 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2dty s ARG 82 N -3.17 0.55 0.07 0.54 1.81 -1.26 -4.42 118.95 113.06 2dty s ARG 82 Ca 0.03 -0.50 -0.06 0.00 -1.72 0.00 0.00 55.73 53.47 2dty s ARG 82 Cb 0.06 -0.45 -0.29 0.00 -0.45 0.00 0.00 34.95 33.82 2dty s ARG 82 CO 0.20 0.11 1.13 -1.35 -0.68 0.00 0.00 175.30 174.70 2dty h PRO 83 N 5.26 0.32 -1.47 3.54 0.11 -1.86 -3.46 132.00 134.44 2dty h PRO 83 Ca -0.33 -0.54 0.12 0.00 0.11 0.00 0.00 66.00 65.37 2dty h PRO 83 Cb 1.19 0.20 -0.23 0.00 0.11 0.00 0.00 31.00 32.28 2dty h PRO 83 CO 0.45 1.25 0.11 -3.38 -0.21 0.00 0.00 178.00 176.23 2dty s HIS 84 N -2.67 -0.92 0.75 0.65 -3.43 -1.26 -5.12 115.29 103.29 2dty s HIS 84 Ca -0.05 1.63 -0.12 0.00 -0.80 0.00 0.00 55.06 55.72 2dty s HIS 84 Cb 0.07 0.55 0.05 0.00 -1.43 0.00 0.00 32.58 31.82 2dty s HIS 84 CO 0.89 -0.46 1.11 -2.14 -2.00 0.00 0.00 174.74 172.15 2dty s PRO 85 N 2.42 2.26 -0.06 -0.38 0.02 -1.26 -3.93 135.00 134.08 2dty s PRO 85 Ca -0.05 1.34 -0.30 0.00 0.02 0.00 0.00 61.00 62.01 2dty s PRO 85 Cb -0.08 -1.89 0.11 0.00 0.02 0.00 0.00 34.50 32.67 2dty s PRO 85 CO -0.18 -1.66 0.93 0.00 -0.33 0.00 0.00 177.00 175.76 2dty s ALA 86 N -2.61 -1.87 -0.05 -1.55 0.00 -1.26 -4.19 121.76 110.23 2dty s ALA 86 Ca 0.65 1.22 0.06 0.00 0.00 0.00 0.00 51.96 53.89 2dty s ALA 86 Cb -0.20 0.06 -0.09 0.00 0.00 0.00 0.00 23.12 22.89 2dty s ALA 86 CO 0.51 -0.57 0.06 -0.25 0.00 0.00 0.00 175.76 175.52 2dty n ASP 87 N 0.08 3.33 0.00 0.00 9.92 0.19 -3.27 116.55 126.80 2dty n ASP 87 Ca -0.09 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.17 2dty n ASP 87 Cb 0.60 0.87 0.00 0.00 -0.64 0.00 0.00 41.12 41.95 2dty n ASP 87 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2dty n GLY 88 N 2.43 0.96 3.18 0.44 0.00 -1.17 -1.23 105.19 109.80 2dty n GLY 88 Ca -0.08 -2.01 -0.12 0.00 0.00 0.00 0.00 46.02 43.82 2dty n GLY 88 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2dty s LEU 89 N 0.00 2.49 0.03 0.99 0.05 -0.98 -2.21 118.68 119.06 2dty s LEU 89 Ca 0.00 -0.97 -0.03 0.00 0.05 0.00 0.00 54.13 53.18 2dty s LEU 89 Cb 0.00 -0.14 -0.02 0.00 -2.05 0.00 0.00 46.19 43.99 2dty s LEU 89 CO 0.00 -0.41 0.04 0.68 -0.55 0.00 0.00 176.35 176.10 2dty s VAL 90 N -3.36 0.14 -0.14 1.48 -7.23 0.70 -1.11 120.40 110.88 2dty s VAL 90 Ca 0.11 -1.15 -0.05 0.00 -1.81 0.00 0.00 61.98 59.07 2dty s VAL 90 Cb 0.03 -0.81 -0.04 0.00 0.56 0.00 0.00 36.38 36.13 2dty s VAL 90 CO -0.03 -0.64 0.04 0.12 -0.31 0.00 0.00 175.10 174.28 2dty s PHE 91 N -2.46 3.25 0.13 2.82 5.36 -0.37 -1.50 117.98 125.20 2dty s PHE 91 Ca -0.06 0.13 -0.07 0.00 -0.96 0.00 0.00 56.93 55.97 2dty s PHE 91 Cb -0.02 -1.96 -0.02 0.00 -0.34 0.00 0.00 43.02 40.69 2dty s PHE 91 CO -0.04 0.31 0.19 -0.59 -1.46 0.00 0.00 175.22 173.63 2dty s PHE 92 N -0.22 0.44 -0.08 10.12 -0.71 0.21 -0.43 117.98 127.32 2dty s PHE 92 Ca 0.07 -0.84 0.02 0.00 -1.04 0.00 0.00 56.93 55.13 2dty s PHE 92 Cb -0.12 -0.17 0.01 0.00 -1.21 0.00 0.00 43.02 41.53 2dty s PHE 92 CO 0.02 -0.61 -0.13 0.42 -1.34 0.00 0.00 175.22 173.59 2dty s ILE 93 N -3.95 1.21 0.28 -4.49 1.01 0.18 -1.75 121.20 113.70 2dty s ILE 93 Ca 0.15 -0.50 -0.08 0.00 0.00 0.00 0.00 60.65 60.21 2dty s ILE 93 Cb 0.05 -1.12 -0.00 0.00 0.01 0.00 0.00 42.46 41.40 2dty s ILE 93 CO -0.03 0.38 0.46 0.00 0.00 0.00 0.00 174.94 175.75 2dty s ALA 94 N 0.84 0.20 0.68 9.38 0.00 -0.84 -1.63 121.76 130.39 2dty s ALA 94 Ca -0.11 -1.16 -0.16 0.00 0.00 0.00 0.00 51.96 50.53 2dty s ALA 94 Cb -0.15 1.10 0.01 0.00 0.00 0.00 0.00 23.12 24.08 2dty s ALA 94 CO 0.02 -0.82 1.22 -2.14 0.00 0.00 0.00 175.76 174.03 2dty s PRO 95 N -3.60 2.42 0.60 0.00 0.02 -1.26 -0.74 135.00 132.44 2dty s PRO 95 Ca 0.26 1.80 -0.17 0.00 0.02 0.00 0.00 61.00 62.91 2dty s PRO 95 Cb -0.00 -1.86 -0.03 0.00 0.02 0.00 0.00 34.50 32.63 2dty s PRO 95 CO 0.13 -1.63 1.12 -1.25 -0.33 0.00 0.00 177.00 175.04 2dty s PRO 96 N -3.71 3.07 -0.94 5.54 0.04 -1.26 -3.92 135.00 133.82 2dty s PRO 96 Ca 0.76 1.52 -0.06 0.00 0.04 0.00 0.00 61.00 63.26 2dty s PRO 96 Cb -0.30 -1.98 0.01 0.00 0.04 0.00 0.00 34.50 32.27 2dty s PRO 96 CO 0.42 -1.06 0.82 0.27 0.04 0.00 0.00 177.00 177.49 2dty n ASN 97 N -1.83 -4.77 -4.95 6.66 6.94 -1.26 -5.04 115.26 111.01 2dty n ASN 97 Ca 0.11 -0.39 -0.23 0.00 -0.02 0.00 0.00 54.58 54.05 2dty n ASN 97 Cb 0.51 -3.70 -0.01 0.00 -2.36 0.00 0.00 39.78 34.22 2dty n ASN 97 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2dty s THR 98 N -3.23 5.13 0.21 5.53 -4.23 -1.25 -5.11 115.64 112.68 2dty s THR 98 Ca 0.37 -0.60 0.06 0.00 -1.18 0.00 0.00 61.69 60.34 2dty s THR 98 Cb -0.16 -3.86 -0.04 0.00 1.34 0.00 0.00 72.50 69.79 2dty s THR 98 CO 0.51 -0.50 0.19 -1.10 -0.54 0.00 0.00 174.62 173.19 2dty s GLN 99 N -4.23 2.99 0.22 3.99 -1.52 -1.26 -5.06 119.66 114.79 2dty s GLN 99 Ca 0.39 -0.92 -0.32 0.00 -1.95 0.00 0.00 55.36 52.55 2dty s GLN 99 Cb -0.09 -2.65 -0.12 0.00 -0.22 0.00 0.00 33.01 29.92 2dty s GLN 99 CO 0.34 0.45 1.65 2.41 -0.25 0.00 0.00 175.29 179.89 2dty n THR 100 N -0.81 0.27 -0.78 -0.19 -1.04 -1.26 -4.96 114.28 105.50 2dty n THR 100 Ca -0.08 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 61.86 2dty n THR 100 Cb 0.56 -1.86 0.00 0.00 -1.82 0.00 0.00 70.33 67.21 2dty n THR 100 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2dty n GLY 101 N 3.38 0.24 3.75 3.41 0.00 0.51 -4.98 105.19 111.50 2dty n GLY 101 Ca 0.14 -1.79 -0.37 0.00 0.00 0.00 0.00 46.02 44.01 2dty n GLY 101 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dty s GLU 102 N 1.03 3.03 0.00 1.61 2.56 0.49 -4.52 118.70 122.91 2dty s GLU 102 Ca 0.00 2.05 0.00 0.00 0.00 0.00 0.00 54.97 57.02 2dty s GLU 102 Cb 0.00 -2.10 0.00 0.00 2.00 0.00 0.00 34.13 34.03 2dty s GLU 102 CO 0.00 -1.22 0.00 0.41 -0.56 0.00 0.00 175.26 173.89 2dty n GLY 103 N 0.69 1.39 7.00 -1.50 0.00 -1.26 -0.22 105.19 111.29 2dty n GLY 103 Ca 0.12 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.43 2dty n GLY 103 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dty n GLY 104 N 5.00 3.01 0.00 -0.02 0.00 -1.26 -1.80 105.19 110.12 2dty n GLY 104 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.74 2dty n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dty n GLY 105 N 0.00 -0.48 0.62 -0.02 0.00 -1.26 -1.28 105.19 102.77 2dty n GLY 105 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 2dty n GLY 105 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2dty n TYR 106 N -1.48 0.01 -0.56 1.61 4.01 -0.75 -4.95 117.16 115.05 2dty n TYR 106 Ca 0.00 -0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 2dty n TYR 106 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 2dty n TYR 106 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2dty n PHE 107 N 0.51 0.00 -0.69 -0.72 3.72 -0.40 -1.75 117.46 118.12 2dty n PHE 107 Ca 0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.58 2dty n PHE 107 Cb 0.42 -1.44 0.00 0.00 -0.94 0.00 0.00 39.48 37.52 2dty n PHE 107 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dty n GLY 108 N -0.28 0.64 0.00 1.37 0.00 0.70 -3.54 105.19 104.08 2dty n GLY 108 Ca 0.00 -0.11 0.03 0.00 0.00 0.00 0.00 46.02 45.94 2dty n GLY 108 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2dty n ILE 109 N -2.69 0.00 -4.36 -0.61 -5.35 -0.72 -0.36 119.36 105.27 2dty n ILE 109 Ca 0.00 -0.25 -0.34 0.00 -0.27 0.00 0.00 62.75 61.89 2dty n ILE 109 Cb 0.00 0.68 -0.11 0.00 -1.74 0.00 0.00 39.64 38.47 2dty n ILE 109 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 2dty s TYR 110 N -1.99 3.09 -0.31 4.28 5.04 -1.20 -4.74 117.35 121.53 2dty s TYR 110 Ca -0.00 -0.05 -0.00 0.00 -2.44 0.00 0.00 57.07 54.58 2dty s TYR 110 Cb 0.04 -1.89 0.10 0.00 0.35 0.00 0.00 41.96 40.56 2dty s TYR 110 CO 0.25 0.20 0.09 1.21 -1.34 0.00 0.00 175.55 175.96 2dty s ASN 111 N -0.18 4.05 0.38 4.32 3.04 -1.26 -0.38 114.94 124.91 2dty s ASN 111 Ca 0.04 -1.64 0.14 0.00 0.04 0.00 0.00 52.86 51.45 2dty s ASN 111 Cb -0.13 -0.93 0.97 0.00 -1.54 0.00 0.00 41.25 39.63 2dty s ASN 111 CO 0.02 -0.40 1.83 -0.65 -3.04 0.00 0.00 177.10 174.86 2dty h PRO 112 N 8.05 0.51 0.27 0.43 0.11 -1.99 -0.97 132.00 138.41 2dty h PRO 112 Ca -0.13 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.94 2dty h PRO 112 Cb 1.02 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.02 2dty h PRO 112 CO 0.47 0.34 -0.13 -0.07 -0.21 0.00 0.00 178.00 178.39 2dty h LEU 113 N 0.52 -0.31 -6.45 2.35 -0.00 -2.06 -3.39 115.31 105.98 2dty h LEU 113 Ca 0.51 -0.21 -0.60 0.00 -0.00 0.00 0.00 57.88 57.58 2dty h LEU 113 Cb 1.09 0.08 -0.41 0.00 -0.00 0.00 0.00 40.66 41.42 2dty h LEU 113 CO -0.24 0.17 -0.71 -1.54 -0.00 0.00 0.00 178.44 176.12 2dty n SER 114 N -5.04 2.53 -4.77 -0.43 3.41 -1.11 -5.10 113.62 103.11 2dty n SER 114 Ca -0.08 -3.14 -0.41 0.00 -0.26 0.00 0.00 58.87 54.98 2dty n SER 114 Cb 0.26 -0.68 -0.02 0.00 -0.26 0.00 0.00 64.21 63.50 2dty n SER 114 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2dty s PRO 115 N -1.70 4.37 0.13 4.33 0.04 -0.38 -4.76 135.00 137.04 2dty s PRO 115 Ca 0.34 2.18 0.11 0.00 0.04 0.00 0.00 61.00 63.67 2dty s PRO 115 Cb 0.08 -3.09 -0.04 0.00 0.04 0.00 0.00 34.50 31.50 2dty s PRO 115 CO -0.10 -0.17 -0.25 1.52 0.04 0.00 0.00 177.00 178.04 2dty s TYR 116 N -1.04 2.21 0.72 0.56 -0.85 -1.26 -5.05 117.35 112.63 2dty s TYR 116 Ca 0.49 -0.39 -0.13 0.00 -0.52 0.00 0.00 57.07 56.52 2dty s TYR 116 Cb -0.39 -1.18 0.03 0.00 0.38 0.00 0.00 41.96 40.80 2dty s TYR 116 CO 0.51 0.34 1.12 -1.25 -1.52 0.00 0.00 175.55 174.75 2dty s PRO 117 N -2.12 2.43 -0.17 -3.49 0.04 -1.26 -4.94 135.00 125.49 2dty s PRO 117 Ca 0.14 1.40 -0.31 0.00 0.04 0.00 0.00 61.00 62.27 2dty s PRO 117 Cb -0.10 -1.90 0.14 0.00 0.04 0.00 0.00 34.50 32.68 2dty s PRO 117 CO 0.06 -1.54 1.08 -0.59 0.04 0.00 0.00 177.00 176.06 2dty s PHE 118 N -2.45 -0.27 -0.12 0.56 -0.12 -1.26 -4.18 117.98 110.15 2dty s PHE 118 Ca 0.67 0.38 0.03 0.00 -0.05 0.00 0.00 56.93 57.96 2dty s PHE 118 Cb -0.21 0.48 0.00 0.00 -0.63 0.00 0.00 43.02 42.66 2dty s PHE 118 CO 0.47 -0.29 -0.23 0.08 -0.05 0.00 0.00 175.22 175.20 2dty s VAL 119 N -1.56 2.06 0.02 -2.49 1.01 -0.65 -0.16 120.40 118.63 2dty s VAL 119 Ca 0.03 -1.00 -0.02 0.00 0.00 0.00 0.00 61.98 60.99 2dty s VAL 119 Cb -0.01 -1.79 -0.02 0.00 0.00 0.00 0.00 36.38 34.56 2dty s VAL 119 CO -0.03 0.56 0.02 0.00 0.00 0.00 0.00 175.10 175.65 2dty s ALA 120 N 0.54 0.02 -0.21 5.51 0.00 0.35 -0.65 121.76 127.33 2dty s ALA 120 Ca -0.14 -0.51 -0.03 0.00 0.00 0.00 0.00 51.96 51.28 2dty s ALA 120 Cb -0.17 0.15 -0.01 0.00 0.00 0.00 0.00 23.12 23.10 2dty s ALA 120 CO 0.04 -0.19 -0.07 0.08 0.00 0.00 0.00 175.76 175.62 2dty s VAL 121 N -1.63 3.20 0.15 0.00 1.01 0.43 -0.28 120.40 123.27 2dty s VAL 121 Ca -0.14 -0.55 0.06 0.00 0.00 0.00 0.00 61.98 61.34 2dty s VAL 121 Cb -0.08 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.82 2dty s VAL 121 CO -0.01 0.45 0.06 -1.83 0.00 0.00 0.00 175.10 173.77 2dty s GLU 122 N 1.35 2.67 -0.47 2.72 -1.05 0.32 -1.24 118.70 123.00 2dty s GLU 122 Ca 0.04 -0.93 0.03 0.00 -0.15 0.00 0.00 54.97 53.96 2dty s GLU 122 Cb -0.14 -2.54 0.14 0.00 -0.44 0.00 0.00 34.13 31.15 2dty s GLU 122 CO -0.04 0.49 0.26 -0.06 0.95 0.00 0.00 175.26 176.86 2dty s PHE 123 N -1.64 2.27 -0.17 4.83 0.08 -0.26 -1.46 117.98 121.63 2dty s PHE 123 Ca 0.29 -2.62 -0.22 0.00 0.12 0.00 0.00 56.93 54.50 2dty s PHE 123 Cb -0.10 -2.08 -0.03 0.00 -0.57 0.00 0.00 43.02 40.24 2dty s PHE 123 CO 0.21 -0.76 0.66 0.34 -0.10 0.00 0.00 175.22 175.57 2dty s ASP 124 N 0.12 6.76 -0.01 1.36 -1.08 -0.72 -2.31 116.67 120.79 2dty s ASP 124 Ca 0.18 0.93 0.15 0.00 -0.52 0.00 0.00 52.55 53.29 2dty s ASP 124 Cb -0.23 -2.37 -0.21 0.00 -1.46 0.00 0.00 42.92 38.65 2dty s ASP 124 CO -0.01 -0.26 0.42 0.35 0.52 0.00 0.00 175.17 176.18 2dty n THR 125 N 4.55 0.00 -5.04 1.71 -2.24 -0.36 -2.04 114.28 110.86 2dty n THR 125 Ca -0.01 -0.29 -0.32 0.00 -2.27 0.00 0.00 64.05 61.17 2dty n THR 125 Cb 0.50 0.42 -0.14 0.00 -2.10 0.00 0.00 70.33 69.01 2dty n THR 125 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2dty s PHE 126 N -2.83 2.58 -0.55 4.78 5.36 -1.19 -4.73 117.98 121.38 2dty s PHE 126 Ca -0.02 -0.29 -0.20 0.00 -0.96 0.00 0.00 56.93 55.47 2dty s PHE 126 Cb 0.10 -1.59 0.08 0.00 -0.34 0.00 0.00 43.02 41.26 2dty s PHE 126 CO 0.62 0.08 0.70 0.50 -1.46 0.00 0.00 175.22 175.66 2dty s ARG 127 N -0.63 3.10 0.86 10.12 3.52 -1.26 -4.97 118.95 129.70 2dty s ARG 127 Ca 0.10 -1.01 -0.11 0.00 -0.13 0.00 0.00 55.73 54.57 2dty s ARG 127 Cb -0.11 -4.17 0.16 0.00 -1.56 0.00 0.00 34.95 29.27 2dty s ARG 127 CO 0.00 -1.41 1.20 -0.80 -0.81 0.00 0.00 175.30 173.48 2dty s ASN 128 N 3.14 3.71 0.60 -2.12 -0.87 -1.26 -4.90 114.94 113.24 2dty s ASN 128 Ca 0.15 0.18 0.31 0.00 -1.57 0.00 0.00 52.86 51.93 2dty s ASN 128 Cb -0.20 -0.40 1.87 0.00 -0.02 0.00 0.00 41.25 42.49 2dty s ASN 128 CO 0.10 -2.33 2.24 0.71 -2.57 0.00 0.00 177.10 175.25 2dty h THR 129 N -1.21 0.45 -0.42 1.60 1.35 -2.01 -1.67 112.91 110.99 2dty h THR 129 Ca -0.43 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 2dty h THR 129 Cb 1.26 0.97 0.00 0.00 -1.73 0.00 0.00 68.15 68.64 2dty h THR 129 CO 0.43 0.00 0.00 -2.67 -0.25 0.00 0.00 175.52 173.03 2dty n TRP 130 N -3.74 0.55 -3.98 4.73 2.14 -1.26 -4.99 117.44 110.89 2dty n TRP 130 Ca -0.02 -0.28 -0.28 0.00 2.07 0.00 0.00 57.50 58.99 2dty n TRP 130 Cb 0.13 -0.00 -0.04 0.00 -0.81 0.00 0.00 31.31 30.59 2dty n TRP 130 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 2dty s ASP 131 N -1.43 6.10 0.60 -0.67 1.01 -0.63 -4.88 116.67 116.77 2dty s ASP 131 Ca 0.39 0.12 0.01 0.00 0.71 0.00 0.00 52.55 53.78 2dty s ASP 131 Cb 0.23 -1.79 0.10 0.00 1.01 0.00 0.00 42.92 42.47 2dty s ASP 131 CO 0.32 0.10 0.68 -0.81 0.21 0.00 0.00 175.17 175.66 2dty n PRO 132 N -0.19 0.20 -1.52 8.23 -0.04 -1.26 -4.76 135.00 135.66 2dty n PRO 132 Ca -0.07 -1.93 -0.44 0.00 -0.04 0.00 0.00 63.50 61.02 2dty n PRO 132 Cb 0.53 -0.42 -0.01 0.00 -0.04 0.00 0.00 33.50 33.56 2dty n PRO 132 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2dty n GLN 133 N -2.23 0.87 -4.27 0.54 7.27 -1.26 -4.85 117.38 113.44 2dty n GLN 133 Ca 0.11 0.31 -0.24 0.00 0.07 0.00 0.00 57.00 57.26 2dty n GLN 133 Cb 0.41 -1.59 -0.07 0.00 2.41 0.00 0.00 30.24 31.40 2dty n GLN 133 CO 0.00 0.00 0.00 0.96 0.07 0.00 0.00 177.06 178.09 2dty s ILE 134 N -1.18 3.52 0.72 1.69 -5.25 -1.26 -4.40 121.20 115.04 2dty s ILE 134 Ca 0.61 -1.80 -0.11 0.00 -0.99 0.00 0.00 60.65 58.36 2dty s ILE 134 Cb -0.71 -2.86 0.02 0.00 2.95 0.00 0.00 42.46 41.86 2dty s ILE 134 CO 0.58 -0.32 1.07 -2.84 -1.79 0.00 0.00 174.94 171.65 2dty s PRO 135 N -3.53 2.76 0.02 0.37 0.02 -1.26 -4.98 135.00 128.40 2dty s PRO 135 Ca 0.30 0.77 -0.23 0.00 0.02 0.00 0.00 61.00 61.86 2dty s PRO 135 Cb -0.07 -1.98 0.05 0.00 0.02 0.00 0.00 34.50 32.52 2dty s PRO 135 CO 0.20 -1.18 0.53 -3.38 -0.33 0.00 0.00 177.00 172.84 2dty s HIS 136 N -3.14 -0.44 0.15 6.54 -3.43 -0.86 -2.38 115.29 111.72 2dty s HIS 136 Ca 0.58 0.59 -0.08 0.00 -0.80 0.00 0.00 55.06 55.35 2dty s HIS 136 Cb -0.13 0.33 -0.06 0.00 -1.43 0.00 0.00 32.58 31.28 2dty s HIS 136 CO 0.54 -0.60 0.44 0.42 -2.00 0.00 0.00 174.74 173.54 2dty s ILE 137 N -2.03 5.06 -0.04 -5.38 1.01 0.67 -1.75 121.20 118.74 2dty s ILE 137 Ca -0.08 0.33 -0.14 0.00 0.00 0.00 0.00 60.65 60.76 2dty s ILE 137 Cb -0.01 -3.63 0.02 0.00 0.01 0.00 0.00 42.46 38.85 2dty s ILE 137 CO 0.02 0.10 0.32 -0.83 0.00 0.00 0.00 174.94 174.54 2dty s GLY 138 N -2.17 -0.17 -0.27 6.18 0.00 -0.53 -1.76 107.32 108.60 2dty s GLY 138 Ca 0.40 0.44 -0.08 0.00 0.00 0.00 0.00 44.72 45.48 2dty s GLY 138 CO 0.21 0.25 0.10 -0.42 0.00 0.00 0.00 173.10 173.24 2dty s ILE 139 N -1.05 4.39 -0.10 0.90 1.01 -0.96 -0.52 121.20 124.87 2dty s ILE 139 Ca -0.11 -0.26 0.00 0.00 0.00 0.00 0.00 60.65 60.28 2dty s ILE 139 Cb -0.05 -3.12 -0.02 0.00 0.01 0.00 0.00 42.46 39.28 2dty s ILE 139 CO 0.04 0.25 -0.10 -1.81 0.00 0.00 0.00 174.94 173.31 2dty s ASP 140 N 1.61 4.33 -0.24 3.58 1.01 0.61 -1.10 116.67 126.46 2dty s ASP 140 Ca 0.06 -0.18 -0.00 0.00 0.71 0.00 0.00 52.55 53.14 2dty s ASP 140 Cb -0.16 -1.34 0.07 0.00 1.01 0.00 0.00 42.92 42.50 2dty s ASP 140 CO 0.04 0.26 -0.00 -0.69 0.21 0.00 0.00 175.17 175.00 2dty s VAL 141 N -0.22 1.24 0.00 -1.27 1.01 -1.26 -0.49 120.40 119.42 2dty s VAL 141 Ca 0.02 -1.18 0.00 0.00 0.00 0.00 0.00 61.98 60.82 2dty s VAL 141 Cb -0.13 -1.66 0.00 0.00 0.00 0.00 0.00 36.38 34.59 2dty s VAL 141 CO 0.03 -0.25 0.00 0.59 0.00 0.00 0.00 175.10 175.46 2dty n ASN 142 N 4.76 0.00 -3.68 3.32 3.02 0.78 -4.89 115.26 118.57 2dty n ASN 142 Ca -0.09 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.36 2dty n ASN 142 Cb 0.44 -1.85 -0.05 0.00 -0.61 0.00 0.00 39.78 37.72 2dty n ASN 142 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2dty s SER 143 N -2.24 -0.20 0.00 6.41 1.04 -1.26 -4.88 113.70 112.56 2dty s SER 143 Ca 0.00 -0.40 0.29 0.00 0.48 0.00 0.00 55.95 56.32 2dty s SER 143 Cb 0.00 0.48 1.28 0.00 0.10 0.00 0.00 66.02 67.88 2dty s SER 143 CO 0.00 -0.89 1.88 0.52 0.98 0.00 0.00 173.24 175.73 2dty n VAL 144 N -0.24 0.00 -3.25 5.02 0.31 -1.26 -4.55 118.33 114.36 2dty n VAL 144 Ca -0.14 -0.17 -0.46 0.00 -0.01 0.00 0.00 64.34 63.56 2dty n VAL 144 Cb 0.63 0.19 -0.03 0.00 -0.91 0.00 0.00 33.84 33.72 2dty n VAL 144 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 2dty s ILE 145 N -2.04 5.29 0.38 2.52 2.07 -1.26 -5.02 121.20 123.13 2dty s ILE 145 Ca 0.40 -1.86 -0.23 0.00 -1.41 0.00 0.00 60.65 57.55 2dty s ILE 145 Cb 0.21 -4.46 -0.14 0.00 0.13 0.00 0.00 42.46 38.20 2dty s ILE 145 CO 0.36 -1.04 0.43 -1.20 -1.91 0.00 0.00 174.94 171.58 2dty n SER 146 N 4.97 -1.42 0.11 4.50 7.64 -1.26 -4.85 113.62 123.31 2dty n SER 146 Ca 0.02 0.93 -0.22 0.00 1.01 0.00 0.00 58.87 60.61 2dty n SER 146 Cb 0.44 -1.03 -0.15 0.00 -1.01 0.00 0.00 64.21 62.46 2dty n SER 146 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2dty h THR 147 N 0.75 1.21 -3.96 0.44 1.35 -1.49 -3.46 112.91 107.73 2dty h THR 147 Ca -0.37 -2.71 -0.33 0.00 -0.55 0.00 0.00 66.41 62.45 2dty h THR 147 Cb 1.42 2.93 -0.24 0.00 -1.73 0.00 0.00 68.15 70.53 2dty h THR 147 CO 0.51 0.83 -0.75 -0.75 -0.25 0.00 0.00 175.52 175.11 2dty s LYS 148 N -2.60 0.59 -0.01 4.72 2.47 -1.25 -5.02 119.74 118.63 2dty s LYS 148 Ca -0.10 -0.59 -0.03 0.00 -1.56 0.00 0.00 55.97 53.69 2dty s LYS 148 Cb 0.05 -0.48 -0.00 0.00 -1.46 0.00 0.00 37.83 35.94 2dty s LYS 148 CO 0.91 0.11 0.06 0.99 0.16 0.00 0.00 175.35 177.57 2dty s THR 149 N -0.88 0.04 -0.08 3.43 2.01 -1.26 -2.27 115.64 116.63 2dty s THR 149 Ca -0.04 -0.35 -0.04 0.00 0.31 0.00 0.00 61.69 61.58 2dty s THR 149 Cb -0.07 -0.20 0.04 0.00 0.01 0.00 0.00 72.50 72.28 2dty s THR 149 CO 0.00 -0.19 0.18 0.54 -0.69 0.00 0.00 174.62 174.46 2dty s VAL 150 N -0.59 -0.08 0.43 3.82 0.11 -0.72 -4.98 120.40 118.39 2dty s VAL 150 Ca -0.07 0.19 -0.22 0.00 -2.93 0.00 0.00 61.98 58.95 2dty s VAL 150 Cb -0.04 -0.29 -0.09 0.00 -1.53 0.00 0.00 36.38 34.42 2dty s VAL 150 CO 0.00 0.08 1.01 -2.16 -3.33 0.00 0.00 175.10 170.70 2dty s PRO 151 N 1.34 4.10 0.02 1.54 0.04 -1.26 -0.24 135.00 140.54 2dty s PRO 151 Ca -0.08 1.34 -0.09 0.00 0.04 0.00 0.00 61.00 62.21 2dty s PRO 151 Cb -0.11 -2.32 0.00 0.00 0.04 0.00 0.00 34.50 32.11 2dty s PRO 151 CO -0.07 -0.17 0.19 -0.59 0.04 0.00 0.00 177.00 176.40 2dty s PHE 152 N -1.90 0.03 -0.29 0.56 -0.12 -1.00 -4.88 117.98 110.39 2dty s PHE 152 Ca 0.61 -0.19 -0.12 0.00 -0.05 0.00 0.00 56.93 57.19 2dty s PHE 152 Cb -0.16 -0.03 -0.04 0.00 -0.63 0.00 0.00 43.02 42.16 2dty s PHE 152 CO 0.21 -0.38 0.22 0.99 -0.05 0.00 0.00 175.22 176.21 2dty s THR 153 N -2.09 5.29 0.26 -4.49 2.01 -1.26 -3.98 115.64 111.37 2dty s THR 153 Ca -0.09 0.18 -0.30 0.00 0.31 0.00 0.00 61.69 61.80 2dty s THR 153 Cb -0.03 -3.58 -0.09 0.00 0.01 0.00 0.00 72.50 68.80 2dty s THR 153 CO -0.01 0.20 1.25 -0.22 -0.69 0.00 0.00 174.62 175.14 2dty s LEU 154 N 1.80 4.45 -0.90 4.42 2.96 -1.26 -4.97 118.68 125.19 2dty s LEU 154 Ca 0.08 2.44 -0.16 0.00 -0.22 0.00 0.00 54.13 56.27 2dty s LEU 154 Cb -0.16 -3.63 0.17 0.00 0.50 0.00 0.00 46.19 43.08 2dty s LEU 154 CO 0.11 -0.42 0.98 -0.62 -1.32 0.00 0.00 176.35 175.07 2dty s ASP 155 N -0.21 6.71 -0.33 3.68 2.15 -1.26 -4.98 116.67 122.42 2dty s ASP 155 Ca 0.51 -2.38 -0.39 0.00 0.43 0.00 0.00 52.55 50.72 2dty s ASP 155 Cb -0.36 -2.31 -0.15 0.00 -0.30 0.00 0.00 42.92 39.80 2dty s ASP 155 CO 0.43 -0.83 1.95 -3.20 -0.17 0.00 0.00 175.17 173.35 2dty n ASN 156 N 5.33 2.11 0.00 -0.34 2.85 -1.26 0.35 115.26 124.30 2dty n ASN 156 Ca 0.20 0.80 0.00 0.00 -0.11 0.00 0.00 54.58 55.47 2dty n ASN 156 Cb 0.48 -1.15 0.00 0.00 1.24 0.00 0.00 39.78 40.35 2dty n ASN 156 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2dty n GLY 157 N 5.40 2.56 3.69 8.20 0.00 -0.64 -4.94 105.19 119.47 2dty n GLY 157 Ca 0.35 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.07 2dty n GLY 157 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dty s GLY 158 N -1.70 1.66 -0.09 -0.02 0.00 0.15 -4.83 107.32 102.49 2dty s GLY 158 Ca 0.00 -1.15 -0.08 0.00 0.00 0.00 0.00 44.72 43.49 2dty s GLY 158 CO 0.00 -0.24 0.19 -0.42 0.00 0.00 0.00 173.10 172.63 2dty s ILE 159 N -3.31 5.41 -0.04 0.90 1.01 -1.26 -4.40 121.20 119.51 2dty s ILE 159 Ca 0.73 0.33 0.06 0.00 0.00 0.00 0.00 60.65 61.77 2dty s ILE 159 Cb -0.06 -3.46 -0.01 0.00 0.01 0.00 0.00 42.46 38.93 2dty s ILE 159 CO 0.55 0.61 -0.24 0.00 0.00 0.00 0.00 174.94 175.86 2dty s ALA 160 N -1.05 2.04 -0.14 9.38 0.00 -0.61 -4.12 121.76 127.26 2dty s ALA 160 Ca 0.17 -1.01 -0.02 0.00 0.00 0.00 0.00 51.96 51.10 2dty s ALA 160 Cb -0.13 -0.59 -0.02 0.00 0.00 0.00 0.00 23.12 22.38 2dty s ALA 160 CO 0.06 0.43 -0.08 -0.80 0.00 0.00 0.00 175.76 175.38 2dty s ASN 161 N -0.30 4.46 -0.03 0.00 0.01 0.14 -2.18 114.94 117.03 2dty s ASN 161 Ca 0.02 -0.21 0.06 0.00 -0.71 0.00 0.00 52.86 52.01 2dty s ASN 161 Cb -0.12 -1.71 -0.01 0.00 0.41 0.00 0.00 41.25 39.82 2dty s ASN 161 CO 0.02 0.17 -0.21 -0.69 -1.51 0.00 0.00 177.10 174.87 2dty s VAL 162 N 0.36 1.70 -0.16 1.60 1.01 -0.00 -0.47 120.40 124.43 2dty s VAL 162 Ca -0.07 -0.90 -0.00 0.00 0.00 0.00 0.00 61.98 61.01 2dty s VAL 162 Cb -0.15 -1.42 0.04 0.00 0.00 0.00 0.00 36.38 34.85 2dty s VAL 162 CO 0.04 0.48 -0.08 -0.69 0.00 0.00 0.00 175.10 174.85 2dty s VAL 163 N -0.35 1.27 -0.16 2.92 1.01 -0.41 -1.95 120.40 122.72 2dty s VAL 163 Ca 0.04 -0.66 -0.00 0.00 0.00 0.00 0.00 61.98 61.36 2dty s VAL 163 Cb -0.10 -1.37 -0.00 0.00 0.00 0.00 0.00 36.38 34.91 2dty s VAL 163 CO 0.00 0.21 -0.14 -0.63 0.00 0.00 0.00 175.10 174.55 2dty s ILE 164 N 1.57 2.76 -0.03 2.22 1.01 0.13 -0.43 121.20 128.44 2dty s ILE 164 Ca 0.01 -0.73 0.04 0.00 0.00 0.00 0.00 60.65 59.97 2dty s ILE 164 Cb -0.15 -2.18 -0.00 0.00 0.01 0.00 0.00 42.46 40.14 2dty s ILE 164 CO -0.08 0.51 -0.14 -0.75 0.00 0.00 0.00 174.94 174.47 2dty s LYS 165 N 0.89 1.41 -0.14 2.79 2.20 -0.34 -0.70 119.74 125.84 2dty s LYS 165 Ca -0.04 -0.51 0.00 0.00 -0.36 0.00 0.00 55.97 55.06 2dty s LYS 165 Cb -0.15 -1.28 0.03 0.00 -1.51 0.00 0.00 37.83 34.92 2dty s LYS 165 CO -0.01 0.23 -0.10 -0.47 -0.36 0.00 0.00 175.35 174.64 2dty s TYR 166 N -0.04 1.90 -0.35 4.03 5.04 0.10 -1.33 117.35 126.70 2dty s TYR 166 Ca -0.01 -1.07 -0.10 0.00 -2.44 0.00 0.00 57.07 53.44 2dty s TYR 166 Cb -0.09 -1.44 0.02 0.00 0.35 0.00 0.00 41.96 40.80 2dty s TYR 166 CO 0.01 -0.62 0.18 0.34 -1.34 0.00 0.00 175.55 174.12 2dty s ASP 167 N 1.57 5.65 0.31 4.32 2.15 -0.84 -1.91 116.67 127.92 2dty s ASP 167 Ca 0.04 -0.85 -0.01 0.00 0.43 0.00 0.00 52.55 52.17 2dty s ASP 167 Cb -0.13 -2.01 0.49 0.00 -0.30 0.00 0.00 42.92 40.97 2dty s ASP 167 CO -0.09 -0.32 1.94 0.00 -0.17 0.00 0.00 175.17 176.52 2dty h ALA 168 N 8.40 1.39 -0.60 3.66 0.00 -1.88 0.55 119.26 130.77 2dty h ALA 168 Ca -0.28 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 2dty h ALA 168 Cb 1.12 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2dty h ALA 168 CO 0.65 0.51 0.30 0.66 0.00 0.00 0.00 179.25 181.36 2dty h SER 169 N 0.94 0.75 0.00 0.00 4.64 -1.93 -3.03 113.55 114.91 2dty h SER 169 Ca 0.24 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 2dty h SER 169 Cb 0.01 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 61.91 2dty h SER 169 CO -0.04 0.63 -0.78 0.35 -0.87 0.00 0.00 176.83 176.12 2dty n THR 170 N -4.37 0.00 -1.84 2.95 -2.24 -1.11 -4.98 114.28 102.69 2dty n THR 170 Ca 0.05 -0.17 -0.17 0.00 -2.27 0.00 0.00 64.05 61.49 2dty n THR 170 Cb 0.12 0.92 -0.05 0.00 -2.10 0.00 0.00 70.33 69.23 2dty n THR 170 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2dty n LYS 171 N -1.40 -1.25 -3.24 -0.78 5.02 0.19 -4.94 118.16 111.75 2dty n LYS 171 Ca 0.02 0.98 -0.39 0.00 -2.02 0.00 0.00 58.31 56.91 2dty n LYS 171 Cb 0.24 -5.30 -0.06 0.00 -0.02 0.00 0.00 35.03 29.90 2dty n LYS 171 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2dty s ILE 172 N -2.72 5.14 -0.33 -0.18 1.01 -1.14 -1.29 121.20 121.67 2dty s ILE 172 Ca 0.00 1.04 -0.06 0.00 0.00 0.00 0.00 60.65 61.63 2dty s ILE 172 Cb 0.00 -3.86 0.04 0.00 0.01 0.00 0.00 42.46 38.64 2dty s ILE 172 CO 0.00 0.26 0.10 -0.22 0.00 0.00 0.00 174.94 175.08 2dty s LEU 173 N 0.99 4.28 -0.07 2.97 2.96 0.03 -1.98 118.68 127.86 2dty s LEU 173 Ca 0.27 -1.11 0.05 0.00 -0.22 0.00 0.00 54.13 53.13 2dty s LEU 173 Cb -0.16 -1.87 -0.01 0.00 0.50 0.00 0.00 46.19 44.66 2dty s LEU 173 CO 0.11 -0.32 -0.24 -1.38 -1.32 0.00 0.00 176.35 173.21 2dty s HIS 174 N 1.41 2.50 0.09 5.38 -3.43 -0.44 -1.66 115.29 119.13 2dty s HIS 174 Ca -0.01 -0.81 0.10 0.00 -0.80 0.00 0.00 55.06 53.53 2dty s HIS 174 Cb -0.19 -1.65 -0.03 0.00 -1.43 0.00 0.00 32.58 29.28 2dty s HIS 174 CO 0.03 -0.27 -0.24 0.14 -2.00 0.00 0.00 174.74 172.39 2dty s VAL 175 N 0.00 2.37 -0.04 -5.38 -7.23 0.20 -1.20 120.40 109.12 2dty s VAL 175 Ca -0.08 -1.52 0.03 0.00 -1.81 0.00 0.00 61.98 58.60 2dty s VAL 175 Cb -0.15 -2.00 0.00 0.00 0.56 0.00 0.00 36.38 34.79 2dty s VAL 175 CO 0.05 0.22 -0.13 -0.69 -0.31 0.00 0.00 175.10 174.25 2dty s VAL 176 N -0.96 1.14 -0.12 1.32 1.01 0.43 -2.08 120.40 121.13 2dty s VAL 176 Ca 0.14 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.62 2dty s VAL 176 Cb -0.10 -1.01 0.01 0.00 0.00 0.00 0.00 36.38 35.28 2dty s VAL 176 CO 0.05 0.34 -0.23 -0.22 0.00 0.00 0.00 175.10 175.04 2dty s LEU 177 N 0.29 2.10 -0.03 3.92 2.96 0.22 -1.29 118.68 126.84 2dty s LEU 177 Ca -0.07 -0.58 0.01 0.00 -0.22 0.00 0.00 54.13 53.27 2dty s LEU 177 Cb -0.12 -1.43 0.02 0.00 0.50 0.00 0.00 46.19 45.16 2dty s LEU 177 CO 0.02 0.12 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.44 2dty s VAL 178 N 0.59 0.46 -0.70 1.68 1.01 0.39 -0.86 120.40 122.97 2dty s VAL 178 Ca -0.13 -0.13 -0.05 0.00 0.00 0.00 0.00 61.98 61.68 2dty s VAL 178 Cb -0.17 -0.47 0.18 0.00 0.00 0.00 0.00 36.38 35.93 2dty s VAL 178 CO 0.03 0.18 0.54 -0.36 0.00 0.00 0.00 175.10 175.50 2dty s PHE 179 N 0.62 3.51 0.38 5.22 0.08 -1.03 0.25 117.98 127.01 2dty s PHE 179 Ca -0.08 -2.62 0.19 0.00 0.12 0.00 0.00 56.93 54.55 2dty s PHE 179 Cb -0.11 -3.32 1.16 0.00 -0.57 0.00 0.00 43.02 40.17 2dty s PHE 179 CO -0.00 -0.86 1.70 -1.00 -0.10 0.00 0.00 175.22 174.96 2dty h PRO 180 N 7.05 0.31 0.00 0.24 0.13 -1.86 0.24 132.00 138.11 2dty h PRO 180 Ca 0.03 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 65.10 2dty h PRO 180 Cb 0.95 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.01 2dty h PRO 180 CO 0.73 0.20 -0.20 0.77 -0.23 0.00 0.00 178.00 179.28 2dty h SER 181 N 0.32 0.00 0.00 1.44 0.02 -1.93 -3.01 113.55 110.38 2dty h SER 181 Ca 0.70 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.65 2dty h SER 181 Cb 1.79 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.33 2dty h SER 181 CO -0.43 0.20 -1.11 0.18 -1.14 0.00 0.00 176.83 174.53 2dty n LEU 182 N -3.75 0.36 -0.58 5.07 4.77 0.17 -4.99 117.00 118.06 2dty n LEU 182 Ca -0.02 -0.27 -0.08 0.00 -0.03 0.00 0.00 56.01 55.62 2dty n LEU 182 Cb 0.31 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.37 2dty n LEU 182 CO 0.33 0.09 -0.07 0.61 -1.33 0.00 0.00 177.39 177.02 2dty n GLY 183 N 1.49 0.92 3.83 -0.72 0.00 0.59 -5.00 105.19 106.30 2dty n GLY 183 Ca 0.00 -0.38 -0.37 0.00 0.00 0.00 0.00 46.02 45.27 2dty n GLY 183 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dty s THR 184 N -2.13 4.75 -0.06 2.61 -4.23 -1.22 -4.96 115.64 110.39 2dty s THR 184 Ca 0.00 1.07 0.03 0.00 -1.18 0.00 0.00 61.69 61.60 2dty s THR 184 Cb 0.00 -3.82 0.01 0.00 1.34 0.00 0.00 72.50 70.03 2dty s THR 184 CO 0.00 0.34 -0.14 -0.63 -0.54 0.00 0.00 174.62 173.65 2dty s ILE 185 N -1.36 1.27 -0.04 2.99 1.01 -1.26 -2.47 121.20 121.34 2dty s ILE 185 Ca 0.36 -0.57 0.06 0.00 0.00 0.00 0.00 60.65 60.50 2dty s ILE 185 Cb -0.17 -1.13 -0.01 0.00 0.01 0.00 0.00 42.46 41.16 2dty s ILE 185 CO 0.20 0.38 -0.21 -0.31 0.00 0.00 0.00 174.94 175.00 2dty s TYR 186 N 0.51 1.97 0.01 3.97 2.02 -0.04 -5.00 117.35 120.79 2dty s TYR 186 Ca -0.13 -0.51 0.02 0.00 -0.37 0.00 0.00 57.07 56.09 2dty s TYR 186 Cb -0.15 -1.29 -0.01 0.00 -0.40 0.00 0.00 41.96 40.10 2dty s TYR 186 CO 0.04 -0.13 -0.08 -0.08 -1.57 0.00 0.00 175.55 173.73 2dty s THR 187 N -0.20 0.58 -0.08 -0.71 -1.32 -1.26 -0.61 115.64 112.05 2dty s THR 187 Ca 0.00 -0.57 -0.18 0.00 -1.21 0.00 0.00 61.69 59.73 2dty s THR 187 Cb -0.11 -0.54 0.04 0.00 -1.51 0.00 0.00 72.50 70.38 2dty s THR 187 CO 0.02 -0.01 0.44 -0.51 -2.21 0.00 0.00 174.62 172.34 2dty s ILE 188 N -0.55 0.02 0.06 5.08 2.07 -0.88 -4.98 121.20 122.02 2dty s ILE 188 Ca -0.01 -0.20 -0.17 0.00 -1.41 0.00 0.00 60.65 58.86 2dty s ILE 188 Cb -0.05 -0.70 0.03 0.00 0.13 0.00 0.00 42.46 41.87 2dty s ILE 188 CO 0.00 -0.11 0.39 0.00 -1.91 0.00 0.00 174.94 173.31 2dty s ALA 189 N -0.71 -0.92 0.23 1.50 0.00 -1.26 -0.63 121.76 119.97 2dty s ALA 189 Ca -0.08 0.19 -0.21 0.00 0.00 0.00 0.00 51.96 51.86 2dty s ALA 189 Cb -0.03 0.39 0.04 0.00 0.00 0.00 0.00 23.12 23.52 2dty s ALA 189 CO 0.04 -0.47 0.66 0.34 0.00 0.00 0.00 175.76 176.32 2dty s ASP 190 N -2.14 -0.37 -0.22 0.00 2.15 -0.67 -4.99 116.67 110.43 2dty s ASP 190 Ca -0.04 -0.38 -0.15 0.00 0.43 0.00 0.00 52.55 52.41 2dty s ASP 190 Cb -0.00 0.67 -0.04 0.00 -0.30 0.00 0.00 42.92 43.25 2dty s ASP 190 CO -0.04 -1.19 0.36 -0.63 -0.17 0.00 0.00 175.17 173.51 2dty s ILE 191 N -3.86 5.21 -0.06 4.11 1.01 -1.26 -0.79 121.20 125.57 2dty s ILE 191 Ca 0.07 0.61 0.01 0.00 0.00 0.00 0.00 60.65 61.35 2dty s ILE 191 Cb -0.04 -3.69 0.02 0.00 0.01 0.00 0.00 42.46 38.76 2dty s ILE 191 CO -0.01 0.24 -0.07 -0.69 0.00 0.00 0.00 174.94 174.41 2dty s VAL 192 N 1.49 0.75 -0.72 2.92 1.01 -0.42 -4.98 120.40 120.46 2dty s VAL 192 Ca 0.17 -0.24 -0.15 0.00 0.00 0.00 0.00 61.98 61.76 2dty s VAL 192 Cb -0.15 -0.74 0.19 0.00 0.00 0.00 0.00 36.38 35.67 2dty s VAL 192 CO 0.08 0.28 0.66 -0.62 0.00 0.00 0.00 175.10 175.50 2dty s ASP 193 N 0.93 6.54 0.28 3.32 -1.08 -1.26 -4.72 116.67 120.67 2dty s ASP 193 Ca -0.11 -2.36 0.01 0.00 -0.52 0.00 0.00 52.55 49.58 2dty s ASP 193 Cb -0.15 -2.21 0.56 0.00 -1.46 0.00 0.00 42.92 39.66 2dty s ASP 193 CO 0.01 -0.68 1.82 -0.07 0.52 0.00 0.00 175.17 176.77 2dty h LEU 194 N 8.19 0.87 -2.25 -1.34 3.38 -1.96 -0.52 115.31 121.68 2dty h LEU 194 Ca -0.05 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2dty h LEU 194 Cb 1.06 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 2dty h LEU 194 CO 0.86 0.45 -0.03 0.50 0.09 0.00 0.00 178.44 180.31 2dty h LYS 195 N 0.93 0.00 0.00 1.13 3.64 -1.91 -0.08 116.57 120.28 2dty h LYS 195 Ca 0.50 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.88 2dty h LYS 195 Cb 0.53 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 2dty h LYS 195 CO -0.28 0.03 -0.68 0.37 -2.27 0.00 0.00 179.45 176.62 2dty h GLN 196 N 0.00 0.00 0.00 1.90 5.75 -1.51 -3.41 115.11 117.84 2dty h GLN 196 Ca -0.00 0.00 -0.07 0.00 -0.15 0.00 0.00 58.65 58.43 2dty h GLN 196 Cb 0.06 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.60 2dty h GLN 196 CO 0.00 0.00 -1.28 1.33 -2.65 0.00 0.00 178.83 176.23 2dty n VAL 197 N -2.64 0.28 -4.32 2.39 0.24 -0.87 -5.07 118.33 108.34 2dty n VAL 197 Ca 0.02 -0.17 -0.25 0.00 -2.04 0.00 0.00 64.34 61.90 2dty n VAL 197 Cb 0.52 -0.89 -0.08 0.00 -1.47 0.00 0.00 33.84 31.92 2dty n VAL 197 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2dty s LEU 198 N -4.32 3.00 0.84 1.34 1.43 -0.10 -4.70 118.68 116.17 2dty s LEU 198 Ca -0.02 -0.69 -0.12 0.00 -1.03 0.00 0.00 54.13 52.27 2dty s LEU 198 Cb 0.01 -1.58 0.10 0.00 0.03 0.00 0.00 46.19 44.75 2dty s LEU 198 CO 0.17 0.05 1.17 -2.16 0.23 0.00 0.00 176.35 175.80 2dty s PRO 199 N -3.33 1.75 0.20 1.29 0.04 -1.26 -4.67 135.00 129.02 2dty s PRO 199 Ca 0.29 0.16 -0.11 0.00 0.04 0.00 0.00 61.00 61.38 2dty s PRO 199 Cb -0.07 -1.92 0.26 0.00 0.04 0.00 0.00 34.50 32.81 2dty s PRO 199 CO 0.17 -1.76 1.71 0.93 0.04 0.00 0.00 177.00 178.09 2dty h GLU 200 N -1.17 0.24 -5.72 4.56 5.08 -1.97 -3.41 114.58 112.20 2dty h GLU 200 Ca -0.47 -0.01 -0.66 0.00 -1.00 0.00 0.00 59.36 57.21 2dty h GLU 200 Cb 1.33 -0.06 -0.20 0.00 0.50 0.00 0.00 28.75 30.33 2dty h GLU 200 CO 0.65 0.16 -0.68 -1.12 -1.00 0.00 0.00 179.01 177.02 2dty s SER 201 N -5.30 4.76 0.34 1.42 0.01 -1.26 -1.17 113.70 112.49 2dty s SER 201 Ca -0.13 -0.06 0.05 0.00 1.31 0.00 0.00 55.95 57.12 2dty s SER 201 Cb 0.17 -1.49 -0.03 0.00 0.21 0.00 0.00 66.02 64.88 2dty s SER 201 CO 0.73 0.27 0.22 0.68 0.41 0.00 0.00 173.24 175.56 2dty s VAL 202 N -0.26 0.19 0.10 3.43 -7.23 -0.44 -4.16 120.40 112.03 2dty s VAL 202 Ca 0.04 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.31 2dty s VAL 202 Cb -0.13 -2.45 -0.04 0.00 0.56 0.00 0.00 36.38 34.32 2dty s VAL 202 CO 0.02 0.00 -0.22 0.20 -0.31 0.00 0.00 175.10 174.79 2dty s ASN 203 N -3.43 3.57 0.07 4.85 0.02 0.08 -1.45 114.94 118.64 2dty s ASN 203 Ca 0.35 -0.61 0.08 0.00 -1.02 0.00 0.00 52.86 51.66 2dty s ASN 203 Cb 0.03 -0.40 -0.03 0.00 0.02 0.00 0.00 41.25 40.87 2dty s ASN 203 CO 0.22 0.20 -0.22 0.68 0.02 0.00 0.00 177.10 178.01 2dty s VAL 204 N -1.03 1.78 -1.08 1.60 -7.23 -1.26 -1.99 120.40 111.18 2dty s VAL 204 Ca 0.15 -1.35 0.00 0.00 -1.81 0.00 0.00 61.98 58.97 2dty s VAL 204 Cb -0.10 -1.56 0.00 0.00 0.56 0.00 0.00 36.38 35.28 2dty s VAL 204 CO 0.07 0.15 0.00 0.61 -0.31 0.00 0.00 175.10 175.61 2dty n GLY 205 N 1.57 -0.85 3.39 2.32 0.00 -0.71 -1.94 105.19 108.97 2dty n GLY 205 Ca -0.18 -0.78 -0.21 0.00 0.00 0.00 0.00 46.02 44.85 2dty n GLY 205 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dty s PHE 206 N -3.00 1.94 -0.16 1.61 0.40 -0.57 -0.62 117.98 117.58 2dty s PHE 206 Ca 0.00 -0.47 -0.19 0.00 -0.60 0.00 0.00 56.93 55.67 2dty s PHE 206 Cb 0.00 -0.89 0.05 0.00 0.51 0.00 0.00 43.02 42.69 2dty s PHE 206 CO 0.00 0.48 0.52 0.45 0.70 0.00 0.00 175.22 177.37 2dty s SER 207 N -3.27 -0.52 0.21 1.36 0.15 -0.56 -1.58 113.70 109.49 2dty s SER 207 Ca 0.24 0.92 -0.07 0.00 0.70 0.00 0.00 55.95 57.74 2dty s SER 207 Cb -0.03 0.93 -0.02 0.00 -1.71 0.00 0.00 66.02 65.19 2dty s SER 207 CO 0.10 -0.26 0.28 0.00 1.20 0.00 0.00 173.24 174.56 2dty s ALA 208 N -0.05 0.48 -0.04 5.45 0.00 -0.85 -0.21 121.76 126.53 2dty s ALA 208 Ca -0.03 -1.28 -0.31 0.00 0.00 0.00 0.00 51.96 50.35 2dty s ALA 208 Cb -0.03 1.19 0.07 0.00 0.00 0.00 0.00 23.12 24.34 2dty s ALA 208 CO 0.02 -0.70 0.68 0.00 0.00 0.00 0.00 175.76 175.76 2dty s ALA 209 N -4.08 -1.76 0.49 0.00 0.00 -0.94 -2.84 121.76 112.63 2dty s ALA 209 Ca 0.30 1.28 0.06 0.00 0.00 0.00 0.00 51.96 53.60 2dty s ALA 209 Cb 0.04 0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.20 2dty s ALA 209 CO 0.09 -0.39 0.37 0.95 0.00 0.00 0.00 175.76 176.78 2dty s THR 210 N -1.31 2.06 0.08 0.00 -4.23 -0.57 0.57 115.64 112.24 2dty s THR 210 Ca -0.10 -1.47 -0.36 0.00 -1.18 0.00 0.00 61.69 58.58 2dty s THR 210 Cb -0.00 -2.53 -0.18 0.00 1.34 0.00 0.00 72.50 71.12 2dty s THR 210 CO 0.09 0.00 0.99 0.61 -0.54 0.00 0.00 174.62 175.77 2dty n GLY 211 N -1.63 -0.47 3.77 3.99 0.00 0.15 -4.13 105.19 106.88 2dty n GLY 211 Ca 0.00 0.63 -0.38 0.00 0.00 0.00 0.00 46.02 46.27 2dty n GLY 211 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dty s ASP 212 N -0.17 7.45 0.35 1.61 2.15 -1.26 0.28 116.67 127.09 2dty s ASP 212 Ca 0.82 1.86 0.10 0.00 0.43 0.00 0.00 52.55 55.76 2dty s ASP 212 Cb -1.11 -2.58 0.85 0.00 -0.30 0.00 0.00 42.92 39.79 2dty s ASP 212 CO 0.55 0.04 1.84 -0.65 -0.17 0.00 0.00 175.17 176.78 2dty h PRO 213 N 3.61 0.63 -0.00 4.34 0.11 -1.94 -0.85 132.00 137.90 2dty h PRO 213 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2dty h PRO 213 Cb 1.20 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 2dty h PRO 213 CO 0.66 0.42 0.09 0.66 -0.21 0.00 0.00 178.00 179.62 2dty h SER 214 N 0.65 0.00 1.25 -2.05 4.64 -1.99 0.13 113.55 116.17 2dty h SER 214 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 2dty h SER 214 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 2dty h SER 214 CO -0.25 0.00 0.00 1.23 -0.87 0.00 0.00 176.83 176.94 2dty h GLY 215 N 0.00 0.00 -5.87 -0.77 0.00 -1.54 -3.47 103.07 91.42 2dty h GLY 215 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 47.33 46.94 2dty h GLY 215 CO -0.00 0.00 -0.72 0.28 0.00 0.00 0.00 176.54 176.10 2dty n LYS 216 N -2.33 -7.29 -3.44 4.80 4.76 0.45 -4.99 118.16 110.13 2dty n LYS 216 Ca 0.04 0.80 -0.17 0.00 -2.87 0.00 0.00 58.31 56.11 2dty n LYS 216 Cb 0.37 -5.81 -0.11 0.00 -1.84 0.00 0.00 35.03 27.64 2dty n LYS 216 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 2dty s GLN 217 N -6.12 0.27 0.46 1.97 -1.52 -1.26 -4.99 119.66 108.46 2dty s GLN 217 Ca 0.44 0.04 0.30 0.00 -1.95 0.00 0.00 55.36 54.19 2dty s GLN 217 Cb -0.20 -0.88 1.15 0.00 -0.22 0.00 0.00 33.01 32.86 2dty s GLN 217 CO 0.74 -0.84 1.88 0.00 -0.25 0.00 0.00 175.29 176.82 2dty h ARG 218 N 8.28 0.00 0.00 2.91 3.08 -1.95 -2.45 114.38 124.25 2dty h ARG 218 Ca -0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.89 2dty h ARG 218 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.16 2dty h ARG 218 CO 0.31 0.00 0.00 0.09 -1.07 0.00 0.00 179.97 179.30 2dty n ASN 219 N -2.87 0.54 -4.00 7.04 4.13 -1.26 -4.40 115.26 114.44 2dty n ASN 219 Ca 0.01 0.57 -0.40 0.00 1.68 0.00 0.00 54.58 56.44 2dty n ASN 219 Cb 0.32 -0.71 -0.03 0.00 -1.54 0.00 0.00 39.78 37.82 2dty n ASN 219 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2dty n ALA 220 N -1.70 3.87 -3.65 5.41 0.00 -0.92 -4.55 120.51 118.97 2dty n ALA 220 Ca 0.05 -3.56 -0.09 0.00 0.00 0.00 0.00 53.44 49.84 2dty n ALA 220 Cb 0.36 -3.57 -0.01 0.00 0.00 0.00 0.00 19.45 16.22 2dty n ALA 220 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2dty s THR 221 N 5.21 0.00 -0.06 0.00 -1.32 -1.26 0.33 115.64 118.54 2dty s THR 221 Ca 0.55 -1.12 -0.31 0.00 -1.21 0.00 0.00 61.69 59.60 2dty s THR 221 Cb 0.10 -2.40 0.12 0.00 -1.51 0.00 0.00 72.50 68.81 2dty s THR 221 CO 0.04 0.00 1.35 -1.83 -2.21 0.00 0.00 174.62 171.98 2dty s GLU 222 N -3.29 0.20 0.36 7.08 -1.05 -1.25 -4.08 118.70 116.67 2dty s GLU 222 Ca 0.16 -0.12 -0.01 0.00 -0.15 0.00 0.00 54.97 54.85 2dty s GLU 222 Cb -0.04 0.06 -0.04 0.00 -0.44 0.00 0.00 34.13 33.67 2dty s GLU 222 CO 0.10 -0.09 0.59 0.95 0.95 0.00 0.00 175.26 177.76 2dty s THR 223 N -2.10 5.06 -0.42 1.83 -4.23 -0.53 -4.79 115.64 110.47 2dty s THR 223 Ca 0.23 -0.27 0.05 0.00 -1.18 0.00 0.00 61.69 60.51 2dty s THR 223 Cb 0.03 -3.84 0.18 0.00 1.34 0.00 0.00 72.50 70.21 2dty s THR 223 CO -0.04 -0.57 0.39 1.41 -0.54 0.00 0.00 174.62 175.27 2dty n HIS 224 N -1.74 -1.08 -3.85 3.99 -0.00 -1.26 -3.84 115.22 107.45 2dty n HIS 224 Ca -0.03 -3.20 -0.36 0.00 -0.00 0.00 0.00 57.72 54.13 2dty n HIS 224 Cb 0.56 0.28 -0.07 0.00 -0.00 0.00 0.00 29.99 30.76 2dty n HIS 224 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2dty s ASP 225 N -0.05 6.19 -0.34 0.41 1.01 -0.43 -2.09 116.67 121.37 2dty s ASP 225 Ca 0.33 0.32 -0.10 0.00 0.71 0.00 0.00 52.55 53.81 2dty s ASP 225 Cb 0.05 -2.04 0.01 0.00 1.01 0.00 0.00 42.92 41.95 2dty s ASP 225 CO -0.18 0.29 0.17 -0.63 0.21 0.00 0.00 175.17 175.03 2dty s ILE 226 N -0.32 4.51 0.02 0.77 -1.09 -0.19 -0.42 121.20 124.47 2dty s ILE 226 Ca 0.11 -0.65 -0.14 0.00 -2.23 0.00 0.00 60.65 57.74 2dty s ILE 226 Cb -0.12 -3.40 -0.34 0.00 -1.58 0.00 0.00 42.46 37.02 2dty s ILE 226 CO 0.01 -0.06 0.94 -0.07 -1.23 0.00 0.00 174.94 174.52 2dty h LEU 227 N 8.37 0.78 -7.33 2.97 -0.00 -0.02 -2.43 115.31 117.64 2dty h LEU 227 Ca -0.29 -0.89 -0.05 0.00 -0.00 0.00 0.00 57.88 56.65 2dty h LEU 227 Cb 1.12 -0.25 -0.13 0.00 -0.00 0.00 0.00 40.66 41.40 2dty h LEU 227 CO 0.63 1.71 -0.03 -0.94 -0.00 0.00 0.00 178.44 179.81 2dty s SER 228 N -7.50 -0.29 -0.28 -0.43 1.04 -1.21 -4.33 113.70 100.70 2dty s SER 228 Ca -0.10 -0.24 -0.14 0.00 0.48 0.00 0.00 55.95 55.95 2dty s SER 228 Cb 0.05 0.49 0.09 0.00 0.10 0.00 0.00 66.02 66.75 2dty s SER 228 CO 0.92 -0.85 0.65 0.86 0.98 0.00 0.00 173.24 175.81 2dty s TRP 229 N -3.68 -1.12 0.06 5.02 -0.00 -0.52 -1.96 118.94 116.73 2dty s TRP 229 Ca 0.02 2.14 0.07 0.00 -0.00 0.00 0.00 56.10 58.33 2dty s TRP 229 Cb 0.01 0.66 -0.03 0.00 -0.00 0.00 0.00 33.47 34.12 2dty s TRP 229 CO -0.11 -0.56 -0.19 -1.54 -0.00 0.00 0.00 176.95 174.55 2dty s SER 230 N 2.05 2.26 0.02 5.86 1.04 0.08 0.78 113.70 125.78 2dty s SER 230 Ca -0.08 -0.56 0.01 0.00 0.48 0.00 0.00 55.95 55.79 2dty s SER 230 Cb -0.08 -0.15 -0.01 0.00 0.10 0.00 0.00 66.02 65.88 2dty s SER 230 CO -0.19 0.09 -0.04 0.12 0.98 0.00 0.00 173.24 174.19 2dty s PHE 231 N -0.95 0.39 -0.20 5.02 5.36 -0.40 -1.58 117.98 125.62 2dty s PHE 231 Ca 0.05 -0.34 -0.08 0.00 -0.96 0.00 0.00 56.93 55.60 2dty s PHE 231 Cb -0.09 -0.25 0.08 0.00 -0.34 0.00 0.00 43.02 42.43 2dty s PHE 231 CO 0.02 -0.09 0.44 0.45 -1.46 0.00 0.00 175.22 174.59 2dty s SER 232 N -0.99 -0.39 0.01 6.13 0.15 -0.11 -1.79 113.70 116.71 2dty s SER 232 Ca -0.08 1.02 0.04 0.00 0.70 0.00 0.00 55.95 57.63 2dty s SER 232 Cb -0.07 1.25 -0.02 0.00 -1.71 0.00 0.00 66.02 65.48 2dty s SER 232 CO -0.00 -0.22 -0.13 0.00 1.20 0.00 0.00 173.24 174.09 2dty s ALA 233 N 2.28 1.06 -0.23 5.45 0.00 -0.12 -0.49 121.76 129.71 2dty s ALA 233 Ca -0.04 -0.67 -0.02 0.00 0.00 0.00 0.00 51.96 51.24 2dty s ALA 233 Cb -0.11 -0.21 0.07 0.00 0.00 0.00 0.00 23.12 22.87 2dty s ALA 233 CO -0.13 0.22 0.03 -1.12 0.00 0.00 0.00 175.76 174.76 2dty s SER 234 N -0.72 3.37 -0.48 0.00 0.01 0.16 -2.25 113.70 113.79 2dty s SER 234 Ca 0.03 -1.08 -0.15 0.00 1.31 0.00 0.00 55.95 56.06 2dty s SER 234 Cb -0.06 -0.79 0.09 0.00 0.21 0.00 0.00 66.02 65.46 2dty s SER 234 CO 0.00 -0.31 0.40 -0.22 0.41 0.00 0.00 173.24 173.52 2dty s LEU 235 N 1.70 5.71 0.00 2.44 0.20 -0.67 -2.31 118.68 125.74 2dty s LEU 235 Ca 0.00 -1.48 0.00 0.00 0.69 0.00 0.00 54.13 53.34 2dty s LEU 235 Cb -0.18 -2.16 0.00 0.00 -0.43 0.00 0.00 46.19 43.42 2dty s LEU 235 CO -0.11 -0.69 0.73 -0.81 -0.29 0.00 0.00 176.35 175.18 2dty n PRO 236 N 5.17 0.00 0.00 0.98 -0.04 -1.26 -3.20 135.00 136.65 2dty n PRO 236 Ca -0.12 0.25 0.14 0.00 -0.04 0.00 0.00 63.50 63.72 2dty n PRO 236 Cb 0.43 -1.71 0.52 0.00 -0.04 0.00 0.00 33.50 32.70 2dty n PRO 236 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87