#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3adr s ARG 4 N -0.52 0.84 0.81 0.00 1.81 -1.26 -4.70 118.95 115.93 3adr s ARG 4 Ca 0.44 -1.04 0.00 0.00 -1.72 0.00 0.00 55.73 53.40 3adr s ARG 4 Cb -0.24 0.32 0.00 0.00 -0.45 0.00 0.00 34.95 34.58 3adr s ARG 4 CO 0.30 -0.25 0.00 0.41 -0.68 0.00 0.00 175.30 175.08 3adr n GLY 5 N -0.05 -1.96 3.39 -3.53 0.00 -1.19 -4.76 105.19 97.09 3adr n GLY 5 Ca -0.14 -1.58 -0.33 0.00 0.00 0.00 0.00 46.02 43.97 3adr n GLY 5 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3adr s LEU 6 N 0.00 2.83 -0.14 0.99 2.96 -1.26 -1.08 118.68 122.98 3adr s LEU 6 Ca 0.00 -0.29 0.02 0.00 -0.22 0.00 0.00 54.13 53.64 3adr s LEU 6 Cb 0.00 -1.65 0.00 0.00 0.50 0.00 0.00 46.19 45.04 3adr s LEU 6 CO 0.00 0.16 -0.20 -1.00 -1.32 0.00 0.00 176.35 173.99 3adr s HIS 7 N 0.41 2.69 -0.34 5.38 3.76 -0.06 -4.99 115.29 122.15 3adr s HIS 7 Ca -0.09 -1.19 -0.04 0.00 -0.15 0.00 0.00 55.06 53.59 3adr s HIS 7 Cb -0.15 -1.82 0.06 0.00 1.11 0.00 0.00 32.58 31.77 3adr s HIS 7 CO 0.05 -0.53 0.10 -1.12 -0.85 0.00 0.00 174.74 172.38 3adr s SER 8 N 0.73 5.18 -0.16 1.40 0.01 -1.26 -0.82 113.70 118.78 3adr s SER 8 Ca -0.08 -1.37 -0.03 0.00 1.31 0.00 0.00 55.95 55.78 3adr s SER 8 Cb -0.16 -1.82 -0.02 0.00 0.21 0.00 0.00 66.02 64.24 3adr s SER 8 CO 0.00 -0.36 -0.06 -0.63 0.41 0.00 0.00 173.24 172.60 3adr s ILE 9 N 1.31 3.55 0.06 1.44 -1.09 0.18 -4.95 121.20 121.70 3adr s ILE 9 Ca -0.01 -0.47 -0.31 0.00 -2.23 0.00 0.00 60.65 57.64 3adr s ILE 9 Cb -0.20 -2.55 -0.07 0.00 -1.58 0.00 0.00 42.46 38.05 3adr s ILE 9 CO 0.00 0.48 1.48 -2.16 -1.23 0.00 0.00 174.94 173.52 3adr s PRO 10 N 0.60 4.26 -0.11 2.79 0.04 -1.26 -0.89 135.00 140.43 3adr s PRO 10 Ca -0.04 2.13 0.17 0.00 0.04 0.00 0.00 61.00 63.30 3adr s PRO 10 Cb -0.15 -3.46 0.40 0.00 0.04 0.00 0.00 34.50 31.33 3adr s PRO 10 CO 0.03 -0.59 1.18 0.00 0.04 0.00 0.00 177.00 177.66 3adr n ALA 11 N 4.94 2.97 -1.77 8.56 0.00 0.55 -4.66 120.51 131.10 3adr n ALA 11 Ca 0.14 -2.76 -0.05 0.00 0.00 0.00 0.00 53.44 50.76 3adr n ALA 11 Cb 0.42 -0.52 0.04 0.00 0.00 0.00 0.00 19.45 19.39 3adr n ALA 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3adr n GLY 12 N -0.42 -0.25 3.79 0.00 0.00 0.38 -1.85 105.19 106.84 3adr n GLY 12 Ca 0.13 -1.82 -0.30 0.00 0.00 0.00 0.00 46.02 44.02 3adr n GLY 12 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3adr s PRO 13 N -3.35 1.95 0.55 1.61 0.04 -1.24 -4.29 135.00 130.27 3adr s PRO 13 Ca 0.16 0.70 0.24 0.00 0.04 0.00 0.00 61.00 62.15 3adr s PRO 13 Cb -0.01 -1.90 1.46 0.00 0.04 0.00 0.00 34.50 34.09 3adr s PRO 13 CO 0.11 -1.73 2.07 -0.39 0.04 0.00 0.00 177.00 177.10 3adr h VAL 14 N -1.17 0.70 0.00 -0.36 -1.51 -1.92 0.40 116.25 112.39 3adr h VAL 14 Ca -0.47 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.00 3adr h VAL 14 Cb 1.27 0.83 -0.00 0.00 -2.13 0.00 0.00 31.29 31.26 3adr h VAL 14 CO 0.58 0.00 -0.00 -0.33 -1.23 0.00 0.00 177.57 176.59 3adr h GLU 15 N 0.00 0.00 -0.45 5.19 3.07 -1.96 -3.38 114.58 117.04 3adr h GLU 15 Ca 0.14 0.00 -0.17 0.00 -0.50 0.00 0.00 59.36 58.83 3adr h GLU 15 Cb 0.60 0.00 -0.15 0.00 -0.84 0.00 0.00 28.75 28.36 3adr h GLU 15 CO -0.00 0.00 -0.45 0.34 -1.40 0.00 0.00 179.01 177.50 3adr n PHE 16 N -3.09 -3.31 -0.35 4.33 -0.00 0.02 -3.91 117.46 111.16 3adr n PHE 16 Ca 0.01 -1.47 0.10 0.00 -0.00 0.00 0.00 57.45 56.09 3adr n PHE 16 Cb 0.35 1.49 0.29 0.00 -0.00 0.00 0.00 39.48 41.61 3adr n PHE 16 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.76 175.41 3adr h PRO 17 N 4.41 0.85 0.00 -7.13 0.11 -1.46 -2.34 132.00 126.45 3adr h PRO 17 Ca -0.05 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.00 3adr h PRO 17 Cb 1.08 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.00 3adr h PRO 17 CO 0.14 0.56 0.00 0.39 -0.21 0.00 0.00 178.00 178.88 3adr n GLU 18 N -4.66 0.96 0.27 1.05 -0.58 -1.26 -0.47 120.64 115.95 3adr n GLU 18 Ca 0.20 0.00 0.15 0.00 -0.42 0.00 0.00 57.16 57.10 3adr n GLU 18 Cb 0.45 -1.36 0.69 0.00 -0.57 0.00 0.00 31.44 30.65 3adr n GLU 18 CO 0.00 0.00 0.00 0.97 -0.48 0.00 0.00 177.13 177.62 3adr h ILE 19 N 0.00 0.24 -3.81 -3.67 2.10 -1.79 -3.40 117.51 107.18 3adr h ILE 19 Ca 0.00 -0.62 -0.28 0.00 1.08 0.00 0.00 64.86 65.04 3adr h ILE 19 Cb 0.00 1.49 -0.28 0.00 -1.09 0.00 0.00 36.82 36.94 3adr h ILE 19 CO 0.00 0.08 -0.74 0.00 -1.08 0.00 0.00 178.15 176.41 3adr s ALA 20 N -3.81 0.23 -0.10 0.18 0.00 -1.25 -4.39 121.76 112.63 3adr s ALA 20 Ca -0.00 -0.11 0.04 0.00 0.00 0.00 0.00 51.96 51.89 3adr s ALA 20 Cb 0.10 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.16 3adr s ALA 20 CO 0.56 0.05 -0.23 0.99 0.00 0.00 0.00 175.76 177.13 3adr s THR 21 N -0.02 2.02 -0.14 0.00 2.01 0.11 -0.33 115.64 119.29 3adr s THR 21 Ca 0.01 -1.00 -0.05 0.00 0.31 0.00 0.00 61.69 60.95 3adr s THR 21 Cb -0.02 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.71 3adr s THR 21 CO -0.00 0.55 0.04 -0.69 -0.69 0.00 0.00 174.62 173.83 3adr s VAL 22 N 0.36 4.65 -0.06 3.82 1.01 -0.07 -4.74 120.40 125.37 3adr s VAL 22 Ca -0.19 -0.10 0.00 0.00 0.00 0.00 0.00 61.98 61.70 3adr s VAL 22 Cb -0.18 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 3adr s VAL 22 CO 0.09 0.53 -0.05 -0.31 0.00 0.00 0.00 175.10 175.36 3adr s TYR 23 N -0.18 3.00 0.21 5.22 2.02 -1.05 -0.65 117.35 125.91 3adr s TYR 23 Ca 0.07 0.07 0.02 0.00 -0.37 0.00 0.00 57.07 56.85 3adr s TYR 23 Cb -0.12 -1.72 -0.01 0.00 -0.40 0.00 0.00 41.96 39.71 3adr s TYR 23 CO 0.02 0.38 0.06 0.28 -1.57 0.00 0.00 175.55 174.72 3adr n VAL 24 N 2.08 0.00 -3.01 0.71 0.31 0.00 0.16 118.33 118.57 3adr n VAL 24 Ca -0.18 -1.18 0.02 0.00 -0.01 0.00 0.00 64.34 63.00 3adr n VAL 24 Cb 0.53 0.40 -0.00 0.00 -0.91 0.00 0.00 33.84 33.86 3adr n VAL 24 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3adr s GLY 27 N 2.20 1.74 0.45 0.00 0.00 0.20 -3.20 107.32 108.71 3adr s GLY 27 Ca 0.17 -1.17 0.25 0.00 0.00 0.00 0.00 44.72 43.97 3adr s GLY 27 CO -0.15 -0.52 1.74 0.83 0.00 0.00 0.00 173.10 175.00 3adr h GLU 28 N -1.25 0.00 0.00 2.90 5.08 -0.51 -3.36 114.58 117.44 3adr h GLU 28 Ca -0.43 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 57.79 3adr h GLU 28 Cb 1.26 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.49 3adr h GLU 28 CO 0.45 0.11 -1.51 1.63 -1.00 0.00 0.00 179.01 178.69 3adr n LYS 29 N -3.17 0.31 -4.34 2.33 5.02 0.48 -4.94 118.16 113.85 3adr n LYS 29 Ca 0.02 0.05 -0.20 0.00 -2.02 0.00 0.00 58.31 56.16 3adr n LYS 29 Cb 0.47 -1.18 -0.13 0.00 -0.02 0.00 0.00 35.03 34.17 3adr n LYS 29 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3adr s LEU 30 N -5.49 2.17 -0.18 -0.35 1.43 -0.39 -4.97 118.68 110.90 3adr s LEU 30 Ca -0.12 -0.46 -0.02 0.00 -1.03 0.00 0.00 54.13 52.50 3adr s LEU 30 Cb 0.03 -0.59 -0.01 0.00 0.03 0.00 0.00 46.19 45.65 3adr s LEU 30 CO 0.21 0.03 -0.09 -0.89 0.23 0.00 0.00 176.35 175.84 3adr s THR 31 N -0.87 3.16 0.00 5.49 2.01 -1.26 -0.63 115.64 123.54 3adr s THR 31 Ca 0.01 -0.58 0.00 0.00 0.31 0.00 0.00 61.69 61.43 3adr s THR 31 Cb -0.08 -2.39 0.00 0.00 0.01 0.00 0.00 72.50 70.04 3adr s THR 31 CO 0.01 0.47 0.00 0.52 -0.69 0.00 0.00 174.62 174.93 3adr n VAL 32 N 4.32 0.00 -3.49 3.82 0.31 -1.26 -1.56 118.33 120.47 3adr n VAL 32 Ca -0.18 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.15 3adr n VAL 32 Cb 0.51 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.41 3adr n VAL 32 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3adr s ILE 34 N -1.30 -0.84 0.14 2.52 1.01 0.12 -4.28 121.20 118.57 3adr s ILE 34 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.65 3adr s ILE 34 Cb 0.00 -1.00 0.00 0.00 0.01 0.00 0.00 42.46 41.47 3adr s ILE 34 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 174.94 175.41 3adr n ASP 35 N 5.33 -2.45 -1.37 3.58 8.00 0.50 -2.54 116.55 127.60 3adr n ASP 35 Ca -0.09 0.30 0.03 0.00 0.71 0.00 0.00 54.79 55.74 3adr n ASP 35 Cb 0.50 -1.33 0.01 0.00 -0.02 0.00 0.00 41.12 40.28 3adr n ASP 35 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3adr n ALA 36 N -2.73 2.37 -0.88 2.24 0.00 0.59 -4.79 120.51 117.31 3adr n ALA 36 Ca -0.01 -2.14 0.09 0.00 0.00 0.00 0.00 53.44 51.37 3adr n ALA 36 Cb 0.19 -0.70 -0.02 0.00 0.00 0.00 0.00 19.45 18.92 3adr n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3adr n GLY 37 N 0.43 -1.76 3.89 0.00 0.00 -1.26 -0.96 105.19 105.53 3adr n GLY 37 Ca 0.04 -1.22 -0.30 0.00 0.00 0.00 0.00 46.02 44.54 3adr n GLY 37 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3adr s VAL 38 N -1.17 4.92 0.31 1.61 -7.23 -0.77 -0.50 120.40 117.56 3adr s VAL 38 Ca 0.00 0.37 0.04 0.00 -1.81 0.00 0.00 61.98 60.58 3adr s VAL 38 Cb 0.00 -3.70 0.30 0.00 0.56 0.00 0.00 36.38 33.54 3adr s VAL 38 CO 0.00 -0.30 1.84 0.28 -0.31 0.00 0.00 175.10 176.61 3adr h SER 39 N 1.82 0.84 -0.25 4.85 0.02 -1.64 -1.88 113.55 117.31 3adr h SER 39 Ca -0.47 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 3adr h SER 39 Cb 1.18 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.60 3adr h SER 39 CO 0.66 0.43 0.00 0.59 -1.14 0.00 0.00 176.83 177.37 3adr n ASN 40 N -4.61 2.19 -4.78 3.07 3.02 -0.11 -4.78 115.26 109.25 3adr n ASN 40 Ca 0.19 -2.18 -0.37 0.00 -0.03 0.00 0.00 54.58 52.19 3adr n ASN 40 Cb 0.40 -0.39 -0.06 0.00 -0.61 0.00 0.00 39.78 39.13 3adr n ASN 40 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3adr s SER 41 N -0.64 7.14 -0.23 6.41 0.15 -0.71 -4.38 113.70 121.45 3adr s SER 41 Ca 0.20 1.89 0.14 0.00 0.70 0.00 0.00 55.95 58.89 3adr s SER 41 Cb 0.13 -2.58 0.65 0.00 -1.71 0.00 0.00 66.02 62.51 3adr s SER 41 CO 0.10 -0.21 1.58 2.30 1.20 0.00 0.00 173.24 178.21 3adr n ILE 42 N 0.29 2.55 -1.64 6.45 -5.35 -1.26 -5.00 119.36 115.40 3adr n ILE 42 Ca 0.03 -1.76 -0.45 0.00 -0.27 0.00 0.00 62.75 60.30 3adr n ILE 42 Cb 0.50 -0.28 -0.02 0.00 -1.74 0.00 0.00 39.64 38.09 3adr n ILE 42 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3adr n ALA 43 N -0.15 0.45 -3.40 -1.28 0.00 -1.26 -4.96 120.51 109.91 3adr n ALA 43 Ca 0.27 0.41 -0.36 0.00 0.00 0.00 0.00 53.44 53.76 3adr n ALA 43 Cb 1.07 -2.16 -0.13 0.00 0.00 0.00 0.00 19.45 18.22 3adr n ALA 43 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3adr s ASP 44 N -0.04 4.71 -0.19 0.00 2.15 -1.26 -4.97 116.67 117.07 3adr s ASP 44 Ca 0.65 -0.66 0.16 0.00 0.43 0.00 0.00 52.55 53.13 3adr s ASP 44 Cb -0.69 -1.79 0.62 0.00 -0.30 0.00 0.00 42.92 40.76 3adr s ASP 44 CO 0.54 -0.13 1.52 0.49 -0.17 0.00 0.00 175.17 177.43 3adr n PHE 45 N 4.80 1.29 0.07 -5.34 3.72 -1.26 -4.64 117.46 116.10 3adr n PHE 45 Ca -0.16 -0.81 0.01 0.00 -0.05 0.00 0.00 57.45 56.44 3adr n PHE 45 Cb 0.48 -0.36 0.04 0.00 -0.94 0.00 0.00 39.48 38.70 3adr n PHE 45 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3adr n SER 46 N -0.06 0.00 0.00 4.37 3.41 -1.26 -1.60 113.62 118.48 3adr n SER 46 Ca 0.23 0.48 0.11 0.00 -0.26 0.00 0.00 58.87 59.43 3adr n SER 46 Cb 0.97 -0.48 0.59 0.00 -0.26 0.00 0.00 64.21 65.03 3adr n SER 46 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 3adr n PHE 47 N -1.48 0.00 -3.70 7.33 1.16 -1.26 -4.69 117.46 114.81 3adr n PHE 47 Ca 0.00 0.00 -0.36 0.00 -1.87 0.00 0.00 57.45 55.22 3adr n PHE 47 Cb 0.02 -0.16 -0.07 0.00 -1.61 0.00 0.00 39.48 37.66 3adr n PHE 47 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3adr s LEU 48 N -2.32 4.30 0.03 5.98 1.43 -0.63 -4.79 118.68 122.69 3adr s LEU 48 Ca 0.26 0.45 0.15 0.00 -1.03 0.00 0.00 54.13 53.96 3adr s LEU 48 Cb 0.15 -2.21 -0.16 0.00 0.03 0.00 0.00 46.19 44.00 3adr s LEU 48 CO 0.30 0.25 0.80 -2.24 0.23 0.00 0.00 176.35 175.68 3adr h ASP 49 N 5.94 0.00 -5.06 2.29 3.04 -1.89 -3.48 116.42 117.26 3adr h ASP 49 Ca -0.47 0.00 -0.06 0.00 -3.24 0.00 0.00 57.03 53.27 3adr h ASP 49 Cb 1.19 0.00 -0.14 0.00 -1.04 0.00 0.00 39.33 39.34 3adr h ASP 49 CO 0.69 0.73 -0.04 -1.59 -2.04 0.00 0.00 179.24 176.99 3adr s LYS 50 N -2.81 1.05 -0.14 4.15 -2.85 -1.26 -5.09 119.74 112.80 3adr s LYS 50 Ca -0.03 -0.56 -0.04 0.00 -1.00 0.00 0.00 55.97 54.33 3adr s LYS 50 Cb 0.08 0.47 0.07 0.00 -2.06 0.00 0.00 37.83 36.39 3adr s LYS 50 CO 0.81 -0.40 0.19 -1.17 0.10 0.00 0.00 175.35 174.88 3adr s LEU 51 N -2.54 -0.08 -0.11 2.77 2.96 -1.26 -4.84 118.68 115.57 3adr s LEU 51 Ca 0.00 0.09 -0.18 0.00 -0.22 0.00 0.00 54.13 53.82 3adr s LEU 51 Cb 0.01 0.32 -0.26 0.00 0.50 0.00 0.00 46.19 46.76 3adr s LEU 51 CO -0.09 -0.28 0.56 0.44 -1.32 0.00 0.00 176.35 175.66 3adr h ASP 52 N 8.34 0.31 -4.72 3.68 3.32 -1.63 -2.64 116.42 123.09 3adr h ASP 52 Ca -0.15 -0.83 -0.20 0.00 0.02 0.00 0.00 57.03 55.87 3adr h ASP 52 Cb 1.13 -0.10 -0.22 0.00 0.22 0.00 0.00 39.33 40.36 3adr h ASP 52 CO 0.20 1.53 -0.71 -0.31 -1.72 0.00 0.00 179.24 178.24 3adr s TYR 53 N -2.44 0.27 -0.24 4.55 2.02 -1.11 -1.60 117.35 118.81 3adr s TYR 53 Ca -0.20 -0.43 0.01 0.00 -0.37 0.00 0.00 57.07 56.08 3adr s TYR 53 Cb 0.04 -0.19 0.06 0.00 -0.40 0.00 0.00 41.96 41.47 3adr s TYR 53 CO 0.74 -0.14 -0.06 0.42 -1.57 0.00 0.00 175.55 174.94 3adr s ILE 54 N -1.17 1.65 -0.20 2.71 1.01 -0.45 -4.36 121.20 120.39 3adr s ILE 54 Ca -0.12 -1.31 -0.18 0.00 0.00 0.00 0.00 60.65 59.04 3adr s ILE 54 Cb -0.08 -1.89 -0.03 0.00 0.01 0.00 0.00 42.46 40.46 3adr s ILE 54 CO -0.01 -0.10 0.48 -0.69 0.00 0.00 0.00 174.94 174.62 3adr s VAL 55 N 1.34 5.14 -0.33 2.92 1.01 -1.26 -1.04 120.40 128.18 3adr s VAL 55 Ca -0.06 0.88 -0.17 0.00 0.00 0.00 0.00 61.98 62.63 3adr s VAL 55 Cb -0.19 -3.81 -0.01 0.00 0.00 0.00 0.00 36.38 32.37 3adr s VAL 55 CO -0.06 0.20 0.46 -0.76 0.00 0.00 0.00 175.10 174.94 3adr s LEU 56 N 1.50 4.29 0.33 3.92 1.43 -0.85 -0.37 118.68 128.94 3adr s LEU 56 Ca 0.23 0.03 0.02 0.00 -1.03 0.00 0.00 54.13 53.38 3adr s LEU 56 Cb -0.15 -2.52 0.58 0.00 0.03 0.00 0.00 46.19 44.14 3adr s LEU 56 CO 0.09 -0.39 1.95 0.71 0.23 0.00 0.00 176.35 178.94 3adr h THR 57 N 5.54 1.18 -2.35 5.49 1.35 -1.89 -3.44 112.91 118.78 3adr h THR 57 Ca -0.29 -0.49 0.18 0.00 -0.55 0.00 0.00 66.41 65.25 3adr h THR 57 Cb 1.14 0.47 -0.07 0.00 -1.73 0.00 0.00 68.15 67.95 3adr h THR 57 CO 0.73 0.21 0.50 -1.38 -0.25 0.00 0.00 175.52 175.33 3adr s HIS 58 N -5.47 -0.10 -0.43 4.73 0.00 -1.26 -3.96 115.29 108.80 3adr s HIS 58 Ca -0.09 -0.22 0.07 0.00 -3.00 0.00 0.00 55.06 51.82 3adr s HIS 58 Cb 0.17 0.65 0.52 0.00 -4.00 0.00 0.00 32.58 29.92 3adr s HIS 58 CO 0.77 -0.84 1.43 1.28 -1.00 0.00 0.00 174.74 176.38 3adr n LEU 59 N -0.50 4.62 -4.78 5.38 4.77 -1.26 -4.71 117.00 120.52 3adr n LEU 59 Ca -0.06 -2.38 -0.36 0.00 -0.03 0.00 0.00 56.01 53.18 3adr n LEU 59 Cb 0.61 -0.66 -0.03 0.00 -2.33 0.00 0.00 43.42 41.01 3adr n LEU 59 CO 0.15 0.62 0.75 -1.00 -1.33 0.00 0.00 177.39 176.58 3adr s HIS 60 N -2.20 3.07 0.57 -1.77 3.76 -1.26 -4.91 115.29 112.54 3adr s HIS 60 Ca 0.37 1.60 0.27 0.00 -0.15 0.00 0.00 55.06 57.15 3adr s HIS 60 Cb 0.29 -3.18 1.49 0.00 1.11 0.00 0.00 32.58 32.30 3adr s HIS 60 CO 0.10 -0.94 1.99 -0.84 -0.85 0.00 0.00 174.74 174.20 3adr h ILE 61 N 1.89 0.54 -0.00 0.60 3.07 -1.92 -1.71 117.51 119.98 3adr h ILE 61 Ca -0.49 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.92 3adr h ILE 61 Cb 1.23 0.72 0.00 0.00 -0.27 0.00 0.00 36.82 38.50 3adr h ILE 61 CO 0.61 0.00 0.00 -0.90 -1.05 0.00 0.00 178.15 176.81 3adr n ASP 62 N -4.01 0.01 0.00 2.16 5.75 -1.26 -3.21 116.55 116.00 3adr n ASP 62 Ca 0.07 -1.70 0.00 0.00 -0.01 0.00 0.00 54.79 53.16 3adr n ASP 62 Cb 0.56 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.65 3adr n ASP 62 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 3adr n HIS 63 N -0.64 0.00 -0.64 2.11 8.25 -0.64 -3.78 115.22 119.87 3adr n HIS 63 Ca 0.07 -0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.53 3adr n HIS 63 Cb 0.04 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.14 3adr n HIS 63 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 3adr n ILE 64 N -0.01 0.25 -0.26 1.59 -5.35 -1.15 -0.30 119.36 114.14 3adr n ILE 64 Ca 0.00 -0.30 0.05 0.00 -0.27 0.00 0.00 62.75 62.22 3adr n ILE 64 Cb 0.08 1.06 0.18 0.00 -1.74 0.00 0.00 39.64 39.22 3adr n ILE 64 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 3adr h GLY 65 N 0.00 1.15 -1.33 3.28 0.00 -0.76 -3.00 103.07 102.41 3adr h GLY 65 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.16 3adr h GLY 65 CO 0.00 -0.07 0.00 1.04 0.00 0.00 0.00 176.54 177.51 3adr n LEU 66 N -4.97 2.11 -0.29 3.11 4.77 -0.13 -4.37 117.00 117.22 3adr n LEU 66 Ca 0.14 -0.99 0.02 0.00 -0.03 0.00 0.00 56.01 55.15 3adr n LEU 66 Cb 0.40 -0.22 0.16 0.00 -2.33 0.00 0.00 43.42 41.43 3adr n LEU 66 CO 0.19 0.50 1.15 -0.07 -1.33 0.00 0.00 177.39 177.83 3adr h LEU 67 N 2.49 0.69 -0.38 2.23 3.38 -1.74 -1.28 115.31 120.72 3adr h LEU 67 Ca 0.00 0.04 0.07 0.00 0.09 0.00 0.00 57.88 58.08 3adr h LEU 67 Cb 0.56 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 41.16 3adr h LEU 67 CO 0.00 0.40 0.02 -0.65 0.09 0.00 0.00 178.44 178.30 3adr h PRO 68 N 0.81 0.12 -0.18 1.13 0.11 -1.84 -0.16 132.00 131.99 3adr h PRO 68 Ca 0.39 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 66.39 3adr h PRO 68 Cb 0.33 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 31.41 3adr h PRO 68 CO -0.23 0.08 -0.28 0.93 -0.21 0.00 0.00 178.00 178.28 3adr h GLU 69 N 0.12 0.50 -0.77 1.05 5.08 -1.84 -3.23 114.58 115.50 3adr h GLU 69 Ca 0.18 -0.30 0.03 0.00 -1.00 0.00 0.00 59.36 58.27 3adr h GLU 69 Cb 0.25 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 3adr h GLU 69 CO -0.29 0.90 0.51 -0.07 -1.00 0.00 0.00 179.01 179.06 3adr h LEU 70 N 0.15 0.83 0.00 1.33 3.38 -0.98 -1.65 115.31 118.37 3adr h LEU 70 Ca 0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3adr h LEU 70 Cb 0.86 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.41 3adr h LEU 70 CO 0.06 0.57 0.00 0.18 0.09 0.00 0.00 178.44 179.35 3adr n LEU 71 N -4.44 0.00 -0.09 1.67 4.77 -0.09 -1.45 117.00 117.36 3adr n LEU 71 Ca 0.10 0.40 -0.14 0.00 -0.03 0.00 0.00 56.01 56.33 3adr n LEU 71 Cb 0.10 -0.40 -0.14 0.00 -2.33 0.00 0.00 43.42 40.65 3adr n LEU 71 CO 0.35 -0.09 -1.13 0.00 -1.33 0.00 0.00 177.39 175.19 3adr n GLN 72 N -1.40 0.68 0.11 3.23 1.13 -0.68 -4.46 117.38 115.98 3adr n GLN 72 Ca 0.08 0.11 -0.20 0.00 -1.94 0.00 0.00 57.00 55.06 3adr n GLN 72 Cb 0.23 -1.57 -0.13 0.00 0.11 0.00 0.00 30.24 28.88 3adr n GLN 72 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3adr h VAL 73 N 0.01 1.36 -2.15 5.09 2.07 -1.32 -3.47 116.25 117.84 3adr h VAL 73 Ca -0.52 -2.69 -0.57 0.00 0.82 0.00 0.00 66.70 63.73 3adr h VAL 73 Cb 2.07 2.81 -0.11 0.00 -1.52 0.00 0.00 31.29 34.54 3adr h VAL 73 CO -0.00 0.80 -0.67 -0.31 0.02 0.00 0.00 177.57 177.41 3adr s TYR 74 N -2.84 2.57 -0.41 1.57 2.02 -0.53 -5.02 117.35 114.71 3adr s TYR 74 Ca -0.07 -0.29 0.06 0.00 -0.37 0.00 0.00 57.07 56.40 3adr s TYR 74 Cb 0.06 -1.20 0.46 0.00 -0.40 0.00 0.00 41.96 40.88 3adr s TYR 74 CO 0.91 0.62 1.40 1.63 -1.57 0.00 0.00 175.55 178.54 3adr n LYS 75 N -0.84 2.61 -1.67 -0.62 5.02 -1.26 -4.56 118.16 116.84 3adr n LYS 75 Ca -0.06 -1.87 -0.34 0.00 -2.02 0.00 0.00 58.31 54.02 3adr n LYS 75 Cb 0.60 -1.85 0.06 0.00 -0.02 0.00 0.00 35.03 33.82 3adr n LYS 75 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3adr s ALA 76 N -2.04 2.33 -0.03 7.82 0.00 -0.99 -4.89 121.76 123.96 3adr s ALA 76 Ca 0.34 0.79 0.03 0.00 0.00 0.00 0.00 51.96 53.12 3adr s ALA 76 Cb 0.27 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.95 3adr s ALA 76 CO 0.08 -1.51 -0.10 0.15 0.00 0.00 0.00 175.76 174.38 3adr s LYS 77 N -3.84 2.56 -0.10 0.00 -0.14 -0.63 -4.95 119.74 112.65 3adr s LYS 77 Ca 0.72 -0.68 -0.14 0.00 -1.36 0.00 0.00 55.97 54.51 3adr s LYS 77 Cb -0.26 -2.47 -0.05 0.00 -1.68 0.00 0.00 37.83 33.37 3adr s LYS 77 CO 0.41 0.62 0.34 0.08 -0.76 0.00 0.00 175.35 176.05 3adr s VAL 78 N -0.86 5.22 -0.20 3.17 1.01 0.73 -1.34 120.40 128.12 3adr s VAL 78 Ca 0.14 0.67 -0.07 0.00 0.00 0.00 0.00 61.98 62.72 3adr s VAL 78 Cb -0.11 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 3adr s VAL 78 CO 0.04 0.46 0.04 -0.76 0.00 0.00 0.00 175.10 174.88 3adr s LEU 79 N -0.15 3.53 0.04 3.92 1.43 -0.20 -0.00 118.68 127.24 3adr s LEU 79 Ca 0.20 -0.09 0.02 0.00 -1.03 0.00 0.00 54.13 53.23 3adr s LEU 79 Cb -0.14 -1.90 -0.02 0.00 0.03 0.00 0.00 46.19 44.15 3adr s LEU 79 CO 0.08 0.08 -0.07 0.54 0.23 0.00 0.00 176.35 177.22 3adr s VAL 80 N 0.89 0.45 0.18 -1.59 0.11 -0.73 -2.01 120.40 117.71 3adr s VAL 80 Ca 0.03 -0.99 -0.33 0.00 -2.93 0.00 0.00 61.98 57.75 3adr s VAL 80 Cb -0.14 -0.52 -0.14 0.00 -1.53 0.00 0.00 36.38 34.05 3adr s VAL 80 CO 0.02 -0.37 1.51 1.17 -3.33 0.00 0.00 175.10 174.10 3adr n LYS 81 N 1.58 2.05 -1.72 1.54 3.00 -1.26 -1.09 118.16 122.26 3adr n LYS 81 Ca -0.22 0.74 -0.42 0.00 -0.00 0.00 0.00 58.31 58.40 3adr n LYS 81 Cb 0.55 -2.46 -0.01 0.00 0.00 0.00 0.00 35.03 33.11 3adr n LYS 81 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 3adr n SER 82 N 2.94 3.09 0.00 3.14 3.41 0.16 -2.58 113.62 123.78 3adr n SER 82 Ca 0.15 1.21 0.00 0.00 -0.26 0.00 0.00 58.87 59.97 3adr n SER 82 Cb 0.29 -1.52 0.00 0.00 -0.26 0.00 0.00 64.21 62.72 3adr n SER 82 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3adr n GLY 83 N 0.80 0.17 0.05 5.00 0.00 -1.26 -4.92 105.19 105.03 3adr n GLY 83 Ca 0.04 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.07 3adr n GLY 83 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3adr n PHE 84 N -1.85 0.00 -0.33 1.61 3.72 -1.06 -4.73 117.46 114.82 3adr n PHE 84 Ca 0.00 -0.05 0.11 0.00 -0.05 0.00 0.00 57.45 57.46 3adr n PHE 84 Cb 0.00 -0.00 0.31 0.00 -0.94 0.00 0.00 39.48 38.85 3adr n PHE 84 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 3adr h LYS 85 N 0.23 0.80 0.00 -1.08 3.64 -1.92 -1.94 116.57 116.31 3adr h LYS 85 Ca 0.00 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3adr h LYS 85 Cb 0.09 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.73 3adr h LYS 85 CO 0.00 0.53 -0.01 0.87 -2.27 0.00 0.00 179.45 178.57 3adr h LYS 86 N 0.83 0.00 0.00 1.90 1.57 -1.97 -1.01 116.57 117.89 3adr h LYS 86 Ca 0.51 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.29 3adr h LYS 86 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.01 3adr h LYS 86 CO -0.28 0.01 0.00 1.88 -0.57 0.00 0.00 179.45 180.49 3adr h TYR 87 N 0.00 0.00 0.00 -1.35 0.05 -1.65 -3.17 116.97 110.85 3adr h TYR 87 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3adr h TYR 87 Cb 0.04 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.78 3adr h TYR 87 CO 0.00 0.00 -1.63 1.28 -1.05 0.00 0.00 178.16 176.76 3adr n LEU 88 N -2.63 0.03 -0.91 3.88 4.77 -0.41 -2.78 117.00 118.96 3adr n LEU 88 Ca 0.02 -0.02 0.09 0.00 -0.03 0.00 0.00 56.01 56.07 3adr n LEU 88 Cb 0.29 0.00 0.18 0.00 -2.33 0.00 0.00 43.42 41.55 3adr n LEU 88 CO 0.24 0.01 0.64 0.35 -1.33 0.00 0.00 177.39 177.29 3adr n THR 89 N -1.98 0.57 -4.07 -5.08 -2.24 -1.05 -0.39 114.28 100.05 3adr n THR 89 Ca -0.02 -0.79 -0.08 0.00 -2.27 0.00 0.00 64.05 60.89 3adr n THR 89 Cb 0.38 0.88 -0.10 0.00 -2.10 0.00 0.00 70.33 69.38 3adr n THR 89 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3adr s SER 90 N -1.22 0.51 0.21 3.42 1.04 -1.21 -4.72 113.70 111.74 3adr s SER 90 Ca 0.31 -0.83 -0.07 0.00 0.48 0.00 0.00 55.95 55.84 3adr s SER 90 Cb 0.18 0.15 0.16 0.00 0.10 0.00 0.00 66.02 66.61 3adr s SER 90 CO 0.24 -0.47 1.74 -0.33 0.98 0.00 0.00 173.24 175.40 3adr h GLU 91 N 3.65 1.12 -0.04 4.02 4.39 -1.94 -1.51 114.58 124.26 3adr h GLU 91 Ca -0.34 -0.25 -0.10 0.00 0.34 0.00 0.00 59.36 59.02 3adr h GLU 91 Cb 1.17 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.65 3adr h GLU 91 CO 0.57 0.97 -0.42 0.38 -1.16 0.00 0.00 179.01 179.35 3adr h ASP 92 N 1.07 0.09 -0.10 1.42 2.03 -1.96 -1.43 116.42 117.53 3adr h ASP 92 Ca 0.23 -0.04 -0.03 0.00 -0.73 0.00 0.00 57.03 56.46 3adr h ASP 92 Cb 0.33 -0.02 -0.00 0.00 -0.83 0.00 0.00 39.33 38.81 3adr h ASP 92 CO -0.00 0.50 -0.06 1.23 -1.03 0.00 0.00 179.24 179.88 3adr h GLY 93 N 1.26 0.24 1.02 7.15 0.00 -1.61 -2.60 103.07 108.54 3adr h GLY 93 Ca 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 3adr h GLY 93 CO 0.06 0.20 0.53 1.41 0.00 0.00 0.00 176.54 178.74 3adr h LEU 94 N -0.15 1.13 -1.18 3.11 4.07 -1.11 -1.84 115.31 119.32 3adr h LEU 94 Ca 0.02 -0.08 0.01 0.00 0.08 0.00 0.00 57.88 57.91 3adr h LEU 94 Cb 0.53 -0.29 -0.04 0.00 1.08 0.00 0.00 40.66 41.94 3adr h LEU 94 CO 0.02 0.88 0.55 0.50 -1.08 0.00 0.00 178.44 179.31 3adr h LYS 95 N 1.28 1.09 -0.29 1.13 3.64 -1.19 -0.39 116.57 121.84 3adr h LYS 95 Ca 0.33 -0.07 -0.16 0.00 -1.27 0.00 0.00 60.65 59.48 3adr h LYS 95 Cb -0.02 -0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 31.56 3adr h LYS 95 CO -0.06 0.72 -0.46 0.87 -2.27 0.00 0.00 179.45 178.26 3adr h LYS 96 N 1.12 0.81 -0.22 1.90 1.57 -1.03 -0.04 116.57 120.69 3adr h LYS 96 Ca 0.31 -0.49 -0.00 0.00 -1.87 0.00 0.00 60.65 58.59 3adr h LYS 96 Cb -0.11 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 3adr h LYS 96 CO -0.07 1.13 0.12 -0.07 -0.57 0.00 0.00 179.45 179.99 3adr h LEU 97 N 0.58 0.27 -0.83 2.94 3.38 -0.83 -1.58 115.31 119.24 3adr h LEU 97 Ca 0.02 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 3adr h LEU 97 Cb 1.06 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 3adr h LEU 97 CO 0.10 0.28 -0.26 0.78 0.09 0.00 0.00 178.44 179.44 3adr h ASN 98 N 0.24 0.59 0.11 -0.43 2.35 -1.07 -1.77 115.58 115.61 3adr h ASN 98 Ca 0.08 -0.21 -0.01 0.00 -0.55 0.00 0.00 56.30 55.61 3adr h ASN 98 Cb 0.07 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.28 3adr h ASN 98 CO -0.01 0.84 -0.05 -0.08 -1.65 0.00 0.00 177.43 176.47 3adr h GLU 99 N 0.51 -0.14 -0.40 0.81 4.81 -0.71 -0.30 114.58 119.17 3adr h GLU 99 Ca 0.07 0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.23 3adr h GLU 99 Cb 0.72 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.11 3adr h GLU 99 CO 0.05 -0.09 -0.09 0.66 -0.73 0.00 0.00 179.01 178.82 3adr h SER 100 N -0.15 0.66 -0.01 1.04 4.64 -1.25 -2.16 113.55 116.33 3adr h SER 100 Ca -0.01 -0.18 -0.00 0.00 -0.47 0.00 0.00 61.79 61.13 3adr h SER 100 Cb 0.11 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.02 3adr h SER 100 CO 0.02 0.79 0.00 0.00 -0.87 0.00 0.00 176.83 176.78 3adr h ALA 101 N 1.28 0.02 -0.95 5.18 0.00 -1.05 -2.16 119.26 121.59 3adr h ALA 101 Ca 0.11 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3adr h ALA 101 Cb 0.52 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 3adr h ALA 101 CO 0.03 -0.39 0.56 1.49 0.00 0.00 0.00 179.25 180.94 3adr h GLU 102 N -0.16 1.29 -0.71 0.00 4.22 -0.96 0.30 114.58 118.55 3adr h GLU 102 Ca 0.00 -0.12 -0.07 0.00 0.08 0.00 0.00 59.36 59.26 3adr h GLU 102 Cb 0.18 -0.27 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 3adr h GLU 102 CO -0.00 0.91 0.19 -0.22 -2.18 0.00 0.00 179.01 177.71 3adr h LYS 103 N 1.31 1.13 0.19 1.92 3.64 -1.29 -1.07 116.57 122.39 3adr h LYS 103 Ca 0.34 -0.26 -0.26 0.00 -1.27 0.00 0.00 60.65 59.20 3adr h LYS 103 Cb -0.04 -0.15 0.03 0.00 -0.41 0.00 0.00 32.23 31.65 3adr h LYS 103 CO -0.06 0.98 -1.16 0.28 -2.27 0.00 0.00 179.45 177.22 3adr h VAL 104 N 1.07 1.37 0.00 2.00 2.07 -1.00 -3.39 116.25 118.37 3adr h VAL 104 Ca 0.23 -2.59 -0.12 0.00 0.82 0.00 0.00 66.70 65.03 3adr h VAL 104 Cb 0.35 3.10 -0.02 0.00 -1.52 0.00 0.00 31.29 33.19 3adr h VAL 104 CO -0.00 0.76 -1.03 -0.07 0.02 0.00 0.00 177.57 177.25 3adr h LEU 105 N -0.14 0.00 0.00 2.57 3.38 -0.44 -3.48 115.31 117.19 3adr h LEU 105 Ca -0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.76 3adr h LEU 105 Cb 1.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.63 3adr h LEU 105 CO 0.20 0.47 0.00 0.61 0.09 0.00 0.00 178.44 179.81 3adr n GLY 106 N 1.31 3.27 0.38 0.83 0.00 -0.41 -2.18 105.19 108.39 3adr n GLY 106 Ca -0.04 -0.18 0.17 0.00 0.00 0.00 0.00 46.02 45.96 3adr n GLY 106 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3adr h ASP 107 N 1.18 0.26 0.04 1.61 3.32 -1.96 -0.64 116.42 120.22 3adr h ASP 107 Ca 0.00 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 3adr h ASP 107 Cb 0.00 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 3adr h ASP 107 CO 0.00 0.13 -0.02 -0.07 -1.72 0.00 0.00 179.24 177.57 3adr h LEU 108 N 0.27 0.00 -0.75 1.55 3.38 -1.84 -1.96 115.31 115.95 3adr h LEU 108 Ca 0.33 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.37 3adr h LEU 108 Cb 0.91 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.60 3adr h LEU 108 CO -0.08 0.02 0.44 0.22 0.09 0.00 0.00 178.44 179.13 3adr h TYR 109 N 0.00 0.80 0.00 1.13 3.20 -1.26 0.05 116.97 120.89 3adr h TYR 109 Ca -0.00 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 61.77 3adr h TYR 109 Cb 0.04 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.04 3adr h TYR 109 CO 0.00 0.38 -0.62 1.88 -1.64 0.00 0.00 178.16 178.16 3adr h TYR 110 N 0.78 0.00 0.12 -3.82 0.05 -1.52 0.12 116.97 112.70 3adr h TYR 110 Ca 0.34 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 59.12 3adr h TYR 110 Cb 0.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.96 3adr h TYR 110 CO -0.06 0.62 -0.06 0.28 -1.05 0.00 0.00 178.16 177.89 3adr h VAL 111 N 0.00 1.06 -0.21 -2.88 2.07 -1.11 -3.28 116.25 111.90 3adr h VAL 111 Ca -0.01 -0.93 -0.16 0.00 0.82 0.00 0.00 66.70 66.42 3adr h VAL 111 Cb 1.30 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 32.70 3adr h VAL 111 CO 0.08 0.22 -0.49 1.88 0.02 0.00 0.00 177.57 179.27 3adr h TYR 112 N -0.62 0.90 0.00 1.57 0.05 -1.09 -3.44 116.97 114.34 3adr h TYR 112 Ca -0.02 -0.34 0.00 0.00 0.05 0.00 0.00 58.73 58.42 3adr h TYR 112 Cb 0.48 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.06 3adr h TYR 112 CO 0.06 1.13 0.00 0.41 -1.05 0.00 0.00 178.16 178.71 3adr n GLY 113 N 0.47 1.86 3.93 3.88 0.00 0.40 -0.94 105.19 114.79 3adr n GLY 113 Ca -0.06 -1.42 -0.30 0.00 0.00 0.00 0.00 46.02 44.25 3adr n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3adr n GLY 114 N 2.74 -1.47 3.76 -0.02 0.00 -1.25 -4.17 105.19 104.80 3adr n GLY 114 Ca 0.00 -1.72 -0.39 0.00 0.00 0.00 0.00 46.02 43.91 3adr n GLY 114 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3adr s LEU 115 N 0.00 4.42 -0.00 0.99 1.43 -1.26 -4.81 118.68 119.46 3adr s LEU 115 Ca 0.76 1.18 0.00 0.00 -1.03 0.00 0.00 54.13 55.05 3adr s LEU 115 Cb -0.02 -2.93 -0.01 0.00 0.03 0.00 0.00 46.19 43.26 3adr s LEU 115 CO 0.54 0.10 0.01 -0.62 0.23 0.00 0.00 176.35 176.61 3adr n GLU 116 N 2.69 1.71 -4.37 1.70 1.02 -1.26 -4.97 120.64 117.16 3adr n GLU 116 Ca -0.07 -0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.84 3adr n GLU 116 Cb 0.51 -0.89 -0.17 0.00 -0.02 0.00 0.00 31.44 30.88 3adr n GLU 116 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3adr s LYS 117 N -1.78 1.38 0.73 3.49 1.02 -1.26 -5.13 119.74 118.18 3adr s LYS 117 Ca -0.00 -0.29 -0.11 0.00 0.02 0.00 0.00 55.97 55.59 3adr s LYS 117 Cb 0.00 -1.23 0.03 0.00 -0.52 0.00 0.00 37.83 36.11 3adr s LYS 117 CO 0.02 -0.04 1.07 -1.59 -0.92 0.00 0.00 175.35 173.89 3adr s LYS 118 N 0.87 2.62 0.13 1.68 -2.85 -1.26 -4.84 119.74 116.10 3adr s LYS 118 Ca -0.11 0.97 0.03 0.00 -1.00 0.00 0.00 55.97 55.86 3adr s LYS 118 Cb -0.15 -1.95 -0.04 0.00 -2.06 0.00 0.00 37.83 33.63 3adr s LYS 118 CO 0.01 -1.33 0.21 -0.51 0.10 0.00 0.00 175.35 173.83 3adr s LEU 119 N -5.69 4.12 0.19 2.77 1.43 0.48 -5.00 118.68 116.98 3adr s LEU 119 Ca 0.59 0.07 -0.31 0.00 -1.03 0.00 0.00 54.13 53.46 3adr s LEU 119 Cb -0.15 -2.71 -0.09 0.00 0.03 0.00 0.00 46.19 43.26 3adr s LEU 119 CO 0.55 0.09 1.42 -1.81 0.23 0.00 0.00 176.35 176.83 3adr s ASP 120 N -3.01 6.74 0.46 2.29 1.01 -1.26 -4.33 116.67 118.57 3adr s ASP 120 Ca 0.33 2.50 0.13 0.00 0.71 0.00 0.00 52.55 56.22 3adr s ASP 120 Cb -0.11 -2.60 1.07 0.00 1.01 0.00 0.00 42.92 42.29 3adr s ASP 120 CO 0.26 -0.67 2.07 0.06 0.21 0.00 0.00 175.17 177.10 3adr h GLN 121 N 5.92 0.29 0.00 8.23 -0.00 -1.94 -1.50 115.11 126.11 3adr h GLN 121 Ca -0.44 -0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.19 3adr h GLN 121 Cb 1.21 -0.07 0.00 0.00 -0.00 0.00 0.00 27.48 28.63 3adr h GLN 121 CO 0.83 0.19 0.00 -0.40 -0.00 0.00 0.00 178.83 179.45 3adr n ASP 122 N -4.49 0.00 -0.70 0.06 5.75 -1.26 -2.33 116.55 113.59 3adr n ASP 122 Ca 0.03 0.25 0.11 0.00 -0.01 0.00 0.00 54.79 55.17 3adr n ASP 122 Cb 0.17 -0.39 0.04 0.00 -1.03 0.00 0.00 41.12 39.91 3adr n ASP 122 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3adr n LYS 123 N -1.39 1.69 -4.12 0.11 5.02 -0.57 -4.88 118.16 114.02 3adr n LYS 123 Ca 0.07 -1.40 -0.34 0.00 -2.02 0.00 0.00 58.31 54.62 3adr n LYS 123 Cb 0.20 -1.47 -0.14 0.00 -0.02 0.00 0.00 35.03 33.59 3adr n LYS 123 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3adr s VAL 124 N -2.27 3.06 -0.16 -0.18 1.01 -0.98 -0.19 120.40 120.68 3adr s VAL 124 Ca 0.23 -0.61 -0.01 0.00 0.00 0.00 0.00 61.98 61.58 3adr s VAL 124 Cb 0.19 -2.35 -0.01 0.00 0.00 0.00 0.00 36.38 34.21 3adr s VAL 124 CO 0.45 0.47 -0.11 -0.63 0.00 0.00 0.00 175.10 175.28 3adr s ILE 125 N 1.21 3.05 0.16 2.22 1.01 1.00 -4.94 121.20 124.91 3adr s ILE 125 Ca 0.02 -0.64 -0.26 0.00 0.00 0.00 0.00 60.65 59.77 3adr s ILE 125 Cb -0.14 -2.31 -0.08 0.00 0.01 0.00 0.00 42.46 39.94 3adr s ILE 125 CO -0.03 0.50 0.79 -1.61 0.00 0.00 0.00 174.94 174.59 3adr s GLU 126 N 0.72 4.59 0.13 2.79 2.02 -1.26 -1.77 118.70 125.92 3adr s GLU 126 Ca -0.05 1.18 0.06 0.00 0.02 0.00 0.00 54.97 56.18 3adr s GLU 126 Cb -0.15 -3.28 -0.04 0.00 0.10 0.00 0.00 34.13 30.76 3adr s GLU 126 CO 0.02 0.53 -0.13 0.14 0.02 0.00 0.00 175.26 175.83 3adr s VAL 127 N -1.01 1.29 -0.00 2.63 -7.23 -0.25 -4.83 120.40 111.00 3adr s VAL 127 Ca 0.37 -1.77 0.16 0.00 -1.81 0.00 0.00 61.98 58.92 3adr s VAL 127 Cb -0.23 -1.57 0.07 0.00 0.56 0.00 0.00 36.38 35.20 3adr s VAL 127 CO 0.26 -0.48 1.55 -0.33 -0.31 0.00 0.00 175.10 175.79 3adr h GLU 128 N 3.39 0.00 0.00 4.82 4.39 -1.96 0.49 114.58 125.71 3adr h GLU 128 Ca -0.39 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.31 3adr h GLU 128 Cb 1.20 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.85 3adr h GLU 128 CO 0.53 0.50 0.00 0.41 -1.16 0.00 0.00 179.01 179.28 3adr n GLY 129 N 0.84 1.19 0.00 -3.84 0.00 -1.26 -4.76 105.19 97.36 3adr n GLY 129 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3adr n GLY 129 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3adr n ASN 130 N 0.00 0.03 -4.76 1.61 0.23 -1.25 -1.24 115.26 109.88 3adr n ASN 130 Ca 0.00 -1.01 -0.37 0.00 -0.53 0.00 0.00 54.58 52.67 3adr n ASN 130 Cb 0.00 0.00 0.02 0.00 -2.08 0.00 0.00 39.78 37.72 3adr n ASN 130 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 3adr s GLU 131 N -0.01 3.39 0.04 -3.83 8.01 -1.26 -4.61 118.70 120.42 3adr s GLU 131 Ca 0.00 1.93 0.07 0.00 0.01 0.00 0.00 54.97 56.99 3adr s GLU 131 Cb 0.00 -2.25 -0.03 0.00 -4.31 0.00 0.00 34.13 27.54 3adr s GLU 131 CO 0.00 -0.90 -0.19 -2.00 0.01 0.00 0.00 175.26 172.18 3adr s GLU 132 N -2.91 2.06 -0.01 1.61 2.12 -1.26 -1.10 118.70 119.22 3adr s GLU 132 Ca 0.69 -0.98 0.01 0.00 0.36 0.00 0.00 54.97 55.05 3adr s GLU 132 Cb -0.33 -2.17 -0.00 0.00 0.26 0.00 0.00 34.13 31.89 3adr s GLU 132 CO 0.38 0.54 -0.04 -0.06 -0.54 0.00 0.00 175.26 175.54 3adr s PHE 133 N -0.90 0.41 -0.48 5.30 0.08 -1.26 -5.00 117.98 116.13 3adr s PHE 133 Ca 0.14 -0.08 -0.18 0.00 0.12 0.00 0.00 56.93 56.93 3adr s PHE 133 Cb -0.10 -0.27 0.05 0.00 -0.57 0.00 0.00 43.02 42.13 3adr s PHE 133 CO 0.05 -0.01 0.55 0.34 -0.10 0.00 0.00 175.22 176.05 3adr s ASP 134 N -0.05 6.21 0.00 1.36 2.15 -1.26 -4.53 116.67 120.54 3adr s ASP 134 Ca 0.01 -0.91 0.29 0.00 0.43 0.00 0.00 52.55 52.37 3adr s ASP 134 Cb -0.02 -2.26 1.26 0.00 -0.30 0.00 0.00 42.92 41.60 3adr s ASP 134 CO -0.00 -0.79 1.93 0.18 -0.17 0.00 0.00 175.17 176.32 3adr n LEU 135 N 5.91 0.04 -0.53 -1.34 4.77 -0.09 -4.61 117.00 121.14 3adr n LEU 135 Ca -0.07 0.42 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 3adr n LEU 135 Cb 0.46 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 3adr n LEU 135 CO 0.51 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 3adr n GLY 136 N 1.45 -0.59 0.66 -0.72 0.00 -1.26 -0.39 105.19 104.34 3adr n GLY 136 Ca 0.09 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.59 3adr n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3adr n GLY 137 N -0.07 0.64 3.21 -0.02 0.00 -1.26 -0.99 105.19 106.69 3adr n GLY 137 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 3adr n GLY 137 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3adr s TYR 138 N -2.31 -0.22 0.45 1.61 2.02 -1.26 -5.05 117.35 112.59 3adr s TYR 138 Ca 0.00 0.44 0.03 0.00 -0.37 0.00 0.00 57.07 57.17 3adr s TYR 138 Cb 0.00 0.09 0.03 0.00 -0.40 0.00 0.00 41.96 41.68 3adr s TYR 138 CO 0.00 -0.29 0.25 0.54 -1.57 0.00 0.00 175.55 174.48 3adr n ARG 139 N 1.94 0.86 0.00 -0.62 5.12 -1.26 -0.91 116.66 121.78 3adr n ARG 139 Ca -0.18 -2.91 0.00 0.00 -1.93 0.00 0.00 57.85 52.82 3adr n ARG 139 Cb 0.57 0.45 0.00 0.00 -1.16 0.00 0.00 32.46 32.31 3adr n ARG 139 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 3adr n ARG 141 N -1.43 0.00 -2.87 5.56 0.63 0.56 -0.80 116.66 118.31 3adr n ARG 141 Ca -0.06 0.00 -0.31 0.00 -0.92 0.00 0.00 57.85 56.56 3adr n ARG 141 Cb 0.52 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.39 3adr n ARG 141 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 3adr s LEU 142 N 0.00 3.86 -0.05 6.15 1.43 -0.26 -0.81 118.68 129.01 3adr s LEU 142 Ca 0.00 1.21 -0.02 0.00 -1.03 0.00 0.00 54.13 54.29 3adr s LEU 142 Cb 0.00 -4.08 0.03 0.00 0.03 0.00 0.00 46.19 42.17 3adr s LEU 142 CO 0.00 -0.37 0.08 -0.63 0.23 0.00 0.00 176.35 175.66 3adr s ILE 143 N -2.31 -0.14 -0.09 -0.59 1.01 -0.47 -3.80 121.20 114.83 3adr s ILE 143 Ca 0.53 0.39 -0.30 0.00 0.00 0.00 0.00 60.65 61.27 3adr s ILE 143 Cb -0.10 -0.18 -0.03 0.00 0.01 0.00 0.00 42.46 42.15 3adr s ILE 143 CO 0.28 0.16 1.36 -0.47 0.00 0.00 0.00 174.94 176.27 3adr s TYR 144 N 2.06 2.74 -0.49 3.97 5.04 -0.37 -0.06 117.35 130.23 3adr s TYR 144 Ca 0.03 0.84 0.08 0.00 -2.44 0.00 0.00 57.07 55.58 3adr s TYR 144 Cb -0.12 -3.61 0.28 0.00 0.35 0.00 0.00 41.96 38.86 3adr s TYR 144 CO -0.04 -2.22 0.68 0.25 -1.34 0.00 0.00 175.55 172.88 3adr n THR 145 N 5.09 0.88 -1.02 4.34 -2.24 -0.53 -4.89 114.28 115.91 3adr n THR 145 Ca 0.14 -4.70 -0.29 0.00 -2.27 0.00 0.00 64.05 56.93 3adr n THR 145 Cb 0.44 -1.70 0.17 0.00 -2.10 0.00 0.00 70.33 67.15 3adr n THR 145 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3adr s PRO 146 N -2.08 0.71 0.00 -0.78 0.04 -1.23 -4.50 135.00 127.17 3adr s PRO 146 Ca 0.39 0.86 0.00 0.00 0.04 0.00 0.00 61.00 62.29 3adr s PRO 146 Cb 0.20 -1.74 0.00 0.00 0.04 0.00 0.00 34.50 33.00 3adr s PRO 146 CO -0.08 -2.63 0.00 0.41 0.04 0.00 0.00 177.00 174.75 3adr n GLY 147 N -0.63 2.99 0.28 0.56 0.00 -1.26 -3.75 105.19 103.38 3adr n GLY 147 Ca 0.07 -0.58 -0.07 0.00 0.00 0.00 0.00 46.02 45.43 3adr n GLY 147 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3adr h HIS 148 N 0.00 0.92 -2.30 1.61 -0.00 -1.86 -0.18 115.15 113.34 3adr h HIS 148 Ca 0.00 -0.18 -0.01 0.00 -0.00 0.00 0.00 60.37 60.18 3adr h HIS 148 Cb 0.00 -0.23 -0.17 0.00 -0.00 0.00 0.00 27.41 27.01 3adr h HIS 148 CO 0.00 0.91 0.28 0.00 -0.00 0.00 0.00 177.93 179.13 3adr s ALA 149 N -4.75 -1.74 -0.12 5.26 0.00 -1.26 -4.66 121.76 114.49 3adr s ALA 149 Ca -0.10 1.05 0.30 0.00 0.00 0.00 0.00 51.96 53.21 3adr s ALA 149 Cb 0.13 0.25 1.27 0.00 0.00 0.00 0.00 23.12 24.77 3adr s ALA 149 CO 0.83 -0.53 1.88 0.00 0.00 0.00 0.00 175.76 177.94 3adr h ARG 150 N 2.49 0.00 -0.59 0.00 3.08 -1.95 -2.57 114.38 114.84 3adr h ARG 150 Ca -0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.78 3adr h ARG 150 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 3adr h ARG 150 CO 0.37 0.00 0.00 -2.39 -1.07 0.00 0.00 179.97 176.88 3adr n HIS 151 N -2.69 1.35 -2.13 3.04 1.44 -1.26 -4.85 115.22 110.12 3adr n HIS 151 Ca 0.01 -0.63 -0.28 0.00 -2.01 0.00 0.00 57.72 54.81 3adr n HIS 151 Cb 0.24 -0.23 0.06 0.00 0.12 0.00 0.00 29.99 30.18 3adr n HIS 151 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 3adr s HIS 152 N -1.87 3.11 0.19 -1.40 5.04 -0.97 -4.31 115.29 115.08 3adr s HIS 152 Ca 0.48 0.69 -0.12 0.00 -1.54 0.00 0.00 55.06 54.57 3adr s HIS 152 Cb 0.31 -3.09 -0.00 0.00 0.04 0.00 0.00 32.58 29.84 3adr s HIS 152 CO 0.22 -1.26 0.38 -1.12 -2.34 0.00 0.00 174.74 170.62 3adr s SER 154 N -4.43 -0.05 -0.07 9.88 0.01 0.91 -1.45 113.70 118.49 3adr s SER 154 Ca 0.58 -0.81 0.01 0.00 1.31 0.00 0.00 55.95 57.05 3adr s SER 154 Cb -0.11 0.50 0.02 0.00 0.21 0.00 0.00 66.02 66.64 3adr s SER 154 CO 0.47 -0.98 -0.08 -0.69 0.41 0.00 0.00 173.24 172.37 3adr s VAL 155 N -3.96 0.89 -0.23 3.43 1.01 -0.11 -1.36 120.40 120.07 3adr s VAL 155 Ca 0.17 -0.30 -0.05 0.00 0.00 0.00 0.00 61.98 61.79 3adr s VAL 155 Cb 0.02 -0.87 -0.02 0.00 0.00 0.00 0.00 36.38 35.51 3adr s VAL 155 CO 0.02 0.31 0.01 -0.22 0.00 0.00 0.00 175.10 175.22 3adr s LEU 156 N 1.00 3.16 -0.31 3.92 2.96 0.01 -0.18 118.68 129.25 3adr s LEU 156 Ca -0.09 -0.30 0.02 0.00 -0.22 0.00 0.00 54.13 53.54 3adr s LEU 156 Cb -0.15 -1.83 0.07 0.00 0.50 0.00 0.00 46.19 44.79 3adr s LEU 156 CO -0.00 -0.02 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.31 3adr s VAL 157 N 1.51 2.47 0.00 1.68 1.01 0.10 -0.32 120.40 126.85 3adr s VAL 157 Ca 0.06 -1.84 0.00 0.00 0.00 0.00 0.00 61.98 60.20 3adr s VAL 157 Cb -0.15 -2.58 0.00 0.00 0.00 0.00 0.00 36.38 33.65 3adr s VAL 157 CO 0.00 -0.28 0.00 0.47 0.00 0.00 0.00 175.10 175.29 3adr n ASP 158 N 4.43 0.00 -1.27 3.32 8.00 0.02 -0.85 116.55 130.20 3adr n ASP 158 Ca -0.07 0.00 0.05 0.00 0.71 0.00 0.00 54.79 55.47 3adr n ASP 158 Cb 0.42 0.00 0.29 0.00 -0.02 0.00 0.00 41.12 41.81 3adr n ASP 158 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3adr n ASP 159 N 8.76 4.21 -4.66 -2.24 3.85 -1.26 -4.92 116.55 120.30 3adr n ASP 159 Ca 0.00 -3.12 -0.36 0.00 -0.71 0.00 0.00 54.79 50.61 3adr n ASP 159 Cb 0.00 -0.61 -0.09 0.00 -1.35 0.00 0.00 41.12 39.07 3adr n ASP 159 CO 0.00 0.00 0.00 -0.36 -1.01 0.00 0.00 177.20 175.83 3adr s PHE 160 N -2.89 3.31 -0.22 2.11 0.08 -0.03 -0.16 117.98 120.18 3adr s PHE 160 Ca 0.47 0.17 -0.01 0.00 0.12 0.00 0.00 56.93 57.68 3adr s PHE 160 Cb 0.38 -2.18 0.01 0.00 -0.57 0.00 0.00 43.02 40.66 3adr s PHE 160 CO 0.10 0.13 -0.10 -1.17 -0.10 0.00 0.00 175.22 174.07 3adr s LEU 161 N 0.71 2.74 -0.43 -0.37 2.96 -0.66 -0.73 118.68 122.91 3adr s LEU 161 Ca 0.06 -0.66 -0.16 0.00 -0.22 0.00 0.00 54.13 53.16 3adr s LEU 161 Cb -0.13 -1.62 0.03 0.00 0.50 0.00 0.00 46.19 44.97 3adr s LEU 161 CO 0.01 -0.05 0.35 -0.36 -1.32 0.00 0.00 176.35 174.99 3adr s PHE 162 N 1.36 3.22 -2.50 5.38 0.08 0.75 -0.24 117.98 126.02 3adr s PHE 162 Ca 0.03 -0.62 0.27 0.00 0.12 0.00 0.00 56.93 56.74 3adr s PHE 162 Cb -0.15 -2.79 0.85 0.00 -0.57 0.00 0.00 43.02 40.36 3adr s PHE 162 CO -0.07 -0.67 1.63 0.25 -0.10 0.00 0.00 175.22 176.27 3adr n THR 163 N 5.23 0.00 0.00 0.64 -2.24 -0.94 -0.93 114.28 116.04 3adr n THR 163 Ca -0.10 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 3adr n THR 163 Cb 0.46 0.68 0.00 0.00 -2.10 0.00 0.00 70.33 69.37 3adr n THR 163 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3adr n GLY 164 N 1.23 3.80 0.88 3.38 0.00 -1.26 -1.34 105.19 111.87 3adr n GLY 164 Ca 0.17 0.09 0.01 0.00 0.00 0.00 0.00 46.02 46.29 3adr n GLY 164 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3adr n ASP 165 N 6.46 2.36 -0.32 1.61 9.92 -1.26 -2.51 116.55 132.81 3adr n ASP 165 Ca 0.00 -3.69 0.10 0.00 -0.53 0.00 0.00 54.79 50.67 3adr n ASP 165 Cb 0.00 -0.58 -0.04 0.00 -0.64 0.00 0.00 41.12 39.86 3adr n ASP 165 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 3adr n SER 166 N -1.10 1.64 -0.32 -2.24 3.41 -0.45 -4.57 113.62 109.99 3adr n SER 166 Ca 0.26 -1.32 0.03 0.00 -0.26 0.00 0.00 58.87 57.58 3adr n SER 166 Cb 0.89 0.66 0.04 0.00 -0.26 0.00 0.00 64.21 65.53 3adr n SER 166 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3adr n ALA 167 N -0.52 1.98 0.00 7.33 0.00 -1.26 -4.48 120.51 123.56 3adr n ALA 167 Ca 0.07 -1.38 0.00 0.00 0.00 0.00 0.00 53.44 52.13 3adr n ALA 167 Cb 0.41 -0.41 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3adr n ALA 167 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3adr n GLY 168 N -0.40 1.87 3.32 0.00 0.00 -1.26 -4.84 105.19 103.88 3adr n GLY 168 Ca 0.04 -2.09 -0.17 0.00 0.00 0.00 0.00 46.02 43.80 3adr n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3adr s ALA 169 N -1.93 1.83 -0.22 4.61 0.00 0.41 -4.74 121.76 121.72 3adr s ALA 169 Ca 0.00 -1.66 -0.06 0.00 0.00 0.00 0.00 51.96 50.24 3adr s ALA 169 Cb 0.00 0.12 0.11 0.00 0.00 0.00 0.00 23.12 23.35 3adr s ALA 169 CO 0.00 -0.07 0.43 -0.47 0.00 0.00 0.00 175.76 175.64 3adr s TYR 170 N -3.19 -0.86 -0.05 0.00 5.04 -0.52 -1.02 117.35 116.75 3adr s TYR 170 Ca 0.23 1.40 0.01 0.00 -2.44 0.00 0.00 57.07 56.26 3adr s TYR 170 Cb 0.02 0.27 0.02 0.00 0.35 0.00 0.00 41.96 42.62 3adr s TYR 170 CO 0.06 -0.57 -0.05 -0.06 -1.34 0.00 0.00 175.55 173.59 3adr s PHE 171 N 2.62 0.82 -1.43 4.97 0.08 -0.70 -4.06 117.98 120.27 3adr s PHE 171 Ca 0.03 -0.24 -0.03 0.00 0.12 0.00 0.00 56.93 56.80 3adr s PHE 171 Cb -0.13 -0.72 0.03 0.00 -0.57 0.00 0.00 43.02 41.62 3adr s PHE 171 CO -0.14 -0.22 0.56 0.09 -0.10 0.00 0.00 175.22 175.41 3adr n ASN 172 N 4.14 -1.18 -0.18 1.36 3.02 -1.26 -1.12 115.26 120.04 3adr n ASN 172 Ca -0.23 -0.95 -0.02 0.00 -0.03 0.00 0.00 54.58 53.34 3adr n ASN 172 Cb 0.51 -3.28 -0.01 0.00 -0.61 0.00 0.00 39.78 36.39 3adr n ASN 172 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3adr n GLY 173 N -1.82 0.49 3.23 7.41 0.00 -1.26 -4.92 105.19 108.32 3adr n GLY 173 Ca -0.24 -0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.28 3adr n GLY 173 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3adr s VAL 174 N -1.79 2.43 -0.05 1.61 1.01 -0.28 -5.10 120.40 118.23 3adr s VAL 174 Ca 0.00 -0.85 -0.30 0.00 0.00 0.00 0.00 61.98 60.83 3adr s VAL 174 Cb 0.00 -2.01 -0.03 0.00 0.00 0.00 0.00 36.38 34.35 3adr s VAL 174 CO 0.00 0.53 1.07 -0.69 0.00 0.00 0.00 175.10 176.01 3adr s VAL 175 N 0.83 4.58 -0.07 2.92 1.01 -1.26 -1.72 120.40 126.68 3adr s VAL 175 Ca -0.06 1.87 0.05 0.00 0.00 0.00 0.00 61.98 63.84 3adr s VAL 175 Cb -0.15 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 32.02 3adr s VAL 175 CO -0.01 0.04 -0.23 -0.63 0.00 0.00 0.00 175.10 174.27 3adr s ILE 176 N 1.78 2.19 0.12 2.22 1.01 -0.19 -4.98 121.20 123.34 3adr s ILE 176 Ca 0.52 -1.01 -0.30 0.00 0.00 0.00 0.00 60.65 59.86 3adr s ILE 176 Cb -0.22 -1.82 -0.06 0.00 0.01 0.00 0.00 42.46 40.37 3adr s ILE 176 CO 0.22 0.57 1.14 -2.16 0.00 0.00 0.00 174.94 174.71 3adr s PRO 177 N -0.03 4.51 -1.22 2.79 0.04 -1.26 -0.44 135.00 139.39 3adr s PRO 177 Ca -0.07 1.74 -0.06 0.00 0.04 0.00 0.00 61.00 62.64 3adr s PRO 177 Cb -0.15 -3.32 0.20 0.00 0.04 0.00 0.00 34.50 31.28 3adr s PRO 177 CO 0.05 -0.10 1.92 0.25 0.04 0.00 0.00 177.00 179.17 3adr n THR 178 N 3.17 4.98 -2.61 1.26 -2.24 -1.26 -4.75 114.28 112.82 3adr n THR 178 Ca 0.06 -4.87 -0.22 0.00 -2.27 0.00 0.00 64.05 56.75 3adr n THR 178 Cb 0.46 -2.14 0.00 0.00 -2.10 0.00 0.00 70.33 66.55 3adr n THR 178 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3adr n THR 179 N 2.13 1.96 -1.21 4.28 -2.24 -1.26 -4.83 114.28 113.11 3adr n THR 179 Ca 0.43 -4.50 -0.31 0.00 -2.27 0.00 0.00 64.05 57.41 3adr n THR 179 Cb 0.31 -0.73 0.10 0.00 -2.10 0.00 0.00 70.33 67.92 3adr n THR 179 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3adr s PRO 180 N -3.37 2.03 0.27 -0.78 0.04 -1.26 -2.81 135.00 129.12 3adr s PRO 180 Ca 0.42 1.14 -0.30 0.00 0.04 0.00 0.00 61.00 62.31 3adr s PRO 180 Cb 0.40 -1.87 -0.11 0.00 0.04 0.00 0.00 34.50 32.96 3adr s PRO 180 CO -0.12 -1.79 1.52 -2.14 0.04 0.00 0.00 177.00 174.51 3adr s PRO 181 N -4.89 4.19 -0.07 0.56 0.02 -1.26 -3.62 135.00 129.92 3adr s PRO 181 Ca 0.62 2.45 0.03 0.00 0.02 0.00 0.00 61.00 64.12 3adr s PRO 181 Cb -0.18 -3.07 0.01 0.00 0.02 0.00 0.00 34.50 31.29 3adr s PRO 181 CO 0.56 -0.53 -0.16 0.54 -0.33 0.00 0.00 177.00 177.08 3adr s VAL 182 N 0.02 1.44 0.15 3.83 0.11 -1.26 -4.97 120.40 119.72 3adr s VAL 182 Ca 0.62 -0.67 0.04 0.00 -2.93 0.00 0.00 61.98 59.03 3adr s VAL 182 Cb -0.45 -1.28 -0.04 0.00 -1.53 0.00 0.00 36.38 33.09 3adr s VAL 182 CO 0.45 0.42 0.21 0.27 -3.33 0.00 0.00 175.10 173.13 3adr s ILE 183 N 0.47 4.92 -0.75 7.04 -4.36 -1.24 -4.83 121.20 122.46 3adr s ILE 183 Ca -0.14 -0.87 -0.18 0.00 -0.26 0.00 0.00 60.65 59.19 3adr s ILE 183 Cb -0.16 -3.52 0.13 0.00 1.25 0.00 0.00 42.46 40.16 3adr s ILE 183 CO 0.05 -0.10 0.87 -0.62 0.24 0.00 0.00 174.94 175.39 3adr s ASP 184 N -3.16 6.42 0.19 4.36 -1.08 -0.08 -4.83 116.67 118.50 3adr s ASP 184 Ca 0.33 -1.80 -0.19 0.00 -0.52 0.00 0.00 52.55 50.37 3adr s ASP 184 Cb -0.11 -2.33 0.16 0.00 -1.46 0.00 0.00 42.92 39.18 3adr s ASP 184 CO 0.26 -1.04 1.60 0.22 0.52 0.00 0.00 175.17 176.73 3adr h TYR 185 N 8.87 -0.74 0.00 -5.34 3.20 -1.85 0.18 116.97 121.29 3adr h TYR 185 Ca -0.08 0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.85 3adr h TYR 185 Cb 1.06 0.41 0.00 0.00 1.54 0.00 0.00 36.73 39.74 3adr h TYR 185 CO 0.99 -0.35 0.00 1.63 -1.64 0.00 0.00 178.16 178.78 3adr n LYS 186 N -5.44 0.03 -0.73 1.82 5.02 -1.26 -4.64 118.16 112.96 3adr n LYS 186 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 3adr n LYS 186 Cb 0.35 -1.01 0.00 0.00 -0.02 0.00 0.00 35.03 34.34 3adr n LYS 186 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 3adr n TYR 188 N 0.43 -0.70 0.00 2.13 9.36 0.63 -4.70 117.16 124.32 3adr n TYR 188 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 3adr n TYR 188 Cb 0.01 -0.65 0.00 0.00 -0.63 0.00 0.00 39.34 38.07 3adr n TYR 188 CO 0.00 0.00 0.00 -1.91 0.22 0.00 0.00 176.86 175.17 3adr n GLU 190 N -0.72 0.00 -0.07 2.98 2.13 -1.26 -1.35 120.64 122.36 3adr n GLU 190 Ca 0.00 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.78 3adr n GLU 190 Cb 0.02 0.00 0.17 0.00 0.27 0.00 0.00 31.44 31.90 3adr n GLU 190 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 3adr h SER 191 N 0.00 0.67 -0.29 4.31 0.02 -1.84 -0.91 113.55 115.52 3adr h SER 191 Ca 0.00 -0.19 -0.05 0.00 -0.84 0.00 0.00 61.79 60.71 3adr h SER 191 Cb 0.00 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 3adr h SER 191 CO 0.00 0.80 -0.03 0.25 -1.14 0.00 0.00 176.83 176.72 3adr h LEU 192 N 0.63 0.52 -0.70 5.07 5.85 -1.44 -2.09 115.31 123.16 3adr h LEU 192 Ca 0.11 -0.33 -0.04 0.00 0.84 0.00 0.00 57.88 58.46 3adr h LEU 192 Cb 0.53 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 3adr h LEU 192 CO 0.03 0.73 0.29 0.11 -0.34 0.00 0.00 178.44 179.26 3adr h LYS 193 N 0.30 1.04 -0.97 1.25 1.57 -1.78 -1.61 116.57 116.36 3adr h LYS 193 Ca 0.08 -0.18 0.02 0.00 -1.87 0.00 0.00 60.65 58.70 3adr h LYS 193 Cb 0.48 -0.17 -0.05 0.00 0.08 0.00 0.00 32.23 32.57 3adr h LYS 193 CO 0.02 0.85 0.64 0.00 -0.57 0.00 0.00 179.45 180.39 3adr h ARG 194 N 0.99 1.24 -0.19 3.15 3.08 -1.05 -1.06 114.38 120.54 3adr h ARG 194 Ca 0.23 -0.07 -0.18 0.00 0.07 0.00 0.00 59.98 60.02 3adr h ARG 194 Cb 0.19 -0.28 -0.00 0.00 0.08 0.00 0.00 29.97 29.96 3adr h ARG 194 CO -0.02 0.82 -0.62 1.96 -1.07 0.00 0.00 179.97 181.04 3adr h GLN 195 N 1.28 0.67 -0.84 0.04 4.20 -1.03 -2.74 115.11 116.70 3adr h GLN 195 Ca 0.37 -0.47 -0.02 0.00 0.06 0.00 0.00 58.65 58.59 3adr h GLN 195 Cb -0.10 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.71 3adr h GLN 195 CO -0.09 1.09 0.46 0.82 -0.67 0.00 0.00 178.83 180.44 3adr h ILE 196 N 0.50 1.25 0.00 2.54 2.04 -0.97 -1.99 117.51 120.87 3adr h ILE 196 Ca -0.01 -0.61 0.00 0.00 1.00 0.00 0.00 64.86 65.24 3adr h ILE 196 Cb 1.21 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.39 3adr h ILE 196 CO 0.12 0.27 0.00 -0.33 0.00 0.00 0.00 178.15 178.22 3adr h GLU 197 N 1.18 0.00 0.00 2.37 5.08 -0.99 -2.26 114.58 119.96 3adr h GLU 197 Ca 0.30 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 3adr h GLU 197 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3adr h GLU 197 CO -0.05 0.00 0.00 -0.07 -1.00 0.00 0.00 179.01 177.89 3adr h LEU 198 N 0.00 0.00 -2.96 1.33 3.38 -1.06 -3.47 115.31 112.53 3adr h LEU 198 Ca 0.00 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 3adr h LEU 198 Cb 0.33 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.12 3adr h LEU 198 CO 0.00 0.00 -0.94 0.29 0.09 0.00 0.00 178.44 177.88 3adr n LYS 199 N -2.48 -1.64 -1.25 1.13 5.02 -0.85 -4.96 118.16 113.12 3adr n LYS 199 Ca 0.02 0.39 -0.30 0.00 -2.02 0.00 0.00 58.31 56.40 3adr n LYS 199 Cb 0.29 -4.01 0.13 0.00 -0.02 0.00 0.00 35.03 31.42 3adr n LYS 199 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3adr s PRO 200 N -6.34 1.41 0.00 1.97 0.04 -1.26 -4.97 135.00 125.85 3adr s PRO 200 Ca 0.35 0.81 0.11 0.00 0.04 0.00 0.00 61.00 62.31 3adr s PRO 200 Cb -0.14 -1.83 -0.23 0.00 0.04 0.00 0.00 34.50 32.35 3adr s PRO 200 CO 0.88 -2.14 0.83 1.57 0.04 0.00 0.00 177.00 178.18 3adr h LYS 201 N -1.47 0.01 -3.53 4.56 2.10 -0.92 -3.45 116.57 113.86 3adr h LYS 201 Ca -0.49 -0.01 -0.16 0.00 -2.00 0.00 0.00 60.65 57.99 3adr h LYS 201 Cb 1.28 0.00 -0.22 0.00 -0.90 0.00 0.00 32.23 32.39 3adr h LYS 201 CO 0.55 0.64 -0.53 0.08 -2.00 0.00 0.00 179.45 178.19 3adr s VAL 202 N -2.63 0.07 -0.02 0.07 1.01 -1.22 -4.53 120.40 113.14 3adr s VAL 202 Ca -0.03 -0.56 0.07 0.00 0.00 0.00 0.00 61.98 61.45 3adr s VAL 202 Cb 0.08 -0.36 -0.02 0.00 0.00 0.00 0.00 36.38 36.08 3adr s VAL 202 CO 0.82 -0.31 -0.22 -0.69 0.00 0.00 0.00 175.10 174.71 3adr s VAL 203 N -1.07 2.40 -0.41 2.92 1.01 -0.67 -1.66 120.40 122.93 3adr s VAL 203 Ca -0.12 -1.01 -0.03 0.00 0.00 0.00 0.00 61.98 60.82 3adr s VAL 203 Cb -0.06 -1.88 0.11 0.00 0.00 0.00 0.00 36.38 34.54 3adr s VAL 203 CO 0.01 0.56 0.20 -0.83 0.00 0.00 0.00 175.10 175.04 3adr s GLY 204 N -0.72 1.98 0.43 4.51 0.00 0.67 -0.45 107.32 113.73 3adr s GLY 204 Ca 0.11 -2.48 -0.23 0.00 0.00 0.00 0.00 44.72 42.12 3adr s GLY 204 CO -0.00 1.01 1.03 -1.36 0.00 0.00 0.00 173.10 173.79 3adr s PHE 205 N 1.17 3.19 0.19 1.90 0.08 0.32 -2.22 117.98 122.61 3adr s PHE 205 Ca 0.07 1.62 -0.01 0.00 0.12 0.00 0.00 56.93 58.74 3adr s PHE 205 Cb -0.23 -3.08 0.12 0.00 -0.57 0.00 0.00 43.02 39.26 3adr s PHE 205 CO -0.04 -0.63 1.48 0.00 -0.10 0.00 0.00 175.22 175.94 3adr h ALA 206 N 2.15 0.68 -3.42 5.36 0.00 -1.78 -3.07 119.26 119.18 3adr h ALA 206 Ca -0.49 -0.56 -0.67 0.00 0.00 0.00 0.00 54.91 53.19 3adr h ALA 206 Cb 1.21 -0.07 -0.38 0.00 0.00 0.00 0.00 17.79 18.55 3adr h ALA 206 CO 0.61 0.73 -0.62 -1.01 0.00 0.00 0.00 179.25 178.96 3adr s HIS 207 N -3.77 3.62 0.00 0.00 3.76 -1.26 0.06 115.29 117.70 3adr s HIS 207 Ca -0.06 -2.78 0.00 0.00 -0.15 0.00 0.00 55.06 52.07 3adr s HIS 207 Cb 0.11 -3.05 0.00 0.00 1.11 0.00 0.00 32.58 30.75 3adr s HIS 207 CO 0.83 -0.93 0.00 0.41 -0.85 0.00 0.00 174.74 174.20 3adr n GLY 208 N 4.22 1.29 7.00 -2.22 0.00 -1.26 -1.44 105.19 112.79 3adr n GLY 208 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3adr n GLY 208 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3adr n GLY 209 N 0.00 -0.20 3.74 -0.02 0.00 -1.16 -4.82 105.19 102.74 3adr n GLY 209 Ca 0.00 -1.03 -0.41 0.00 0.00 0.00 0.00 46.02 44.58 3adr n GLY 209 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3adr s LEU 210 N 0.00 4.45 0.18 0.99 1.43 -1.26 -0.52 118.68 123.95 3adr s LEU 210 Ca 0.00 2.32 -0.05 0.00 -1.03 0.00 0.00 54.13 55.36 3adr s LEU 210 Cb 0.00 -3.61 -0.02 0.00 0.03 0.00 0.00 46.19 42.58 3adr s LEU 210 CO 0.00 -0.39 0.22 0.68 0.23 0.00 0.00 176.35 177.09 3adr s VAL 211 N -0.28 0.05 0.50 -1.59 -7.23 0.40 -4.93 120.40 107.33 3adr s VAL 211 Ca 0.52 -1.68 -0.17 0.00 -1.81 0.00 0.00 61.98 58.84 3adr s VAL 211 Cb -0.34 -2.12 -0.08 0.00 0.56 0.00 0.00 36.38 34.40 3adr s VAL 211 CO 0.39 -0.22 0.99 -0.94 -0.31 0.00 0.00 175.10 175.01 3adr s SER 212 N -3.04 6.59 0.55 4.85 1.04 -1.26 -1.67 113.70 120.75 3adr s SER 212 Ca 0.25 1.63 0.23 0.00 0.48 0.00 0.00 55.95 58.55 3adr s SER 212 Cb 0.05 -2.52 1.49 0.00 0.10 0.00 0.00 66.02 65.13 3adr s SER 212 CO 0.05 -0.61 2.12 -0.65 0.98 0.00 0.00 173.24 175.13 3adr h PRO 213 N 1.09 0.00 -0.44 4.02 0.11 -1.86 -1.67 132.00 133.24 3adr h PRO 213 Ca -0.47 0.00 0.10 0.00 0.11 0.00 0.00 66.00 65.73 3adr h PRO 213 Cb 1.19 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 3adr h PRO 213 CO 0.61 0.00 0.31 -0.22 -0.21 0.00 0.00 178.00 178.48 3adr h LYS 214 N 0.00 0.16 -1.99 1.05 1.63 -1.96 -3.28 116.57 112.18 3adr h LYS 214 Ca 0.08 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 3adr h LYS 214 Cb 0.34 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.94 3adr h LYS 214 CO -0.00 0.11 0.00 -0.89 -3.45 0.00 0.00 179.45 175.22 3adr n ILE 215 N -4.45 0.00 0.00 2.00 2.08 -0.63 -1.67 119.36 116.69 3adr n ILE 215 Ca 0.07 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.38 3adr n ILE 215 Cb 0.40 -0.78 0.00 0.00 -0.75 0.00 0.00 39.64 38.51 3adr n ILE 215 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 3adr n GLU 217 N 1.59 0.00 -0.06 0.38 1.02 -1.24 -0.98 120.64 121.35 3adr n GLU 217 Ca 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.07 3adr n GLU 217 Cb 0.00 0.00 0.12 0.00 -0.02 0.00 0.00 31.44 31.54 3adr n GLU 217 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3adr h GLU 218 N 0.00 0.70 -0.44 3.49 5.08 -1.65 -1.81 114.58 119.95 3adr h GLU 218 Ca 0.00 -0.28 -0.13 0.00 -1.00 0.00 0.00 59.36 57.95 3adr h GLU 218 Cb 0.00 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 3adr h GLU 218 CO 0.00 0.87 -0.24 1.25 -1.00 0.00 0.00 179.01 179.89 3adr h HIS 219 N 0.62 1.06 -0.48 4.33 2.76 -1.33 -1.21 115.15 120.89 3adr h HIS 219 Ca 0.09 -0.26 0.02 0.00 -2.20 0.00 0.00 60.37 58.01 3adr h HIS 219 Cb 0.71 -0.24 -0.03 0.00 1.55 0.00 0.00 27.41 29.40 3adr h HIS 219 CO 0.03 1.06 0.30 1.25 -1.30 0.00 0.00 177.93 179.27 3adr h LEU 220 N 0.79 0.49 -0.77 0.26 5.85 -1.75 -1.90 115.31 118.29 3adr h LEU 220 Ca 0.10 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 3adr h LEU 220 Cb 0.80 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.69 3adr h LEU 220 CO 0.07 0.35 0.46 0.50 -0.34 0.00 0.00 178.44 179.48 3adr h LYS 221 N 0.60 1.04 -1.42 1.25 3.64 -1.15 -2.27 116.57 118.25 3adr h LYS 221 Ca 0.19 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3adr h LYS 221 Cb -0.01 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.59 3adr h LYS 221 CO -0.07 0.73 0.00 0.94 -2.27 0.00 0.00 179.45 178.78 3adr n GLN 222 N -4.49 0.00 0.00 1.90 7.27 -0.47 -2.27 117.38 119.32 3adr n GLN 222 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.14 3adr n GLN 222 Cb 0.06 -1.25 0.00 0.00 2.41 0.00 0.00 30.24 31.46 3adr n GLN 222 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 3adr n LEU 224 N 0.81 0.00 -4.72 1.69 4.77 -0.86 -4.94 117.00 113.76 3adr n LEU 224 Ca 0.00 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.55 3adr n LEU 224 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 3adr n LEU 224 CO 0.00 0.00 1.26 -0.24 -1.33 0.00 0.00 177.39 177.08 3adr n SER 225 N 0.00 3.69 0.08 -1.43 2.88 -0.96 -4.89 113.62 112.99 3adr n SER 225 Ca 0.00 1.10 -0.09 0.00 -1.33 0.00 0.00 58.87 58.55 3adr n SER 225 Cb 0.00 -1.54 -0.03 0.00 -0.75 0.00 0.00 64.21 61.89 3adr n SER 225 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 3adr h LYS 226 N 5.70 0.19 -7.11 -1.46 1.57 -1.93 -3.45 116.57 110.08 3adr h LYS 226 Ca -0.45 -0.22 -0.47 0.00 -1.87 0.00 0.00 60.65 57.64 3adr h LYS 226 Cb 1.22 0.07 0.02 0.00 0.08 0.00 0.00 32.23 33.63 3adr h LYS 226 CO 0.87 0.98 0.38 -1.21 -0.57 0.00 0.00 179.45 179.89 3adr s GLU 227 N -3.12 3.79 0.12 3.15 0.41 -1.26 -4.97 118.70 116.82 3adr s GLU 227 Ca -0.03 1.25 -0.31 0.00 -0.41 0.00 0.00 54.97 55.47 3adr s GLU 227 Cb 0.10 -2.10 -0.09 0.00 -1.78 0.00 0.00 34.13 30.26 3adr s GLU 227 CO 0.83 -0.42 1.53 -2.00 -0.49 0.00 0.00 175.26 174.71 3adr s GLU 228 N -3.47 4.24 0.11 1.61 2.12 -1.26 -4.93 118.70 117.12 3adr s GLU 228 Ca 0.65 2.25 -0.31 0.00 0.36 0.00 0.00 54.97 57.92 3adr s GLU 228 Cb -0.14 -3.31 -0.08 0.00 0.26 0.00 0.00 34.13 30.86 3adr s GLU 228 CO 0.23 -0.59 1.41 0.42 -0.54 0.00 0.00 175.26 176.19 3adr s ILE 229 N 1.56 3.29 -0.11 -3.70 -1.09 -1.26 -5.00 121.20 114.89 3adr s ILE 229 Ca 0.69 0.91 -0.02 0.00 -2.23 0.00 0.00 60.65 60.00 3adr s ILE 229 Cb -0.40 -3.58 0.04 0.00 -1.58 0.00 0.00 42.46 36.93 3adr s ILE 229 CO 0.31 0.06 0.00 -1.10 -1.23 0.00 0.00 174.94 172.98 3adr s GLN 230 N 1.24 0.71 0.06 2.79 -0.21 -1.26 -5.03 119.66 117.96 3adr s GLN 230 Ca 0.65 -0.06 0.06 0.00 0.02 0.00 0.00 55.36 56.03 3adr s GLN 230 Cb -0.37 -1.31 -0.04 0.00 1.00 0.00 0.00 33.01 32.29 3adr s GLN 230 CO 0.30 -0.38 -0.10 0.42 -2.12 0.00 0.00 175.29 173.41 3adr s ILE 231 N 1.92 3.37 -0.05 1.08 1.01 -1.26 -5.12 121.20 122.16 3adr s ILE 231 Ca 0.04 -1.09 -0.02 0.00 0.00 0.00 0.00 60.65 59.58 3adr s ILE 231 Cb -0.13 -2.52 0.03 0.00 0.01 0.00 0.00 42.46 39.85 3adr s ILE 231 CO -0.06 0.24 0.08 0.21 0.00 0.00 0.00 174.94 175.41 3adr s ASN 232 N -1.83 0.80 -0.12 3.58 2.47 -1.26 -5.09 114.94 113.49 3adr s ASN 232 Ca 0.19 0.13 -0.00 0.00 0.42 0.00 0.00 52.86 53.60 3adr s ASN 232 Cb -0.11 -0.04 -0.02 0.00 -1.45 0.00 0.00 41.25 39.64 3adr s ASN 232 CO 0.10 -0.22 -0.11 -0.69 -3.72 0.00 0.00 177.10 172.46 3adr s VAL 233 N 1.93 3.25 -1.18 -5.21 1.01 -1.26 -5.04 120.40 113.89 3adr s VAL 233 Ca 0.01 -0.61 -0.20 0.00 0.00 0.00 0.00 61.98 61.18 3adr s VAL 233 Cb -0.12 -2.36 0.05 0.00 0.00 0.00 0.00 36.38 33.95 3adr s VAL 233 CO -0.04 0.54 1.64 -0.62 0.00 0.00 0.00 175.10 176.62 3adr s ASP 234 N 0.09 6.61 -0.11 3.32 2.15 -1.26 -4.89 116.67 122.59 3adr s ASP 234 Ca -0.05 -2.01 -0.10 0.00 0.43 0.00 0.00 52.55 50.82 3adr s ASP 234 Cb -0.14 -2.58 0.03 0.00 -0.30 0.00 0.00 42.92 39.93 3adr s ASP 234 CO 0.04 -1.40 0.29 -0.51 -0.17 0.00 0.00 175.17 173.43 3adr s ILE 235 N 4.87 0.00 0.10 4.11 1.10 -1.26 -5.03 121.20 125.09 3adr s ILE 235 Ca 0.52 -0.03 0.00 0.00 -0.51 0.00 0.00 60.65 60.63 3adr s ILE 235 Cb 0.02 -0.43 0.00 0.00 0.15 0.00 0.00 42.46 42.21 3adr s ILE 235 CO 0.01 -0.02 0.02 0.61 -2.11 0.00 0.00 174.94 173.46 3adr n GLY 236 N 2.83 3.80 7.00 1.50 0.00 -1.26 -4.50 105.19 114.56 3adr n GLY 236 Ca -0.13 -2.23 0.00 0.00 0.00 0.00 0.00 46.02 43.66 3adr n GLY 236 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3adr n GLY 237 N 3.80 -1.03 0.28 -0.02 0.00 -1.26 -1.81 105.19 105.14 3adr n GLY 237 Ca -0.03 -1.16 -0.05 0.00 0.00 0.00 0.00 46.02 44.78 3adr n GLY 237 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3adr h VAL 238 N 0.00 1.25 -0.57 1.61 -1.51 -1.98 -2.66 116.25 112.38 3adr h VAL 238 Ca 0.00 -1.08 0.05 0.00 -1.23 0.00 0.00 66.70 64.45 3adr h VAL 238 Cb 0.00 0.98 -0.05 0.00 -2.13 0.00 0.00 31.29 30.09 3adr h VAL 238 CO 0.00 0.37 0.30 0.00 -1.23 0.00 0.00 177.57 177.01 3adr h ALA 239 N 1.24 0.75 -0.73 5.19 0.00 -1.68 0.29 119.26 124.32 3adr h ALA 239 Ca 0.13 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 3adr h ALA 239 Cb 0.52 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 3adr h ALA 239 CO 0.03 -0.05 0.34 0.78 0.00 0.00 0.00 179.25 180.35 3adr h GLY 240 N 0.56 1.12 1.22 0.00 0.00 -1.03 -1.16 103.07 103.78 3adr h GLY 240 Ca 0.26 -0.55 -0.15 0.00 0.00 0.00 0.00 47.33 46.89 3adr h GLY 240 CO -0.18 0.52 -0.35 -2.09 0.00 0.00 0.00 176.54 174.45 3adr h GLU 241 N 1.04 0.87 -0.32 4.80 4.57 -0.99 -0.95 114.58 123.60 3adr h GLU 241 Ca 0.25 -0.43 -0.02 0.00 -1.18 0.00 0.00 59.36 57.98 3adr h GLU 241 Cb 0.12 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 3adr h GLU 241 CO -0.03 1.08 0.11 0.82 -1.18 0.00 0.00 179.01 179.81 3adr h ILE 242 N 0.72 1.19 -0.68 2.32 2.04 -0.67 -1.53 117.51 120.91 3adr h ILE 242 Ca 0.07 -0.61 -0.05 0.00 1.00 0.00 0.00 64.86 65.27 3adr h ILE 242 Cb 0.92 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.97 3adr h ILE 242 CO 0.08 0.21 0.24 0.25 0.00 0.00 0.00 178.15 178.94 3adr h LEU 243 N 0.36 0.96 -0.82 1.44 5.85 -1.12 -1.62 115.31 120.36 3adr h LEU 243 Ca 0.10 -0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 3adr h LEU 243 Cb 0.22 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 3adr h LEU 243 CO -0.01 0.89 0.40 0.03 -0.34 0.00 0.00 178.44 179.41 3adr h ARG 244 N 0.97 1.18 -0.34 1.25 3.08 -0.97 0.97 114.38 120.53 3adr h ARG 244 Ca 0.22 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 3adr h ARG 244 Cb 0.25 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 3adr h ARG 244 CO -0.01 0.91 0.13 0.87 -1.07 0.00 0.00 179.97 180.80 3adr h LYS 245 N 1.17 0.50 -0.67 0.04 1.57 -0.98 -1.41 116.57 116.78 3adr h LYS 245 Ca 0.28 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.95 3adr h LYS 245 Cb 0.11 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 3adr h LYS 245 CO -0.04 0.50 0.32 0.37 -0.57 0.00 0.00 179.45 180.04 3adr h GLN 246 N 0.40 0.97 -0.86 3.15 5.75 -0.89 -2.05 115.11 121.58 3adr h GLN 246 Ca 0.11 -0.14 0.01 0.00 -0.15 0.00 0.00 58.65 58.48 3adr h GLN 246 Cb 0.18 -0.17 -0.04 0.00 1.07 0.00 0.00 27.48 28.52 3adr h GLN 246 CO -0.01 0.77 0.57 0.82 -2.65 0.00 0.00 178.83 178.33 3adr h ILE 247 N 0.94 1.21 -0.81 2.39 2.04 -0.57 -0.99 117.51 121.72 3adr h ILE 247 Ca 0.23 -0.40 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 3adr h ILE 247 Cb 0.12 -0.05 -0.04 0.00 -0.74 0.00 0.00 36.82 36.11 3adr h ILE 247 CO -0.03 0.21 0.38 -0.33 0.00 0.00 0.00 178.15 178.38 3adr h GLU 248 N 1.16 1.17 -0.32 2.37 5.08 -0.78 0.70 114.58 123.96 3adr h GLU 248 Ca 0.32 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 3adr h GLU 248 Cb -0.12 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 28.91 3adr h GLU 248 CO -0.07 0.90 0.13 0.28 -1.00 0.00 0.00 179.01 179.25 3adr h VAL 249 N 1.15 1.18 -0.47 3.13 2.07 -0.74 -1.65 116.25 120.92 3adr h VAL 249 Ca 0.28 -0.56 -0.08 0.00 0.82 0.00 0.00 66.70 67.15 3adr h VAL 249 Cb 0.13 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 3adr h VAL 249 CO -0.03 0.20 -0.05 0.78 0.02 0.00 0.00 177.57 178.48 3adr h ASN 250 N 0.37 0.79 0.24 0.57 4.21 -0.76 -1.40 115.58 119.59 3adr h ASN 250 Ca 0.11 -0.21 -0.12 0.00 1.21 0.00 0.00 56.30 57.28 3adr h ASN 250 Cb 0.19 -0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 37.16 3adr h ASN 250 CO -0.01 0.89 -0.47 -0.07 -1.29 0.00 0.00 177.43 176.47 3adr h LEU 251 N 0.75 0.30 -0.17 1.61 3.38 -0.73 -1.12 115.31 119.33 3adr h LEU 251 Ca 0.14 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3adr h LEU 251 Cb 0.52 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 3adr h LEU 251 CO 0.03 0.73 0.03 -0.09 0.09 0.00 0.00 178.44 179.24 3adr h ARG 252 N 0.23 0.28 -0.89 1.13 2.43 -0.95 -1.15 114.38 115.45 3adr h ARG 252 Ca 0.01 -0.07 0.04 0.00 -0.81 0.00 0.00 59.98 59.15 3adr h ARG 252 Cb 0.92 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 30.39 3adr h ARG 252 CO 0.08 0.43 0.57 0.78 -1.51 0.00 0.00 179.97 180.32 3adr h GLY 253 N 0.08 1.30 0.89 2.80 0.00 -1.02 -1.26 103.07 105.86 3adr h GLY 253 Ca 0.05 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 46.94 3adr h GLY 253 CO 0.00 0.36 0.08 -2.00 0.00 0.00 0.00 176.54 174.98 3adr h LEU 254 N 1.10 0.28 -0.52 3.11 5.85 -0.98 -0.53 115.31 123.62 3adr h LEU 254 Ca 0.36 -0.17 0.04 0.00 0.84 0.00 0.00 57.88 58.95 3adr h LEU 254 Cb 0.03 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 3adr h LEU 254 CO -0.12 0.38 0.28 0.03 -0.34 0.00 0.00 178.44 178.67 3adr h ARG 255 N 0.17 0.54 -0.22 1.25 3.08 -0.80 -2.43 114.38 115.97 3adr h ARG 255 Ca 0.07 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 59.97 3adr h ARG 255 Cb 0.18 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 3adr h ARG 255 CO -0.01 0.36 -0.36 0.93 -1.07 0.00 0.00 179.97 179.83 3adr h GLU 256 N 0.56 0.48 -0.13 0.04 5.08 -1.11 -2.96 114.58 116.53 3adr h GLU 256 Ca 0.22 -0.22 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 3adr h GLU 256 Cb 0.10 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 3adr h GLU 256 CO -0.14 0.77 -0.18 0.66 -1.00 0.00 0.00 179.01 179.12 3adr h SER 257 N 0.40 0.20 1.08 1.42 4.64 -0.64 -2.34 113.55 118.31 3adr h SER 257 Ca 0.04 -0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 3adr h SER 257 Cb 0.81 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.84 3adr h SER 257 CO 0.07 0.40 -0.22 0.11 -0.87 0.00 0.00 176.83 176.32 3adr h LYS 258 N 0.20 0.00 0.00 4.77 1.57 -1.28 -2.97 116.57 118.85 3adr h LYS 258 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3adr h LYS 258 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 3adr h LYS 258 CO 0.03 0.22 -0.15 0.87 -0.57 0.00 0.00 179.45 179.85 3adr h LYS 259 N 0.00 0.00 0.00 3.15 1.57 -1.40 -3.52 116.57 116.36 3adr h LYS 259 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3adr h LYS 259 Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.13 3adr h LYS 259 CO 0.03 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 177.78