#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wkw s PRO 9 N 0.00 4.16 0.61 -2.82 0.02 -1.26 -5.00 135.00 130.71 2wkw s PRO 9 Ca 0.00 2.47 0.04 0.00 0.02 0.00 0.00 61.00 63.53 2wkw s PRO 9 Cb 0.00 -4.04 0.09 0.00 0.02 0.00 0.00 34.50 30.56 2wkw s PRO 9 CO 0.00 -0.90 0.85 0.00 -0.33 0.00 0.00 177.00 176.61 2wkw s ALA 10 N 4.12 4.17 0.00 -1.55 0.00 -1.26 -5.05 121.76 122.20 2wkw s ALA 10 Ca 0.83 -1.81 0.00 0.00 0.00 0.00 0.00 51.96 50.98 2wkw s ALA 10 Cb -0.40 -1.79 0.00 0.00 0.00 0.00 0.00 23.12 20.93 2wkw s ALA 10 CO 0.37 -1.02 0.00 0.41 0.00 0.00 0.00 175.76 175.52 2wkw n GLY 11 N -2.45 -2.43 3.78 0.00 0.00 -1.26 -4.98 105.19 97.84 2wkw n GLY 11 Ca 0.13 -1.60 -0.30 0.00 0.00 0.00 0.00 46.02 44.25 2wkw n GLY 11 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wkw s PRO 12 N -0.66 1.65 -0.06 1.61 0.04 -1.26 -5.07 135.00 131.24 2wkw s PRO 12 Ca 0.00 0.61 0.03 0.00 0.04 0.00 0.00 61.00 61.68 2wkw s PRO 12 Cb 0.00 -1.87 0.01 0.00 0.04 0.00 0.00 34.50 32.68 2wkw s PRO 12 CO 0.00 -1.92 -0.14 -1.17 0.04 0.00 0.00 177.00 173.81 2wkw s LEU 13 N -5.96 1.76 -0.14 -3.56 2.96 -1.26 -5.13 118.68 107.35 2wkw s LEU 13 Ca 0.62 -0.33 -0.04 0.00 -0.22 0.00 0.00 54.13 54.16 2wkw s LEU 13 Cb -0.15 -0.91 -0.03 0.00 0.50 0.00 0.00 46.19 45.59 2wkw s LEU 13 CO 0.55 0.07 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.75 2wkw s THR 14 N 0.48 4.15 -0.16 3.68 2.01 -1.26 -5.09 115.64 119.46 2wkw s THR 14 Ca -0.13 -0.27 -0.02 0.00 0.31 0.00 0.00 61.69 61.58 2wkw s THR 14 Cb -0.15 -2.81 -0.02 0.00 0.01 0.00 0.00 72.50 69.53 2wkw s THR 14 CO 0.04 0.51 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.64 2wkw s LEU 15 N 0.08 2.89 0.28 4.42 1.43 -1.26 -3.94 118.68 122.59 2wkw s LEU 15 Ca 0.01 -0.29 0.02 0.00 -1.03 0.00 0.00 54.13 52.84 2wkw s LEU 15 Cb -0.13 -1.69 0.42 0.00 0.03 0.00 0.00 46.19 44.82 2wkw s LEU 15 CO 0.02 0.12 1.75 -1.28 0.23 0.00 0.00 176.35 177.19 2wkw h SER 16 N 7.05 0.54 -4.93 2.29 0.87 -0.63 -3.47 113.55 115.27 2wkw h SER 16 Ca -0.31 -0.16 0.01 0.00 -1.23 0.00 0.00 61.79 60.09 2wkw h SER 16 Cb 1.19 -0.15 -0.13 0.00 -0.44 0.00 0.00 62.40 62.88 2wkw h SER 16 CO 0.59 0.73 0.27 -0.83 -0.53 0.00 0.00 176.83 177.06 2wkw s GLY 17 N -3.93 -0.58 0.03 5.77 0.00 -1.01 -5.00 107.32 102.60 2wkw s GLY 17 Ca -0.07 0.58 -0.14 0.00 0.00 0.00 0.00 44.72 45.09 2wkw s GLY 17 CO 0.79 0.19 0.30 -0.86 0.00 0.00 0.00 173.10 173.52 2wkw s GLN 18 N -3.63 0.78 0.00 2.90 -2.07 -1.26 -0.44 119.66 115.94 2wkw s GLN 18 Ca 0.02 -0.47 0.00 0.00 -1.82 0.00 0.00 55.36 53.09 2wkw s GLN 18 Cb -0.01 0.34 0.00 0.00 -1.09 0.00 0.00 33.01 32.25 2wkw s GLN 18 CO -0.12 -0.24 0.00 0.41 -1.32 0.00 0.00 175.29 174.02 2wkw n GLY 19 N 0.69 -1.21 3.08 2.60 0.00 -0.72 -5.01 105.19 104.62 2wkw n GLY 19 Ca -0.19 -0.89 -0.11 0.00 0.00 0.00 0.00 46.02 44.82 2wkw n GLY 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wkw s SER 20 N -2.56 -0.01 0.31 1.61 0.01 -1.26 -0.29 113.70 111.51 2wkw s SER 20 Ca 0.00 -0.10 -0.19 0.00 1.31 0.00 0.00 55.95 56.97 2wkw s SER 20 Cb 0.00 0.23 0.06 0.00 0.21 0.00 0.00 66.02 66.51 2wkw s SER 20 CO 0.00 -0.29 0.85 0.72 0.41 0.00 0.00 173.24 174.93 2wkw s PHE 21 N -1.04 0.04 0.13 2.43 -0.71 -0.64 -5.02 117.98 113.17 2wkw s PHE 21 Ca -0.11 -0.60 0.10 0.00 -1.04 0.00 0.00 56.93 55.28 2wkw s PHE 21 Cb -0.06 0.77 -0.04 0.00 -1.21 0.00 0.00 43.02 42.48 2wkw s PHE 21 CO 0.01 -1.32 -0.25 -0.06 -1.34 0.00 0.00 175.22 172.26 2wkw s PHE 22 N -2.60 2.20 -0.09 3.49 0.40 -1.26 -0.90 117.98 119.22 2wkw s PHE 22 Ca 0.16 -0.39 0.03 0.00 -0.60 0.00 0.00 56.93 56.14 2wkw s PHE 22 Cb -0.04 -1.18 -0.01 0.00 0.51 0.00 0.00 43.02 42.30 2wkw s PHE 22 CO 0.09 0.33 -0.21 0.08 0.70 0.00 0.00 175.22 176.21 2wkw s VAL 23 N -1.18 2.36 0.00 -0.44 1.01 -0.43 -4.92 120.40 116.80 2wkw s VAL 23 Ca 0.13 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.19 2wkw s VAL 23 Cb -0.10 -1.92 0.00 0.00 0.00 0.00 0.00 36.38 34.37 2wkw s VAL 23 CO 0.06 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.33 2wkw n GLY 24 N 3.33 0.00 0.00 4.51 0.00 -1.26 -0.88 105.19 110.89 2wkw n GLY 24 Ca -0.18 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 44.85 2wkw n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wkw n GLY 25 N 0.00 2.52 3.04 -0.02 0.00 -1.26 -4.48 105.19 104.99 2wkw n GLY 25 Ca 0.00 -1.88 -0.11 0.00 0.00 0.00 0.00 46.02 44.03 2wkw n GLY 25 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2wkw s ARG 26 N -3.22 0.37 0.05 1.61 1.70 -0.17 -4.86 118.95 114.43 2wkw s ARG 26 Ca 0.00 -0.40 -0.22 0.00 -0.47 0.00 0.00 55.73 54.64 2wkw s ARG 26 Cb 0.00 0.15 -0.06 0.00 -0.57 0.00 0.00 34.95 34.47 2wkw s ARG 26 CO 0.00 -0.08 0.65 -0.51 -1.08 0.00 0.00 175.30 174.28 2wkw s ASP 27 N -1.22 7.10 -0.04 -2.89 1.01 -1.26 -0.93 116.67 118.44 2wkw s ASP 27 Ca -0.13 1.31 0.03 0.00 0.71 0.00 0.00 52.55 54.47 2wkw s ASP 27 Cb -0.08 -2.40 0.00 0.00 1.01 0.00 0.00 42.92 41.45 2wkw s ASP 27 CO 0.00 0.14 -0.13 0.68 0.21 0.00 0.00 175.17 176.08 2wkw s VAL 28 N -0.52 1.12 -0.15 -1.27 -7.23 0.44 -4.97 120.40 107.82 2wkw s VAL 28 Ca 0.33 -0.53 -0.18 0.00 -1.81 0.00 0.00 61.98 59.79 2wkw s VAL 28 Cb -0.20 -0.98 -0.04 0.00 0.56 0.00 0.00 36.38 35.72 2wkw s VAL 28 CO 0.20 0.34 0.47 -0.89 -0.31 0.00 0.00 175.10 174.90 2wkw s THR 29 N 0.22 5.18 0.12 5.32 2.01 -1.26 -1.08 115.64 126.15 2wkw s THR 29 Ca -0.06 0.90 0.08 0.00 0.31 0.00 0.00 61.69 62.92 2wkw s THR 29 Cb -0.11 -3.80 -0.04 0.00 0.01 0.00 0.00 72.50 68.56 2wkw s THR 29 CO 0.02 0.28 -0.18 -0.55 -0.69 0.00 0.00 174.62 173.50 2wkw s SER 30 N 0.79 2.43 0.00 3.53 0.15 0.18 -5.00 113.70 115.79 2wkw s SER 30 Ca 0.24 -0.76 0.20 0.00 0.70 0.00 0.00 55.95 56.33 2wkw s SER 30 Cb -0.15 -0.13 0.14 0.00 -1.71 0.00 0.00 66.02 64.18 2wkw s SER 30 CO 0.09 -0.02 1.11 -0.62 1.20 0.00 0.00 173.24 175.01 2wkw n GLU 31 N 0.74 1.72 -2.53 5.44 -0.58 -1.26 -1.98 120.64 122.19 2wkw n GLU 31 Ca -0.17 -1.62 -0.09 0.00 -0.42 0.00 0.00 57.16 54.87 2wkw n GLU 31 Cb 0.55 -1.38 0.04 0.00 -0.57 0.00 0.00 31.44 30.09 2wkw n GLU 31 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2wkw n THR 32 N 1.02 1.71 0.26 2.62 -2.24 -1.03 -4.23 114.28 112.40 2wkw n THR 32 Ca 0.11 -3.37 0.15 0.00 -2.27 0.00 0.00 64.05 58.67 2wkw n THR 32 Cb 0.48 0.43 0.56 0.00 -2.10 0.00 0.00 70.33 69.70 2wkw n THR 32 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2wkw h LEU 33 N 2.44 0.00 -7.97 3.22 3.38 -1.31 -3.42 115.31 111.65 2wkw h LEU 33 Ca 0.04 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 2wkw h LEU 33 Cb 1.37 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.98 2wkw h LEU 33 CO 0.39 0.03 -0.42 -0.94 0.09 0.00 0.00 178.44 177.58 2wkw s SER 34 N -5.85 0.17 -0.00 -0.43 1.04 -1.26 -4.96 113.70 102.40 2wkw s SER 34 Ca 0.02 -0.78 0.18 0.00 0.48 0.00 0.00 55.95 55.85 2wkw s SER 34 Cb 0.08 0.33 -0.21 0.00 0.10 0.00 0.00 66.02 66.33 2wkw s SER 34 CO 0.58 -0.74 0.73 0.18 0.98 0.00 0.00 173.24 174.96 2wkw n LEU 35 N -0.07 0.76 -4.85 2.42 4.77 -1.26 -4.67 117.00 114.09 2wkw n LEU 35 Ca -0.13 -0.45 -0.35 0.00 -0.03 0.00 0.00 56.01 55.05 2wkw n LEU 35 Cb 0.62 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.66 2wkw n LEU 35 CO 0.24 0.19 0.15 -0.55 -1.33 0.00 0.00 177.39 176.09 2wkw s SER 36 N -2.85 6.74 0.45 -1.43 0.15 -1.26 -4.99 113.70 110.50 2wkw s SER 36 Ca 0.05 0.94 0.24 0.00 0.70 0.00 0.00 55.95 57.88 2wkw s SER 36 Cb 0.13 -2.23 0.97 0.00 -1.71 0.00 0.00 66.02 63.18 2wkw s SER 36 CO 0.74 0.15 1.85 -0.65 1.20 0.00 0.00 173.24 176.53 2wkw h PRO 37 N 3.68 0.00 0.36 5.44 0.11 -2.03 -3.25 132.00 136.31 2wkw h PRO 37 Ca -0.49 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 2wkw h PRO 37 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2wkw h PRO 37 CO 0.66 0.21 -0.17 0.87 -0.21 0.00 0.00 178.00 179.36 2wkw h LYS 38 N 0.00 -0.46 -5.83 1.05 1.79 -2.03 -3.45 116.57 107.64 2wkw h LYS 38 Ca -0.00 0.03 -0.61 0.00 -2.18 0.00 0.00 60.65 57.89 2wkw h LYS 38 Cb 0.71 0.11 -0.07 0.00 -1.58 0.00 0.00 32.23 31.40 2wkw h LYS 38 CO 0.03 -0.15 -0.25 0.71 -1.08 0.00 0.00 179.45 178.70 2wkw s TYR 39 N -4.74 3.63 -0.15 -1.35 1.51 -1.23 -5.02 117.35 109.99 2wkw s TYR 39 Ca -0.14 0.84 -0.29 0.00 -1.01 0.00 0.00 57.07 56.47 2wkw s TYR 39 Cb 0.02 -2.29 -0.03 0.00 -0.11 0.00 0.00 41.96 39.56 2wkw s TYR 39 CO 0.53 0.52 1.48 0.34 -1.11 0.00 0.00 175.55 177.32 2wkw s ASP 40 N -0.55 6.69 0.48 2.29 -1.08 -1.26 -4.56 116.67 118.67 2wkw s ASP 40 Ca 0.21 1.81 0.27 0.00 -0.52 0.00 0.00 52.55 54.32 2wkw s ASP 40 Cb -0.15 -2.54 1.08 0.00 -1.46 0.00 0.00 42.92 39.85 2wkw s ASP 40 CO 0.10 -0.97 1.89 0.00 0.52 0.00 0.00 175.17 176.71 2wkw h ALA 41 N 9.38 1.04 -2.89 3.66 0.00 -1.85 -3.42 119.26 125.18 2wkw h ALA 41 Ca -0.32 -0.14 -0.58 0.00 0.00 0.00 0.00 54.91 53.86 2wkw h ALA 41 Cb 1.14 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 18.83 2wkw h ALA 41 CO 0.98 0.20 -0.15 -1.58 0.00 0.00 0.00 179.25 178.70 2wkw s HIS 42 N -3.70 3.55 -1.44 0.00 5.65 -1.26 -0.94 115.29 117.15 2wkw s HIS 42 Ca 0.00 0.91 0.00 0.00 0.25 0.00 0.00 55.06 56.23 2wkw s HIS 42 Cb 0.10 -2.51 0.00 0.00 -1.18 0.00 0.00 32.58 28.99 2wkw s HIS 42 CO 0.61 0.25 0.00 0.41 -0.65 0.00 0.00 174.74 175.36 2wkw n GLY 43 N 3.02 -1.61 3.46 1.59 0.00 -0.84 -5.01 105.19 105.80 2wkw n GLY 43 Ca -0.08 -1.10 -0.33 0.00 0.00 0.00 0.00 46.02 44.51 2wkw n GLY 43 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wkw s THR 44 N -2.03 3.45 0.26 2.61 2.01 -1.26 -0.65 115.64 120.03 2wkw s THR 44 Ca 0.00 -0.53 0.10 0.00 0.31 0.00 0.00 61.69 61.57 2wkw s THR 44 Cb 0.00 -2.46 -0.05 0.00 0.01 0.00 0.00 72.50 70.00 2wkw s THR 44 CO 0.00 0.53 -0.16 0.68 -0.69 0.00 0.00 174.62 174.98 2wkw s VAL 45 N 0.06 2.12 -0.17 3.82 -7.23 -0.24 -4.94 120.40 113.82 2wkw s VAL 45 Ca -0.03 -2.30 -0.06 0.00 -1.81 0.00 0.00 61.98 57.78 2wkw s VAL 45 Cb -0.14 -2.23 -0.04 0.00 0.56 0.00 0.00 36.38 34.53 2wkw s VAL 45 CO 0.04 -0.46 0.03 -0.89 -0.31 0.00 0.00 175.10 173.51 2wkw s THR 46 N -2.73 4.46 0.12 5.32 2.01 -1.26 -0.42 115.64 123.15 2wkw s THR 46 Ca 0.27 -0.15 0.02 0.00 0.31 0.00 0.00 61.69 62.15 2wkw s THR 46 Cb -0.02 -2.99 -0.04 0.00 0.01 0.00 0.00 72.50 69.45 2wkw s THR 46 CO 0.12 0.47 -0.06 0.68 -0.69 0.00 0.00 174.62 175.14 2wkw s VAL 47 N 0.35 0.82 0.00 3.82 -7.23 -0.11 -4.84 120.40 113.21 2wkw s VAL 47 Ca 0.00 -1.98 0.00 0.00 -1.81 0.00 0.00 61.98 58.20 2wkw s VAL 47 Cb -0.13 -1.81 0.00 0.00 0.56 0.00 0.00 36.38 35.00 2wkw s VAL 47 CO 0.01 -0.77 0.00 0.47 -0.31 0.00 0.00 175.10 174.50 2wkw n ASP 48 N -0.12 0.00 -4.65 4.85 8.00 -1.23 -1.00 116.55 122.40 2wkw n ASP 48 Ca -0.11 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.03 2wkw n ASP 48 Cb 0.61 0.00 0.08 0.00 -0.02 0.00 0.00 41.12 41.79 2wkw n ASP 48 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wkw n GLN 49 N -2.00 0.73 -4.03 -1.24 0.00 -1.26 -4.23 117.38 105.35 2wkw n GLN 49 Ca 0.00 0.30 -0.34 0.00 0.00 0.00 0.00 57.00 56.97 2wkw n GLN 49 Cb 0.00 -2.30 -0.15 0.00 0.00 0.00 0.00 30.24 27.79 2wkw n GLN 49 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.06 178.47 2wkw s MET 50 N -3.26 3.00 0.22 2.61 1.75 -0.06 -4.38 119.30 119.19 2wkw s MET 50 Ca 0.77 -0.85 -0.30 0.00 -1.25 0.00 0.00 55.69 54.06 2wkw s MET 50 Cb -0.37 -2.79 -0.10 0.00 2.84 0.00 0.00 34.83 34.42 2wkw s MET 50 CO 0.47 -0.27 1.44 -0.47 -0.65 0.00 0.00 175.02 175.53 2wkw s TYR 51 N 1.33 3.07 -0.06 4.11 5.04 -1.22 -1.32 117.35 128.31 2wkw s TYR 51 Ca 0.03 0.99 0.00 0.00 -2.44 0.00 0.00 57.07 55.65 2wkw s TYR 51 Cb -0.15 -3.80 0.02 0.00 0.35 0.00 0.00 41.96 38.39 2wkw s TYR 51 CO -0.08 -2.66 -0.03 0.08 -1.34 0.00 0.00 175.55 171.52 2wkw s VAL 52 N 0.26 0.49 -0.17 3.14 1.01 -0.08 -1.75 120.40 123.30 2wkw s VAL 52 Ca 0.61 -0.04 -0.02 0.00 0.00 0.00 0.00 61.98 62.53 2wkw s VAL 52 Cb -0.41 -0.56 -0.01 0.00 0.00 0.00 0.00 36.38 35.39 2wkw s VAL 52 CO 0.40 0.24 -0.08 -0.60 0.00 0.00 0.00 175.10 175.06 2wkw s ARG 53 N 1.33 3.44 0.07 2.72 6.06 0.08 -1.62 118.95 131.03 2wkw s ARG 53 Ca -0.05 -0.63 0.09 0.00 -2.50 0.00 0.00 55.73 52.65 2wkw s ARG 53 Cb -0.13 -2.84 -0.03 0.00 0.06 0.00 0.00 34.95 32.00 2wkw s ARG 53 CO -0.02 0.05 -0.25 1.52 -2.50 0.00 0.00 175.30 174.09 2wkw s TYR 54 N 0.82 2.35 -0.02 5.12 -0.85 0.60 -0.07 117.35 125.31 2wkw s TYR 54 Ca -0.02 -0.38 0.03 0.00 -0.52 0.00 0.00 57.07 56.17 2wkw s TYR 54 Cb -0.15 -1.36 -0.00 0.00 0.38 0.00 0.00 41.96 40.83 2wkw s TYR 54 CO 0.01 0.20 -0.09 -0.65 -1.52 0.00 0.00 175.55 173.50 2wkw s GLN 55 N -1.50 0.87 -0.22 -3.49 -0.21 -0.64 -1.75 119.66 112.72 2wkw s GLN 55 Ca 0.13 -0.33 0.02 0.00 0.02 0.00 0.00 55.36 55.20 2wkw s GLN 55 Cb -0.10 -0.83 0.04 0.00 1.00 0.00 0.00 33.01 33.12 2wkw s GLN 55 CO 0.04 0.16 -0.16 0.42 -2.12 0.00 0.00 175.29 173.63 2wkw s ILE 56 N -0.02 2.09 0.84 1.08 -1.09 0.41 -1.58 121.20 122.94 2wkw s ILE 56 Ca 0.00 -1.25 -0.12 0.00 -2.23 0.00 0.00 60.65 57.05 2wkw s ILE 56 Cb -0.06 -2.04 0.10 0.00 -1.58 0.00 0.00 42.46 38.88 2wkw s ILE 56 CO 0.00 0.27 1.15 -2.16 -1.23 0.00 0.00 174.94 172.97 2wkw s PRO 57 N 1.21 1.69 0.49 2.79 0.04 -1.26 -0.03 135.00 139.93 2wkw s PRO 57 Ca -0.01 0.27 -0.22 0.00 0.04 0.00 0.00 61.00 61.08 2wkw s PRO 57 Cb -0.16 -1.90 -0.07 0.00 0.04 0.00 0.00 34.50 32.41 2wkw s PRO 57 CO -0.09 -1.82 1.18 -0.65 0.04 0.00 0.00 177.00 175.67 2wkw s GLN 58 N -5.39 3.57 -1.46 4.56 -0.21 -1.25 -3.34 119.66 116.14 2wkw s GLN 58 Ca 0.62 1.80 -0.09 0.00 0.02 0.00 0.00 55.36 57.71 2wkw s GLN 58 Cb -0.13 -2.29 0.06 0.00 1.00 0.00 0.00 33.01 31.65 2wkw s GLN 58 CO 0.52 -0.72 0.91 0.54 -2.12 0.00 0.00 175.29 174.42 2wkw n ARG 59 N -0.76 -5.49 -1.70 2.91 1.74 -1.26 -4.85 116.66 107.26 2wkw n ARG 59 Ca 0.09 0.62 -0.41 0.00 -0.77 0.00 0.00 57.85 57.37 2wkw n ARG 59 Cb 0.48 -5.42 0.01 0.00 -1.02 0.00 0.00 32.46 26.52 2wkw n ARG 59 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wkw n ALA 60 N -4.58 1.24 -0.89 7.54 0.00 -1.21 -4.97 120.51 117.63 2wkw n ALA 60 Ca -0.06 0.27 -0.31 0.00 0.00 0.00 0.00 53.44 53.34 2wkw n ALA 60 Cb 0.57 -2.26 0.14 0.00 0.00 0.00 0.00 19.45 17.91 2wkw n ALA 60 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2wkw s LYS 61 N -2.17 1.38 0.21 0.00 1.02 0.31 -4.94 119.74 115.56 2wkw s LYS 61 Ca 0.61 1.39 -0.09 0.00 0.02 0.00 0.00 55.97 57.90 2wkw s LYS 61 Cb -0.51 -1.78 0.24 0.00 -0.52 0.00 0.00 37.83 35.25 2wkw s LYS 61 CO 0.58 -2.33 1.83 -0.09 -0.92 0.00 0.00 175.35 174.43 2wkw h ARG 62 N -1.64 0.79 -4.98 1.68 9.65 -1.93 -3.41 114.38 114.54 2wkw h ARG 62 Ca -0.44 -0.05 -0.65 0.00 -1.10 0.00 0.00 59.98 57.74 2wkw h ARG 62 Cb 1.26 -0.18 -0.24 0.00 -1.39 0.00 0.00 29.97 29.42 2wkw h ARG 62 CO 0.45 0.52 -0.65 0.71 2.80 0.00 0.00 179.97 183.81 2wkw s TYR 63 N -6.10 3.05 0.71 2.20 2.02 -1.26 -5.01 117.35 112.97 2wkw s TYR 63 Ca -0.13 -0.54 -0.12 0.00 -0.37 0.00 0.00 57.07 55.91 2wkw s TYR 63 Cb 0.16 -2.19 0.02 0.00 -0.40 0.00 0.00 41.96 39.56 2wkw s TYR 63 CO 0.77 -0.38 1.08 -2.14 -1.57 0.00 0.00 175.55 173.31 2wkw s PRO 64 N 1.51 2.63 -0.18 -1.71 0.02 -1.26 -4.66 135.00 131.34 2wkw s PRO 64 Ca 0.06 1.17 -0.07 0.00 0.02 0.00 0.00 61.00 62.18 2wkw s PRO 64 Cb -0.15 -1.94 -0.04 0.00 0.02 0.00 0.00 34.50 32.39 2wkw s PRO 64 CO 0.02 -1.36 0.05 0.42 -0.33 0.00 0.00 177.00 175.80 2wkw s ILE 65 N -2.77 4.72 -0.26 2.83 1.01 0.14 -1.00 121.20 125.86 2wkw s ILE 65 Ca 0.62 -0.06 -0.09 0.00 0.00 0.00 0.00 60.65 61.12 2wkw s ILE 65 Cb -0.17 -3.12 -0.04 0.00 0.01 0.00 0.00 42.46 39.14 2wkw s ILE 65 CO 0.51 0.46 0.14 -0.89 0.00 0.00 0.00 174.94 175.16 2wkw s THR 66 N 0.35 4.87 -0.24 2.92 2.01 0.87 -1.12 115.64 125.31 2wkw s THR 66 Ca 0.02 0.02 -0.10 0.00 0.31 0.00 0.00 61.69 61.94 2wkw s THR 66 Cb -0.12 -3.30 -0.05 0.00 0.01 0.00 0.00 72.50 69.04 2wkw s THR 66 CO 0.00 0.29 0.15 -0.76 -0.69 0.00 0.00 174.62 173.61 2wkw s LEU 67 N 1.67 4.05 -0.27 4.42 1.43 0.09 -0.81 118.68 129.26 2wkw s LEU 67 Ca 0.07 0.09 0.02 0.00 -1.03 0.00 0.00 54.13 53.27 2wkw s LEU 67 Cb -0.16 -2.08 0.07 0.00 0.03 0.00 0.00 46.19 44.05 2wkw s LEU 67 CO 0.08 0.07 -0.03 -0.63 0.23 0.00 0.00 176.35 176.06 2wkw s ILE 68 N 1.04 1.72 0.91 -0.59 1.01 0.65 -2.89 121.20 123.05 2wkw s ILE 68 Ca 0.07 -1.51 -0.12 0.00 0.00 0.00 0.00 60.65 59.08 2wkw s ILE 68 Cb -0.14 -2.03 0.14 0.00 0.01 0.00 0.00 42.46 40.44 2wkw s ILE 68 CO 0.04 -0.23 1.12 -1.38 0.00 0.00 0.00 174.94 174.49 2wkw s HIS 69 N 1.27 2.45 0.00 3.97 -3.43 -1.26 -2.60 115.29 115.70 2wkw s HIS 69 Ca -0.02 0.97 0.00 0.00 -0.80 0.00 0.00 55.06 55.21 2wkw s HIS 69 Cb -0.19 -3.30 0.00 0.00 -1.43 0.00 0.00 32.58 27.66 2wkw s HIS 69 CO -0.08 -2.40 0.00 0.41 -2.00 0.00 0.00 174.74 170.67 2wkw n GLY 70 N -1.84 1.73 3.78 -1.38 0.00 -1.22 -4.37 105.19 101.90 2wkw n GLY 70 Ca 0.06 -1.83 -0.31 0.00 0.00 0.00 0.00 46.02 43.95 2wkw n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wkw s LEU 73 N -1.80 0.52 0.00 0.00 1.43 -1.26 -1.38 118.68 116.19 2wkw s LEU 73 Ca 0.00 -1.13 0.00 0.00 -1.03 0.00 0.00 54.13 51.97 2wkw s LEU 73 Cb 0.00 1.72 0.00 0.00 0.03 0.00 0.00 46.19 47.94 2wkw s LEU 73 CO 0.00 -1.22 0.00 0.35 0.23 0.00 0.00 176.35 175.71 2wkw n THR 74 N -0.44 0.00 0.28 5.49 -2.24 -1.26 -4.83 114.28 111.27 2wkw n THR 74 Ca -0.01 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.91 2wkw n THR 74 Cb 0.62 0.00 0.71 0.00 -2.10 0.00 0.00 70.33 69.56 2wkw n THR 74 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2wkw h GLY 75 N 0.00 0.00 0.39 3.38 0.00 -1.95 -1.10 103.07 103.79 2wkw h GLY 75 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 47.33 47.53 2wkw h GLY 75 CO 0.00 0.00 0.61 1.98 0.00 0.00 0.00 176.54 179.13 2wkw h MET 76 N 0.00 0.00 -0.94 4.80 1.85 -1.95 -2.16 114.93 116.52 2wkw h MET 76 Ca 0.00 0.00 0.28 0.00 -0.61 0.00 0.00 59.70 59.37 2wkw h MET 76 Cb 0.16 0.00 -0.18 0.00 0.43 0.00 0.00 31.60 32.02 2wkw h MET 76 CO 0.00 0.00 0.08 2.41 -0.40 0.00 0.00 176.91 179.00 2wkw n THR 77 N -3.94 -0.40 1.11 -0.77 -1.04 -0.42 -1.49 114.28 107.34 2wkw n THR 77 Ca 0.14 2.06 0.12 0.00 -2.04 0.00 0.00 64.05 64.33 2wkw n THR 77 Cb 0.87 -3.04 0.18 0.00 -1.82 0.00 0.00 70.33 66.51 2wkw n THR 77 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 2wkw n TRP 78 N -5.36 0.00 -0.67 -1.42 7.02 -0.81 -4.81 117.44 111.39 2wkw n TRP 78 Ca 0.24 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.72 2wkw n TRP 78 Cb 0.79 -0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.68 2wkw n TRP 78 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 2wkw n GLU 79 N 0.92 2.95 -1.60 -0.99 1.02 -0.56 -1.84 120.64 120.54 2wkw n GLU 79 Ca 0.14 0.00 -0.49 0.00 -0.02 0.00 0.00 57.16 56.79 2wkw n GLU 79 Cb 0.53 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.90 2wkw n GLU 79 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2wkw n THR 80 N 0.00 0.46 -0.81 2.62 -1.04 -1.26 -3.56 114.28 110.69 2wkw n THR 80 Ca 0.00 -0.12 -0.30 0.00 -2.04 0.00 0.00 64.05 61.59 2wkw n THR 80 Cb 0.00 -0.96 0.16 0.00 -1.82 0.00 0.00 70.33 67.71 2wkw n THR 80 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2wkw s THR 81 N 0.19 2.33 0.52 12.58 -4.23 -0.30 -4.85 115.64 121.88 2wkw s THR 81 Ca 0.78 0.11 0.25 0.00 -1.18 0.00 0.00 61.69 61.65 2wkw s THR 81 Cb -0.86 -2.25 0.41 0.00 1.34 0.00 0.00 72.50 71.14 2wkw s THR 81 CO 0.48 -0.14 1.96 -0.65 -0.54 0.00 0.00 174.62 175.74 2wkw h PRO 82 N -1.84 0.05 -0.63 3.99 0.11 -1.91 0.24 132.00 132.02 2wkw h PRO 82 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2wkw h PRO 82 Cb 1.27 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2wkw h PRO 82 CO 0.46 0.04 0.00 -0.40 -0.21 0.00 0.00 178.00 177.88 2wkw n ASP 83 N -4.37 3.71 0.00 -2.05 5.75 -1.26 -4.79 116.55 113.54 2wkw n ASP 83 Ca 0.12 -2.20 0.00 0.00 -0.01 0.00 0.00 54.79 52.70 2wkw n ASP 83 Cb 0.68 -0.47 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 2wkw n ASP 83 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wkw n GLY 84 N 1.22 0.68 3.98 6.12 0.00 0.07 -5.07 105.19 112.19 2wkw n GLY 84 Ca 0.21 -0.46 -0.20 0.00 0.00 0.00 0.00 46.02 45.57 2wkw n GLY 84 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wkw s ARG 85 N -0.94 3.18 0.16 1.61 0.52 -1.26 -4.82 118.95 117.40 2wkw s ARG 85 Ca 0.00 -0.88 -0.34 0.00 -0.52 0.00 0.00 55.73 53.99 2wkw s ARG 85 Cb 0.00 -2.80 -0.14 0.00 0.52 0.00 0.00 34.95 32.53 2wkw s ARG 85 CO 0.00 0.08 1.47 -0.12 0.02 0.00 0.00 175.30 176.76 2wkw n MET 86 N -1.66 1.86 -2.65 3.54 0.00 -1.26 -1.15 117.12 115.80 2wkw n MET 86 Ca -0.02 0.67 -0.23 0.00 -0.00 0.00 0.00 57.70 58.13 2wkw n MET 86 Cb 0.58 -2.38 0.09 0.00 0.00 0.00 0.00 33.22 31.51 2wkw n MET 86 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2wkw s GLY 87 N 0.65 1.77 0.41 -5.12 0.00 -1.23 -4.65 107.32 99.16 2wkw s GLY 87 Ca 0.78 -1.70 0.11 0.00 0.00 0.00 0.00 44.72 43.91 2wkw s GLY 87 CO 0.43 -1.20 1.96 1.49 0.00 0.00 0.00 173.10 175.77 2wkw h TRP 88 N -0.32 0.17 0.84 1.90 4.06 -1.74 -1.93 115.95 118.93 2wkw h TRP 88 Ca -0.37 -0.02 -0.04 0.00 2.06 0.00 0.00 58.89 60.53 2wkw h TRP 88 Cb 1.28 -0.05 0.01 0.00 -1.00 0.00 0.00 29.16 29.39 2wkw h TRP 88 CO -0.01 0.29 -0.40 0.22 -3.56 0.00 0.00 178.44 174.98 2wkw h ASP 89 N 0.16 -0.95 -0.80 -3.49 3.58 -1.69 0.24 116.42 113.46 2wkw h ASP 89 Ca 0.03 0.03 0.04 0.00 0.42 0.00 0.00 57.03 57.55 2wkw h ASP 89 Cb 0.31 0.25 -0.05 0.00 1.72 0.00 0.00 39.33 41.56 2wkw h ASP 89 CO 0.02 -0.68 0.51 -0.08 -2.88 0.00 0.00 179.24 176.12 2wkw h GLU 90 N -1.12 0.95 -0.44 0.28 4.81 -1.78 -2.37 114.58 114.90 2wkw h GLU 90 Ca -0.11 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.04 2wkw h GLU 90 Cb 0.86 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 30.01 2wkw h GLU 90 CO 0.19 0.63 0.22 -0.92 -0.73 0.00 0.00 179.01 178.39 2wkw h TYR 91 N 0.98 0.64 -0.65 0.92 3.20 -1.15 -0.92 116.97 119.99 2wkw h TYR 91 Ca 0.32 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.16 2wkw h TYR 91 Cb 0.04 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.08 2wkw h TYR 91 CO -0.03 0.52 0.39 0.74 -1.64 0.00 0.00 178.16 178.13 2wkw h PHE 92 N 0.58 0.86 -0.13 -3.82 0.04 -0.37 -1.55 116.94 112.55 2wkw h PHE 92 Ca 0.15 -0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.96 2wkw h PHE 92 Cb 0.12 -0.28 -0.04 0.00 2.20 0.00 0.00 35.95 37.94 2wkw h PHE 92 CO -0.01 0.59 -0.13 1.25 -0.60 0.00 0.00 178.31 179.41 2wkw h LEU 93 N 0.88 -0.41 -2.39 1.54 5.85 -1.16 -0.67 115.31 118.96 2wkw h LEU 93 Ca 0.23 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 59.03 2wkw h LEU 93 Cb -0.02 0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 2wkw h LEU 93 CO -0.04 -0.17 -0.03 0.03 -0.34 0.00 0.00 178.44 177.89 2wkw h ARG 94 N -0.16 0.00 -0.29 1.25 3.08 -0.82 -1.10 114.38 116.34 2wkw h ARG 94 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 2wkw h ARG 94 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.34 2wkw h ARG 94 CO -0.22 0.03 0.00 1.63 -1.07 0.00 0.00 179.97 180.34 2wkw n LYS 95 N -3.69 1.84 -0.39 0.04 4.76 -0.62 -4.92 118.16 115.19 2wkw n LYS 95 Ca -0.03 -1.29 0.00 0.00 -2.87 0.00 0.00 58.31 54.12 2wkw n LYS 95 Cb 0.12 -1.35 0.00 0.00 -1.84 0.00 0.00 35.03 31.96 2wkw n LYS 95 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wkw n GLY 96 N 1.13 0.80 3.75 0.72 0.00 -0.42 -4.98 105.19 106.20 2wkw n GLY 96 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 2wkw n GLY 96 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wkw s TYR 97 N -2.02 3.45 0.34 1.61 2.02 -0.33 -0.53 117.35 121.90 2wkw s TYR 97 Ca 0.00 0.45 -0.29 0.00 -0.37 0.00 0.00 57.07 56.86 2wkw s TYR 97 Cb 0.00 -2.20 -0.10 0.00 -0.40 0.00 0.00 41.96 39.26 2wkw s TYR 97 CO 0.00 0.33 1.34 -1.12 -1.57 0.00 0.00 175.55 174.53 2wkw s SER 98 N 0.21 6.69 -0.02 2.29 0.01 -1.26 -3.49 113.70 118.13 2wkw s SER 98 Ca 0.12 2.75 0.06 0.00 1.31 0.00 0.00 55.95 60.19 2wkw s SER 98 Cb -0.12 -2.65 -0.01 0.00 0.21 0.00 0.00 66.02 63.45 2wkw s SER 98 CO 0.01 -0.60 -0.21 0.42 0.41 0.00 0.00 173.24 173.28 2wkw s THR 99 N -1.14 1.64 -0.27 1.44 -4.23 -0.61 -0.69 115.64 111.78 2wkw s THR 99 Ca 0.50 -0.87 0.03 0.00 -1.18 0.00 0.00 61.69 60.16 2wkw s THR 99 Cb -0.41 -1.37 0.06 0.00 1.34 0.00 0.00 72.50 72.13 2wkw s THR 99 CO 0.55 0.46 -0.09 -0.31 -0.54 0.00 0.00 174.62 174.69 2wkw s TYR 100 N -0.38 3.24 -0.23 3.99 1.51 -0.28 -1.63 117.35 123.58 2wkw s TYR 100 Ca 0.05 -2.35 -0.07 0.00 -1.01 0.00 0.00 57.07 53.69 2wkw s TYR 100 Cb -0.09 -2.01 -0.03 0.00 -0.11 0.00 0.00 41.96 39.72 2wkw s TYR 100 CO 0.00 -0.88 0.06 0.08 -1.11 0.00 0.00 175.55 173.70 2wkw s VAL 101 N 1.11 4.33 0.22 0.71 1.01 0.90 -0.73 120.40 127.94 2wkw s VAL 101 Ca -0.06 -0.17 0.05 0.00 0.00 0.00 0.00 61.98 61.80 2wkw s VAL 101 Cb -0.20 -3.00 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 2wkw s VAL 101 CO -0.06 0.37 0.28 0.27 0.00 0.00 0.00 175.10 175.96 2wkw s ILE 102 N 1.36 4.96 -0.22 2.22 -4.36 -1.14 -0.74 121.20 123.28 2wkw s ILE 102 Ca 0.05 -1.07 -0.09 0.00 -0.26 0.00 0.00 60.65 59.28 2wkw s ILE 102 Cb -0.15 -3.65 -0.05 0.00 1.25 0.00 0.00 42.46 39.86 2wkw s ILE 102 CO 0.03 -0.28 0.12 -1.81 0.24 0.00 0.00 174.94 173.25 2wkw s ASP 103 N -3.73 5.91 0.67 4.36 1.01 -0.72 -3.48 116.67 120.69 2wkw s ASP 103 Ca 0.33 0.09 -0.17 0.00 0.71 0.00 0.00 52.55 53.52 2wkw s ASP 103 Cb -0.09 -2.05 -0.05 0.00 1.01 0.00 0.00 42.92 41.74 2wkw s ASP 103 CO 0.27 0.11 0.62 0.00 0.21 0.00 0.00 175.17 176.38 2wkw n GLN 104 N 4.00 0.45 -1.54 8.23 6.02 -1.26 -3.41 117.38 129.87 2wkw n GLN 104 Ca -0.16 0.19 -0.49 0.00 -0.01 0.00 0.00 57.00 56.54 2wkw n GLN 104 Cb 0.52 -1.87 -0.04 0.00 1.02 0.00 0.00 30.24 29.87 2wkw n GLN 104 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2wkw n SER 105 N -0.27 0.75 -0.50 1.08 7.64 -1.26 -1.61 113.62 119.45 2wkw n SER 105 Ca 0.11 1.15 -0.07 0.00 1.01 0.00 0.00 58.87 61.08 2wkw n SER 105 Cb 0.49 -1.16 -0.03 0.00 -1.01 0.00 0.00 64.21 62.51 2wkw n SER 105 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wkw n GLY 106 N 1.81 0.86 3.01 0.23 0.00 -1.21 -4.88 105.19 105.01 2wkw n GLY 106 Ca 0.15 -0.48 -0.10 0.00 0.00 0.00 0.00 46.02 45.58 2wkw n GLY 106 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2wkw s ARG 107 N -2.26 0.38 7.03 1.61 6.06 -0.64 -4.41 118.95 126.73 2wkw s ARG 107 Ca 0.00 -0.65 0.00 0.00 -2.50 0.00 0.00 55.73 52.58 2wkw s ARG 107 Cb 0.00 -0.03 0.00 0.00 0.06 0.00 0.00 34.95 34.98 2wkw s ARG 107 CO 0.00 -0.01 0.00 0.41 -2.50 0.00 0.00 175.30 173.20 2wkw n GLY 108 N 1.57 3.70 0.06 8.12 0.00 -1.26 -1.46 105.19 115.92 2wkw n GLY 108 Ca -0.23 0.00 0.15 0.00 0.00 0.00 0.00 46.02 45.94 2wkw n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wkw n ARG 109 N 14.00 1.08 -3.39 1.61 1.74 -1.26 -4.72 116.66 125.71 2wkw n ARG 109 Ca 0.00 -0.12 -0.40 0.00 -0.77 0.00 0.00 57.85 56.57 2wkw n ARG 109 Cb 0.00 -1.48 -0.09 0.00 -1.02 0.00 0.00 32.46 29.87 2wkw n ARG 109 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2wkw s SER 110 N -1.96 6.23 0.29 0.55 0.01 -0.54 -4.79 113.70 113.50 2wkw s SER 110 Ca 0.45 0.12 -0.30 0.00 1.31 0.00 0.00 55.95 57.53 2wkw s SER 110 Cb 0.21 -2.21 -0.11 0.00 0.21 0.00 0.00 66.02 64.12 2wkw s SER 110 CO 0.35 -0.24 1.62 0.00 0.41 0.00 0.00 173.24 175.38 2wkw s ALA 111 N 2.07 3.77 0.60 1.44 0.00 -1.26 -2.63 121.76 125.74 2wkw s ALA 111 Ca 0.14 1.60 0.01 0.00 0.00 0.00 0.00 51.96 53.71 2wkw s ALA 111 Cb -0.16 -3.66 0.06 0.00 0.00 0.00 0.00 23.12 19.36 2wkw s ALA 111 CO 0.11 -1.01 0.84 0.95 0.00 0.00 0.00 175.76 176.66 2wkw s THR 112 N 0.06 2.48 -0.27 0.00 -4.23 -1.26 -3.54 115.64 108.88 2wkw s THR 112 Ca 0.64 -0.65 -0.06 0.00 -1.18 0.00 0.00 61.69 60.45 2wkw s THR 112 Cb -0.48 -2.83 0.00 0.00 1.34 0.00 0.00 72.50 70.52 2wkw s THR 112 CO 0.48 0.00 0.04 -0.62 -0.54 0.00 0.00 174.62 173.97 2wkw s ASP 113 N -4.53 4.86 0.00 3.99 2.15 -1.26 -4.94 116.67 116.94 2wkw s ASP 113 Ca 0.60 -0.59 0.16 0.00 0.43 0.00 0.00 52.55 53.15 2wkw s ASP 113 Cb -0.09 -1.83 0.50 0.00 -0.30 0.00 0.00 42.92 41.20 2wkw s ASP 113 CO 0.40 -0.13 1.39 2.30 -0.17 0.00 0.00 175.17 178.97 2wkw n ILE 114 N 4.84 0.43 -0.25 4.11 -6.64 -1.26 -4.55 119.36 116.04 2wkw n ILE 114 Ca -0.16 -0.49 0.03 0.00 -1.77 0.00 0.00 62.75 60.36 2wkw n ILE 114 Cb 0.49 0.35 0.16 0.00 -1.44 0.00 0.00 39.64 39.20 2wkw n ILE 114 CO 0.00 0.00 0.00 0.28 -1.77 0.00 0.00 176.55 175.06 2wkw h SER 115 N 2.47 0.40 0.06 7.28 0.02 -1.94 -2.23 113.55 119.60 2wkw h SER 115 Ca 0.00 0.08 -0.07 0.00 -0.84 0.00 0.00 61.79 60.96 2wkw h SER 115 Cb 0.55 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.10 2wkw h SER 115 CO 0.00 0.20 -0.22 0.00 -1.14 0.00 0.00 176.83 175.68 2wkw h ALA 116 N 1.47 1.34 -0.22 3.77 0.00 -1.90 -1.47 119.26 122.26 2wkw h ALA 116 Ca 0.38 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2wkw h ALA 116 Cb 0.47 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2wkw h ALA 116 CO -0.32 0.45 -0.10 0.82 0.00 0.00 0.00 179.25 180.10 2wkw h ILE 117 N 0.25 1.30 -0.57 0.00 2.04 -1.75 -3.05 117.51 115.74 2wkw h ILE 117 Ca 0.04 -1.16 -0.07 0.00 1.00 0.00 0.00 64.86 64.68 2wkw h ILE 117 Cb 0.53 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 38.19 2wkw h ILE 117 CO 0.04 0.35 0.09 0.78 0.00 0.00 0.00 178.15 179.41 2wkw h ASN 118 N 0.15 0.86 -0.99 1.72 2.35 -1.25 -2.24 115.58 116.19 2wkw h ASN 118 Ca 0.05 -0.18 0.07 0.00 -0.55 0.00 0.00 56.30 55.69 2wkw h ASN 118 Cb 0.59 -0.23 -0.07 0.00 0.05 0.00 0.00 38.32 38.66 2wkw h ASN 118 CO 0.03 0.87 0.64 0.00 -1.65 0.00 0.00 177.43 177.31 2wkw h ALA 119 N 1.24 1.39 -0.13 -0.83 0.00 -1.26 0.22 119.26 119.89 2wkw h ALA 119 Ca 0.18 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 2wkw h ALA 119 Cb 0.38 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2wkw h ALA 119 CO 0.01 0.41 -0.38 0.28 0.00 0.00 0.00 179.25 179.57 2wkw h VAL 120 N 1.15 1.37 -0.06 0.00 2.07 -1.37 0.01 116.25 119.42 2wkw h VAL 120 Ca 0.43 -1.68 -0.01 0.00 0.82 0.00 0.00 66.70 66.25 2wkw h VAL 120 Cb 0.19 2.10 -0.00 0.00 -1.52 0.00 0.00 31.29 32.06 2wkw h VAL 120 CO -0.18 0.50 -0.03 0.50 0.02 0.00 0.00 177.57 178.38 2wkw h LYS 121 N 0.09 0.08 -0.01 1.57 3.64 -0.96 -0.15 116.57 120.82 2wkw h LYS 121 Ca -0.01 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2wkw h LYS 121 Cb 1.01 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 2wkw h LYS 121 CO 0.08 0.12 0.00 1.28 -2.27 0.00 0.00 179.45 178.66 2wkw n LEU 122 N -4.45 0.14 -0.73 5.20 4.77 0.03 -4.90 117.00 117.06 2wkw n LEU 122 Ca -0.02 -0.05 -0.10 0.00 -0.03 0.00 0.00 56.01 55.81 2wkw n LEU 122 Cb 0.15 -0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.19 2wkw n LEU 122 CO 0.35 0.03 -0.09 0.61 -1.33 0.00 0.00 177.39 176.96 2wkw n GLY 123 N 0.91 1.09 0.05 -0.72 0.00 -0.07 -4.90 105.19 101.56 2wkw n GLY 123 Ca 0.19 -0.42 0.11 0.00 0.00 0.00 0.00 46.02 45.89 2wkw n GLY 123 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wkw n LYS 124 N -2.38 0.43 -3.96 1.61 5.02 -0.03 -4.94 118.16 113.91 2wkw n LYS 124 Ca -0.10 0.01 -0.09 0.00 -2.02 0.00 0.00 58.31 56.11 2wkw n LYS 124 Cb 0.36 -1.65 -0.09 0.00 -0.02 0.00 0.00 35.03 33.62 2wkw n LYS 124 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wkw s ALA 125 N -3.29 0.05 0.62 7.82 0.00 -1.12 -4.97 121.76 120.87 2wkw s ALA 125 Ca 0.01 -0.69 -0.09 0.00 0.00 0.00 0.00 51.96 51.18 2wkw s ALA 125 Cb 0.13 0.27 -0.01 0.00 0.00 0.00 0.00 23.12 23.50 2wkw s ALA 125 CO 0.81 -0.33 1.00 -1.25 0.00 0.00 0.00 175.76 175.98 2wkw s PRO 126 N -2.90 3.25 0.47 0.00 0.04 -1.26 -4.25 135.00 130.35 2wkw s PRO 126 Ca -0.02 0.46 0.20 0.00 0.04 0.00 0.00 61.00 61.67 2wkw s PRO 126 Cb 0.01 -2.13 1.20 0.00 0.04 0.00 0.00 34.50 33.61 2wkw s PRO 126 CO -0.06 -0.68 1.96 0.00 0.04 0.00 0.00 177.00 178.25 2wkw h ALA 127 N -0.32 2.28 0.00 8.56 0.00 -1.99 -0.82 119.26 126.96 2wkw h ALA 127 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2wkw h ALA 127 Cb 1.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2wkw h ALA 127 CO 0.62 -0.45 0.00 0.66 0.00 0.00 0.00 179.25 180.08 2wkw h SER 128 N 0.24 0.00 0.27 0.00 4.64 -2.02 -1.83 113.55 114.84 2wkw h SER 128 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 2wkw h SER 128 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2wkw h SER 128 CO -0.06 0.00 -0.06 -1.54 -0.87 0.00 0.00 176.83 174.30 2wkw n SER 129 N -2.83 0.42 -4.76 4.97 3.41 -0.31 -4.89 113.62 109.63 2wkw n SER 129 Ca -0.01 -0.72 -0.38 0.00 -0.26 0.00 0.00 58.87 57.51 2wkw n SER 129 Cb 0.16 -0.08 0.02 0.00 -0.26 0.00 0.00 64.21 64.06 2wkw n SER 129 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2wkw s LEU 130 N -2.33 3.88 0.73 1.04 1.43 -0.69 -4.89 118.68 117.85 2wkw s LEU 130 Ca 0.34 2.54 -0.14 0.00 -1.03 0.00 0.00 54.13 55.84 2wkw s LEU 130 Cb 0.21 -4.31 0.04 0.00 0.03 0.00 0.00 46.19 42.15 2wkw s LEU 130 CO 0.43 -1.34 1.16 -2.16 0.23 0.00 0.00 176.35 174.67 2wkw s PRO 131 N -2.90 2.23 -0.49 1.29 0.04 -1.26 -4.95 135.00 128.96 2wkw s PRO 131 Ca 0.70 1.57 -0.24 0.00 0.04 0.00 0.00 61.00 63.06 2wkw s PRO 131 Cb -0.35 -1.86 0.03 0.00 0.04 0.00 0.00 34.50 32.36 2wkw s PRO 131 CO 0.41 -1.72 0.87 -0.51 0.04 0.00 0.00 177.00 176.08 2wkw s ASP 132 N -2.40 6.40 0.16 6.66 1.01 -1.26 -5.02 116.67 122.22 2wkw s ASP 132 Ca 0.70 -0.16 0.10 0.00 0.71 0.00 0.00 52.55 53.90 2wkw s ASP 132 Cb -0.25 -2.42 -0.04 0.00 1.01 0.00 0.00 42.92 41.23 2wkw s ASP 132 CO 0.46 -1.06 -0.21 -0.76 0.21 0.00 0.00 175.17 173.81 2wkw s LEU 133 N 3.62 2.56 -0.01 1.23 1.43 -1.26 -3.45 118.68 122.80 2wkw s LEU 133 Ca 0.31 -0.72 -0.02 0.00 -1.03 0.00 0.00 54.13 52.67 2wkw s LEU 133 Cb -0.12 -1.35 -0.00 0.00 0.03 0.00 0.00 46.19 44.75 2wkw s LEU 133 CO 0.22 0.14 0.05 0.12 0.23 0.00 0.00 176.35 177.12 2wkw s PHE 134 N -1.42 0.04 -0.01 0.29 2.19 -0.95 -5.00 117.98 113.13 2wkw s PHE 134 Ca 0.19 -0.07 0.02 0.00 0.33 0.00 0.00 56.93 57.40 2wkw s PHE 134 Cb -0.09 -0.05 -0.00 0.00 -1.31 0.00 0.00 43.02 41.57 2wkw s PHE 134 CO 0.10 -0.12 -0.08 0.00 1.83 0.00 0.00 175.22 176.95 2wkw s ALA 135 N -0.62 0.67 -0.22 11.12 0.00 -1.26 -0.19 121.76 131.26 2wkw s ALA 135 Ca -0.07 -0.33 -0.23 0.00 0.00 0.00 0.00 51.96 51.33 2wkw s ALA 135 Cb -0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 2wkw s ALA 135 CO 0.00 0.16 0.73 0.00 0.00 0.00 0.00 175.76 176.65 2wkw s ALA 136 N -0.13 3.59 0.61 0.00 0.00 -1.26 -5.05 121.76 119.51 2wkw s ALA 136 Ca 0.02 -0.21 -0.16 0.00 0.00 0.00 0.00 51.96 51.61 2wkw s ALA 136 Cb -0.04 -3.14 -0.03 0.00 0.00 0.00 0.00 23.12 19.91 2wkw s ALA 136 CO -0.00 -0.77 1.08 0.20 0.00 0.00 0.00 175.76 176.27 2wkw s GLY 137 N 1.31 2.22 0.20 0.00 0.00 -1.26 -4.89 107.32 104.91 2wkw s GLY 137 Ca 0.32 0.52 -0.10 0.00 0.00 0.00 0.00 44.72 45.46 2wkw s GLY 137 CO 0.09 0.85 1.78 0.45 0.00 0.00 0.00 173.10 176.27 2wkw h HIS 138 N 0.45 0.54 -0.01 1.90 3.86 -1.99 -0.55 115.15 119.35 2wkw h HIS 138 Ca -0.47 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 58.76 2wkw h HIS 138 Cb 1.23 -0.15 -0.00 0.00 1.06 0.00 0.00 27.41 29.55 2wkw h HIS 138 CO 0.56 0.22 0.00 0.93 0.86 0.00 0.00 177.93 180.50 2wkw h GLU 139 N 0.54 0.01 -0.79 2.45 3.07 -1.99 -1.27 114.58 116.60 2wkw h GLU 139 Ca 0.29 -0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 59.10 2wkw h GLU 139 Cb 0.26 -0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.14 2wkw h GLU 139 CO -0.23 0.31 0.32 0.00 -1.40 0.00 0.00 179.01 178.02 2wkw h ALA 140 N 0.70 1.03 -0.64 3.43 0.00 -1.94 -3.04 119.26 118.80 2wkw h ALA 140 Ca 0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2wkw h ALA 140 Cb 0.30 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2wkw h ALA 140 CO 0.00 0.65 0.21 0.00 0.00 0.00 0.00 179.25 180.11 2wkw h ALA 141 N 1.17 1.17 -0.76 0.00 0.00 -0.93 -2.59 119.26 117.32 2wkw h ALA 141 Ca 0.27 -0.19 0.16 0.00 0.00 0.00 0.00 54.91 55.14 2wkw h ALA 141 Cb 0.21 -0.26 -0.10 0.00 0.00 0.00 0.00 17.79 17.64 2wkw h ALA 141 CO -0.02 0.58 0.25 2.35 0.00 0.00 0.00 179.25 182.42 2wkw h TRP 142 N 0.94 0.42 0.14 0.00 2.91 -1.11 0.24 115.95 119.48 2wkw h TRP 142 Ca 0.21 0.04 -0.30 0.00 1.13 0.00 0.00 58.89 59.97 2wkw h TRP 142 Cb 0.25 -0.07 0.03 0.00 -0.51 0.00 0.00 29.16 28.86 2wkw h TRP 142 CO 0.02 -0.02 -1.27 0.00 -1.03 0.00 0.00 178.44 176.14 2wkw h ALA 143 N 1.59 -0.03 -0.44 2.65 0.00 -1.57 -2.08 119.26 119.39 2wkw h ALA 143 Ca 0.43 -0.78 -0.05 0.00 0.00 0.00 0.00 54.91 54.51 2wkw h ALA 143 Cb 0.71 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 2wkw h ALA 143 CO -0.47 0.68 0.07 0.82 0.00 0.00 0.00 179.25 180.36 2wkw h ILE 144 N 0.25 1.21 0.00 0.00 2.04 -1.07 -2.02 117.51 117.92 2wkw h ILE 144 Ca -0.20 -0.77 0.00 0.00 1.00 0.00 0.00 64.86 64.89 2wkw h ILE 144 Cb 1.95 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 38.82 2wkw h ILE 144 CO 0.24 0.28 0.00 0.49 0.00 0.00 0.00 178.15 179.16 2wkw n PHE 145 N -4.29 0.67 -3.36 1.37 3.72 0.81 -4.81 117.46 111.57 2wkw n PHE 145 Ca 0.03 0.21 -0.21 0.00 -0.05 0.00 0.00 57.45 57.43 2wkw n PHE 145 Cb 0.23 -0.84 0.06 0.00 -0.94 0.00 0.00 39.48 37.99 2wkw n PHE 145 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2wkw n ARG 146 N -2.06 -6.49 0.23 -1.08 1.74 -0.76 -1.08 116.66 107.17 2wkw n ARG 146 Ca 0.05 0.74 0.10 0.00 -0.77 0.00 0.00 57.85 57.97 2wkw n ARG 146 Cb 0.36 -5.45 0.55 0.00 -1.02 0.00 0.00 32.46 26.91 2wkw n ARG 146 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 2wkw h PHE 147 N -2.16 0.00 0.00 -1.55 0.04 -1.65 -3.45 116.94 108.16 2wkw h PHE 147 Ca -0.49 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.28 2wkw h PHE 147 Cb 1.32 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.47 2wkw h PHE 147 CO 0.44 0.21 0.00 0.41 -0.60 0.00 0.00 178.31 178.77 2wkw n GLY 148 N -0.26 -0.43 0.21 -1.45 0.00 -1.25 -0.51 105.19 101.50 2wkw n GLY 148 Ca -0.01 -0.93 -0.10 0.00 0.00 0.00 0.00 46.02 44.98 2wkw n GLY 148 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2wkw h PRO 149 N 0.00 0.69 -3.19 1.61 0.11 -1.93 -3.41 132.00 125.89 2wkw h PRO 149 Ca 0.00 -0.20 -0.16 0.00 0.11 0.00 0.00 66.00 65.75 2wkw h PRO 149 Cb 0.00 -0.07 -0.24 0.00 0.11 0.00 0.00 31.00 30.80 2wkw h PRO 149 CO 0.00 0.76 -0.42 1.03 -0.21 0.00 0.00 178.00 179.16 2wkw s ARG 150 N -5.09 0.37 0.29 1.05 0.52 -1.26 -4.77 118.95 110.06 2wkw s ARG 150 Ca -0.13 0.14 -0.30 0.00 -0.52 0.00 0.00 55.73 54.93 2wkw s ARG 150 Cb 0.10 0.17 -0.12 0.00 0.52 0.00 0.00 34.95 35.62 2wkw s ARG 150 CO 0.79 -0.07 1.48 0.98 0.02 0.00 0.00 175.30 178.50 2wkw n TYR 151 N 2.47 2.58 -1.59 -0.53 9.36 -1.26 -0.60 117.16 127.59 2wkw n TYR 151 Ca -0.16 0.37 -0.31 0.00 3.32 0.00 0.00 57.90 61.12 2wkw n TYR 151 Cb 0.58 -2.52 0.06 0.00 -0.63 0.00 0.00 39.34 36.82 2wkw n TYR 151 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2wkw n PRO 152 N 1.69 3.03 -3.15 2.98 -0.04 -1.26 -5.09 135.00 133.16 2wkw n PRO 152 Ca 0.08 -3.62 -0.40 0.00 -0.04 0.00 0.00 63.50 59.52 2wkw n PRO 152 Cb 0.35 -2.29 -0.06 0.00 -0.04 0.00 0.00 33.50 31.47 2wkw n PRO 152 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2wkw s ASP 153 N -2.46 6.63 0.02 3.54 1.01 0.23 -5.06 116.67 120.58 2wkw s ASP 153 Ca 0.60 0.76 -0.09 0.00 0.71 0.00 0.00 52.55 54.53 2wkw s ASP 153 Cb 0.47 -2.33 -0.05 0.00 1.01 0.00 0.00 42.92 42.02 2wkw s ASP 153 CO -0.00 -0.27 0.33 0.00 0.21 0.00 0.00 175.17 175.44 2wkw s ALA 154 N 1.96 3.78 0.36 5.23 0.00 -1.26 -3.82 121.76 128.00 2wkw s ALA 154 Ca 0.27 -0.44 -0.28 0.00 0.00 0.00 0.00 51.96 51.51 2wkw s ALA 154 Cb -0.16 -2.19 -0.12 0.00 0.00 0.00 0.00 23.12 20.66 2wkw s ALA 154 CO 0.10 0.59 1.35 1.19 0.00 0.00 0.00 175.76 178.99 2wkw n PHE 155 N 1.23 2.51 -0.16 0.00 3.72 0.34 -4.89 117.46 120.20 2wkw n PHE 155 Ca -0.11 0.51 0.03 0.00 -0.05 0.00 0.00 57.45 57.83 2wkw n PHE 155 Cb 0.53 -2.45 0.32 0.00 -0.94 0.00 0.00 39.48 36.93 2wkw n PHE 155 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2wkw h LYS 156 N 2.63 0.82 -0.59 -1.08 1.79 -1.97 -2.40 116.57 115.77 2wkw h LYS 156 Ca -0.48 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 57.94 2wkw h LYS 156 Cb 1.27 -0.18 0.00 0.00 -1.58 0.00 0.00 32.23 31.74 2wkw h LYS 156 CO 0.63 0.54 0.00 -0.40 -1.08 0.00 0.00 179.45 179.14 2wkw n ASP 157 N -4.45 3.32 -4.72 0.86 5.75 -1.26 -4.99 116.55 111.06 2wkw n ASP 157 Ca 0.08 -2.14 -0.43 0.00 -0.01 0.00 0.00 54.79 52.29 2wkw n ASP 157 Cb 0.09 -0.43 -0.02 0.00 -1.03 0.00 0.00 41.12 39.73 2wkw n ASP 157 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 2wkw n THR 158 N 1.00 0.73 0.66 2.12 5.66 -0.91 -4.28 114.28 119.27 2wkw n THR 158 Ca 0.19 -0.18 0.13 0.00 -3.05 0.00 0.00 64.05 61.14 2wkw n THR 158 Cb 0.57 -1.83 0.43 0.00 -1.55 0.00 0.00 70.33 67.95 2wkw n THR 158 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2wkw n GLN 159 N 2.57 0.24 -2.50 1.09 1.13 -0.01 -4.88 117.38 115.02 2wkw n GLN 159 Ca 0.11 0.20 -0.41 0.00 -1.94 0.00 0.00 57.00 54.96 2wkw n GLN 159 Cb 0.35 -1.78 -0.04 0.00 0.11 0.00 0.00 30.24 28.88 2wkw n GLN 159 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 2wkw s PHE 160 N -3.09 3.59 -1.13 1.08 5.36 -1.26 0.67 117.98 123.20 2wkw s PHE 160 Ca 0.11 1.61 -0.20 0.00 -0.96 0.00 0.00 56.93 57.49 2wkw s PHE 160 Cb 0.13 -3.28 -0.06 0.00 -0.34 0.00 0.00 43.02 39.47 2wkw s PHE 160 CO 0.59 -0.62 1.93 -0.35 -1.46 0.00 0.00 175.22 175.32 2wkw n PRO 161 N 2.17 2.08 0.29 10.12 -0.04 -1.26 -4.76 135.00 143.60 2wkw n PRO 161 Ca 0.02 -2.47 0.19 0.00 -0.04 0.00 0.00 63.50 61.20 2wkw n PRO 161 Cb 0.46 -3.38 0.97 0.00 -0.04 0.00 0.00 33.50 31.51 2wkw n PRO 161 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 2wkw h VAL 162 N 5.22 0.00 0.00 0.52 -1.51 -1.94 0.17 116.25 118.71 2wkw h VAL 162 Ca 0.38 -0.13 -0.01 0.00 -1.23 0.00 0.00 66.70 65.71 2wkw h VAL 162 Cb 0.80 1.03 -0.00 0.00 -2.13 0.00 0.00 31.29 30.99 2wkw h VAL 162 CO 1.59 0.00 -0.03 0.06 -1.23 0.00 0.00 177.57 177.96 2wkw h GLN 163 N 0.00 0.00 -0.78 5.19 -0.00 -2.03 -1.79 115.11 115.70 2wkw h GLN 163 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 58.65 58.27 2wkw h GLN 163 Cb 0.13 0.00 -0.23 0.00 -0.00 0.00 0.00 27.48 27.39 2wkw h GLN 163 CO 0.00 0.03 0.40 0.00 -0.00 0.00 0.00 178.83 179.26 2wkw n ALA 164 N -2.14 5.09 -0.33 0.06 0.00 0.59 -4.65 120.51 119.12 2wkw n ALA 164 Ca -0.01 -2.89 0.06 0.00 0.00 0.00 0.00 53.44 50.60 2wkw n ALA 164 Cb 0.19 -1.22 0.24 0.00 0.00 0.00 0.00 19.45 18.67 2wkw n ALA 164 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 2wkw h GLN 165 N 1.22 0.98 -0.95 0.00 3.07 -1.42 -2.10 115.11 115.90 2wkw h GLN 165 Ca 0.47 -0.06 0.06 0.00 0.09 0.00 0.00 58.65 59.21 2wkw h GLN 165 Cb 2.46 -0.22 -0.06 0.00 0.08 0.00 0.00 27.48 29.74 2wkw h GLN 165 CO 0.85 0.65 0.61 0.00 0.09 0.00 0.00 178.83 181.03 2wkw h ALA 166 N 1.52 1.30 -0.31 0.06 0.00 -1.86 -0.69 119.26 119.28 2wkw h ALA 166 Ca 0.45 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 55.19 2wkw h ALA 166 Cb 0.37 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2wkw h ALA 166 CO -0.20 0.42 -0.37 0.93 0.00 0.00 0.00 179.25 180.03 2wkw h GLU 167 N 1.13 0.71 -0.53 0.00 3.07 -1.70 -2.16 114.58 115.11 2wkw h GLU 167 Ca 0.40 -0.35 0.02 0.00 -0.50 0.00 0.00 59.36 58.93 2wkw h GLU 167 Cb 0.12 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.00 2wkw h GLU 167 CO -0.16 0.96 0.33 1.25 -1.40 0.00 0.00 179.01 180.00 2wkw h LEU 168 N 0.59 0.56 -1.52 1.33 5.85 -0.92 -2.48 115.31 118.72 2wkw h LEU 168 Ca 0.06 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 2wkw h LEU 168 Cb 0.90 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 2wkw h LEU 168 CO 0.08 0.40 0.23 -0.50 -0.34 0.00 0.00 178.44 178.30 2wkw h TRP 169 N 0.67 0.53 -0.13 1.25 -0.00 -0.93 -2.02 115.95 115.32 2wkw h TRP 169 Ca 0.20 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 59.09 2wkw h TRP 169 Cb -0.03 -0.18 -0.01 0.00 -0.00 0.00 0.00 29.16 28.95 2wkw h TRP 169 CO -0.05 0.37 0.06 1.96 -0.00 0.00 0.00 178.44 180.78 2wkw h GLN 170 N 0.56 0.18 -0.01 0.49 4.20 -0.92 -2.77 115.11 116.84 2wkw h GLN 170 Ca 0.15 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.84 2wkw h GLN 170 Cb 0.01 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.75 2wkw h GLN 170 CO -0.03 0.15 -0.16 0.00 -0.67 0.00 0.00 178.83 178.12 2wkw n GLN 171 N -4.48 1.15 -3.00 1.46 10.64 -0.76 -4.88 117.38 117.51 2wkw n GLN 171 Ca -0.01 -0.68 -0.39 0.00 -1.83 0.00 0.00 57.00 54.08 2wkw n GLN 171 Cb 0.11 -1.49 -0.06 0.00 -0.86 0.00 0.00 30.24 27.94 2wkw n GLN 171 CO 0.00 0.00 0.00 -1.64 -1.83 0.00 0.00 177.06 173.59 2wkw s MET 172 N -2.32 4.53 0.08 2.61 -1.94 -1.05 -4.36 119.30 116.85 2wkw s MET 172 Ca 0.29 1.11 0.01 0.00 -1.71 0.00 0.00 55.69 55.39 2wkw s MET 172 Cb 0.20 -3.29 -0.04 0.00 2.01 0.00 0.00 34.83 33.71 2wkw s MET 172 CO 0.45 0.49 -0.06 0.14 -0.01 0.00 0.00 175.02 176.04 2wkw s VAL 173 N -0.83 0.55 0.60 -6.03 -7.23 -0.48 -4.97 120.40 102.00 2wkw s VAL 173 Ca 0.36 -1.88 -0.20 0.00 -1.81 0.00 0.00 61.98 58.45 2wkw s VAL 173 Cb -0.22 -1.61 -0.03 0.00 0.56 0.00 0.00 36.38 35.08 2wkw s VAL 173 CO 0.25 -0.90 1.33 -2.65 -0.31 0.00 0.00 175.10 172.82 2wkw n PRO 174 N 0.04 1.43 -4.92 4.82 -0.02 -1.26 -4.28 135.00 130.79 2wkw n PRO 174 Ca -0.13 0.54 -0.32 0.00 -2.02 0.00 0.00 63.50 61.57 2wkw n PRO 174 Cb 0.61 -2.56 -0.17 0.00 -0.02 0.00 0.00 33.50 31.36 2wkw n PRO 174 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2wkw s ASP 175 N -1.13 3.14 -0.03 2.55 -1.08 0.74 -4.81 116.67 116.06 2wkw s ASP 175 Ca 0.77 -0.57 0.20 0.00 -0.52 0.00 0.00 52.55 52.43 2wkw s ASP 175 Cb -0.40 -1.44 0.62 0.00 -1.46 0.00 0.00 42.92 40.25 2wkw s ASP 175 CO 0.45 0.12 1.53 0.79 0.52 0.00 0.00 175.17 178.57 2wkw n TRP 176 N 3.80 1.04 -0.32 -5.34 7.02 -1.26 -2.23 117.44 120.14 2wkw n TRP 176 Ca -0.19 -0.53 0.15 0.00 -1.02 0.00 0.00 57.50 55.90 2wkw n TRP 176 Cb 0.52 -0.07 0.34 0.00 -2.42 0.00 0.00 31.31 29.68 2wkw n TRP 176 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 2wkw h LEU 177 N 3.94 0.52 -2.57 -0.99 5.85 -1.90 0.13 115.31 120.30 2wkw h LEU 177 Ca 0.00 0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 2wkw h LEU 177 Cb 1.08 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.18 2wkw h LEU 177 CO 0.06 0.07 -0.01 1.23 -0.34 0.00 0.00 178.44 179.46 2wkw h GLY 178 N 0.51 0.00 -2.46 3.75 0.00 -1.83 -2.49 103.07 100.55 2wkw h GLY 178 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.92 2wkw h GLY 178 CO -0.49 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.49 2wkw n SER 179 N -3.14 4.08 -4.54 0.19 7.64 0.03 -4.66 113.62 113.22 2wkw n SER 179 Ca -0.02 -2.26 -0.26 0.00 1.01 0.00 0.00 58.87 57.33 2wkw n SER 179 Cb 0.13 -0.48 -0.10 0.00 -1.01 0.00 0.00 64.21 62.75 2wkw n SER 179 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2wkw s MET 180 N -1.49 1.82 0.99 1.43 1.00 -0.94 -4.98 119.30 117.13 2wkw s MET 180 Ca 0.44 -1.93 -0.12 0.00 0.00 0.00 0.00 55.69 54.08 2wkw s MET 180 Cb 0.26 -1.71 0.19 0.00 0.00 0.00 0.00 34.83 33.57 2wkw s MET 180 CO 0.24 0.15 1.09 -2.14 0.00 0.00 0.00 175.02 174.36 2wkw s PRO 181 N -3.61 0.47 -0.10 2.03 0.02 -1.26 -4.97 135.00 127.59 2wkw s PRO 181 Ca 0.32 0.60 0.02 0.00 0.02 0.00 0.00 61.00 61.96 2wkw s PRO 181 Cb 0.02 -1.74 0.01 0.00 0.02 0.00 0.00 34.50 32.82 2wkw s PRO 181 CO 0.16 -2.72 -0.15 0.99 -0.33 0.00 0.00 177.00 174.95 2wkw s THR 182 N -2.92 1.48 0.61 0.99 2.01 -1.26 -2.83 115.64 113.71 2wkw s THR 182 Ca 0.65 -0.65 -0.19 0.00 0.31 0.00 0.00 61.69 61.81 2wkw s THR 182 Cb -0.19 -1.34 -0.03 0.00 0.01 0.00 0.00 72.50 70.96 2wkw s THR 182 CO 0.58 0.43 1.31 -2.84 -0.69 0.00 0.00 174.62 173.41 2wkw s PRO 183 N 0.85 2.81 0.32 4.92 0.02 -1.26 -5.10 135.00 137.55 2wkw s PRO 183 Ca -0.10 2.10 -0.28 0.00 0.02 0.00 0.00 61.00 62.74 2wkw s PRO 183 Cb -0.15 -2.00 -0.13 0.00 0.02 0.00 0.00 34.50 32.24 2wkw s PRO 183 CO 0.01 -1.41 1.24 -1.71 -0.33 0.00 0.00 177.00 174.80 2wkw n ASN 184 N -1.56 2.47 0.27 2.53 2.85 -1.13 -4.84 115.26 115.85 2wkw n ASN 184 Ca 0.14 1.20 0.16 0.00 -0.11 0.00 0.00 54.58 55.97 2wkw n ASN 184 Cb 0.47 -1.44 0.78 0.00 1.24 0.00 0.00 39.78 40.83 2wkw n ASN 184 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2wkw h PRO 185 N 2.56 0.00 -0.82 1.20 0.11 -1.93 0.25 132.00 133.37 2wkw h PRO 185 Ca -0.45 0.00 0.09 0.00 0.11 0.00 0.00 66.00 65.75 2wkw h PRO 185 Cb 1.29 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.35 2wkw h PRO 185 CO 0.63 0.00 0.53 1.15 -0.21 0.00 0.00 178.00 180.11 2wkw h THR 186 N 0.00 0.97 0.14 -1.15 2.02 -1.88 -2.77 112.91 110.24 2wkw h THR 186 Ca 0.06 -0.27 0.01 0.00 0.77 0.00 0.00 66.41 66.98 2wkw h THR 186 Cb 0.83 0.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.31 2wkw h THR 186 CO -0.00 0.15 -0.25 0.58 0.37 0.00 0.00 175.52 176.37 2wkw h VAL 187 N 0.80 0.46 -0.02 3.16 2.07 -1.28 0.06 116.25 121.51 2wkw h VAL 187 Ca 0.37 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.83 2wkw h VAL 187 Cb 0.40 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 2wkw h VAL 187 CO -0.15 0.00 -0.31 0.00 0.02 0.00 0.00 177.57 177.13 2wkw h ALA 188 N 0.27 1.45 -0.17 1.67 0.00 -1.68 -2.36 119.26 118.45 2wkw h ALA 188 Ca 0.02 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.51 2wkw h ALA 188 Cb 0.47 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2wkw h ALA 188 CO -0.12 0.41 -0.45 -0.91 0.00 0.00 0.00 179.25 178.17 2wkw h ASN 189 N 0.03 0.46 -0.16 0.00 2.35 -1.15 -2.37 115.58 114.74 2wkw h ASN 189 Ca 0.00 -0.21 -0.10 0.00 -0.55 0.00 0.00 56.30 55.44 2wkw h ASN 189 Cb 0.57 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.79 2wkw h ASN 189 CO 0.04 0.85 -0.20 -0.07 -1.65 0.00 0.00 177.43 176.40 2wkw h LEU 190 N 0.35 0.59 -0.14 1.61 3.38 -0.47 -0.41 115.31 120.22 2wkw h LEU 190 Ca 0.02 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 2wkw h LEU 190 Cb 0.93 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 2wkw h LEU 190 CO 0.08 0.80 0.07 -1.28 0.09 0.00 0.00 178.44 178.20 2wkw h SER 191 N 0.53 0.17 -0.78 -0.43 0.87 -1.33 0.07 113.55 112.65 2wkw h SER 191 Ca 0.08 -0.09 0.03 0.00 -1.23 0.00 0.00 61.79 60.58 2wkw h SER 191 Cb 0.64 -0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 62.51 2wkw h SER 191 CO 0.05 0.21 0.50 0.11 -0.53 0.00 0.00 176.83 177.16 2wkw h LYS 192 N 0.12 0.95 0.01 2.24 1.57 -1.21 -0.68 116.57 119.58 2wkw h LYS 192 Ca 0.05 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2wkw h LYS 192 Cb 0.08 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.17 2wkw h LYS 192 CO -0.01 0.63 -0.01 1.25 -0.57 0.00 0.00 179.45 180.75 2wkw h LEU 193 N 0.98 -0.02 -0.94 2.94 5.85 -0.98 -1.60 115.31 121.55 2wkw h LEU 193 Ca 0.31 -0.16 0.05 0.00 0.84 0.00 0.00 57.88 58.92 2wkw h LEU 193 Cb -0.01 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 40.97 2wkw h LEU 193 CO -0.10 0.15 0.61 0.00 -0.34 0.00 0.00 178.44 178.75 2wkw h ALA 194 N 0.81 1.26 -0.15 1.25 0.00 -0.72 -0.60 119.26 121.11 2wkw h ALA 194 Ca -0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2wkw h ALA 194 Cb 0.17 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 2wkw h ALA 194 CO 0.00 0.44 -0.06 0.82 0.00 0.00 0.00 179.25 180.46 2wkw h ILE 195 N 1.15 1.30 -0.98 0.00 2.04 -1.08 -0.09 117.51 119.84 2wkw h ILE 195 Ca 0.39 -1.06 0.10 0.00 1.00 0.00 0.00 64.86 65.28 2wkw h ILE 195 Cb 0.07 1.69 -0.08 0.00 -0.74 0.00 0.00 36.82 37.77 2wkw h ILE 195 CO -0.14 0.31 0.63 0.50 0.00 0.00 0.00 178.15 179.45 2wkw h LYS 196 N -0.02 0.99 0.00 2.37 3.64 -0.99 -2.00 116.57 120.57 2wkw h LYS 196 Ca 0.04 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2wkw h LYS 196 Cb 0.51 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 2wkw h LYS 196 CO 0.02 0.66 -0.07 -0.07 -2.27 0.00 0.00 179.45 177.72 2wkw h LEU 197 N 1.02 0.00 -1.40 5.20 3.38 -0.92 -3.48 115.31 119.12 2wkw h LEU 197 Ca 0.46 -0.01 -0.37 0.00 0.09 0.00 0.00 57.88 58.06 2wkw h LEU 197 Cb 0.38 0.00 0.14 0.00 0.09 0.00 0.00 40.66 41.27 2wkw h LEU 197 CO -0.22 0.00 -0.75 -0.67 0.09 0.00 0.00 178.44 176.90 2wkw n ASP 198 N -2.71 -3.37 0.00 -0.43 2.03 -0.07 -4.86 116.55 107.14 2wkw n ASP 198 Ca 0.04 -0.62 0.00 0.00 0.52 0.00 0.00 54.79 54.73 2wkw n ASP 198 Cb 0.49 -4.94 0.00 0.00 -0.72 0.00 0.00 41.12 35.95 2wkw n ASP 198 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2wkw n GLY 199 N -1.46 2.88 3.13 0.27 0.00 -1.06 -4.93 105.19 104.02 2wkw n GLY 199 Ca -0.19 -0.77 -0.11 0.00 0.00 0.00 0.00 46.02 44.95 2wkw n GLY 199 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2wkw s THR 200 N 0.00 0.09 -0.16 2.61 -1.32 0.62 -4.10 115.64 113.37 2wkw s THR 200 Ca 0.00 -0.72 -0.25 0.00 -1.21 0.00 0.00 61.69 59.51 2wkw s THR 200 Cb 0.00 -0.55 -0.02 0.00 -1.51 0.00 0.00 72.50 70.43 2wkw s THR 200 CO 0.00 -0.40 0.80 -0.69 -2.21 0.00 0.00 174.62 172.12 2wkw s VAL 201 N -1.61 4.91 -0.24 5.08 1.01 -0.17 -1.44 120.40 127.93 2wkw s VAL 201 Ca -0.13 1.57 -0.17 0.00 0.00 0.00 0.00 61.98 63.25 2wkw s VAL 201 Cb -0.06 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.18 2wkw s VAL 201 CO 0.01 0.06 0.47 -0.76 0.00 0.00 0.00 175.10 174.88 2wkw s LEU 202 N 1.97 4.08 -0.19 3.92 1.43 -0.39 -0.09 118.68 129.42 2wkw s LEU 202 Ca 0.37 0.50 0.01 0.00 -1.03 0.00 0.00 54.13 53.99 2wkw s LEU 202 Cb -0.17 -2.60 0.03 0.00 0.03 0.00 0.00 46.19 43.48 2wkw s LEU 202 CO 0.13 -0.21 -0.17 -0.22 0.23 0.00 0.00 176.35 176.11 2wkw s LEU 203 N 1.98 2.22 0.42 1.79 0.20 0.01 -0.61 118.68 124.69 2wkw s LEU 203 Ca 0.20 -0.73 0.04 0.00 0.69 0.00 0.00 54.13 54.33 2wkw s LEU 203 Cb -0.15 -1.41 -0.02 0.00 -0.43 0.00 0.00 46.19 44.17 2wkw s LEU 203 CO 0.09 -0.05 0.12 -0.94 -0.29 0.00 0.00 176.35 175.28 2wkw s SER 204 N 1.31 2.95 -0.19 3.68 1.04 -0.19 -0.26 113.70 122.04 2wkw s SER 204 Ca 0.03 -1.67 -0.08 0.00 0.48 0.00 0.00 55.95 54.71 2wkw s SER 204 Cb -0.14 0.50 0.08 0.00 0.10 0.00 0.00 66.02 66.56 2wkw s SER 204 CO -0.11 -0.92 0.42 -2.28 0.98 0.00 0.00 173.24 171.32 2wkw s HIS 205 N -3.17 -0.72 0.00 5.02 2.46 -1.07 -0.86 115.29 116.95 2wkw s HIS 205 Ca 0.22 1.44 0.00 0.00 0.47 0.00 0.00 55.06 57.19 2wkw s HIS 205 Cb 0.02 0.29 0.00 0.00 -0.13 0.00 0.00 32.58 32.76 2wkw s HIS 205 CO 0.13 -0.43 0.00 0.45 -2.47 0.00 0.00 174.74 172.42 2wkw n SER 206 N 4.95 0.00 -0.26 9.88 2.88 -0.60 -1.49 113.62 128.97 2wkw n SER 206 Ca -0.14 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.46 2wkw n SER 206 Cb 0.52 0.00 0.20 0.00 -0.75 0.00 0.00 64.21 64.18 2wkw n SER 206 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 2wkw h GLN 207 N 0.00 0.27 -0.11 -1.46 4.15 -1.90 0.11 115.11 116.17 2wkw h GLN 207 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.40 2wkw h GLN 207 Cb 0.00 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.63 2wkw h GLN 207 CO 0.00 0.18 0.00 -1.13 -1.93 0.00 0.00 178.83 175.95 2wkw n SER 208 N -5.15 1.23 -0.28 -0.69 3.41 -0.56 -4.32 113.62 107.26 2wkw n SER 208 Ca 0.15 -1.61 0.08 0.00 -0.26 0.00 0.00 58.87 57.23 2wkw n SER 208 Cb 0.49 -0.07 0.23 0.00 -0.26 0.00 0.00 64.21 64.60 2wkw n SER 208 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2wkw h GLY 209 N 5.09 1.31 2.00 5.00 0.00 -0.90 -0.84 103.07 114.73 2wkw h GLY 209 Ca 0.00 -0.18 -0.07 0.00 0.00 0.00 0.00 47.33 47.08 2wkw h GLY 209 CO 0.00 -0.13 -0.33 1.19 0.00 0.00 0.00 176.54 177.27 2wkw h ILE 210 N 0.48 0.73 -0.42 2.60 6.09 -1.75 -3.38 117.51 121.86 2wkw h ILE 210 Ca 0.47 -1.49 0.09 0.00 -1.37 0.00 0.00 64.86 62.55 2wkw h ILE 210 Cb 0.75 1.96 -0.08 0.00 0.47 0.00 0.00 36.82 39.92 2wkw h ILE 210 CO -0.43 0.33 -0.14 1.88 -3.07 0.00 0.00 178.15 176.71 2wkw h TYR 211 N 0.00 -0.34 -0.27 2.19 -1.99 -1.42 -1.61 116.97 113.54 2wkw h TYR 211 Ca -0.00 0.04 -0.02 0.00 2.00 0.00 0.00 58.73 60.75 2wkw h TYR 211 Cb 0.94 0.21 -0.01 0.00 2.00 0.00 0.00 36.73 39.87 2wkw h TYR 211 CO 0.00 -0.23 0.09 -1.35 -0.00 0.00 0.00 178.16 176.67 2wkw h PRO 212 N -0.05 0.37 -0.43 4.88 0.11 -1.75 0.12 132.00 135.25 2wkw h PRO 212 Ca 0.20 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 66.15 2wkw h PRO 212 Cb 0.36 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.39 2wkw h PRO 212 CO -0.46 0.33 -0.18 0.74 -0.21 0.00 0.00 178.00 178.22 2wkw h PHE 213 N 0.37 1.01 -0.57 0.65 0.04 -1.58 -0.87 116.94 115.99 2wkw h PHE 213 Ca 0.09 -0.24 -0.05 0.00 2.80 0.00 0.00 57.97 60.57 2wkw h PHE 213 Cb 0.11 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 38.00 2wkw h PHE 213 CO 0.00 1.02 0.14 1.96 -0.60 0.00 0.00 178.31 180.84 2wkw h GLN 214 N 0.71 0.90 -0.14 1.51 4.20 -0.70 -1.10 115.11 120.50 2wkw h GLN 214 Ca 0.10 -0.22 0.03 0.00 0.06 0.00 0.00 58.65 58.62 2wkw h GLN 214 Cb 0.74 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.37 2wkw h GLN 214 CO 0.06 0.84 -0.03 1.15 -0.67 0.00 0.00 178.83 180.17 2wkw h THR 215 N 0.81 0.87 -0.50 -0.54 2.02 -0.65 -1.34 112.91 113.57 2wkw h THR 215 Ca 0.18 -0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.29 2wkw h THR 215 Cb 0.34 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 2wkw h THR 215 CO 0.00 0.00 0.05 0.00 0.37 0.00 0.00 175.52 175.94 2wkw h ALA 216 N 1.13 0.67 -0.17 6.16 0.00 -1.03 0.15 119.26 126.18 2wkw h ALA 216 Ca 0.07 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2wkw h ALA 216 Cb 0.10 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2wkw h ALA 216 CO -0.14 0.43 -0.14 0.00 0.00 0.00 0.00 179.25 179.40 2wkw h ALA 217 N 0.96 1.46 -0.09 0.00 0.00 -1.10 -2.09 119.26 118.40 2wkw h ALA 217 Ca 0.15 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2wkw h ALA 217 Cb 0.44 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2wkw h ALA 217 CO 0.02 0.38 -0.04 1.98 0.00 0.00 0.00 179.25 181.59 2wkw h MET 218 N 0.25 0.18 -0.91 0.00 -1.53 -0.83 -3.45 114.93 108.64 2wkw h MET 218 Ca 0.05 -0.08 0.13 0.00 -3.44 0.00 0.00 59.70 56.36 2wkw h MET 218 Cb 0.41 -0.01 -0.21 0.00 -0.55 0.00 0.00 31.60 31.24 2wkw h MET 218 CO 0.02 0.54 -0.13 1.21 0.14 0.00 0.00 176.91 178.69 2wkw s ASN 219 N -5.82 -1.09 0.00 1.39 3.84 0.48 -5.04 114.94 108.70 2wkw s ASN 219 Ca -0.15 0.78 0.22 0.00 0.21 0.00 0.00 52.86 53.93 2wkw s ASN 219 Cb 0.04 1.95 1.01 0.00 -0.55 0.00 0.00 41.25 43.71 2wkw s ASN 219 CO 0.71 -0.20 1.72 -0.81 -2.79 0.00 0.00 177.10 175.72 2wkw n PRO 220 N 5.42 0.12 -1.82 0.43 -0.04 -0.82 -4.22 135.00 134.07 2wkw n PRO 220 Ca -0.04 0.10 -0.42 0.00 -0.04 0.00 0.00 63.50 63.11 2wkw n PRO 220 Cb 0.52 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.45 2wkw n PRO 220 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2wkw s LYS 221 N -2.84 4.17 0.00 0.54 2.20 -1.26 -2.24 119.74 120.31 2wkw s LYS 221 Ca 0.15 2.49 0.00 0.00 -0.36 0.00 0.00 55.97 58.24 2wkw s LYS 221 Cb 0.15 -3.23 0.00 0.00 -1.51 0.00 0.00 37.83 33.24 2wkw s LYS 221 CO 0.38 -0.71 0.00 0.41 -0.36 0.00 0.00 175.35 175.07 2wkw n GLY 222 N 3.93 0.90 3.35 5.54 0.00 -1.26 -4.22 105.19 113.43 2wkw n GLY 222 Ca 0.15 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.72 2wkw n GLY 222 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wkw s ILE 223 N -3.59 5.20 0.02 -0.61 1.01 -0.95 -0.28 121.20 122.00 2wkw s ILE 223 Ca 0.00 -1.28 -0.18 0.00 0.00 0.00 0.00 60.65 59.19 2wkw s ILE 223 Cb 0.00 -4.26 -0.29 0.00 0.01 0.00 0.00 42.46 37.92 2wkw s ILE 223 CO 0.00 -0.76 1.04 0.74 0.00 0.00 0.00 174.94 175.96 2wkw h THR 224 N 5.84 1.36 -2.65 2.92 2.02 -1.56 -3.47 112.91 117.36 2wkw h THR 224 Ca -0.29 -2.43 0.03 0.00 0.77 0.00 0.00 66.41 64.49 2wkw h THR 224 Cb 1.10 2.83 -0.14 0.00 -1.74 0.00 0.00 68.15 70.20 2wkw h THR 224 CO 0.98 0.72 0.32 0.00 0.37 0.00 0.00 175.52 177.91 2wkw s ALA 225 N -2.86 -1.70 -0.09 6.16 0.00 -1.25 -4.23 121.76 117.78 2wkw s ALA 225 Ca -0.11 0.75 0.03 0.00 0.00 0.00 0.00 51.96 52.63 2wkw s ALA 225 Cb 0.04 0.63 0.01 0.00 0.00 0.00 0.00 23.12 23.80 2wkw s ALA 225 CO 0.89 -0.71 -0.19 0.42 0.00 0.00 0.00 175.76 176.17 2wkw s ILE 226 N -3.33 1.71 -0.19 0.00 1.01 -0.53 -1.26 121.20 118.61 2wkw s ILE 226 Ca 0.02 -0.81 0.00 0.00 0.00 0.00 0.00 60.65 59.87 2wkw s ILE 226 Cb -0.01 -1.51 0.02 0.00 0.01 0.00 0.00 42.46 40.97 2wkw s ILE 226 CO -0.10 0.48 -0.17 -0.69 0.00 0.00 0.00 174.94 174.46 2wkw s VAL 227 N 0.56 2.29 -0.26 2.92 1.01 0.22 -0.59 120.40 126.55 2wkw s VAL 227 Ca -0.15 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 60.91 2wkw s VAL 227 Cb -0.17 -2.00 0.04 0.00 0.00 0.00 0.00 36.38 34.25 2wkw s VAL 227 CO 0.05 0.48 -0.08 -0.55 0.00 0.00 0.00 175.10 175.00 2wkw s SER 228 N 1.31 4.38 -0.30 3.32 0.15 0.76 -1.03 113.70 122.29 2wkw s SER 228 Ca 0.04 -1.14 -0.18 0.00 0.70 0.00 0.00 55.95 55.38 2wkw s SER 228 Cb -0.14 -1.62 -0.02 0.00 -1.71 0.00 0.00 66.02 62.54 2wkw s SER 228 CO -0.11 -0.17 0.51 -0.69 1.20 0.00 0.00 173.24 173.98 2wkw s VAL 229 N 1.22 5.05 -1.17 4.45 1.01 -0.04 -1.28 120.40 129.64 2wkw s VAL 229 Ca -0.04 0.62 -0.30 0.00 0.00 0.00 0.00 61.98 62.26 2wkw s VAL 229 Cb -0.18 -3.88 0.04 0.00 0.00 0.00 0.00 36.38 32.36 2wkw s VAL 229 CO -0.05 -0.05 0.57 -0.62 0.00 0.00 0.00 175.10 174.95 2wkw n GLU 230 N 5.63 -0.31 -1.92 2.72 1.02 0.33 -1.56 120.64 126.54 2wkw n GLU 230 Ca -0.05 0.02 -0.37 0.00 -0.02 0.00 0.00 57.16 56.74 2wkw n GLU 230 Cb 0.49 -2.31 0.03 0.00 -0.02 0.00 0.00 31.44 29.63 2wkw n GLU 230 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2wkw s PRO 231 N -7.33 3.16 0.40 3.49 0.04 -1.26 -3.00 135.00 130.51 2wkw s PRO 231 Ca 0.42 2.04 0.07 0.00 0.04 0.00 0.00 61.00 63.57 2wkw s PRO 231 Cb -0.23 -2.17 0.84 0.00 0.04 0.00 0.00 34.50 32.97 2wkw s PRO 231 CO 0.91 -1.11 2.03 0.78 0.04 0.00 0.00 177.00 179.65 2wkw h GLY 232 N 1.36 0.52 -4.78 0.56 0.00 -1.24 -3.44 103.07 96.06 2wkw h GLY 232 Ca -0.50 -0.22 -0.12 0.00 0.00 0.00 0.00 47.33 46.49 2wkw h GLY 232 CO 0.57 0.21 -0.27 -1.83 0.00 0.00 0.00 176.54 175.22 2wkw s GLU 233 N -5.35 0.59 0.23 4.80 -1.05 -1.26 -4.98 118.70 111.68 2wkw s GLU 233 Ca -0.08 0.07 0.03 0.00 -0.15 0.00 0.00 54.97 54.84 2wkw s GLU 233 Cb 0.17 0.27 -0.03 0.00 -0.44 0.00 0.00 34.13 34.10 2wkw s GLU 233 CO 0.73 -0.14 0.38 0.00 0.95 0.00 0.00 175.26 177.18 2wkw n PRO 235 N -1.22 0.03 -2.36 0.00 -0.02 -1.26 -4.98 135.00 125.20 2wkw n PRO 235 Ca -0.08 0.08 -0.36 0.00 -2.02 0.00 0.00 63.50 61.12 2wkw n PRO 235 Cb 0.56 -2.28 -0.02 0.00 -0.02 0.00 0.00 33.50 31.74 2wkw n PRO 235 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2wkw s LYS 236 N -3.97 3.83 0.38 -0.52 1.02 -1.26 -4.60 119.74 114.63 2wkw s LYS 236 Ca 0.69 1.66 0.15 0.00 0.02 0.00 0.00 55.97 58.49 2wkw s LYS 236 Cb -0.28 -2.38 1.01 0.00 -0.52 0.00 0.00 37.83 35.66 2wkw s LYS 236 CO 0.55 -0.46 1.80 -1.35 -0.92 0.00 0.00 175.35 174.97 2wkw h PRO 237 N 2.05 0.47 0.00 -1.68 0.11 -1.89 0.34 132.00 131.40 2wkw h PRO 237 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2wkw h PRO 237 Cb 1.24 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2wkw h PRO 237 CO 0.60 0.31 0.00 0.39 -0.21 0.00 0.00 178.00 179.10 2wkw n GLU 238 N -4.62 0.15 -0.37 1.05 4.71 -1.26 -3.56 120.64 116.75 2wkw n GLU 238 Ca 0.23 0.15 0.08 0.00 -0.01 0.00 0.00 57.16 57.60 2wkw n GLU 238 Cb 0.75 -1.50 0.23 0.00 -1.01 0.00 0.00 31.44 29.91 2wkw n GLU 238 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2wkw n ASP 239 N -1.37 3.61 0.18 1.62 8.00 0.12 -4.67 116.55 124.04 2wkw n ASP 239 Ca 0.07 -2.66 0.13 0.00 0.71 0.00 0.00 54.79 53.03 2wkw n ASP 239 Cb 0.17 -0.44 0.29 0.00 -0.02 0.00 0.00 41.12 41.11 2wkw n ASP 239 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 2wkw h VAL 240 N 1.95 0.00 -0.74 2.53 -1.51 -1.64 -3.38 116.25 113.46 2wkw h VAL 240 Ca 0.00 -0.78 -0.01 0.00 -1.23 0.00 0.00 66.70 64.69 2wkw h VAL 240 Cb 1.21 1.77 -0.04 0.00 -2.13 0.00 0.00 31.29 32.11 2wkw h VAL 240 CO 0.15 0.00 0.44 0.11 -1.23 0.00 0.00 177.57 177.04 2wkw h LYS 241 N 0.00 1.00 0.00 5.19 1.57 -1.89 -0.07 116.57 122.37 2wkw h LYS 241 Ca 0.00 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2wkw h LYS 241 Cb 0.87 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.97 2wkw h LYS 241 CO 0.00 0.71 0.00 -2.30 -0.57 0.00 0.00 179.45 177.29 2wkw n PRO 242 N -4.38 0.11 -0.01 3.15 -0.02 -1.26 -3.41 135.00 129.18 2wkw n PRO 242 Ca 0.08 0.22 0.06 0.00 -2.02 0.00 0.00 63.50 61.83 2wkw n PRO 242 Cb 0.07 -1.50 0.06 0.00 -0.02 0.00 0.00 33.50 32.11 2wkw n PRO 242 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2wkw n LEU 243 N -1.31 2.03 0.11 2.45 4.77 -0.04 -4.71 117.00 120.29 2wkw n LEU 243 Ca 0.04 -1.07 0.11 0.00 -0.03 0.00 0.00 56.01 55.06 2wkw n LEU 243 Cb 0.08 -0.02 0.47 0.00 -2.33 0.00 0.00 43.42 41.62 2wkw n LEU 243 CO 0.07 0.40 0.85 0.35 -1.33 0.00 0.00 177.39 177.72 2wkw n THR 244 N 0.64 0.83 0.65 -5.08 -2.24 -1.22 -2.10 114.28 105.76 2wkw n THR 244 Ca 0.07 0.20 0.12 0.00 -2.27 0.00 0.00 64.05 62.17 2wkw n THR 244 Cb 0.30 -1.11 0.16 0.00 -2.10 0.00 0.00 70.33 67.57 2wkw n THR 244 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2wkw n SER 245 N -2.16 3.24 -4.21 3.42 3.41 -1.26 -4.21 113.62 111.85 2wkw n SER 245 Ca 0.02 -2.00 -0.34 0.00 -0.26 0.00 0.00 58.87 56.30 2wkw n SER 245 Cb 0.24 -0.12 -0.15 0.00 -0.26 0.00 0.00 64.21 63.91 2wkw n SER 245 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2wkw s ILE 246 N -1.74 2.65 0.32 -1.33 1.01 -0.89 -5.06 121.20 116.15 2wkw s ILE 246 Ca 0.33 -0.74 -0.29 0.00 0.00 0.00 0.00 60.65 59.95 2wkw s ILE 246 Cb 0.21 -2.16 -0.11 0.00 0.01 0.00 0.00 42.46 40.41 2wkw s ILE 246 CO 0.31 0.49 1.53 -2.84 0.00 0.00 0.00 174.94 174.43 2wkw s PRO 247 N 1.34 4.14 -0.08 2.79 0.02 -1.26 -4.61 135.00 137.34 2wkw s PRO 247 Ca 0.05 2.53 0.01 0.00 0.02 0.00 0.00 61.00 63.62 2wkw s PRO 247 Cb -0.14 -3.02 0.02 0.00 0.02 0.00 0.00 34.50 31.38 2wkw s PRO 247 CO -0.08 -0.56 -0.11 0.08 -0.33 0.00 0.00 177.00 175.99 2wkw s VAL 248 N -0.40 1.16 -0.11 3.83 1.01 -0.29 -1.45 120.40 124.15 2wkw s VAL 248 Ca 0.59 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 62.15 2wkw s VAL 248 Cb -0.46 -1.09 0.00 0.00 0.00 0.00 0.00 36.38 34.83 2wkw s VAL 248 CO 0.52 0.37 -0.23 -0.22 0.00 0.00 0.00 175.10 175.55 2wkw s LEU 249 N 0.97 2.15 -0.12 3.92 2.96 0.25 -1.26 118.68 127.55 2wkw s LEU 249 Ca -0.09 -0.55 0.03 0.00 -0.22 0.00 0.00 54.13 53.31 2wkw s LEU 249 Cb -0.15 -1.43 0.01 0.00 0.50 0.00 0.00 46.19 45.11 2wkw s LEU 249 CO -0.00 0.15 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.26 2wkw s VAL 250 N 0.42 2.03 -0.11 1.68 1.01 -0.74 -0.17 120.40 124.51 2wkw s VAL 250 Ca -0.16 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 60.86 2wkw s VAL 250 Cb -0.17 -1.77 -0.01 0.00 0.00 0.00 0.00 36.38 34.43 2wkw s VAL 250 CO 0.07 0.55 -0.19 -0.69 0.00 0.00 0.00 175.10 174.83 2wkw s VAL 251 N 0.60 2.48 0.05 2.92 1.01 -0.41 -0.52 120.40 126.54 2wkw s VAL 251 Ca -0.13 -0.87 0.07 0.00 0.00 0.00 0.00 61.98 61.06 2wkw s VAL 251 Cb -0.17 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.20 2wkw s VAL 251 CO 0.03 0.54 -0.20 -0.36 0.00 0.00 0.00 175.10 175.12 2wkw s PHE 252 N 0.35 1.75 0.00 5.22 0.40 -0.32 -0.51 117.98 124.86 2wkw s PHE 252 Ca -0.15 -0.38 0.00 0.00 -0.60 0.00 0.00 56.93 55.80 2wkw s PHE 252 Cb -0.17 -1.03 0.00 0.00 0.51 0.00 0.00 43.02 42.33 2wkw s PHE 252 CO 0.07 0.10 0.00 0.41 0.70 0.00 0.00 175.22 176.51 2wkw n GLY 253 N 1.73 1.64 3.83 4.36 0.00 -1.26 -0.92 105.19 114.57 2wkw n GLY 253 Ca -0.18 -1.69 -0.27 0.00 0.00 0.00 0.00 46.02 43.89 2wkw n GLY 253 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wkw s ASP 254 N -1.00 4.52 -1.46 1.61 -1.08 -0.48 -4.47 116.67 114.30 2wkw s ASP 254 Ca 0.00 -1.24 -0.09 0.00 -0.52 0.00 0.00 52.55 50.70 2wkw s ASP 254 Cb 0.00 0.13 0.05 0.00 -1.46 0.00 0.00 42.92 41.64 2wkw s ASP 254 CO 0.00 -0.88 0.79 1.41 0.52 0.00 0.00 175.17 177.01 2wkw n HIS 255 N -1.52 -2.19 -0.04 -5.34 8.25 -1.26 -4.82 115.22 108.30 2wkw n HIS 255 Ca -0.04 0.71 -0.14 0.00 -0.26 0.00 0.00 57.72 57.98 2wkw n HIS 255 Cb 0.65 -4.09 -0.11 0.00 1.12 0.00 0.00 29.99 27.56 2wkw n HIS 255 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 2wkw h ILE 256 N -1.73 1.57 0.00 1.59 1.08 -1.95 -3.37 117.51 114.70 2wkw h ILE 256 Ca -0.53 -1.83 -0.03 0.00 -0.39 0.00 0.00 64.86 62.08 2wkw h ILE 256 Cb 1.35 2.75 -0.00 0.00 -3.07 0.00 0.00 36.82 37.85 2wkw h ILE 256 CO 0.59 0.49 -0.14 -0.33 -0.69 0.00 0.00 178.15 178.07 2wkw h GLU 257 N -0.61 0.00 0.00 2.37 4.39 -1.93 -1.73 114.58 117.06 2wkw h GLU 257 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2wkw h GLU 257 Cb 0.86 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 2wkw h GLU 257 CO 0.02 0.14 0.00 -1.91 -1.16 0.00 0.00 179.01 176.10 2wkw n GLU 258 N -3.91 0.12 -3.95 2.33 2.13 -1.26 -4.65 120.64 111.45 2wkw n GLU 258 Ca -0.02 0.37 -0.34 0.00 0.66 0.00 0.00 57.16 57.82 2wkw n GLU 258 Cb 0.23 -1.74 -0.14 0.00 0.27 0.00 0.00 31.44 30.06 2wkw n GLU 258 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 2wkw s PHE 259 N -3.21 3.12 0.54 4.31 0.40 -0.65 -4.99 117.98 117.50 2wkw s PHE 259 Ca 0.05 -1.65 0.22 0.00 -0.60 0.00 0.00 56.93 54.94 2wkw s PHE 259 Cb 0.09 -2.07 1.48 0.00 0.51 0.00 0.00 43.02 43.03 2wkw s PHE 259 CO 0.34 -0.75 2.17 -1.35 0.70 0.00 0.00 175.22 176.33 2wkw h PRO 260 N 8.00 0.00 -0.88 0.24 0.11 -1.84 0.38 132.00 138.01 2wkw h PRO 260 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2wkw h PRO 260 Cb 1.09 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.16 2wkw h PRO 260 CO 0.56 0.02 0.56 -0.09 -0.21 0.00 0.00 178.00 178.84 2wkw h ARG 261 N 0.00 1.18 0.04 1.05 2.43 -1.94 -3.38 114.38 113.76 2wkw h ARG 261 Ca -0.00 -0.09 -0.38 0.00 -0.81 0.00 0.00 59.98 58.70 2wkw h ARG 261 Cb 0.05 -0.26 -0.05 0.00 -0.42 0.00 0.00 29.97 29.28 2wkw h ARG 261 CO 0.00 0.80 -2.33 0.91 -1.51 0.00 0.00 179.97 177.85 2wkw n TRP 262 N -4.44 0.37 -0.17 2.20 7.02 -0.10 -4.38 117.44 117.94 2wkw n TRP 262 Ca 0.09 0.08 -0.02 0.00 -1.02 0.00 0.00 57.50 56.63 2wkw n TRP 262 Cb 0.04 -1.05 0.05 0.00 -2.42 0.00 0.00 31.31 27.93 2wkw n TRP 262 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2wkw h ALA 263 N 0.07 0.40 0.00 6.99 0.00 -1.04 -1.32 119.26 124.35 2wkw h ALA 263 Ca -0.53 0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 2wkw h ALA 263 Cb 1.95 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 20.09 2wkw h ALA 263 CO -0.03 -0.43 -0.16 -1.35 0.00 0.00 0.00 179.25 177.28 2wkw h PRO 264 N 0.03 0.00 -0.15 0.00 0.11 -1.79 -2.76 132.00 127.44 2wkw h PRO 264 Ca 0.26 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 66.14 2wkw h PRO 264 Cb 0.40 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.52 2wkw h PRO 264 CO -0.51 0.16 -0.79 0.00 -0.21 0.00 0.00 178.00 176.65 2wkw h ARG 265 N 0.00 0.80 -0.24 1.05 3.08 -1.46 -0.22 114.38 117.39 2wkw h ARG 265 Ca -0.00 -0.66 0.01 0.00 0.07 0.00 0.00 59.98 59.41 2wkw h ARG 265 Cb 0.45 0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.62 2wkw h ARG 265 CO 0.02 1.26 0.12 1.25 -1.07 0.00 0.00 179.97 181.55 2wkw h LEU 266 N 0.54 0.17 -0.28 3.04 5.85 -1.32 0.63 115.31 123.95 2wkw h LEU 266 Ca -0.06 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 2wkw h LEU 266 Cb 1.42 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.42 2wkw h LEU 266 CO 0.16 0.13 0.14 0.50 -0.34 0.00 0.00 178.44 179.04 2wkw h LYS 267 N 0.25 0.39 -0.58 1.25 3.64 -1.41 0.07 116.57 120.18 2wkw h LYS 267 Ca 0.10 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 2wkw h LYS 267 Cb 0.03 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 2wkw h LYS 267 CO -0.07 0.36 0.19 0.00 -2.27 0.00 0.00 179.45 177.66 2wkw h ALA 268 N 1.01 1.23 -0.20 5.00 0.00 -0.95 -1.99 119.26 123.37 2wkw h ALA 268 Ca 0.10 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 2wkw h ALA 268 Cb 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2wkw h ALA 268 CO -0.01 0.54 -0.42 0.00 0.00 0.00 0.00 179.25 179.36 2wkw h HIS 270 N 0.38 0.39 -0.88 0.00 -0.00 -0.59 -0.73 115.15 113.73 2wkw h HIS 270 Ca 0.03 0.01 -0.00 0.00 -0.00 0.00 0.00 60.37 60.41 2wkw h HIS 270 Cb 0.90 -0.12 -0.04 0.00 -0.00 0.00 0.00 27.41 28.14 2wkw h HIS 270 CO 0.03 0.23 0.54 0.00 -0.00 0.00 0.00 177.93 178.72 2wkw h ALA 271 N 1.17 1.30 0.36 2.45 0.00 -1.18 0.29 119.26 123.64 2wkw h ALA 271 Ca 0.15 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2wkw h ALA 271 Cb 0.01 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 2wkw h ALA 271 CO -0.07 0.61 -0.20 0.35 0.00 0.00 0.00 179.25 179.94 2wkw h PHE 272 N 1.20 -0.53 -0.55 0.00 3.57 -0.84 -1.95 116.94 117.85 2wkw h PHE 272 Ca 0.32 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.80 2wkw h PHE 272 Cb -0.07 0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.83 2wkw h PHE 272 CO 0.00 -0.32 0.30 0.82 -2.23 0.00 0.00 178.31 176.89 2wkw h ILE 273 N -0.53 1.18 -0.53 1.41 1.08 -0.80 0.47 117.51 119.81 2wkw h ILE 273 Ca -0.04 -0.46 -0.00 0.00 -0.39 0.00 0.00 64.86 63.97 2wkw h ILE 273 Cb 0.42 0.48 -0.03 0.00 -3.07 0.00 0.00 36.82 34.63 2wkw h ILE 273 CO 0.05 0.20 0.32 0.44 -0.69 0.00 0.00 178.15 178.47 2wkw h ASP 274 N 0.74 0.63 0.30 1.72 3.32 -0.94 -1.04 116.42 121.15 2wkw h ASP 274 Ca 0.19 -0.05 -0.12 0.00 0.02 0.00 0.00 57.03 57.08 2wkw h ASP 274 Cb 0.04 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 2wkw h ASP 274 CO -0.03 0.49 -0.48 0.00 -1.72 0.00 0.00 179.24 177.50 2wkw h ALA 275 N 1.16 1.04 -0.04 3.45 0.00 -1.07 -1.03 119.26 122.77 2wkw h ALA 275 Ca 0.19 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2wkw h ALA 275 Cb -0.03 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 2wkw h ALA 275 CO -0.04 0.64 0.02 1.25 0.00 0.00 0.00 179.25 181.12 2wkw h LEU 276 N 0.17 0.06 -0.66 0.00 5.85 -0.47 -0.88 115.31 119.37 2wkw h LEU 276 Ca 0.01 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.59 2wkw h LEU 276 Cb 0.91 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.90 2wkw h LEU 276 CO 0.07 0.16 0.34 0.78 -0.34 0.00 0.00 178.44 179.45 2wkw h ASN 277 N -0.06 0.84 0.20 1.25 2.35 -1.08 0.24 115.58 119.33 2wkw h ASN 277 Ca 0.01 -0.12 -0.03 0.00 -0.55 0.00 0.00 56.30 55.61 2wkw h ASN 277 Cb 0.12 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.27 2wkw h ASN 277 CO -0.00 0.72 -0.16 0.00 -1.65 0.00 0.00 177.43 176.34 2wkw h ALA 278 N 1.16 1.62 -0.14 -0.83 0.00 -1.05 -1.23 119.26 118.79 2wkw h ALA 278 Ca 0.23 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2wkw h ALA 278 Cb 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2wkw h ALA 278 CO -0.03 0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.42 2wkw n ALA 279 N -2.46 2.53 -0.23 0.00 0.00 -0.35 -4.87 120.51 115.13 2wkw n ALA 279 Ca -0.02 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.04 2wkw n ALA 279 Cb 0.23 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.57 2wkw n ALA 279 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wkw n GLY 280 N 0.96 0.87 0.00 0.00 0.00 -0.47 -4.98 105.19 101.56 2wkw n GLY 280 Ca 0.13 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2wkw n GLY 280 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wkw n GLY 281 N -2.23 0.66 2.51 -0.02 0.00 0.81 -4.85 105.19 102.06 2wkw n GLY 281 Ca 0.00 -1.93 -0.29 0.00 0.00 0.00 0.00 46.02 43.80 2wkw n GLY 281 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wkw s LYS 282 N -1.84 0.62 0.12 1.61 2.47 -1.26 -4.47 119.74 117.00 2wkw s LYS 282 Ca 0.00 -1.35 0.06 0.00 -1.56 0.00 0.00 55.97 53.12 2wkw s LYS 282 Cb 0.00 -1.45 -0.04 0.00 -1.46 0.00 0.00 37.83 34.88 2wkw s LYS 282 CO 0.00 -1.18 -0.15 0.20 0.16 0.00 0.00 175.35 174.38 2wkw s GLY 283 N 1.07 1.12 -0.10 5.54 0.00 -1.26 -1.14 107.32 112.54 2wkw s GLY 283 Ca 0.17 -1.30 -0.06 0.00 0.00 0.00 0.00 44.72 43.54 2wkw s GLY 283 CO -0.03 -1.35 0.24 1.62 0.00 0.00 0.00 173.10 173.59 2wkw s GLN 284 N -2.56 0.22 -0.42 2.90 0.74 -0.39 -4.91 119.66 115.23 2wkw s GLN 284 Ca 0.09 0.49 -0.19 0.00 0.05 0.00 0.00 55.36 55.80 2wkw s GLN 284 Cb -0.06 -0.07 0.02 0.00 1.10 0.00 0.00 33.01 34.00 2wkw s GLN 284 CO 0.04 -0.14 0.53 -1.17 -0.55 0.00 0.00 175.29 173.99 2wkw s LEU 285 N 1.04 4.69 -0.53 3.68 0.20 -1.26 -1.79 118.68 124.71 2wkw s LEU 285 Ca -0.07 -0.50 -0.19 0.00 0.69 0.00 0.00 54.13 54.05 2wkw s LEU 285 Cb -0.09 -2.54 0.07 0.00 -0.43 0.00 0.00 46.19 43.20 2wkw s LEU 285 CO -0.07 -0.66 0.64 -0.32 -0.29 0.00 0.00 176.35 175.66 2wkw s MET 286 N 2.43 3.10 -0.40 1.98 -2.45 0.32 -4.98 119.30 119.31 2wkw s MET 286 Ca 0.17 -0.99 -0.16 0.00 -1.25 0.00 0.00 55.69 53.46 2wkw s MET 286 Cb -0.16 -4.14 0.01 0.00 1.25 0.00 0.00 34.83 31.80 2wkw s MET 286 CO 0.16 -1.30 0.38 0.45 1.05 0.00 0.00 175.02 175.76 2wkw s SER 287 N 2.91 6.16 0.19 1.11 0.15 -1.26 -1.18 113.70 121.78 2wkw s SER 287 Ca 0.14 -0.61 -0.12 0.00 0.70 0.00 0.00 55.95 56.06 2wkw s SER 287 Cb -0.20 -2.20 0.19 0.00 -1.71 0.00 0.00 66.02 62.10 2wkw s SER 287 CO 0.11 -0.47 1.76 -0.07 1.20 0.00 0.00 173.24 175.76 2wkw h LEU 288 N 8.85 0.26 -1.66 3.45 3.38 -1.26 -1.46 115.31 126.87 2wkw h LEU 288 Ca -0.28 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 2wkw h LEU 288 Cb 1.12 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 2wkw h LEU 288 CO 0.75 0.18 -0.13 1.55 0.09 0.00 0.00 178.44 180.87 2wkw h PRO 289 N 0.42 0.05 0.00 1.13 0.13 -1.61 -0.14 132.00 131.98 2wkw h PRO 289 Ca 0.25 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.37 2wkw h PRO 289 Cb 0.25 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.37 2wkw h PRO 289 CO -0.23 0.18 0.00 0.00 -0.23 0.00 0.00 178.00 177.72 2wkw h ALA 290 N 1.82 1.00 -0.70 -0.56 0.00 -1.57 -1.80 119.26 117.46 2wkw h ALA 290 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2wkw h ALA 290 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2wkw h ALA 290 CO 0.02 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.55 2wkw n LEU 291 N -2.53 4.33 -0.09 0.00 4.77 -0.25 -4.94 117.00 118.29 2wkw n LEU 291 Ca 0.01 -2.18 -0.01 0.00 -0.03 0.00 0.00 56.01 53.80 2wkw n LEU 291 Cb 0.22 -0.54 -0.01 0.00 -2.33 0.00 0.00 43.42 40.77 2wkw n LEU 291 CO 0.21 0.90 -0.01 0.61 -1.33 0.00 0.00 177.39 177.77 2wkw n GLY 292 N 1.43 0.49 3.29 -0.72 0.00 -0.67 -5.02 105.19 103.99 2wkw n GLY 292 Ca 0.25 -0.86 -0.36 0.00 0.00 0.00 0.00 46.02 45.05 2wkw n GLY 292 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wkw s VAL 293 N -2.03 3.62 0.15 1.61 1.01 -0.23 -4.99 120.40 119.53 2wkw s VAL 293 Ca 0.00 -0.84 0.09 0.00 0.00 0.00 0.00 61.98 61.24 2wkw s VAL 293 Cb 0.00 -2.88 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 2wkw s VAL 293 CO 0.00 0.09 -0.16 -1.00 0.00 0.00 0.00 175.10 174.03 2wkw s HIS 294 N 1.44 2.54 0.00 5.22 3.76 -1.26 -1.92 115.29 125.06 2wkw s HIS 294 Ca 0.01 -0.26 0.00 0.00 -0.15 0.00 0.00 55.06 54.66 2wkw s HIS 294 Cb -0.17 -1.29 0.00 0.00 1.11 0.00 0.00 32.58 32.22 2wkw s HIS 294 CO 0.00 0.45 0.00 0.41 -0.85 0.00 0.00 174.74 174.75 2wkw n GLY 295 N 0.45 0.91 3.75 -2.22 0.00 -1.26 -4.72 105.19 102.09 2wkw n GLY 295 Ca -0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 2wkw n GLY 295 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wkw s ASN 296 N -3.02 6.69 0.63 1.61 -0.87 -1.26 -0.83 114.94 117.90 2wkw s ASN 296 Ca 0.00 2.66 -0.01 0.00 -1.57 0.00 0.00 52.86 53.94 2wkw s ASN 296 Cb 0.00 -2.63 0.09 0.00 -0.02 0.00 0.00 41.25 38.69 2wkw s ASN 296 CO 0.00 -0.65 0.63 -1.54 -2.57 0.00 0.00 177.10 172.97 2wkw n SER 297 N 1.95 0.78 0.23 -1.22 3.41 -1.26 -1.38 113.62 116.13 2wkw n SER 297 Ca 0.05 -1.68 0.09 0.00 -0.26 0.00 0.00 58.87 57.07 2wkw n SER 297 Cb 0.41 -0.42 0.57 0.00 -0.26 0.00 0.00 64.21 64.51 2wkw n SER 297 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 2wkw h HIS 298 N -0.59 0.00 -1.63 7.33 2.76 -1.42 -3.05 115.15 118.56 2wkw h HIS 298 Ca -0.21 0.00 -0.67 0.00 -2.20 0.00 0.00 60.37 57.29 2wkw h HIS 298 Cb 0.76 0.00 -0.23 0.00 1.55 0.00 0.00 27.41 29.49 2wkw h HIS 298 CO 0.00 0.20 0.91 -1.33 -1.30 0.00 0.00 177.93 176.41 2wkw n MET 299 N -3.87 3.01 0.26 5.26 2.81 -1.26 -4.75 117.12 118.57 2wkw n MET 299 Ca -0.02 -3.20 0.12 0.00 -1.81 0.00 0.00 57.70 52.80 2wkw n MET 299 Cb 0.29 -2.27 0.71 0.00 -0.71 0.00 0.00 33.22 31.24 2wkw n MET 299 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2wkw h MET 300 N 3.22 0.00 0.00 0.03 3.00 -1.92 0.29 114.93 119.55 2wkw h MET 300 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 59.70 60.21 2wkw h MET 300 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 31.60 31.92 2wkw h MET 300 CO 1.21 0.12 0.00 0.00 0.00 0.00 0.00 176.91 178.25 2wkw n MET 301 N -3.70 0.11 0.00 -0.10 0.00 -1.26 -2.65 117.12 109.52 2wkw n MET 301 Ca -0.02 0.40 0.05 0.00 0.00 0.00 0.00 57.70 58.13 2wkw n MET 301 Cb 0.24 -1.74 -0.03 0.00 0.00 0.00 0.00 33.22 31.69 2wkw n MET 301 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 2wkw n GLN 302 N -1.95 2.94 -0.96 3.17 6.02 0.07 -4.49 117.38 122.18 2wkw n GLN 302 Ca 0.02 -0.30 -0.30 0.00 -0.01 0.00 0.00 57.00 56.40 2wkw n GLN 302 Cb 0.17 -1.03 0.15 0.00 1.02 0.00 0.00 30.24 30.55 2wkw n GLN 302 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2wkw s ASP 303 N -1.66 3.31 0.52 1.08 1.01 -1.08 -4.64 116.67 115.22 2wkw s ASP 303 Ca 0.06 1.85 0.22 0.00 0.71 0.00 0.00 52.55 55.39 2wkw s ASP 303 Cb 0.08 -2.44 1.41 0.00 1.01 0.00 0.00 42.92 42.98 2wkw s ASP 303 CO 0.33 -2.80 2.13 0.03 0.21 0.00 0.00 175.17 175.08 2wkw h ARG 304 N -1.66 0.00 -0.83 8.23 3.08 -0.10 -0.30 114.38 122.80 2wkw h ARG 304 Ca -0.47 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.22 2wkw h ARG 304 Cb 1.27 0.00 -0.22 0.00 0.08 0.00 0.00 29.97 31.10 2wkw h ARG 304 CO 0.48 0.06 0.43 0.27 -1.07 0.00 0.00 179.97 180.15 2wkw n ASN 305 N -4.13 3.99 -0.14 7.04 6.94 -1.26 -4.73 115.26 122.96 2wkw n ASN 305 Ca -0.03 -3.48 0.11 0.00 -0.02 0.00 0.00 54.58 51.16 2wkw n ASN 305 Cb 0.15 -0.78 0.45 0.00 -2.36 0.00 0.00 39.78 37.23 2wkw n ASN 305 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 2wkw h ASN 306 N 1.59 0.49 0.62 0.53 -1.07 -1.24 -1.31 115.58 115.20 2wkw h ASN 306 Ca 0.45 0.01 -0.12 0.00 0.07 0.00 0.00 56.30 56.72 2wkw h ASN 306 Cb 2.53 -0.09 -0.02 0.00 -2.07 0.00 0.00 38.32 38.68 2wkw h ASN 306 CO 0.89 0.29 -0.55 -0.07 0.07 0.00 0.00 177.43 178.06 2wkw h LEU 307 N 0.54 0.00 -0.45 6.14 3.38 -1.85 -0.40 115.31 122.68 2wkw h LEU 307 Ca 0.32 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.22 2wkw h LEU 307 Cb 0.52 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2wkw h LEU 307 CO -0.10 0.55 0.02 -0.61 0.09 0.00 0.00 178.44 178.38 2wkw h GLN 308 N 0.00 0.78 -0.57 1.13 4.15 -1.63 -0.91 115.11 118.06 2wkw h GLN 308 Ca -0.01 -0.24 -0.02 0.00 0.77 0.00 0.00 58.65 59.15 2wkw h GLN 308 Cb 1.01 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.60 2wkw h GLN 308 CO 0.07 0.83 0.27 0.28 -1.93 0.00 0.00 178.83 178.35 2wkw h VAL 309 N 0.63 1.21 -0.54 2.39 2.07 -1.11 -1.97 116.25 118.93 2wkw h VAL 309 Ca 0.13 -0.60 0.03 0.00 0.82 0.00 0.00 66.70 67.09 2wkw h VAL 309 Cb 0.47 0.56 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 2wkw h VAL 309 CO 0.02 0.24 0.31 0.00 0.02 0.00 0.00 177.57 178.15 2wkw h ALA 310 N 1.10 0.70 -0.61 1.67 0.00 -0.97 -1.16 119.26 120.00 2wkw h ALA 310 Ca 0.19 0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.16 2wkw h ALA 310 Cb 0.13 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 2wkw h ALA 310 CO -0.02 -0.00 0.32 -0.44 0.00 0.00 0.00 179.25 179.11 2wkw h ASP 311 N 0.60 0.47 -0.73 0.00 3.32 -0.80 0.49 116.42 119.77 2wkw h ASP 311 Ca 0.23 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.31 2wkw h ASP 311 Cb 0.08 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.53 2wkw h ASP 311 CO -0.12 0.31 0.46 -0.07 -1.72 0.00 0.00 179.24 178.10 2wkw h LEU 312 N 0.61 0.85 -0.07 1.55 3.38 -0.87 -0.06 115.31 120.69 2wkw h LEU 312 Ca 0.27 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 2wkw h LEU 312 Cb 0.18 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 2wkw h LEU 312 CO -0.18 0.64 -0.01 0.40 0.09 0.00 0.00 178.44 179.38 2wkw h ILE 313 N 0.99 1.28 -0.45 1.22 2.04 -0.36 -2.93 117.51 119.30 2wkw h ILE 313 Ca 0.26 -0.90 -0.00 0.00 1.00 0.00 0.00 64.86 65.23 2wkw h ILE 313 Cb -0.08 1.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.72 2wkw h ILE 313 CO -0.05 0.25 0.28 -0.07 0.00 0.00 0.00 178.15 178.55 2wkw h LEU 314 N -0.19 0.53 -0.32 1.44 3.38 0.09 -0.69 115.31 119.56 2wkw h LEU 314 Ca 0.02 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2wkw h LEU 314 Cb 0.40 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2wkw h LEU 314 CO 0.01 0.40 0.16 -0.78 0.09 0.00 0.00 178.44 178.32 2wkw h ASP 315 N 0.62 0.41 -0.82 -0.43 3.58 -0.98 0.67 116.42 119.47 2wkw h ASP 315 Ca 0.16 -0.12 -0.04 0.00 0.42 0.00 0.00 57.03 57.46 2wkw h ASP 315 Cb -0.04 -0.11 -0.04 0.00 1.72 0.00 0.00 39.33 40.87 2wkw h ASP 315 CO -0.03 0.41 0.37 -0.25 -2.88 0.00 0.00 179.24 176.86 2wkw h TRP 316 N 0.38 1.21 -0.02 0.28 7.01 -1.21 -1.98 115.95 121.61 2wkw h TRP 316 Ca 0.11 -0.07 -0.00 0.00 2.11 0.00 0.00 58.89 61.04 2wkw h TRP 316 Cb 0.11 -0.37 -0.00 0.00 -2.10 0.00 0.00 29.16 26.80 2wkw h TRP 316 CO -0.02 0.89 0.01 0.82 -2.79 0.00 0.00 178.44 177.35 2wkw h ILE 317 N 1.18 1.13 -0.78 2.65 2.04 -0.73 -1.46 117.51 121.54 2wkw h ILE 317 Ca 0.28 -0.37 0.13 0.00 1.00 0.00 0.00 64.86 65.90 2wkw h ILE 317 Cb 0.16 1.34 -0.09 0.00 -0.74 0.00 0.00 36.82 37.49 2wkw h ILE 317 CO -0.03 0.10 0.36 1.23 0.00 0.00 0.00 178.15 179.81 2wkw h GLY 318 N -0.12 1.20 2.00 5.37 0.00 -0.74 -1.01 103.07 109.79 2wkw h GLY 318 Ca 0.01 -0.20 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 2wkw h GLY 318 CO -0.00 -0.04 -0.12 3.21 0.00 0.00 0.00 176.54 179.59 2wkw h ARG 319 N 0.54 0.00 -0.08 4.80 3.08 -1.17 -3.19 114.38 118.35 2wkw h ARG 319 Ca 0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.47 2wkw h ARG 319 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.63 2wkw h ARG 319 CO -0.36 0.12 0.00 0.09 -1.07 0.00 0.00 179.97 178.75 2wkw n ASN 320 N -3.17 2.34 -0.03 7.04 3.02 -0.57 -4.40 115.26 119.49 2wkw n ASN 320 Ca 0.02 -1.66 0.01 0.00 -0.03 0.00 0.00 54.58 52.92 2wkw n ASN 320 Cb 0.48 -0.04 -0.00 0.00 -0.61 0.00 0.00 39.78 39.60 2wkw n ASN 320 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2wkw n THR 321 N 0.81 0.00 0.00 3.41 -2.24 -0.45 -4.87 114.28 110.93 2wkw n THR 321 Ca 0.09 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 2wkw n THR 321 Cb 0.38 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.62 2wkw n THR 321 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50