#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bpw h GLN 2 N 0.00 0.59 -0.57 0.00 -0.00 -2.05 -1.36 115.11 111.72 1bpw h GLN 2 Ca 0.00 -0.28 -0.01 0.00 -0.00 0.00 0.00 58.65 58.36 1bpw h GLN 2 Cb 0.00 -0.00 -0.03 0.00 -0.00 0.00 0.00 27.48 27.45 1bpw h GLN 2 CO 0.00 0.87 0.33 1.25 -0.00 0.00 0.00 178.83 181.28 1bpw h LEU 3 N 0.50 0.68 -0.85 0.06 5.85 -2.00 0.11 115.31 119.66 1bpw h LEU 3 Ca 0.05 -0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.62 1bpw h LEU 3 Cb 0.86 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 1bpw h LEU 3 CO 0.07 0.53 -0.34 0.58 -0.34 0.00 0.00 178.44 178.95 1bpw h VAL 4 N 0.78 1.29 0.00 1.05 2.07 -1.71 -2.59 116.25 117.14 1bpw h VAL 4 Ca 0.20 -1.43 0.00 0.00 0.82 0.00 0.00 66.70 66.29 1bpw h VAL 4 Cb -0.01 1.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.25 1bpw h VAL 4 CO -0.04 0.45 0.00 0.44 0.02 0.00 0.00 177.57 178.44 1bpw h ASP 5 N 0.39 0.00 1.89 0.57 3.32 -0.12 -3.10 116.42 119.37 1bpw h ASP 5 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1bpw h ASP 5 Cb 0.78 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.33 1bpw h ASP 5 CO 0.06 0.00 0.00 0.77 -1.72 0.00 0.00 179.24 178.35 1bpw h SER 6 N 0.00 0.00 -1.02 6.45 4.64 -0.44 -3.37 113.55 119.81 1bpw h SER 6 Ca 0.00 0.00 0.25 0.00 -0.47 0.00 0.00 61.79 61.57 1bpw h SER 6 Cb 0.87 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.85 1bpw h SER 6 CO 0.00 0.00 0.63 0.24 -0.87 0.00 0.00 176.83 176.83 1bpw h MET 7 N 0.00 0.51 -1.18 4.77 2.86 -1.44 -2.57 114.93 117.88 1bpw h MET 7 Ca 0.00 -0.03 0.33 0.00 -2.06 0.00 0.00 59.70 57.94 1bpw h MET 7 Cb 0.95 -0.11 -0.07 0.00 0.06 0.00 0.00 31.60 32.42 1bpw h MET 7 CO 0.00 0.34 0.81 -1.35 1.06 0.00 0.00 176.91 177.77 1bpw h PRO 8 N 0.52 0.12 -0.02 -0.22 0.11 -1.82 0.55 132.00 131.25 1bpw h PRO 8 Ca 0.61 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.72 1bpw h PRO 8 Cb 1.30 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1bpw h PRO 8 CO -0.39 0.08 -0.37 -1.13 -0.21 0.00 0.00 178.00 175.99 1bpw n SER 9 N -4.35 2.00 -4.74 -2.05 3.41 -0.97 -4.98 113.62 101.94 1bpw n SER 9 Ca 0.27 -1.50 -0.34 0.00 -0.26 0.00 0.00 58.87 57.03 1bpw n SER 9 Cb 1.17 0.41 0.07 0.00 -0.26 0.00 0.00 64.21 65.60 1bpw n SER 9 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bpw s ALA 10 N -2.19 2.30 0.15 7.33 0.00 0.19 -5.04 121.76 124.50 1bpw s ALA 10 Ca 0.18 0.83 -0.17 0.00 0.00 0.00 0.00 51.96 52.80 1bpw s ALA 10 Cb 0.16 -3.43 0.04 0.00 0.00 0.00 0.00 23.12 19.89 1bpw s ALA 10 CO 0.48 -1.56 0.45 -1.54 0.00 0.00 0.00 175.76 173.58 1bpw s SER 11 N -2.05 -0.28 0.20 0.00 1.04 -1.26 -5.02 113.70 106.33 1bpw s SER 11 Ca 0.73 -0.33 -0.32 0.00 0.48 0.00 0.00 55.95 56.51 1bpw s SER 11 Cb -0.27 0.51 -0.14 0.00 0.10 0.00 0.00 66.02 66.22 1bpw s SER 11 CO 0.41 -0.92 1.45 0.41 0.98 0.00 0.00 173.24 175.58 1bpw n THR 12 N -0.27 0.58 -0.58 2.02 -1.04 -1.26 -1.73 114.28 112.00 1bpw n THR 12 Ca -0.14 -0.15 0.00 0.00 -2.04 0.00 0.00 64.05 61.72 1bpw n THR 12 Cb 0.64 -1.44 0.00 0.00 -1.82 0.00 0.00 70.33 67.71 1bpw n THR 12 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1bpw n GLY 13 N 2.59 1.77 0.13 3.41 0.00 -1.26 -4.87 105.19 106.96 1bpw n GLY 13 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 1bpw n GLY 13 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1bpw n SER 14 N 0.00 1.94 -4.66 1.61 3.41 -0.70 -5.01 113.62 110.22 1bpw n SER 14 Ca 0.00 -0.01 -0.29 0.00 -0.26 0.00 0.00 58.87 58.31 1bpw n SER 14 Cb 0.00 -0.51 0.17 0.00 -0.26 0.00 0.00 64.21 63.61 1bpw n SER 14 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1bpw s VAL 15 N -2.53 2.36 -0.29 -3.33 1.01 -1.25 -5.00 120.40 111.37 1bpw s VAL 15 Ca -0.29 0.12 -0.15 0.00 0.00 0.00 0.00 61.98 61.66 1bpw s VAL 15 Cb 0.08 -2.45 0.12 0.00 0.00 0.00 0.00 36.38 34.13 1bpw s VAL 15 CO 0.67 -0.15 0.81 0.54 0.00 0.00 0.00 175.10 176.96 1bpw s VAL 16 N -2.80 -0.23 0.33 2.92 0.11 -1.26 -4.94 120.40 114.52 1bpw s VAL 16 Ca 0.65 0.00 -0.22 0.00 -2.93 0.00 0.00 61.98 59.48 1bpw s VAL 16 Cb -0.20 -1.00 -0.10 0.00 -1.53 0.00 0.00 36.38 33.55 1bpw s VAL 16 CO 0.59 0.00 0.88 -0.69 -3.33 0.00 0.00 175.10 172.55 1bpw s VAL 17 N 1.86 4.38 0.00 2.04 1.01 -0.47 -4.96 120.40 124.27 1bpw s VAL 17 Ca -0.08 1.53 0.00 0.00 0.00 0.00 0.00 61.98 63.43 1bpw s VAL 17 Cb -0.06 -3.83 0.00 0.00 0.00 0.00 0.00 36.38 32.49 1bpw s VAL 17 CO -0.18 -0.00 0.00 0.35 0.00 0.00 0.00 175.10 175.27 1bpw n THR 18 N 0.18 0.00 -1.66 3.92 -2.24 -1.26 -4.65 114.28 108.57 1bpw n THR 18 Ca 0.03 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.51 1bpw n THR 18 Cb 0.52 1.15 0.19 0.00 -2.10 0.00 0.00 70.33 70.08 1bpw n THR 18 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1bpw s ASP 19 N 0.00 2.71 0.00 3.42 1.01 -1.26 -5.03 116.67 117.52 1bpw s ASP 19 Ca 0.00 0.49 -0.13 0.00 0.71 0.00 0.00 52.55 53.63 1bpw s ASP 19 Cb 0.00 -0.69 -0.05 0.00 1.01 0.00 0.00 42.92 43.18 1bpw s ASP 19 CO 0.00 -3.00 0.37 -1.81 0.21 0.00 0.00 175.17 170.94 1bpw s ASP 20 N -4.50 6.72 0.00 0.27 1.01 -1.26 -5.01 116.67 113.90 1bpw s ASP 20 Ca 0.71 0.87 0.24 0.00 0.71 0.00 0.00 52.55 55.08 1bpw s ASP 20 Cb -0.07 -2.21 0.29 0.00 1.01 0.00 0.00 42.92 41.94 1bpw s ASP 20 CO 0.53 0.31 1.30 0.18 0.21 0.00 0.00 175.17 177.70 1bpw n LEU 21 N 1.66 2.34 -4.86 1.23 4.77 -1.26 -4.82 117.00 116.06 1bpw n LEU 21 Ca -0.14 -0.80 -0.37 0.00 -0.03 0.00 0.00 56.01 54.68 1bpw n LEU 21 Cb 0.53 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.55 1bpw n LEU 21 CO 0.38 0.40 -0.00 0.20 -1.33 0.00 0.00 177.39 177.04 1bpw s ASN 22 N -2.19 6.62 -0.13 -1.43 0.01 -1.26 -4.59 114.94 111.97 1bpw s ASN 22 Ca 0.26 0.74 -0.04 0.00 -0.71 0.00 0.00 52.86 53.11 1bpw s ASN 22 Cb 0.19 -2.17 0.06 0.00 0.41 0.00 0.00 41.25 39.75 1bpw s ASN 22 CO 0.41 0.32 0.23 -0.47 -1.51 0.00 0.00 177.10 176.08 1bpw s TYR 23 N -1.13 -0.33 0.13 2.20 6.14 -0.12 -0.93 117.35 123.31 1bpw s TYR 23 Ca 0.23 0.75 -0.24 0.00 0.64 0.00 0.00 57.07 58.44 1bpw s TYR 23 Cb -0.14 -0.15 0.08 0.00 0.42 0.00 0.00 41.96 42.16 1bpw s TYR 23 CO 0.11 -0.38 0.66 1.67 0.64 0.00 0.00 175.55 178.26 1bpw s TRP 24 N 2.37 -0.50 -0.67 4.97 -2.14 -0.92 0.51 118.94 122.57 1bpw s TRP 24 Ca 0.03 0.30 0.00 0.00 2.66 0.00 0.00 56.10 59.09 1bpw s TRP 24 Cb -0.13 0.56 0.00 0.00 -3.10 0.00 0.00 33.47 30.80 1bpw s TRP 24 CO -0.08 -0.79 0.00 0.41 -2.66 0.00 0.00 176.95 173.82 1bpw n GLY 25 N -0.35 0.82 2.02 3.67 0.00 -1.26 -2.81 105.19 107.27 1bpw n GLY 25 Ca -0.15 -0.35 -0.01 0.00 0.00 0.00 0.00 46.02 45.51 1bpw n GLY 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bpw n GLY 26 N -1.49 0.42 3.53 -0.02 0.00 -1.26 -4.71 105.19 101.67 1bpw n GLY 26 Ca -0.06 -1.05 -0.11 0.00 0.00 0.00 0.00 46.02 44.80 1bpw n GLY 26 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1bpw s ARG 27 N -2.26 1.41 -0.08 1.61 1.70 -1.12 -5.01 118.95 115.19 1bpw s ARG 27 Ca 0.00 -0.63 -0.30 0.00 -0.47 0.00 0.00 55.73 54.34 1bpw s ARG 27 Cb 0.00 0.59 -0.02 0.00 -0.57 0.00 0.00 34.95 34.95 1bpw s ARG 27 CO 0.00 -0.62 1.00 1.03 -1.08 0.00 0.00 175.30 175.62 1bpw s ARG 28 N -3.80 4.45 -0.00 3.89 0.52 -1.26 -2.16 118.95 120.59 1bpw s ARG 28 Ca 0.04 1.39 -0.25 0.00 -0.52 0.00 0.00 55.73 56.39 1bpw s ARG 28 Cb -0.02 -3.52 -0.04 0.00 0.52 0.00 0.00 34.95 31.88 1bpw s ARG 28 CO -0.07 -0.25 0.77 0.42 0.02 0.00 0.00 175.30 176.19 1bpw s ILE 29 N 1.77 4.87 0.15 1.52 -1.09 -0.10 -4.96 121.20 123.35 1bpw s ILE 29 Ca 0.49 1.62 0.34 0.00 -2.23 0.00 0.00 60.65 60.87 1bpw s ILE 29 Cb -0.19 -4.12 0.36 0.00 -1.58 0.00 0.00 42.46 36.94 1bpw s ILE 29 CO 0.20 0.29 2.02 0.11 -1.23 0.00 0.00 174.94 176.33 1bpw h LYS 30 N 6.26 0.00 -6.54 2.79 1.57 -1.96 -3.40 116.57 115.29 1bpw h LYS 30 Ca -0.42 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.00 1bpw h LYS 30 Cb 1.20 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.53 1bpw h LYS 30 CO 0.73 0.00 -1.20 -1.13 -0.57 0.00 0.00 179.45 177.28 1bpw n SER 31 N -2.82 -5.55 -3.86 0.86 3.41 -1.26 -4.94 113.62 99.46 1bpw n SER 31 Ca -0.01 -0.11 -0.22 0.00 -0.26 0.00 0.00 58.87 58.26 1bpw n SER 31 Cb 0.18 -1.58 0.14 0.00 -0.26 0.00 0.00 64.21 62.68 1bpw n SER 31 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1bpw n LYS 32 N -0.04 -0.60 -0.89 4.33 3.00 -1.26 -5.00 118.16 117.70 1bpw n LYS 32 Ca -0.08 -2.00 0.03 0.00 -0.00 0.00 0.00 58.31 56.26 1bpw n LYS 32 Cb 0.67 -0.89 -0.02 0.00 0.00 0.00 0.00 35.03 34.80 1bpw n LYS 32 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1bpw n ASP 33 N -3.36 -4.80 0.00 3.14 -0.08 -1.26 -4.71 116.55 105.48 1bpw n ASP 33 Ca 0.14 1.02 0.00 0.00 -1.51 0.00 0.00 54.79 54.44 1bpw n ASP 33 Cb 0.49 -2.63 0.00 0.00 2.34 0.00 0.00 41.12 41.33 1bpw n ASP 33 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1bpw n GLY 34 N -2.49 -2.25 2.98 0.27 0.00 -1.26 -4.92 105.19 97.52 1bpw n GLY 34 Ca -0.02 0.44 -0.01 0.00 0.00 0.00 0.00 46.02 46.44 1bpw n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bpw n ALA 35 N -2.15 -2.35 -0.65 4.61 0.00 -1.26 -4.72 120.51 113.99 1bpw n ALA 35 Ca 0.00 0.45 -0.23 0.00 0.00 0.00 0.00 53.44 53.66 1bpw n ALA 35 Cb 0.00 -1.20 -0.02 0.00 0.00 0.00 0.00 19.45 18.23 1bpw n ALA 35 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1bpw n THR 36 N 1.50 0.67 -4.41 0.00 -1.04 -1.26 -4.88 114.28 104.86 1bpw n THR 36 Ca -0.06 -0.17 -0.20 0.00 -2.04 0.00 0.00 64.05 61.58 1bpw n THR 36 Cb 0.29 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.70 1bpw n THR 36 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1bpw s THR 37 N -0.34 1.23 -0.02 12.58 -4.23 -1.26 -4.42 115.64 119.19 1bpw s THR 37 Ca 0.33 -2.03 0.06 0.00 -1.18 0.00 0.00 61.69 58.86 1bpw s THR 37 Cb -0.47 -2.61 -0.01 0.00 1.34 0.00 0.00 72.50 70.75 1bpw s THR 37 CO 0.26 -0.14 -0.18 -1.61 -0.54 0.00 0.00 174.62 172.40 1bpw s GLU 38 N -3.85 1.55 0.04 3.99 0.41 -0.46 -4.87 118.70 115.50 1bpw s GLU 38 Ca 0.33 -0.66 -0.29 0.00 -0.41 0.00 0.00 54.97 53.94 1bpw s GLU 38 Cb 0.07 -1.48 -0.04 0.00 -1.78 0.00 0.00 34.13 30.90 1bpw s GLU 38 CO 0.13 0.38 0.92 -1.25 -0.49 0.00 0.00 175.26 174.95 1bpw s PRO 39 N -0.37 4.59 -0.12 0.39 0.04 -1.26 0.80 135.00 139.06 1bpw s PRO 39 Ca 0.06 1.34 -0.05 0.00 0.04 0.00 0.00 61.00 62.39 1bpw s PRO 39 Cb -0.08 -3.42 -0.04 0.00 0.04 0.00 0.00 34.50 31.01 1bpw s PRO 39 CO -0.00 0.09 0.08 0.14 0.04 0.00 0.00 177.00 177.35 1bpw s VAL 40 N 0.51 4.94 0.32 -0.36 -7.23 -0.48 -4.94 120.40 113.16 1bpw s VAL 40 Ca 0.47 0.00 0.08 0.00 -1.81 0.00 0.00 61.98 60.72 1bpw s VAL 40 Cb -0.21 -3.15 -0.03 0.00 0.56 0.00 0.00 36.38 33.54 1bpw s VAL 40 CO 0.27 0.58 0.21 -0.36 -0.31 0.00 0.00 175.10 175.49 1bpw s PHE 41 N -0.64 2.87 -0.48 2.82 0.40 -1.26 -1.02 117.98 120.67 1bpw s PHE 41 Ca 0.12 -0.28 -0.15 0.00 -0.60 0.00 0.00 56.93 56.01 1bpw s PHE 41 Cb -0.12 -1.64 0.08 0.00 0.51 0.00 0.00 43.02 41.85 1bpw s PHE 41 CO 0.02 0.32 0.40 -2.00 0.70 0.00 0.00 175.22 174.66 1bpw s GLU 42 N -3.90 2.96 0.41 0.44 2.12 -0.41 -4.67 118.70 115.65 1bpw s GLU 42 Ca 0.38 -1.40 0.20 0.00 0.36 0.00 0.00 54.97 54.51 1bpw s GLU 42 Cb -0.05 -4.14 1.14 0.00 0.26 0.00 0.00 34.13 31.34 1bpw s GLU 42 CO 0.25 -1.06 1.79 -1.35 -0.54 0.00 0.00 175.26 174.35 1bpw h PRO 43 N 8.75 0.35 0.00 4.30 0.11 -1.76 0.14 132.00 143.90 1bpw h PRO 43 Ca -0.28 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1bpw h PRO 43 Cb 1.11 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1bpw h PRO 43 CO 0.89 0.23 0.00 0.00 -0.21 0.00 0.00 178.00 178.91 1bpw h ALA 44 N 1.60 1.00 0.00 -0.75 0.00 -1.87 -1.71 119.26 117.53 1bpw h ALA 44 Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.47 1bpw h ALA 44 Cb 1.50 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1bpw h ALA 44 CO -0.25 0.00 -0.42 0.25 0.00 0.00 0.00 179.25 178.83 1bpw n THR 45 N -2.66 0.00 -0.91 0.00 -2.24 -0.57 -3.69 114.28 104.21 1bpw n THR 45 Ca 0.03 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 1bpw n THR 45 Cb 0.34 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 69.05 1bpw n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bpw n GLY 46 N 1.22 0.85 3.80 3.38 0.00 0.40 -3.68 105.19 111.15 1bpw n GLY 46 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1bpw n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bpw s ARG 47 N -0.09 3.52 -0.45 1.61 0.52 -1.25 -4.79 118.95 118.03 1bpw s ARG 47 Ca 0.00 1.33 -0.24 0.00 -0.52 0.00 0.00 55.73 56.30 1bpw s ARG 47 Cb 0.00 -2.05 0.03 0.00 0.52 0.00 0.00 34.95 33.44 1bpw s ARG 47 CO 0.00 -0.66 0.86 0.08 0.02 0.00 0.00 175.30 175.60 1bpw s VAL 48 N -2.16 4.56 0.21 3.52 1.01 -1.26 -1.29 120.40 125.00 1bpw s VAL 48 Ca 0.66 0.61 0.12 0.00 0.00 0.00 0.00 61.98 63.38 1bpw s VAL 48 Cb -0.17 -4.37 -0.00 0.00 0.00 0.00 0.00 36.38 31.83 1bpw s VAL 48 CO 0.28 -0.76 1.60 -0.07 0.00 0.00 0.00 175.10 176.15 1bpw h LEU 49 N 10.33 0.00 0.00 3.92 3.38 -1.39 -3.48 115.31 128.07 1bpw h LEU 49 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1bpw h LEU 49 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1bpw h LEU 49 CO 0.99 0.59 0.00 0.00 0.09 0.00 0.00 178.44 180.11 1bpw s GLN 51 N -2.00 2.93 -0.08 0.00 -1.52 -1.26 -1.38 119.66 116.35 1bpw s GLN 51 Ca 0.00 -1.04 0.00 0.00 -1.95 0.00 0.00 55.36 52.38 1bpw s GLN 51 Cb 0.00 -2.57 0.02 0.00 -0.22 0.00 0.00 33.01 30.24 1bpw s GLN 51 CO 0.00 0.41 -0.07 0.00 -0.25 0.00 0.00 175.29 175.38 1bpw s MET 52 N -3.79 1.30 -0.34 2.91 0.23 0.24 -4.87 119.30 114.97 1bpw s MET 52 Ca 0.33 -0.21 -0.14 0.00 -1.03 0.00 0.00 55.69 54.63 1bpw s MET 52 Cb -0.08 -1.30 -0.01 0.00 -1.53 0.00 0.00 34.83 31.90 1bpw s MET 52 CO 0.25 -0.16 0.31 0.54 -2.03 0.00 0.00 175.02 173.93 1bpw s VAL 53 N 1.31 5.22 0.60 5.16 0.11 -1.26 -1.36 120.40 130.18 1bpw s VAL 53 Ca -0.03 -0.07 -0.18 0.00 -2.93 0.00 0.00 61.98 58.76 1bpw s VAL 53 Cb -0.14 -3.78 -0.03 0.00 -1.53 0.00 0.00 36.38 30.90 1bpw s VAL 53 CO -0.03 -0.07 1.16 -2.16 -3.33 0.00 0.00 175.10 170.67 1bpw s PRO 54 N 1.90 3.03 0.07 1.54 0.04 -1.26 -4.71 135.00 135.60 1bpw s PRO 54 Ca 0.09 1.64 -0.13 0.00 0.04 0.00 0.00 61.00 62.65 1bpw s PRO 54 Cb -0.17 -1.96 -0.06 0.00 0.04 0.00 0.00 34.50 32.35 1bpw s PRO 54 CO 0.11 -1.12 0.44 0.00 0.04 0.00 0.00 177.00 176.48 1bpw n GLY 56 N 1.19 2.70 0.23 0.00 0.00 -1.26 -4.40 105.19 103.65 1bpw n GLY 56 Ca -0.09 -2.22 0.01 0.00 0.00 0.00 0.00 46.02 43.71 1bpw n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bpw h ALA 57 N 0.63 0.67 0.00 4.61 0.00 -1.98 -1.59 119.26 121.61 1bpw h ALA 57 Ca -0.16 0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1bpw h ALA 57 Cb 0.60 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.57 1bpw h ALA 57 CO 0.24 -0.34 -0.54 0.93 0.00 0.00 0.00 179.25 179.55 1bpw h GLU 58 N 0.20 -0.65 0.73 0.00 3.07 -1.99 -1.16 114.58 114.77 1bpw h GLU 58 Ca 0.32 0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 59.19 1bpw h GLU 58 Cb 0.49 0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.54 1bpw h GLU 58 CO -0.44 -0.43 -0.46 0.93 -1.40 0.00 0.00 179.01 177.20 1bpw h GLU 59 N -0.68 -1.08 -0.89 2.33 3.07 -1.84 -2.65 114.58 112.84 1bpw h GLU 59 Ca 0.01 0.07 0.11 0.00 -0.50 0.00 0.00 59.36 59.05 1bpw h GLU 59 Cb 0.73 0.25 -0.13 0.00 -0.84 0.00 0.00 28.75 28.75 1bpw h GLU 59 CO -0.36 -0.72 -0.50 0.28 -1.40 0.00 0.00 179.01 176.31 1bpw h VAL 60 N -1.12 0.01 -0.92 3.13 2.07 -1.22 0.20 116.25 118.40 1bpw h VAL 60 Ca -0.09 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.62 1bpw h VAL 60 Cb 0.91 0.01 -0.11 0.00 -1.52 0.00 0.00 31.29 30.58 1bpw h VAL 60 CO 0.09 0.00 0.50 -0.78 0.02 0.00 0.00 177.57 177.39 1bpw h ASP 61 N -0.06 0.57 -0.68 0.57 1.82 -1.10 0.37 116.42 117.91 1bpw h ASP 61 Ca 0.22 0.11 -0.05 0.00 -0.39 0.00 0.00 57.03 56.92 1bpw h ASP 61 Cb 0.51 0.03 -0.03 0.00 0.68 0.00 0.00 39.33 40.52 1bpw h ASP 61 CO -0.89 0.17 0.21 1.56 -1.61 0.00 0.00 179.24 178.68 1bpw h GLN 62 N 0.60 1.06 0.26 0.28 4.20 -0.28 -0.31 115.11 120.93 1bpw h GLN 62 Ca 0.54 -0.23 0.01 0.00 0.06 0.00 0.00 58.65 59.03 1bpw h GLN 62 Cb 0.90 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.49 1bpw h GLN 62 CO -0.42 0.92 -0.34 0.00 -0.67 0.00 0.00 178.83 178.32 1bpw h ALA 63 N 1.09 -0.68 -0.07 3.87 0.00 0.77 0.61 119.26 124.86 1bpw h ALA 63 Ca 0.22 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.08 1bpw h ALA 63 Cb 0.30 0.52 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 1bpw h ALA 63 CO -0.01 -0.93 -0.26 0.28 0.00 0.00 0.00 179.25 178.33 1bpw h VAL 64 N -0.66 0.39 -0.92 0.00 2.07 -0.85 -0.48 116.25 115.80 1bpw h VAL 64 Ca -0.00 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.68 1bpw h VAL 64 Cb 0.63 0.39 -0.08 0.00 -1.52 0.00 0.00 31.29 30.71 1bpw h VAL 64 CO -0.11 0.00 0.59 1.56 0.02 0.00 0.00 177.57 179.63 1bpw h GLN 65 N -0.37 0.64 0.13 1.57 4.20 -0.72 0.53 115.11 121.09 1bpw h GLN 65 Ca 0.08 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 1bpw h GLN 65 Cb 0.49 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.12 1bpw h GLN 65 CO -0.28 0.42 -0.06 1.03 -0.67 0.00 0.00 178.83 179.27 1bpw h SER 66 N 0.65 -0.15 0.13 1.46 0.87 0.09 -1.64 113.55 114.96 1bpw h SER 66 Ca 0.48 -0.15 0.01 0.00 -1.23 0.00 0.00 61.79 60.90 1bpw h SER 66 Cb 0.86 0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.84 1bpw h SER 66 CO -0.24 0.06 -0.16 0.00 -0.53 0.00 0.00 176.83 175.97 1bpw h ALA 67 N 0.47 -0.29 -0.92 6.23 0.00 0.54 -2.62 119.26 122.67 1bpw h ALA 67 Ca -0.02 -0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.02 1bpw h ALA 67 Cb 0.29 0.23 -0.16 0.00 0.00 0.00 0.00 17.79 18.15 1bpw h ALA 67 CO 0.03 -0.69 -0.30 0.37 0.00 0.00 0.00 179.25 178.66 1bpw h GLN 68 N -0.33 -0.02 0.66 0.00 5.75 0.09 0.18 115.11 121.45 1bpw h GLN 68 Ca 0.01 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.49 1bpw h GLN 68 Cb 0.33 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.87 1bpw h GLN 68 CO -0.06 -0.01 -0.46 0.00 -2.65 0.00 0.00 178.83 175.65 1bpw h ALA 69 N 1.64 -1.14 -0.91 3.38 0.00 -0.94 -2.99 119.26 118.29 1bpw h ALA 69 Ca 0.39 -0.22 0.12 0.00 0.00 0.00 0.00 54.91 55.21 1bpw h ALA 69 Cb 0.64 0.60 -0.08 0.00 0.00 0.00 0.00 17.79 18.94 1bpw h ALA 69 CO -0.94 -1.16 0.54 0.00 0.00 0.00 0.00 179.25 177.69 1bpw h ALA 70 N -0.91 1.37 -0.30 0.00 0.00 -0.94 -1.89 119.26 116.59 1bpw h ALA 70 Ca -0.08 0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.94 1bpw h ALA 70 Cb 0.89 -0.13 -0.08 0.00 0.00 0.00 0.00 17.79 18.47 1bpw h ALA 70 CO 0.05 0.10 -0.22 -0.92 0.00 0.00 0.00 179.25 178.25 1bpw h TYR 71 N 0.83 -0.58 -1.00 0.00 3.20 -0.56 0.38 116.97 119.25 1bpw h TYR 71 Ca 0.47 0.04 0.36 0.00 3.14 0.00 0.00 58.73 62.74 1bpw h TYR 71 Cb 0.52 0.30 -0.16 0.00 1.54 0.00 0.00 36.73 38.93 1bpw h TYR 71 CO -0.04 -0.30 0.52 -0.07 -1.64 0.00 0.00 178.16 176.63 1bpw h LEU 72 N -0.20 0.38 0.00 2.82 4.07 -1.21 0.44 115.31 121.62 1bpw h LEU 72 Ca 0.16 0.22 -0.03 0.00 0.08 0.00 0.00 57.88 58.31 1bpw h LEU 72 Cb 0.44 0.21 -0.00 0.00 1.08 0.00 0.00 40.66 42.39 1bpw h LEU 72 CO -0.42 -0.27 -0.20 0.50 -1.08 0.00 0.00 178.44 176.97 1bpw h LYS 73 N 0.17 0.00 -0.66 1.13 1.63 -1.29 -3.34 116.57 114.20 1bpw h LYS 73 Ca 0.77 0.00 0.03 0.00 -0.85 0.00 0.00 60.65 60.60 1bpw h LYS 73 Cb 1.88 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 33.48 1bpw h LYS 73 CO -0.69 0.74 0.44 2.35 -3.45 0.00 0.00 179.45 178.84 1bpw h TRP 74 N -1.00 0.77 0.00 1.91 2.91 0.15 -1.10 115.95 119.60 1bpw h TRP 74 Ca -0.05 0.02 0.00 0.00 1.13 0.00 0.00 58.89 59.99 1bpw h TRP 74 Cb 0.81 -0.26 0.00 0.00 -0.51 0.00 0.00 29.16 29.20 1bpw h TRP 74 CO 0.17 0.45 0.00 0.66 -1.03 0.00 0.00 178.44 178.69 1bpw h SER 75 N 0.80 0.00 1.08 2.65 4.64 -0.29 -2.35 113.55 120.09 1bpw h SER 75 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1bpw h SER 75 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1bpw h SER 75 CO -0.07 0.00 -0.38 0.29 -0.87 0.00 0.00 176.83 175.80 1bpw n LYS 76 N -2.48 0.27 -2.87 4.77 4.01 -0.42 -4.85 118.16 116.60 1bpw n LYS 76 Ca 0.02 0.13 -0.33 0.00 -0.51 0.00 0.00 58.31 57.62 1bpw n LYS 76 Cb 0.26 -1.72 -0.07 0.00 -0.51 0.00 0.00 35.03 32.99 1bpw n LYS 76 CO 0.00 0.00 0.00 -1.64 -1.11 0.00 0.00 177.40 174.65 1bpw s MET 77 N -3.13 4.22 0.61 1.97 -1.94 -0.89 -5.04 119.30 115.10 1bpw s MET 77 Ca 0.08 1.06 -0.11 0.00 -1.71 0.00 0.00 55.69 55.02 1bpw s MET 77 Cb 0.13 -2.25 -0.04 0.00 2.01 0.00 0.00 34.83 34.68 1bpw s MET 77 CO 0.67 0.01 1.02 0.00 -0.01 0.00 0.00 175.02 176.71 1bpw s ALA 78 N -2.12 3.11 0.17 3.03 0.00 -1.26 -4.77 121.76 119.92 1bpw s ALA 78 Ca 0.60 -0.12 -0.18 0.00 0.00 0.00 0.00 51.96 52.26 1bpw s ALA 78 Cb -0.10 -3.05 0.10 0.00 0.00 0.00 0.00 23.12 20.07 1bpw s ALA 78 CO 0.14 -0.68 1.64 0.78 0.00 0.00 0.00 175.76 177.64 1bpw h GLY 79 N -0.30 0.15 0.29 0.00 0.00 -1.92 0.29 103.07 101.57 1bpw h GLY 79 Ca -0.44 0.22 0.20 0.00 0.00 0.00 0.00 47.33 47.31 1bpw h GLY 79 CO 0.62 -0.19 0.60 1.19 0.00 0.00 0.00 176.54 178.76 1bpw h ILE 80 N -0.09 0.69 0.06 2.60 6.09 -1.89 0.14 117.51 125.10 1bpw h ILE 80 Ca 0.20 -0.16 -0.15 0.00 -1.37 0.00 0.00 64.86 63.37 1bpw h ILE 80 Cb 0.39 0.18 0.02 0.00 0.47 0.00 0.00 36.82 37.88 1bpw h ILE 80 CO -0.46 0.09 -0.63 -0.33 -3.07 0.00 0.00 178.15 173.74 1bpw h GLU 81 N 0.47 0.31 0.00 2.19 5.08 -1.03 -3.19 114.58 118.41 1bpw h GLU 81 Ca 0.48 -0.42 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1bpw h GLU 81 Cb 1.12 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.50 1bpw h GLU 81 CO -0.21 1.14 -0.14 0.00 -1.00 0.00 0.00 179.01 178.80 1bpw h ARG 82 N -0.32 0.00 -0.06 2.33 3.08 0.33 -2.99 114.38 116.75 1bpw h ARG 82 Ca -0.10 0.00 0.01 0.00 0.07 0.00 0.00 59.98 59.96 1bpw h ARG 82 Cb 1.42 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.46 1bpw h ARG 82 CO 0.12 0.14 0.00 1.03 -1.07 0.00 0.00 179.97 180.20 1bpw h SER 83 N 0.00 -0.01 -0.29 7.04 0.87 -0.77 -2.94 113.55 117.45 1bpw h SER 83 Ca -0.00 0.01 0.07 0.00 -1.23 0.00 0.00 61.79 60.64 1bpw h SER 83 Cb 0.36 0.02 -0.08 0.00 -0.44 0.00 0.00 62.40 62.26 1bpw h SER 83 CO 0.02 0.00 -0.25 0.03 -0.53 0.00 0.00 176.83 176.10 1bpw h ARG 84 N 0.03 -0.23 -0.18 2.24 2.47 -1.52 -0.75 114.38 116.44 1bpw h ARG 84 Ca 0.02 0.02 0.02 0.00 -1.26 0.00 0.00 59.98 58.78 1bpw h ARG 84 Cb 0.02 0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 28.37 1bpw h ARG 84 CO -0.04 -0.15 0.04 0.28 0.56 0.00 0.00 179.97 180.66 1bpw h VAL 85 N -0.23 0.93 -0.48 2.04 2.07 -1.65 -2.80 116.25 116.12 1bpw h VAL 85 Ca 0.15 -0.04 0.01 0.00 0.82 0.00 0.00 66.70 67.64 1bpw h VAL 85 Cb 0.47 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 1bpw h VAL 85 CO -0.42 0.02 0.31 0.24 0.02 0.00 0.00 177.57 177.74 1bpw h MET 86 N 0.12 0.62 -0.87 1.57 2.86 -1.30 -1.21 114.93 116.72 1bpw h MET 86 Ca 0.08 -0.04 0.16 0.00 -2.06 0.00 0.00 59.70 57.84 1bpw h MET 86 Cb 0.07 -0.14 -0.07 0.00 0.06 0.00 0.00 31.60 31.52 1bpw h MET 86 CO -0.10 0.41 0.57 -0.07 1.06 0.00 0.00 176.91 178.77 1bpw h LEU 87 N 0.64 0.55 -0.11 1.22 3.38 -0.94 -0.97 115.31 119.08 1bpw h LEU 87 Ca 0.18 0.04 -0.16 0.00 0.09 0.00 0.00 57.88 58.03 1bpw h LEU 87 Cb -0.06 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 40.63 1bpw h LEU 87 CO -0.05 0.26 -0.56 -0.33 0.09 0.00 0.00 178.44 177.86 1bpw h GLU 88 N 0.57 0.57 -0.81 1.13 4.39 -1.08 -2.17 114.58 117.18 1bpw h GLU 88 Ca 0.44 -0.47 0.14 0.00 0.34 0.00 0.00 59.36 59.82 1bpw h GLU 88 Cb 0.86 0.10 -0.06 0.00 -0.10 0.00 0.00 28.75 29.55 1bpw h GLU 88 CO -0.19 1.09 0.53 0.00 -1.16 0.00 0.00 179.01 179.29 1bpw h ALA 89 N 0.48 1.98 0.41 3.43 0.00 -0.06 -0.95 119.26 124.55 1bpw h ALA 89 Ca -0.04 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1bpw h ALA 89 Cb 1.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1bpw h ALA 89 CO 0.12 -0.20 -0.20 0.00 0.00 0.00 0.00 179.25 178.97 1bpw h ALA 90 N 1.62 -0.62 -1.62 0.00 0.00 -1.24 -2.56 119.26 114.84 1bpw h ALA 90 Ca 0.40 -0.12 0.50 0.00 0.00 0.00 0.00 54.91 55.69 1bpw h ALA 90 Cb 0.78 0.21 -0.10 0.00 0.00 0.00 0.00 17.79 18.68 1bpw h ALA 90 CO -0.15 -0.58 1.13 -2.13 0.00 0.00 0.00 179.25 177.51 1bpw n ARG 91 N -4.72 -0.01 0.01 0.00 0.00 -0.82 0.49 116.66 111.60 1bpw n ARG 91 Ca -0.07 1.08 -0.09 0.00 -0.00 0.00 0.00 57.85 58.76 1bpw n ARG 91 Cb 0.22 -2.32 -0.07 0.00 0.00 0.00 0.00 32.46 30.28 1bpw n ARG 91 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 1bpw h ILE 92 N 0.00 0.88 -0.93 5.15 2.04 -1.11 -2.26 117.51 121.28 1bpw h ILE 92 Ca 0.86 -1.35 0.16 0.00 1.00 0.00 0.00 64.86 65.53 1bpw h ILE 92 Cb 3.17 1.56 -0.08 0.00 -0.74 0.00 0.00 36.82 40.73 1bpw h ILE 92 CO -0.18 0.26 0.59 0.40 0.00 0.00 0.00 178.15 179.22 1bpw h ILE 93 N -0.92 0.80 -0.21 -0.67 2.04 0.46 0.46 117.51 119.48 1bpw h ILE 93 Ca -0.01 -0.24 0.04 0.00 1.00 0.00 0.00 64.86 65.64 1bpw h ILE 93 Cb 0.53 0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.61 1bpw h ILE 93 CO 0.02 0.13 -0.01 -0.09 0.00 0.00 0.00 178.15 178.21 1bpw h ARG 94 N 0.70 0.06 0.00 2.37 2.43 -0.09 0.35 114.38 120.21 1bpw h ARG 94 Ca 0.48 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.65 1bpw h ARG 94 Cb 0.79 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.33 1bpw h ARG 94 CO -0.24 0.04 0.00 0.39 -1.51 0.00 0.00 179.97 178.65 1bpw n GLU 95 N -5.15 0.24 -0.20 0.20 1.02 0.09 -2.45 120.64 114.38 1bpw n GLU 95 Ca -0.02 0.12 0.05 0.00 -0.02 0.00 0.00 57.16 57.29 1bpw n GLU 95 Cb 0.11 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.10 1bpw n GLU 95 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1bpw n ARG 96 N -1.30 0.93 -0.17 3.49 1.74 -0.71 -4.88 116.66 115.76 1bpw n ARG 96 Ca 0.08 -1.77 -0.04 0.00 -0.77 0.00 0.00 57.85 55.35 1bpw n ARG 96 Cb 0.15 -1.03 -0.04 0.00 -1.02 0.00 0.00 32.46 30.52 1bpw n ARG 96 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1bpw n ARG 97 N -0.74 -0.17 0.07 5.56 0.00 0.03 -1.60 116.66 119.80 1bpw n ARG 97 Ca 0.08 1.11 -0.04 0.00 -0.00 0.00 0.00 57.85 58.99 1bpw n ARG 97 Cb 0.61 -1.64 -0.02 0.00 0.00 0.00 0.00 32.46 31.40 1bpw n ARG 97 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 1bpw h ASP 98 N 0.00 -0.33 -0.91 6.15 3.32 -1.88 -0.25 116.42 122.52 1bpw h ASP 98 Ca 0.06 0.03 0.23 0.00 0.02 0.00 0.00 57.03 57.37 1bpw h ASP 98 Cb 0.16 0.11 -0.17 0.00 0.22 0.00 0.00 39.33 39.66 1bpw h ASP 98 CO -0.37 -0.16 -0.01 0.78 -1.72 0.00 0.00 179.24 177.76 1bpw h ASN 99 N -0.23 -0.47 -0.26 6.45 2.35 -1.83 0.54 115.58 122.13 1bpw h ASN 99 Ca -0.01 0.25 -0.01 0.00 -0.55 0.00 0.00 56.30 55.98 1bpw h ASN 99 Cb 0.20 0.45 -0.01 0.00 0.05 0.00 0.00 38.32 39.01 1bpw h ASN 99 CO -0.02 -0.29 0.13 0.40 -1.65 0.00 0.00 177.43 176.01 1bpw h ILE 100 N 0.05 1.14 -0.57 2.81 2.04 -1.13 -1.92 117.51 119.92 1bpw h ILE 100 Ca 0.52 -0.38 0.07 0.00 1.00 0.00 0.00 64.86 66.07 1bpw h ILE 100 Cb 0.99 0.91 -0.06 0.00 -0.74 0.00 0.00 36.82 37.92 1bpw h ILE 100 CO -0.84 0.14 0.24 0.00 0.00 0.00 0.00 178.15 177.69 1bpw h ALA 101 N 1.00 0.74 -0.28 1.87 0.00 0.18 0.14 119.26 122.90 1bpw h ALA 101 Ca 0.09 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.07 1bpw h ALA 101 Cb 0.10 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1bpw h ALA 101 CO -0.01 -0.15 0.15 -0.22 0.00 0.00 0.00 179.25 179.02 1bpw h LYS 102 N 0.45 0.31 -0.64 0.00 3.64 -0.43 -1.43 116.57 118.47 1bpw h LYS 102 Ca 0.28 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.57 1bpw h LYS 102 Cb 0.28 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 1bpw h LYS 102 CO -0.25 0.21 0.15 1.25 -2.27 0.00 0.00 179.45 178.54 1bpw h LEU 103 N 0.32 0.95 -0.60 5.20 6.46 -0.53 -2.20 115.31 124.91 1bpw h LEU 103 Ca 0.11 -0.19 0.08 0.00 -0.12 0.00 0.00 57.88 57.76 1bpw h LEU 103 Cb 0.02 -0.25 -0.06 0.00 -0.73 0.00 0.00 40.66 39.63 1bpw h LEU 103 CO -0.07 0.92 0.26 -0.08 -0.62 0.00 0.00 178.44 178.85 1bpw h GLU 104 N 0.96 0.46 0.06 1.25 4.57 -0.13 -2.41 114.58 119.34 1bpw h GLU 104 Ca 0.20 -0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.37 1bpw h GLU 104 Cb 0.34 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.81 1bpw h GLU 104 CO 0.00 0.30 -0.15 0.28 -1.18 0.00 0.00 179.01 178.26 1bpw h VAL 105 N 0.47 0.64 -1.00 0.32 2.07 -0.66 -0.80 116.25 117.29 1bpw h VAL 105 Ca 0.29 0.00 0.22 0.00 0.82 0.00 0.00 66.70 68.03 1bpw h VAL 105 Cb 0.30 0.64 -0.10 0.00 -1.52 0.00 0.00 31.29 30.61 1bpw h VAL 105 CO -0.25 0.00 0.62 0.40 0.02 0.00 0.00 177.57 178.36 1bpw h ILE 106 N -0.29 0.64 0.06 4.57 2.04 -1.14 0.30 117.51 123.69 1bpw h ILE 106 Ca 0.03 -0.21 -0.35 0.00 1.00 0.00 0.00 64.86 65.34 1bpw h ILE 106 Cb 0.32 -0.02 -0.04 0.00 -0.74 0.00 0.00 36.82 36.34 1bpw h ILE 106 CO -0.10 0.11 -2.02 -3.20 0.00 0.00 0.00 178.15 172.93 1bpw n ASN 107 N -4.71 1.61 -0.02 1.72 4.05 -1.14 -3.98 115.26 112.79 1bpw n ASN 107 Ca 0.24 0.20 -0.17 0.00 0.45 0.00 0.00 54.58 55.30 1bpw n ASN 107 Cb 0.69 -0.44 -0.14 0.00 1.23 0.00 0.00 39.78 41.12 1bpw n ASN 107 CO 0.00 0.00 0.00 -1.13 -3.05 0.00 0.00 177.26 173.08 1bpw h ASN 108 N 0.04 0.20 0.00 1.20 -0.73 -0.83 -3.39 115.58 112.07 1bpw h ASN 108 Ca -0.42 -0.98 0.00 0.00 1.87 0.00 0.00 56.30 56.77 1bpw h ASN 108 Cb 2.03 -0.07 0.00 0.00 0.27 0.00 0.00 38.32 40.55 1bpw h ASN 108 CO 0.06 1.18 0.00 0.61 -0.37 0.00 0.00 177.43 178.90 1bpw n GLY 109 N 1.64 2.58 3.76 1.57 0.00 0.10 -4.53 105.19 110.30 1bpw n GLY 109 Ca -0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 1bpw n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bpw s LYS 110 N -0.51 2.30 0.49 1.61 -2.85 -1.26 -3.80 119.74 115.72 1bpw s LYS 110 Ca 0.00 1.30 -0.22 0.00 -1.00 0.00 0.00 55.97 56.05 1bpw s LYS 110 Cb 0.00 -1.89 -0.07 0.00 -2.06 0.00 0.00 37.83 33.81 1bpw s LYS 110 CO 0.00 -1.62 1.16 0.95 0.10 0.00 0.00 175.35 175.93 1bpw s THR 111 N -2.67 3.09 0.50 3.79 -4.23 -1.26 -4.63 115.64 110.22 1bpw s THR 111 Ca 0.64 0.76 0.18 0.00 -1.18 0.00 0.00 61.69 62.09 1bpw s THR 111 Cb -0.19 -3.36 0.25 0.00 1.34 0.00 0.00 72.50 70.54 1bpw s THR 111 CO 0.51 -0.06 2.11 0.16 -0.54 0.00 0.00 174.62 176.80 1bpw h ILE 112 N 1.61 0.95 -0.86 2.99 -0.00 -1.50 0.76 117.51 121.46 1bpw h ILE 112 Ca -0.50 -0.24 0.12 0.00 -0.00 0.00 0.00 64.86 64.24 1bpw h ILE 112 Cb 1.26 1.14 -0.06 0.00 -0.00 0.00 0.00 36.82 39.15 1bpw h ILE 112 CO 0.59 0.07 0.56 0.74 -0.00 0.00 0.00 178.15 180.10 1bpw h THR 113 N 0.00 0.90 0.00 0.16 2.02 -1.85 -0.20 112.91 113.94 1bpw h THR 113 Ca -0.00 -0.26 -0.00 0.00 0.77 0.00 0.00 66.41 66.92 1bpw h THR 113 Cb 0.13 0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 66.63 1bpw h THR 113 CO 0.01 0.14 -0.04 -0.33 0.37 0.00 0.00 175.52 175.67 1bpw h GLU 114 N 0.75 0.00 -0.91 6.66 5.08 -1.52 -3.37 114.58 121.27 1bpw h GLU 114 Ca 0.41 0.00 0.22 0.00 -1.00 0.00 0.00 59.36 58.99 1bpw h GLU 114 Cb 0.56 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 29.64 1bpw h GLU 114 CO -0.18 0.47 -0.10 0.00 -1.00 0.00 0.00 179.01 178.21 1bpw n ALA 115 N -2.73 0.34 -0.14 3.43 0.00 0.11 -0.08 120.51 121.45 1bpw n ALA 115 Ca -0.05 0.98 -0.04 0.00 0.00 0.00 0.00 53.44 54.34 1bpw n ALA 115 Cb 0.24 -0.66 0.05 0.00 0.00 0.00 0.00 19.45 19.08 1bpw n ALA 115 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1bpw h GLU 116 N 0.00 0.18 -0.56 0.00 5.08 -1.20 -1.10 114.58 116.99 1bpw h GLU 116 Ca 0.49 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.86 1bpw h GLU 116 Cb 0.90 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.08 1bpw h GLU 116 CO -0.89 0.12 0.35 1.88 -1.00 0.00 0.00 179.01 179.47 1bpw h TYR 117 N 0.19 0.66 -0.85 4.33 0.05 -0.65 -1.83 116.97 118.86 1bpw h TYR 117 Ca 0.22 0.02 0.20 0.00 0.05 0.00 0.00 58.73 59.22 1bpw h TYR 117 Cb 0.29 -0.22 -0.12 0.00 1.01 0.00 0.00 36.73 37.70 1bpw h TYR 117 CO -0.23 0.39 0.34 -0.44 -1.05 0.00 0.00 178.16 177.16 1bpw h ASP 118 N 0.70 0.27 0.01 3.88 5.19 -0.46 0.21 116.42 126.23 1bpw h ASP 118 Ca 0.22 0.15 -0.07 0.00 -0.62 0.00 0.00 57.03 56.71 1bpw h ASP 118 Cb -0.01 0.14 0.01 0.00 0.18 0.00 0.00 39.33 39.64 1bpw h ASP 118 CO -0.08 0.02 -0.27 0.40 -3.12 0.00 0.00 179.24 176.18 1bpw h ILE 119 N 0.39 1.58 -0.95 0.35 1.08 -0.92 -2.20 117.51 116.85 1bpw h ILE 119 Ca 0.51 -2.06 0.19 0.00 -0.39 0.00 0.00 64.86 63.11 1bpw h ILE 119 Cb 0.93 2.90 -0.11 0.00 -3.07 0.00 0.00 36.82 37.47 1bpw h ILE 119 CO -0.51 0.56 0.54 0.44 -0.69 0.00 0.00 178.15 178.50 1bpw h ASP 120 N -0.56 0.66 -0.57 1.72 3.32 -0.85 0.83 116.42 120.98 1bpw h ASP 120 Ca -0.04 0.11 0.05 0.00 0.02 0.00 0.00 57.03 57.17 1bpw h ASP 120 Cb 1.07 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.58 1bpw h ASP 120 CO 0.05 0.22 0.38 0.00 -1.72 0.00 0.00 179.24 178.16 1bpw h ALA 121 N 1.64 1.81 0.11 3.45 0.00 -0.48 -1.11 119.26 124.69 1bpw h ALA 121 Ca 0.55 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.44 1bpw h ALA 121 Cb 0.88 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1bpw h ALA 121 CO -0.40 0.10 -0.05 0.00 0.00 0.00 0.00 179.25 178.89 1bpw h ALA 122 N 1.69 -0.15 0.00 0.00 0.00 0.13 -2.77 119.26 118.16 1bpw h ALA 122 Ca 0.24 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1bpw h ALA 122 Cb 0.24 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1bpw h ALA 122 CO -0.07 -0.36 -0.14 0.11 0.00 0.00 0.00 179.25 178.79 1bpw h TRP 123 N -0.61 0.00 -0.19 0.00 5.08 -1.03 -2.73 115.95 116.46 1bpw h TRP 123 Ca -0.02 0.00 -0.20 0.00 1.08 0.00 0.00 58.89 59.76 1bpw h TRP 123 Cb 0.48 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.64 1bpw h TRP 123 CO 0.07 0.14 -0.66 1.96 -1.28 0.00 0.00 178.44 178.67 1bpw h GLN 124 N 0.00 0.73 -0.96 0.12 4.20 -1.23 -1.43 115.11 116.54 1bpw h GLN 124 Ca -0.00 -0.53 0.01 0.00 0.06 0.00 0.00 58.65 58.19 1bpw h GLN 124 Cb 0.67 0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.49 1bpw h GLN 124 CO 0.02 1.15 0.63 0.00 -0.67 0.00 0.00 178.83 179.96 1bpw h ILE 126 N 1.31 1.43 0.00 0.00 2.04 -1.42 -2.30 117.51 118.57 1bpw h ILE 126 Ca 0.35 -1.40 -0.01 0.00 1.00 0.00 0.00 64.86 64.80 1bpw h ILE 126 Cb -0.14 2.28 -0.00 0.00 -0.74 0.00 0.00 36.82 38.22 1bpw h ILE 126 CO -0.07 0.38 -0.03 -0.08 0.00 0.00 0.00 178.15 178.35 1bpw h GLU 127 N -0.41 0.00 0.13 2.37 4.81 -0.89 0.52 114.58 121.11 1bpw h GLU 127 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1bpw h GLU 127 Cb 0.66 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.04 1bpw h GLU 127 CO 0.02 0.03 -0.06 -0.92 -0.73 0.00 0.00 179.01 177.34 1bpw h TYR 128 N 0.00 -0.16 -0.01 0.92 3.20 -0.45 -2.90 116.97 117.57 1bpw h TYR 128 Ca -0.00 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 1bpw h TYR 128 Cb 0.06 0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.38 1bpw h TYR 128 CO 0.00 0.22 -0.11 1.88 -1.64 0.00 0.00 178.16 178.51 1bpw h TYR 129 N -0.96 0.02 0.35 -3.82 0.05 -1.14 -1.77 116.97 109.70 1bpw h TYR 129 Ca -0.02 -0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.74 1bpw h TYR 129 Cb 0.45 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.19 1bpw h TYR 129 CO 0.08 0.13 -0.17 0.00 -1.05 0.00 0.00 178.16 177.16 1bpw h ALA 130 N 1.87 -0.47 0.00 3.88 0.00 -0.97 -0.18 119.26 123.38 1bpw h ALA 130 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1bpw h ALA 130 Cb 0.21 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1bpw h ALA 130 CO 0.01 -0.75 0.00 0.41 0.00 0.00 0.00 179.25 178.92 1bpw n GLY 131 N -1.22 -0.77 0.04 0.00 0.00 -0.81 -1.62 105.19 100.81 1bpw n GLY 131 Ca -0.10 -0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.00 1bpw n GLY 131 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1bpw n LEU 132 N -1.48 0.46 -0.29 0.99 7.94 -0.24 -4.42 117.00 119.97 1bpw n LEU 132 Ca 0.02 0.00 -0.03 0.00 -1.11 0.00 0.00 56.01 54.90 1bpw n LEU 132 Cb 0.10 -0.04 0.09 0.00 0.53 0.00 0.00 43.42 44.09 1bpw n LEU 132 CO 0.08 0.01 1.19 0.00 -1.11 0.00 0.00 177.39 177.56 1bpw h ALA 133 N 2.28 1.04 0.00 1.96 0.00 -0.14 -2.04 119.26 122.36 1bpw h ALA 133 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1bpw h ALA 133 Cb 0.86 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1bpw h ALA 133 CO 0.00 0.35 0.00 -2.30 0.00 0.00 0.00 179.25 177.30 1bpw n PRO 134 N -4.57 0.20 -0.02 0.00 -0.02 -1.26 -2.05 135.00 127.28 1bpw n PRO 134 Ca 0.09 0.15 0.01 0.00 -2.02 0.00 0.00 63.50 61.73 1bpw n PRO 134 Cb 0.07 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 31.91 1bpw n PRO 134 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1bpw n THR 135 N -1.24 0.82 -1.70 3.45 -1.04 -0.77 -4.87 114.28 108.92 1bpw n THR 135 Ca 0.06 -0.67 -0.57 0.00 -2.04 0.00 0.00 64.05 60.83 1bpw n THR 135 Cb 0.08 -0.38 -0.07 0.00 -1.82 0.00 0.00 70.33 68.14 1bpw n THR 135 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1bpw n LEU 136 N -2.62 2.43 -3.90 -4.42 4.32 -0.87 -4.92 117.00 107.02 1bpw n LEU 136 Ca -0.15 1.07 -0.09 0.00 -0.02 0.00 0.00 56.01 56.82 1bpw n LEU 136 Cb 0.83 -1.16 -0.01 0.00 -1.62 0.00 0.00 43.42 41.46 1bpw n LEU 136 CO 0.44 -0.43 0.39 -0.94 -1.22 0.00 0.00 177.39 175.63 1bpw s SER 137 N 3.42 0.00 0.01 -1.43 1.04 -1.26 -4.99 113.70 110.49 1bpw s SER 137 Ca 0.97 -0.95 0.00 0.00 0.48 0.00 0.00 55.95 56.45 1bpw s SER 137 Cb -1.03 0.73 -0.00 0.00 0.10 0.00 0.00 66.02 65.82 1bpw s SER 137 CO 0.64 -1.41 0.00 0.61 0.98 0.00 0.00 173.24 174.05 1bpw n GLY 138 N -0.48 4.13 3.77 7.32 0.00 -1.26 -4.57 105.19 114.09 1bpw n GLY 138 Ca -0.04 -2.06 -0.23 0.00 0.00 0.00 0.00 46.02 43.69 1bpw n GLY 138 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bpw s GLN 139 N -2.05 2.41 -0.15 1.61 -0.21 -1.23 -4.89 119.66 115.15 1bpw s GLN 139 Ca 0.00 -1.57 -0.03 0.00 0.02 0.00 0.00 55.36 53.79 1bpw s GLN 139 Cb 0.00 -2.20 0.05 0.00 1.00 0.00 0.00 33.01 31.86 1bpw s GLN 139 CO 0.00 0.03 0.04 -1.58 -2.12 0.00 0.00 175.29 171.66 1bpw s HIS 140 N -2.45 0.72 0.01 0.91 5.65 -1.26 -1.05 115.29 117.82 1bpw s HIS 140 Ca 0.40 -0.50 0.08 0.00 0.25 0.00 0.00 55.06 55.30 1bpw s HIS 140 Cb -0.02 -0.87 -0.02 0.00 -1.18 0.00 0.00 32.58 30.48 1bpw s HIS 140 CO 0.24 -0.49 -0.26 0.42 -0.65 0.00 0.00 174.74 174.00 1bpw s ILE 141 N 1.96 2.14 -0.17 0.89 1.01 -0.50 -5.00 121.20 121.53 1bpw s ILE 141 Ca 0.02 -1.24 -0.17 0.00 0.00 0.00 0.00 60.65 59.26 1bpw s ILE 141 Cb -0.15 -1.79 -0.04 0.00 0.01 0.00 0.00 42.46 40.49 1bpw s ILE 141 CO -0.07 0.47 0.46 -1.10 0.00 0.00 0.00 174.94 174.70 1bpw s GLN 142 N -0.94 4.24 0.38 2.79 -0.21 -1.26 -0.92 119.66 123.73 1bpw s GLN 142 Ca 0.11 0.34 0.07 0.00 0.02 0.00 0.00 55.36 55.91 1bpw s GLN 142 Cb -0.10 -3.51 -0.01 0.00 1.00 0.00 0.00 33.01 30.39 1bpw s GLN 142 CO 0.01 0.00 0.43 -0.51 -2.12 0.00 0.00 175.29 173.10 1bpw s LEU 143 N 1.15 3.64 0.52 2.90 1.43 -0.08 -4.95 118.68 123.29 1bpw s LEU 143 Ca 0.23 -0.48 -0.22 0.00 -1.03 0.00 0.00 54.13 52.63 1bpw s LEU 143 Cb -0.15 -2.41 -0.06 0.00 0.03 0.00 0.00 46.19 43.60 1bpw s LEU 143 CO 0.09 -0.57 1.28 -2.65 0.23 0.00 0.00 176.35 174.73 1bpw n PRO 144 N -1.61 1.62 -3.33 1.29 -0.02 -1.26 -3.69 135.00 128.00 1bpw n PRO 144 Ca 0.03 0.59 -0.18 0.00 -2.02 0.00 0.00 63.50 61.92 1bpw n PRO 144 Cb 0.60 -2.46 0.07 0.00 -0.02 0.00 0.00 33.50 31.68 1bpw n PRO 144 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bpw n GLY 145 N 0.85 -0.25 4.11 -1.23 0.00 -1.26 -3.65 105.19 103.75 1bpw n GLY 145 Ca 0.10 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1bpw n GLY 145 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bpw n GLY 146 N -1.56 2.34 3.74 -0.02 0.00 -1.24 -4.90 105.19 103.54 1bpw n GLY 146 Ca -0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 1bpw n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bpw s ALA 147 N -0.23 2.04 0.05 4.61 0.00 -1.24 -4.70 121.76 122.29 1bpw s ALA 147 Ca 0.00 0.39 -0.07 0.00 0.00 0.00 0.00 51.96 52.28 1bpw s ALA 147 Cb 0.00 -3.33 -0.01 0.00 0.00 0.00 0.00 23.12 19.78 1bpw s ALA 147 CO 0.00 -2.03 0.12 -0.59 0.00 0.00 0.00 175.76 173.26 1bpw s PHE 148 N -2.78 0.19 0.25 0.00 -0.71 -1.02 -0.90 117.98 113.01 1bpw s PHE 148 Ca 0.63 -0.53 0.07 0.00 -1.04 0.00 0.00 56.93 56.07 1bpw s PHE 148 Cb -0.19 -0.13 -0.05 0.00 -1.21 0.00 0.00 43.02 41.44 1bpw s PHE 148 CO 0.56 -0.42 -0.09 0.00 -1.34 0.00 0.00 175.22 173.93 1bpw s ALA 149 N -2.98 2.22 -0.15 1.99 0.00 -0.10 -0.74 121.76 122.00 1bpw s ALA 149 Ca -0.02 -1.81 -0.28 0.00 0.00 0.00 0.00 51.96 49.86 1bpw s ALA 149 Cb 0.01 0.08 0.07 0.00 0.00 0.00 0.00 23.12 23.28 1bpw s ALA 149 CO -0.06 -0.01 0.68 1.52 0.00 0.00 0.00 175.76 177.88 1bpw s TYR 150 N -2.99 -0.70 0.01 0.00 -0.85 0.41 -1.40 117.35 111.83 1bpw s TYR 150 Ca 0.27 1.46 0.02 0.00 -0.52 0.00 0.00 57.07 58.30 1bpw s TYR 150 Cb 0.02 0.33 -0.04 0.00 0.38 0.00 0.00 41.96 42.66 1bpw s TYR 150 CO 0.10 -0.49 0.01 0.95 -1.52 0.00 0.00 175.55 174.60 1bpw s THR 151 N -0.46 4.21 -0.11 -3.49 -4.23 -0.22 -0.52 115.64 110.82 1bpw s THR 151 Ca -0.06 -0.63 0.00 0.00 -1.18 0.00 0.00 61.69 59.82 1bpw s THR 151 Cb -0.02 -2.90 -0.02 0.00 1.34 0.00 0.00 72.50 70.89 1bpw s THR 151 CO 0.06 0.33 -0.11 -0.13 -0.54 0.00 0.00 174.62 174.23 1bpw s ARG 152 N -1.69 3.13 -0.46 3.99 0.52 -0.44 -3.55 118.95 120.44 1bpw s ARG 152 Ca 0.21 -0.64 -0.20 0.00 -0.52 0.00 0.00 55.73 54.58 1bpw s ARG 152 Cb -0.12 -2.61 0.03 0.00 0.52 0.00 0.00 34.95 32.77 1bpw s ARG 152 CO 0.12 0.38 0.64 0.50 0.02 0.00 0.00 175.30 176.97 1bpw s ARG 153 N -0.08 3.22 0.14 3.54 3.52 -1.26 -1.81 118.95 126.22 1bpw s ARG 153 Ca -0.01 -0.54 0.07 0.00 -0.13 0.00 0.00 55.73 55.11 1bpw s ARG 153 Cb -0.14 -4.00 -0.04 0.00 -1.56 0.00 0.00 34.95 29.21 1bpw s ARG 153 CO 0.03 -1.09 -0.02 -1.21 -0.81 0.00 0.00 175.30 172.20 1bpw s GLU 154 N 2.79 2.39 0.78 5.12 2.02 0.37 -4.91 118.70 127.26 1bpw s GLU 154 Ca 0.20 -1.02 -0.11 0.00 0.02 0.00 0.00 54.97 54.07 1bpw s GLU 154 Cb -0.16 -2.40 0.06 0.00 0.10 0.00 0.00 34.13 31.74 1bpw s GLU 154 CO 0.17 0.49 1.10 -1.25 0.02 0.00 0.00 175.26 175.78 1bpw s PRO 155 N -2.63 2.14 0.04 0.39 0.04 -1.26 -0.67 135.00 133.06 1bpw s PRO 155 Ca 0.26 1.22 -0.15 0.00 0.04 0.00 0.00 61.00 62.36 1bpw s PRO 155 Cb -0.10 -1.88 -0.33 0.00 0.04 0.00 0.00 34.50 32.22 1bpw s PRO 155 CO 0.18 -1.74 1.04 -0.07 0.04 0.00 0.00 177.00 176.45 1bpw h LEU 156 N -1.16 0.87 0.00 -3.56 4.07 -1.88 -3.44 115.31 110.22 1bpw h LEU 156 Ca -0.44 -0.88 0.00 0.00 0.08 0.00 0.00 57.88 56.65 1bpw h LEU 156 Cb 1.24 -0.28 0.00 0.00 1.08 0.00 0.00 40.66 42.70 1bpw h LEU 156 CO 0.50 1.68 0.00 0.61 -1.08 0.00 0.00 178.44 180.15 1bpw n GLY 157 N 1.58 0.60 3.48 0.83 0.00 -1.26 -4.83 105.19 105.60 1bpw n GLY 157 Ca -0.16 -0.81 -0.38 0.00 0.00 0.00 0.00 46.02 44.68 1bpw n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bpw s VAL 158 N 0.00 4.76 -0.19 1.61 1.01 -1.26 -2.04 120.40 124.29 1bpw s VAL 158 Ca 0.00 -0.22 -0.14 0.00 0.00 0.00 0.00 61.98 61.62 1bpw s VAL 158 Cb 0.00 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 1bpw s VAL 158 CO 0.00 0.16 0.31 0.00 0.00 0.00 0.00 175.10 175.57 1bpw s ALA 160 N 0.90 3.41 -0.12 0.00 0.00 0.67 -1.48 121.76 125.14 1bpw s ALA 160 Ca 0.16 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.39 1bpw s ALA 160 Cb -0.14 -1.90 -0.01 0.00 0.00 0.00 0.00 23.12 21.07 1bpw s ALA 160 CO 0.05 0.21 -0.15 0.20 0.00 0.00 0.00 175.76 176.07 1bpw s GLY 161 N 0.28 1.50 -0.35 0.00 0.00 -0.59 -0.74 107.32 107.43 1bpw s GLY 161 Ca 0.03 -0.91 -0.01 0.00 0.00 0.00 0.00 44.72 43.83 1bpw s GLY 161 CO 0.00 -0.28 0.08 -0.42 0.00 0.00 0.00 173.10 172.48 1bpw s ILE 162 N 0.22 2.99 0.82 0.90 1.01 -0.55 -1.02 121.20 125.57 1bpw s ILE 162 Ca -0.10 -1.77 -0.10 0.00 0.00 0.00 0.00 60.65 58.68 1bpw s ILE 162 Cb -0.16 -2.91 0.12 0.00 0.01 0.00 0.00 42.46 39.53 1bpw s ILE 162 CO 0.06 -0.39 1.16 -0.76 0.00 0.00 0.00 174.94 175.00 1bpw s LEU 163 N 1.16 2.72 0.40 2.97 1.43 -1.05 -2.34 118.68 123.98 1bpw s LEU 163 Ca 0.02 0.37 0.06 0.00 -1.03 0.00 0.00 54.13 53.55 1bpw s LEU 163 Cb -0.21 -2.73 -0.07 0.00 0.03 0.00 0.00 46.19 43.21 1bpw s LEU 163 CO -0.03 -2.10 0.02 0.00 0.23 0.00 0.00 176.35 174.47 1bpw s ALA 164 N -3.54 3.08 -0.86 4.21 0.00 -1.26 -4.28 121.76 119.11 1bpw s ALA 164 Ca 0.66 -2.05 0.22 0.00 0.00 0.00 0.00 51.96 50.80 1bpw s ALA 164 Cb -0.08 0.28 -0.01 0.00 0.00 0.00 0.00 23.12 23.31 1bpw s ALA 164 CO 0.49 -0.16 1.02 -2.67 0.00 0.00 0.00 175.76 174.44 1bpw n TRP 165 N -0.94 0.05 0.25 0.00 4.27 -1.26 -4.27 117.44 115.55 1bpw n TRP 165 Ca -0.06 0.02 0.13 0.00 -3.89 0.00 0.00 57.50 53.70 1bpw n TRP 165 Cb 0.67 -0.18 0.62 0.00 -1.36 0.00 0.00 31.31 31.07 1bpw n TRP 165 CO 0.00 0.00 0.00 -2.95 -2.29 0.00 0.00 177.69 172.45 1bpw h ASN 166 N 0.00 0.00 -1.69 -0.67 -1.07 -1.98 -3.33 115.58 106.84 1bpw h ASN 166 Ca 0.00 0.00 -0.50 0.00 0.07 0.00 0.00 56.30 55.87 1bpw h ASN 166 Cb 0.58 0.00 -0.34 0.00 -2.07 0.00 0.00 38.32 36.49 1bpw h ASN 166 CO 0.00 0.13 -0.98 -1.22 0.07 0.00 0.00 177.43 175.43 1bpw n TYR 167 N -3.35 -1.01 -0.03 4.14 4.02 -1.26 -5.02 117.16 114.64 1bpw n TYR 167 Ca -0.00 -3.18 -0.09 0.00 -0.01 0.00 0.00 57.90 54.62 1bpw n TYR 167 Cb 0.33 0.08 -0.06 0.00 -0.02 0.00 0.00 39.34 39.67 1bpw n TYR 167 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1bpw h PRO 168 N 4.21 -0.31 -0.45 -0.72 0.11 -1.74 -0.73 132.00 132.36 1bpw h PRO 168 Ca 0.06 0.02 -0.13 0.00 0.11 0.00 0.00 66.00 66.06 1bpw h PRO 168 Cb 0.91 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 1bpw h PRO 168 CO 0.42 -0.21 -0.23 0.35 -0.21 0.00 0.00 178.00 178.12 1bpw h PHE 169 N -0.32 1.08 -0.04 0.65 3.57 -1.94 -3.03 116.94 116.91 1bpw h PHE 169 Ca 0.03 -0.26 -0.01 0.00 3.53 0.00 0.00 57.97 61.26 1bpw h PHE 169 Cb 0.41 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 38.89 1bpw h PHE 169 CO -0.59 1.07 0.00 1.98 -2.23 0.00 0.00 178.31 178.55 1bpw h MET 170 N 0.81 0.07 -0.70 1.11 4.05 -1.77 -2.44 114.93 116.06 1bpw h MET 170 Ca 0.10 -0.02 -0.05 0.00 -0.28 0.00 0.00 59.70 59.45 1bpw h MET 170 Cb 0.80 -0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 31.56 1bpw h MET 170 CO 0.07 0.33 0.22 0.97 0.23 0.00 0.00 176.91 178.73 1bpw h ILE 171 N -0.20 1.25 -0.53 1.77 2.10 -1.20 -0.60 117.51 120.10 1bpw h ILE 171 Ca 0.01 -0.86 0.00 0.00 1.08 0.00 0.00 64.86 65.09 1bpw h ILE 171 Cb 0.30 0.48 -0.03 0.00 -1.09 0.00 0.00 36.82 36.48 1bpw h ILE 171 CO 0.00 0.34 0.33 0.00 -1.08 0.00 0.00 178.15 177.74 1bpw h ALA 172 N 1.21 0.67 -0.82 0.18 0.00 -1.52 -1.99 119.26 116.99 1bpw h ALA 172 Ca 0.23 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1bpw h ALA 172 Cb 0.28 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1bpw h ALA 172 CO -0.01 0.13 0.45 0.00 0.00 0.00 0.00 179.25 179.83 1bpw h ALA 173 N 1.17 1.05 0.00 0.00 0.00 -1.08 -0.75 119.26 119.65 1bpw h ALA 173 Ca 0.19 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1bpw h ALA 173 Cb -0.05 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.42 1bpw h ALA 173 CO -0.04 0.55 -0.02 -1.49 0.00 0.00 0.00 179.25 178.26 1bpw h TRP 174 N 1.14 0.00 0.04 0.00 4.06 -0.54 -0.22 115.95 120.43 1bpw h TRP 174 Ca 0.29 0.00 -0.38 0.00 2.06 0.00 0.00 58.89 60.86 1bpw h TRP 174 Cb 0.02 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.13 1bpw h TRP 174 CO 0.00 0.02 -2.26 1.63 -3.56 0.00 0.00 178.44 174.27 1bpw n LYS 175 N -3.16 0.68 -0.02 0.49 5.02 -0.78 -4.43 118.16 115.97 1bpw n LYS 175 Ca -0.01 0.22 -0.12 0.00 -2.02 0.00 0.00 58.31 56.37 1bpw n LYS 175 Cb 0.18 -1.60 -0.08 0.00 -0.02 0.00 0.00 35.03 33.52 1bpw n LYS 175 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1bpw h ALA 177 N 0.70 -0.14 -0.69 0.00 0.00 -1.26 0.17 119.26 118.03 1bpw h ALA 177 Ca 0.02 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1bpw h ALA 177 Cb 0.36 1.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 1bpw h ALA 177 CO 0.00 -0.20 0.42 -1.00 0.00 0.00 0.00 179.25 178.47 1bpw h PRO 178 N -0.01 0.94 -0.45 0.00 0.13 -1.77 -1.43 132.00 129.41 1bpw h PRO 178 Ca 0.02 -0.09 0.09 0.00 -0.87 0.00 0.00 66.00 65.16 1bpw h PRO 178 Cb 0.07 -0.20 -0.10 0.00 0.13 0.00 0.00 31.00 30.91 1bpw h PRO 178 CO -0.14 0.67 -0.27 0.00 -0.23 0.00 0.00 178.00 178.03 1bpw h ALA 179 N 1.22 -0.01 -0.18 -0.56 0.00 -0.98 -1.52 119.26 117.22 1bpw h ALA 179 Ca 0.25 0.14 -0.08 0.00 0.00 0.00 0.00 54.91 55.22 1bpw h ALA 179 Cb -0.03 0.63 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1bpw h ALA 179 CO -0.05 -0.64 -0.19 -0.07 0.00 0.00 0.00 179.25 178.31 1bpw h LEU 180 N -0.18 0.48 -1.69 0.00 4.07 -0.67 -1.86 115.31 115.47 1bpw h LEU 180 Ca 0.20 -0.48 0.30 0.00 0.08 0.00 0.00 57.88 57.98 1bpw h LEU 180 Cb 0.50 -0.14 -0.07 0.00 1.08 0.00 0.00 40.66 42.04 1bpw h LEU 180 CO -0.56 0.87 0.74 0.00 -1.08 0.00 0.00 178.44 178.41 1bpw h ALA 181 N 0.63 2.66 -0.01 1.53 0.00 -0.61 0.48 119.26 123.96 1bpw h ALA 181 Ca 0.03 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1bpw h ALA 181 Cb 0.73 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1bpw h ALA 181 CO 0.05 -1.03 -0.12 0.00 0.00 0.00 0.00 179.25 178.15 1bpw n GLY 183 N 1.26 0.62 3.89 0.00 0.00 0.17 -4.07 105.19 107.06 1bpw n GLY 183 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 1bpw n GLY 183 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1bpw s ASN 184 N -2.83 4.67 0.08 1.61 0.01 -0.72 -3.95 114.94 113.81 1bpw s ASN 184 Ca 0.00 0.87 0.05 0.00 -0.71 0.00 0.00 52.86 53.08 1bpw s ASN 184 Cb 0.00 -1.44 -0.04 0.00 0.41 0.00 0.00 41.25 40.18 1bpw s ASN 184 CO 0.00 -1.81 -0.04 0.00 -1.51 0.00 0.00 177.10 173.74 1bpw s ALA 185 N -3.51 3.15 0.04 0.60 0.00 -0.86 -4.36 121.76 116.82 1bpw s ALA 185 Ca 0.61 -1.15 0.08 0.00 0.00 0.00 0.00 51.96 51.51 1bpw s ALA 185 Cb -0.11 -1.09 -0.03 0.00 0.00 0.00 0.00 23.12 21.89 1bpw s ALA 185 CO 0.50 0.67 -0.23 0.08 0.00 0.00 0.00 175.76 176.78 1bpw s VAL 186 N -1.24 1.87 -0.20 0.00 1.01 0.84 -0.84 120.40 121.84 1bpw s VAL 186 Ca 0.23 -1.27 -0.03 0.00 0.00 0.00 0.00 61.98 60.91 1bpw s VAL 186 Cb -0.11 -1.61 0.06 0.00 0.00 0.00 0.00 36.38 34.72 1bpw s VAL 186 CO 0.15 0.28 0.05 -0.69 0.00 0.00 0.00 175.10 174.90 1bpw s VAL 187 N -0.79 0.43 0.22 2.92 1.01 -0.55 -0.83 120.40 122.81 1bpw s VAL 187 Ca 0.09 -0.55 0.11 0.00 0.00 0.00 0.00 61.98 61.63 1bpw s VAL 187 Cb -0.09 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.24 1bpw s VAL 187 CO 0.02 -0.26 -0.22 0.72 0.00 0.00 0.00 175.10 175.36 1bpw s PHE 188 N 1.89 2.32 -0.30 5.22 -0.12 -0.90 -1.55 117.98 124.56 1bpw s PHE 188 Ca 0.00 -0.34 0.03 0.00 -0.05 0.00 0.00 56.93 56.57 1bpw s PHE 188 Cb -0.17 -1.11 0.08 0.00 -0.63 0.00 0.00 43.02 41.19 1bpw s PHE 188 CO -0.10 0.56 -0.01 0.21 -0.05 0.00 0.00 175.22 175.83 1bpw s LYS 189 N -2.92 1.70 0.92 1.99 2.20 -0.19 -1.74 119.74 121.69 1bpw s LYS 189 Ca 0.24 -1.54 -0.11 0.00 -0.36 0.00 0.00 55.97 54.19 1bpw s LYS 189 Cb -0.07 -2.95 0.14 0.00 -1.51 0.00 0.00 37.83 33.45 1bpw s LYS 189 CO 0.12 -0.78 1.09 -2.14 -0.36 0.00 0.00 175.35 173.28 1bpw s PRO 190 N 1.07 1.04 0.13 4.03 0.02 -1.26 -2.53 135.00 137.51 1bpw s PRO 190 Ca 0.02 1.04 -0.31 0.00 0.02 0.00 0.00 61.00 61.77 1bpw s PRO 190 Cb -0.19 -1.77 -0.09 0.00 0.02 0.00 0.00 34.50 32.48 1bpw s PRO 190 CO -0.08 -2.45 1.44 0.45 -0.33 0.00 0.00 177.00 176.03 1bpw s SER 191 N -3.12 6.76 0.63 2.53 0.15 -1.26 -4.54 113.70 114.84 1bpw s SER 191 Ca 0.64 2.41 0.25 0.00 0.70 0.00 0.00 55.95 59.95 1bpw s SER 191 Cb -0.20 -2.59 1.24 0.00 -1.71 0.00 0.00 66.02 62.76 1bpw s SER 191 CO 0.58 -0.70 1.69 1.55 1.20 0.00 0.00 173.24 177.56 1bpw h PRO 192 N 6.76 0.00 0.00 5.44 0.13 -1.93 0.55 132.00 142.96 1bpw h PRO 192 Ca -0.42 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.62 1bpw h PRO 192 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1bpw h PRO 192 CO 0.88 0.00 -0.40 0.52 -0.23 0.00 0.00 178.00 178.77 1bpw h MET 193 N 0.00 0.00 -2.06 0.86 2.86 -1.93 -3.38 114.93 111.29 1bpw h MET 193 Ca 0.14 0.00 -0.51 0.00 -2.06 0.00 0.00 59.70 57.27 1bpw h MET 193 Cb 1.34 0.00 -0.41 0.00 0.06 0.00 0.00 31.60 32.59 1bpw h MET 193 CO -0.00 0.40 -1.03 0.25 1.06 0.00 0.00 176.91 177.58 1bpw n THR 194 N -3.23 0.83 0.22 2.22 -2.24 0.19 -4.51 114.28 107.76 1bpw n THR 194 Ca 0.02 -4.85 0.12 0.00 -2.27 0.00 0.00 64.05 57.07 1bpw n THR 194 Cb 0.67 -0.58 0.19 0.00 -2.10 0.00 0.00 70.33 68.51 1bpw n THR 194 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1bpw h PRO 195 N 2.99 0.00 0.28 -0.78 0.13 -1.70 -3.40 132.00 129.53 1bpw h PRO 195 Ca 0.11 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.22 1bpw h PRO 195 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1bpw h PRO 195 CO 0.60 0.02 -0.14 -0.24 -0.23 0.00 0.00 178.00 178.01 1bpw h VAL 196 N 0.00 0.00 -0.13 1.56 3.04 -1.92 -3.32 116.25 115.48 1bpw h VAL 196 Ca -0.00 -0.08 0.04 0.00 -1.01 0.00 0.00 66.70 65.65 1bpw h VAL 196 Cb 0.99 0.00 -0.01 0.00 -2.01 0.00 0.00 31.29 30.26 1bpw h VAL 196 CO 0.00 0.00 0.22 0.71 -1.01 0.00 0.00 177.57 177.50 1bpw h THR 197 N -0.46 0.27 0.71 3.17 1.35 -1.93 -3.02 112.91 112.99 1bpw h THR 197 Ca -0.04 0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.79 1bpw h THR 197 Cb 0.29 0.81 -0.00 0.00 -1.73 0.00 0.00 68.15 67.52 1bpw h THR 197 CO 0.06 0.00 -0.41 1.23 -0.25 0.00 0.00 175.52 176.16 1bpw h GLY 198 N 0.00 -1.13 0.29 5.82 0.00 -1.82 -2.31 103.07 103.93 1bpw h GLY 198 Ca 0.06 0.45 0.25 0.00 0.00 0.00 0.00 47.33 48.09 1bpw h GLY 198 CO -0.00 -0.40 0.62 -0.24 0.00 0.00 0.00 176.54 176.52 1bpw h VAL 199 N -1.04 0.57 0.10 4.60 3.04 -1.68 -0.95 116.25 120.89 1bpw h VAL 199 Ca -0.09 0.00 0.02 0.00 -1.01 0.00 0.00 66.70 65.62 1bpw h VAL 199 Cb 0.83 0.57 -0.03 0.00 -2.01 0.00 0.00 31.29 30.65 1bpw h VAL 199 CO 0.11 0.00 -0.22 0.40 -1.01 0.00 0.00 177.57 176.85 1bpw h ILE 200 N 0.00 0.51 -0.42 3.17 1.08 -1.52 -0.05 117.51 120.28 1bpw h ILE 200 Ca 0.40 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.96 1bpw h ILE 200 Cb 1.63 0.51 -0.09 0.00 -3.07 0.00 0.00 36.82 35.81 1bpw h ILE 200 CO -0.00 0.00 -0.16 0.25 -0.69 0.00 0.00 178.15 177.54 1bpw h LEU 201 N -0.40 -0.57 -0.22 1.44 5.85 -1.13 -0.04 115.31 120.24 1bpw h LEU 201 Ca 0.03 0.15 0.06 0.00 0.84 0.00 0.00 57.88 58.96 1bpw h LEU 201 Cb 0.42 0.33 -0.07 0.00 0.37 0.00 0.00 40.66 41.71 1bpw h LEU 201 CO -0.13 -0.20 -0.33 0.00 -0.34 0.00 0.00 178.44 177.44 1bpw h ALA 202 N 1.27 -0.34 -0.60 1.25 0.00 -1.15 0.26 119.26 119.96 1bpw h ALA 202 Ca 0.21 0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.24 1bpw h ALA 202 Cb 0.39 0.66 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 1bpw h ALA 202 CO -0.48 -0.79 0.26 0.93 0.00 0.00 0.00 179.25 179.18 1bpw h GLU 203 N -0.36 0.47 -0.65 0.00 5.08 -0.21 -2.23 114.58 116.68 1bpw h GLU 203 Ca 0.12 -0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.53 1bpw h GLU 203 Cb 0.55 -0.11 -0.07 0.00 0.50 0.00 0.00 28.75 29.63 1bpw h GLU 203 CO -0.42 0.31 0.31 0.82 -1.00 0.00 0.00 179.01 179.03 1bpw h ILE 204 N 0.48 0.86 -0.66 3.13 2.04 0.89 0.14 117.51 124.39 1bpw h ILE 204 Ca 0.29 -0.19 0.04 0.00 1.00 0.00 0.00 64.86 66.00 1bpw h ILE 204 Cb 0.29 0.26 -0.05 0.00 -0.74 0.00 0.00 36.82 36.59 1bpw h ILE 204 CO -0.25 0.10 0.39 -0.26 0.00 0.00 0.00 178.15 178.14 1bpw h PHE 205 N 0.55 0.73 -0.24 1.37 0.04 -0.66 0.49 116.94 119.22 1bpw h PHE 205 Ca 0.31 0.02 0.01 0.00 2.80 0.00 0.00 57.97 61.11 1bpw h PHE 205 Cb 0.31 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.21 1bpw h PHE 205 CO -0.12 0.40 0.14 0.45 -0.60 0.00 0.00 178.31 178.58 1bpw h HIS 206 N 0.76 0.27 -0.38 -0.55 3.86 -0.79 -1.52 115.15 116.80 1bpw h HIS 206 Ca 0.28 0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.51 1bpw h HIS 206 Cb 0.08 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 28.44 1bpw h HIS 206 CO -0.06 0.16 0.25 1.49 0.86 0.00 0.00 177.93 180.63 1bpw h GLU 207 N 0.29 0.43 -0.05 2.45 4.81 0.36 -0.81 114.58 122.07 1bpw h GLU 207 Ca 0.09 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.23 1bpw h GLU 207 Cb -0.01 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 1bpw h GLU 207 CO -0.04 0.29 -0.28 0.00 -0.73 0.00 0.00 179.01 178.25 1bpw h ALA 208 N 1.78 1.44 0.00 2.92 0.00 0.95 -3.46 119.26 122.89 1bpw h ALA 208 Ca 0.15 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1bpw h ALA 208 Cb 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1bpw h ALA 208 CO -0.03 0.41 0.00 0.41 0.00 0.00 0.00 179.25 180.03 1bpw n GLY 209 N -0.64 1.33 3.78 0.00 0.00 -0.31 -4.83 105.19 104.51 1bpw n GLY 209 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 1bpw n GLY 209 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bpw s VAL 210 N -1.33 3.79 0.26 1.61 1.01 -0.99 -4.96 120.40 119.80 1bpw s VAL 210 Ca 0.00 1.39 -0.31 0.00 0.00 0.00 0.00 61.98 63.07 1bpw s VAL 210 Cb 0.00 -3.73 -0.12 0.00 0.00 0.00 0.00 36.38 32.53 1bpw s VAL 210 CO 0.00 0.03 1.54 -2.65 0.00 0.00 0.00 175.10 174.02 1bpw n PRO 211 N 0.05 2.45 -1.69 2.72 -0.02 -1.26 -4.74 135.00 132.50 1bpw n PRO 211 Ca 0.04 0.87 -0.55 0.00 -2.02 0.00 0.00 63.50 61.85 1bpw n PRO 211 Cb 0.50 -2.62 -0.06 0.00 -0.02 0.00 0.00 33.50 31.30 1bpw n PRO 211 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1bpw n VAL 212 N 2.30 0.32 0.00 -1.45 0.31 -1.26 -1.45 118.33 117.10 1bpw n VAL 212 Ca 0.11 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 1bpw n VAL 212 Cb 0.34 -1.33 0.00 0.00 -0.91 0.00 0.00 33.84 31.94 1bpw n VAL 212 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1bpw n GLY 213 N 4.03 0.15 0.35 2.92 0.00 -1.26 -4.35 105.19 107.02 1bpw n GLY 213 Ca 0.24 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.28 1bpw n GLY 213 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1bpw h LEU 214 N 0.00 0.82 -7.97 0.99 5.85 -1.51 -3.18 115.31 110.32 1bpw h LEU 214 Ca 0.00 -0.02 -0.66 0.00 0.84 0.00 0.00 57.88 58.04 1bpw h LEU 214 Cb 0.00 -0.20 -0.36 0.00 0.37 0.00 0.00 40.66 40.47 1bpw h LEU 214 CO 0.00 0.59 -0.83 -0.69 -0.34 0.00 0.00 178.44 177.17 1bpw s VAL 215 N -5.82 2.06 0.34 1.05 1.01 -1.26 -0.11 120.40 117.67 1bpw s VAL 215 Ca -0.11 -1.19 0.09 0.00 0.00 0.00 0.00 61.98 60.78 1bpw s VAL 215 Cb 0.18 -1.99 -0.06 0.00 0.00 0.00 0.00 36.38 34.51 1bpw s VAL 215 CO 0.78 0.30 -0.04 0.20 0.00 0.00 0.00 175.10 176.34 1bpw s ASN 216 N 1.23 3.97 -0.05 3.32 0.01 -0.01 -4.86 114.94 118.55 1bpw s ASN 216 Ca -0.01 -1.09 -0.02 0.00 -0.71 0.00 0.00 52.86 51.04 1bpw s ASN 216 Cb -0.16 -0.45 0.04 0.00 0.41 0.00 0.00 41.25 41.09 1bpw s ASN 216 CO -0.10 -0.22 0.10 -0.69 -1.51 0.00 0.00 177.10 174.69 1bpw s VAL 217 N -2.56 -0.08 -0.06 1.60 1.01 0.18 -2.11 120.40 118.39 1bpw s VAL 217 Ca 0.34 0.23 0.05 0.00 0.00 0.00 0.00 61.98 62.59 1bpw s VAL 217 Cb 0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 36.38 36.20 1bpw s VAL 217 CO 0.18 0.09 -0.20 0.68 0.00 0.00 0.00 175.10 175.86 1bpw s VAL 218 N 1.32 1.65 0.48 2.92 -7.23 -0.71 -0.94 120.40 117.88 1bpw s VAL 218 Ca -0.07 -0.83 0.00 0.00 -1.81 0.00 0.00 61.98 59.27 1bpw s VAL 218 Cb -0.12 -1.42 0.00 0.00 0.56 0.00 0.00 36.38 35.40 1bpw s VAL 218 CO -0.05 0.47 0.71 -1.10 -0.31 0.00 0.00 175.10 174.82 1bpw s GLN 219 N 0.09 2.96 0.00 4.82 -1.52 -1.26 -4.02 119.66 120.73 1bpw s GLN 219 Ca -0.07 -0.50 0.00 0.00 -1.95 0.00 0.00 55.36 52.84 1bpw s GLN 219 Cb -0.13 -2.52 0.00 0.00 -0.22 0.00 0.00 33.01 30.13 1bpw s GLN 219 CO 0.04 -0.38 0.00 0.41 -0.25 0.00 0.00 175.29 175.11 1bpw n GLY 220 N -2.16 0.82 0.00 3.09 0.00 -1.26 -1.39 105.19 104.29 1bpw n GLY 220 Ca 0.03 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.99 1bpw n GLY 220 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bpw n GLY 221 N -0.60 3.87 0.39 -0.02 0.00 -1.26 -4.00 105.19 103.58 1bpw n GLY 221 Ca 0.00 -0.63 -0.11 0.00 0.00 0.00 0.00 46.02 45.27 1bpw n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bpw h ALA 222 N 1.00 -0.64 -0.33 4.61 0.00 -2.01 0.23 119.26 122.12 1bpw h ALA 222 Ca 0.00 0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.02 1bpw h ALA 222 Cb 0.00 1.19 -0.08 0.00 0.00 0.00 0.00 17.79 18.90 1bpw h ALA 222 CO 0.00 -0.93 -0.35 0.93 0.00 0.00 0.00 179.25 178.90 1bpw h GLU 223 N -0.21 -0.30 0.63 0.00 4.39 -1.96 -0.64 114.58 116.51 1bpw h GLU 223 Ca 0.10 0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.79 1bpw h GLU 223 Cb 0.47 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 1bpw h GLU 223 CO -0.67 -0.20 -0.49 1.15 -1.16 0.00 0.00 179.01 177.65 1bpw h THR 224 N -0.31 0.00 -1.19 1.13 2.02 -1.56 -1.85 112.91 111.16 1bpw h THR 224 Ca 0.15 0.00 0.35 0.00 0.77 0.00 0.00 66.41 67.67 1bpw h THR 224 Cb 0.55 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.87 1bpw h THR 224 CO -0.50 0.00 0.79 1.23 0.37 0.00 0.00 175.52 177.41 1bpw h GLY 225 N -1.08 1.00 0.71 2.16 0.00 -0.22 0.19 103.07 105.83 1bpw h GLY 225 Ca -0.08 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1bpw h GLY 225 CO 0.02 -0.20 -0.01 1.76 0.00 0.00 0.00 176.54 178.12 1bpw h SER 226 N 0.21 0.11 -0.97 0.19 0.02 -0.43 -2.65 113.55 110.05 1bpw h SER 226 Ca 0.68 -0.34 0.21 0.00 -0.84 0.00 0.00 61.79 61.50 1bpw h SER 226 Cb 2.07 -0.03 -0.11 0.00 0.14 0.00 0.00 62.40 64.46 1bpw h SER 226 CO -0.28 0.43 0.55 -0.07 -1.14 0.00 0.00 176.83 176.32 1bpw h LEU 227 N -0.20 0.64 -0.49 5.07 3.38 0.15 0.42 115.31 124.27 1bpw h LEU 227 Ca 0.02 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1bpw h LEU 227 Cb 0.37 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1bpw h LEU 227 CO 0.00 0.16 0.31 -0.07 0.09 0.00 0.00 178.44 178.93 1bpw h LEU 228 N 0.62 0.59 -1.30 1.67 3.38 -1.10 0.14 115.31 119.31 1bpw h LEU 228 Ca 0.59 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.44 1bpw h LEU 228 Cb 1.01 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 1bpw h LEU 228 CO -0.44 0.46 -0.32 0.00 0.09 0.00 0.00 178.44 178.23 1bpw n HIS 230 N -3.80 0.91 -1.66 0.00 8.25 -0.46 -4.41 115.22 114.05 1bpw n HIS 230 Ca -0.01 0.31 -0.50 0.00 -0.26 0.00 0.00 57.72 57.26 1bpw n HIS 230 Cb 0.40 -1.10 -0.05 0.00 1.12 0.00 0.00 29.99 30.36 1bpw n HIS 230 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1bpw n HIS 231 N -2.91 2.08 0.42 4.41 -0.00 0.45 -4.83 115.22 114.84 1bpw n HIS 231 Ca -0.13 0.32 0.05 0.00 -0.00 0.00 0.00 57.72 57.96 1bpw n HIS 231 Cb 0.92 -2.52 0.24 0.00 -0.00 0.00 0.00 29.99 28.63 1bpw n HIS 231 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 1bpw n PRO 232 N 4.57 0.07 -0.19 1.57 -0.04 -1.26 -2.76 135.00 136.96 1bpw n PRO 232 Ca 0.21 0.26 0.07 0.00 -0.04 0.00 0.00 63.50 63.99 1bpw n PRO 232 Cb 0.24 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.37 1bpw n PRO 232 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1bpw n ASN 233 N -1.39 3.02 -4.64 3.54 5.03 -1.26 -4.87 115.26 114.68 1bpw n ASN 233 Ca 0.04 -1.97 -0.37 0.00 0.87 0.00 0.00 54.58 53.14 1bpw n ASN 233 Cb 0.10 -0.25 -0.09 0.00 -1.02 0.00 0.00 39.78 38.51 1bpw n ASN 233 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1bpw s VAL 234 N -1.01 5.29 -0.08 2.41 1.01 -1.11 -4.27 120.40 122.65 1bpw s VAL 234 Ca 0.26 0.33 0.15 0.00 0.00 0.00 0.00 61.98 62.71 1bpw s VAL 234 Cb 0.14 -3.57 -0.16 0.00 0.00 0.00 0.00 36.38 32.78 1bpw s VAL 234 CO 0.18 0.28 0.83 0.00 0.00 0.00 0.00 175.10 176.39 1bpw h ALA 235 N 7.78 0.68 -3.22 5.51 0.00 -1.04 -3.48 119.26 125.50 1bpw h ALA 235 Ca -0.36 -1.06 -0.19 0.00 0.00 0.00 0.00 54.91 53.31 1bpw h ALA 235 Cb 1.17 0.31 -0.24 0.00 0.00 0.00 0.00 17.79 19.04 1bpw h ALA 235 CO 0.64 1.17 -0.64 0.21 0.00 0.00 0.00 179.25 180.63 1bpw s LYS 236 N -2.79 0.23 -0.10 0.00 2.20 -1.20 -2.09 119.74 115.98 1bpw s LYS 236 Ca -0.03 -0.26 0.04 0.00 -0.36 0.00 0.00 55.97 55.36 1bpw s LYS 236 Cb 0.08 0.09 -0.00 0.00 -1.51 0.00 0.00 37.83 36.49 1bpw s LYS 236 CO 0.81 -0.04 -0.23 0.08 -0.36 0.00 0.00 175.35 175.61 1bpw s VAL 237 N -0.76 2.19 -0.31 4.02 1.01 -0.37 -0.24 120.40 125.93 1bpw s VAL 237 Ca -0.08 -0.98 0.03 0.00 0.00 0.00 0.00 61.98 60.95 1bpw s VAL 237 Cb -0.05 -1.84 0.08 0.00 0.00 0.00 0.00 36.38 34.57 1bpw s VAL 237 CO -0.00 0.56 -0.01 -0.55 0.00 0.00 0.00 175.10 175.10 1bpw s SER 238 N 0.31 4.58 -0.07 3.32 0.15 0.08 -2.52 113.70 119.56 1bpw s SER 238 Ca -0.17 -1.83 -0.03 0.00 0.70 0.00 0.00 55.95 54.62 1bpw s SER 238 Cb -0.18 -1.55 -0.04 0.00 -1.71 0.00 0.00 66.02 62.55 1bpw s SER 238 CO 0.08 -0.31 0.07 0.12 1.20 0.00 0.00 173.24 174.40 1bpw s PHE 239 N 1.02 3.32 -0.06 3.44 5.36 -0.60 -1.48 117.98 128.98 1bpw s PHE 239 Ca 0.03 0.29 -0.02 0.00 -0.96 0.00 0.00 56.93 56.28 1bpw s PHE 239 Cb -0.19 -1.81 0.03 0.00 -0.34 0.00 0.00 43.02 40.70 1bpw s PHE 239 CO -0.08 0.57 0.02 0.99 -1.46 0.00 0.00 175.22 175.27 1bpw s THR 240 N -1.03 0.21 -2.46 0.12 2.01 -0.99 -1.48 115.64 112.02 1bpw s THR 240 Ca 0.17 0.22 0.00 0.00 0.31 0.00 0.00 61.69 62.40 1bpw s THR 240 Cb -0.12 -0.40 0.00 0.00 0.01 0.00 0.00 72.50 71.99 1bpw s THR 240 CO 0.07 0.23 0.00 0.61 -0.69 0.00 0.00 174.62 174.84 1bpw n GLY 241 N 5.20 -0.57 3.76 4.40 0.00 -1.16 -4.04 105.19 112.77 1bpw n GLY 241 Ca -0.06 -0.73 -0.32 0.00 0.00 0.00 0.00 46.02 44.91 1bpw n GLY 241 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bpw s SER 242 N -4.00 4.65 0.07 1.61 1.04 -1.26 -3.09 113.70 112.72 1bpw s SER 242 Ca 0.00 1.92 -0.25 0.00 0.48 0.00 0.00 55.95 58.11 1bpw s SER 242 Cb 0.00 -2.54 -0.16 0.00 0.10 0.00 0.00 66.02 63.42 1bpw s SER 242 CO 0.00 -1.94 1.66 0.58 0.98 0.00 0.00 173.24 174.53 1bpw h VAL 243 N -0.70 0.95 -0.77 5.02 2.07 -1.93 -0.62 116.25 120.28 1bpw h VAL 243 Ca -0.45 -0.13 0.18 0.00 0.82 0.00 0.00 66.70 67.12 1bpw h VAL 243 Cb 1.24 1.03 -0.12 0.00 -1.52 0.00 0.00 31.29 31.92 1bpw h VAL 243 CO 0.52 0.03 0.12 -0.65 0.02 0.00 0.00 177.57 177.61 1bpw h PRO 244 N -0.18 0.18 -0.07 1.57 0.11 -1.97 -0.34 132.00 131.31 1bpw h PRO 244 Ca -0.01 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.03 1bpw h PRO 244 Cb 0.15 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.22 1bpw h PRO 244 CO 0.02 0.12 -0.19 1.15 -0.21 0.00 0.00 178.00 178.89 1bpw h THR 245 N 0.19 1.43 -0.92 -1.15 2.02 -1.91 -2.92 112.91 109.64 1bpw h THR 245 Ca 0.44 -1.55 0.27 0.00 0.77 0.00 0.00 66.41 66.33 1bpw h THR 245 Cb 0.79 2.27 -0.15 0.00 -1.74 0.00 0.00 68.15 69.32 1bpw h THR 245 CO -0.60 0.44 0.34 1.23 0.37 0.00 0.00 175.52 177.30 1bpw h GLY 246 N -0.25 1.60 1.00 2.16 0.00 0.04 0.57 103.07 108.19 1bpw h GLY 246 Ca -0.00 -0.10 -0.00 0.00 0.00 0.00 0.00 47.33 47.23 1bpw h GLY 246 CO 0.04 -0.41 0.36 0.50 0.00 0.00 0.00 176.54 177.02 1bpw h LYS 247 N 0.24 0.79 -0.25 4.80 1.57 -0.99 -1.31 116.57 121.42 1bpw h LYS 247 Ca 0.62 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 59.28 1bpw h LYS 247 Cb 1.31 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 1bpw h LYS 247 CO -0.65 0.56 -0.02 0.87 -0.57 0.00 0.00 179.45 179.64 1bpw h LYS 248 N 0.79 0.46 -0.69 3.15 1.57 0.18 -2.79 116.57 119.24 1bpw h LYS 248 Ca 0.21 -0.16 0.10 0.00 -1.87 0.00 0.00 60.65 58.93 1bpw h LYS 248 Cb -0.03 -0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.17 1bpw h LYS 248 CO -0.04 0.65 0.32 0.28 -0.57 0.00 0.00 179.45 180.09 1bpw h VAL 249 N 0.22 0.82 -0.43 0.50 2.07 -0.56 -0.96 116.25 117.91 1bpw h VAL 249 Ca 0.07 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.36 1bpw h VAL 249 Cb 0.46 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1bpw h VAL 249 CO 0.02 0.10 0.10 -0.03 0.02 0.00 0.00 177.57 177.78 1bpw h MET 250 N 0.55 0.64 -0.30 1.57 1.85 -1.14 -1.53 114.93 116.57 1bpw h MET 250 Ca 0.34 -0.11 -0.07 0.00 -0.61 0.00 0.00 59.70 59.26 1bpw h MET 250 Cb 0.39 -0.11 -0.01 0.00 0.43 0.00 0.00 31.60 32.31 1bpw h MET 250 CO -0.29 0.59 -0.07 0.93 -0.40 0.00 0.00 176.91 177.67 1bpw h GLU 251 N 0.63 0.57 -0.46 0.39 5.08 -0.93 -2.68 114.58 117.19 1bpw h GLU 251 Ca 0.14 -0.22 -0.11 0.00 -1.00 0.00 0.00 59.36 58.18 1bpw h GLU 251 Cb 0.24 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1bpw h GLU 251 CO -0.00 0.77 -0.14 0.52 -1.00 0.00 0.00 179.01 179.15 1bpw h MET 252 N 0.34 0.86 0.00 2.33 2.86 -1.21 -2.61 114.93 117.51 1bpw h MET 252 Ca 0.08 -0.31 -0.01 0.00 -2.06 0.00 0.00 59.70 57.39 1bpw h MET 252 Cb 0.55 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.15 1bpw h MET 252 CO 0.03 0.95 -0.04 0.77 1.06 0.00 0.00 176.91 179.67 1bpw h SER 253 N 0.77 0.00 -0.18 1.22 0.02 -1.13 -2.43 113.55 111.82 1bpw h SER 253 Ca 0.12 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.00 1bpw h SER 253 Cb 0.66 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.18 1bpw h SER 253 CO 0.05 0.04 -0.10 0.00 -1.14 0.00 0.00 176.83 175.68 1bpw h ALA 254 N 1.96 1.24 0.00 3.77 0.00 -1.12 -1.79 119.26 123.32 1bpw h ALA 254 Ca -0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1bpw h ALA 254 Cb 0.11 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1bpw h ALA 254 CO 0.01 0.50 0.11 0.87 0.00 0.00 0.00 179.25 180.73 1bpw h LYS 255 N 0.50 0.00 0.00 0.00 1.57 -1.53 -1.09 116.57 116.02 1bpw h LYS 255 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1bpw h LYS 255 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1bpw h LYS 255 CO 0.03 0.00 0.00 2.41 -0.57 0.00 0.00 179.45 181.32 1bpw n THR 256 N -2.32 0.00 -2.44 -0.16 -1.04 -1.10 -5.00 114.28 102.21 1bpw n THR 256 Ca -0.01 -0.37 -0.10 0.00 -2.04 0.00 0.00 64.05 61.53 1bpw n THR 256 Cb 0.14 1.15 0.01 0.00 -1.82 0.00 0.00 70.33 69.81 1bpw n THR 256 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1bpw n VAL 257 N -0.31 -0.74 -2.13 12.58 0.31 -0.41 -4.99 118.33 122.63 1bpw n VAL 257 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 63.97 1bpw n VAL 257 Cb 0.04 -1.96 0.01 0.00 -0.91 0.00 0.00 33.84 31.02 1bpw n VAL 257 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1bpw s LYS 258 N -4.84 3.32 0.30 5.55 1.02 -0.72 -5.00 119.74 119.38 1bpw s LYS 258 Ca 0.09 1.80 -0.29 0.00 0.02 0.00 0.00 55.97 57.59 1bpw s LYS 258 Cb -0.04 -2.12 -0.10 0.00 -0.52 0.00 0.00 37.83 35.05 1bpw s LYS 258 CO 0.11 -0.92 1.11 -1.01 -0.92 0.00 0.00 175.35 173.72 1bpw s HIS 259 N -1.59 3.49 0.03 3.18 3.76 -0.89 -4.84 115.29 118.43 1bpw s HIS 259 Ca 0.72 1.67 0.02 0.00 -0.15 0.00 0.00 55.06 57.31 1bpw s HIS 259 Cb -0.29 -3.31 -0.02 0.00 1.11 0.00 0.00 32.58 30.07 1bpw s HIS 259 CO 0.33 -0.69 -0.06 0.08 -0.85 0.00 0.00 174.74 173.55 1bpw s VAL 260 N -1.21 0.40 -0.05 -0.90 1.01 -1.26 -1.24 120.40 117.15 1bpw s VAL 260 Ca 0.46 -1.01 -0.03 0.00 0.00 0.00 0.00 61.98 61.40 1bpw s VAL 260 Cb -0.32 -0.50 0.03 0.00 0.00 0.00 0.00 36.38 35.59 1bpw s VAL 260 CO 0.41 -0.41 0.13 0.42 0.00 0.00 0.00 175.10 175.65 1bpw s THR 261 N -1.38 -0.03 -0.11 3.92 -4.23 -1.05 -4.92 115.64 107.84 1bpw s THR 261 Ca -0.12 0.10 0.01 0.00 -1.18 0.00 0.00 61.69 60.50 1bpw s THR 261 Cb -0.10 -0.20 0.02 0.00 1.34 0.00 0.00 72.50 73.56 1bpw s THR 261 CO -0.00 0.04 -0.11 -0.76 -0.54 0.00 0.00 174.62 173.25 1bpw s LEU 262 N 0.68 1.47 -0.91 4.79 1.43 -0.71 -1.56 118.68 123.87 1bpw s LEU 262 Ca -0.05 -0.36 -0.03 0.00 -1.03 0.00 0.00 54.13 52.66 1bpw s LEU 262 Cb -0.07 -0.95 0.23 0.00 0.03 0.00 0.00 46.19 45.43 1bpw s LEU 262 CO -0.03 -0.05 0.81 -1.61 0.23 0.00 0.00 176.35 175.70 1bpw s GLU 263 N 1.32 3.36 0.00 1.70 0.41 -0.55 -0.78 118.70 124.17 1bpw s GLU 263 Ca -0.01 -3.26 0.00 0.00 -0.41 0.00 0.00 54.97 51.29 1bpw s GLU 263 Cb -0.14 -4.02 0.00 0.00 -1.78 0.00 0.00 34.13 28.20 1bpw s GLU 263 CO -0.05 -1.26 0.00 1.28 -0.49 0.00 0.00 175.26 174.74 1bpw n LEU 264 N 2.39 0.00 0.00 1.80 4.32 -0.08 -3.01 117.00 122.42 1bpw n LEU 264 Ca 0.21 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.20 1bpw n LEU 264 Cb 0.37 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.17 1bpw n LEU 264 CO 0.37 -0.23 0.00 0.61 -1.22 0.00 0.00 177.39 176.92 1bpw n GLY 265 N 4.16 0.82 0.00 -0.72 0.00 -1.18 -4.78 105.19 103.49 1bpw n GLY 265 Ca 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.37 1bpw n GLY 265 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bpw n GLY 266 N 5.00 0.64 2.30 -0.02 0.00 -1.26 -4.59 105.19 107.26 1bpw n GLY 266 Ca 0.00 -0.73 -0.22 0.00 0.00 0.00 0.00 46.02 45.07 1bpw n GLY 266 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1bpw n LYS 267 N -0.06 1.29 -2.31 1.61 3.00 -1.26 -4.71 118.16 115.71 1bpw n LYS 267 Ca 0.00 -3.62 -0.41 0.00 -0.00 0.00 0.00 58.31 54.29 1bpw n LYS 267 Cb 0.00 -1.65 -0.03 0.00 0.00 0.00 0.00 35.03 33.35 1bpw n LYS 267 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1bpw s SER 268 N -2.13 7.04 0.01 3.14 0.01 -1.25 -4.82 113.70 115.70 1bpw s SER 268 Ca 0.39 2.44 -0.18 0.00 1.31 0.00 0.00 55.95 59.91 1bpw s SER 268 Cb 0.26 -2.63 -0.06 0.00 0.21 0.00 0.00 66.02 63.80 1bpw s SER 268 CO -0.09 -0.33 0.50 -2.16 0.41 0.00 0.00 173.24 171.56 1bpw s PRO 269 N -1.40 4.13 -0.20 12.44 0.04 -1.26 -2.72 135.00 146.04 1bpw s PRO 269 Ca 0.48 0.58 -0.03 0.00 0.04 0.00 0.00 61.00 62.06 1bpw s PRO 269 Cb -0.35 -3.27 -0.01 0.00 0.04 0.00 0.00 34.50 30.91 1bpw s PRO 269 CO 0.45 0.57 -0.07 -1.17 0.04 0.00 0.00 177.00 176.81 1bpw s LEU 270 N -0.76 2.82 -0.22 -3.56 2.96 -0.69 -1.21 118.68 118.01 1bpw s LEU 270 Ca 0.27 -0.39 -0.07 0.00 -0.22 0.00 0.00 54.13 53.73 1bpw s LEU 270 Cb -0.18 -1.69 -0.03 0.00 0.50 0.00 0.00 46.19 44.79 1bpw s LEU 270 CO 0.15 0.03 0.05 -0.76 -1.32 0.00 0.00 176.35 174.50 1bpw s LEU 271 N 1.18 3.47 -0.28 -0.68 1.43 0.34 0.09 118.68 124.23 1bpw s LEU 271 Ca 0.02 -0.14 -0.02 0.00 -1.03 0.00 0.00 54.13 52.96 1bpw s LEU 271 Cb -0.14 -1.90 0.04 0.00 0.03 0.00 0.00 46.19 44.21 1bpw s LEU 271 CO -0.02 0.04 -0.02 -0.63 0.23 0.00 0.00 176.35 175.95 1bpw s ILE 272 N 1.17 3.01 0.20 -0.59 -1.09 0.11 0.45 121.20 124.45 1bpw s ILE 272 Ca 0.04 -1.21 -0.04 0.00 -2.23 0.00 0.00 60.65 57.21 1bpw s ILE 272 Cb -0.14 -2.65 -0.05 0.00 -1.58 0.00 0.00 42.46 38.04 1bpw s ILE 272 CO 0.03 0.01 0.44 -0.36 -1.23 0.00 0.00 174.94 173.83 1bpw s PHE 273 N 1.29 3.47 0.34 3.97 0.40 -0.36 -1.00 117.98 126.09 1bpw s PHE 273 Ca -0.03 0.55 0.33 0.00 -0.60 0.00 0.00 56.93 57.18 1bpw s PHE 273 Cb -0.18 -2.01 1.81 0.00 0.51 0.00 0.00 43.02 43.15 1bpw s PHE 273 CO -0.02 0.34 2.01 1.57 0.70 0.00 0.00 175.22 179.83 1bpw h LYS 274 N 2.31 0.00 -0.48 0.44 2.10 -1.88 -1.44 116.57 117.63 1bpw h LYS 274 Ca -0.47 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 1bpw h LYS 274 Cb 1.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 1bpw h LYS 274 CO 0.70 0.00 0.00 -0.40 -2.00 0.00 0.00 179.45 177.75 1bpw n ASP 275 N -2.72 2.55 -2.66 7.07 5.75 -1.26 -4.93 116.55 120.36 1bpw n ASP 275 Ca -0.02 -2.02 0.00 0.00 -0.01 0.00 0.00 54.79 52.74 1bpw n ASP 275 Cb 0.12 -0.32 0.00 0.00 -1.03 0.00 0.00 41.12 39.88 1bpw n ASP 275 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1bpw s GLU 277 N -1.86 1.76 0.11 0.00 2.02 -1.26 -4.96 118.70 114.51 1bpw s GLU 277 Ca 0.00 -2.28 -0.09 0.00 0.02 0.00 0.00 54.97 52.63 1bpw s GLU 277 Cb 0.00 -3.28 0.11 0.00 0.10 0.00 0.00 34.13 31.06 1bpw s GLU 277 CO 0.00 -1.03 0.74 1.28 0.02 0.00 0.00 175.26 176.27 1bpw n LEU 278 N 3.65 -0.32 0.07 1.80 4.77 -1.26 -1.29 117.00 124.42 1bpw n LEU 278 Ca 0.04 0.84 -0.12 0.00 -0.03 0.00 0.00 56.01 56.74 1bpw n LEU 278 Cb 0.37 -0.19 -0.06 0.00 -2.33 0.00 0.00 43.42 41.21 1bpw n LEU 278 CO 0.29 -0.75 0.64 -0.08 -1.33 0.00 0.00 177.39 176.16 1bpw h GLU 279 N 0.00 -0.48 -0.95 3.23 4.57 -1.99 1.00 114.58 119.96 1bpw h GLU 279 Ca 0.16 0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.40 1bpw h GLU 279 Cb 0.28 0.11 -0.05 0.00 -0.16 0.00 0.00 28.75 28.93 1bpw h GLU 279 CO -0.47 -0.32 0.63 -0.91 -1.18 0.00 0.00 179.01 176.75 1bpw h ASN 280 N -0.50 1.07 -0.74 1.04 2.35 -1.63 0.14 115.58 117.30 1bpw h ASN 280 Ca 0.05 -0.02 -0.06 0.00 -0.55 0.00 0.00 56.30 55.72 1bpw h ASN 280 Cb 0.58 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.66 1bpw h ASN 280 CO -0.25 0.76 0.22 0.00 -1.65 0.00 0.00 177.43 176.50 1bpw h ALA 281 N 1.42 0.99 -0.28 -0.83 0.00 -0.36 0.38 119.26 120.58 1bpw h ALA 281 Ca 0.36 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1bpw h ALA 281 Cb -0.09 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 1bpw h ALA 281 CO -0.09 0.67 0.11 0.28 0.00 0.00 0.00 179.25 180.21 1bpw h VAL 282 N 1.11 1.18 -0.44 0.00 2.07 0.20 -1.61 116.25 118.75 1bpw h VAL 282 Ca 0.24 -0.57 0.04 0.00 0.82 0.00 0.00 66.70 67.23 1bpw h VAL 282 Cb 0.32 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 31.08 1bpw h VAL 282 CO -0.01 0.19 0.20 0.03 0.02 0.00 0.00 177.57 178.01 1bpw h ARG 283 N 0.31 0.39 0.22 1.57 3.08 -0.66 -0.26 114.38 119.02 1bpw h ARG 283 Ca 0.09 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 1bpw h ARG 283 Cb 0.20 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.14 1bpw h ARG 283 CO -0.01 0.26 -0.37 0.78 -1.07 0.00 0.00 179.97 179.56 1bpw h GLY 284 N 0.41 -1.15 -0.24 0.04 0.00 -0.68 0.95 103.07 102.40 1bpw h GLY 284 Ca 0.20 0.57 0.26 0.00 0.00 0.00 0.00 47.33 48.35 1bpw h GLY 284 CO -0.16 -0.33 0.55 0.00 0.00 0.00 0.00 176.54 176.60 1bpw h ALA 285 N -0.98 1.76 0.63 3.60 0.00 -1.04 0.98 119.26 124.21 1bpw h ALA 285 Ca -0.02 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1bpw h ALA 285 Cb 0.59 0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.45 1bpw h ALA 285 CO -0.13 -0.34 -0.30 1.25 0.00 0.00 0.00 179.25 179.72 1bpw h LEU 286 N 0.49 -0.71 -2.04 0.00 5.85 -0.20 -2.86 115.31 115.84 1bpw h LEU 286 Ca 0.65 0.02 0.04 0.00 0.84 0.00 0.00 57.88 59.44 1bpw h LEU 286 Cb 1.29 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.50 1bpw h LEU 286 CO -0.51 -0.36 0.11 0.24 -0.34 0.00 0.00 178.44 177.57 1bpw h MET 287 N -1.14 0.00 -0.00 1.25 2.86 0.22 -0.45 114.93 117.67 1bpw h MET 287 Ca -0.09 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1bpw h MET 287 Cb 0.65 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.31 1bpw h MET 287 CO 0.14 0.00 -0.00 0.00 1.06 0.00 0.00 176.91 178.11 1bpw n ALA 288 N -2.54 2.65 0.00 6.32 0.00 0.33 -4.26 120.51 123.01 1bpw n ALA 288 Ca 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1bpw n ALA 288 Cb 0.24 -1.51 0.00 0.00 0.00 0.00 0.00 19.45 18.18 1bpw n ALA 288 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1bpw n ASN 289 N -1.04 2.27 -0.28 0.00 3.02 -0.25 -1.13 115.26 117.86 1bpw n ASN 289 Ca 0.22 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.85 1bpw n ASN 289 Cb 0.14 0.33 0.13 0.00 -0.61 0.00 0.00 39.78 39.78 1bpw n ASN 289 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1bpw n PHE 290 N -0.95 0.00 -2.81 3.10 3.72 -0.78 -4.13 117.46 115.60 1bpw n PHE 290 Ca 0.00 -0.97 -0.35 0.00 -0.05 0.00 0.00 57.45 56.09 1bpw n PHE 290 Cb 0.12 -0.16 -0.07 0.00 -0.94 0.00 0.00 39.48 38.43 1bpw n PHE 290 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1bpw s LEU 291 N -2.51 4.10 -1.27 4.37 1.43 -1.26 -3.97 118.68 119.57 1bpw s LEU 291 Ca 0.30 1.73 -0.23 0.00 -1.03 0.00 0.00 54.13 54.90 1bpw s LEU 291 Cb 0.27 -4.32 0.02 0.00 0.03 0.00 0.00 46.19 42.19 1bpw s LEU 291 CO -0.00 -0.24 0.58 0.41 0.23 0.00 0.00 176.35 177.33 1bpw n THR 292 N -0.17 -3.30 -1.86 5.49 -1.04 -1.26 0.45 114.28 112.59 1bpw n THR 292 Ca 0.05 -0.67 -0.13 0.00 -2.04 0.00 0.00 64.05 61.25 1bpw n THR 292 Cb 0.52 -2.66 -0.03 0.00 -1.82 0.00 0.00 70.33 66.34 1bpw n THR 292 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1bpw n GLN 293 N -4.71 -1.68 -1.25 -2.82 3.00 -1.25 -0.43 117.38 108.24 1bpw n GLN 293 Ca -0.16 0.73 -0.09 0.00 -0.01 0.00 0.00 57.00 57.48 1bpw n GLN 293 Cb 0.60 -5.14 -0.04 0.00 0.00 0.00 0.00 30.24 25.66 1bpw n GLN 293 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1bpw n GLY 294 N -0.51 1.00 2.42 1.08 0.00 0.17 -2.63 105.19 106.72 1bpw n GLY 294 Ca -0.15 -0.37 -0.32 0.00 0.00 0.00 0.00 46.02 45.19 1bpw n GLY 294 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1bpw n GLN 295 N -2.18 2.50 -4.15 1.61 6.02 0.43 -3.04 117.38 118.58 1bpw n GLN 295 Ca -0.09 -2.91 -0.34 0.00 -0.01 0.00 0.00 57.00 53.65 1bpw n GLN 295 Cb 0.35 -2.14 -0.14 0.00 1.02 0.00 0.00 30.24 29.34 1bpw n GLN 295 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1bpw s VAL 296 N -4.10 3.45 0.42 5.09 1.01 -1.26 -4.77 120.40 120.25 1bpw s VAL 296 Ca 0.55 -0.48 0.13 0.00 0.00 0.00 0.00 61.98 62.18 1bpw s VAL 296 Cb 0.43 -2.54 0.33 0.00 0.00 0.00 0.00 36.38 34.59 1bpw s VAL 296 CO -0.14 0.45 1.97 0.00 0.00 0.00 0.00 175.10 177.38 1bpw n THR 298 N -4.47 0.34 -2.00 0.00 -2.24 -1.26 -4.18 114.28 100.47 1bpw n THR 298 Ca 0.11 -0.35 -0.41 0.00 -2.27 0.00 0.00 64.05 61.13 1bpw n THR 298 Cb 0.38 0.18 -0.02 0.00 -2.10 0.00 0.00 70.33 68.77 1bpw n THR 298 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1bpw s ASN 299 N -1.05 6.64 -1.45 3.42 0.02 -1.01 -4.82 114.94 116.69 1bpw s ASN 299 Ca 0.19 2.65 -0.11 0.00 -1.02 0.00 0.00 52.86 54.57 1bpw s ASN 299 Cb 0.10 -2.62 0.04 0.00 0.02 0.00 0.00 41.25 38.79 1bpw s ASN 299 CO 0.13 -0.72 2.35 0.61 0.02 0.00 0.00 177.10 179.49 1bpw n GLY 300 N 2.47 4.54 0.00 0.66 0.00 -0.28 -3.88 105.19 108.70 1bpw n GLY 300 Ca 0.08 -1.72 0.07 0.00 0.00 0.00 0.00 46.02 44.45 1bpw n GLY 300 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1bpw n THR 301 N 4.00 0.32 -3.78 2.61 -2.24 -1.10 -4.02 114.28 110.07 1bpw n THR 301 Ca 0.57 0.08 -0.29 0.00 -2.27 0.00 0.00 64.05 62.15 1bpw n THR 301 Cb 0.33 -0.84 -0.12 0.00 -2.10 0.00 0.00 70.33 67.59 1bpw n THR 301 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1bpw s ARG 302 N -2.31 1.82 -0.33 -0.78 3.52 -1.16 -2.33 118.95 117.37 1bpw s ARG 302 Ca 0.18 -2.66 -0.23 0.00 -0.13 0.00 0.00 55.73 52.89 1bpw s ARG 302 Cb 0.10 -2.81 0.00 0.00 -1.56 0.00 0.00 34.95 30.69 1bpw s ARG 302 CO 0.20 -1.23 0.78 0.08 -0.81 0.00 0.00 175.30 174.32 1bpw s VAL 303 N -0.51 4.77 -0.31 7.11 1.01 -0.46 -1.71 120.40 130.30 1bpw s VAL 303 Ca 0.23 1.05 -0.12 0.00 0.00 0.00 0.00 61.98 63.14 1bpw s VAL 303 Cb -0.13 -4.17 -0.03 0.00 0.00 0.00 0.00 36.38 32.05 1bpw s VAL 303 CO -0.09 -0.32 0.21 -0.36 0.00 0.00 0.00 175.10 174.54 1bpw s PHE 304 N 3.01 3.22 -0.13 5.22 0.40 0.11 -1.11 117.98 128.70 1bpw s PHE 304 Ca 0.32 -0.10 -0.00 0.00 -0.60 0.00 0.00 56.93 56.55 1bpw s PHE 304 Cb -0.14 -2.42 -0.02 0.00 0.51 0.00 0.00 43.02 40.95 1bpw s PHE 304 CO 0.14 -0.28 -0.12 0.08 0.70 0.00 0.00 175.22 175.74 1bpw s VAL 305 N 1.73 3.17 0.05 -0.44 1.01 -0.47 0.04 120.40 125.50 1bpw s VAL 305 Ca 0.06 -0.62 -0.30 0.00 0.00 0.00 0.00 61.98 61.12 1bpw s VAL 305 Cb -0.17 -2.34 -0.08 0.00 0.00 0.00 0.00 36.38 33.79 1bpw s VAL 305 CO 0.10 0.53 1.73 -1.58 0.00 0.00 0.00 175.10 175.88 1bpw s GLN 306 N 0.27 4.17 0.16 2.72 0.74 -0.17 -2.35 119.66 125.21 1bpw s GLN 306 Ca -0.09 2.40 -0.04 0.00 0.05 0.00 0.00 55.36 57.69 1bpw s GLN 306 Cb -0.15 -3.75 0.29 0.00 1.10 0.00 0.00 33.01 30.50 1bpw s GLN 306 CO 0.05 -0.81 0.89 -2.13 -0.55 0.00 0.00 175.29 172.75 1bpw n ARG 307 N 6.17 -0.05 -0.33 1.67 0.63 -0.11 -1.61 116.66 123.03 1bpw n ARG 307 Ca 0.17 0.89 0.11 0.00 -0.92 0.00 0.00 57.85 58.10 1bpw n ARG 307 Cb 0.41 -1.34 0.29 0.00 0.45 0.00 0.00 32.46 32.26 1bpw n ARG 307 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1bpw h GLU 308 N 0.00 0.70 -0.02 -0.14 3.07 -1.90 -1.91 114.58 114.38 1bpw h GLU 308 Ca 0.29 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.10 1bpw h GLU 308 Cb 0.46 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 1bpw h GLU 308 CO -0.58 0.46 -0.17 0.44 -1.40 0.00 0.00 179.01 177.75 1bpw n ILE 309 N -4.80 0.00 -0.37 3.13 -5.35 -0.64 -4.61 119.36 106.72 1bpw n ILE 309 Ca 0.21 -0.34 0.02 0.00 -0.27 0.00 0.00 62.75 62.37 1bpw n ILE 309 Cb 0.52 1.10 0.08 0.00 -1.74 0.00 0.00 39.64 39.61 1bpw n ILE 309 CO 0.00 0.00 0.00 -0.03 -1.76 0.00 0.00 176.55 174.76 1bpw h MET 310 N 3.16 -0.00 0.00 6.28 4.05 -1.25 -1.41 114.93 125.76 1bpw h MET 310 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1bpw h MET 310 Cb 0.77 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.58 1bpw h MET 310 CO 0.00 -0.00 0.00 -2.30 0.23 0.00 0.00 176.91 174.84 1bpw n PRO 311 N -5.54 0.00 -0.19 0.39 -0.02 -1.26 -0.73 135.00 127.66 1bpw n PRO 311 Ca 0.12 0.55 0.15 0.00 -2.02 0.00 0.00 63.50 62.31 1bpw n PRO 311 Cb 0.44 -1.49 0.49 0.00 -0.02 0.00 0.00 33.50 32.91 1bpw n PRO 311 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 1bpw h GLN 312 N 0.00 0.44 0.70 -0.52 -0.00 -1.88 0.48 115.11 114.33 1bpw h GLN 312 Ca 0.00 -0.03 -0.03 0.00 -0.00 0.00 0.00 58.65 58.59 1bpw h GLN 312 Cb 0.00 -0.10 0.01 0.00 -0.00 0.00 0.00 27.48 27.39 1bpw h GLN 312 CO 0.00 0.29 -0.34 0.35 -0.00 0.00 0.00 178.83 179.14 1bpw h PHE 313 N 0.45 -0.87 -0.33 0.06 3.57 -1.25 -3.01 116.94 115.57 1bpw h PHE 313 Ca 0.39 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.97 1bpw h PHE 313 Cb 0.87 0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.89 1bpw h PHE 313 CO -0.00 -0.54 0.34 1.25 -2.23 0.00 0.00 178.31 177.13 1bpw h LEU 314 N -1.25 0.00 0.40 0.59 5.85 -0.24 -1.91 115.31 118.75 1bpw h LEU 314 Ca -0.10 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.60 1bpw h LEU 314 Cb 0.72 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.75 1bpw h LEU 314 CO 0.16 0.00 -0.19 -0.08 -0.34 0.00 0.00 178.44 177.98 1bpw h GLU 315 N 0.00 -0.52 -0.41 1.25 4.81 -0.90 -2.92 114.58 115.89 1bpw h GLU 315 Ca 0.16 0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.47 1bpw h GLU 315 Cb 0.84 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.31 1bpw h GLU 315 CO -0.00 -0.35 0.28 1.49 -0.73 0.00 0.00 179.01 179.70 1bpw h GLU 316 N -1.04 0.36 0.00 1.92 4.57 -1.36 -2.46 114.58 116.58 1bpw h GLU 316 Ca -0.06 -0.02 -0.18 0.00 -1.18 0.00 0.00 59.36 57.92 1bpw h GLU 316 Cb 0.41 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.90 1bpw h GLU 316 CO 0.09 0.24 -0.85 -0.24 -1.18 0.00 0.00 179.01 177.07 1bpw h VAL 317 N 0.37 1.59 -0.13 0.32 3.04 -1.46 -2.07 116.25 117.91 1bpw h VAL 317 Ca 0.18 -2.86 -0.20 0.00 -1.01 0.00 0.00 66.70 62.81 1bpw h VAL 317 Cb 0.23 2.55 0.00 0.00 -2.01 0.00 0.00 31.29 32.07 1bpw h VAL 317 CO -0.04 0.82 -0.72 0.58 -1.01 0.00 0.00 177.57 177.20 1bpw h VAL 318 N 0.01 1.33 0.54 1.51 2.07 -1.24 -1.63 116.25 118.83 1bpw h VAL 318 Ca -0.01 -2.01 -0.03 0.00 0.82 0.00 0.00 66.70 65.47 1bpw h VAL 318 Cb 1.50 1.99 0.01 0.00 -1.52 0.00 0.00 31.29 33.26 1bpw h VAL 318 CO 0.11 0.62 -0.26 0.50 0.02 0.00 0.00 177.57 178.57 1bpw h LYS 319 N 0.42 -0.70 -0.88 1.57 3.64 -1.48 -2.10 116.57 117.04 1bpw h LYS 319 Ca -0.03 0.05 0.09 0.00 -1.27 0.00 0.00 60.65 59.49 1bpw h LYS 319 Cb 1.31 0.16 -0.07 0.00 -0.41 0.00 0.00 32.23 33.22 1bpw h LYS 319 CO 0.14 -0.44 0.53 0.00 -2.27 0.00 0.00 179.45 177.41 1bpw h ARG 320 N -0.78 0.87 -0.14 1.90 2.47 -1.37 -0.51 114.38 116.83 1bpw h ARG 320 Ca -0.07 -0.05 -0.08 0.00 -1.26 0.00 0.00 59.98 58.51 1bpw h ARG 320 Cb 0.58 -0.20 -0.01 0.00 -1.65 0.00 0.00 29.97 28.69 1bpw h ARG 320 CO 0.12 0.58 -0.29 1.15 0.56 0.00 0.00 179.97 182.09 1bpw h THR 321 N 0.90 1.26 0.00 2.04 2.02 -1.23 -2.40 112.91 115.49 1bpw h THR 321 Ca 0.42 -1.23 -0.12 0.00 0.77 0.00 0.00 66.41 66.24 1bpw h THR 321 Cb 0.33 1.48 -0.02 0.00 -1.74 0.00 0.00 68.15 68.21 1bpw h THR 321 CO -0.23 0.37 -0.57 0.11 0.37 0.00 0.00 175.52 175.57 1bpw h LYS 322 N 0.23 0.00 0.00 6.66 1.57 -0.51 -2.98 116.57 121.55 1bpw h LYS 322 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1bpw h LYS 322 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 1bpw h LYS 322 CO 0.05 0.57 0.00 0.00 -0.57 0.00 0.00 179.45 179.50 1bpw n ALA 323 N -2.33 2.47 -2.71 3.86 0.00 -0.32 -4.81 120.51 116.67 1bpw n ALA 323 Ca -0.00 -0.06 -0.42 0.00 0.00 0.00 0.00 53.44 52.97 1bpw n ALA 323 Cb 0.65 -1.15 -0.03 0.00 0.00 0.00 0.00 19.45 18.92 1bpw n ALA 323 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1bpw s ILE 324 N -2.00 4.90 -0.43 0.00 1.01 -1.13 -5.01 121.20 118.54 1bpw s ILE 324 Ca 0.13 1.90 -0.26 0.00 0.00 0.00 0.00 60.65 62.42 1bpw s ILE 324 Cb 0.06 -4.25 0.02 0.00 0.01 0.00 0.00 42.46 38.31 1bpw s ILE 324 CO 0.10 0.15 0.95 -0.69 0.00 0.00 0.00 174.94 175.46 1bpw s VAL 325 N 1.16 4.48 -0.19 2.92 1.01 -1.26 -4.97 120.40 123.55 1bpw s VAL 325 Ca 0.48 0.98 -0.09 0.00 0.00 0.00 0.00 61.98 63.35 1bpw s VAL 325 Cb -0.20 -4.42 -0.05 0.00 0.00 0.00 0.00 36.38 31.72 1bpw s VAL 325 CO 0.24 -0.74 0.11 -0.69 0.00 0.00 0.00 175.10 174.01 1bpw s VAL 326 N 3.74 5.20 0.00 2.92 1.01 -1.26 -0.81 120.40 131.20 1bpw s VAL 326 Ca 0.39 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.48 1bpw s VAL 326 Cb -0.10 -3.36 0.00 0.00 0.00 0.00 0.00 36.38 32.92 1bpw s VAL 326 CO 0.24 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.41 1bpw n GLY 327 N 3.43 -0.90 3.63 4.51 0.00 -1.08 -4.92 105.19 109.86 1bpw n GLY 327 Ca -0.16 0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 1bpw n GLY 327 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bpw s ASP 328 N -4.00 6.27 0.53 1.61 -1.08 -1.26 -4.64 116.67 114.10 1bpw s ASP 328 Ca 0.00 1.90 0.22 0.00 -0.52 0.00 0.00 52.55 54.15 1bpw s ASP 328 Cb 0.00 -2.53 1.45 0.00 -1.46 0.00 0.00 42.92 40.38 1bpw s ASP 328 CO 0.00 -1.30 2.15 1.55 0.52 0.00 0.00 175.17 178.08 1bpw h PRO 329 N 11.28 0.00 -0.07 4.34 0.13 -1.87 -1.66 132.00 144.15 1bpw h PRO 329 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1bpw h PRO 329 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1bpw h PRO 329 CO 0.98 0.05 0.00 -0.11 -0.23 0.00 0.00 178.00 178.69 1bpw n LEU 330 N -4.12 0.49 -4.85 1.56 7.94 -1.26 -1.42 117.00 115.33 1bpw n LEU 330 Ca -0.03 -0.22 -0.37 0.00 -1.11 0.00 0.00 56.01 54.28 1bpw n LEU 330 Cb 0.14 -0.05 -0.06 0.00 0.53 0.00 0.00 43.42 43.98 1bpw n LEU 330 CO 0.31 0.11 -0.14 -0.76 -1.11 0.00 0.00 177.39 175.81 1bpw s LEU 331 N -1.30 4.37 0.35 -1.96 1.02 -0.62 -4.90 118.68 115.64 1bpw s LEU 331 Ca 0.18 0.50 0.16 0.00 0.02 0.00 0.00 54.13 54.99 1bpw s LEU 331 Cb 0.09 -2.14 0.60 0.00 0.02 0.00 0.00 46.19 44.76 1bpw s LEU 331 CO 0.14 0.36 1.71 0.71 0.02 0.00 0.00 176.35 179.29 1bpw h THR 332 N 4.05 1.08 -0.00 5.49 1.35 -1.87 -2.90 112.91 120.12 1bpw h THR 332 Ca -0.53 -1.67 0.00 0.00 -0.55 0.00 0.00 66.41 63.67 1bpw h THR 332 Cb 1.22 1.96 0.00 0.00 -1.73 0.00 0.00 68.15 69.60 1bpw h THR 332 CO 0.61 0.44 -0.20 -1.84 -0.25 0.00 0.00 175.52 174.27 1bpw n GLU 333 N -3.66 0.15 -2.28 4.72 0.00 -1.26 -4.85 120.64 113.46 1bpw n GLU 333 Ca -0.01 -0.05 -0.40 0.00 0.00 0.00 0.00 57.16 56.70 1bpw n GLU 333 Cb 0.53 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 30.44 1bpw n GLU 333 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 1bpw s THR 334 N -2.88 3.07 -0.51 3.84 2.01 -1.09 -4.77 115.64 115.31 1bpw s THR 334 Ca 0.16 1.06 0.04 0.00 0.31 0.00 0.00 61.69 63.27 1bpw s THR 334 Cb 0.19 -3.67 0.03 0.00 0.01 0.00 0.00 72.50 69.06 1bpw s THR 334 CO 0.58 0.24 0.60 0.54 -0.69 0.00 0.00 174.62 175.88 1bpw n ARG 335 N 0.87 0.05 -3.64 4.92 5.12 0.01 -4.87 116.66 119.11 1bpw n ARG 335 Ca 0.00 -0.70 -0.07 0.00 -1.93 0.00 0.00 57.85 55.15 1bpw n ARG 335 Cb 0.44 -1.05 -0.07 0.00 -1.16 0.00 0.00 32.46 30.61 1bpw n ARG 335 CO 0.00 0.00 0.00 1.41 -1.93 0.00 0.00 177.63 177.11 1bpw s MET 336 N -0.43 0.68 0.00 5.56 1.75 -1.03 -4.90 119.30 120.94 1bpw s MET 336 Ca 0.05 1.13 0.00 0.00 -1.25 0.00 0.00 55.69 55.62 1bpw s MET 336 Cb 0.03 0.16 0.00 0.00 2.84 0.00 0.00 34.83 37.86 1bpw s MET 336 CO 0.06 -0.14 0.00 0.41 -0.65 0.00 0.00 175.02 174.70 1bpw n GLY 337 N 4.08 1.68 3.93 2.11 0.00 -1.26 -2.62 105.19 113.12 1bpw n GLY 337 Ca -0.19 -1.99 -0.25 0.00 0.00 0.00 0.00 46.02 43.59 1bpw n GLY 337 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1bpw s GLY 338 N -0.89 1.48 1.14 -0.02 0.00 -1.25 -4.85 107.32 102.95 1bpw s GLY 338 Ca 0.00 -0.83 -0.18 0.00 0.00 0.00 0.00 44.72 43.70 1bpw s GLY 338 CO 0.00 -0.68 1.16 1.08 0.00 0.00 0.00 173.10 174.66 1bpw s LEU 339 N -4.58 1.21 0.20 0.66 1.43 0.39 -4.65 118.68 113.34 1bpw s LEU 339 Ca 0.46 0.53 -0.04 0.00 -1.03 0.00 0.00 54.13 54.05 1bpw s LEU 339 Cb -0.10 -2.34 0.15 0.00 0.03 0.00 0.00 46.19 43.93 1bpw s LEU 339 CO 0.40 -3.78 1.58 -0.29 0.23 0.00 0.00 176.35 174.50 1bpw h ILE 340 N -2.35 1.28 -3.49 -0.59 -0.00 -1.89 -3.43 117.51 107.04 1bpw h ILE 340 Ca -0.45 -1.49 -0.04 0.00 -0.00 0.00 0.00 64.86 62.89 1bpw h ILE 340 Cb 1.28 1.40 -0.10 0.00 -0.00 0.00 0.00 36.82 39.39 1bpw h ILE 340 CO 0.35 0.48 -0.07 -0.94 -0.00 0.00 0.00 178.15 177.97 1bpw s SER 341 N -6.82 -0.16 0.08 2.19 1.04 -1.26 -4.70 113.70 104.08 1bpw s SER 341 Ca -0.09 -0.65 -0.29 0.00 0.48 0.00 0.00 55.95 55.40 1bpw s SER 341 Cb 0.12 0.55 -0.16 0.00 0.10 0.00 0.00 66.02 66.63 1bpw s SER 341 CO 0.84 -1.04 1.66 0.50 0.98 0.00 0.00 173.24 176.19 1bpw h LYS 342 N 2.29 -0.54 -0.83 4.02 1.63 -1.96 -1.45 116.57 119.72 1bpw h LYS 342 Ca -0.29 0.04 0.19 0.00 -0.85 0.00 0.00 60.65 59.74 1bpw h LYS 342 Cb 1.25 0.12 -0.12 0.00 -0.60 0.00 0.00 32.23 32.89 1bpw h LYS 342 CO 0.39 -0.36 0.30 -1.35 -3.45 0.00 0.00 179.45 174.98 1bpw h PRO 343 N -0.56 0.35 -0.53 1.90 0.11 -1.99 0.76 132.00 132.03 1bpw h PRO 343 Ca -0.05 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.02 1bpw h PRO 343 Cb 0.45 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.46 1bpw h PRO 343 CO 0.06 0.23 0.23 1.96 -0.21 0.00 0.00 178.00 180.28 1bpw h GLN 344 N 0.36 0.78 -0.25 1.05 1.08 -1.87 0.08 115.11 116.33 1bpw h GLN 344 Ca 0.50 -0.13 0.02 0.00 -1.45 0.00 0.00 58.65 57.59 1bpw h GLN 344 Cb 0.89 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 28.17 1bpw h GLN 344 CO -0.52 0.67 0.10 1.25 -0.95 0.00 0.00 178.83 179.38 1bpw h LEU 345 N 0.71 0.13 -1.14 1.46 5.85 0.15 0.15 115.31 122.63 1bpw h LEU 345 Ca 0.18 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.87 1bpw h LEU 345 Cb 0.16 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 1bpw h LEU 345 CO -0.02 0.11 0.12 0.44 -0.34 0.00 0.00 178.44 178.75 1bpw h ASP 346 N 0.23 0.67 -0.09 1.25 3.32 -0.82 -0.55 116.42 120.41 1bpw h ASP 346 Ca 0.10 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1bpw h ASP 346 Cb 0.05 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.43 1bpw h ASP 346 CO -0.09 0.66 -0.02 0.50 -1.72 0.00 0.00 179.24 178.57 1bpw h LYS 347 N 0.70 0.18 -0.78 3.56 3.64 -0.40 0.10 116.57 123.57 1bpw h LYS 347 Ca 0.16 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 1bpw h LYS 347 Cb 0.26 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 1bpw h LYS 347 CO -0.00 0.48 0.46 0.28 -2.27 0.00 0.00 179.45 178.39 1bpw h VAL 348 N -0.14 1.22 -0.27 2.00 2.07 -0.34 -2.07 116.25 118.73 1bpw h VAL 348 Ca 0.02 -0.51 -0.04 0.00 0.82 0.00 0.00 66.70 66.99 1bpw h VAL 348 Cb 0.41 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1bpw h VAL 348 CO 0.01 0.24 0.01 -0.07 0.02 0.00 0.00 177.57 177.78 1bpw h LEU 349 N 1.07 0.46 -1.29 2.57 3.38 -1.05 -2.49 115.31 117.95 1bpw h LEU 349 Ca 0.28 -0.29 0.23 0.00 0.09 0.00 0.00 57.88 58.19 1bpw h LEU 349 Cb -0.02 -0.12 -0.09 0.00 0.09 0.00 0.00 40.66 40.52 1bpw h LEU 349 CO -0.05 0.64 0.64 1.23 0.09 0.00 0.00 178.44 180.98 1bpw h GLY 350 N 0.26 1.31 0.80 0.83 0.00 -0.33 -0.27 103.07 105.66 1bpw h GLY 350 Ca 0.08 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 1bpw h GLY 350 CO 0.01 -0.09 0.02 0.74 0.00 0.00 0.00 176.54 177.22 1bpw h PHE 351 N 0.50 0.15 -0.94 5.60 -1.00 -0.94 -1.91 116.94 118.39 1bpw h PHE 351 Ca 0.57 -0.02 0.04 0.00 2.81 0.00 0.00 57.97 61.37 1bpw h PHE 351 Cb 1.27 -0.04 -0.06 0.00 3.61 0.00 0.00 35.95 40.73 1bpw h PHE 351 CO -0.00 0.33 0.61 0.28 -1.61 0.00 0.00 178.31 177.92 1bpw h VAL 352 N -0.07 1.15 0.38 -0.55 2.07 -0.87 -0.77 116.25 117.58 1bpw h VAL 352 Ca 0.03 -0.40 -0.00 0.00 0.82 0.00 0.00 66.70 67.14 1bpw h VAL 352 Cb 0.26 -0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 29.88 1bpw h VAL 352 CO 0.00 0.21 -0.39 0.00 0.02 0.00 0.00 177.57 177.41 1bpw h ALA 353 N 1.39 -0.84 0.00 1.67 0.00 -0.98 -1.15 119.26 119.34 1bpw h ALA 353 Ca 0.38 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 1bpw h ALA 353 Cb 0.03 0.56 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1bpw h ALA 353 CO -0.13 -1.01 -0.00 0.37 0.00 0.00 0.00 179.25 178.48 1bpw h GLN 354 N -0.79 0.00 0.52 0.00 4.15 -1.09 -2.60 115.11 115.30 1bpw h GLN 354 Ca -0.03 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.36 1bpw h GLN 354 Cb 0.71 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.41 1bpw h GLN 354 CO -0.07 0.00 -0.25 0.00 -1.93 0.00 0.00 178.83 176.58 1bpw h ALA 355 N 2.00 -0.70 0.00 3.38 0.00 0.12 -1.82 119.26 122.24 1bpw h ALA 355 Ca -0.00 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 1bpw h ALA 355 Cb 0.26 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1bpw h ALA 355 CO 0.00 -0.82 -0.13 1.57 0.00 0.00 0.00 179.25 179.86 1bpw h LYS 356 N -0.84 0.00 0.00 0.00 2.10 -1.22 0.17 116.57 116.78 1bpw h LYS 356 Ca -0.07 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.58 1bpw h LYS 356 Cb 0.59 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.92 1bpw h LYS 356 CO 0.12 0.13 0.00 1.63 -2.00 0.00 0.00 179.45 179.33 1bpw n LYS 357 N -3.76 0.09 -0.08 0.07 5.02 -0.96 -1.95 118.16 116.59 1bpw n LYS 357 Ca -0.02 0.27 0.07 0.00 -2.02 0.00 0.00 58.31 56.61 1bpw n LYS 357 Cb 0.24 -1.65 0.10 0.00 -0.02 0.00 0.00 35.03 33.71 1bpw n LYS 357 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1bpw n GLU 358 N -1.81 1.60 0.00 1.97 1.02 0.46 -4.95 120.64 118.93 1bpw n GLU 358 Ca 0.04 -1.63 0.00 0.00 -0.02 0.00 0.00 57.16 55.55 1bpw n GLU 358 Cb 0.24 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.37 1bpw n GLU 358 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1bpw n GLY 359 N 0.78 1.66 3.60 0.62 0.00 -0.82 -5.03 105.19 106.00 1bpw n GLY 359 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1bpw n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bpw n ALA 360 N -0.36 0.04 -3.96 4.61 0.00 -0.34 -4.90 120.51 115.60 1bpw n ALA 360 Ca 0.00 -0.01 -0.31 0.00 0.00 0.00 0.00 53.44 53.12 1bpw n ALA 360 Cb 0.00 -2.08 -0.15 0.00 0.00 0.00 0.00 19.45 17.21 1bpw n ALA 360 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1bpw s ARG 361 N -2.74 1.55 -0.34 0.00 3.00 0.13 -4.19 118.95 116.34 1bpw s ARG 361 Ca 0.76 -1.39 -0.29 0.00 -1.00 0.00 0.00 55.73 53.81 1bpw s ARG 361 Cb -0.41 -2.78 -0.00 0.00 0.00 0.00 0.00 34.95 31.75 1bpw s ARG 361 CO 0.47 -0.78 1.49 0.08 0.00 0.00 0.00 175.30 176.56 1bpw s VAL 362 N 1.19 3.84 -0.62 7.11 1.01 -1.26 -1.42 120.40 130.26 1bpw s VAL 362 Ca 0.02 0.89 0.25 0.00 0.00 0.00 0.00 61.98 63.14 1bpw s VAL 362 Cb -0.19 -4.02 0.16 0.00 0.00 0.00 0.00 36.38 32.33 1bpw s VAL 362 CO -0.10 -0.57 1.49 -0.07 0.00 0.00 0.00 175.10 175.85 1bpw h LEU 363 N 12.10 0.00 0.00 3.92 3.38 -1.68 -3.48 115.31 129.55 1bpw h LEU 363 Ca -0.29 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1bpw h LEU 363 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1bpw h LEU 363 CO 1.05 0.05 0.00 0.00 0.09 0.00 0.00 178.44 179.63 1bpw n GLY 365 N -0.11 -0.94 0.03 0.00 0.00 -1.24 -2.11 105.19 100.83 1bpw n GLY 365 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.97 1bpw n GLY 365 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bpw n GLY 366 N 0.00 0.99 3.25 -0.02 0.00 -0.12 -4.74 105.19 104.55 1bpw n GLY 366 Ca 0.00 -0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 1bpw n GLY 366 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bpw s GLU 367 N -0.80 1.08 1.22 1.61 2.02 -1.26 -4.91 118.70 117.66 1bpw s GLU 367 Ca 0.00 -1.49 -0.17 0.00 0.02 0.00 0.00 54.97 53.33 1bpw s GLU 367 Cb 0.00 -0.45 0.25 0.00 0.10 0.00 0.00 34.13 34.03 1bpw s GLU 367 CO 0.00 -0.03 0.60 -2.30 0.02 0.00 0.00 175.26 173.55 1bpw n PRO 368 N -0.22 -2.83 -4.05 0.39 -0.02 -1.26 -2.07 135.00 124.93 1bpw n PRO 368 Ca -0.09 -0.82 -0.10 0.00 -2.02 0.00 0.00 63.50 60.47 1bpw n PRO 368 Cb 0.62 -1.88 -0.08 0.00 -0.02 0.00 0.00 33.50 32.14 1bpw n PRO 368 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1bpw s LEU 369 N -4.78 1.05 -0.31 2.45 2.96 -0.98 -4.55 118.68 114.53 1bpw s LEU 369 Ca 0.61 -1.05 0.03 0.00 -0.22 0.00 0.00 54.13 53.50 1bpw s LEU 369 Cb -0.16 0.95 0.17 0.00 0.50 0.00 0.00 46.19 47.65 1bpw s LEU 369 CO 0.60 -0.89 0.45 -0.89 -1.32 0.00 0.00 176.35 174.30 1bpw s THR 370 N -4.03 -0.69 0.69 3.68 2.01 -1.26 -4.70 115.64 111.33 1bpw s THR 370 Ca 0.24 -0.30 -0.17 0.00 0.31 0.00 0.00 61.69 61.77 1bpw s THR 370 Cb 0.04 -0.87 -0.00 0.00 0.01 0.00 0.00 72.50 71.68 1bpw s THR 370 CO 0.04 -0.25 1.07 -2.65 -0.69 0.00 0.00 174.62 172.15 1bpw n PRO 371 N 5.17 0.71 0.09 4.92 -0.02 -1.26 -4.93 135.00 139.68 1bpw n PRO 371 Ca 0.03 0.30 -0.12 0.00 -2.02 0.00 0.00 63.50 61.69 1bpw n PRO 371 Cb 0.50 -2.31 -0.06 0.00 -0.02 0.00 0.00 33.50 31.61 1bpw n PRO 371 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1bpw h SER 372 N 0.03 -0.42 -1.59 2.55 0.02 -1.96 -3.42 113.55 108.76 1bpw h SER 372 Ca -0.48 0.05 -0.72 0.00 -0.84 0.00 0.00 61.79 59.80 1bpw h SER 372 Cb 1.34 0.16 0.03 0.00 0.14 0.00 0.00 62.40 64.07 1bpw h SER 372 CO 0.49 -0.22 0.70 -0.67 -1.14 0.00 0.00 176.83 175.99 1bpw n ASP 373 N -5.28 2.03 0.08 3.07 -0.08 -1.26 -4.86 116.55 110.24 1bpw n ASP 373 Ca -0.07 1.10 0.08 0.00 -1.51 0.00 0.00 54.79 54.39 1bpw n ASP 373 Cb 0.20 -1.15 0.53 0.00 2.34 0.00 0.00 41.12 43.03 1bpw n ASP 373 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1bpw h PRO 374 N 6.02 0.29 0.00 -0.67 0.11 -2.02 -2.70 132.00 133.03 1bpw h PRO 374 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1bpw h PRO 374 Cb 1.33 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1bpw h PRO 374 CO 0.88 0.19 0.00 1.57 -0.21 0.00 0.00 178.00 180.43 1bpw h LYS 375 N 0.30 0.00 -0.59 1.05 2.10 -1.94 -2.83 116.57 114.66 1bpw h LYS 375 Ca 0.13 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.78 1bpw h LYS 375 Cb 0.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.47 1bpw h LYS 375 CO -0.03 0.00 0.00 1.28 -2.00 0.00 0.00 179.45 178.70 1bpw n LEU 376 N -2.67 3.29 -0.01 7.07 4.32 -1.02 -4.42 117.00 123.58 1bpw n LEU 376 Ca 0.02 -1.65 0.04 0.00 -0.02 0.00 0.00 56.01 54.40 1bpw n LEU 376 Cb 0.32 -0.42 0.41 0.00 -1.62 0.00 0.00 43.42 42.12 1bpw n LEU 376 CO 0.26 0.73 1.16 0.11 -1.22 0.00 0.00 177.39 178.42 1bpw h LYS 377 N 3.30 0.55 -0.61 3.23 6.56 -1.60 -2.50 116.57 125.51 1bpw h LYS 377 Ca 0.00 -0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.55 1bpw h LYS 377 Cb 0.89 -0.12 0.00 0.00 -0.57 0.00 0.00 32.23 32.43 1bpw h LYS 377 CO 0.06 0.37 0.00 0.09 -2.06 0.00 0.00 179.45 177.91 1bpw n ASN 378 N -4.46 3.80 -4.57 0.86 5.03 -1.26 -4.95 115.26 109.71 1bpw n ASN 378 Ca 0.03 -2.00 -0.28 0.00 0.87 0.00 0.00 54.58 53.20 1bpw n ASN 378 Cb 0.07 -0.40 0.22 0.00 -1.02 0.00 0.00 39.78 38.65 1bpw n ASN 378 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1bpw s GLY 379 N -1.20 1.55 -1.03 7.41 0.00 -0.94 -3.62 107.32 109.49 1bpw s GLY 379 Ca 0.46 -0.24 -0.02 0.00 0.00 0.00 0.00 44.72 44.91 1bpw s GLY 379 CO 0.33 0.44 1.60 -1.72 0.00 0.00 0.00 173.10 173.75 1bpw n TYR 380 N -4.63 2.55 -3.88 1.90 4.01 -0.64 -4.88 117.16 111.59 1bpw n TYR 380 Ca 0.04 -2.65 -0.30 0.00 -0.16 0.00 0.00 57.90 54.82 1bpw n TYR 380 Cb 0.56 -1.19 -0.04 0.00 -0.31 0.00 0.00 39.34 38.36 1bpw n TYR 380 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1bpw s PHE 381 N -3.50 3.51 0.15 -0.72 0.40 -1.26 -0.46 117.98 116.10 1bpw s PHE 381 Ca 0.35 0.28 -0.14 0.00 -0.60 0.00 0.00 56.93 56.82 1bpw s PHE 381 Cb 0.12 -1.78 0.02 0.00 0.51 0.00 0.00 43.02 41.89 1bpw s PHE 381 CO -0.01 0.56 0.38 0.00 0.70 0.00 0.00 175.22 176.85 1bpw s MET 382 N -2.63 1.13 -0.16 0.44 0.23 -1.26 -2.32 119.30 114.74 1bpw s MET 382 Ca 0.36 -0.88 -0.09 0.00 -1.03 0.00 0.00 55.69 54.06 1bpw s MET 382 Cb -0.13 0.45 -0.05 0.00 -1.53 0.00 0.00 34.83 33.58 1bpw s MET 382 CO 0.28 -0.44 0.14 -1.54 -2.03 0.00 0.00 175.02 171.42 1bpw s SER 383 N -2.86 6.30 -0.07 -1.18 1.04 -0.88 -4.87 113.70 111.18 1bpw s SER 383 Ca 0.08 0.35 -0.38 0.00 0.48 0.00 0.00 55.95 56.48 1bpw s SER 383 Cb 0.02 -2.08 -0.16 0.00 0.10 0.00 0.00 66.02 63.90 1bpw s SER 383 CO -0.07 0.29 1.57 -0.81 0.98 0.00 0.00 173.24 175.20 1bpw n PRO 384 N 2.78 1.30 -4.35 4.02 -0.04 -1.26 -0.94 135.00 136.51 1bpw n PRO 384 Ca -0.18 0.47 -0.34 0.00 -0.04 0.00 0.00 63.50 63.41 1bpw n PRO 384 Cb 0.53 -2.16 -0.09 0.00 -0.04 0.00 0.00 33.50 31.74 1bpw n PRO 384 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bpw s VAL 386 N -0.95 1.65 0.58 0.00 1.01 -0.90 -1.46 120.40 120.34 1bpw s VAL 386 Ca 0.15 -1.52 -0.11 0.00 0.00 0.00 0.00 61.98 60.50 1bpw s VAL 386 Cb -0.11 -2.01 -0.05 0.00 0.00 0.00 0.00 36.38 34.21 1bpw s VAL 386 CO 0.05 -0.28 0.99 -0.76 0.00 0.00 0.00 175.10 175.10 1bpw s LEU 387 N 1.30 3.35 0.04 3.92 1.43 0.98 -1.76 118.68 127.94 1bpw s LEU 387 Ca -0.00 1.39 -0.11 0.00 -1.03 0.00 0.00 54.13 54.37 1bpw s LEU 387 Cb -0.19 -4.40 0.01 0.00 0.03 0.00 0.00 46.19 41.64 1bpw s LEU 387 CO -0.09 -0.78 0.24 -0.62 0.23 0.00 0.00 176.35 175.32 1bpw s ASP 388 N -3.97 -0.03 -0.68 2.29 2.15 -0.51 -2.84 116.67 113.09 1bpw s ASP 388 Ca 0.55 -0.30 -0.01 0.00 0.43 0.00 0.00 52.55 53.22 1bpw s ASP 388 Cb -0.11 0.31 -0.01 0.00 -0.30 0.00 0.00 42.92 42.82 1bpw s ASP 388 CO 0.49 -0.58 0.57 0.59 -0.17 0.00 0.00 175.17 176.07 1bpw n ASN 389 N 0.64 -2.74 -4.82 -0.34 4.13 -1.26 -0.70 115.26 110.18 1bpw n ASN 389 Ca -0.19 -0.37 -0.27 0.00 1.68 0.00 0.00 54.58 55.43 1bpw n ASN 389 Cb 0.59 -3.21 -0.05 0.00 -1.54 0.00 0.00 39.78 35.57 1bpw n ASN 389 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1bpw s ARG 391 N -2.94 1.46 0.40 0.00 0.52 -1.26 -4.88 118.95 112.25 1bpw s ARG 391 Ca 0.31 -0.99 0.19 0.00 -0.52 0.00 0.00 55.73 54.73 1bpw s ARG 391 Cb -0.11 -1.60 1.06 0.00 0.52 0.00 0.00 34.95 34.82 1bpw s ARG 391 CO 0.24 0.41 1.54 -0.44 0.02 0.00 0.00 175.30 177.07 1bpw h ASP 392 N 4.82 0.00 0.08 0.23 5.19 -2.00 -0.55 116.42 124.18 1bpw h ASP 392 Ca -0.44 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.97 1bpw h ASP 392 Cb 1.16 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.67 1bpw h ASP 392 CO 0.44 0.00 -0.91 -0.90 -3.12 0.00 0.00 179.24 174.75 1bpw n ASP 393 N -2.29 0.95 -4.77 6.45 5.75 -1.26 -4.66 116.55 116.72 1bpw n ASP 393 Ca -0.01 -0.90 -0.41 0.00 -0.01 0.00 0.00 54.79 53.46 1bpw n ASP 393 Cb 0.25 0.87 -0.02 0.00 -1.03 0.00 0.00 41.12 41.19 1bpw n ASP 393 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 1bpw s MET 394 N -2.98 4.28 0.37 0.11 -1.94 -0.22 -4.91 119.30 114.01 1bpw s MET 394 Ca 0.09 2.29 0.12 0.00 -1.71 0.00 0.00 55.69 56.48 1bpw s MET 394 Cb 0.16 -3.03 0.93 0.00 2.01 0.00 0.00 34.83 34.90 1bpw s MET 394 CO 0.83 -0.28 1.83 1.15 -0.01 0.00 0.00 175.02 178.55 1bpw h THR 395 N 2.99 0.71 0.00 2.05 2.02 -1.93 -0.43 112.91 118.32 1bpw h THR 395 Ca -0.49 -0.20 -0.05 0.00 0.77 0.00 0.00 66.41 66.44 1bpw h THR 395 Cb 1.23 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.72 1bpw h THR 395 CO 0.65 0.10 -0.24 0.00 0.37 0.00 0.00 175.52 176.41 1bpw h VAL 397 N 0.00 0.75 0.09 0.00 2.07 -1.37 -3.37 116.25 114.42 1bpw h VAL 397 Ca -0.00 -2.18 -0.35 0.00 0.82 0.00 0.00 66.70 64.98 1bpw h VAL 397 Cb 0.63 2.27 -0.03 0.00 -1.52 0.00 0.00 31.29 32.64 1bpw h VAL 397 CO 0.03 0.43 -1.98 0.29 0.02 0.00 0.00 177.57 176.35 1bpw n LYS 398 N -3.08 0.72 -3.29 1.57 5.02 -0.97 -4.97 118.16 113.15 1bpw n LYS 398 Ca -0.03 0.25 -0.33 0.00 -2.02 0.00 0.00 58.31 56.18 1bpw n LYS 398 Cb 0.79 -1.71 -0.06 0.00 -0.02 0.00 0.00 35.03 34.03 1bpw n LYS 398 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1bpw s GLU 399 N -2.56 3.93 -0.32 1.97 0.41 -0.30 -4.94 118.70 116.90 1bpw s GLU 399 Ca -0.19 0.49 -0.28 0.00 -0.41 0.00 0.00 54.97 54.58 1bpw s GLU 399 Cb 0.07 -2.65 0.01 0.00 -1.78 0.00 0.00 34.13 29.78 1bpw s GLU 399 CO 0.77 0.30 1.00 -2.00 -0.49 0.00 0.00 175.26 174.84 1bpw s GLU 400 N -2.65 4.03 -0.06 1.61 2.12 -1.26 -4.86 118.70 117.63 1bpw s GLU 400 Ca 0.47 0.94 -0.12 0.00 0.36 0.00 0.00 54.97 56.63 1bpw s GLU 400 Cb -0.12 -3.74 -0.07 0.00 0.26 0.00 0.00 34.13 30.46 1bpw s GLU 400 CO 0.20 -0.85 0.46 0.82 -0.54 0.00 0.00 175.26 175.35 1bpw h ILE 401 N 5.70 0.19 -1.22 -3.70 1.08 -1.91 -3.49 117.51 114.17 1bpw h ILE 401 Ca -0.21 -0.88 0.00 0.00 -0.39 0.00 0.00 64.86 63.38 1bpw h ILE 401 Cb 1.07 0.34 0.00 0.00 -3.07 0.00 0.00 36.82 35.16 1bpw h ILE 401 CO 1.00 0.06 0.00 0.33 -0.69 0.00 0.00 178.15 178.84 1bpw n PHE 402 N -4.97 0.00 -4.03 1.37 7.35 -1.26 -4.86 117.46 111.07 1bpw n PHE 402 Ca -0.05 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 56.55 1bpw n PHE 402 Cb 0.16 -1.22 -0.06 0.00 0.35 0.00 0.00 39.48 38.70 1bpw n PHE 402 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1bpw s GLY 403 N -2.99 0.69 -0.87 7.13 0.00 -1.17 -4.44 107.32 105.67 1bpw s GLY 403 Ca 0.00 -1.02 -0.22 0.00 0.00 0.00 0.00 44.72 43.48 1bpw s GLY 403 CO 0.00 -0.80 1.94 -1.55 0.00 0.00 0.00 173.10 172.69 1bpw n PRO 404 N -0.33 1.62 -3.79 2.90 -0.04 -1.08 -4.72 135.00 129.56 1bpw n PRO 404 Ca -0.02 -1.98 -0.27 0.00 -0.04 0.00 0.00 63.50 61.19 1bpw n PRO 404 Cb 0.63 -3.04 -0.17 0.00 -0.04 0.00 0.00 33.50 30.88 1bpw n PRO 404 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1bpw s VAL 405 N 5.56 0.66 -0.24 0.52 1.01 -1.26 -1.49 120.40 125.16 1bpw s VAL 405 Ca 0.58 -0.44 -0.11 0.00 0.00 0.00 0.00 61.98 62.01 1bpw s VAL 405 Cb 0.13 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.46 1bpw s VAL 405 CO 0.11 -0.02 0.17 -0.32 0.00 0.00 0.00 175.10 175.04 1bpw s MET 406 N 1.82 4.07 -0.37 2.72 1.75 -0.53 -4.90 119.30 123.86 1bpw s MET 406 Ca 0.01 -0.25 -0.11 0.00 -1.25 0.00 0.00 55.69 54.09 1bpw s MET 406 Cb -0.16 -3.54 0.03 0.00 2.84 0.00 0.00 34.83 34.00 1bpw s MET 406 CO -0.07 0.05 0.20 -1.12 -0.65 0.00 0.00 175.02 173.43 1bpw s SER 407 N 1.08 5.71 -0.06 1.11 0.01 -0.99 -0.01 113.70 120.55 1bpw s SER 407 Ca 0.08 -1.00 -0.14 0.00 1.31 0.00 0.00 55.95 56.20 1bpw s SER 407 Cb -0.14 -2.01 -0.05 0.00 0.21 0.00 0.00 66.02 64.03 1bpw s SER 407 CO 0.05 -0.38 0.38 -0.69 0.41 0.00 0.00 173.24 173.00 1bpw s VAL 408 N 1.55 5.14 -0.02 3.43 1.01 -1.13 -1.35 120.40 129.02 1bpw s VAL 408 Ca 0.02 0.75 -0.02 0.00 0.00 0.00 0.00 61.98 62.73 1bpw s VAL 408 Cb -0.19 -3.69 0.01 0.00 0.00 0.00 0.00 36.38 32.51 1bpw s VAL 408 CO 0.06 0.51 0.06 -0.76 0.00 0.00 0.00 175.10 174.97 1bpw s LEU 409 N -0.55 1.68 0.61 3.92 1.02 -0.27 -4.00 118.68 121.09 1bpw s LEU 409 Ca 0.22 0.12 -0.11 0.00 0.02 0.00 0.00 54.13 54.38 1bpw s LEU 409 Cb -0.15 0.18 -0.04 0.00 0.02 0.00 0.00 46.19 46.20 1bpw s LEU 409 CO 0.10 -0.03 1.02 -2.16 0.02 0.00 0.00 176.35 175.30 1bpw s PRO 410 N 0.16 3.60 0.10 1.29 0.04 -1.26 -1.36 135.00 137.58 1bpw s PRO 410 Ca -0.01 0.73 -0.19 0.00 0.04 0.00 0.00 61.00 61.57 1bpw s PRO 410 Cb -0.02 -2.09 0.04 0.00 0.04 0.00 0.00 34.50 32.47 1bpw s PRO 410 CO -0.00 -0.55 0.46 -0.59 0.04 0.00 0.00 177.00 176.36 1bpw s PHE 411 N -3.15 -0.32 -0.11 0.56 -0.12 -0.99 -4.82 117.98 109.04 1bpw s PHE 411 Ca 0.55 0.13 -0.07 0.00 -0.05 0.00 0.00 56.93 57.49 1bpw s PHE 411 Cb -0.11 0.32 -0.05 0.00 -0.63 0.00 0.00 43.02 42.55 1bpw s PHE 411 CO 0.53 -0.70 -0.16 -0.25 -0.05 0.00 0.00 175.22 174.59 1bpw n ASP 412 N -0.01 1.00 -4.44 1.98 8.00 -1.26 -0.93 116.55 120.88 1bpw n ASP 412 Ca -0.17 0.17 -0.24 0.00 0.71 0.00 0.00 54.79 55.25 1bpw n ASP 412 Cb 0.63 -0.40 -0.11 0.00 -0.02 0.00 0.00 41.12 41.22 1bpw n ASP 412 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1bpw s THR 413 N -2.26 2.36 0.10 -3.53 -4.23 -1.26 -4.90 115.64 101.92 1bpw s THR 413 Ca -0.17 -2.27 -0.24 0.00 -1.18 0.00 0.00 61.69 57.83 1bpw s THR 413 Cb 0.06 -2.21 -0.13 0.00 1.34 0.00 0.00 72.50 71.56 1bpw s THR 413 CO 0.22 -0.33 1.71 -0.08 -0.54 0.00 0.00 174.62 175.60 1bpw h GLU 414 N 2.58 -0.13 -0.65 3.99 4.81 -2.01 -1.56 114.58 121.62 1bpw h GLU 414 Ca -0.42 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 58.91 1bpw h GLU 414 Cb 1.24 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.61 1bpw h GLU 414 CO 0.56 -0.09 0.43 1.49 -0.73 0.00 0.00 179.01 180.68 1bpw h GLU 415 N -0.13 0.50 0.42 1.92 4.81 -2.00 -2.53 114.58 117.56 1bpw h GLU 415 Ca 0.01 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 1bpw h GLU 415 Cb 0.14 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 1bpw h GLU 415 CO -0.03 0.33 -0.26 1.49 -0.73 0.00 0.00 179.01 179.82 1bpw h GLU 416 N 0.51 -0.61 -0.88 1.92 4.81 -1.71 -2.99 114.58 115.64 1bpw h GLU 416 Ca 0.30 0.04 0.08 0.00 -0.13 0.00 0.00 59.36 59.64 1bpw h GLU 416 Cb 0.48 0.14 -0.06 0.00 0.63 0.00 0.00 28.75 29.94 1bpw h GLU 416 CO -0.09 -0.40 0.57 -0.39 -0.73 0.00 0.00 179.01 177.97 1bpw h VAL 417 N -0.63 1.03 -0.16 0.32 -1.51 -1.34 -2.49 116.25 111.48 1bpw h VAL 417 Ca -0.06 -0.33 0.03 0.00 -1.23 0.00 0.00 66.70 65.12 1bpw h VAL 417 Cb 0.50 -0.01 -0.03 0.00 -2.13 0.00 0.00 31.29 29.62 1bpw h VAL 417 CO 0.06 0.17 -0.04 -0.07 -1.23 0.00 0.00 177.57 176.46 1bpw h LEU 418 N 0.96 -0.15 -1.31 4.19 3.38 -1.46 2.29 115.31 123.20 1bpw h LEU 418 Ca 0.39 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.39 1bpw h LEU 418 Cb 0.27 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1bpw h LEU 418 CO -0.15 -0.05 0.23 0.06 0.09 0.00 0.00 178.44 178.62 1bpw h GLN 419 N -0.00 0.70 0.02 1.13 -0.00 -1.33 -0.02 115.11 115.61 1bpw h GLN 419 Ca 0.08 -0.09 -0.27 0.00 -0.00 0.00 0.00 58.65 58.37 1bpw h GLN 419 Cb 0.12 -0.14 0.02 0.00 -0.00 0.00 0.00 27.48 27.49 1bpw h GLN 419 CO -0.16 0.55 -1.08 0.00 -0.00 0.00 0.00 178.83 178.14 1bpw h ARG 420 N 0.71 0.69 0.17 0.06 3.08 -0.78 -2.38 114.38 115.92 1bpw h ARG 420 Ca 0.18 -0.77 -0.01 0.00 0.07 0.00 0.00 59.98 59.44 1bpw h ARG 420 Cb 0.09 0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.37 1bpw h ARG 420 CO -0.02 1.34 -0.08 0.00 -1.07 0.00 0.00 179.97 180.14 1bpw h ALA 421 N 0.38 -0.22 0.00 0.04 0.00 0.43 -2.52 119.26 117.37 1bpw h ALA 421 Ca -0.14 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1bpw h ALA 421 Cb 1.73 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.61 1bpw h ALA 421 CO 0.21 -0.56 0.00 0.09 0.00 0.00 0.00 179.25 178.99 1bpw n ASN 422 N -5.13 0.00 -3.81 0.00 3.02 -0.07 -4.36 115.26 104.91 1bpw n ASN 422 Ca -0.09 -0.07 -0.42 0.00 -0.03 0.00 0.00 54.58 53.97 1bpw n ASN 422 Cb 0.16 -0.27 0.00 0.00 -0.61 0.00 0.00 39.78 39.05 1bpw n ASN 422 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1bpw n ASN 423 N -1.27 4.19 -3.56 6.41 4.05 -0.90 -4.82 115.26 119.36 1bpw n ASN 423 Ca 0.11 -2.90 -0.11 0.00 0.45 0.00 0.00 54.58 52.13 1bpw n ASN 423 Cb 0.18 -1.63 -0.04 0.00 1.23 0.00 0.00 39.78 39.52 1bpw n ASN 423 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 177.26 174.49 1bpw s THR 424 N 2.66 0.04 -0.65 -0.44 -1.32 -1.26 -5.00 115.64 109.67 1bpw s THR 424 Ca 0.46 -0.36 0.25 0.00 -1.21 0.00 0.00 61.69 60.83 1bpw s THR 424 Cb 0.12 -1.09 0.18 0.00 -1.51 0.00 0.00 72.50 70.20 1bpw s THR 424 CO -0.06 -0.20 1.54 0.00 -2.21 0.00 0.00 174.62 173.69 1bpw h THR 425 N 2.32 0.00 -4.35 5.08 1.03 -1.97 -3.46 112.91 111.56 1bpw h THR 425 Ca -0.34 -0.55 -0.46 0.00 -0.01 0.00 0.00 66.41 65.05 1bpw h THR 425 Cb 1.27 1.34 0.10 0.00 -1.07 0.00 0.00 68.15 69.79 1bpw h THR 425 CO 0.43 0.00 0.37 -0.36 -0.01 0.00 0.00 175.52 175.96 1bpw s PHE 426 N -3.15 2.76 0.00 0.00 0.08 -1.26 -2.15 117.98 114.25 1bpw s PHE 426 Ca 0.08 0.62 0.00 0.00 0.12 0.00 0.00 56.93 57.75 1bpw s PHE 426 Cb 0.12 -3.51 0.00 0.00 -0.57 0.00 0.00 43.02 39.06 1bpw s PHE 426 CO 0.66 -1.82 0.00 0.41 -0.10 0.00 0.00 175.22 174.37 1bpw n GLY 427 N -3.30 0.00 0.05 4.36 0.00 -1.25 -4.78 105.19 100.28 1bpw n GLY 427 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.08 1bpw n GLY 427 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1bpw h LEU 428 N 0.00 0.00 0.00 0.99 5.85 -1.81 0.14 115.31 120.48 1bpw h LEU 428 Ca 0.00 0.00 -0.41 0.00 0.84 0.00 0.00 57.88 58.31 1bpw h LEU 428 Cb 0.00 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 40.93 1bpw h LEU 428 CO 0.00 0.56 -0.39 0.00 -0.34 0.00 0.00 178.44 178.27 1bpw n ALA 429 N -3.19 0.57 -3.62 1.25 0.00 -1.26 -2.02 120.51 112.24 1bpw n ALA 429 Ca -0.04 -1.64 -0.02 0.00 0.00 0.00 0.00 53.44 51.73 1bpw n ALA 429 Cb 0.16 1.28 -0.02 0.00 0.00 0.00 0.00 19.45 20.87 1bpw n ALA 429 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1bpw s SER 430 N -2.96 -0.05 0.14 0.00 1.04 -0.55 -4.05 113.70 107.26 1bpw s SER 430 Ca 0.30 -0.01 -0.08 0.00 0.48 0.00 0.00 55.95 56.64 1bpw s SER 430 Cb 0.01 0.06 -0.01 0.00 0.10 0.00 0.00 66.02 66.18 1bpw s SER 430 CO 0.21 -0.10 0.24 -0.83 0.98 0.00 0.00 173.24 173.74 1bpw s GLY 431 N -2.16 0.42 -0.18 7.32 0.00 -0.35 -1.08 107.32 111.28 1bpw s GLY 431 Ca 0.11 -0.87 -0.10 0.00 0.00 0.00 0.00 44.72 43.87 1bpw s GLY 431 CO -0.03 -0.87 0.44 0.54 0.00 0.00 0.00 173.10 173.17 1bpw s VAL 432 N -3.95 -0.05 -0.29 1.40 0.11 -0.54 -0.50 120.40 116.58 1bpw s VAL 432 Ca 0.14 0.09 -0.03 0.00 -2.93 0.00 0.00 61.98 59.25 1bpw s VAL 432 Cb 0.04 -0.66 0.04 0.00 -1.53 0.00 0.00 36.38 34.28 1bpw s VAL 432 CO -0.03 0.04 0.00 -0.36 -3.33 0.00 0.00 175.10 171.42 1bpw s PHE 433 N 1.48 3.21 0.35 1.54 0.40 0.17 -1.44 117.98 123.70 1bpw s PHE 433 Ca -0.09 -1.69 -0.14 0.00 -0.60 0.00 0.00 56.93 54.41 1bpw s PHE 433 Cb -0.08 -2.12 0.04 0.00 0.51 0.00 0.00 43.02 41.36 1bpw s PHE 433 CO -0.14 -0.76 0.69 -0.08 0.70 0.00 0.00 175.22 175.64 1bpw s THR 434 N 1.30 0.00 0.00 0.64 -1.32 -1.26 -1.23 115.64 113.77 1bpw s THR 434 Ca -0.03 -1.15 0.00 0.00 -1.21 0.00 0.00 61.69 59.30 1bpw s THR 434 Cb -0.19 -2.65 0.00 0.00 -1.51 0.00 0.00 72.50 68.15 1bpw s THR 434 CO -0.01 0.00 0.00 0.54 -2.21 0.00 0.00 174.62 172.94 1bpw n ARG 435 N -0.52 3.93 -2.78 7.08 5.12 -1.26 -4.82 116.66 123.41 1bpw n ARG 435 Ca -0.05 0.00 -0.43 0.00 -1.93 0.00 0.00 57.85 55.44 1bpw n ARG 435 Cb 0.60 -0.68 -0.04 0.00 -1.16 0.00 0.00 32.46 31.19 1bpw n ARG 435 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1bpw s ASP 436 N -1.32 6.68 0.32 0.55 2.15 -1.26 -4.93 116.67 118.86 1bpw s ASP 436 Ca 0.00 0.57 0.07 0.00 0.43 0.00 0.00 52.55 53.62 1bpw s ASP 436 Cb 0.00 -2.47 0.91 0.00 -0.30 0.00 0.00 42.92 41.06 1bpw s ASP 436 CO 0.00 -0.90 1.58 -0.29 -0.17 0.00 0.00 175.17 175.39 1bpw h ILE 437 N 5.86 0.02 -0.16 4.11 2.10 -2.00 0.43 117.51 127.87 1bpw h ILE 437 Ca -0.23 -0.00 -0.06 0.00 1.08 0.00 0.00 64.86 65.64 1bpw h ILE 437 Cb 1.08 0.01 -0.00 0.00 -1.09 0.00 0.00 36.82 36.81 1bpw h ILE 437 CO 1.00 0.00 -0.15 0.28 -1.08 0.00 0.00 178.15 178.19 1bpw h SER 438 N 0.01 0.41 -0.74 2.19 0.02 -2.01 -3.13 113.55 110.30 1bpw h SER 438 Ca 0.67 -0.48 -0.01 0.00 -0.84 0.00 0.00 61.79 61.13 1bpw h SER 438 Cb 1.50 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 63.89 1bpw h SER 438 CO -0.88 0.80 0.44 -0.09 -1.14 0.00 0.00 176.83 175.96 1bpw h ARG 439 N 0.02 1.02 0.00 3.45 2.43 -1.39 -1.06 114.38 118.85 1bpw h ARG 439 Ca 0.02 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1bpw h ARG 439 Cb 0.69 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1bpw h ARG 439 CO 0.04 0.73 0.00 0.00 -1.51 0.00 0.00 179.97 179.23 1bpw n ALA 440 N -2.34 -0.20 -0.27 2.80 0.00 -0.38 0.25 120.51 120.37 1bpw n ALA 440 Ca 0.07 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.53 1bpw n ALA 440 Cb 0.07 0.20 0.16 0.00 0.00 0.00 0.00 19.45 19.87 1bpw n ALA 440 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1bpw h HIS 441 N 0.00 0.78 -0.11 0.00 3.86 -1.56 0.53 115.15 118.65 1bpw h HIS 441 Ca 0.00 0.03 0.03 0.00 -1.16 0.00 0.00 60.37 59.27 1bpw h HIS 441 Cb 0.00 -0.23 -0.04 0.00 1.06 0.00 0.00 27.41 28.20 1bpw h HIS 441 CO -0.23 0.31 -0.12 -0.09 0.86 0.00 0.00 177.93 178.66 1bpw h ARG 442 N 0.73 -0.14 -0.64 2.45 2.43 -0.97 0.79 114.38 119.02 1bpw h ARG 442 Ca 0.38 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.51 1bpw h ARG 442 Cb 0.36 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 1bpw h ARG 442 CO -0.25 -0.09 0.22 0.28 -1.51 0.00 0.00 179.97 178.61 1bpw h VAL 443 N -0.15 1.23 0.25 0.20 2.07 0.47 -1.24 116.25 119.09 1bpw h VAL 443 Ca 0.08 -0.79 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 1bpw h VAL 443 Cb 0.26 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 1bpw h VAL 443 CO -0.19 0.31 -0.18 0.00 0.02 0.00 0.00 177.57 177.52 1bpw h ALA 444 N 1.30 -0.42 -0.65 1.67 0.00 0.31 -0.54 119.26 120.93 1bpw h ALA 444 Ca 0.21 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.13 1bpw h ALA 444 Cb 0.24 0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1bpw h ALA 444 CO -0.01 -0.75 0.43 0.00 0.00 0.00 0.00 179.25 178.92 1bpw h ALA 445 N 0.28 1.88 0.00 0.00 0.00 0.95 -3.00 119.26 119.37 1bpw h ALA 445 Ca -0.02 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1bpw h ALA 445 Cb 0.37 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1bpw h ALA 445 CO 0.00 -0.00 -0.71 -0.91 0.00 0.00 0.00 179.25 177.63 1bpw h ASN 446 N 0.55 0.00 -3.93 0.00 2.35 -0.54 -3.46 115.58 110.56 1bpw h ASN 446 Ca 0.29 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.52 1bpw h ASN 446 Cb 0.42 0.00 0.07 0.00 0.05 0.00 0.00 38.32 38.86 1bpw h ASN 446 CO -0.09 0.17 0.59 -0.76 -1.65 0.00 0.00 177.43 175.69 1bpw s LEU 447 N -5.84 4.26 -1.05 1.61 1.02 -0.28 -4.92 118.68 113.48 1bpw s LEU 447 Ca 0.02 2.58 -0.03 0.00 0.02 0.00 0.00 54.13 56.72 1bpw s LEU 447 Cb 0.08 -3.88 0.31 0.00 0.02 0.00 0.00 46.19 42.72 1bpw s LEU 447 CO 0.75 -0.74 1.59 -0.62 0.02 0.00 0.00 176.35 177.35 1bpw n GLU 448 N 0.26 4.78 -4.22 1.70 1.02 -1.26 -4.96 120.64 117.96 1bpw n GLU 448 Ca 0.03 -4.60 -0.13 0.00 -0.02 0.00 0.00 57.16 52.44 1bpw n GLU 448 Cb 0.44 -2.49 -0.10 0.00 -0.02 0.00 0.00 31.44 29.27 1bpw n GLU 448 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1bpw s ALA 449 N -3.32 1.24 -0.58 0.62 0.00 -1.26 -4.56 121.76 113.90 1bpw s ALA 449 Ca 0.34 -1.62 0.24 0.00 0.00 0.00 0.00 51.96 50.92 1bpw s ALA 449 Cb 0.10 0.87 0.55 0.00 0.00 0.00 0.00 23.12 24.64 1bpw s ALA 449 CO 0.03 -0.44 1.68 0.78 0.00 0.00 0.00 175.76 177.81 1bpw h GLY 450 N 2.68 0.00 -5.56 0.00 0.00 -0.91 -3.45 103.07 95.83 1bpw h GLY 450 Ca -0.36 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 46.76 1bpw h GLY 450 CO 0.60 0.00 -0.61 -1.59 0.00 0.00 0.00 176.54 174.94 1bpw s THR 451 N -3.16 -0.01 -0.08 4.70 2.01 -0.86 -4.74 115.64 113.51 1bpw s THR 451 Ca 0.09 0.02 -0.02 0.00 0.31 0.00 0.00 61.69 62.08 1bpw s THR 451 Cb 0.09 -0.15 0.04 0.00 0.01 0.00 0.00 72.50 72.48 1bpw s THR 451 CO 0.64 0.01 0.04 0.00 -0.69 0.00 0.00 174.62 174.62 1bpw s TYR 453 N 2.07 3.76 -0.27 0.00 2.02 -0.24 -4.97 117.35 119.72 1bpw s TYR 453 Ca 0.04 1.20 0.03 0.00 -0.37 0.00 0.00 57.07 57.97 1bpw s TYR 453 Cb -0.13 -2.45 0.06 0.00 -0.40 0.00 0.00 41.96 39.04 1bpw s TYR 453 CO -0.05 0.56 -0.10 0.42 -1.57 0.00 0.00 175.55 174.82 1bpw s ILE 454 N -1.18 2.23 -1.19 2.71 1.01 -1.26 -1.46 121.20 122.05 1bpw s ILE 454 Ca 0.30 -1.66 -0.07 0.00 0.00 0.00 0.00 60.65 59.23 1bpw s ILE 454 Cb -0.18 -2.33 0.01 0.00 0.01 0.00 0.00 42.46 39.97 1bpw s ILE 454 CO 0.18 -0.06 0.89 0.59 0.00 0.00 0.00 174.94 176.55 1bpw n ASN 455 N 4.43 -5.68 -1.60 3.58 3.02 -0.52 -4.95 115.26 113.55 1bpw n ASN 455 Ca -0.13 -0.41 0.01 0.00 -0.03 0.00 0.00 54.58 54.02 1bpw n ASN 455 Cb 0.42 -4.34 0.00 0.00 -0.61 0.00 0.00 39.78 35.25 1bpw n ASN 455 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1bpw n THR 456 N -4.57 0.00 -3.63 3.41 5.66 -1.26 -5.03 114.28 108.86 1bpw n THR 456 Ca -0.02 -0.04 -0.03 0.00 -3.05 0.00 0.00 64.05 60.92 1bpw n THR 456 Cb 0.56 0.13 -0.04 0.00 -1.55 0.00 0.00 70.33 69.43 1bpw n THR 456 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 1bpw s TYR 457 N -2.98 -0.07 0.00 1.09 6.14 -1.26 -4.78 117.35 115.48 1bpw s TYR 457 Ca 0.06 0.11 0.00 0.00 0.64 0.00 0.00 57.07 57.88 1bpw s TYR 457 Cb -0.00 0.49 0.00 0.00 0.42 0.00 0.00 41.96 42.87 1bpw s TYR 457 CO -0.00 -0.08 0.00 0.43 0.64 0.00 0.00 175.55 176.54 1bpw n SER 458 N 0.39 -3.39 -4.73 4.32 7.64 -1.26 -4.81 113.62 111.77 1bpw n SER 458 Ca -0.00 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.47 1bpw n SER 458 Cb 0.58 -1.55 -0.04 0.00 -1.01 0.00 0.00 64.21 62.19 1bpw n SER 458 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1bpw s ILE 459 N -1.83 4.31 -0.42 0.44 -1.09 -1.26 -5.00 121.20 116.35 1bpw s ILE 459 Ca 0.00 1.90 0.06 0.00 -2.23 0.00 0.00 60.65 60.38 1bpw s ILE 459 Cb 0.00 -4.21 0.22 0.00 -1.58 0.00 0.00 42.46 36.89 1bpw s ILE 459 CO 0.00 0.28 0.47 -1.20 -1.23 0.00 0.00 174.94 173.27 1bpw n SER 460 N 2.81 0.24 -4.74 3.58 7.64 -1.26 -5.11 113.62 116.78 1bpw n SER 460 Ca 0.03 -2.64 -0.36 0.00 1.01 0.00 0.00 58.87 56.90 1bpw n SER 460 Cb 0.48 -0.62 0.05 0.00 -1.01 0.00 0.00 64.21 63.11 1bpw n SER 460 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1bpw s PRO 461 N -0.85 2.82 0.32 1.43 0.04 -1.26 -4.96 135.00 132.53 1bpw s PRO 461 Ca 0.34 1.94 0.17 0.00 0.04 0.00 0.00 61.00 63.50 1bpw s PRO 461 Cb 0.12 -1.92 0.25 0.00 0.04 0.00 0.00 34.50 33.00 1bpw s PRO 461 CO -0.14 -1.36 1.53 -0.39 0.04 0.00 0.00 177.00 176.69 1bpw h VAL 462 N 0.79 0.81 0.00 -0.36 -1.51 -1.98 -3.24 116.25 110.76 1bpw h VAL 462 Ca -0.51 -1.97 -0.00 0.00 -1.23 0.00 0.00 66.70 62.99 1bpw h VAL 462 Cb 1.31 2.27 -0.00 0.00 -2.13 0.00 0.00 31.29 32.74 1bpw h VAL 462 CO 0.54 0.43 -0.02 -0.33 -1.23 0.00 0.00 177.57 176.97 1bpw h GLU 463 N 0.00 0.00 -6.61 5.19 3.07 -1.95 0.11 114.58 114.39 1bpw h GLU 463 Ca -0.00 0.00 -0.65 0.00 -0.50 0.00 0.00 59.36 58.20 1bpw h GLU 463 Cb 1.24 0.00 -0.18 0.00 -0.84 0.00 0.00 28.75 28.97 1bpw h GLU 463 CO 0.06 0.02 -0.80 0.14 -1.40 0.00 0.00 179.01 177.02 1bpw s VAL 464 N -4.30 2.55 0.70 3.13 -7.23 -1.22 -4.34 120.40 109.69 1bpw s VAL 464 Ca -0.04 -1.90 -0.15 0.00 -1.81 0.00 0.00 61.98 58.08 1bpw s VAL 464 Cb 0.13 -2.22 0.02 0.00 0.56 0.00 0.00 36.38 34.87 1bpw s VAL 464 CO 0.49 -0.08 1.15 -2.84 -0.31 0.00 0.00 175.10 173.51 1bpw s PRO 465 N -2.62 2.47 -0.13 4.82 0.02 -1.25 -3.15 135.00 135.16 1bpw s PRO 465 Ca 0.21 1.54 -0.05 0.00 0.02 0.00 0.00 61.00 62.71 1bpw s PRO 465 Cb -0.08 -1.90 0.06 0.00 0.02 0.00 0.00 34.50 32.60 1bpw s PRO 465 CO 0.11 -1.53 0.28 0.12 -0.33 0.00 0.00 177.00 175.64 1bpw s PHE 466 N -2.22 -0.44 0.10 6.54 5.36 0.08 -4.93 117.98 122.47 1bpw s PHE 466 Ca 0.70 0.99 -0.23 0.00 -0.96 0.00 0.00 56.93 57.43 1bpw s PHE 466 Cb -0.24 0.02 0.08 0.00 -0.34 0.00 0.00 43.02 42.54 1bpw s PHE 466 CO 0.44 -0.34 1.09 0.41 -1.46 0.00 0.00 175.22 175.36 1bpw n GLY 467 N 5.11 0.46 4.03 13.12 0.00 -1.26 -1.64 105.19 125.02 1bpw n GLY 467 Ca -0.10 -1.10 -0.20 0.00 0.00 0.00 0.00 46.02 44.61 1bpw n GLY 467 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1bpw s GLY 468 N -3.57 1.76 0.26 -0.02 0.00 -1.26 -4.15 107.32 100.34 1bpw s GLY 468 Ca 0.25 -2.12 0.06 0.00 0.00 0.00 0.00 44.72 42.91 1bpw s GLY 468 CO 0.03 -1.73 -0.05 -0.19 0.00 0.00 0.00 173.10 171.16 1bpw s TYR 469 N -2.72 1.82 0.00 1.90 1.51 0.43 -4.48 117.35 115.81 1bpw s TYR 469 Ca 0.60 -0.76 0.00 0.00 -1.01 0.00 0.00 57.07 55.91 1bpw s TYR 469 Cb -0.05 -1.03 0.00 0.00 -0.11 0.00 0.00 41.96 40.77 1bpw s TYR 469 CO 0.38 0.19 0.00 1.63 -1.11 0.00 0.00 175.55 176.64 1bpw n LYS 470 N -0.52 0.00 -0.35 -0.62 5.02 -1.26 -1.04 118.16 119.39 1bpw n LYS 470 Ca -0.06 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.27 1bpw n LYS 470 Cb 0.63 0.00 0.17 0.00 -0.02 0.00 0.00 35.03 35.81 1bpw n LYS 470 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1bpw n MET 471 N 14.00 2.52 -0.03 1.97 2.81 -0.92 -3.39 117.12 134.08 1bpw n MET 471 Ca 0.00 -1.29 0.13 0.00 -1.81 0.00 0.00 57.70 54.73 1bpw n MET 471 Cb 0.00 -1.75 0.35 0.00 -0.71 0.00 0.00 33.22 31.11 1bpw n MET 471 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1bpw n SER 472 N 0.28 2.13 0.00 7.83 7.64 -0.20 -4.71 113.62 126.59 1bpw n SER 472 Ca 0.11 -1.72 0.00 0.00 1.01 0.00 0.00 58.87 58.27 1bpw n SER 472 Cb 0.60 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 1bpw n SER 472 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bpw n GLY 473 N 1.25 -0.58 3.32 0.23 0.00 -1.22 -0.91 105.19 107.29 1bpw n GLY 473 Ca 0.17 -2.24 -0.10 0.00 0.00 0.00 0.00 46.02 43.85 1bpw n GLY 473 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1bpw s PHE 474 N -0.35 -0.14 0.00 1.61 -0.12 0.04 -3.74 117.98 115.28 1bpw s PHE 474 Ca 0.00 -0.19 0.00 0.00 -0.05 0.00 0.00 56.93 56.69 1bpw s PHE 474 Cb 0.00 0.22 0.00 0.00 -0.63 0.00 0.00 43.02 42.61 1bpw s PHE 474 CO 0.00 -0.70 0.00 0.41 -0.05 0.00 0.00 175.22 174.88 1bpw n GLY 475 N -0.22 1.56 3.14 1.99 0.00 -1.26 -1.74 105.19 108.67 1bpw n GLY 475 Ca -0.15 -1.98 -0.11 0.00 0.00 0.00 0.00 46.02 43.78 1bpw n GLY 475 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bpw s ARG 476 N -2.23 0.75 0.10 1.61 1.81 -1.26 -4.41 118.95 115.32 1bpw s ARG 476 Ca 0.00 -1.19 0.08 0.00 -1.72 0.00 0.00 55.73 52.90 1bpw s ARG 476 Cb 0.00 -0.21 -0.03 0.00 -0.45 0.00 0.00 34.95 34.25 1bpw s ARG 476 CO 0.00 -0.00 -0.20 -2.00 -0.68 0.00 0.00 175.30 172.41 1bpw s GLU 477 N -3.27 1.10 0.50 3.54 2.56 -0.65 -4.57 118.70 117.91 1bpw s GLU 477 Ca 0.06 -1.15 0.00 0.00 0.00 0.00 0.00 54.97 53.88 1bpw s GLU 477 Cb 0.02 -1.35 0.00 0.00 2.00 0.00 0.00 34.13 34.79 1bpw s GLU 477 CO -0.04 0.31 0.00 0.09 -0.56 0.00 0.00 175.26 175.07 1bpw n ASN 478 N 1.09 -7.32 -0.43 -1.70 3.02 -1.26 -0.74 115.26 107.93 1bpw n ASN 478 Ca -0.20 1.14 0.06 0.00 -0.03 0.00 0.00 54.58 55.55 1bpw n ASN 478 Cb 0.54 -4.32 -0.02 0.00 -0.61 0.00 0.00 39.78 35.37 1bpw n ASN 478 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bpw n GLY 479 N -4.10 -2.11 0.22 7.41 0.00 0.38 -3.76 105.19 103.23 1bpw n GLY 479 Ca -0.06 -1.38 -0.10 0.00 0.00 0.00 0.00 46.02 44.47 1bpw n GLY 479 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1bpw h GLN 480 N -0.41 0.62 -0.94 1.61 4.20 -1.86 -3.24 115.11 115.08 1bpw h GLN 480 Ca -0.02 -0.37 0.24 0.00 0.06 0.00 0.00 58.65 58.56 1bpw h GLN 480 Cb 0.40 0.03 -0.17 0.00 0.30 0.00 0.00 27.48 28.04 1bpw h GLN 480 CO 0.01 0.98 0.01 0.00 -0.67 0.00 0.00 178.83 179.16 1bpw h ALA 481 N 0.95 1.05 -0.85 3.87 0.00 -1.95 -1.70 119.26 120.62 1bpw h ALA 481 Ca 0.02 0.32 0.22 0.00 0.00 0.00 0.00 54.91 55.47 1bpw h ALA 481 Cb 1.05 0.56 -0.13 0.00 0.00 0.00 0.00 17.79 19.27 1bpw h ALA 481 CO 0.10 -0.52 0.23 1.15 0.00 0.00 0.00 179.25 180.21 1bpw h THR 482 N 0.04 0.37 -0.96 0.00 2.02 -1.70 -1.88 112.91 110.79 1bpw h THR 482 Ca 0.55 -0.08 0.28 0.00 0.77 0.00 0.00 66.41 67.93 1bpw h THR 482 Cb 1.08 0.11 -0.04 0.00 -1.74 0.00 0.00 68.15 67.56 1bpw h THR 482 CO -0.87 0.04 0.91 -0.37 0.37 0.00 0.00 175.52 175.60 1bpw h VAL 483 N 0.24 0.21 0.00 3.16 -1.51 -1.54 1.28 116.25 118.08 1bpw h VAL 483 Ca 0.52 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.99 1bpw h VAL 483 Cb 1.02 0.30 0.00 0.00 -2.13 0.00 0.00 31.29 30.49 1bpw h VAL 483 CO -0.62 0.00 0.00 0.47 -1.23 0.00 0.00 177.57 176.19 1bpw n ASP 484 N -3.67 0.00 -0.36 4.19 8.00 -0.71 -2.56 116.55 121.44 1bpw n ASP 484 Ca 0.21 0.48 0.11 0.00 0.71 0.00 0.00 54.79 56.29 1bpw n ASP 484 Cb 1.22 -0.49 0.01 0.00 -0.02 0.00 0.00 41.12 41.84 1bpw n ASP 484 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1bpw n TYR 485 N -1.49 0.00 -1.19 1.24 4.01 0.44 -4.12 117.16 116.05 1bpw n TYR 485 Ca 0.05 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.88 1bpw n TYR 485 Cb 0.24 -0.02 0.12 0.00 -0.31 0.00 0.00 39.34 39.37 1bpw n TYR 485 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1bpw n TYR 486 N -0.41 0.00 -3.73 -0.72 4.02 -1.06 -5.03 117.16 110.23 1bpw n TYR 486 Ca 0.08 -0.86 -0.10 0.00 -0.01 0.00 0.00 57.90 57.02 1bpw n TYR 486 Cb 0.43 -0.14 -0.05 0.00 -0.02 0.00 0.00 39.34 39.56 1bpw n TYR 486 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1bpw s SER 487 N -2.60 -0.16 0.07 7.72 1.04 -1.08 -3.96 113.70 114.71 1bpw s SER 487 Ca 0.27 -0.47 0.01 0.00 0.48 0.00 0.00 55.95 56.24 1bpw s SER 487 Cb 0.24 0.48 -0.04 0.00 0.10 0.00 0.00 66.02 66.80 1bpw s SER 487 CO 0.03 -0.90 -0.05 0.00 0.98 0.00 0.00 173.24 173.30 1bpw s GLN 488 N -3.85 0.66 -0.21 4.02 -2.07 0.16 -4.80 119.66 113.57 1bpw s GLN 488 Ca 0.07 -1.15 -0.06 0.00 -1.82 0.00 0.00 55.36 52.40 1bpw s GLN 488 Cb 0.02 -0.03 -0.02 0.00 -1.09 0.00 0.00 33.01 31.88 1bpw s GLN 488 CO -0.08 -0.05 0.02 -0.51 -1.32 0.00 0.00 175.29 173.35 1bpw s LEU 489 N -2.66 3.29 -0.15 2.60 1.43 -1.26 -0.48 118.68 121.44 1bpw s LEU 489 Ca 0.05 -0.21 -0.12 0.00 -1.03 0.00 0.00 54.13 52.82 1bpw s LEU 489 Cb 0.03 -1.85 -0.05 0.00 0.03 0.00 0.00 46.19 44.36 1bpw s LEU 489 CO -0.06 0.04 0.23 -0.75 0.23 0.00 0.00 176.35 176.04 1bpw s LYS 490 N 1.17 4.09 -0.22 1.70 2.20 -0.75 -4.91 119.74 123.02 1bpw s LYS 490 Ca 0.03 -0.00 -0.13 0.00 -0.36 0.00 0.00 55.97 55.51 1bpw s LYS 490 Cb -0.14 -3.37 -0.05 0.00 -1.51 0.00 0.00 37.83 32.76 1bpw s LYS 490 CO 0.02 0.37 0.27 0.99 -0.36 0.00 0.00 175.35 176.64 1bpw s THR 491 N 0.09 5.29 -0.24 3.43 2.01 -1.26 -1.32 115.64 123.63 1bpw s THR 491 Ca 0.14 0.42 0.01 0.00 0.31 0.00 0.00 61.69 62.57 1bpw s THR 491 Cb -0.13 -3.60 0.04 0.00 0.01 0.00 0.00 72.50 68.82 1bpw s THR 491 CO 0.03 0.31 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.47 1bpw s VAL 492 N 1.13 2.41 -0.18 3.82 1.01 0.32 -4.99 120.40 123.92 1bpw s VAL 492 Ca 0.13 -1.31 -0.06 0.00 0.00 0.00 0.00 61.98 60.73 1bpw s VAL 492 Cb -0.14 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 1bpw s VAL 492 CO 0.06 0.14 0.04 -0.63 0.00 0.00 0.00 175.10 174.70 1bpw s ILE 493 N 1.21 4.53 -0.21 2.22 1.01 -1.26 -0.44 121.20 128.26 1bpw s ILE 493 Ca -0.03 -0.13 0.01 0.00 0.00 0.00 0.00 60.65 60.50 1bpw s ILE 493 Cb -0.18 -3.03 0.04 0.00 0.01 0.00 0.00 42.46 39.31 1bpw s ILE 493 CO -0.06 0.46 -0.11 0.54 0.00 0.00 0.00 174.94 175.77 1bpw s VAL 494 N 0.43 1.75 -0.12 2.92 0.11 0.08 -5.00 120.40 120.57 1bpw s VAL 494 Ca 0.01 -1.12 -0.30 0.00 -2.93 0.00 0.00 61.98 57.65 1bpw s VAL 494 Cb -0.13 -1.82 -0.02 0.00 -1.53 0.00 0.00 36.38 32.87 1bpw s VAL 494 CO 0.01 0.15 1.25 -0.70 -3.33 0.00 0.00 175.10 172.48 1bpw s GLU 495 N 1.34 4.27 0.14 1.54 2.56 -1.26 -2.44 118.70 124.86 1bpw s GLU 495 Ca -0.02 1.69 0.23 0.00 0.00 0.00 0.00 54.97 56.87 1bpw s GLU 495 Cb -0.17 -3.69 0.17 0.00 2.00 0.00 0.00 34.13 32.45 1bpw s GLU 495 CO -0.08 -0.62 1.18 0.52 -0.56 0.00 0.00 175.26 175.70 1bpw h MET 496 N 7.96 0.00 0.00 4.30 2.86 -1.91 -3.48 114.93 124.66 1bpw h MET 496 Ca -0.30 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.34 1bpw h MET 496 Cb 1.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.79 1bpw h MET 496 CO 0.94 0.00 0.00 0.41 1.06 0.00 0.00 176.91 179.32 1bpw n GLY 497 N 1.28 2.77 3.90 8.32 0.00 -1.26 -5.07 105.19 115.13 1bpw n GLY 497 Ca 0.02 -0.28 -0.24 0.00 0.00 0.00 0.00 46.02 45.52 1bpw n GLY 497 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bpw s ASP 498 N 1.00 6.01 0.27 1.61 1.01 -1.26 -5.09 116.67 120.22 1bpw s ASP 498 Ca 0.00 0.00 -0.30 0.00 0.71 0.00 0.00 52.55 52.97 1bpw s ASP 498 Cb 0.00 -1.70 -0.09 0.00 1.01 0.00 0.00 42.92 42.13 1bpw s ASP 498 CO 0.00 0.01 1.08 -0.69 0.21 0.00 0.00 175.17 175.78 1bpw s VAL 499 N -1.88 3.58 -0.48 -1.27 1.01 -1.26 -4.99 120.40 115.11 1bpw s VAL 499 Ca 0.33 1.58 -0.17 0.00 0.00 0.00 0.00 61.98 63.72 1bpw s VAL 499 Cb -0.10 -4.01 0.06 0.00 0.00 0.00 0.00 36.38 32.34 1bpw s VAL 499 CO 0.27 0.37 0.49 -1.81 0.00 0.00 0.00 175.10 174.42 1bpw s ASP 500 N -0.88 6.18 0.05 3.32 1.01 -1.26 -5.04 116.67 120.05 1bpw s ASP 500 Ca 0.44 -1.13 0.05 0.00 0.71 0.00 0.00 52.55 52.62 1bpw s ASP 500 Cb -0.31 -2.23 -0.04 0.00 1.01 0.00 0.00 42.92 41.35 1bpw s ASP 500 CO 0.40 -0.74 -0.07 -0.55 0.21 0.00 0.00 175.17 174.41 1bpw s SER 501 N 2.60 4.57 -0.06 0.27 0.15 -1.26 -4.98 113.70 114.99 1bpw s SER 501 Ca 0.09 -0.25 0.16 0.00 0.70 0.00 0.00 55.95 56.65 1bpw s SER 501 Cb -0.22 -0.99 0.55 0.00 -1.71 0.00 0.00 66.02 63.66 1bpw s SER 501 CO 0.09 0.23 1.44 0.18 1.20 0.00 0.00 173.24 176.38 1bpw n LEU 502 N 1.10 3.61 0.00 3.45 4.77 -1.26 -5.33 117.00 123.34 1bpw n LEU 502 Ca -0.14 -1.82 0.00 0.00 -0.03 0.00 0.00 56.01 54.02 1bpw n LEU 502 Cb 0.52 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1bpw n LEU 502 CO 0.33 0.70 0.00 0.49 -1.33 0.00 0.00 177.39 177.58