#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2occ h PHE 2 N 0.00 0.91 0.37 2.03 3.57 -2.03 -2.43 116.94 119.35 2occ h PHE 2 Ca 0.00 -0.24 -0.02 0.00 3.53 0.00 0.00 57.97 61.25 2occ h PHE 2 Cb 0.00 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.54 2occ h PHE 2 CO 0.00 0.98 -0.18 0.82 -2.23 0.00 0.00 178.31 177.71 2occ h ILE 3 N 0.57 0.64 -0.74 1.41 5.03 -2.00 0.38 117.51 122.80 2occ h ILE 3 Ca 0.08 -0.28 0.12 0.00 -0.12 0.00 0.00 64.86 64.66 2occ h ILE 3 Cb 0.76 0.78 -0.05 0.00 -3.03 0.00 0.00 36.82 35.28 2occ h ILE 3 CO 0.06 0.05 0.49 0.78 -0.68 0.00 0.00 178.15 178.86 2occ h ASN 4 N -0.66 0.49 0.02 1.72 4.21 -1.94 0.24 115.58 119.66 2occ h ASN 4 Ca -0.05 0.02 -0.10 0.00 1.21 0.00 0.00 56.30 57.38 2occ h ASN 4 Cb 0.47 -0.08 -0.01 0.00 -1.12 0.00 0.00 38.32 37.58 2occ h ASN 4 CO 0.08 0.28 -0.53 -0.09 -1.29 0.00 0.00 177.43 175.88 2occ h ARG 5 N 0.54 0.04 0.00 0.81 2.43 -1.23 -3.23 114.38 113.73 2occ h ARG 5 Ca 0.35 -0.07 -0.12 0.00 -0.81 0.00 0.00 59.98 59.34 2occ h ARG 5 Cb 0.64 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.20 2occ h ARG 5 CO -0.12 1.03 -1.61 0.91 -1.51 0.00 0.00 179.97 178.66 2occ n TRP 6 N -4.47 0.59 -0.04 2.20 7.02 0.13 -3.52 117.44 119.35 2occ n TRP 6 Ca -0.18 0.19 0.00 0.00 -1.02 0.00 0.00 57.50 56.49 2occ n TRP 6 Cb 0.59 -0.90 -0.12 0.00 -2.42 0.00 0.00 31.31 28.47 2occ n TRP 6 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2occ n LEU 7 N -2.66 0.00 -0.61 -0.99 4.77 0.72 -4.54 117.00 113.69 2occ n LEU 7 Ca -0.09 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 55.96 2occ n LEU 7 Cb 0.75 0.18 0.21 0.00 -2.33 0.00 0.00 43.42 42.23 2occ n LEU 7 CO 0.43 0.18 0.64 0.49 -1.33 0.00 0.00 177.39 177.80 2occ n PHE 8 N -2.28 0.58 -1.56 -1.77 3.72 -0.53 -5.01 117.46 110.60 2occ n PHE 8 Ca -0.13 -1.04 -0.39 0.00 -0.05 0.00 0.00 57.45 55.85 2occ n PHE 8 Cb 0.69 -0.27 0.04 0.00 -0.94 0.00 0.00 39.48 38.99 2occ n PHE 8 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2occ n SER 9 N -0.95 0.20 -1.37 4.37 2.88 -1.22 -4.88 113.62 112.65 2occ n SER 9 Ca 0.21 0.83 0.03 0.00 -1.33 0.00 0.00 58.87 58.61 2occ n SER 9 Cb 0.81 -1.30 0.02 0.00 -0.75 0.00 0.00 64.21 62.98 2occ n SER 9 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2occ n THR 10 N -1.47 0.00 -4.56 2.46 -2.24 -1.26 -4.69 114.28 102.52 2occ n THR 10 Ca 0.12 -0.86 -0.33 0.00 -2.27 0.00 0.00 64.05 60.71 2occ n THR 10 Cb 0.46 0.93 -0.15 0.00 -2.10 0.00 0.00 70.33 69.46 2occ n THR 10 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2occ s ASN 11 N -1.85 3.64 0.48 3.42 3.84 -1.26 -4.84 114.94 118.37 2occ s ASN 11 Ca 0.29 -0.47 0.18 0.00 0.21 0.00 0.00 52.86 53.07 2occ s ASN 11 Cb 0.33 -1.56 1.19 0.00 -0.55 0.00 0.00 41.25 40.67 2occ s ASN 11 CO -0.15 0.09 2.01 1.12 -2.79 0.00 0.00 177.10 177.39 2occ h HIS 12 N 7.26 0.22 -0.00 0.43 2.07 -1.91 -1.53 115.15 121.68 2occ h HIS 12 Ca -0.32 0.01 -0.06 0.00 -2.85 0.00 0.00 60.37 57.14 2occ h HIS 12 Cb 1.19 -0.07 0.01 0.00 2.57 0.00 0.00 27.41 31.11 2occ h HIS 12 CO 0.50 0.10 -0.25 0.87 -3.07 0.00 0.00 177.93 176.09 2occ h LYS 13 N 0.20 0.18 -0.72 5.12 1.57 -1.90 -2.30 116.57 118.72 2occ h LYS 13 Ca 0.22 -0.18 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 2occ h LYS 13 Cb 0.60 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.93 2occ h LYS 13 CO -0.04 0.92 0.25 -0.44 -0.57 0.00 0.00 179.45 179.57 2occ h ASP 14 N -0.49 1.02 -0.53 0.86 3.32 -1.85 -1.66 116.42 117.09 2occ h ASP 14 Ca -0.03 -0.17 -0.07 0.00 0.02 0.00 0.00 57.03 56.78 2occ h ASP 14 Cb 1.00 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 40.27 2occ h ASP 14 CO 0.05 0.93 0.04 0.40 -1.72 0.00 0.00 179.24 178.94 2occ h ILE 15 N 1.06 1.26 -0.48 0.35 2.04 -1.38 -1.40 117.51 118.96 2occ h ILE 15 Ca 0.24 -1.03 -0.00 0.00 1.00 0.00 0.00 64.86 65.07 2occ h ILE 15 Cb 0.26 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 2occ h ILE 15 CO -0.01 0.37 0.28 1.23 0.00 0.00 0.00 178.15 180.01 2occ h GLY 16 N 0.78 0.70 1.14 5.37 0.00 -1.13 -1.81 103.07 108.13 2occ h GLY 16 Ca 0.16 -0.28 -0.17 0.00 0.00 0.00 0.00 47.33 47.03 2occ h GLY 16 CO 0.02 0.28 -0.45 -0.84 0.00 0.00 0.00 176.54 175.54 2occ h THR 17 N 0.66 1.27 -0.41 4.70 2.02 -0.83 -2.10 112.91 118.23 2occ h THR 17 Ca 0.17 -1.63 0.03 0.00 0.77 0.00 0.00 66.41 65.76 2occ h THR 17 Cb -0.01 1.47 -0.03 0.00 -1.74 0.00 0.00 68.15 67.84 2occ h THR 17 CO -0.03 0.54 0.20 -0.07 0.37 0.00 0.00 175.52 176.53 2occ h LEU 18 N 0.73 0.30 -0.31 2.58 4.07 -0.57 -1.11 115.31 121.01 2occ h LEU 18 Ca 0.04 0.02 -0.00 0.00 0.08 0.00 0.00 57.88 58.02 2occ h LEU 18 Cb 1.05 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.74 2occ h LEU 18 CO 0.11 0.21 0.19 1.88 -1.08 0.00 0.00 178.44 179.75 2occ h TYR 19 N 0.41 0.40 -0.46 1.13 0.05 -1.24 0.35 116.97 117.61 2occ h TYR 19 Ca 0.18 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.93 2occ h TYR 19 Cb 0.08 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 37.67 2occ h TYR 19 CO -0.10 0.29 0.17 -0.07 -1.05 0.00 0.00 178.16 177.39 2occ h LEU 20 N 0.40 0.60 -0.22 3.88 3.38 -0.98 -0.04 115.31 122.33 2occ h LEU 20 Ca 0.11 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 2occ h LEU 20 Cb -0.00 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2occ h LEU 20 CO -0.02 0.56 -0.12 -0.07 0.09 0.00 0.00 178.44 178.88 2occ h LEU 21 N 0.65 0.48 0.11 1.67 3.38 -0.55 -1.53 115.31 119.52 2occ h LEU 21 Ca 0.16 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 2occ h LEU 21 Cb 0.16 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2occ h LEU 21 CO -0.01 0.79 -0.05 0.15 0.09 0.00 0.00 178.44 179.41 2occ h PHE 22 N 0.17 -0.14 -0.59 1.13 3.57 -0.44 -2.20 116.94 118.44 2occ h PHE 22 Ca 0.05 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.58 2occ h PHE 22 Cb 0.62 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.37 2occ h PHE 22 CO 0.07 -0.09 0.39 0.78 -2.23 0.00 0.00 178.31 177.23 2occ h GLY 23 N -0.15 0.78 0.95 2.40 0.00 -1.05 -0.59 103.07 105.42 2occ h GLY 23 Ca -0.01 -0.27 -0.08 0.00 0.00 0.00 0.00 47.33 46.96 2occ h GLY 23 CO 0.02 0.24 -0.10 0.00 0.00 0.00 0.00 176.54 176.70 2occ h ALA 24 N 1.66 0.50 0.00 3.60 0.00 -0.99 -1.62 119.26 122.41 2occ h ALA 24 Ca 0.24 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2occ h ALA 24 Cb 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2occ h ALA 24 CO -0.06 0.37 -0.00 2.35 0.00 0.00 0.00 179.25 181.90 2occ h TRP 25 N 0.51 -0.00 -0.63 0.00 7.01 -0.80 -2.58 115.95 119.45 2occ h TRP 25 Ca 0.09 -0.00 0.11 0.00 2.11 0.00 0.00 58.89 61.20 2occ h TRP 25 Cb 0.61 0.00 -0.04 0.00 -2.10 0.00 0.00 29.16 27.63 2occ h TRP 25 CO 0.05 0.17 0.42 0.00 -2.79 0.00 0.00 178.44 176.29 2occ h ALA 26 N 0.83 2.03 0.00 2.65 0.00 -1.11 -0.46 119.26 123.19 2occ h ALA 26 Ca -0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2occ h ALA 26 Cb 0.17 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2occ h ALA 26 CO 0.00 -0.18 -0.19 0.78 0.00 0.00 0.00 179.25 179.67 2occ h GLY 27 N 0.42 0.00 0.92 0.00 0.00 -0.88 0.12 103.07 103.64 2occ h GLY 27 Ca 0.30 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.43 2occ h GLY 27 CO -0.08 0.00 -0.74 -0.33 0.00 0.00 0.00 176.54 175.38 2occ h MET 28 N 0.00 0.51 -0.27 4.80 2.07 -0.96 -1.59 114.93 119.49 2occ h MET 28 Ca -0.00 -0.54 0.01 0.00 -2.07 0.00 0.00 59.70 57.10 2occ h MET 28 Cb 0.42 0.15 -0.02 0.00 -1.87 0.00 0.00 31.60 30.28 2occ h MET 28 CO 0.02 1.18 0.16 0.28 1.07 0.00 0.00 176.91 179.62 2occ h VAL 29 N 0.06 1.03 -0.15 -2.22 2.07 -1.18 -0.59 116.25 115.27 2occ h VAL 29 Ca -0.09 -0.11 -0.04 0.00 0.82 0.00 0.00 66.70 67.28 2occ h VAL 29 Cb 1.44 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 2occ h VAL 29 CO 0.15 0.06 -0.09 1.23 0.02 0.00 0.00 177.57 178.94 2occ h GLY 30 N 0.32 0.24 1.26 2.17 0.00 -0.82 -1.81 103.07 104.43 2occ h GLY 30 Ca 0.10 -0.14 -0.21 0.00 0.00 0.00 0.00 47.33 47.09 2occ h GLY 30 CO -0.05 0.13 -0.75 -0.84 0.00 0.00 0.00 176.54 175.03 2occ h THR 31 N 0.22 1.29 -0.49 4.70 2.02 -0.52 -2.11 112.91 118.03 2occ h THR 31 Ca 0.05 -1.98 -0.03 0.00 0.77 0.00 0.00 66.41 65.22 2occ h THR 31 Cb 0.30 1.97 -0.02 0.00 -1.74 0.00 0.00 68.15 68.66 2occ h THR 31 CO 0.02 0.62 0.20 0.00 0.37 0.00 0.00 175.52 176.73 2occ h ALA 32 N 0.64 0.63 -0.87 6.16 0.00 -0.56 -2.30 119.26 122.97 2occ h ALA 32 Ca -0.04 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 2occ h ALA 32 Cb 1.37 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 2occ h ALA 32 CO 0.15 0.23 0.47 -0.07 0.00 0.00 0.00 179.25 180.03 2occ h LEU 33 N 0.64 1.09 -1.51 0.00 3.38 -1.33 -1.31 115.31 116.27 2occ h LEU 33 Ca 0.16 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 2occ h LEU 33 Cb 0.18 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2occ h LEU 33 CO -0.01 0.88 -0.21 0.77 0.09 0.00 0.00 178.44 179.95 2occ h SER 34 N 1.22 0.00 0.77 -0.43 4.64 -0.95 -2.22 113.55 116.57 2occ h SER 34 Ca 0.30 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.38 2occ h SER 34 Cb 0.04 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.10 2occ h SER 34 CO -0.05 0.21 -1.27 -0.07 -0.87 0.00 0.00 176.83 174.79 2occ h LEU 35 N 0.00 0.07 -1.01 5.97 3.38 -0.81 -2.82 115.31 120.09 2occ h LEU 35 Ca -0.00 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 2occ h LEU 35 Cb 0.55 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2occ h LEU 35 CO 0.03 1.08 -0.03 -0.07 0.09 0.00 0.00 178.44 179.54 2occ h LEU 36 N 0.01 0.65 0.21 1.67 3.38 -0.83 0.38 115.31 120.78 2occ h LEU 36 Ca -0.12 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 2occ h LEU 36 Cb 1.88 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.46 2occ h LEU 36 CO 0.12 0.74 -0.10 0.40 0.09 0.00 0.00 178.44 179.69 2occ h ILE 37 N 0.63 0.86 0.00 1.22 2.04 -1.43 -2.37 117.51 118.46 2occ h ILE 37 Ca 0.12 -0.31 -0.04 0.00 1.00 0.00 0.00 64.86 65.64 2occ h ILE 37 Cb 0.44 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 2occ h ILE 37 CO 0.02 0.07 -0.18 0.03 0.00 0.00 0.00 178.15 178.09 2occ h ARG 38 N -0.43 0.00 -0.28 2.37 2.47 -1.37 -2.76 114.38 114.37 2occ h ARG 38 Ca -0.03 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.62 2occ h ARG 38 Cb 0.33 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.64 2occ h ARG 38 CO 0.05 0.18 -0.12 0.00 0.56 0.00 0.00 179.97 180.64 2occ h ALA 39 N 1.82 0.39 -0.84 0.04 0.00 -0.74 -1.40 119.26 118.53 2occ h ALA 39 Ca -0.00 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.61 2occ h ALA 39 Cb 0.69 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 2occ h ALA 39 CO 0.02 0.26 0.56 1.49 0.00 0.00 0.00 179.25 181.58 2occ h GLU 40 N 0.32 1.09 -0.18 0.00 4.57 -1.24 -2.91 114.58 116.23 2occ h GLU 40 Ca 0.06 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2occ h GLU 40 Cb 0.63 -0.25 0.00 0.00 -0.16 0.00 0.00 28.75 28.97 2occ h GLU 40 CO 0.04 0.72 0.00 1.28 -1.18 0.00 0.00 179.01 179.87 2occ n LEU 41 N -4.41 2.64 -0.05 1.64 4.77 -1.06 -4.38 117.00 116.15 2occ n LEU 41 Ca 0.10 -1.03 0.15 0.00 -0.03 0.00 0.00 56.01 55.20 2occ n LEU 41 Cb 0.04 -0.11 0.77 0.00 -2.33 0.00 0.00 43.42 41.79 2occ n LEU 41 CO 0.36 0.51 1.01 0.61 -1.33 0.00 0.00 177.39 178.55 2occ n GLY 42 N 1.33 -1.07 3.40 -0.72 0.00 -0.54 -4.48 105.19 103.12 2occ n GLY 42 Ca 0.17 -0.20 -0.12 0.00 0.00 0.00 0.00 46.02 45.87 2occ n GLY 42 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2occ s GLN 43 N -2.36 0.57 0.50 1.61 0.74 -1.26 -4.51 119.66 114.94 2occ s GLN 43 Ca 0.35 0.77 -0.23 0.00 0.05 0.00 0.00 55.36 56.29 2occ s GLN 43 Cb 0.21 0.22 -0.07 0.00 1.10 0.00 0.00 33.01 34.47 2occ s GLN 43 CO 0.43 -0.09 1.26 -2.30 -0.55 0.00 0.00 175.29 174.04 2occ n PRO 44 N 3.20 1.68 0.00 1.67 -0.02 -1.26 -4.75 135.00 135.51 2occ n PRO 44 Ca -0.16 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 2occ n PRO 44 Cb 0.56 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 2occ n PRO 44 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2occ n GLY 45 N 0.87 -0.35 3.18 -1.23 0.00 -1.26 -5.01 105.19 101.38 2occ n GLY 45 Ca 0.09 -2.23 -0.28 0.00 0.00 0.00 0.00 46.02 43.60 2occ n GLY 45 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2occ s THR 46 N 0.00 1.67 -0.23 2.61 -4.23 -1.26 -4.67 115.64 109.53 2occ s THR 46 Ca 0.00 -0.84 -0.14 0.00 -1.18 0.00 0.00 61.69 59.52 2occ s THR 46 Cb 0.00 -1.43 -0.09 0.00 1.34 0.00 0.00 72.50 72.32 2occ s THR 46 CO 0.00 0.47 -0.33 -0.11 -0.54 0.00 0.00 174.62 174.11 2occ n LEU 47 N 3.14 1.85 -0.02 4.79 7.94 -1.26 -4.82 117.00 128.61 2occ n LEU 47 Ca -0.18 0.32 -0.17 0.00 -1.11 0.00 0.00 56.01 54.87 2occ n LEU 47 Cb 0.53 -0.75 -0.14 0.00 0.53 0.00 0.00 43.42 43.59 2occ n LEU 47 CO 0.25 0.27 0.22 -0.07 -1.11 0.00 0.00 177.39 176.95 2occ h LEU 48 N -0.93 0.20 0.00 -1.96 3.38 -1.96 -3.51 115.31 110.53 2occ h LEU 48 Ca -0.45 -0.97 0.00 0.00 0.09 0.00 0.00 57.88 56.55 2occ h LEU 48 Cb 1.37 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.05 2occ h LEU 48 CO -0.27 1.18 0.00 0.61 0.09 0.00 0.00 178.44 180.05 2occ n GLY 49 N 1.63 0.01 3.60 0.83 0.00 -1.26 -5.04 105.19 104.97 2occ n GLY 49 Ca -0.12 -1.11 -0.29 0.00 0.00 0.00 0.00 46.02 44.49 2occ n GLY 49 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2occ s ASP 50 N -4.00 1.59 0.16 1.61 1.47 -1.26 -4.79 116.67 111.45 2occ s ASP 50 Ca 0.00 1.00 0.10 0.00 1.18 0.00 0.00 52.55 54.83 2occ s ASP 50 Cb 0.00 -1.53 0.54 0.00 -0.34 0.00 0.00 42.92 41.59 2occ s ASP 50 CO 0.00 -3.75 1.27 0.47 0.68 0.00 0.00 175.17 173.84 2occ n ASP 51 N -4.56 0.26 0.09 2.11 8.00 -1.26 -2.37 116.55 118.82 2occ n ASP 51 Ca 0.08 0.59 -0.09 0.00 0.71 0.00 0.00 54.79 56.08 2occ n ASP 51 Cb 0.58 -0.61 -0.05 0.00 -0.02 0.00 0.00 41.12 41.02 2occ n ASP 51 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 2occ h GLN 52 N 0.00 -0.31 -0.14 -1.24 5.75 -1.94 0.51 115.11 117.74 2occ h GLN 52 Ca 0.00 0.02 -0.04 0.00 -0.15 0.00 0.00 58.65 58.48 2occ h GLN 52 Cb 0.11 0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 2occ h GLN 52 CO 0.00 -0.01 -0.08 0.97 -2.65 0.00 0.00 178.83 177.06 2occ h ILE 53 N -1.00 1.14 -0.00 2.39 6.09 -1.84 -1.08 117.51 123.22 2occ h ILE 53 Ca -0.03 -0.61 -0.00 0.00 -1.37 0.00 0.00 64.86 62.85 2occ h ILE 53 Cb 0.43 1.13 -0.00 0.00 0.47 0.00 0.00 36.82 38.85 2occ h ILE 53 CO 0.05 0.19 -0.00 0.22 -3.07 0.00 0.00 178.15 175.55 2occ h TYR 54 N 0.21 0.00 0.00 2.19 3.20 -1.51 -2.87 116.97 118.18 2occ h TYR 54 Ca 0.05 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.92 2occ h TYR 54 Cb 0.28 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.55 2occ h TYR 54 CO 0.00 0.36 0.00 -0.91 -1.64 0.00 0.00 178.16 175.98 2occ h ASN 55 N -0.36 0.00 -0.34 -2.11 2.35 -0.48 -0.22 115.58 114.42 2occ h ASN 55 Ca 0.00 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.59 2occ h ASN 55 Cb 0.36 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.73 2occ h ASN 55 CO 0.00 0.00 -0.41 0.58 -1.65 0.00 0.00 177.43 175.95 2occ h VAL 56 N 0.00 1.27 -0.25 2.81 2.07 -1.16 -1.03 116.25 119.96 2occ h VAL 56 Ca 0.00 -1.59 -0.12 0.00 0.82 0.00 0.00 66.70 65.81 2occ h VAL 56 Cb 0.55 1.43 -0.00 0.00 -1.52 0.00 0.00 31.29 31.75 2occ h VAL 56 CO 0.00 0.53 -0.30 0.58 0.02 0.00 0.00 177.57 178.40 2occ h VAL 57 N 0.73 1.31 -0.51 2.57 2.07 -1.01 -2.18 116.25 119.24 2occ h VAL 57 Ca 0.05 -1.48 -0.07 0.00 0.82 0.00 0.00 66.70 66.02 2occ h VAL 57 Cb 1.01 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.44 2occ h VAL 57 CO 0.10 0.47 0.02 0.58 0.02 0.00 0.00 177.57 178.76 2occ h VAL 58 N 0.36 1.24 -0.17 2.57 2.07 -1.04 -1.74 116.25 119.53 2occ h VAL 58 Ca 0.03 -0.99 -0.05 0.00 0.82 0.00 0.00 66.70 66.50 2occ h VAL 58 Cb 0.87 0.83 -0.00 0.00 -1.52 0.00 0.00 31.29 31.47 2occ h VAL 58 CO 0.07 0.36 -0.11 0.74 0.02 0.00 0.00 177.57 178.65 2occ h THR 59 N 0.78 1.32 -0.20 2.57 2.02 -1.13 -2.85 112.91 115.43 2occ h THR 59 Ca 0.15 -1.19 -0.08 0.00 0.77 0.00 0.00 66.41 66.06 2occ h THR 59 Cb 0.44 1.73 -0.01 0.00 -1.74 0.00 0.00 68.15 68.57 2occ h THR 59 CO 0.02 0.36 -0.24 0.00 0.37 0.00 0.00 175.52 176.02 2occ h ALA 60 N 0.67 1.22 -0.29 6.16 0.00 -1.34 -2.37 119.26 123.31 2occ h ALA 60 Ca 0.04 -0.32 0.03 0.00 0.00 0.00 0.00 54.91 54.65 2occ h ALA 60 Cb 0.60 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2occ h ALA 60 CO 0.03 0.51 0.12 1.25 0.00 0.00 0.00 179.25 181.16 2occ h HIS 61 N 0.33 0.23 -0.20 0.00 6.17 -1.22 -1.36 115.15 119.09 2occ h HIS 61 Ca 0.05 0.01 -0.01 0.00 0.71 0.00 0.00 60.37 61.14 2occ h HIS 61 Cb 0.61 -0.06 -0.01 0.00 2.52 0.00 0.00 27.41 30.47 2occ h HIS 61 CO 0.01 0.11 0.09 0.00 0.71 0.00 0.00 177.93 178.86 2occ h ALA 62 N 1.17 0.26 -0.55 5.26 0.00 -1.21 -2.33 119.26 121.85 2occ h ALA 62 Ca 0.12 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2occ h ALA 62 Cb 0.07 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2occ h ALA 62 CO -0.11 -0.16 0.11 0.74 0.00 0.00 0.00 179.25 179.83 2occ h PHE 63 N 0.19 0.96 0.15 0.00 0.04 -1.27 -1.94 116.94 115.05 2occ h PHE 63 Ca 0.07 -0.12 -0.01 0.00 2.80 0.00 0.00 57.97 60.71 2occ h PHE 63 Cb 0.15 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 38.03 2occ h PHE 63 CO -0.02 0.84 -0.07 0.28 -0.60 0.00 0.00 178.31 178.74 2occ h VAL 64 N 0.80 0.92 -0.43 -0.55 2.07 -1.25 0.55 116.25 118.36 2occ h VAL 64 Ca 0.17 -0.28 -0.05 0.00 0.82 0.00 0.00 66.70 67.37 2occ h VAL 64 Cb 0.38 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 2occ h VAL 64 CO 0.01 0.07 0.07 0.24 0.02 0.00 0.00 177.57 177.97 2occ h MET 65 N -0.33 0.65 0.00 1.57 2.86 -1.41 -1.38 114.93 116.90 2occ h MET 65 Ca -0.02 -0.13 -0.02 0.00 -2.06 0.00 0.00 59.70 57.47 2occ h MET 65 Cb 0.26 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 31.82 2occ h MET 65 CO 0.03 0.62 -0.28 0.82 1.06 0.00 0.00 176.91 179.16 2occ h ILE 66 N 0.63 0.31 0.00 -1.22 2.04 -1.25 -1.43 117.51 116.60 2occ h ILE 66 Ca 0.14 -1.28 -0.16 0.00 1.00 0.00 0.00 64.86 64.56 2occ h ILE 66 Cb 0.29 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 2occ h ILE 66 CO 0.00 0.11 -0.84 -0.26 0.00 0.00 0.00 178.15 177.15 2occ h PHE 67 N -1.00 0.00 -0.00 1.37 -1.00 -1.00 -2.95 116.94 112.36 2occ h PHE 67 Ca -0.03 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.75 2occ h PHE 67 Cb 0.41 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.97 2occ h PHE 67 CO -0.03 0.74 -0.55 1.19 -1.61 0.00 0.00 178.31 178.06 2occ n PHE 68 N -3.24 0.00 0.00 -0.55 3.72 -0.61 -4.35 117.46 112.43 2occ n PHE 68 Ca -0.01 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.39 2occ n PHE 68 Cb 0.84 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.38 2occ n PHE 68 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 176.76 176.59 2occ n MET 69 N -1.08 0.00 -0.06 -1.08 1.56 -0.67 -4.17 117.12 111.62 2occ n MET 69 Ca 0.03 0.00 -0.08 0.00 -0.27 0.00 0.00 57.70 57.38 2occ n MET 69 Cb 0.22 -0.04 -0.02 0.00 2.15 0.00 0.00 33.22 35.53 2occ n MET 69 CO 0.00 0.00 0.00 0.28 -0.73 0.00 0.00 175.97 175.52 2occ h VAL 70 N -0.00 0.90 -0.21 1.12 2.07 -1.37 -2.50 116.25 116.27 2occ h VAL 70 Ca 0.00 -0.05 -0.08 0.00 0.82 0.00 0.00 66.70 67.38 2occ h VAL 70 Cb 0.00 0.74 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 2occ h VAL 70 CO 0.00 0.03 -0.20 0.24 0.02 0.00 0.00 177.57 177.66 2occ h MET 71 N 0.15 0.50 -0.69 1.57 2.07 -1.76 -1.75 114.93 115.02 2occ h MET 71 Ca 0.11 -0.26 -0.01 0.00 -2.07 0.00 0.00 59.70 57.47 2occ h MET 71 Cb 0.10 0.01 -0.03 0.00 -1.87 0.00 0.00 31.60 29.81 2occ h MET 71 CO -0.14 0.84 0.40 -1.35 1.07 0.00 0.00 176.91 177.74 2occ h PRO 72 N 0.18 0.94 0.47 -0.22 0.11 -1.75 -1.43 132.00 130.30 2occ h PRO 72 Ca 0.03 -0.09 -0.02 0.00 0.11 0.00 0.00 66.00 66.03 2occ h PRO 72 Cb 0.75 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.67 2occ h PRO 72 CO 0.05 0.68 -0.22 0.82 -0.21 0.00 0.00 178.00 179.12 2occ h ILE 73 N 0.94 0.36 -0.29 4.15 2.04 -1.44 0.36 117.51 123.62 2occ h ILE 73 Ca 0.25 -0.51 -0.04 0.00 1.00 0.00 0.00 64.86 65.56 2occ h ILE 73 Cb -0.01 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 2occ h ILE 73 CO -0.04 0.06 0.04 0.24 0.00 0.00 0.00 178.15 178.45 2occ h MET 74 N -0.99 0.49 0.00 2.37 2.86 -1.38 -1.09 114.93 117.19 2occ h MET 74 Ca -0.06 -0.14 -0.09 0.00 -2.06 0.00 0.00 59.70 57.35 2occ h MET 74 Cb 0.58 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.17 2occ h MET 74 CO 0.10 0.61 -0.87 -0.89 1.06 0.00 0.00 176.91 176.92 2occ n ILE 75 N -4.63 1.46 0.10 -1.22 5.41 -0.55 -2.90 119.36 117.04 2occ n ILE 75 Ca -0.03 0.11 -0.03 0.00 1.00 0.00 0.00 62.75 63.81 2occ n ILE 75 Cb 0.22 -2.26 0.17 0.00 -0.71 0.00 0.00 39.64 37.06 2occ n ILE 75 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2occ h GLY 76 N -1.00 0.20 0.00 7.39 0.00 -1.22 -1.93 103.07 106.51 2occ h GLY 76 Ca -0.14 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 46.96 2occ h GLY 76 CO -0.08 0.21 0.00 0.61 0.00 0.00 0.00 176.54 177.28 2occ n GLY 77 N 0.09 1.19 0.27 4.60 0.00 0.12 -3.15 105.19 108.31 2occ n GLY 77 Ca -0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.09 2occ n GLY 77 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2occ h PHE 78 N 0.00 0.00 0.42 1.61 0.04 -1.31 -1.99 116.94 115.71 2occ h PHE 78 Ca 0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 2occ h PHE 78 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 2occ h PHE 78 CO 0.00 0.00 -0.20 0.78 -0.60 0.00 0.00 178.31 178.29 2occ h GLY 79 N 0.00 -0.59 1.39 -1.45 0.00 -1.21 -1.50 103.07 99.71 2occ h GLY 79 Ca 0.02 0.22 -0.10 0.00 0.00 0.00 0.00 47.33 47.47 2occ h GLY 79 CO -0.00 -0.21 -0.16 3.43 0.00 0.00 0.00 176.54 179.60 2occ h ASN 80 N -0.79 0.72 0.25 0.19 2.35 -1.48 -1.60 115.58 115.22 2occ h ASN 80 Ca -0.06 -0.23 -0.01 0.00 -0.55 0.00 0.00 56.30 55.45 2occ h ASN 80 Cb 0.54 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.72 2occ h ASN 80 CO 0.09 0.88 -0.12 -0.50 -1.65 0.00 0.00 177.43 176.14 2occ h TRP 81 N 0.65 -0.31 0.04 1.19 4.06 -1.39 -3.39 115.95 116.80 2occ h TRP 81 Ca 0.10 -0.01 -0.29 0.00 2.06 0.00 0.00 58.89 60.76 2occ h TRP 81 Cb 0.63 0.10 -0.03 0.00 -1.00 0.00 0.00 29.16 28.86 2occ h TRP 81 CO 0.03 0.01 -1.58 -0.07 -3.56 0.00 0.00 178.44 173.27 2occ h LEU 82 N -0.65 0.14 0.02 -4.49 3.38 -1.33 -3.38 115.31 109.01 2occ h LEU 82 Ca -0.03 -0.25 0.03 0.00 0.09 0.00 0.00 57.88 57.72 2occ h LEU 82 Cb 0.46 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 2occ h LEU 82 CO 0.06 1.21 -0.24 0.58 0.09 0.00 0.00 178.44 180.14 2occ h VAL 83 N 0.03 0.45 -0.78 1.22 2.07 -1.44 -1.21 116.25 116.59 2occ h VAL 83 Ca -0.24 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 2occ h VAL 83 Cb 1.98 0.45 -0.04 0.00 -1.52 0.00 0.00 31.29 32.16 2occ h VAL 83 CO 0.11 0.00 0.38 -0.65 0.02 0.00 0.00 177.57 177.43 2occ h PRO 84 N -0.39 1.12 -0.27 1.57 0.11 -1.79 -2.48 132.00 129.86 2occ h PRO 84 Ca 0.06 -0.16 -0.00 0.00 0.11 0.00 0.00 66.00 66.00 2occ h PRO 84 Cb 0.46 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 2occ h PRO 84 CO -0.20 0.86 0.14 -0.07 -0.21 0.00 0.00 178.00 178.53 2occ h LEU 85 N 1.09 0.32 0.00 2.35 3.38 -1.68 -0.76 115.31 120.01 2occ h LEU 85 Ca 0.27 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2occ h LEU 85 Cb 0.11 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2occ h LEU 85 CO -0.03 0.26 -0.13 0.24 0.09 0.00 0.00 178.44 178.87 2occ h MET 86 N 0.37 0.00 -0.14 1.13 2.86 -0.78 -3.30 114.93 115.08 2occ h MET 86 Ca 0.10 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 2occ h MET 86 Cb 0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.68 2occ h MET 86 CO -0.02 0.00 0.00 0.44 1.06 0.00 0.00 176.91 178.39 2occ n ILE 87 N -2.75 0.96 -2.67 -1.22 -5.35 -0.73 -4.78 119.36 102.82 2occ n ILE 87 Ca 0.04 -0.98 -0.13 0.00 -0.27 0.00 0.00 62.75 61.41 2occ n ILE 87 Cb 0.50 0.52 0.02 0.00 -1.74 0.00 0.00 39.64 38.94 2occ n ILE 87 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2occ n GLY 88 N -0.07 -0.00 3.88 3.28 0.00 -0.37 -4.05 105.19 107.85 2occ n GLY 88 Ca 0.05 -0.27 -0.34 0.00 0.00 0.00 0.00 46.02 45.45 2occ n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2occ s ALA 89 N -2.89 3.87 0.38 4.61 0.00 -0.73 -4.57 121.76 122.44 2occ s ALA 89 Ca 0.17 -0.76 0.08 0.00 0.00 0.00 0.00 51.96 51.45 2occ s ALA 89 Cb -0.07 -1.85 0.76 0.00 0.00 0.00 0.00 23.12 21.96 2occ s ALA 89 CO 0.21 0.71 1.92 -1.00 0.00 0.00 0.00 175.76 177.59 2occ h PRO 90 N 4.12 0.31 0.00 0.00 0.13 -1.78 -3.41 132.00 131.36 2occ h PRO 90 Ca -0.50 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.56 2occ h PRO 90 Cb 1.20 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2occ h PRO 90 CO 0.65 0.41 0.00 -3.47 -0.23 0.00 0.00 178.00 175.36 2occ n ASP 91 N -4.29 0.00 -4.91 1.44 -0.08 -1.26 -4.59 116.55 102.86 2occ n ASP 91 Ca -0.00 -0.67 -0.28 0.00 -1.51 0.00 0.00 54.79 52.33 2occ n ASP 91 Cb 0.25 0.00 0.07 0.00 2.34 0.00 0.00 41.12 43.78 2occ n ASP 91 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 2occ s MET 92 N -1.02 2.36 0.20 -0.67 -1.94 -1.26 -4.91 119.30 112.06 2occ s MET 92 Ca 0.00 0.04 -0.06 0.00 -1.71 0.00 0.00 55.69 53.96 2occ s MET 92 Cb 0.00 -2.08 0.14 0.00 2.01 0.00 0.00 34.83 34.89 2occ s MET 92 CO 0.00 -1.24 1.62 0.00 -0.01 0.00 0.00 175.02 175.39 2occ h ALA 93 N -0.70 0.83 -2.85 3.03 0.00 -1.93 -3.35 119.26 114.30 2occ h ALA 93 Ca -0.45 -0.37 -0.61 0.00 0.00 0.00 0.00 54.91 53.48 2occ h ALA 93 Cb 1.30 -0.16 -0.41 0.00 0.00 0.00 0.00 17.79 18.52 2occ h ALA 93 CO 0.63 0.64 -0.71 -0.06 0.00 0.00 0.00 179.25 179.75 2occ s PHE 94 N -4.67 2.69 0.46 0.00 0.08 -1.26 -4.96 117.98 110.32 2occ s PHE 94 Ca -0.10 -2.97 0.13 0.00 0.12 0.00 0.00 56.93 54.11 2occ s PHE 94 Cb 0.13 -2.09 1.04 0.00 -0.57 0.00 0.00 43.02 41.53 2occ s PHE 94 CO 0.85 -0.65 2.04 -1.35 -0.10 0.00 0.00 175.22 176.00 2occ h PRO 95 N 5.54 0.10 0.09 0.24 0.11 -1.89 -0.87 132.00 135.32 2occ h PRO 95 Ca 0.18 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 66.11 2occ h PRO 95 Cb 0.81 -0.02 0.02 0.00 0.11 0.00 0.00 31.00 31.92 2occ h PRO 95 CO 0.59 0.17 -0.69 -0.09 -0.21 0.00 0.00 178.00 177.78 2occ h ARG 96 N 0.10 0.31 -0.33 1.05 2.43 -1.88 -2.98 114.38 113.07 2occ h ARG 96 Ca 0.02 -0.45 -0.03 0.00 -0.81 0.00 0.00 59.98 58.71 2occ h ARG 96 Cb 0.18 0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 2occ h ARG 96 CO 0.01 1.18 0.08 1.98 -1.51 0.00 0.00 179.97 181.71 2occ h MET 97 N -0.34 0.48 -0.93 0.20 4.05 -1.91 -0.33 114.93 116.16 2occ h MET 97 Ca -0.11 -0.08 -0.01 0.00 -0.28 0.00 0.00 59.70 59.23 2occ h MET 97 Cb 1.50 -0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 32.17 2occ h MET 97 CO 0.13 0.45 0.55 -0.97 0.23 0.00 0.00 176.91 177.31 2occ h ASN 98 N 0.48 1.12 0.11 1.39 -1.24 -1.20 -1.19 115.58 115.05 2occ h ASN 98 Ca 0.11 -0.07 -0.07 0.00 0.71 0.00 0.00 56.30 56.98 2occ h ASN 98 Cb 0.19 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 38.95 2occ h ASN 98 CO -0.00 0.86 -0.23 -1.13 -1.29 0.00 0.00 177.43 175.64 2occ h ASN 99 N 1.28 0.21 -0.08 1.15 -1.24 -0.89 -2.39 115.58 113.63 2occ h ASN 99 Ca 0.33 -0.06 -0.12 0.00 0.71 0.00 0.00 56.30 57.16 2occ h ASN 99 Cb -0.04 -0.06 -0.01 0.00 0.73 0.00 0.00 38.32 38.94 2occ h ASN 99 CO -0.06 0.46 -0.35 -0.03 -1.29 0.00 0.00 177.43 176.16 2occ h MET 100 N 0.20 0.57 -0.94 6.67 4.05 -0.95 -2.33 114.93 122.20 2occ h MET 100 Ca 0.03 -0.27 0.13 0.00 -0.28 0.00 0.00 59.70 59.32 2occ h MET 100 Cb 0.53 -0.01 -0.09 0.00 -0.80 0.00 0.00 31.60 31.23 2occ h MET 100 CO 0.04 0.84 0.56 0.77 0.23 0.00 0.00 176.91 179.35 2occ h SER 101 N 0.48 0.79 -0.01 1.39 0.02 -0.85 -1.88 113.55 113.49 2occ h SER 101 Ca 0.05 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.05 2occ h SER 101 Cb 0.83 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.28 2occ h SER 101 CO 0.07 0.40 -0.03 0.15 -1.14 0.00 0.00 176.83 176.27 2occ h PHE 102 N 0.86 0.06 0.00 3.45 3.57 -1.40 -3.31 116.94 120.17 2occ h PHE 102 Ca 0.48 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.96 2occ h PHE 102 Cb 0.54 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.27 2occ h PHE 102 CO -0.03 0.62 0.00 0.91 -2.23 0.00 0.00 178.31 177.58 2occ n TRP 103 N -4.77 0.46 0.16 0.41 7.02 -0.90 -1.90 117.44 117.92 2occ n TRP 103 Ca -0.09 0.20 0.04 0.00 -1.02 0.00 0.00 57.50 56.63 2occ n TRP 103 Cb 0.31 -0.82 0.17 0.00 -2.42 0.00 0.00 31.31 28.55 2occ n TRP 103 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 2occ h LEU 104 N 0.00 0.00 -0.01 -0.99 3.38 -1.43 -3.36 115.31 112.90 2occ h LEU 104 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2occ h LEU 104 Cb 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 2occ h LEU 104 CO 0.00 0.46 0.00 -0.07 0.09 0.00 0.00 178.44 178.92 2occ h LEU 105 N 0.00 0.01 -0.23 1.67 4.07 -1.52 -1.95 115.31 117.36 2occ h LEU 105 Ca -0.00 -0.28 0.02 0.00 0.08 0.00 0.00 57.88 57.70 2occ h LEU 105 Cb 1.18 -0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.89 2occ h LEU 105 CO 0.06 0.29 0.08 -0.65 -1.08 0.00 0.00 178.44 177.14 2occ h PRO 106 N -0.27 0.19 -0.77 1.13 0.11 -1.71 -0.77 132.00 129.90 2occ h PRO 106 Ca 0.00 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 66.19 2occ h PRO 106 Cb 0.28 -0.04 -0.07 0.00 0.11 0.00 0.00 31.00 31.28 2occ h PRO 106 CO 0.00 0.12 0.43 -1.35 -0.21 0.00 0.00 178.00 176.99 2occ h PRO 107 N 0.19 0.71 -0.84 1.05 0.11 -1.72 -1.24 132.00 130.26 2occ h PRO 107 Ca 0.10 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 66.20 2occ h PRO 107 Cb 0.06 -0.16 -0.05 0.00 0.11 0.00 0.00 31.00 30.97 2occ h PRO 107 CO -0.10 0.47 0.54 1.03 -0.21 0.00 0.00 178.00 179.73 2occ h SER 108 N 0.73 0.91 -0.52 -2.05 0.87 -0.96 -1.63 113.55 110.89 2occ h SER 108 Ca 0.37 -0.01 -0.12 0.00 -1.23 0.00 0.00 61.79 60.80 2occ h SER 108 Cb 0.33 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.07 2occ h SER 108 CO -0.24 0.63 -0.15 0.15 -0.53 0.00 0.00 176.83 176.69 2occ h PHE 109 N 1.06 1.15 -0.09 2.24 3.04 -0.18 -2.48 116.94 121.69 2occ h PHE 109 Ca 0.33 -0.26 0.02 0.00 3.98 0.00 0.00 57.97 62.04 2occ h PHE 109 Cb -0.02 -0.28 -0.02 0.00 2.56 0.00 0.00 35.95 38.19 2occ h PHE 109 CO -0.02 1.09 -0.05 1.25 -2.02 0.00 0.00 178.31 178.55 2occ h LEU 110 N 0.89 -0.17 -1.40 0.59 5.85 -0.64 0.12 115.31 120.56 2occ h LEU 110 Ca 0.13 0.04 0.10 0.00 0.84 0.00 0.00 57.88 58.99 2occ h LEU 110 Cb 0.73 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.80 2occ h LEU 110 CO 0.06 -0.07 0.50 -0.07 -0.34 0.00 0.00 178.44 178.52 2occ h LEU 111 N -0.05 0.61 -0.31 2.25 3.38 -1.18 0.42 115.31 120.42 2occ h LEU 111 Ca 0.05 0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.88 2occ h LEU 111 Cb 0.13 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 2occ h LEU 111 CO -0.12 0.36 -0.43 0.25 0.09 0.00 0.00 178.44 178.59 2occ h LEU 112 N 0.67 0.91 -0.95 1.67 5.85 -0.74 -1.71 115.31 121.01 2occ h LEU 112 Ca 0.35 -0.50 -0.09 0.00 0.84 0.00 0.00 57.88 58.48 2occ h LEU 112 Cb 0.48 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 2occ h LEU 112 CO -0.13 1.24 -0.25 -0.07 -0.34 0.00 0.00 178.44 178.88 2occ h LEU 113 N 0.61 0.47 -0.81 2.25 3.38 0.69 -2.80 115.31 119.10 2occ h LEU 113 Ca 0.03 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.75 2occ h LEU 113 Cb 1.03 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 2occ h LEU 113 CO 0.10 0.72 -0.15 0.00 0.09 0.00 0.00 178.44 179.20 2occ h ALA 114 N 1.32 0.99 0.00 1.53 0.00 -0.06 -2.70 119.26 120.34 2occ h ALA 114 Ca 0.06 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 2occ h ALA 114 Cb 0.66 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2occ h ALA 114 CO 0.05 0.60 -0.07 0.66 0.00 0.00 0.00 179.25 180.49 2occ h SER 115 N 0.67 0.00 0.01 0.00 4.64 -1.04 -0.94 113.55 116.89 2occ h SER 115 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 2occ h SER 115 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 2occ h SER 115 CO 0.04 0.07 -0.03 -1.54 -0.87 0.00 0.00 176.83 174.50 2occ n SER 116 N -4.03 1.58 -0.08 4.97 3.41 -1.02 -3.73 113.62 114.71 2occ n SER 116 Ca -0.03 -1.48 -0.09 0.00 -0.26 0.00 0.00 58.87 57.02 2occ n SER 116 Cb 0.16 0.02 -0.11 0.00 -0.26 0.00 0.00 64.21 64.01 2occ n SER 116 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 2occ n MET 117 N 0.18 1.24 -2.96 4.33 2.81 -0.40 -4.47 117.12 117.85 2occ n MET 117 Ca 0.18 0.02 -0.32 0.00 -1.81 0.00 0.00 57.70 55.77 2occ n MET 117 Cb 0.38 -1.40 -0.05 0.00 -0.71 0.00 0.00 33.22 31.44 2occ n MET 117 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2occ s VAL 118 N -2.38 4.68 0.00 2.03 -7.23 -0.91 -4.89 120.40 111.69 2occ s VAL 118 Ca -0.12 0.91 0.00 0.00 -1.81 0.00 0.00 61.98 60.95 2occ s VAL 118 Cb 0.05 -3.66 0.00 0.00 0.56 0.00 0.00 36.38 33.33 2occ s VAL 118 CO 0.59 -0.35 0.00 -0.62 -0.31 0.00 0.00 175.10 174.41 2occ n GLU 119 N -0.79 0.00 -0.45 4.82 -0.58 -1.26 -2.11 120.64 120.26 2occ n GLU 119 Ca 0.04 0.00 0.08 0.00 -0.42 0.00 0.00 57.16 56.86 2occ n GLU 119 Cb 0.54 0.00 0.26 0.00 -0.57 0.00 0.00 31.44 31.67 2occ n GLU 119 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2occ n ALA 120 N 8.45 2.99 -0.55 0.62 0.00 -1.26 -5.09 120.51 125.66 2occ n ALA 120 Ca 0.00 -2.21 0.07 0.00 0.00 0.00 0.00 53.44 51.30 2occ n ALA 120 Cb 0.00 -0.72 -0.02 0.00 0.00 0.00 0.00 19.45 18.71 2occ n ALA 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2occ n GLY 121 N -0.38 -1.78 3.33 0.00 0.00 -0.90 -4.69 105.19 100.77 2occ n GLY 121 Ca 0.21 -1.38 -0.46 0.00 0.00 0.00 0.00 46.02 44.40 2occ n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2occ s ALA 122 N -1.86 3.59 -0.87 4.61 0.00 -1.25 -4.82 121.76 121.16 2occ s ALA 122 Ca 0.00 -2.44 -0.00 0.00 0.00 0.00 0.00 51.96 49.52 2occ s ALA 122 Cb 0.00 -3.32 0.34 0.00 0.00 0.00 0.00 23.12 20.14 2occ s ALA 122 CO 0.00 -2.08 1.75 0.41 0.00 0.00 0.00 175.76 175.84 2occ n GLY 123 N 5.25 5.87 0.00 0.00 0.00 -1.26 -4.31 105.19 110.74 2occ n GLY 123 Ca -0.13 -2.58 0.10 0.00 0.00 0.00 0.00 46.02 43.41 2occ n GLY 123 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2occ n THR 124 N -0.28 0.00 0.00 2.61 -2.24 -1.26 -4.77 114.28 108.34 2occ n THR 124 Ca 0.47 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 62.13 2occ n THR 124 Cb 0.30 0.77 0.00 0.00 -2.10 0.00 0.00 70.33 69.30 2occ n THR 124 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2occ n GLY 125 N 1.44 -0.09 0.10 3.38 0.00 -1.26 -3.92 105.19 104.84 2occ n GLY 125 Ca 0.02 -1.64 0.09 0.00 0.00 0.00 0.00 46.02 44.49 2occ n GLY 125 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2occ n TRP 126 N 0.18 0.53 0.69 1.61 4.27 -1.26 -1.28 117.44 122.19 2occ n TRP 126 Ca 0.00 0.24 0.13 0.00 -3.89 0.00 0.00 57.50 53.98 2occ n TRP 126 Cb 0.00 -0.88 0.37 0.00 -1.36 0.00 0.00 31.31 29.43 2occ n TRP 126 CO 0.00 0.00 0.00 0.25 -2.29 0.00 0.00 177.69 175.65 2occ n THR 127 N -2.01 0.41 -4.04 -1.67 -2.24 -1.26 -4.95 114.28 98.51 2occ n THR 127 Ca 0.01 -0.22 -0.29 0.00 -2.27 0.00 0.00 64.05 61.28 2occ n THR 127 Cb 0.13 -0.40 -0.08 0.00 -2.10 0.00 0.00 70.33 67.88 2occ n THR 127 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2occ n VAL 128 N -2.06 -0.58 -2.07 2.28 3.14 -0.41 -4.89 118.33 113.74 2occ n VAL 128 Ca 0.05 -0.29 -0.41 0.00 -2.96 0.00 0.00 64.34 60.73 2occ n VAL 128 Cb 0.41 -0.71 -0.02 0.00 -1.06 0.00 0.00 33.84 32.46 2occ n VAL 128 CO 0.00 0.00 0.00 -0.31 -6.46 0.00 0.00 176.83 170.06 2occ s TYR 129 N -3.77 3.07 0.45 1.45 1.51 -1.26 -4.68 117.35 114.11 2occ s TYR 129 Ca 0.22 1.15 -0.05 0.00 -1.01 0.00 0.00 57.07 57.37 2occ s TYR 129 Cb -0.13 -3.75 -0.04 0.00 -0.11 0.00 0.00 41.96 37.93 2occ s TYR 129 CO 0.85 -2.35 0.75 -1.25 -1.11 0.00 0.00 175.55 172.44 2occ s PRO 130 N -0.63 3.58 0.34 -1.71 0.04 -1.26 -1.79 135.00 133.57 2occ s PRO 130 Ca 0.57 0.18 0.26 0.00 0.04 0.00 0.00 61.00 62.05 2occ s PRO 130 Cb -0.40 -2.42 0.81 0.00 0.04 0.00 0.00 34.50 32.53 2occ s PRO 130 CO 0.44 -0.13 1.75 -1.35 0.04 0.00 0.00 177.00 177.76 2occ h PRO 131 N 0.50 0.00 -0.68 0.56 0.11 -1.94 -3.45 132.00 127.10 2occ h PRO 131 Ca -0.47 0.00 0.16 0.00 0.11 0.00 0.00 66.00 65.79 2occ h PRO 131 Cb 1.20 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 2occ h PRO 131 CO 0.62 0.00 0.46 1.25 -0.21 0.00 0.00 178.00 180.13 2occ h LEU 132 N 0.00 0.23 -0.53 2.35 5.85 -1.95 0.12 115.31 121.38 2occ h LEU 132 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2occ h LEU 132 Cb 0.70 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.69 2occ h LEU 132 CO 0.00 0.12 -0.20 0.00 -0.34 0.00 0.00 178.44 178.01 2occ n ALA 133 N -2.58 2.97 -1.33 1.25 0.00 -0.74 -3.68 120.51 116.41 2occ n ALA 133 Ca 0.13 -0.39 -0.29 0.00 0.00 0.00 0.00 53.44 52.88 2occ n ALA 133 Cb 0.58 -1.16 0.18 0.00 0.00 0.00 0.00 19.45 19.05 2occ n ALA 133 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2occ s GLY 134 N -2.43 1.59 0.00 0.00 0.00 0.42 -4.77 107.32 102.14 2occ s GLY 134 Ca 0.27 -0.66 0.05 0.00 0.00 0.00 0.00 44.72 44.38 2occ s GLY 134 CO 0.49 0.03 0.83 1.16 0.00 0.00 0.00 173.10 175.60 2occ n ASN 135 N -4.19 0.00 -0.06 1.64 0.23 -1.26 -1.80 115.26 109.82 2occ n ASN 135 Ca 0.09 -0.95 -0.11 0.00 -0.53 0.00 0.00 54.58 53.07 2occ n ASN 135 Cb 0.59 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 38.25 2occ n ASN 135 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 2occ n LEU 136 N -0.65 1.57 0.24 -4.53 0.00 -1.26 -3.69 117.00 108.68 2occ n LEU 136 Ca 0.04 0.26 0.15 0.00 0.00 0.00 0.00 56.01 56.45 2occ n LEU 136 Cb 0.02 -0.60 0.45 0.00 0.00 0.00 0.00 43.42 43.29 2occ n LEU 136 CO 0.03 -0.13 0.91 0.00 0.00 0.00 0.00 177.39 178.20 2occ h ALA 137 N -0.69 1.00 -1.82 1.96 0.00 -1.76 -3.29 119.26 114.66 2occ h ALA 137 Ca -0.18 0.00 -0.46 0.00 0.00 0.00 0.00 54.91 54.27 2occ h ALA 137 Cb 0.96 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 18.35 2occ h ALA 137 CO -0.11 0.00 -1.19 0.72 0.00 0.00 0.00 179.25 178.68 2occ n HIS 138 N -3.02 0.46 -1.79 0.00 8.25 -0.74 -4.96 115.22 113.42 2occ n HIS 138 Ca 0.02 -3.63 -0.35 0.00 -0.26 0.00 0.00 57.72 53.50 2occ n HIS 138 Cb 0.40 -0.41 0.05 0.00 1.12 0.00 0.00 29.99 31.15 2occ n HIS 138 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2occ s ALA 139 N -2.59 2.40 0.00 -1.41 0.00 -1.24 -4.56 121.76 114.37 2occ s ALA 139 Ca 0.38 0.86 0.00 0.00 0.00 0.00 0.00 51.96 53.20 2occ s ALA 139 Cb 0.37 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 20.06 2occ s ALA 139 CO -0.06 -1.39 0.00 0.41 0.00 0.00 0.00 175.76 174.72 2occ n GLY 140 N 0.24 1.29 0.28 0.00 0.00 -1.26 -4.80 105.19 100.94 2occ n GLY 140 Ca 0.13 -2.12 0.17 0.00 0.00 0.00 0.00 46.02 44.20 2occ n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2occ h ALA 141 N 0.00 1.02 -0.16 4.61 0.00 -1.94 -3.38 119.26 119.41 2occ h ALA 141 Ca 0.00 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.91 2occ h ALA 141 Cb 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 2occ h ALA 141 CO 0.00 0.05 -0.48 0.77 0.00 0.00 0.00 179.25 179.58 2occ h SER 142 N 0.00 -1.54 -0.12 0.00 0.02 -1.85 0.50 113.55 110.55 2occ h SER 142 Ca -0.00 0.19 -0.03 0.00 -0.84 0.00 0.00 61.79 61.11 2occ h SER 142 Cb 0.46 0.61 -0.01 0.00 0.14 0.00 0.00 62.40 63.59 2occ h SER 142 CO 0.00 -0.42 0.01 0.58 -1.14 0.00 0.00 176.83 175.87 2occ h VAL 143 N -0.49 1.13 -0.31 2.27 2.07 -1.86 -1.23 116.25 117.83 2occ h VAL 143 Ca 0.03 -0.50 -0.13 0.00 0.82 0.00 0.00 66.70 66.92 2occ h VAL 143 Cb 0.59 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 2occ h VAL 143 CO -0.41 0.17 -0.34 0.44 0.02 0.00 0.00 177.57 177.45 2occ h ASP 144 N 0.30 0.72 -0.24 0.57 3.32 -1.52 -0.44 116.42 119.13 2occ h ASP 144 Ca 0.07 -0.30 -0.09 0.00 0.02 0.00 0.00 57.03 56.73 2occ h ASP 144 Cb 0.19 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 2occ h ASP 144 CO 0.00 1.00 -0.15 -0.07 -1.72 0.00 0.00 179.24 178.30 2occ h LEU 145 N 0.58 0.66 -0.53 1.55 3.38 -0.29 -1.75 115.31 118.91 2occ h LEU 145 Ca 0.06 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 2occ h LEU 145 Cb 0.85 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 2occ h LEU 145 CO 0.07 0.83 -0.05 0.74 0.09 0.00 0.00 178.44 180.12 2occ h THR 146 N 0.60 1.27 -0.60 0.22 2.02 -0.83 -1.72 112.91 113.87 2occ h THR 146 Ca 0.10 -1.18 -0.06 0.00 0.77 0.00 0.00 66.41 66.04 2occ h THR 146 Cb 0.60 0.96 -0.02 0.00 -1.74 0.00 0.00 68.15 67.94 2occ h THR 146 CO 0.04 0.42 0.15 0.40 0.37 0.00 0.00 175.52 176.89 2occ h ILE 147 N 0.84 1.25 -0.35 3.11 2.04 -0.69 -2.45 117.51 121.25 2occ h ILE 147 Ca 0.14 -0.91 -0.08 0.00 1.00 0.00 0.00 64.86 65.02 2occ h ILE 147 Cb 0.60 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 2occ h ILE 147 CO 0.04 0.34 -0.12 -0.26 0.00 0.00 0.00 178.15 178.15 2occ h PHE 148 N 0.87 0.67 -0.63 1.37 0.04 -1.19 -1.54 116.94 116.52 2occ h PHE 148 Ca 0.19 -0.11 -0.02 0.00 2.80 0.00 0.00 57.97 60.83 2occ h PHE 148 Cb 0.35 -0.18 -0.03 0.00 2.20 0.00 0.00 35.95 38.30 2occ h PHE 148 CO 0.03 0.71 0.32 1.03 -0.60 0.00 0.00 178.31 179.79 2occ h SER 149 N 0.57 0.82 0.31 2.17 0.87 -1.08 -1.98 113.55 115.21 2occ h SER 149 Ca 0.10 -0.12 -0.08 0.00 -1.23 0.00 0.00 61.79 60.46 2occ h SER 149 Cb 0.53 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.27 2occ h SER 149 CO 0.03 0.71 -0.35 -0.07 -0.53 0.00 0.00 176.83 176.62 2occ h LEU 150 N 0.87 0.07 -0.23 2.23 4.07 -1.15 -2.02 115.31 119.15 2occ h LEU 150 Ca 0.22 -0.02 -0.05 0.00 0.08 0.00 0.00 57.88 58.11 2occ h LEU 150 Cb 0.09 -0.02 -0.01 0.00 1.08 0.00 0.00 40.66 41.81 2occ h LEU 150 CO -0.03 0.41 -0.05 0.45 -1.08 0.00 0.00 178.44 178.14 2occ h HIS 151 N 0.06 0.48 -0.51 1.13 3.86 -0.57 -1.09 115.15 118.51 2occ h HIS 151 Ca 0.01 -0.10 -0.09 0.00 -1.16 0.00 0.00 60.37 59.02 2occ h HIS 151 Cb 0.64 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.97 2occ h HIS 151 CO 0.00 0.66 -0.06 -0.07 0.86 0.00 0.00 177.93 179.33 2occ h LEU 152 N 0.17 0.89 -0.93 2.43 3.38 -1.26 -1.00 115.31 118.98 2occ h LEU 152 Ca 0.06 -0.26 -0.10 0.00 0.09 0.00 0.00 57.88 57.67 2occ h LEU 152 Cb 0.50 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2occ h LEU 152 CO 0.02 0.98 -0.30 0.00 0.09 0.00 0.00 178.44 179.23 2occ h ALA 153 N 1.11 1.10 -0.07 1.53 0.00 -1.34 -0.15 119.26 121.43 2occ h ALA 153 Ca 0.14 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 2occ h ALA 153 Cb 0.57 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2occ h ALA 153 CO 0.03 0.57 -0.08 0.78 0.00 0.00 0.00 179.25 180.55 2occ h GLY 154 N 1.06 0.19 0.69 0.00 0.00 -0.87 -1.66 103.07 102.48 2occ h GLY 154 Ca 0.05 -0.21 0.06 0.00 0.00 0.00 0.00 47.33 47.23 2occ h GLY 154 CO 0.05 0.19 0.37 -2.08 0.00 0.00 0.00 176.54 175.07 2occ h VAL 155 N -0.27 0.97 0.11 4.60 2.07 -1.03 -0.26 116.25 122.44 2occ h VAL 155 Ca 0.01 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 67.31 2occ h VAL 155 Cb 0.61 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 2occ h VAL 155 CO 0.02 0.12 -0.27 -1.28 0.02 0.00 0.00 177.57 176.18 2occ h SER 156 N 0.68 -0.78 0.42 0.57 0.87 -0.92 -1.02 113.55 113.38 2occ h SER 156 Ca 0.29 0.09 -0.04 0.00 -1.23 0.00 0.00 61.79 60.91 2occ h SER 156 Cb 0.17 0.30 -0.01 0.00 -0.44 0.00 0.00 62.40 62.43 2occ h SER 156 CO -0.18 -0.36 -0.18 0.28 -0.53 0.00 0.00 176.83 175.87 2occ h SER 157 N -0.48 0.00 -0.05 6.23 0.02 -0.73 -1.46 113.55 117.08 2occ h SER 157 Ca 0.03 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.84 2occ h SER 157 Cb 0.51 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.06 2occ h SER 157 CO -0.17 0.18 -0.55 0.40 -1.14 0.00 0.00 176.83 175.55 2occ h ILE 158 N 0.00 1.40 -0.83 3.27 2.04 -0.47 -1.16 117.51 121.77 2occ h ILE 158 Ca -0.00 -1.95 -0.04 0.00 1.00 0.00 0.00 64.86 63.87 2occ h ILE 158 Cb 0.43 2.41 -0.04 0.00 -0.74 0.00 0.00 36.82 38.89 2occ h ILE 158 CO 0.02 0.58 0.37 -0.07 0.00 0.00 0.00 178.15 179.04 2occ h LEU 159 N -0.01 1.11 -1.01 1.44 4.07 -0.98 -2.06 115.31 117.87 2occ h LEU 159 Ca -0.06 -0.15 -0.07 0.00 0.08 0.00 0.00 57.88 57.68 2occ h LEU 159 Cb 1.23 -0.29 -0.02 0.00 1.08 0.00 0.00 40.66 42.66 2occ h LEU 159 CO 0.11 0.95 -0.06 1.23 -1.08 0.00 0.00 178.44 179.59 2occ h GLY 160 N 1.19 0.69 1.08 0.83 0.00 -1.25 -2.61 103.07 103.01 2occ h GLY 160 Ca 0.28 -0.47 -0.10 0.00 0.00 0.00 0.00 47.33 47.04 2occ h GLY 160 CO -0.03 0.43 0.00 0.00 0.00 0.00 0.00 176.54 176.95 2occ h ALA 161 N 1.34 0.83 -0.64 3.60 0.00 -0.67 -1.06 119.26 122.65 2occ h ALA 161 Ca 0.11 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 2occ h ALA 161 Cb 0.47 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2occ h ALA 161 CO 0.02 0.67 0.29 0.82 0.00 0.00 0.00 179.25 181.06 2occ h ILE 162 N 0.98 1.22 0.32 0.00 2.04 -1.23 -1.92 117.51 118.92 2occ h ILE 162 Ca 0.17 -0.65 -0.02 0.00 1.00 0.00 0.00 64.86 65.37 2occ h ILE 162 Cb 0.56 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 2occ h ILE 162 CO 0.03 0.26 -0.15 -1.13 0.00 0.00 0.00 178.15 177.16 2occ h ASN 163 N 0.88 -0.36 -0.78 1.72 -1.24 -1.22 -1.84 115.58 112.74 2occ h ASN 163 Ca 0.22 -0.03 -0.01 0.00 0.71 0.00 0.00 56.30 57.19 2occ h ASN 163 Cb 0.14 0.09 -0.04 0.00 0.73 0.00 0.00 38.32 39.25 2occ h ASN 163 CO -0.03 -0.21 0.45 -0.26 -1.29 0.00 0.00 177.43 176.10 2occ h PHE 164 N -0.49 1.04 -0.27 0.67 0.04 -1.16 -1.08 116.94 115.68 2occ h PHE 164 Ca -0.04 -0.01 -0.08 0.00 2.80 0.00 0.00 57.97 60.64 2occ h PHE 164 Cb 0.37 -0.34 -0.01 0.00 2.20 0.00 0.00 35.95 38.17 2occ h PHE 164 CO -0.04 0.71 -0.13 0.82 -0.60 0.00 0.00 178.31 179.07 2occ h ILE 165 N 1.07 1.30 -0.55 -0.55 2.04 -1.29 -1.50 117.51 118.02 2occ h ILE 165 Ca 0.28 -1.22 -0.02 0.00 1.00 0.00 0.00 64.86 64.90 2occ h ILE 165 Cb -0.01 1.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 2occ h ILE 165 CO -0.05 0.38 0.25 0.74 0.00 0.00 0.00 178.15 179.48 2occ h THR 166 N 0.31 1.21 0.66 -0.27 2.02 -1.25 -1.92 112.91 113.66 2occ h THR 166 Ca 0.06 -0.60 -0.03 0.00 0.77 0.00 0.00 66.41 66.61 2occ h THR 166 Cb 0.64 0.59 0.01 0.00 -1.74 0.00 0.00 68.15 67.64 2occ h THR 166 CO 0.04 0.24 -0.32 0.74 0.37 0.00 0.00 175.52 176.59 2occ h THR 167 N 0.74 0.26 -0.23 3.16 2.02 -1.19 0.74 112.91 118.42 2occ h THR 167 Ca 0.19 -0.21 0.07 0.00 0.77 0.00 0.00 66.41 67.23 2occ h THR 167 Cb 0.14 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 66.86 2occ h THR 167 CO -0.02 0.02 0.17 0.40 0.37 0.00 0.00 175.52 176.46 2occ h ILE 168 N -1.05 0.82 0.05 3.11 2.04 -1.28 -1.03 117.51 120.17 2occ h ILE 168 Ca -0.09 0.00 -0.33 0.00 1.00 0.00 0.00 64.86 65.44 2occ h ILE 168 Cb 0.72 0.88 -0.04 0.00 -0.74 0.00 0.00 36.82 37.64 2occ h ILE 168 CO 0.15 0.00 -1.89 -0.38 0.00 0.00 0.00 178.15 176.03 2occ n ILE 169 N -4.38 1.66 0.06 -0.67 5.41 -0.73 -4.58 119.36 116.14 2occ n ILE 169 Ca 0.03 -0.74 0.10 0.00 1.00 0.00 0.00 62.75 63.14 2occ n ILE 169 Cb 0.32 -1.29 -0.16 0.00 -0.71 0.00 0.00 39.64 37.81 2occ n ILE 169 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 2occ n ASN 170 N -3.20 0.36 -1.49 4.38 5.15 0.24 -4.68 115.26 116.02 2occ n ASN 170 Ca -0.25 -0.08 -0.12 0.00 -0.60 0.00 0.00 54.58 53.54 2occ n ASN 170 Cb 1.05 1.87 0.16 0.00 -0.53 0.00 0.00 39.78 42.33 2occ n ASN 170 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 2occ n MET 171 N -2.16 2.18 -3.20 1.20 2.81 -0.41 -5.01 117.12 112.53 2occ n MET 171 Ca -0.03 -3.32 -0.23 0.00 -1.81 0.00 0.00 57.70 52.31 2occ n MET 171 Cb 0.52 -1.96 0.00 0.00 -0.71 0.00 0.00 33.22 31.07 2occ n MET 171 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2occ s LYS 172 N -3.36 3.23 0.35 0.03 1.02 -1.26 -4.44 119.74 115.30 2occ s LYS 172 Ca 0.49 -0.50 -0.29 0.00 0.02 0.00 0.00 55.97 55.69 2occ s LYS 172 Cb 0.43 -2.63 -0.11 0.00 -0.52 0.00 0.00 37.83 34.99 2occ s LYS 172 CO 0.01 -0.07 1.49 -2.30 -0.92 0.00 0.00 175.35 173.57 2occ n PRO 173 N -1.91 2.61 -0.49 -1.68 -0.02 -1.26 -4.82 135.00 127.43 2occ n PRO 173 Ca -0.01 0.92 0.42 0.00 -2.02 0.00 0.00 63.50 62.81 2occ n PRO 173 Cb 0.57 -2.64 0.77 0.00 -0.02 0.00 0.00 33.50 32.17 2occ n PRO 173 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2occ h PRO 174 N 3.41 0.02 0.00 0.52 0.11 -1.95 0.22 132.00 134.33 2occ h PRO 174 Ca -0.49 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2occ h PRO 174 Cb 1.24 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2occ h PRO 174 CO 0.68 0.01 -0.68 0.00 -0.21 0.00 0.00 178.00 177.80 2occ n ALA 175 N -2.81 3.00 -2.66 -0.75 0.00 -1.26 -4.86 120.51 111.17 2occ n ALA 175 Ca 0.34 -0.27 -0.43 0.00 0.00 0.00 0.00 53.44 53.08 2occ n ALA 175 Cb 1.56 -1.14 -0.03 0.00 0.00 0.00 0.00 19.45 19.85 2occ n ALA 175 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 2occ s MET 176 N -3.17 4.27 0.65 0.00 0.00 0.06 -4.97 119.30 116.14 2occ s MET 176 Ca 0.06 1.27 -0.05 0.00 0.00 0.00 0.00 55.69 56.97 2occ s MET 176 Cb 0.14 -3.62 0.04 0.00 0.00 0.00 0.00 34.83 31.39 2occ s MET 176 CO 0.73 -0.54 0.94 -1.54 0.00 0.00 0.00 175.02 174.61 2occ s SER 177 N 1.21 5.10 0.56 1.11 1.04 -1.26 -4.80 113.70 116.66 2occ s SER 177 Ca 0.43 0.44 0.28 0.00 0.48 0.00 0.00 55.95 57.58 2occ s SER 177 Cb -0.16 -1.22 1.68 0.00 0.10 0.00 0.00 66.02 66.42 2occ s SER 177 CO 0.08 -1.37 2.19 -0.61 0.98 0.00 0.00 173.24 174.51 2occ h GLN 178 N -0.36 0.00 -0.71 4.02 5.75 -1.96 -0.58 115.11 121.26 2occ h GLN 178 Ca -0.44 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.06 2occ h GLN 178 Cb 1.30 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.85 2occ h GLN 178 CO 0.59 0.04 0.00 0.66 -2.65 0.00 0.00 178.83 177.47 2occ n TYR 179 N -3.79 0.33 -0.68 3.99 4.01 -1.26 -2.85 117.16 116.90 2occ n TYR 179 Ca -0.03 -0.12 0.02 0.00 -0.16 0.00 0.00 57.90 57.61 2occ n TYR 179 Cb 0.14 -0.13 0.02 0.00 -0.31 0.00 0.00 39.34 39.06 2occ n TYR 179 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2occ n GLN 180 N 0.05 1.52 -3.70 -0.72 6.02 -0.23 -5.05 117.38 115.28 2occ n GLN 180 Ca 0.05 -1.33 -0.35 0.00 -0.01 0.00 0.00 57.00 55.36 2occ n GLN 180 Cb 0.34 -0.88 -0.05 0.00 1.02 0.00 0.00 30.24 30.67 2occ n GLN 180 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2occ s THR 181 N -0.91 5.24 0.89 5.09 -4.23 -1.13 -4.92 115.64 115.67 2occ s THR 181 Ca 0.05 0.26 -0.11 0.00 -1.18 0.00 0.00 61.69 60.72 2occ s THR 181 Cb 0.05 -3.59 0.13 0.00 1.34 0.00 0.00 72.50 70.43 2occ s THR 181 CO 0.00 0.34 1.16 -2.84 -0.54 0.00 0.00 174.62 172.75 2occ s PRO 182 N -1.80 1.13 0.35 3.99 0.02 -1.26 -4.84 135.00 132.60 2occ s PRO 182 Ca 0.29 1.60 0.06 0.00 0.02 0.00 0.00 61.00 62.96 2occ s PRO 182 Cb -0.13 -1.74 0.72 0.00 0.02 0.00 0.00 34.50 33.37 2occ s PRO 182 CO 0.17 -2.56 1.94 -0.07 -0.33 0.00 0.00 177.00 176.15 2occ h LEU 183 N -1.68 0.69 -1.13 -5.54 3.38 -1.98 -1.83 115.31 107.22 2occ h LEU 183 Ca -0.44 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.52 2occ h LEU 183 Cb 1.27 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.85 2occ h LEU 183 CO 0.42 0.44 0.36 0.15 0.09 0.00 0.00 178.44 179.90 2occ h PHE 184 N 0.78 0.95 -0.54 1.13 3.57 -1.92 0.35 116.94 121.26 2occ h PHE 184 Ca 0.34 -0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.70 2occ h PHE 184 Cb 0.30 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 2occ h PHE 184 CO -0.00 0.68 -0.10 0.28 -2.23 0.00 0.00 178.31 176.93 2occ h VAL 185 N 0.97 1.27 -0.45 1.41 2.07 -1.70 -1.19 116.25 118.64 2occ h VAL 185 Ca 0.24 -1.25 -0.04 0.00 0.82 0.00 0.00 66.70 66.47 2occ h VAL 185 Cb 0.05 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 2occ h VAL 185 CO -0.04 0.44 0.11 -0.50 0.02 0.00 0.00 177.57 177.61 2occ h TRP 186 N 0.90 0.75 -0.91 1.57 4.06 -0.96 -0.95 115.95 120.41 2occ h TRP 186 Ca 0.14 -0.09 0.04 0.00 2.06 0.00 0.00 58.89 61.05 2occ h TRP 186 Cb 0.66 -0.21 -0.05 0.00 -1.00 0.00 0.00 29.16 28.56 2occ h TRP 186 CO 0.04 0.69 0.59 0.66 -3.56 0.00 0.00 178.44 176.87 2occ h SER 187 N 0.59 0.96 1.73 -3.49 4.64 -0.02 0.54 113.55 118.49 2occ h SER 187 Ca 0.14 -0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.43 2occ h SER 187 Cb 0.32 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.19 2occ h SER 187 CO 0.00 0.65 -0.27 -0.37 -0.87 0.00 0.00 176.83 175.96 2occ h VAL 188 N 1.11 0.19 -0.12 0.95 -1.51 -0.92 -2.63 116.25 113.31 2occ h VAL 188 Ca 0.37 -1.28 -0.08 0.00 -1.23 0.00 0.00 66.70 64.47 2occ h VAL 188 Cb 0.07 2.03 0.00 0.00 -2.13 0.00 0.00 31.29 31.25 2occ h VAL 188 CO -0.12 0.11 -0.25 -0.03 -1.23 0.00 0.00 177.57 176.05 2occ h MET 189 N 0.00 0.38 -0.49 5.19 -1.53 0.45 -1.75 114.93 117.19 2occ h MET 189 Ca -0.01 -0.25 -0.01 0.00 -3.44 0.00 0.00 59.70 55.99 2occ h MET 189 Cb 1.10 0.03 -0.02 0.00 -0.55 0.00 0.00 31.60 32.16 2occ h MET 189 CO 0.01 0.85 0.25 0.82 0.14 0.00 0.00 176.91 178.99 2occ h ILE 190 N -0.04 1.18 -0.61 1.77 2.04 -1.25 -1.80 117.51 118.80 2occ h ILE 190 Ca 0.00 -0.48 0.07 0.00 1.00 0.00 0.00 64.86 65.46 2occ h ILE 190 Cb 0.85 0.60 -0.06 0.00 -0.74 0.00 0.00 36.82 37.47 2occ h ILE 190 CO 0.06 0.19 0.28 0.74 0.00 0.00 0.00 178.15 179.42 2occ h THR 191 N 0.64 0.87 -0.57 -0.27 2.02 -1.50 -0.19 112.91 113.92 2occ h THR 191 Ca 0.17 -0.18 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 2occ h THR 191 Cb 0.08 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 66.77 2occ h THR 191 CO -0.02 0.09 0.25 0.00 0.37 0.00 0.00 175.52 176.21 2occ h ALA 192 N 1.36 1.36 -0.49 6.16 0.00 -0.92 -0.77 119.26 125.96 2occ h ALA 192 Ca 0.29 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 2occ h ALA 192 Cb 0.27 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2occ h ALA 192 CO -0.23 0.49 -0.09 0.28 0.00 0.00 0.00 179.25 179.70 2occ h VAL 193 N 0.81 1.26 -0.58 0.00 2.07 -0.23 -1.94 116.25 117.64 2occ h VAL 193 Ca 0.20 -1.18 -0.06 0.00 0.82 0.00 0.00 66.70 66.48 2occ h VAL 193 Cb 0.13 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 2occ h VAL 193 CO -0.02 0.41 0.14 -0.07 0.02 0.00 0.00 177.57 178.05 2occ h LEU 194 N 0.79 0.88 -0.84 2.57 4.07 -0.40 -2.29 115.31 120.10 2occ h LEU 194 Ca 0.13 -0.23 -0.09 0.00 0.08 0.00 0.00 57.88 57.77 2occ h LEU 194 Cb 0.60 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 42.09 2occ h LEU 194 CO 0.04 0.89 -0.07 -0.07 -1.08 0.00 0.00 178.44 178.14 2occ h LEU 195 N 0.84 0.77 -0.78 1.67 3.38 -1.08 -0.96 115.31 119.15 2occ h LEU 195 Ca 0.18 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 2occ h LEU 195 Cb 0.35 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 2occ h LEU 195 CO 0.00 0.88 0.23 0.25 0.09 0.00 0.00 178.44 179.90 2occ h LEU 196 N 0.72 1.07 0.00 1.67 5.85 -0.87 -2.20 115.31 121.55 2occ h LEU 196 Ca 0.13 -0.20 -0.17 0.00 0.84 0.00 0.00 57.88 58.48 2occ h LEU 196 Cb 0.55 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 2occ h LEU 196 CO 0.03 0.99 -1.16 -0.07 -0.34 0.00 0.00 178.44 177.90 2occ h LEU 197 N 1.10 0.00 0.07 2.25 3.38 -1.37 -3.41 115.31 117.34 2occ h LEU 197 Ca 0.24 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.83 2occ h LEU 197 Cb 0.31 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 2occ h LEU 197 CO -0.01 0.66 -2.18 -1.54 0.09 0.00 0.00 178.44 175.46 2occ n SER 198 N -3.05 2.06 -0.11 -0.43 3.41 -0.37 -4.45 113.62 110.68 2occ n SER 198 Ca -0.06 0.08 0.06 0.00 -0.26 0.00 0.00 58.87 58.69 2occ n SER 198 Cb 0.85 -0.69 0.39 0.00 -0.26 0.00 0.00 64.21 64.50 2occ n SER 198 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2occ h LEU 199 N 0.00 0.58 -1.30 1.04 4.07 -1.60 -2.25 115.31 115.84 2occ h LEU 199 Ca -0.49 -0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.40 2occ h LEU 199 Cb 1.96 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 43.56 2occ h LEU 199 CO 0.00 0.39 -0.23 -0.65 -1.08 0.00 0.00 178.44 176.88 2occ h PRO 200 N 0.67 0.18 -0.25 1.13 0.11 -1.79 -1.24 132.00 130.82 2occ h PRO 200 Ca 0.25 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 66.15 2occ h PRO 200 Cb 0.16 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.25 2occ h PRO 200 CO -0.07 0.41 -0.49 0.28 -0.21 0.00 0.00 178.00 177.91 2occ h VAL 201 N 0.17 1.30 0.05 3.15 2.07 -1.63 -1.88 116.25 119.48 2occ h VAL 201 Ca 0.03 -1.70 -0.00 0.00 0.82 0.00 0.00 66.70 65.84 2occ h VAL 201 Cb 0.50 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 2occ h VAL 201 CO 0.03 0.54 -0.03 0.25 0.02 0.00 0.00 177.57 178.39 2occ h LEU 202 N 0.54 -0.06 -1.34 2.57 5.85 -1.31 -1.22 115.31 120.33 2occ h LEU 202 Ca 0.02 -0.08 0.16 0.00 0.84 0.00 0.00 57.88 58.83 2occ h LEU 202 Cb 1.05 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 42.03 2occ h LEU 202 CO 0.10 0.04 0.58 0.00 -0.34 0.00 0.00 178.44 178.82 2occ h ALA 203 N 0.78 1.94 -0.14 1.25 0.00 -1.08 0.29 119.26 122.30 2occ h ALA 203 Ca -0.01 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2occ h ALA 203 Cb 0.14 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2occ h ALA 203 CO 0.01 -0.20 -0.22 0.00 0.00 0.00 0.00 179.25 178.84 2occ h ALA 204 N 1.61 0.22 -0.23 0.00 0.00 -0.93 -2.65 119.26 117.27 2occ h ALA 204 Ca 0.46 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 55.01 2occ h ALA 204 Cb 0.86 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 2occ h ALA 204 CO -0.21 0.17 0.13 0.78 0.00 0.00 0.00 179.25 180.13 2occ h GLY 205 N 0.01 0.32 2.00 0.00 0.00 0.11 -1.37 103.07 104.14 2occ h GLY 205 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.24 2occ h GLY 205 CO 0.05 0.09 0.00 0.16 0.00 0.00 0.00 176.54 176.84 2occ h ILE 206 N 0.28 0.00 0.06 2.60 3.07 -1.12 -1.34 117.51 121.06 2occ h ILE 206 Ca 0.09 -0.41 -0.25 0.00 1.55 0.00 0.00 64.86 65.84 2occ h ILE 206 Cb -0.00 1.31 0.01 0.00 -0.27 0.00 0.00 36.82 37.86 2occ h ILE 206 CO -0.04 0.00 -1.08 0.74 -1.05 0.00 0.00 178.15 176.72 2occ h THR 207 N 0.00 1.43 -0.39 0.16 2.02 -1.03 -1.32 112.91 113.77 2occ h THR 207 Ca 0.00 -2.67 -0.08 0.00 0.77 0.00 0.00 66.41 64.43 2occ h THR 207 Cb 0.60 2.64 -0.01 0.00 -1.74 0.00 0.00 68.15 69.63 2occ h THR 207 CO 0.00 0.79 -0.05 0.24 0.37 0.00 0.00 175.52 176.87 2occ h MET 208 N 0.17 0.72 -0.59 6.66 2.86 -0.89 -1.05 114.93 122.81 2occ h MET 208 Ca -0.11 -0.26 -0.00 0.00 -2.06 0.00 0.00 59.70 57.27 2occ h MET 208 Cb 1.75 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 33.33 2occ h MET 208 CO 0.18 0.84 0.36 1.25 1.06 0.00 0.00 176.91 180.61 2occ h LEU 209 N 0.53 0.70 -0.61 1.22 5.85 -1.15 -1.34 115.31 120.51 2occ h LEU 209 Ca 0.10 -0.03 -0.13 0.00 0.84 0.00 0.00 57.88 58.66 2occ h LEU 209 Cb 0.55 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 2occ h LEU 209 CO 0.03 0.53 -0.34 0.25 -0.34 0.00 0.00 178.44 178.58 2occ h LEU 210 N 0.81 0.76 -0.39 2.25 5.85 -0.82 -2.57 115.31 121.20 2occ h LEU 210 Ca 0.21 -0.32 -0.18 0.00 0.84 0.00 0.00 57.88 58.43 2occ h LEU 210 Cb -0.04 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.77 2occ h LEU 210 CO -0.04 1.03 -0.61 0.71 -0.34 0.00 0.00 178.44 179.19 2occ h THR 211 N 0.61 1.31 -0.57 1.05 1.35 -0.66 -2.60 112.91 113.41 2occ h THR 211 Ca 0.06 -1.85 0.02 0.00 -0.55 0.00 0.00 66.41 64.09 2occ h THR 211 Cb 0.86 1.81 -0.03 0.00 -1.73 0.00 0.00 68.15 69.06 2occ h THR 211 CO 0.08 0.58 0.38 0.44 -0.25 0.00 0.00 175.52 176.74 2occ h ASP 212 N 0.49 0.61 1.84 5.36 5.19 -1.20 0.65 116.42 129.36 2occ h ASP 212 Ca -0.00 -0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.39 2occ h ASP 212 Cb 1.19 -0.15 -0.00 0.00 0.18 0.00 0.00 39.33 40.55 2occ h ASP 212 CO 0.12 0.43 -0.16 0.03 -3.12 0.00 0.00 179.24 176.53 2occ h ARG 213 N 0.71 0.00 0.00 3.56 3.08 -1.38 -3.39 114.38 116.96 2occ h ARG 213 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.27 2occ h ARG 213 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 2occ h ARG 213 CO -0.05 0.03 -0.16 0.09 -1.07 0.00 0.00 179.97 178.81 2occ n ASN 214 N -3.06 0.80 -0.49 7.04 3.02 -0.84 -4.75 115.26 116.99 2occ n ASN 214 Ca 0.03 -0.02 0.07 0.00 -0.03 0.00 0.00 54.58 54.63 2occ n ASN 214 Cb 0.55 0.20 0.17 0.00 -0.61 0.00 0.00 39.78 40.09 2occ n ASN 214 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2occ n LEU 215 N -0.28 3.01 -2.81 3.41 4.32 0.22 -4.99 117.00 119.89 2occ n LEU 215 Ca 0.00 -2.69 -0.21 0.00 -0.02 0.00 0.00 56.01 53.09 2occ n LEU 215 Cb 0.00 -0.37 0.01 0.00 -1.62 0.00 0.00 43.42 41.44 2occ n LEU 215 CO 0.00 0.67 -0.10 0.59 -1.22 0.00 0.00 177.39 177.33 2occ n ASN 216 N -0.56 -5.68 -4.91 -1.43 3.02 -1.10 -4.94 115.26 99.67 2occ n ASN 216 Ca 0.15 -0.17 -0.25 0.00 -0.03 0.00 0.00 54.58 54.28 2occ n ASN 216 Cb 0.64 -4.65 0.07 0.00 -0.61 0.00 0.00 39.78 35.22 2occ n ASN 216 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2occ s THR 217 N -3.07 2.33 -0.33 3.41 -4.23 -1.20 -4.99 115.64 107.55 2occ s THR 217 Ca 0.19 -0.35 0.17 0.00 -1.18 0.00 0.00 61.69 60.52 2occ s THR 217 Cb -0.09 -2.98 0.44 0.00 1.34 0.00 0.00 72.50 71.21 2occ s THR 217 CO 0.24 0.00 0.92 0.35 -0.54 0.00 0.00 174.62 175.59 2occ n THR 218 N -2.83 0.87 0.00 3.99 -2.24 -1.26 -4.34 114.28 108.46 2occ n THR 218 Ca 0.08 -3.34 -0.03 0.00 -2.27 0.00 0.00 64.05 58.50 2occ n THR 218 Cb 0.60 0.47 0.23 0.00 -2.10 0.00 0.00 70.33 69.53 2occ n THR 218 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2occ h PHE 219 N 2.99 0.57 -0.10 4.78 0.04 -1.96 -3.03 116.94 120.22 2occ h PHE 219 Ca -0.06 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.62 2occ h PHE 219 Cb 1.14 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 39.14 2occ h PHE 219 CO 0.50 0.65 0.00 1.19 -0.60 0.00 0.00 178.31 180.06 2occ n PHE 220 N -4.18 0.13 -3.53 -0.55 3.72 -1.26 -1.62 117.46 110.16 2occ n PHE 220 Ca 0.00 -0.26 -0.41 0.00 -0.05 0.00 0.00 57.45 56.73 2occ n PHE 220 Cb 0.35 -0.02 -0.11 0.00 -0.94 0.00 0.00 39.48 38.76 2occ n PHE 220 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2occ s ASP 221 N -0.75 5.99 0.56 4.37 -1.08 -1.23 -2.66 116.67 121.87 2occ s ASP 221 Ca 0.09 -0.61 0.26 0.00 -0.52 0.00 0.00 52.55 51.77 2occ s ASP 221 Cb 0.06 -2.12 1.49 0.00 -1.46 0.00 0.00 42.92 40.89 2occ s ASP 221 CO 0.08 -0.30 2.05 -0.65 0.52 0.00 0.00 175.17 176.86 2occ h PRO 222 N 8.51 0.00 -0.76 4.34 0.11 -1.87 0.26 132.00 142.58 2occ h PRO 222 Ca -0.30 0.00 0.10 0.00 0.11 0.00 0.00 66.00 65.91 2occ h PRO 222 Cb 1.14 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.20 2occ h PRO 222 CO 0.66 0.00 0.50 0.00 -0.21 0.00 0.00 178.00 178.95 2occ h ALA 223 N 1.75 1.83 -0.38 -0.75 0.00 -1.94 0.84 119.26 120.62 2occ h ALA 223 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2occ h ALA 223 Cb 0.70 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2occ h ALA 223 CO -0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2occ n GLY 224 N -1.46 1.73 0.03 0.00 0.00 -0.82 -4.93 105.19 99.72 2occ n GLY 224 Ca 0.13 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2occ n GLY 224 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2occ n GLY 225 N 1.33 0.63 3.71 -0.02 0.00 0.29 -4.97 105.19 106.15 2occ n GLY 225 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 2occ n GLY 225 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2occ s GLY 226 N -1.27 1.66 -0.16 -0.02 0.00 0.02 -4.90 107.32 102.65 2occ s GLY 226 Ca 0.00 -1.06 -0.04 0.00 0.00 0.00 0.00 44.72 43.62 2occ s GLY 226 CO 0.00 -0.21 0.24 -0.35 0.00 0.00 0.00 173.10 172.78 2occ s ASP 227 N -4.26 0.84 0.57 1.64 -1.08 -0.64 -3.47 116.67 110.26 2occ s ASP 227 Ca 0.72 0.19 0.26 0.00 -0.52 0.00 0.00 52.55 53.21 2occ s ASP 227 Cb -0.07 0.53 1.57 0.00 -1.46 0.00 0.00 42.92 43.49 2occ s ASP 227 CO 0.55 -0.28 2.11 -0.65 0.52 0.00 0.00 175.17 177.42 2occ h PRO 228 N 8.30 0.00 -0.09 4.34 0.11 -1.78 0.04 132.00 142.93 2occ h PRO 228 Ca -0.15 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.87 2occ h PRO 228 Cb 1.13 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2occ h PRO 228 CO 0.20 0.00 -0.35 0.82 -0.21 0.00 0.00 178.00 178.47 2occ h ILE 229 N 0.00 1.27 -0.71 4.15 1.08 -1.92 -3.03 117.51 118.35 2occ h ILE 229 Ca 0.09 -1.32 0.08 0.00 -0.39 0.00 0.00 64.86 63.32 2occ h ILE 229 Cb 0.42 1.60 -0.07 0.00 -3.07 0.00 0.00 36.82 35.71 2occ h ILE 229 CO -0.00 0.39 0.37 0.25 -0.69 0.00 0.00 178.15 178.47 2occ h LEU 230 N 0.15 0.52 -0.71 1.44 5.85 -1.33 -1.01 115.31 120.22 2occ h LEU 230 Ca 0.02 0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.85 2occ h LEU 230 Cb 0.69 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.61 2occ h LEU 230 CO 0.05 0.31 0.40 0.22 -0.34 0.00 0.00 178.44 179.08 2occ h TYR 231 N 0.65 0.73 -0.91 1.25 3.20 -1.64 -1.82 116.97 118.43 2occ h TYR 231 Ca 0.34 0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.25 2occ h TYR 231 Cb 0.30 -0.22 -0.05 0.00 1.54 0.00 0.00 36.73 38.30 2occ h TYR 231 CO -0.09 0.34 0.60 1.96 -1.64 0.00 0.00 178.16 179.33 2occ h GLN 232 N 0.72 1.17 0.06 1.82 4.20 -1.25 0.82 115.11 122.65 2occ h GLN 232 Ca 0.32 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.96 2occ h GLN 232 Cb 0.22 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 27.74 2occ h GLN 232 CO -0.20 0.78 -0.03 0.45 -0.67 0.00 0.00 178.83 179.16 2occ h HIS 233 N 1.21 -0.07 -0.30 2.96 3.86 -0.81 -0.75 115.15 121.24 2occ h HIS 233 Ca 0.35 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.55 2occ h HIS 233 Cb -0.09 0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.39 2occ h HIS 233 CO -0.01 0.12 0.15 -0.07 0.86 0.00 0.00 177.93 178.98 2occ h LEU 234 N -0.25 0.39 -0.33 2.43 3.38 -1.18 -0.84 115.31 118.91 2occ h LEU 234 Ca -0.01 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 2occ h LEU 234 Cb 0.22 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2occ h LEU 234 CO 0.01 0.39 0.17 0.15 0.09 0.00 0.00 178.44 179.25 2occ h PHE 235 N 0.36 0.47 0.00 1.13 3.04 -0.78 -2.74 116.94 118.41 2occ h PHE 235 Ca 0.10 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.04 2occ h PHE 235 Cb 0.10 -0.15 0.00 0.00 2.56 0.00 0.00 35.95 38.46 2occ h PHE 235 CO -0.02 0.39 0.00 0.91 -2.02 0.00 0.00 178.31 177.57 2occ n TRP 236 N -4.77 0.75 0.15 0.41 7.02 -0.29 0.25 117.44 120.95 2occ n TRP 236 Ca -0.01 0.25 0.01 0.00 -1.02 0.00 0.00 57.50 56.72 2occ n TRP 236 Cb 0.09 -0.90 0.31 0.00 -2.42 0.00 0.00 31.31 28.39 2occ n TRP 236 CO 0.00 0.00 0.00 0.35 -2.02 0.00 0.00 177.69 176.02 2occ h PHE 237 N 0.00 0.10 0.08 -5.99 3.57 -0.83 -2.39 116.94 111.48 2occ h PHE 237 Ca 0.00 -0.02 -0.29 0.00 3.53 0.00 0.00 57.97 61.19 2occ h PHE 237 Cb 0.56 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.26 2occ h PHE 237 CO 0.00 0.46 -1.55 0.35 -2.23 0.00 0.00 178.31 175.33 2occ h PHE 238 N 0.08 0.29 -1.00 0.41 3.57 -1.45 -3.39 116.94 115.44 2occ h PHE 238 Ca 0.01 -0.21 0.15 0.00 3.53 0.00 0.00 57.97 61.45 2occ h PHE 238 Cb 0.70 -0.01 -0.09 0.00 2.79 0.00 0.00 35.95 39.34 2occ h PHE 238 CO 0.00 1.61 0.62 0.78 -2.23 0.00 0.00 178.31 179.10 2occ h GLY 239 N 0.03 1.66 0.35 2.40 0.00 -0.09 0.35 103.07 107.77 2occ h GLY 239 Ca -0.36 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 46.58 2occ h GLY 239 CO -0.03 0.07 -0.01 0.84 0.00 0.00 0.00 176.54 177.41 2occ h HIS 240 N 0.89 -0.04 -1.00 5.60 -0.00 -1.66 -3.21 115.15 115.73 2occ h HIS 240 Ca 0.53 -0.00 0.22 0.00 -0.00 0.00 0.00 60.37 61.12 2occ h HIS 240 Cb 0.67 0.01 -0.12 0.00 -0.00 0.00 0.00 27.41 27.97 2occ h HIS 240 CO -0.00 0.58 0.60 -1.35 -0.00 0.00 0.00 177.93 177.75 2occ h PRO 241 N -0.69 0.63 -0.87 5.26 0.11 -1.53 0.16 132.00 135.07 2occ h PRO 241 Ca -0.00 -0.04 0.13 0.00 0.11 0.00 0.00 66.00 66.20 2occ h PRO 241 Cb 0.63 -0.14 -0.07 0.00 0.11 0.00 0.00 31.00 31.53 2occ h PRO 241 CO 0.01 0.42 0.56 1.49 -0.21 0.00 0.00 178.00 180.26 2occ h GLU 242 N 0.65 0.67 0.00 1.05 4.57 -0.96 -0.27 114.58 120.28 2occ h GLU 242 Ca 0.62 -0.04 -0.10 0.00 -1.18 0.00 0.00 59.36 58.66 2occ h GLU 242 Cb 1.09 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 29.52 2occ h GLU 242 CO -0.44 0.44 -0.45 -0.39 -1.18 0.00 0.00 179.01 176.99 2occ h VAL 243 N 0.69 0.97 0.00 0.32 -1.51 -0.96 -2.01 116.25 113.75 2occ h VAL 243 Ca 0.43 -1.81 -0.13 0.00 -1.23 0.00 0.00 66.70 63.96 2occ h VAL 243 Cb 0.67 2.09 -0.02 0.00 -2.13 0.00 0.00 31.29 31.90 2occ h VAL 243 CO -0.19 0.45 -0.61 1.88 -1.23 0.00 0.00 177.57 177.87 2occ h TYR 244 N 0.00 0.00 0.00 5.19 0.05 -1.12 -2.70 116.97 118.39 2occ h TYR 244 Ca -0.00 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.70 2occ h TYR 244 Cb 1.05 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.78 2occ h TYR 244 CO 0.00 0.61 -0.36 0.82 -1.05 0.00 0.00 178.16 178.18 2occ h ILE 245 N 0.00 1.04 0.00 -2.88 2.04 -0.79 -1.11 117.51 115.81 2occ h ILE 245 Ca -0.01 -1.33 -0.02 0.00 1.00 0.00 0.00 64.86 64.50 2occ h ILE 245 Cb 1.43 1.77 -0.00 0.00 -0.74 0.00 0.00 36.82 39.27 2occ h ILE 245 CO 0.08 0.35 -0.47 -0.07 0.00 0.00 0.00 178.15 178.04 2occ h LEU 246 N 0.00 0.00 0.00 1.44 3.38 -1.11 -3.37 115.31 115.65 2occ h LEU 246 Ca -0.00 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.74 2occ h LEU 246 Cb 0.74 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.44 2occ h LEU 246 CO 0.05 0.10 -2.02 0.00 0.09 0.00 0.00 178.44 176.65 2occ n ILE 247 N -2.97 0.84 -0.06 1.22 0.13 -1.04 -4.63 119.36 112.86 2occ n ILE 247 Ca 0.02 -0.61 -0.07 0.00 -1.10 0.00 0.00 62.75 60.98 2occ n ILE 247 Cb 0.58 -0.42 -0.01 0.00 -0.84 0.00 0.00 39.64 38.95 2occ n ILE 247 CO 0.00 0.00 0.00 -0.07 2.80 0.00 0.00 176.55 179.28 2occ h LEU 248 N 0.00 -0.32 -2.13 9.51 3.38 -1.37 0.11 115.31 124.49 2occ h LEU 248 Ca -0.33 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 2occ h LEU 248 Cb 1.71 0.19 -0.00 0.00 0.09 0.00 0.00 40.66 42.65 2occ h LEU 248 CO 0.02 -0.12 -0.04 -0.65 0.09 0.00 0.00 178.44 177.74 2occ h PRO 249 N -0.04 0.00 -0.16 1.13 0.11 -1.79 0.54 132.00 131.80 2occ h PRO 249 Ca 0.13 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.10 2occ h PRO 249 Cb 0.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 2occ h PRO 249 CO -0.29 0.04 -0.53 0.78 -0.21 0.00 0.00 178.00 177.79 2occ h GLY 250 N 0.18 0.50 1.01 -0.55 0.00 -1.39 -1.22 103.07 101.60 2occ h GLY 250 Ca -0.00 -0.56 -0.04 0.00 0.00 0.00 0.00 47.33 46.73 2occ h GLY 250 CO 0.01 0.51 0.25 0.74 0.00 0.00 0.00 176.54 178.04 2occ h PHE 251 N 0.35 1.00 0.27 5.60 0.04 0.90 -1.91 116.94 123.19 2occ h PHE 251 Ca 0.01 -0.08 -0.01 0.00 2.80 0.00 0.00 57.97 60.69 2occ h PHE 251 Cb 1.04 -0.30 0.00 0.00 2.20 0.00 0.00 35.95 38.90 2occ h PHE 251 CO 0.04 0.79 -0.13 0.78 -0.60 0.00 0.00 178.31 179.18 2occ h GLY 252 N 0.92 -0.38 1.21 -1.45 0.00 -0.55 -2.57 103.07 100.25 2occ h GLY 252 Ca 0.22 0.14 -0.00 0.00 0.00 0.00 0.00 47.33 47.68 2occ h GLY 252 CO -0.02 -0.14 0.46 -0.33 0.00 0.00 0.00 176.54 176.52 2occ h MET 253 N -0.37 1.05 -0.51 4.80 2.86 -1.20 -2.32 114.93 119.24 2occ h MET 253 Ca -0.04 -0.09 -0.05 0.00 -2.06 0.00 0.00 59.70 57.46 2occ h MET 253 Cb 0.28 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 2occ h MET 253 CO 0.06 0.74 0.11 0.82 1.06 0.00 0.00 176.91 179.70 2occ h ILE 254 N 1.07 1.22 -0.64 -1.22 1.08 -1.19 -1.09 117.51 116.74 2occ h ILE 254 Ca 0.28 -0.81 -0.03 0.00 -0.39 0.00 0.00 64.86 63.91 2occ h ILE 254 Cb -0.04 0.71 -0.03 0.00 -3.07 0.00 0.00 36.82 34.39 2occ h ILE 254 CO -0.05 0.30 0.27 0.28 -0.69 0.00 0.00 178.15 178.25 2occ h SER 255 N 0.75 0.87 -0.31 1.72 0.02 -1.01 -0.10 113.55 115.49 2occ h SER 255 Ca 0.17 -0.16 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 2occ h SER 255 Cb 0.30 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 2occ h SER 255 CO 0.00 0.79 -0.05 0.45 -1.14 0.00 0.00 176.83 176.89 2occ h HIS 256 N 0.89 0.65 -0.21 3.45 3.86 -1.31 -2.33 115.15 120.15 2occ h HIS 256 Ca 0.21 -0.13 -0.03 0.00 -1.16 0.00 0.00 60.37 59.27 2occ h HIS 256 Cb 0.19 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.49 2occ h HIS 256 CO 0.01 0.75 0.03 0.82 0.86 0.00 0.00 177.93 180.39 2occ h ILE 257 N 0.36 1.23 -0.66 2.45 2.04 -1.03 -0.04 117.51 121.86 2occ h ILE 257 Ca 0.08 -0.78 -0.06 0.00 1.00 0.00 0.00 64.86 65.10 2occ h ILE 257 Cb 0.52 1.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.91 2occ h ILE 257 CO 0.03 0.24 0.19 0.58 0.00 0.00 0.00 178.15 179.18 2occ h VAL 258 N 0.14 1.25 -0.01 1.67 2.07 -1.08 -1.19 116.25 119.10 2occ h VAL 258 Ca 0.06 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.68 2occ h VAL 258 Cb 0.34 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 30.69 2occ h VAL 258 CO 0.01 0.34 0.00 0.74 0.02 0.00 0.00 177.57 178.68 2occ h THR 259 N 0.97 1.19 0.07 2.57 2.02 -1.35 -2.74 112.91 115.64 2occ h THR 259 Ca 0.21 -0.57 0.01 0.00 0.77 0.00 0.00 66.41 66.83 2occ h THR 259 Cb 0.33 1.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.27 2occ h THR 259 CO -0.00 0.15 -0.10 0.22 0.37 0.00 0.00 175.52 176.16 2occ h TYR 260 N -0.21 -0.26 0.00 3.16 3.20 -0.82 -2.27 116.97 119.78 2occ h TYR 260 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.88 2occ h TYR 260 Cb 0.24 0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.61 2occ h TYR 260 CO 0.01 -0.15 0.00 0.66 -1.64 0.00 0.00 178.16 177.03 2occ n TYR 261 N -5.22 0.00 0.88 -3.82 4.01 -0.47 -1.36 117.16 111.18 2occ n TYR 261 Ca -0.07 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.77 2occ n TYR 261 Cb 0.14 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.21 2occ n TYR 261 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2occ n SER 262 N -0.90 2.29 -1.00 7.72 7.64 -1.03 -1.38 113.62 126.96 2occ n SER 262 Ca 0.17 -1.64 -0.09 0.00 1.01 0.00 0.00 58.87 58.32 2occ n SER 262 Cb 0.08 0.25 -0.00 0.00 -1.01 0.00 0.00 64.21 63.52 2occ n SER 262 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2occ n GLY 263 N 1.25 0.01 3.96 0.23 0.00 -0.47 -0.51 105.19 109.65 2occ n GLY 263 Ca 0.10 -0.52 -0.22 0.00 0.00 0.00 0.00 46.02 45.38 2occ n GLY 263 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2occ s LYS 264 N -4.44 3.43 -0.01 1.61 -0.14 -0.88 -4.85 119.74 114.46 2occ s LYS 264 Ca 0.00 -0.59 -0.08 0.00 -1.36 0.00 0.00 55.97 53.94 2occ s LYS 264 Cb -0.00 -2.78 -0.30 0.00 -1.68 0.00 0.00 37.83 33.07 2occ s LYS 264 CO 0.00 0.27 0.81 0.87 -0.76 0.00 0.00 175.35 176.54 2occ h LYS 265 N 0.96 0.35 -3.91 1.68 1.57 -1.96 -3.42 116.57 111.84 2occ h LYS 265 Ca -0.51 -0.60 -0.10 0.00 -1.87 0.00 0.00 60.65 57.58 2occ h LYS 265 Cb 1.23 0.22 -0.15 0.00 0.08 0.00 0.00 32.23 33.61 2occ h LYS 265 CO 0.61 1.24 -0.48 -1.83 -0.57 0.00 0.00 179.45 178.42 2occ s GLU 266 N -2.60 0.73 0.57 3.15 -1.05 -1.26 -4.89 118.70 113.35 2occ s GLU 266 Ca -0.12 -0.98 -0.17 0.00 -0.15 0.00 0.00 54.97 53.55 2occ s GLU 266 Cb 0.06 0.29 -0.05 0.00 -0.44 0.00 0.00 34.13 33.99 2occ s GLU 266 CO 0.87 -0.20 1.06 -1.25 0.95 0.00 0.00 175.26 176.69 2occ s PRO 267 N -3.62 3.40 0.33 -4.83 0.04 -1.26 -4.99 135.00 124.07 2occ s PRO 267 Ca 0.04 1.29 -0.29 0.00 0.04 0.00 0.00 61.00 62.07 2occ s PRO 267 Cb 0.05 -2.04 -0.10 0.00 0.04 0.00 0.00 34.50 32.44 2occ s PRO 267 CO -0.09 -0.75 1.31 0.12 0.04 0.00 0.00 177.00 177.62 2occ s PHE 268 N -2.28 3.05 -1.31 0.56 2.19 -1.26 -3.78 117.98 115.14 2occ s PHE 268 Ca 0.65 1.42 -0.00 0.00 0.33 0.00 0.00 56.93 59.33 2occ s PHE 268 Cb -0.17 -3.68 0.00 0.00 -1.31 0.00 0.00 43.02 37.86 2occ s PHE 268 CO 0.32 -1.86 0.70 0.41 1.83 0.00 0.00 175.22 176.62 2occ n GLY 269 N 0.80 -0.29 0.31 13.12 0.00 -1.26 -4.80 105.19 113.06 2occ n GLY 269 Ca -0.00 0.13 0.06 0.00 0.00 0.00 0.00 46.02 46.21 2occ n GLY 269 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2occ h TYR 270 N -1.87 -0.25 0.00 1.61 5.03 -1.98 0.33 116.97 119.84 2occ h TYR 270 Ca -0.61 0.07 -0.10 0.00 2.58 0.00 0.00 58.73 60.67 2occ h TYR 270 Cb 1.36 0.25 -0.01 0.00 1.55 0.00 0.00 36.73 39.87 2occ h TYR 270 CO 0.47 -0.35 -0.47 0.52 -1.32 0.00 0.00 178.16 177.01 2occ h MET 271 N 0.03 0.00 -0.27 1.82 2.86 -1.95 -2.28 114.93 115.15 2occ h MET 271 Ca 0.45 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 58.00 2occ h MET 271 Cb 0.79 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.44 2occ h MET 271 CO -0.83 0.47 -0.22 0.78 1.06 0.00 0.00 176.91 178.17 2occ h GLY 272 N 1.89 0.55 1.21 8.32 0.00 -0.76 -0.29 103.07 113.99 2occ h GLY 272 Ca -0.00 -0.44 -0.18 0.00 0.00 0.00 0.00 47.33 46.71 2occ h GLY 272 CO 0.06 0.40 -0.56 -0.33 0.00 0.00 0.00 176.54 176.11 2occ h MET 273 N 0.45 0.82 -0.13 4.80 2.86 -0.91 0.22 114.93 123.05 2occ h MET 273 Ca 0.07 -0.53 -0.03 0.00 -2.06 0.00 0.00 59.70 57.15 2occ h MET 273 Cb 0.63 0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.36 2occ h MET 273 CO 0.05 1.16 -0.04 0.28 1.06 0.00 0.00 176.91 179.42 2occ h VAL 274 N 0.63 1.30 -0.29 -2.22 2.07 -1.26 -1.85 116.25 114.63 2occ h VAL 274 Ca 0.01 -1.01 0.04 0.00 0.82 0.00 0.00 66.70 66.57 2occ h VAL 274 Cb 1.16 1.70 -0.04 0.00 -1.52 0.00 0.00 31.29 32.59 2occ h VAL 274 CO 0.12 0.29 0.05 -0.25 0.02 0.00 0.00 177.57 177.80 2occ h TRP 275 N -0.07 0.09 -0.67 1.57 7.01 -0.99 -2.05 115.95 120.84 2occ h TRP 275 Ca 0.03 0.02 0.05 0.00 2.11 0.00 0.00 58.89 61.10 2occ h TRP 275 Cb 0.47 0.00 -0.05 0.00 -2.10 0.00 0.00 29.16 27.49 2occ h TRP 275 CO 0.06 0.02 0.40 0.00 -2.79 0.00 0.00 178.44 176.12 2occ h ALA 276 N 1.21 0.89 -0.11 2.65 0.00 -0.44 -1.48 119.26 121.99 2occ h ALA 276 Ca 0.13 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 2occ h ALA 276 Cb 0.14 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2occ h ALA 276 CO -0.18 0.11 -0.37 0.52 0.00 0.00 0.00 179.25 179.33 2occ h MET 277 N 0.75 0.22 -0.33 0.00 2.86 -1.09 -1.17 114.93 116.18 2occ h MET 277 Ca 0.29 -0.10 -0.14 0.00 -2.06 0.00 0.00 59.70 57.69 2occ h MET 277 Cb 0.11 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.76 2occ h MET 277 CO -0.15 0.57 -0.35 0.52 1.06 0.00 0.00 176.91 178.56 2occ h MET 278 N 0.19 0.81 -0.19 1.72 2.07 -0.71 -2.18 114.93 116.64 2occ h MET 278 Ca 0.02 -0.44 -0.00 0.00 -2.07 0.00 0.00 59.70 57.21 2occ h MET 278 Cb 0.75 0.02 -0.01 0.00 -1.87 0.00 0.00 31.60 30.49 2occ h MET 278 CO 0.06 1.07 0.11 0.77 1.07 0.00 0.00 176.91 179.99 2occ h SER 279 N 0.59 0.23 -0.86 1.22 0.02 -1.06 -0.26 113.55 113.42 2occ h SER 279 Ca 0.05 -0.06 0.02 0.00 -0.84 0.00 0.00 61.79 60.96 2occ h SER 279 Cb 0.93 -0.06 -0.05 0.00 0.14 0.00 0.00 62.40 63.37 2occ h SER 279 CO 0.09 0.22 0.57 0.40 -1.14 0.00 0.00 176.83 176.96 2occ h ILE 280 N 0.22 1.19 -0.01 3.27 2.04 -1.24 -0.07 117.51 122.91 2occ h ILE 280 Ca 0.07 -0.39 -0.00 0.00 1.00 0.00 0.00 64.86 65.54 2occ h ILE 280 Cb 0.04 -0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.07 2occ h ILE 280 CO -0.01 0.21 0.01 1.23 0.00 0.00 0.00 178.15 179.58 2occ h GLY 281 N 1.14 0.02 0.95 5.37 0.00 -1.10 -0.84 103.07 108.61 2occ h GLY 281 Ca 0.33 -0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.62 2occ h GLY 281 CO -0.09 0.01 -0.27 -2.75 0.00 0.00 0.00 176.54 173.44 2occ h PHE 282 N -0.13 -0.70 -0.15 5.60 3.57 -0.87 -3.04 116.94 121.23 2occ h PHE 282 Ca 0.00 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.53 2occ h PHE 282 Cb 0.15 0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 2occ h PHE 282 CO -0.02 -0.41 0.11 -0.07 -2.23 0.00 0.00 178.31 175.68 2occ h LEU 283 N -0.82 0.00 0.00 0.59 3.38 -1.03 -2.23 115.31 115.20 2occ h LEU 283 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2occ h LEU 283 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2occ h LEU 283 CO 0.13 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.27 2occ n GLY 284 N -1.56 -0.64 0.00 0.83 0.00 -0.32 -2.52 105.19 100.98 2occ n GLY 284 Ca 0.01 -0.12 0.09 0.00 0.00 0.00 0.00 46.02 45.99 2occ n GLY 284 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2occ n PHE 285 N -0.97 0.00 -1.50 1.61 3.72 -0.84 -3.52 117.46 115.96 2occ n PHE 285 Ca 0.15 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.58 2occ n PHE 285 Cb 0.07 -0.07 0.20 0.00 -0.94 0.00 0.00 39.48 38.73 2occ n PHE 285 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 2occ n ILE 286 N -1.56 2.30 -1.02 4.37 -5.35 -1.05 -4.68 119.36 112.38 2occ n ILE 286 Ca 0.02 -2.99 0.01 0.00 -0.27 0.00 0.00 62.75 59.52 2occ n ILE 286 Cb 0.32 -0.27 0.01 0.00 -1.74 0.00 0.00 39.64 37.96 2occ n ILE 286 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 2occ n VAL 287 N -1.13 0.27 -0.34 7.28 0.24 -1.26 -4.91 118.33 118.50 2occ n VAL 287 Ca 0.23 -0.30 0.17 0.00 -2.04 0.00 0.00 64.34 62.41 2occ n VAL 287 Cb 0.80 0.75 0.40 0.00 -1.47 0.00 0.00 33.84 34.33 2occ n VAL 287 CO 0.00 0.00 0.00 4.11 -2.14 0.00 0.00 176.83 178.80 2occ h TRP 288 N 0.00 0.93 0.00 6.34 0.09 -1.83 -2.41 115.95 119.07 2occ h TRP 288 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 58.89 59.01 2occ h TRP 288 Cb 0.99 -0.27 0.00 0.00 0.08 0.00 0.00 29.16 29.96 2occ h TRP 288 CO 0.02 0.12 0.00 0.00 0.09 0.00 0.00 178.44 178.67 2occ n ALA 289 N -2.36 1.89 1.10 0.11 0.00 -1.26 -2.29 120.51 117.71 2occ n ALA 289 Ca 0.25 -0.05 0.10 0.00 0.00 0.00 0.00 53.44 53.73 2occ n ALA 289 Cb 0.72 -1.13 0.54 0.00 0.00 0.00 0.00 19.45 19.58 2occ n ALA 289 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2occ n HIS 290 N -0.87 0.00 -0.40 0.00 1.44 -0.91 -1.49 115.22 112.98 2occ n HIS 290 Ca 0.06 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.87 2occ n HIS 290 Cb 0.03 -0.09 0.29 0.00 0.12 0.00 0.00 29.99 30.34 2occ n HIS 290 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2occ n HIS 291 N -1.09 0.97 -2.65 -1.40 8.25 -0.97 -4.45 115.22 113.88 2occ n HIS 291 Ca 0.13 -0.54 0.01 0.00 -0.26 0.00 0.00 57.72 57.07 2occ n HIS 291 Cb 0.09 -0.07 0.04 0.00 1.12 0.00 0.00 29.99 31.17 2occ n HIS 291 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2occ n MET 292 N 1.22 1.00 0.05 -0.41 2.00 -0.56 -4.89 117.12 115.53 2occ n MET 292 Ca 0.22 -2.85 0.10 0.00 0.00 0.00 0.00 57.70 55.17 2occ n MET 292 Cb 0.64 -0.91 0.42 0.00 0.00 0.00 0.00 33.22 33.38 2occ n MET 292 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 2occ n PHE 293 N -0.12 0.33 -1.14 2.03 3.72 -1.25 -2.97 117.46 118.06 2occ n PHE 293 Ca 0.07 0.12 0.07 0.00 -0.05 0.00 0.00 57.45 57.67 2occ n PHE 293 Cb 0.96 -0.70 0.21 0.00 -0.94 0.00 0.00 39.48 39.01 2occ n PHE 293 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2occ n THR 294 N -1.80 2.19 0.71 4.37 -2.24 -1.26 -4.63 114.28 111.62 2occ n THR 294 Ca 0.04 -2.25 0.11 0.00 -2.27 0.00 0.00 64.05 59.68 2occ n THR 294 Cb 0.24 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.21 2occ n THR 294 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2occ n VAL 295 N -0.97 0.08 -0.14 2.28 0.31 -1.16 -4.98 118.33 113.75 2occ n VAL 295 Ca 0.21 -0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 2occ n VAL 295 Cb 0.81 0.43 0.00 0.00 -0.91 0.00 0.00 33.84 34.17 2occ n VAL 295 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2occ n GLY 296 N 1.42 1.43 3.92 2.92 0.00 -1.26 -5.10 105.19 108.51 2occ n GLY 296 Ca 0.03 -0.05 -0.26 0.00 0.00 0.00 0.00 46.02 45.74 2occ n GLY 296 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2occ s MET 297 N -0.73 3.52 0.58 1.61 1.00 -1.26 -5.03 119.30 118.99 2occ s MET 297 Ca 0.00 -0.01 -0.19 0.00 0.00 0.00 0.00 55.69 55.49 2occ s MET 297 Cb 0.00 -2.49 -0.06 0.00 0.00 0.00 0.00 34.83 32.28 2occ s MET 297 CO 0.00 -0.06 0.86 -0.25 0.00 0.00 0.00 175.02 175.57 2occ n ASP 298 N -2.04 0.34 -0.00 3.03 8.00 -1.26 -4.84 116.55 119.78 2occ n ASP 298 Ca -0.02 0.80 -0.02 0.00 0.71 0.00 0.00 54.79 56.27 2occ n ASP 298 Cb 0.55 -1.33 0.24 0.00 -0.02 0.00 0.00 41.12 40.56 2occ n ASP 298 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 2occ h VAL 299 N 0.48 1.23 -0.50 2.53 3.04 -1.98 -2.34 116.25 118.72 2occ h VAL 299 Ca -0.47 -1.03 -0.08 0.00 -1.01 0.00 0.00 66.70 64.11 2occ h VAL 299 Cb 1.37 1.13 -0.02 0.00 -2.01 0.00 0.00 31.29 31.76 2occ h VAL 299 CO 0.50 0.34 0.00 0.44 -1.01 0.00 0.00 177.57 177.84 2occ h ASP 300 N 0.49 0.86 0.81 3.17 3.32 -1.99 -0.27 116.42 122.81 2occ h ASP 300 Ca 0.09 -0.30 -0.05 0.00 0.02 0.00 0.00 57.03 56.79 2occ h ASP 300 Cb 0.50 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 2occ h ASP 300 CO 0.03 0.95 -0.24 0.71 -1.72 0.00 0.00 179.24 178.97 2occ h THR 301 N 0.74 0.63 -0.00 0.35 1.35 -1.88 -1.27 112.91 112.83 2occ h THR 301 Ca 0.14 -1.10 -0.18 0.00 -0.55 0.00 0.00 66.41 64.72 2occ h THR 301 Cb 0.51 1.73 -0.02 0.00 -1.73 0.00 0.00 68.15 68.64 2occ h THR 301 CO 0.02 0.23 -0.82 0.03 -0.25 0.00 0.00 175.52 174.74 2occ h ARG 302 N 0.00 0.11 -0.35 4.72 3.08 -0.91 -2.05 114.38 118.98 2occ h ARG 302 Ca -0.00 -0.11 -0.14 0.00 0.07 0.00 0.00 59.98 59.79 2occ h ARG 302 Cb 0.71 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.78 2occ h ARG 302 CO 0.03 0.86 -0.34 0.00 -1.07 0.00 0.00 179.97 179.46 2occ h ALA 303 N 1.10 0.73 0.41 0.04 0.00 -0.33 -2.52 119.26 118.69 2occ h ALA 303 Ca -0.03 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 2occ h ALA 303 Cb 1.43 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2occ h ALA 303 CO 0.12 0.66 -0.20 -0.92 0.00 0.00 0.00 179.25 178.91 2occ h TYR 304 N 0.67 -0.51 -0.04 0.00 3.20 -1.15 -2.07 116.97 117.07 2occ h TYR 304 Ca 0.07 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.94 2occ h TYR 304 Cb 0.89 0.17 -0.00 0.00 1.54 0.00 0.00 36.73 39.32 2occ h TYR 304 CO 0.05 -0.22 0.09 0.74 -1.64 0.00 0.00 178.16 177.18 2occ h PHE 305 N -0.76 0.00 0.16 -3.82 0.04 -1.37 0.90 116.94 112.09 2occ h PHE 305 Ca -0.06 0.00 -0.34 0.00 2.80 0.00 0.00 57.97 60.37 2occ h PHE 305 Cb 0.52 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.68 2occ h PHE 305 CO -0.00 0.00 -1.73 1.79 -0.60 0.00 0.00 178.31 177.76 2occ h THR 306 N 0.00 0.94 0.09 -1.55 1.35 -1.36 -2.92 112.91 109.47 2occ h THR 306 Ca 0.02 -2.56 -0.00 0.00 -0.55 0.00 0.00 66.41 63.31 2occ h THR 306 Cb 0.20 2.72 0.00 0.00 -1.73 0.00 0.00 68.15 69.33 2occ h THR 306 CO -0.00 0.84 -0.04 0.28 -0.25 0.00 0.00 175.52 176.35 2occ h SER 307 N 0.09 -0.10 -0.60 5.36 0.02 -0.49 -2.51 113.55 115.32 2occ h SER 307 Ca -0.33 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 60.54 2occ h SER 307 Cb 2.07 0.03 -0.03 0.00 0.14 0.00 0.00 62.40 64.61 2occ h SER 307 CO 0.16 0.01 0.34 0.00 -1.14 0.00 0.00 176.83 176.20 2occ h ALA 308 N 0.70 0.77 -0.32 3.77 0.00 -1.03 -2.32 119.26 120.83 2occ h ALA 308 Ca -0.01 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2occ h ALA 308 Cb 0.17 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2occ h ALA 308 CO 0.02 0.28 0.19 1.15 0.00 0.00 0.00 179.25 180.88 2occ h THR 309 N 0.81 1.10 -0.02 0.00 2.02 -1.45 -2.95 112.91 112.42 2occ h THR 309 Ca 0.21 -0.23 -0.14 0.00 0.77 0.00 0.00 66.41 67.02 2occ h THR 309 Cb 0.03 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 2occ h THR 309 CO -0.04 0.10 -0.65 0.24 0.37 0.00 0.00 175.52 175.55 2occ h MET 310 N 0.44 0.07 0.00 6.66 2.86 -0.96 -3.20 114.93 120.80 2occ h MET 310 Ca 0.12 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2occ h MET 310 Cb -0.00 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.67 2occ h MET 310 CO -0.02 0.70 0.00 -0.84 1.06 0.00 0.00 176.91 177.81 2occ h ILE 311 N 0.05 0.00 0.00 -1.22 3.07 -1.43 -2.03 117.51 115.95 2occ h ILE 311 Ca -0.01 -0.21 0.00 0.00 1.55 0.00 0.00 64.86 66.19 2occ h ILE 311 Cb 1.16 0.96 0.00 0.00 -0.27 0.00 0.00 36.82 38.67 2occ h ILE 311 CO 0.09 0.00 0.00 -0.38 -1.05 0.00 0.00 178.15 176.81 2occ n ILE 312 N -2.48 1.29 0.16 0.16 5.41 -1.21 -1.47 119.36 121.22 2occ n ILE 312 Ca 0.01 0.54 0.04 0.00 1.00 0.00 0.00 62.75 64.33 2occ n ILE 312 Cb 0.19 -1.50 0.12 0.00 -0.71 0.00 0.00 39.64 37.73 2occ n ILE 312 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2occ h ALA 313 N 2.09 0.76 0.75 -1.39 0.00 -1.60 -3.04 119.26 116.83 2occ h ALA 313 Ca 0.00 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.47 2occ h ALA 313 Cb 0.08 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.81 2occ h ALA 313 CO 0.00 0.55 -0.36 0.82 0.00 0.00 0.00 179.25 180.26 2occ h ILE 314 N 0.00 0.00 -0.31 0.00 2.04 -1.47 0.19 117.51 117.96 2occ h ILE 314 Ca -0.00 -0.20 0.02 0.00 1.00 0.00 0.00 64.86 65.67 2occ h ILE 314 Cb 1.24 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 2occ h ILE 314 CO 0.06 0.00 0.21 1.55 0.00 0.00 0.00 178.15 179.96 2occ h PRO 315 N -1.20 0.35 -0.13 2.37 0.13 -1.72 0.10 132.00 131.90 2occ h PRO 315 Ca -0.10 -0.02 -0.12 0.00 -0.87 0.00 0.00 66.00 64.89 2occ h PRO 315 Cb 0.77 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.81 2occ h PRO 315 CO 0.17 0.23 -0.43 1.15 -0.23 0.00 0.00 178.00 178.89 2occ h THR 316 N 0.36 1.32 -0.54 1.56 2.02 -1.44 -2.89 112.91 113.30 2occ h THR 316 Ca 0.12 -1.58 -0.12 0.00 0.77 0.00 0.00 66.41 65.60 2occ h THR 316 Cb 0.05 1.70 -0.02 0.00 -1.74 0.00 0.00 68.15 68.14 2occ h THR 316 CO -0.03 0.48 -0.13 1.23 0.37 0.00 0.00 175.52 177.44 2occ h GLY 317 N 1.22 1.11 1.71 2.16 0.00 0.14 -2.11 103.07 107.29 2occ h GLY 317 Ca 0.02 -0.91 -0.04 0.00 0.00 0.00 0.00 47.33 46.40 2occ h GLY 317 CO 0.07 0.83 -0.00 -0.39 0.00 0.00 0.00 176.54 177.05 2occ h VAL 318 N 0.91 1.16 -0.31 4.60 -1.51 -1.20 -1.03 116.25 118.86 2occ h VAL 318 Ca 0.14 -0.62 -0.07 0.00 -1.23 0.00 0.00 66.70 64.92 2occ h VAL 318 Cb 0.70 0.97 -0.01 0.00 -2.13 0.00 0.00 31.29 30.82 2occ h VAL 318 CO 0.05 0.21 -0.08 0.11 -1.23 0.00 0.00 177.57 176.63 2occ h LYS 319 N 0.37 0.60 -0.61 5.19 1.57 -1.31 -0.59 116.57 121.79 2occ h LYS 319 Ca 0.08 -0.23 -0.02 0.00 -1.87 0.00 0.00 60.65 58.61 2occ h LYS 319 Cb 0.25 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 2occ h LYS 319 CO 0.01 0.79 0.31 0.28 -0.57 0.00 0.00 179.45 180.27 2occ h VAL 320 N 0.38 1.21 0.00 0.50 2.07 -0.78 -1.95 116.25 117.66 2occ h VAL 320 Ca 0.08 -0.55 -0.09 0.00 0.82 0.00 0.00 66.70 66.96 2occ h VAL 320 Cb 0.57 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 2occ h VAL 320 CO 0.03 0.23 -0.43 -0.26 0.02 0.00 0.00 177.57 177.16 2occ h PHE 321 N 0.83 0.00 -0.13 1.57 0.04 -1.19 -2.85 116.94 115.21 2occ h PHE 321 Ca 0.21 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.82 2occ h PHE 321 Cb 0.08 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.23 2occ h PHE 321 CO -0.00 0.43 -0.61 0.77 -0.60 0.00 0.00 178.31 178.29 2occ h SER 322 N 0.00 0.52 -0.36 2.17 0.02 -0.56 -0.11 113.55 115.22 2occ h SER 322 Ca -0.00 -0.30 -0.08 0.00 -0.84 0.00 0.00 61.79 60.57 2occ h SER 322 Cb 0.92 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.29 2occ h SER 322 CO 0.06 1.01 -0.04 -0.50 -1.14 0.00 0.00 176.83 176.21 2occ h TRP 323 N 0.34 0.82 -0.31 3.45 6.55 -1.27 -0.93 115.95 124.60 2occ h TRP 323 Ca -0.01 -0.13 -0.17 0.00 0.95 0.00 0.00 58.89 59.54 2occ h TRP 323 Cb 1.16 -0.22 -0.00 0.00 -0.86 0.00 0.00 29.16 29.23 2occ h TRP 323 CO 0.04 0.79 -0.48 -0.07 -1.05 0.00 0.00 178.44 177.67 2occ h LEU 324 N 0.71 0.93 -1.52 -4.49 4.07 -1.32 -2.84 115.31 110.85 2occ h LEU 324 Ca 0.13 -0.46 -0.05 0.00 0.08 0.00 0.00 57.88 57.58 2occ h LEU 324 Cb 0.50 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.96 2occ h LEU 324 CO 0.03 1.25 -0.25 0.00 -1.08 0.00 0.00 178.44 178.38 2occ h ALA 325 N 0.78 1.45 -0.29 1.53 0.00 -0.64 -2.31 119.26 119.78 2occ h ALA 325 Ca 0.03 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.55 2occ h ALA 325 Cb 1.07 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 2occ h ALA 325 CO 0.11 0.31 -0.47 1.15 0.00 0.00 0.00 179.25 180.35 2occ h THR 326 N 0.00 1.29 0.00 0.00 2.02 -1.03 -2.62 112.91 112.56 2occ h THR 326 Ca -0.00 -1.66 -0.08 0.00 0.77 0.00 0.00 66.41 65.43 2occ h THR 326 Cb 0.48 1.56 -0.01 0.00 -1.74 0.00 0.00 68.15 68.44 2occ h THR 326 CO 0.03 0.54 -0.39 -0.07 0.37 0.00 0.00 175.52 176.00 2occ h LEU 327 N 0.62 0.00 -9.24 2.58 3.38 -1.25 -3.41 115.31 107.99 2occ h LEU 327 Ca 0.03 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.37 2occ h LEU 327 Cb 1.04 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.81 2occ h LEU 327 CO 0.10 0.39 1.09 1.57 0.09 0.00 0.00 178.44 181.68 2occ n HIS 328 N -3.77 2.28 -0.97 1.13 -0.00 -0.90 -1.06 115.22 111.93 2occ n HIS 328 Ca -0.01 0.06 0.00 0.00 0.46 0.00 0.00 57.72 58.23 2occ n HIS 328 Cb 0.46 -2.64 0.00 0.00 -0.12 0.00 0.00 29.99 27.69 2occ n HIS 328 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2occ n GLY 329 N 4.46 0.54 3.83 1.57 0.00 -1.26 -5.02 105.19 109.31 2occ n GLY 329 Ca 0.24 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.96 2occ n GLY 329 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2occ s GLY 330 N -2.00 1.62 -0.78 -0.02 0.00 -0.22 -4.96 107.32 100.95 2occ s GLY 330 Ca 0.00 -0.26 -0.14 0.00 0.00 0.00 0.00 44.72 44.32 2occ s GLY 330 CO 0.00 0.16 0.73 0.21 0.00 0.00 0.00 173.10 174.19 2occ s ASN 331 N -4.05 6.67 -0.01 1.64 2.47 0.33 -5.00 114.94 116.99 2occ s ASN 331 Ca 0.60 -2.56 -0.30 0.00 0.42 0.00 0.00 52.86 51.02 2occ s ASN 331 Cb -0.13 -2.21 -0.05 0.00 -1.45 0.00 0.00 41.25 37.41 2occ s ASN 331 CO 0.53 -0.61 1.33 -0.63 -3.72 0.00 0.00 177.10 174.00 2occ s ILE 332 N 0.37 3.88 -0.34 -5.21 -1.09 -1.26 -3.95 121.20 113.60 2occ s ILE 332 Ca 0.16 1.25 -0.09 0.00 -2.23 0.00 0.00 60.65 59.74 2occ s ILE 332 Cb -0.13 -3.80 0.02 0.00 -1.58 0.00 0.00 42.46 36.96 2occ s ILE 332 CO -0.07 0.01 0.15 -0.75 -1.23 0.00 0.00 174.94 173.04 2occ s LYS 333 N 2.23 2.99 -1.18 2.79 2.20 -0.48 -5.00 119.74 123.30 2occ s LYS 333 Ca 0.61 -0.95 -0.15 0.00 -0.36 0.00 0.00 55.97 55.13 2occ s LYS 333 Cb -0.29 -3.57 -0.06 0.00 -1.51 0.00 0.00 37.83 32.40 2occ s LYS 333 CO 0.25 -0.56 2.23 0.91 -0.36 0.00 0.00 175.35 177.82 2occ n TRP 334 N 4.94 2.48 -2.43 4.03 7.02 -1.26 -4.77 117.44 127.45 2occ n TRP 334 Ca -0.13 -2.47 -0.25 0.00 -1.02 0.00 0.00 57.50 53.63 2occ n TRP 334 Cb 0.47 -2.14 0.04 0.00 -2.42 0.00 0.00 31.31 27.26 2occ n TRP 334 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 2occ s SER 335 N 3.63 5.37 0.20 -0.99 1.04 -1.26 -4.92 113.70 116.77 2occ s SER 335 Ca 0.53 0.52 -0.11 0.00 0.48 0.00 0.00 55.95 57.36 2occ s SER 335 Cb 0.14 -1.43 0.19 0.00 0.10 0.00 0.00 66.02 65.02 2occ s SER 335 CO -0.01 -1.18 1.80 1.55 0.98 0.00 0.00 173.24 176.38 2occ h PRO 336 N -0.20 0.59 -0.76 4.02 0.13 -1.92 -1.38 132.00 132.48 2occ h PRO 336 Ca -0.45 -0.04 0.06 0.00 -0.87 0.00 0.00 66.00 64.71 2occ h PRO 336 Cb 1.28 -0.13 -0.05 0.00 0.13 0.00 0.00 31.00 32.23 2occ h PRO 336 CO 0.59 0.39 0.50 0.00 -0.23 0.00 0.00 178.00 179.25 2occ h ALA 337 N 1.31 1.65 -0.11 -0.56 0.00 -1.91 0.97 119.26 120.61 2occ h ALA 337 Ca 0.26 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 55.01 2occ h ALA 337 Cb 0.15 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2occ h ALA 337 CO -0.16 0.23 -0.55 1.98 0.00 0.00 0.00 179.25 180.75 2occ h MET 338 N 0.82 0.33 -0.46 0.00 1.85 -1.59 -2.02 114.93 113.86 2occ h MET 338 Ca 0.32 -0.20 -0.06 0.00 -0.61 0.00 0.00 59.70 59.15 2occ h MET 338 Cb 0.22 0.02 -0.02 0.00 0.43 0.00 0.00 31.60 32.26 2occ h MET 338 CO -0.11 0.79 0.05 0.52 -0.40 0.00 0.00 176.91 177.76 2occ h MET 339 N 0.25 0.78 -0.55 0.39 2.86 0.04 -1.27 114.93 117.42 2occ h MET 339 Ca 0.00 -0.22 -0.02 0.00 -2.06 0.00 0.00 59.70 57.40 2occ h MET 339 Cb 1.04 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.59 2occ h MET 339 CO 0.09 0.81 0.26 -1.49 1.06 0.00 0.00 176.91 177.64 2occ h TRP 340 N 0.64 0.77 -0.05 -0.22 4.06 -0.98 -2.30 115.95 117.87 2occ h TRP 340 Ca 0.14 -0.02 -0.19 0.00 2.06 0.00 0.00 58.89 60.87 2occ h TRP 340 Cb 0.43 -0.24 -0.00 0.00 -1.00 0.00 0.00 29.16 28.34 2occ h TRP 340 CO 0.03 0.57 -0.78 0.00 -3.56 0.00 0.00 178.44 174.70 2occ h ALA 341 N 1.51 0.56 -0.16 1.49 0.00 -0.98 -2.19 119.26 119.48 2occ h ALA 341 Ca 0.19 -0.64 -0.19 0.00 0.00 0.00 0.00 54.91 54.28 2occ h ALA 341 Cb 0.09 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2occ h ALA 341 CO -0.02 0.79 -0.66 -0.07 0.00 0.00 0.00 179.25 179.29 2occ h LEU 342 N 0.24 0.71 -0.57 0.00 3.38 -1.02 -2.16 115.31 115.89 2occ h LEU 342 Ca -0.04 -0.42 -0.02 0.00 0.09 0.00 0.00 57.88 57.49 2occ h LEU 342 Cb 1.37 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.89 2occ h LEU 342 CO 0.13 1.18 0.27 1.23 0.09 0.00 0.00 178.44 181.34 2occ h GLY 343 N 0.96 0.88 0.78 0.83 0.00 -1.40 -2.70 103.07 102.41 2occ h GLY 343 Ca -0.02 -0.44 0.01 0.00 0.00 0.00 0.00 47.33 46.88 2occ h GLY 343 CO 0.13 0.41 -0.15 -2.75 0.00 0.00 0.00 176.54 174.18 2occ h PHE 344 N 0.77 -0.40 -0.70 5.60 3.04 -1.32 -0.20 116.94 123.74 2occ h PHE 344 Ca 0.20 0.00 0.14 0.00 3.98 0.00 0.00 57.97 62.29 2occ h PHE 344 Cb 0.12 0.16 -0.10 0.00 2.56 0.00 0.00 35.95 38.69 2occ h PHE 344 CO -0.00 -0.23 0.20 0.82 -2.02 0.00 0.00 178.31 177.08 2occ h ILE 345 N -0.32 0.60 0.08 1.41 2.04 -1.21 0.14 117.51 120.25 2occ h ILE 345 Ca 0.01 -0.11 -0.00 0.00 1.00 0.00 0.00 64.86 65.76 2occ h ILE 345 Cb 0.32 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 2occ h ILE 345 CO -0.06 0.06 -0.04 0.15 0.00 0.00 0.00 178.15 178.26 2occ h PHE 346 N 0.33 -0.09 -0.98 1.37 3.57 -1.22 -3.11 116.94 116.79 2occ h PHE 346 Ca 0.38 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.89 2occ h PHE 346 Cb 0.61 0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.33 2occ h PHE 346 CO -0.22 0.45 0.63 -0.07 -2.23 0.00 0.00 178.31 176.87 2occ h LEU 347 N -0.89 1.15 -1.19 0.59 4.07 -0.92 -1.00 115.31 117.12 2occ h LEU 347 Ca -0.01 -0.05 -0.06 0.00 0.08 0.00 0.00 57.88 57.84 2occ h LEU 347 Cb 0.59 -0.29 -0.02 0.00 1.08 0.00 0.00 40.66 42.03 2occ h LEU 347 CO 0.02 0.85 -0.10 0.15 -1.08 0.00 0.00 178.44 178.28 2occ h PHE 348 N 1.34 0.47 -0.54 1.13 3.57 -0.86 -1.18 116.94 120.88 2occ h PHE 348 Ca 0.36 -0.06 -0.07 0.00 3.53 0.00 0.00 57.97 61.73 2occ h PHE 348 Cb -0.12 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.47 2occ h PHE 348 CO 0.00 0.53 0.08 1.15 -2.23 0.00 0.00 178.31 177.85 2occ h THR 349 N 0.41 1.25 -0.03 4.41 2.02 -1.14 0.07 112.91 119.91 2occ h THR 349 Ca 0.08 -0.97 -0.00 0.00 0.77 0.00 0.00 66.41 66.29 2occ h THR 349 Cb 0.43 0.84 -0.00 0.00 -1.74 0.00 0.00 68.15 67.68 2occ h THR 349 CO 0.02 0.35 0.02 0.58 0.37 0.00 0.00 175.52 176.86 2occ h VAL 350 N 0.78 1.10 -0.11 3.16 2.07 -1.03 -0.87 116.25 121.34 2occ h VAL 350 Ca 0.16 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.37 2occ h VAL 350 Cb 0.42 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 2occ h VAL 350 CO 0.01 0.08 -0.08 1.23 0.02 0.00 0.00 177.57 178.83 2occ h GLY 351 N -0.07 0.17 1.68 2.17 0.00 -1.15 -1.87 103.07 104.01 2occ h GLY 351 Ca 0.01 -0.09 -0.26 0.00 0.00 0.00 0.00 47.33 46.99 2occ h GLY 351 CO -0.00 0.08 -1.17 -1.33 0.00 0.00 0.00 176.54 174.12 2occ h GLY 352 N 0.52 0.28 1.00 4.60 0.00 -0.64 -2.95 103.07 105.89 2occ h GLY 352 Ca 0.03 -0.68 -0.08 0.00 0.00 0.00 0.00 47.33 46.60 2occ h GLY 352 CO 0.01 0.60 -0.04 1.41 0.00 0.00 0.00 176.54 178.52 2occ h LEU 353 N 0.08 0.82 -2.65 3.11 4.07 -0.85 -1.85 115.31 118.04 2occ h LEU 353 Ca -0.11 -0.33 -0.00 0.00 0.08 0.00 0.00 57.88 57.52 2occ h LEU 353 Cb 1.90 -0.22 -0.00 0.00 1.08 0.00 0.00 40.66 43.42 2occ h LEU 353 CO 0.19 0.95 -0.01 0.74 -1.08 0.00 0.00 178.44 179.23 2occ h THR 354 N 0.66 0.17 0.00 0.22 2.02 -1.39 0.70 112.91 115.29 2occ h THR 354 Ca 0.12 -0.09 -0.12 0.00 0.77 0.00 0.00 66.41 67.08 2occ h THR 354 Cb 0.56 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 2occ h THR 354 CO 0.03 0.01 -0.69 1.23 0.37 0.00 0.00 175.52 176.47 2occ h GLY 355 N 0.26 0.00 1.87 2.16 0.00 -1.16 -3.13 103.07 103.08 2occ h GLY 355 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.18 2occ h GLY 355 CO 0.00 0.00 -0.69 -2.22 0.00 0.00 0.00 176.54 173.64 2occ h ILE 356 N 0.00 1.45 -0.03 2.60 1.08 -0.51 -2.49 117.51 119.61 2occ h ILE 356 Ca -0.03 -2.24 -0.00 0.00 -0.39 0.00 0.00 64.86 62.20 2occ h ILE 356 Cb 1.45 2.20 -0.00 0.00 -3.07 0.00 0.00 36.82 37.39 2occ h ILE 356 CO 0.07 0.65 0.01 0.58 -0.69 0.00 0.00 178.15 178.77 2occ h VAL 357 N 0.09 1.11 0.00 1.67 2.07 -1.45 -2.49 116.25 117.25 2occ h VAL 357 Ca -0.01 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.17 2occ h VAL 357 Cb 1.22 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 2occ h VAL 357 CO 0.10 0.09 0.00 -0.07 0.02 0.00 0.00 177.57 177.71 2occ h LEU 358 N -0.10 0.00 -1.74 2.57 3.38 -1.51 -2.53 115.31 115.38 2occ h LEU 358 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2occ h LEU 358 Cb 0.14 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 2occ h LEU 358 CO -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 178.44 178.51 2occ h ALA 359 N 2.15 1.01 -1.70 1.53 0.00 -0.97 -3.42 119.26 117.86 2occ h ALA 359 Ca 0.00 -0.01 -0.56 0.00 0.00 0.00 0.00 54.91 54.34 2occ h ALA 359 Cb 0.32 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.05 2occ h ALA 359 CO 0.00 0.02 1.01 -0.80 0.00 0.00 0.00 179.25 179.48 2occ s ASN 360 N -5.64 6.43 0.20 0.00 0.01 -0.95 -4.39 114.94 110.60 2occ s ASN 360 Ca -0.00 0.50 -0.10 0.00 -0.71 0.00 0.00 52.86 52.55 2occ s ASN 360 Cb 0.10 -2.55 0.23 0.00 0.41 0.00 0.00 41.25 39.45 2occ s ASN 360 CO 0.53 -1.42 1.78 0.77 -1.51 0.00 0.00 177.10 177.25 2occ h SER 361 N 10.04 0.41 -0.11 -1.22 4.64 -1.87 0.36 113.55 125.81 2occ h SER 361 Ca -0.25 0.04 0.04 0.00 -0.47 0.00 0.00 61.79 61.15 2occ h SER 361 Cb 1.08 -0.03 -0.05 0.00 -0.31 0.00 0.00 62.40 63.09 2occ h SER 361 CO 1.13 0.26 -0.21 0.77 -0.87 0.00 0.00 176.83 177.91 2occ h SER 362 N 0.56 -0.65 1.06 4.97 4.64 -1.95 -1.16 113.55 121.02 2occ h SER 362 Ca 0.29 0.11 -0.05 0.00 -0.47 0.00 0.00 61.79 61.66 2occ h SER 362 Cb 0.24 0.29 -0.01 0.00 -0.31 0.00 0.00 62.40 62.61 2occ h SER 362 CO -0.22 -0.26 -0.26 0.25 -0.87 0.00 0.00 176.83 175.47 2occ h LEU 363 N -0.28 0.00 -0.70 5.97 5.85 -1.80 -2.97 115.31 121.38 2occ h LEU 363 Ca 0.09 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.81 2occ h LEU 363 Cb 0.42 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.45 2occ h LEU 363 CO -0.27 0.26 0.00 -0.78 -0.34 0.00 0.00 178.44 177.31 2occ h ASP 364 N 0.00 0.00 -0.23 1.25 3.58 0.96 -2.98 116.42 118.99 2occ h ASP 364 Ca -0.00 0.00 0.05 0.00 0.42 0.00 0.00 57.03 57.50 2occ h ASP 364 Cb 0.86 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.86 2occ h ASP 364 CO 0.03 0.00 -0.08 0.40 -2.88 0.00 0.00 179.24 176.71 2occ h ILE 365 N 0.00 0.71 0.00 2.25 1.08 -1.27 0.39 117.51 120.67 2occ h ILE 365 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2occ h ILE 365 Cb 0.52 0.71 0.00 0.00 -3.07 0.00 0.00 36.82 34.98 2occ h ILE 365 CO 0.00 0.00 -0.35 0.55 -0.69 0.00 0.00 178.15 177.66 2occ n VAL 366 N -5.24 0.01 -0.04 1.67 3.14 -1.14 -4.02 118.33 112.71 2occ n VAL 366 Ca -0.01 -0.01 0.02 0.00 -2.96 0.00 0.00 64.34 61.38 2occ n VAL 366 Cb 0.17 0.01 -0.15 0.00 -1.06 0.00 0.00 33.84 32.81 2occ n VAL 366 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 2occ n LEU 367 N -1.52 0.00 -4.70 6.55 4.77 -1.03 -4.88 117.00 116.19 2occ n LEU 367 Ca 0.06 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.62 2occ n LEU 367 Cb 0.34 0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 2occ n LEU 367 CO 0.33 0.19 0.90 1.57 -1.33 0.00 0.00 177.39 179.04 2occ n HIS 368 N -2.38 2.23 -1.78 -1.77 -0.00 0.14 -1.83 115.22 109.82 2occ n HIS 368 Ca -0.14 0.53 -0.19 0.00 0.46 0.00 0.00 57.72 58.38 2occ n HIS 368 Cb 0.75 -2.40 -0.06 0.00 -0.12 0.00 0.00 29.99 28.16 2occ n HIS 368 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 2occ n ASP 369 N 0.55 -5.13 -4.82 0.26 8.00 -1.26 -4.99 116.55 109.16 2occ n ASP 369 Ca 0.05 0.35 -0.26 0.00 0.71 0.00 0.00 54.79 55.64 2occ n ASP 369 Cb 0.37 -4.49 -0.04 0.00 -0.02 0.00 0.00 41.12 36.94 2occ n ASP 369 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2occ s THR 370 N -2.70 1.88 -2.00 -3.53 -4.23 -0.76 -1.37 115.64 102.93 2occ s THR 370 Ca 0.00 -1.62 0.16 0.00 -1.18 0.00 0.00 61.69 59.05 2occ s THR 370 Cb 0.00 -2.51 0.46 0.00 1.34 0.00 0.00 72.50 71.79 2occ s THR 370 CO 0.00 0.00 1.39 -1.22 -0.54 0.00 0.00 174.62 174.25 2occ n TYR 371 N -1.49 0.00 0.10 3.99 4.02 -0.62 -2.18 117.16 120.98 2occ n TYR 371 Ca -0.04 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.80 2occ n TYR 371 Cb 0.65 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 40.02 2occ n TYR 371 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 176.86 174.93 2occ h TYR 372 N 0.00 0.15 0.00 -0.72 3.20 -1.81 -2.33 116.97 115.46 2occ h TYR 372 Ca 0.00 -0.08 -0.18 0.00 3.14 0.00 0.00 58.73 61.61 2occ h TYR 372 Cb 0.00 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.23 2occ h TYR 372 CO 0.00 0.84 -0.87 -0.39 -1.64 0.00 0.00 178.16 176.10 2occ h VAL 373 N 0.07 1.61 -0.29 1.81 -1.51 -1.66 -2.73 116.25 113.55 2occ h VAL 373 Ca -0.02 -2.94 -0.05 0.00 -1.23 0.00 0.00 66.70 62.45 2occ h VAL 373 Cb 1.36 2.59 -0.02 0.00 -2.13 0.00 0.00 31.29 33.10 2occ h VAL 373 CO 0.11 0.84 -0.05 0.58 -1.23 0.00 0.00 177.57 177.82 2occ h VAL 374 N 0.01 1.20 -0.02 7.19 2.07 -1.63 -2.05 116.25 123.02 2occ h VAL 374 Ca -0.01 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.68 2occ h VAL 374 Cb 1.53 1.03 -0.00 0.00 -1.52 0.00 0.00 31.29 32.34 2occ h VAL 374 CO 0.12 0.27 -0.03 0.00 0.02 0.00 0.00 177.57 177.95 2occ h ALA 375 N 1.52 0.03 0.15 1.67 0.00 -1.31 -2.70 119.26 118.62 2occ h ALA 375 Ca 0.09 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.74 2occ h ALA 375 Cb 0.37 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 2occ h ALA 375 CO 0.02 -0.19 -0.49 1.25 0.00 0.00 0.00 179.25 179.84 2occ h HIS 376 N -0.43 -1.41 0.00 0.00 6.17 -1.20 -2.05 115.15 116.23 2occ h HIS 376 Ca 0.00 0.03 0.00 0.00 0.71 0.00 0.00 60.37 61.12 2occ h HIS 376 Cb 0.54 0.60 0.00 0.00 2.52 0.00 0.00 27.41 31.07 2occ h HIS 376 CO 0.10 -0.56 0.00 0.27 0.71 0.00 0.00 177.93 178.45 2occ h PHE 377 N -0.72 0.00 0.00 5.26 -5.15 -1.46 -1.06 116.94 113.80 2occ h PHE 377 Ca -0.01 0.00 -0.10 0.00 -0.20 0.00 0.00 57.97 57.66 2occ h PHE 377 Cb 0.71 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.87 2occ h PHE 377 CO -0.42 0.00 -0.81 0.45 -2.00 0.00 0.00 178.31 175.52 2occ h HIS 378 N 0.00 0.00 -0.19 6.09 3.86 -1.20 -1.40 115.15 122.31 2occ h HIS 378 Ca 0.00 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.15 2occ h HIS 378 Cb 0.21 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.67 2occ h HIS 378 CO 0.00 0.39 -0.13 1.88 0.86 0.00 0.00 177.93 180.93 2occ h TYR 379 N 0.00 0.49 0.00 2.45 -1.99 -0.48 0.29 116.97 117.73 2occ h TYR 379 Ca -0.05 -0.14 -0.14 0.00 2.00 0.00 0.00 58.73 60.40 2occ h TYR 379 Cb 1.35 -0.11 -0.02 0.00 2.00 0.00 0.00 36.73 39.95 2occ h TYR 379 CO 0.00 0.75 -0.68 -0.39 -0.00 0.00 0.00 178.16 177.85 2occ h VAL 380 N 0.09 1.35 0.00 -2.88 -1.51 -1.53 -2.40 116.25 109.37 2occ h VAL 380 Ca 0.04 -2.43 -0.27 0.00 -1.23 0.00 0.00 66.70 62.80 2occ h VAL 380 Cb 0.65 2.36 -0.04 0.00 -2.13 0.00 0.00 31.29 32.13 2occ h VAL 380 CO 0.04 0.66 -1.52 0.18 -1.23 0.00 0.00 177.57 175.70 2occ n LEU 381 N -3.53 1.88 0.15 4.19 4.77 -0.53 -1.20 117.00 122.73 2occ n LEU 381 Ca -0.00 0.41 0.03 0.00 -0.03 0.00 0.00 56.01 56.42 2occ n LEU 381 Cb 0.71 -0.93 0.11 0.00 -2.33 0.00 0.00 43.42 40.98 2occ n LEU 381 CO 0.42 0.30 0.53 0.28 -1.33 0.00 0.00 177.39 177.59 2occ h SER 382 N -1.00 0.00 0.00 -1.43 0.02 -0.60 -1.52 113.55 109.02 2occ h SER 382 Ca -0.41 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 2occ h SER 382 Cb 1.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.88 2occ h SER 382 CO -0.25 0.47 -0.01 0.23 -1.14 0.00 0.00 176.83 176.13 2occ n MET 383 N -3.29 2.26 0.00 3.45 2.81 -0.93 -4.33 117.12 117.09 2occ n MET 383 Ca 0.01 -1.78 0.00 0.00 -1.81 0.00 0.00 57.70 54.12 2occ n MET 383 Cb 0.68 -1.12 0.00 0.00 -0.71 0.00 0.00 33.22 32.07 2occ n MET 383 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2occ n GLY 384 N -0.76 0.81 0.34 3.03 0.00 -1.03 -4.19 105.19 103.39 2occ n GLY 384 Ca 0.05 -0.02 0.01 0.00 0.00 0.00 0.00 46.02 46.05 2occ n GLY 384 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2occ h ALA 385 N 1.00 0.35 -0.25 4.61 0.00 -1.14 0.20 119.26 124.03 2occ h ALA 385 Ca 0.00 0.29 -0.05 0.00 0.00 0.00 0.00 54.91 55.15 2occ h ALA 385 Cb 0.00 0.76 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2occ h ALA 385 CO 0.00 -0.51 -0.05 0.28 0.00 0.00 0.00 179.25 178.98 2occ h VAL 386 N -0.03 1.18 -0.15 0.00 2.07 -1.50 -1.51 116.25 116.30 2occ h VAL 386 Ca 0.36 -0.75 -0.16 0.00 0.82 0.00 0.00 66.70 66.98 2occ h VAL 386 Cb 0.61 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 2occ h VAL 386 CO -0.87 0.25 -0.56 -0.26 0.02 0.00 0.00 177.57 176.14 2occ h PHE 387 N 0.38 0.59 -0.42 1.57 -1.00 -0.82 -2.11 116.94 115.13 2occ h PHE 387 Ca 0.08 -0.21 -0.08 0.00 2.81 0.00 0.00 57.97 60.57 2occ h PHE 387 Cb 0.33 -0.11 -0.01 0.00 3.61 0.00 0.00 35.95 39.76 2occ h PHE 387 CO 0.01 0.92 -0.05 0.00 -1.61 0.00 0.00 178.31 177.58 2occ h ALA 388 N 1.03 0.58 -0.49 2.45 0.00 -0.75 -1.52 119.26 120.56 2occ h ALA 388 Ca 0.00 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.65 2occ h ALA 388 Cb 1.09 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 2occ h ALA 388 CO 0.10 0.41 0.27 0.82 0.00 0.00 0.00 179.25 180.86 2occ h ILE 389 N 0.61 1.01 -0.48 0.00 2.04 -1.20 0.77 117.51 120.26 2occ h ILE 389 Ca 0.11 -0.19 -0.08 0.00 1.00 0.00 0.00 64.86 65.71 2occ h ILE 389 Cb 0.56 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 2occ h ILE 389 CO 0.03 0.10 -0.00 0.24 0.00 0.00 0.00 178.15 178.52 2occ h MET 390 N 0.54 0.85 -0.14 2.37 2.86 -1.23 -0.30 114.93 119.89 2occ h MET 390 Ca 0.21 -0.27 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 2occ h MET 390 Cb 0.07 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 2occ h MET 390 CO -0.12 0.90 0.05 0.78 1.06 0.00 0.00 176.91 179.58 2occ h GLY 391 N 0.71 0.24 1.28 8.32 0.00 -0.99 -1.59 103.07 111.03 2occ h GLY 391 Ca 0.14 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2occ h GLY 391 CO 0.03 0.12 0.39 -1.33 0.00 0.00 0.00 176.54 175.75 2occ h GLY 392 N 0.07 1.02 0.80 4.60 0.00 -0.81 -1.82 103.07 106.93 2occ h GLY 392 Ca 0.05 -0.44 -0.04 0.00 0.00 0.00 0.00 47.33 46.89 2occ h GLY 392 CO -0.00 0.42 -0.05 -2.75 0.00 0.00 0.00 176.54 174.16 2occ h PHE 393 N 0.96 0.43 0.00 5.60 3.57 -0.78 -1.68 116.94 125.05 2occ h PHE 393 Ca 0.25 -0.09 -0.10 0.00 3.53 0.00 0.00 57.97 61.56 2occ h PHE 393 Cb 0.01 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 2occ h PHE 393 CO 0.01 0.64 -0.45 -0.39 -2.23 0.00 0.00 178.31 175.88 2occ h VAL 394 N 0.10 0.99 -0.01 1.41 -1.51 -1.13 -0.73 116.25 115.37 2occ h VAL 394 Ca 0.05 -1.79 -0.01 0.00 -1.23 0.00 0.00 66.70 63.72 2occ h VAL 394 Cb 0.50 2.07 0.00 0.00 -2.13 0.00 0.00 31.29 31.73 2occ h VAL 394 CO 0.02 0.45 -0.03 -0.74 -1.23 0.00 0.00 177.57 176.03 2occ h HIS 395 N 0.00 0.04 -0.01 5.19 -0.00 -1.30 -3.34 115.15 115.73 2occ h HIS 395 Ca -0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.35 2occ h HIS 395 Cb 1.04 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 28.44 2occ h HIS 395 CO 0.00 0.72 -0.28 0.91 -0.00 0.00 0.00 177.93 179.28 2occ n TRP 396 N -4.73 0.00 -0.33 5.26 8.01 -0.64 -4.37 117.44 120.65 2occ n TRP 396 Ca -0.09 0.00 0.11 0.00 -1.31 0.00 0.00 57.50 56.21 2occ n TRP 396 Cb 0.36 -0.08 0.32 0.00 -2.01 0.00 0.00 31.31 29.90 2occ n TRP 396 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.69 177.03 2occ h PHE 397 N 1.68 1.00 -0.07 -5.99 3.57 -1.25 -1.27 116.94 114.60 2occ h PHE 397 Ca 0.00 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.47 2occ h PHE 397 Cb 0.58 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 2occ h PHE 397 CO 0.00 0.32 -0.22 -1.35 -2.23 0.00 0.00 178.31 174.83 2occ h PRO 398 N 0.80 0.12 -0.23 6.41 0.11 -1.76 -1.19 132.00 136.27 2occ h PRO 398 Ca 0.51 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 66.39 2occ h PRO 398 Cb 0.74 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.84 2occ h PRO 398 CO -0.28 0.35 -0.64 1.25 -0.21 0.00 0.00 178.00 178.47 2occ h LEU 399 N 0.12 0.91 -0.36 2.35 5.85 -1.54 0.31 115.31 122.95 2occ h LEU 399 Ca 0.02 -0.53 -0.19 0.00 0.84 0.00 0.00 57.88 58.02 2occ h LEU 399 Cb 0.46 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.23 2occ h LEU 399 CO 0.03 1.32 -0.69 -0.26 -0.34 0.00 0.00 178.44 178.51 2occ h PHE 400 N 0.59 0.76 0.00 1.25 0.04 -1.09 -3.37 116.94 115.13 2occ h PHE 400 Ca -0.01 -0.32 -0.25 0.00 2.80 0.00 0.00 57.97 60.19 2occ h PHE 400 Cb 1.24 -0.13 -0.05 0.00 2.20 0.00 0.00 35.95 39.22 2occ h PHE 400 CO 0.07 1.09 -1.95 -1.13 -0.60 0.00 0.00 178.31 175.79 2occ n SER 401 N -3.91 1.68 0.00 2.17 3.41 -0.48 -4.77 113.62 111.73 2occ n SER 401 Ca -0.05 -0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 2occ n SER 401 Cb 0.69 0.74 0.00 0.00 -0.26 0.00 0.00 64.21 65.37 2occ n SER 401 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2occ n GLY 402 N 2.19 0.77 3.46 5.00 0.00 0.11 -4.48 105.19 112.24 2occ n GLY 402 Ca -0.23 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.51 2occ n GLY 402 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2occ s TYR 403 N -2.69 2.40 0.18 1.61 2.02 -1.26 -1.52 117.35 118.09 2occ s TYR 403 Ca 0.00 -0.32 0.04 0.00 -0.37 0.00 0.00 57.07 56.42 2occ s TYR 403 Cb 0.00 -1.21 -0.03 0.00 -0.40 0.00 0.00 41.96 40.32 2occ s TYR 403 CO 0.00 0.47 0.25 0.95 -1.57 0.00 0.00 175.55 175.65 2occ s THR 404 N -1.54 4.99 0.49 -0.71 -4.23 -0.81 -3.94 115.64 109.88 2occ s THR 404 Ca 0.20 -0.94 -0.04 0.00 -1.18 0.00 0.00 61.69 59.74 2occ s THR 404 Cb -0.09 -3.61 -0.02 0.00 1.34 0.00 0.00 72.50 70.12 2occ s THR 404 CO 0.10 -0.18 0.78 -0.76 -0.54 0.00 0.00 174.62 174.02 2occ s LEU 405 N -3.43 3.59 -0.53 4.79 1.43 -1.26 -4.68 118.68 118.58 2occ s LEU 405 Ca 0.33 0.78 -0.25 0.00 -1.03 0.00 0.00 54.13 53.96 2occ s LEU 405 Cb -0.10 -3.69 0.04 0.00 0.03 0.00 0.00 46.19 42.46 2occ s LEU 405 CO 0.27 -0.66 0.98 0.21 0.23 0.00 0.00 176.35 177.37 2occ s ASN 406 N -4.15 6.40 0.47 2.29 3.84 -1.26 -4.91 114.94 117.62 2occ s ASN 406 Ca 0.48 -0.15 0.20 0.00 0.21 0.00 0.00 52.86 53.59 2occ s ASN 406 Cb -0.10 -2.46 1.19 0.00 -0.55 0.00 0.00 41.25 39.33 2occ s ASN 406 CO 0.43 -1.22 1.94 0.44 -2.79 0.00 0.00 177.10 175.91 2occ h ASP 407 N 9.29 0.24 -0.33 -4.21 5.19 -1.99 -2.36 116.42 122.25 2occ h ASP 407 Ca -0.25 0.01 -0.05 0.00 -0.62 0.00 0.00 57.03 56.12 2occ h ASP 407 Cb 1.07 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.54 2occ h ASP 407 CO 1.09 0.12 0.01 0.74 -3.12 0.00 0.00 179.24 178.08 2occ h THR 408 N 0.25 1.25 -0.42 0.35 2.02 -2.00 -2.50 112.91 111.87 2occ h THR 408 Ca 0.33 -0.92 -0.01 0.00 0.77 0.00 0.00 66.41 66.58 2occ h THR 408 Cb 0.95 1.21 -0.02 0.00 -1.74 0.00 0.00 68.15 68.55 2occ h THR 408 CO -0.07 0.30 0.22 -0.50 0.37 0.00 0.00 175.52 175.84 2occ h TRP 409 N 0.38 0.58 -0.50 3.16 -0.00 -1.88 -1.43 115.95 116.25 2occ h TRP 409 Ca 0.09 -0.02 0.08 0.00 -0.00 0.00 0.00 58.89 59.04 2occ h TRP 409 Cb 0.42 -0.18 -0.03 0.00 -0.00 0.00 0.00 29.16 29.37 2occ h TRP 409 CO 0.03 0.45 0.34 0.00 -0.00 0.00 0.00 178.44 179.26 2occ h ALA 410 N 1.08 2.01 0.09 1.49 0.00 -1.34 0.62 119.26 123.20 2occ h ALA 410 Ca 0.15 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.78 2occ h ALA 410 Cb 0.07 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.79 2occ h ALA 410 CO -0.02 -0.11 -1.14 0.87 0.00 0.00 0.00 179.25 178.85 2occ h LYS 411 N 0.35 0.33 -0.71 0.00 1.57 -0.93 -1.99 116.57 115.20 2occ h LYS 411 Ca 0.22 -0.48 -0.03 0.00 -1.87 0.00 0.00 60.65 58.50 2occ h LYS 411 Cb 0.43 0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.87 2occ h LYS 411 CO -0.05 1.19 0.34 0.82 -0.57 0.00 0.00 179.45 181.17 2occ h ILE 412 N 0.13 1.23 -0.23 1.86 2.04 -0.21 -1.31 117.51 121.04 2occ h ILE 412 Ca -0.12 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.08 2occ h ILE 412 Cb 1.83 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 38.25 2occ h ILE 412 CO 0.19 0.28 0.15 -0.74 0.00 0.00 0.00 178.15 178.02 2occ h HIS 413 N 1.00 0.30 -0.22 1.37 2.76 -0.83 -2.18 115.15 117.34 2occ h HIS 413 Ca 0.24 0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.43 2occ h HIS 413 Cb 0.12 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 28.97 2occ h HIS 413 CO 0.01 0.21 0.13 0.35 -1.30 0.00 0.00 177.93 177.32 2occ h PHE 414 N 0.30 0.24 -0.38 5.26 3.57 -1.06 -2.45 116.94 122.43 2occ h PHE 414 Ca 0.08 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.65 2occ h PHE 414 Cb -0.01 -0.08 -0.05 0.00 2.79 0.00 0.00 35.95 38.60 2occ h PHE 414 CO -0.06 0.14 0.06 0.00 -2.23 0.00 0.00 178.31 176.23 2occ h ALA 415 N 1.10 0.39 0.00 2.41 0.00 -0.84 -0.63 119.26 121.70 2occ h ALA 415 Ca 0.09 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 2occ h ALA 415 Cb -0.00 0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2occ h ALA 415 CO -0.04 -0.34 -0.00 0.82 0.00 0.00 0.00 179.25 179.69 2occ h ILE 416 N 0.18 1.04 -0.11 0.00 2.04 -1.33 -2.51 117.51 116.82 2occ h ILE 416 Ca 0.18 -0.13 -0.05 0.00 1.00 0.00 0.00 64.86 65.86 2occ h ILE 416 Cb 0.22 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 2occ h ILE 416 CO -0.25 0.03 -0.18 -0.03 0.00 0.00 0.00 178.15 177.73 2occ h MET 417 N -0.06 0.17 -0.45 2.37 4.05 -1.27 -0.38 114.93 119.36 2occ h MET 417 Ca -0.00 -0.04 -0.12 0.00 -0.28 0.00 0.00 59.70 59.25 2occ h MET 417 Cb 0.06 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 30.82 2occ h MET 417 CO 0.00 0.35 -0.21 0.35 0.23 0.00 0.00 176.91 177.63 2occ h PHE 418 N 0.16 1.04 -0.02 1.39 3.57 -0.85 -2.36 116.94 119.87 2occ h PHE 418 Ca 0.03 -0.24 -0.01 0.00 3.53 0.00 0.00 57.97 61.28 2occ h PHE 418 Cb 0.41 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 38.91 2occ h PHE 418 CO 0.00 1.03 -0.04 0.28 -2.23 0.00 0.00 178.31 177.36 2occ h VAL 419 N 0.79 1.43 -0.01 1.41 2.07 -1.01 -3.18 116.25 117.76 2occ h VAL 419 Ca 0.11 -1.34 0.03 0.00 0.82 0.00 0.00 66.70 66.32 2occ h VAL 419 Cb 0.77 2.29 -0.05 0.00 -1.52 0.00 0.00 31.29 32.78 2occ h VAL 419 CO 0.06 0.36 -0.26 1.23 0.02 0.00 0.00 177.57 178.98 2occ h GLY 420 N -0.47 -0.39 2.00 2.17 0.00 -1.04 -1.68 103.07 103.65 2occ h GLY 420 Ca 0.00 0.31 -0.05 0.00 0.00 0.00 0.00 47.33 47.60 2occ h GLY 420 CO 0.01 -0.21 -0.22 -0.39 0.00 0.00 0.00 176.54 175.72 2occ h VAL 421 N -0.40 1.11 0.07 4.60 -1.51 -1.57 -1.61 116.25 116.94 2occ h VAL 421 Ca 0.06 -0.78 -0.29 0.00 -1.23 0.00 0.00 66.70 64.47 2occ h VAL 421 Cb 0.49 1.43 0.03 0.00 -2.13 0.00 0.00 31.29 31.10 2occ h VAL 421 CO -0.23 0.22 -1.16 0.78 -1.23 0.00 0.00 177.57 175.95 2occ h ASN 422 N 0.00 0.90 -0.63 4.19 2.35 -1.47 -2.51 115.58 118.41 2occ h ASN 422 Ca -0.00 -0.79 -0.06 0.00 -0.55 0.00 0.00 56.30 54.90 2occ h ASN 422 Cb 0.41 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.47 2occ h ASN 422 CO 0.03 1.58 0.16 -0.03 -1.65 0.00 0.00 177.43 177.52 2occ h MET 423 N 0.33 1.03 -0.05 0.81 4.05 -1.16 0.11 114.93 120.05 2occ h MET 423 Ca -0.16 -0.23 -0.01 0.00 -0.28 0.00 0.00 59.70 59.02 2occ h MET 423 Cb 1.82 -0.14 -0.00 0.00 -0.80 0.00 0.00 31.60 32.47 2occ h MET 423 CO 0.22 0.91 0.01 1.15 0.23 0.00 0.00 176.91 179.43 2occ h THR 424 N 0.98 1.21 0.00 -0.77 2.02 -1.32 -3.38 112.91 111.65 2occ h THR 424 Ca 0.21 -0.62 0.00 0.00 0.77 0.00 0.00 66.41 66.77 2occ h THR 424 Cb 0.34 1.53 0.00 0.00 -1.74 0.00 0.00 68.15 68.28 2occ h THR 424 CO -0.00 0.17 -1.90 0.49 0.37 0.00 0.00 175.52 174.65 2occ n PHE 425 N -4.92 0.00 -0.01 3.16 3.72 -0.95 -4.43 117.46 114.04 2occ n PHE 425 Ca -0.07 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.22 2occ n PHE 425 Cb 0.15 -0.45 -0.06 0.00 -0.94 0.00 0.00 39.48 38.18 2occ n PHE 425 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 2occ h PHE 426 N 0.00 0.12 0.00 1.38 3.57 -1.14 -2.85 116.94 118.03 2occ h PHE 426 Ca 0.00 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 2occ h PHE 426 Cb 0.93 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.63 2occ h PHE 426 CO 0.00 0.19 -0.01 -1.00 -2.23 0.00 0.00 178.31 175.25 2occ h PRO 427 N 0.02 0.00 0.00 6.41 0.13 -1.78 -1.91 132.00 134.87 2occ h PRO 427 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 2occ h PRO 427 Cb 0.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.24 2occ h PRO 427 CO -0.00 0.01 0.00 1.04 -0.23 0.00 0.00 178.00 178.82 2occ n GLN 428 N -3.73 0.06 -0.07 0.86 6.02 -1.07 -0.70 117.38 118.75 2occ n GLN 428 Ca -0.03 0.51 -0.12 0.00 -0.01 0.00 0.00 57.00 57.35 2occ n GLN 428 Cb 0.09 -1.68 0.01 0.00 1.02 0.00 0.00 30.24 29.69 2occ n GLN 428 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2occ h HIS 429 N 0.00 0.96 0.19 1.08 3.86 -1.47 -2.75 115.15 117.02 2occ h HIS 429 Ca 0.00 -0.30 -0.01 0.00 -1.16 0.00 0.00 60.37 58.90 2occ h HIS 429 Cb 0.06 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.34 2occ h HIS 429 CO 0.00 1.09 -0.09 0.74 0.86 0.00 0.00 177.93 180.53 2occ h PHE 430 N 0.63 -0.24 -0.99 2.45 0.04 -1.11 -1.82 116.94 115.90 2occ h PHE 430 Ca 0.04 -0.01 0.22 0.00 2.80 0.00 0.00 57.97 61.02 2occ h PHE 430 Cb 1.02 0.08 -0.09 0.00 2.20 0.00 0.00 35.95 39.15 2occ h PHE 430 CO 0.06 0.03 0.62 -0.07 -0.60 0.00 0.00 178.31 178.35 2occ h LEU 431 N -0.50 0.58 0.04 1.54 3.38 -1.53 -0.95 115.31 117.87 2occ h LEU 431 Ca -0.03 0.08 -0.18 0.00 0.09 0.00 0.00 57.88 57.85 2occ h LEU 431 Cb 0.38 -0.02 0.02 0.00 0.09 0.00 0.00 40.66 41.12 2occ h LEU 431 CO 0.04 0.18 -0.72 1.23 0.09 0.00 0.00 178.44 179.27 2occ h GLY 432 N 0.55 0.47 1.25 0.83 0.00 -1.23 0.24 103.07 105.19 2occ h GLY 432 Ca 0.56 -0.90 -0.05 0.00 0.00 0.00 0.00 47.33 46.94 2occ h GLY 432 CO -0.31 0.79 0.18 1.41 0.00 0.00 0.00 176.54 178.61 2occ h LEU 433 N -0.10 0.87 0.00 3.11 3.38 -0.85 -2.10 115.31 119.62 2occ h LEU 433 Ca -0.10 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2occ h LEU 433 Cb 1.45 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2occ h LEU 433 CO 0.14 0.83 0.00 -1.54 0.09 0.00 0.00 178.44 177.96 2occ n SER 434 N -4.27 0.00 0.00 -0.43 3.41 -0.41 -4.91 113.62 107.01 2occ n SER 434 Ca 0.05 -0.92 0.00 0.00 -0.26 0.00 0.00 58.87 57.74 2occ n SER 434 Cb 0.22 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 2occ n SER 434 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2occ n GLY 435 N 0.69 0.83 3.66 5.00 0.00 -0.79 -5.03 105.19 109.55 2occ n GLY 435 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2occ n GLY 435 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2occ s MET 436 N -0.74 4.20 0.86 1.61 0.00 0.79 -4.95 119.30 121.06 2occ s MET 436 Ca 0.00 2.07 -0.11 0.00 0.00 0.00 0.00 55.69 57.65 2occ s MET 436 Cb 0.00 -3.92 0.11 0.00 0.00 0.00 0.00 34.83 31.02 2occ s MET 436 CO 0.00 -0.80 1.09 -2.14 0.00 0.00 0.00 175.02 173.17 2occ s PRO 437 N 3.84 1.56 0.36 4.11 0.02 -1.26 -1.59 135.00 142.04 2occ s PRO 437 Ca 0.69 0.78 -0.09 0.00 0.02 0.00 0.00 61.00 62.40 2occ s PRO 437 Cb -0.31 -1.85 -0.06 0.00 0.02 0.00 0.00 34.50 32.30 2occ s PRO 437 CO 0.26 -2.02 0.70 1.03 -0.33 0.00 0.00 177.00 176.64 2occ s ARG 438 N -5.00 3.74 -0.87 5.54 0.52 -0.47 -4.30 118.95 118.10 2occ s ARG 438 Ca 0.62 0.32 0.00 0.00 -0.52 0.00 0.00 55.73 56.16 2occ s ARG 438 Cb -0.17 -2.47 0.00 0.00 0.52 0.00 0.00 34.95 32.83 2occ s ARG 438 CO 0.56 0.05 0.00 0.54 0.02 0.00 0.00 175.30 176.47 2occ n ARG 439 N -1.16 -0.69 -3.86 3.54 1.74 -1.26 -5.01 116.66 109.97 2occ n ARG 439 Ca 0.01 0.62 -0.35 0.00 -0.77 0.00 0.00 57.85 57.36 2occ n ARG 439 Cb 0.54 -4.58 -0.08 0.00 -1.02 0.00 0.00 32.46 27.32 2occ n ARG 439 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2occ s TYR 440 N -2.40 3.37 -1.22 -1.55 1.51 -1.26 -4.91 117.35 110.89 2occ s TYR 440 Ca 0.00 0.27 0.27 0.00 -1.01 0.00 0.00 57.07 56.60 2occ s TYR 440 Cb 0.00 -2.09 0.88 0.00 -0.11 0.00 0.00 41.96 40.64 2occ s TYR 440 CO 0.00 0.31 1.66 -1.13 -1.11 0.00 0.00 175.55 175.28 2occ n SER 441 N 3.29 0.42 -3.58 2.29 3.41 -1.26 -4.90 113.62 113.29 2occ n SER 441 Ca -0.17 -0.19 -0.11 0.00 -0.26 0.00 0.00 58.87 58.14 2occ n SER 441 Cb 0.52 -0.03 -0.04 0.00 -0.26 0.00 0.00 64.21 64.41 2occ n SER 441 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2occ s ASP 442 N -2.83 -0.34 0.06 4.04 -1.08 -1.26 -4.67 116.67 110.59 2occ s ASP 442 Ca 0.17 -0.24 -0.08 0.00 -0.52 0.00 0.00 52.55 51.89 2occ s ASP 442 Cb 0.19 0.53 -0.01 0.00 -1.46 0.00 0.00 42.92 42.17 2occ s ASP 442 CO 0.59 -0.91 0.16 -0.72 0.52 0.00 0.00 175.17 174.80 2occ s TYR 443 N -3.80 0.17 0.50 -5.34 -0.85 -1.26 -5.08 117.35 101.69 2occ s TYR 443 Ca 0.03 -0.53 -0.22 0.00 -0.52 0.00 0.00 57.07 55.83 2occ s TYR 443 Cb 0.01 -0.10 -0.08 0.00 0.38 0.00 0.00 41.96 42.17 2occ s TYR 443 CO -0.11 -0.47 1.02 -2.30 -1.52 0.00 0.00 175.55 172.17 2occ n PRO 444 N 0.30 1.22 -0.36 -3.49 -0.02 -1.26 -4.84 135.00 126.55 2occ n PRO 444 Ca -0.17 0.45 0.27 0.00 -2.02 0.00 0.00 63.50 62.04 2occ n PRO 444 Cb 0.61 -2.14 0.56 0.00 -0.02 0.00 0.00 33.50 32.50 2occ n PRO 444 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2occ h ASP 445 N 1.13 0.37 -0.06 2.55 5.19 -2.04 -2.66 116.42 120.91 2occ h ASP 445 Ca -0.47 0.10 0.02 0.00 -0.62 0.00 0.00 57.03 56.06 2occ h ASP 445 Cb 1.34 0.05 -0.00 0.00 0.18 0.00 0.00 39.33 40.90 2occ h ASP 445 CO 0.54 -0.00 0.05 0.00 -3.12 0.00 0.00 179.24 176.71 2occ h ALA 446 N 1.61 1.89 -0.18 3.45 0.00 -2.05 -2.55 119.26 121.43 2occ h ALA 446 Ca 0.66 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.57 2occ h ALA 446 Cb 1.86 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.65 2occ h ALA 446 CO -0.33 -0.07 0.00 0.66 0.00 0.00 0.00 179.25 179.51 2occ n TYR 447 N -4.27 0.33 -0.09 0.00 4.01 -1.00 -4.50 117.16 111.64 2occ n TYR 447 Ca -0.02 -0.14 -0.12 0.00 -0.16 0.00 0.00 57.90 57.46 2occ n TYR 447 Cb 0.15 -0.05 -0.04 0.00 -0.31 0.00 0.00 39.34 39.08 2occ n TYR 447 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 2occ h THR 448 N 1.11 1.29 0.37 -0.72 2.02 -1.66 -3.13 112.91 112.18 2occ h THR 448 Ca 0.00 -1.10 -0.01 0.00 0.77 0.00 0.00 66.41 66.08 2occ h THR 448 Cb 0.41 1.48 -0.01 0.00 -1.74 0.00 0.00 68.15 68.29 2occ h THR 448 CO 0.03 0.34 -0.26 -0.03 0.37 0.00 0.00 175.52 175.97 2occ h MET 449 N 0.24 -0.60 -0.64 6.66 1.85 -1.85 -1.51 114.93 119.08 2occ h MET 449 Ca 0.06 0.04 0.02 0.00 -0.61 0.00 0.00 59.70 59.22 2occ h MET 449 Cb 0.55 0.14 -0.03 0.00 0.43 0.00 0.00 31.60 32.68 2occ h MET 449 CO 0.03 -0.40 0.42 -1.49 -0.40 0.00 0.00 176.91 175.07 2occ h TRP 450 N -0.62 0.76 0.00 1.39 -0.00 -1.91 -0.81 115.95 114.76 2occ h TRP 450 Ca -0.03 0.02 -0.10 0.00 -0.00 0.00 0.00 58.89 58.77 2occ h TRP 450 Cb 0.53 -0.26 -0.01 0.00 -0.00 0.00 0.00 29.16 29.42 2occ h TRP 450 CO -0.12 0.46 -0.48 -0.91 -0.00 0.00 0.00 178.44 177.38 2occ h ASN 451 N 0.80 0.00 -0.07 -3.49 2.35 -1.44 -1.33 115.58 112.41 2occ h ASN 451 Ca 0.25 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.87 2occ h ASN 451 Cb 0.01 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.39 2occ h ASN 451 CO -0.06 0.48 -0.48 0.74 -1.65 0.00 0.00 177.43 176.46 2occ h THR 452 N 0.00 1.40 -0.47 2.81 2.02 -0.14 -1.89 112.91 116.64 2occ h THR 452 Ca -0.00 -1.87 -0.02 0.00 0.77 0.00 0.00 66.41 65.29 2occ h THR 452 Cb 1.02 2.33 -0.02 0.00 -1.74 0.00 0.00 68.15 69.74 2occ h THR 452 CO 0.06 0.55 0.22 0.40 0.37 0.00 0.00 175.52 177.12 2occ h ILE 453 N -0.01 1.19 -0.42 3.11 2.04 -1.14 -2.54 117.51 119.74 2occ h ILE 453 Ca -0.04 -0.54 0.00 0.00 1.00 0.00 0.00 64.86 65.28 2occ h ILE 453 Cb 1.14 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.89 2occ h ILE 453 CO 0.10 0.21 0.26 -1.28 0.00 0.00 0.00 178.15 177.44 2occ h SER 454 N 0.61 0.49 0.12 1.72 0.87 -1.26 -1.77 113.55 114.34 2occ h SER 454 Ca 0.16 -0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.63 2occ h SER 454 Cb 0.13 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2occ h SER 454 CO -0.02 0.39 -0.19 0.28 -0.53 0.00 0.00 176.83 176.76 2occ h SER 455 N 0.56 0.13 -0.48 6.23 0.02 -1.17 -1.95 113.55 116.88 2occ h SER 455 Ca 0.15 -0.03 -0.09 0.00 -0.84 0.00 0.00 61.79 60.98 2occ h SER 455 Cb -0.02 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.47 2occ h SER 455 CO -0.03 0.33 -0.05 0.24 -1.14 0.00 0.00 176.83 176.18 2occ h MET 456 N 0.13 0.89 -0.73 3.45 2.07 -0.92 -2.83 114.93 116.99 2occ h MET 456 Ca 0.02 -0.31 0.02 0.00 -2.07 0.00 0.00 59.70 57.36 2occ h MET 456 Cb 0.41 -0.07 -0.04 0.00 -1.87 0.00 0.00 31.60 30.04 2occ h MET 456 CO 0.03 0.95 0.48 0.78 1.07 0.00 0.00 176.91 180.22 2occ h GLY 457 N 0.74 1.03 2.00 8.32 0.00 -0.59 -0.47 103.07 114.10 2occ h GLY 457 Ca 0.13 -0.37 -0.03 0.00 0.00 0.00 0.00 47.33 47.06 2occ h GLY 457 CO 0.03 0.35 -0.14 1.48 0.00 0.00 0.00 176.54 178.27 2occ h SER 458 N 0.96 0.00 0.46 0.19 4.64 -1.22 -1.59 113.55 116.99 2occ h SER 458 Ca 0.28 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.39 2occ h SER 458 Cb -0.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.03 2occ h SER 458 CO -0.07 0.14 -0.89 -0.26 -0.87 0.00 0.00 176.83 174.88 2occ h PHE 459 N 0.00 0.44 -0.53 4.77 -1.00 -0.99 -2.48 116.94 117.16 2occ h PHE 459 Ca -0.00 -0.24 -0.04 0.00 2.81 0.00 0.00 57.97 60.50 2occ h PHE 459 Cb 0.44 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 39.93 2occ h PHE 459 CO 0.00 1.05 0.18 0.82 -1.61 0.00 0.00 178.31 178.75 2occ h ILE 460 N 0.17 1.23 -0.69 -0.55 2.04 -1.08 -1.48 117.51 117.15 2occ h ILE 460 Ca -0.06 -0.76 -0.02 0.00 1.00 0.00 0.00 64.86 65.03 2occ h ILE 460 Cb 1.52 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 38.29 2occ h ILE 460 CO 0.15 0.28 0.36 0.28 0.00 0.00 0.00 178.15 179.22 2occ h SER 461 N 0.73 0.86 -0.46 1.72 0.02 -1.42 -1.15 113.55 113.84 2occ h SER 461 Ca 0.17 -0.07 0.05 0.00 -0.84 0.00 0.00 61.79 61.10 2occ h SER 461 Cb 0.26 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 62.53 2occ h SER 461 CO -0.01 0.70 0.20 0.25 -1.14 0.00 0.00 176.83 176.83 2occ h LEU 462 N 0.96 0.25 -0.80 5.07 5.85 -0.82 -0.44 115.31 125.39 2occ h LEU 462 Ca 0.24 0.04 0.02 0.00 0.84 0.00 0.00 57.88 59.02 2occ h LEU 462 Cb 0.05 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.03 2occ h LEU 462 CO -0.04 0.18 0.52 0.74 -0.34 0.00 0.00 178.44 179.50 2occ h THR 463 N 0.39 1.16 -0.96 1.05 2.02 -0.40 -1.72 112.91 114.45 2occ h THR 463 Ca 0.21 -0.35 0.02 0.00 0.77 0.00 0.00 66.41 67.06 2occ h THR 463 Cb 0.17 0.04 -0.05 0.00 -1.74 0.00 0.00 68.15 66.56 2occ h THR 463 CO -0.18 0.19 0.63 0.00 0.37 0.00 0.00 175.52 176.53 2occ h ALA 464 N 1.32 1.34 0.00 6.16 0.00 -0.16 -0.69 119.26 127.22 2occ h ALA 464 Ca 0.31 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 55.03 2occ h ALA 464 Cb -0.05 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.35 2occ h ALA 464 CO -0.09 0.59 -0.62 -0.39 0.00 0.00 0.00 179.25 178.74 2occ h VAL 465 N 1.27 1.17 -0.35 0.00 -1.51 -0.32 -1.55 116.25 114.95 2occ h VAL 465 Ca 0.36 -2.37 -0.16 0.00 -1.23 0.00 0.00 66.70 63.30 2occ h VAL 465 Cb -0.09 2.39 -0.00 0.00 -2.13 0.00 0.00 31.29 31.46 2occ h VAL 465 CO -0.09 0.61 -0.41 0.24 -1.23 0.00 0.00 177.57 176.69 2occ h MET 466 N 0.00 0.89 -0.84 5.19 2.86 -0.66 -2.69 114.93 119.68 2occ h MET 466 Ca -0.01 -0.49 -0.00 0.00 -2.06 0.00 0.00 59.70 57.14 2occ h MET 466 Cb 1.34 0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.99 2occ h MET 466 CO 0.08 1.14 0.52 1.25 1.06 0.00 0.00 176.91 180.96 2occ h LEU 467 N 0.69 1.00 -1.11 1.22 6.46 -1.01 -2.13 115.31 120.42 2occ h LEU 467 Ca 0.05 -0.06 0.07 0.00 -0.12 0.00 0.00 57.88 57.82 2occ h LEU 467 Cb 1.01 -0.25 -0.06 0.00 -0.73 0.00 0.00 40.66 40.62 2occ h LEU 467 CO 0.10 0.76 0.60 -0.03 -0.62 0.00 0.00 178.44 179.25 2occ h MET 468 N 1.15 1.01 -0.77 1.25 4.05 -0.95 -0.64 114.93 120.03 2occ h MET 468 Ca 0.30 -0.06 -0.03 0.00 -0.28 0.00 0.00 59.70 59.64 2occ h MET 468 Cb -0.07 -0.23 -0.04 0.00 -0.80 0.00 0.00 31.60 30.47 2occ h MET 468 CO -0.06 0.67 0.38 0.28 0.23 0.00 0.00 176.91 178.41 2occ h VAL 469 N 1.04 1.24 -0.32 -5.77 2.07 -1.21 -2.43 116.25 110.87 2occ h VAL 469 Ca 0.41 -0.66 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 2occ h VAL 469 Cb 0.24 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 2occ h VAL 469 CO -0.16 0.28 0.18 0.15 0.02 0.00 0.00 177.57 178.04 2occ h PHE 470 N 1.08 0.43 -0.99 1.57 3.57 -0.97 -1.97 116.94 119.66 2occ h PHE 470 Ca 0.27 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.87 2occ h PHE 470 Cb 0.10 -0.14 -0.08 0.00 2.79 0.00 0.00 35.95 38.62 2occ h PHE 470 CO 0.01 0.33 0.62 0.82 -2.23 0.00 0.00 178.31 177.86 2occ h ILE 471 N 0.40 0.94 -0.15 1.41 2.04 -0.90 0.12 117.51 121.38 2occ h ILE 471 Ca 0.11 -0.35 -0.16 0.00 1.00 0.00 0.00 64.86 65.47 2occ h ILE 471 Cb 0.04 -0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 35.96 2occ h ILE 471 CO -0.02 0.18 -0.57 0.40 0.00 0.00 0.00 178.15 178.15 2occ h ILE 472 N 1.01 1.34 0.19 -0.67 2.04 -1.27 -2.81 117.51 117.32 2occ h ILE 472 Ca 0.48 -1.84 -0.01 0.00 1.00 0.00 0.00 64.86 64.49 2occ h ILE 472 Cb 0.43 1.84 0.00 0.00 -0.74 0.00 0.00 36.82 38.34 2occ h ILE 472 CO -0.25 0.57 -0.09 -0.25 0.00 0.00 0.00 178.15 178.12 2occ h TRP 473 N 0.36 -0.24 -0.29 1.37 7.01 -0.34 -2.86 115.95 120.98 2occ h TRP 473 Ca 0.00 -0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.08 2occ h TRP 473 Cb 1.10 0.08 -0.01 0.00 -2.10 0.00 0.00 29.16 28.23 2occ h TRP 473 CO 0.04 0.05 0.23 1.05 -2.79 0.00 0.00 178.44 177.02 2occ h GLU 474 N -0.52 0.00 -0.19 2.65 -0.00 -0.81 0.23 114.58 115.94 2occ h GLU 474 Ca -0.03 0.00 -0.11 0.00 -0.00 0.00 0.00 59.36 59.22 2occ h GLU 474 Cb 0.39 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.14 2occ h GLU 474 CO 0.04 0.00 -0.31 0.00 -0.00 0.00 0.00 179.01 178.74 2occ h ALA 475 N 1.80 0.29 0.00 1.06 0.00 -1.30 -0.06 119.26 121.05 2occ h ALA 475 Ca 0.14 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 2occ h ALA 475 Cb 0.60 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2occ h ALA 475 CO -0.00 0.32 -0.27 0.74 0.00 0.00 0.00 179.25 180.04 2occ h PHE 476 N 0.20 0.00 0.24 0.00 0.04 -1.08 -2.02 116.94 114.33 2occ h PHE 476 Ca 0.01 0.00 -0.33 0.00 2.80 0.00 0.00 57.97 60.45 2occ h PHE 476 Cb 0.90 0.00 0.03 0.00 2.20 0.00 0.00 35.95 39.09 2occ h PHE 476 CO 0.09 0.27 -1.47 0.00 -0.60 0.00 0.00 178.31 176.60 2occ h ALA 477 N 1.73 -0.13 0.13 2.45 0.00 -0.28 -3.36 119.26 119.80 2occ h ALA 477 Ca -0.00 -0.87 -0.28 0.00 0.00 0.00 0.00 54.91 53.76 2occ h ALA 477 Cb 0.96 0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.93 2occ h ALA 477 CO 0.03 0.74 -1.25 0.77 0.00 0.00 0.00 179.25 179.54 2occ h SER 478 N 0.14 0.43 -5.35 0.00 0.02 -1.02 -3.49 113.55 104.28 2occ h SER 478 Ca -0.25 -0.47 -0.19 0.00 -0.84 0.00 0.00 61.79 60.05 2occ h SER 478 Cb 2.15 -0.14 0.15 0.00 0.14 0.00 0.00 62.40 64.70 2occ h SER 478 CO 0.27 1.37 -0.64 0.29 -1.14 0.00 0.00 176.83 176.98 2occ n LYS 479 N -3.53 -1.96 -3.28 3.45 5.02 -0.76 -4.96 118.16 112.14 2occ n LYS 479 Ca -0.09 0.98 -0.42 0.00 -2.02 0.00 0.00 58.31 56.77 2occ n LYS 479 Cb 1.03 -5.67 -0.08 0.00 -0.02 0.00 0.00 35.03 30.28 2occ n LYS 479 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2occ s ARG 480 N -4.03 3.37 0.37 1.97 0.52 -1.26 -5.03 118.95 114.86 2occ s ARG 480 Ca 0.34 -0.46 -0.18 0.00 -0.52 0.00 0.00 55.73 54.92 2occ s ARG 480 Cb -0.04 -3.89 -0.10 0.00 0.52 0.00 0.00 34.95 31.44 2occ s ARG 480 CO 0.72 -0.75 0.84 -1.21 0.02 0.00 0.00 175.30 174.91 2occ s GLU 481 N 2.29 4.11 0.31 3.54 2.02 -1.26 -1.93 118.70 127.77 2occ s GLU 481 Ca 0.15 0.88 -0.29 0.00 0.02 0.00 0.00 54.97 55.74 2occ s GLU 481 Cb -0.16 -2.31 -0.10 0.00 0.10 0.00 0.00 34.13 31.66 2occ s GLU 481 CO 0.14 0.07 1.14 0.08 0.02 0.00 0.00 175.26 176.70 2occ s VAL 482 N -2.08 3.33 0.00 2.63 1.01 -0.57 -4.89 120.40 119.82 2occ s VAL 482 Ca 0.58 1.30 0.00 0.00 0.00 0.00 0.00 61.98 63.86 2occ s VAL 482 Cb -0.10 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.47 2occ s VAL 482 CO 0.15 0.28 0.00 0.18 0.00 0.00 0.00 175.10 175.71 2occ n LEU 483 N 0.94 0.00 -4.40 3.92 4.77 -1.26 -4.94 117.00 116.02 2occ n LEU 483 Ca -0.00 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.70 2occ n LEU 483 Cb 0.45 -0.18 -0.12 0.00 -2.33 0.00 0.00 43.42 41.23 2occ n LEU 483 CO 0.54 -0.26 -0.55 0.42 -1.33 0.00 0.00 177.39 176.20 2occ s THR 484 N -0.53 2.29 -0.05 -5.08 -4.23 -1.26 -5.03 115.64 101.76 2occ s THR 484 Ca 0.00 -1.86 0.05 0.00 -1.18 0.00 0.00 61.69 58.70 2occ s THR 484 Cb 0.00 -2.04 -0.01 0.00 1.34 0.00 0.00 72.50 71.79 2occ s THR 484 CO 0.00 0.01 -0.21 -0.69 -0.54 0.00 0.00 174.62 173.18 2occ s VAL 485 N -1.31 1.75 0.70 2.29 1.01 -1.26 -5.13 120.40 118.45 2occ s VAL 485 Ca 0.17 -0.90 -0.11 0.00 0.00 0.00 0.00 61.98 61.14 2occ s VAL 485 Cb -0.09 -1.48 0.01 0.00 0.00 0.00 0.00 36.38 34.82 2occ s VAL 485 CO 0.07 0.49 1.07 -1.81 0.00 0.00 0.00 175.10 174.93 2occ s ASP 486 N -0.09 5.42 -1.49 3.32 1.11 -1.26 -4.29 116.67 119.39 2occ s ASP 486 Ca -0.03 1.35 -0.13 0.00 0.18 0.00 0.00 52.55 53.92 2occ s ASP 486 Cb -0.12 -2.21 0.09 0.00 1.07 0.00 0.00 42.92 41.74 2occ s ASP 486 CO 0.03 -1.38 0.77 0.18 1.18 0.00 0.00 175.17 175.94 2occ n LEU 487 N -3.06 -2.10 0.26 1.23 4.77 -1.26 -4.88 117.00 111.95 2occ n LEU 487 Ca 0.07 -0.65 0.15 0.00 -0.03 0.00 0.00 56.01 55.54 2occ n LEU 487 Cb 0.55 -2.38 0.63 0.00 -2.33 0.00 0.00 43.42 39.90 2occ n LEU 487 CO 0.57 0.32 0.94 0.71 -1.33 0.00 0.00 177.39 178.60 2occ h THR 488 N -1.59 0.23 -0.11 -5.08 1.35 -1.86 -3.09 112.91 102.77 2occ h THR 488 Ca -0.53 -0.69 -0.01 0.00 -0.55 0.00 0.00 66.41 64.62 2occ h THR 488 Cb 1.35 1.56 -0.01 0.00 -1.73 0.00 0.00 68.15 69.32 2occ h THR 488 CO 0.64 0.08 0.01 0.71 -0.25 0.00 0.00 175.52 176.71 2occ h THR 489 N 0.00 1.07 -0.22 6.82 1.35 -1.95 -2.51 112.91 117.46 2occ h THR 489 Ca -0.00 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.62 2occ h THR 489 Cb 0.56 0.97 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 2occ h THR 489 CO 0.01 0.08 0.00 0.35 -0.25 0.00 0.00 175.52 175.71 2occ n THR 490 N -4.46 1.77 -3.24 6.82 -2.24 -1.17 -4.77 114.28 106.99 2occ n THR 490 Ca -0.01 -1.62 -0.24 0.00 -2.27 0.00 0.00 64.05 59.91 2occ n THR 490 Cb 0.13 0.02 -0.08 0.00 -2.10 0.00 0.00 70.33 68.30 2occ n THR 490 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2occ n ASN 491 N -0.36 -0.31 -0.31 3.42 3.02 -0.94 -5.01 115.26 114.77 2occ n ASN 491 Ca 0.16 -2.59 0.29 0.00 -0.03 0.00 0.00 54.58 52.41 2occ n ASN 491 Cb 0.67 -0.45 0.63 0.00 -0.61 0.00 0.00 39.78 40.03 2occ n ASN 491 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2occ h LEU 492 N 4.67 0.21 -2.64 3.41 6.46 -1.86 -2.23 115.31 123.33 2occ h LEU 492 Ca 0.14 0.04 -0.00 0.00 -0.12 0.00 0.00 57.88 57.94 2occ h LEU 492 Cb 0.90 0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 40.84 2occ h LEU 492 CO 0.41 0.03 -0.00 1.05 -0.62 0.00 0.00 178.44 179.31 2occ h GLU 493 N 0.19 0.00 0.00 1.25 9.09 -1.92 -2.21 114.58 120.97 2occ h GLU 493 Ca 0.57 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.98 2occ h GLU 493 Cb 1.88 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.98 2occ h GLU 493 CO -0.15 0.00 -0.58 0.91 0.05 0.00 0.00 179.01 179.24 2occ n TRP 494 N -3.57 0.30 0.18 2.06 7.02 -0.84 -4.43 117.44 118.16 2occ n TRP 494 Ca -0.03 0.09 0.07 0.00 -1.02 0.00 0.00 57.50 56.61 2occ n TRP 494 Cb 0.08 -0.48 0.36 0.00 -2.42 0.00 0.00 31.31 28.85 2occ n TRP 494 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2occ n LEU 495 N -1.84 0.34 -1.51 -0.99 4.77 -0.83 -2.40 117.00 114.54 2occ n LEU 495 Ca 0.04 0.64 0.08 0.00 -0.03 0.00 0.00 56.01 56.74 2occ n LEU 495 Cb 0.39 -0.65 0.35 0.00 -2.33 0.00 0.00 43.42 41.18 2occ n LEU 495 CO 0.36 -0.68 0.81 0.59 -1.33 0.00 0.00 177.39 177.14 2occ n ASN 496 N -1.93 4.99 0.00 -1.43 3.02 -1.26 -5.07 115.26 113.57 2occ n ASN 496 Ca 0.00 -2.89 0.00 0.00 -0.03 0.00 0.00 54.58 51.66 2occ n ASN 496 Cb 0.07 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 38.62 2occ n ASN 496 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2occ n GLY 497 N 0.31 -1.25 2.97 7.41 0.00 -1.01 -4.30 105.19 109.32 2occ n GLY 497 Ca 0.25 -1.60 -0.30 0.00 0.00 0.00 0.00 46.02 44.37 2occ n GLY 497 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2occ s PRO 499 N 1.39 3.72 0.63 0.00 0.04 -1.26 -4.21 135.00 135.32 2occ s PRO 499 Ca -0.04 0.49 -0.17 0.00 0.04 0.00 0.00 61.00 61.32 2occ s PRO 499 Cb -0.18 -2.32 -0.01 0.00 0.04 0.00 0.00 34.50 32.03 2occ s PRO 499 CO -0.07 -0.17 1.16 -1.25 0.04 0.00 0.00 177.00 176.71 2occ s PRO 500 N -4.24 2.83 0.77 0.56 0.04 -0.96 -4.96 135.00 129.03 2occ s PRO 500 Ca 0.52 1.63 -0.14 0.00 0.04 0.00 0.00 61.00 63.05 2occ s PRO 500 Cb -0.10 -1.93 0.06 0.00 0.04 0.00 0.00 34.50 32.56 2occ s PRO 500 CO 0.37 -1.27 1.18 -1.25 0.04 0.00 0.00 177.00 176.08 2occ s PRO 501 N -3.68 1.96 0.22 0.56 0.04 -1.26 -4.91 135.00 127.93 2occ s PRO 501 Ca 0.72 1.67 -0.16 0.00 0.04 0.00 0.00 61.00 63.28 2occ s PRO 501 Cb -0.26 -1.82 0.23 0.00 0.04 0.00 0.00 34.50 32.70 2occ s PRO 501 CO 0.37 -1.95 1.59 -0.92 0.04 0.00 0.00 177.00 176.12 2occ h TYR 502 N -0.63 -0.67 -3.62 0.56 3.20 -2.01 -3.31 116.97 110.49 2occ h TYR 502 Ca -0.46 0.07 -0.68 0.00 3.14 0.00 0.00 58.73 60.80 2occ h TYR 502 Cb 1.28 0.40 -0.25 0.00 1.54 0.00 0.00 36.73 39.71 2occ h TYR 502 CO 0.49 -0.36 -0.58 -1.01 -1.64 0.00 0.00 178.16 175.05 2occ s HIS 503 N -6.12 3.18 0.22 -3.82 3.76 -1.26 -4.92 115.29 106.33 2occ s HIS 503 Ca -0.14 -0.87 0.07 0.00 -0.15 0.00 0.00 55.06 53.97 2occ s HIS 503 Cb 0.19 -2.31 -0.04 0.00 1.11 0.00 0.00 32.58 31.53 2occ s HIS 503 CO 0.73 -0.55 0.11 0.95 -0.85 0.00 0.00 174.74 175.12 2occ s THR 504 N 1.54 4.13 -1.53 1.30 -4.23 -1.25 -4.62 115.64 110.97 2occ s THR 504 Ca 0.03 -1.43 -0.14 0.00 -1.18 0.00 0.00 61.69 58.97 2occ s THR 504 Cb -0.18 -3.17 0.10 0.00 1.34 0.00 0.00 72.50 70.60 2occ s THR 504 CO 0.04 -0.26 0.83 0.49 -0.54 0.00 0.00 174.62 175.19 2occ n PHE 505 N -0.74 -2.06 0.23 3.99 3.72 -1.26 -4.42 117.46 116.93 2occ n PHE 505 Ca -0.08 0.78 0.07 0.00 -0.05 0.00 0.00 57.45 58.17 2occ n PHE 505 Cb 0.57 -3.54 0.58 0.00 -0.94 0.00 0.00 39.48 36.16 2occ n PHE 505 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 2occ h GLU 506 N -1.70 0.04 -4.98 -1.08 5.08 -1.95 -3.33 114.58 106.66 2occ h GLU 506 Ca -0.55 -0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.14 2occ h GLU 506 Cb 1.36 -0.01 -0.31 0.00 0.50 0.00 0.00 28.75 30.29 2occ h GLU 506 CO 0.67 0.08 -0.77 -2.00 -1.00 0.00 0.00 179.01 175.99 2occ s GLU 507 N -4.97 3.06 1.06 2.33 2.12 -1.26 -5.10 118.70 115.94 2occ s GLU 507 Ca -0.05 -0.82 -0.15 0.00 0.36 0.00 0.00 54.97 54.31 2occ s GLU 507 Cb 0.17 -2.88 0.12 0.00 0.26 0.00 0.00 34.13 31.79 2occ s GLU 507 CO 0.68 -0.28 0.39 -2.30 -0.54 0.00 0.00 175.26 173.21 2occ n PRO 508 N 4.70 -1.23 -1.57 4.30 -0.02 -1.25 -4.99 135.00 134.93 2occ n PRO 508 Ca -0.18 -0.33 -0.30 0.00 -2.02 0.00 0.00 63.50 60.67 2occ n PRO 508 Cb 0.49 -1.88 0.09 0.00 -0.02 0.00 0.00 33.50 32.18 2occ n PRO 508 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2occ s THR 509 N -2.35 3.01 -0.24 3.45 -4.23 -1.26 -5.03 115.64 108.99 2occ s THR 509 Ca 0.59 0.33 -0.04 0.00 -1.18 0.00 0.00 61.69 61.39 2occ s THR 509 Cb -0.18 -3.09 0.00 0.00 1.34 0.00 0.00 72.50 70.58 2occ s THR 509 CO 0.66 -0.43 -0.03 -0.47 -0.54 0.00 0.00 174.62 173.81 2occ s TYR 510 N -3.18 3.00 -0.09 3.99 5.04 -1.26 -5.04 117.35 119.82 2occ s TYR 510 Ca 0.61 -1.09 -0.01 0.00 -2.44 0.00 0.00 57.07 54.14 2occ s TYR 510 Cb -0.14 -2.11 0.03 0.00 0.35 0.00 0.00 41.96 40.08 2occ s TYR 510 CO 0.54 -0.60 -0.05 0.08 -1.34 0.00 0.00 175.55 174.19 2occ s VAL 511 N 1.44 0.75 0.40 3.14 1.01 -1.26 -5.12 120.40 120.76 2occ s VAL 511 Ca 0.04 -0.13 -0.25 0.00 0.00 0.00 0.00 61.98 61.64 2occ s VAL 511 Cb -0.15 -0.82 -0.08 0.00 0.00 0.00 0.00 36.38 35.33 2occ s VAL 511 CO -0.03 0.32 1.18 0.20 0.00 0.00 0.00 175.10 176.77 2occ s ASN 512 N 1.72 6.52 -1.08 3.32 0.02 -1.26 -4.61 114.94 119.58 2occ s ASN 512 Ca 0.03 2.38 -0.16 0.00 -1.02 0.00 0.00 52.86 54.10 2occ s ASN 512 Cb -0.13 -2.62 0.16 0.00 0.02 0.00 0.00 41.25 38.69 2occ s ASN 512 CO -0.06 -0.68 1.27 -0.22 0.02 0.00 0.00 177.10 177.43 2occ s LEU 513 N -2.45 5.16 0.00 0.60 1.98 -1.26 -4.95 118.68 117.76 2occ s LEU 513 Ca 0.57 -2.63 0.26 0.00 -2.89 0.00 0.00 54.13 49.44 2occ s LEU 513 Cb -0.32 -2.39 0.72 0.00 0.66 0.00 0.00 46.19 44.87 2occ s LEU 513 CO 0.40 -0.85 1.56 0.29 -1.89 0.00 0.00 176.35 175.86