#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x65 s MET 2 N 0.00 0.66 0.18 5.55 1.75 -1.26 -4.16 119.30 122.02 2x65 s MET 2 Ca 0.00 -0.31 0.09 0.00 -1.25 0.00 0.00 55.69 54.22 2x65 s MET 2 Cb 0.00 0.29 -0.04 0.00 2.84 0.00 0.00 34.83 37.92 2x65 s MET 2 CO 0.00 -0.18 -0.09 0.15 -0.65 0.00 0.00 175.02 174.25 2x65 s LYS 3 N -1.61 2.08 -0.12 4.11 -0.14 -0.35 -4.87 119.74 118.84 2x65 s LYS 3 Ca -0.12 -1.27 0.03 0.00 -1.36 0.00 0.00 55.97 53.25 2x65 s LYS 3 Cb -0.05 -2.17 0.01 0.00 -1.68 0.00 0.00 37.83 33.94 2x65 s LYS 3 CO 0.02 0.43 -0.22 0.00 -0.76 0.00 0.00 175.35 174.83 2x65 s ALA 4 N -1.72 2.10 -0.30 5.17 0.00 -0.51 -0.30 121.76 126.20 2x65 s ALA 4 Ca 0.25 -0.97 -0.05 0.00 0.00 0.00 0.00 51.96 51.20 2x65 s ALA 4 Cb -0.09 -0.88 0.03 0.00 0.00 0.00 0.00 23.12 22.19 2x65 s ALA 4 CO 0.15 0.11 0.04 -1.17 0.00 0.00 0.00 175.76 174.90 2x65 s LEU 5 N 0.62 3.87 -0.32 0.00 0.20 0.22 -0.93 118.68 122.34 2x65 s LEU 5 Ca -0.13 -1.00 -0.16 0.00 0.69 0.00 0.00 54.13 53.54 2x65 s LEU 5 Cb -0.17 -1.80 -0.02 0.00 -0.43 0.00 0.00 46.19 43.78 2x65 s LEU 5 CO 0.03 -0.24 0.41 -0.63 -0.29 0.00 0.00 176.35 175.64 2x65 s ILE 6 N 1.38 5.12 -0.23 6.68 1.01 0.59 0.06 121.20 135.81 2x65 s ILE 6 Ca -0.01 0.30 -0.15 0.00 0.00 0.00 0.00 60.65 60.78 2x65 s ILE 6 Cb -0.18 -3.83 -0.04 0.00 0.01 0.00 0.00 42.46 38.42 2x65 s ILE 6 CO 0.00 -0.05 0.39 -0.76 0.00 0.00 0.00 174.94 174.52 2x65 s LEU 7 N 2.15 4.10 0.17 2.97 1.43 0.70 -2.08 118.68 128.12 2x65 s LEU 7 Ca 0.15 0.42 -0.33 0.00 -1.03 0.00 0.00 54.13 53.34 2x65 s LEU 7 Cb -0.16 -2.47 -0.16 0.00 0.03 0.00 0.00 46.19 43.43 2x65 s LEU 7 CO 0.12 -0.12 1.11 0.00 0.23 0.00 0.00 176.35 177.68 2x65 n ALA 8 N 4.84 -1.07 -2.21 4.21 0.00 -1.00 -1.83 120.51 123.44 2x65 n ALA 8 Ca -0.08 0.47 -0.10 0.00 0.00 0.00 0.00 53.44 53.72 2x65 n ALA 8 Cb 0.51 -1.98 0.06 0.00 0.00 0.00 0.00 19.45 18.04 2x65 n ALA 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x65 n GLY 9 N 1.94 0.34 0.00 0.00 0.00 -1.26 -4.84 105.19 101.37 2x65 n GLY 9 Ca 0.15 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.24 2x65 n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x65 n GLY 10 N 1.58 1.40 3.80 -0.02 0.00 -1.26 -4.75 105.19 105.94 2x65 n GLY 10 Ca 0.07 -1.68 -0.34 0.00 0.00 0.00 0.00 46.02 44.07 2x65 n GLY 10 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2x65 s SER 11 N -1.00 6.50 -0.09 1.61 0.15 -1.26 -1.45 113.70 118.16 2x65 s SER 11 Ca 0.00 1.90 0.05 0.00 0.70 0.00 0.00 55.95 58.59 2x65 s SER 11 Cb 0.00 -2.56 0.29 0.00 -1.71 0.00 0.00 66.02 62.04 2x65 s SER 11 CO 0.00 -0.67 0.98 0.61 1.20 0.00 0.00 173.24 175.36 2x65 n GLY 12 N -0.25 2.11 0.35 9.45 0.00 0.15 -4.09 105.19 112.91 2x65 n GLY 12 Ca 0.08 -0.34 0.11 0.00 0.00 0.00 0.00 46.02 45.87 2x65 n GLY 12 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2x65 h GLU 13 N 1.36 0.49 0.00 1.61 4.11 -1.82 -1.84 114.58 118.49 2x65 h GLU 13 Ca 0.02 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.42 2x65 h GLU 13 Cb 1.09 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.23 2x65 h GLU 13 CO 0.20 0.33 0.00 0.54 0.07 0.00 0.00 179.01 180.14 2x65 n ARG 14 N -4.48 0.69 -0.44 1.06 1.74 -1.26 -2.84 116.66 111.13 2x65 n ARG 14 Ca 0.11 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 57.27 2x65 n ARG 14 Cb 0.35 -1.50 0.27 0.00 -1.02 0.00 0.00 32.46 30.56 2x65 n ARG 14 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2x65 n PHE 15 N -1.15 1.04 -1.69 -1.55 3.72 -0.69 -4.27 117.46 112.87 2x65 n PHE 15 Ca 0.19 -0.65 -0.41 0.00 -0.05 0.00 0.00 57.45 56.53 2x65 n PHE 15 Cb 0.18 -0.20 0.01 0.00 -0.94 0.00 0.00 39.48 38.53 2x65 n PHE 15 CO 0.00 0.00 0.00 1.87 -0.05 0.00 0.00 176.76 178.58 2x65 n TRP 16 N 0.53 2.03 0.90 1.38 -0.00 -1.13 -0.66 117.44 120.49 2x65 n TRP 16 Ca 0.20 0.51 0.08 0.00 -0.00 0.00 0.00 57.50 58.30 2x65 n TRP 16 Cb 0.75 -2.36 0.25 0.00 -0.00 0.00 0.00 31.31 29.96 2x65 n TRP 16 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2x65 n PRO 17 N 0.05 1.87 -0.12 5.87 -0.04 -1.26 -4.84 135.00 136.53 2x65 n PRO 17 Ca 0.07 -1.34 -0.11 0.00 -0.04 0.00 0.00 63.50 62.08 2x65 n PRO 17 Cb 0.39 -1.35 -0.02 0.00 -0.04 0.00 0.00 33.50 32.48 2x65 n PRO 17 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2x65 h LEU 18 N 2.37 0.66 -9.32 1.53 5.85 -1.27 -3.42 115.31 111.72 2x65 h LEU 18 Ca 0.00 -0.34 -0.56 0.00 0.84 0.00 0.00 57.88 57.82 2x65 h LEU 18 Cb 0.53 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 2x65 h LEU 18 CO 0.00 0.85 0.36 -0.55 -0.34 0.00 0.00 178.44 178.76 2x65 s SER 19 N -6.23 7.18 0.59 1.25 0.15 -0.87 -5.06 113.70 110.72 2x65 s SER 19 Ca -0.13 1.44 -0.18 0.00 0.70 0.00 0.00 55.95 57.78 2x65 s SER 19 Cb 0.09 -2.51 -0.03 0.00 -1.71 0.00 0.00 66.02 61.86 2x65 s SER 19 CO 0.79 -0.30 1.13 0.42 1.20 0.00 0.00 173.24 176.48 2x65 s THR 20 N 1.43 3.10 0.20 6.45 -4.23 -1.26 -4.51 115.64 116.81 2x65 s THR 20 Ca 0.45 0.62 -0.13 0.00 -1.18 0.00 0.00 61.69 61.46 2x65 s THR 20 Cb -0.19 -3.19 0.18 0.00 1.34 0.00 0.00 72.50 70.64 2x65 s THR 20 CO 0.20 -0.21 1.66 -0.65 -0.54 0.00 0.00 174.62 175.08 2x65 h PRO 21 N 0.72 0.07 -0.38 3.99 0.10 -1.97 -1.55 132.00 132.99 2x65 h PRO 21 Ca -0.49 -0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.61 2x65 h PRO 21 Cb 1.26 -0.02 0.00 0.00 0.10 0.00 0.00 31.00 32.35 2x65 h PRO 21 CO 0.55 0.05 0.00 0.39 0.10 0.00 0.00 178.00 179.09 2x65 n GLU 22 N -5.31 2.77 -2.39 1.05 1.02 -1.26 -4.63 120.64 111.88 2x65 n GLU 22 Ca 0.07 -2.09 -0.41 0.00 -0.02 0.00 0.00 57.16 54.71 2x65 n GLU 22 Cb 0.32 -1.30 -0.04 0.00 -0.02 0.00 0.00 31.44 30.40 2x65 n GLU 22 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2x65 s THR 23 N -1.00 3.54 0.43 2.62 2.01 -0.58 -4.82 115.64 117.83 2x65 s THR 23 Ca 0.26 1.35 -0.24 0.00 0.31 0.00 0.00 61.69 63.37 2x65 s THR 23 Cb 0.13 -3.86 -0.08 0.00 0.01 0.00 0.00 72.50 68.70 2x65 s THR 23 CO 0.18 0.24 1.22 -2.84 -0.69 0.00 0.00 174.62 172.73 2x65 s PRO 24 N -0.56 3.87 0.49 4.92 0.02 -1.26 -0.68 135.00 141.80 2x65 s PRO 24 Ca 0.51 1.93 0.14 0.00 0.02 0.00 0.00 61.00 63.60 2x65 s PRO 24 Cb -0.33 -2.58 1.16 0.00 0.02 0.00 0.00 34.50 32.77 2x65 s PRO 24 CO 0.38 -0.50 2.12 -0.22 -0.33 0.00 0.00 177.00 178.44 2x65 h LYS 25 N 2.38 0.12 0.00 5.54 3.64 -1.40 -2.26 116.57 124.59 2x65 h LYS 25 Ca -0.49 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 58.88 2x65 h LYS 25 Cb 1.25 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2x65 h LYS 25 CO 0.61 0.09 -0.00 -0.56 -2.27 0.00 0.00 179.45 177.33 2x65 h GLN 26 N 0.12 0.00 -0.00 1.90 3.07 -1.89 0.98 115.11 119.29 2x65 h GLN 26 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.77 2x65 h GLN 26 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.57 2x65 h GLN 26 CO -0.00 0.00 -0.17 1.19 0.09 0.00 0.00 178.83 179.94 2x65 n PHE 27 N -3.23 0.00 -2.08 0.06 3.72 -0.85 -1.32 117.46 113.75 2x65 n PHE 27 Ca -0.03 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.96 2x65 n PHE 27 Cb 0.09 -0.25 -0.02 0.00 -0.94 0.00 0.00 39.48 38.36 2x65 n PHE 27 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2x65 s LEU 28 N -2.67 4.41 -1.07 4.37 1.43 0.34 -4.63 118.68 120.86 2x65 s LEU 28 Ca 0.23 2.66 -0.06 0.00 -1.03 0.00 0.00 54.13 55.93 2x65 s LEU 28 Cb 0.19 -3.64 0.29 0.00 0.03 0.00 0.00 46.19 43.06 2x65 s LEU 28 CO 0.53 -0.60 1.25 0.29 0.23 0.00 0.00 176.35 178.05 2x65 n LYS 29 N 1.50 3.87 0.09 1.70 5.02 -1.26 -1.44 118.16 127.64 2x65 n LYS 29 Ca 0.03 -4.51 -0.06 0.00 -2.02 0.00 0.00 58.31 51.75 2x65 n LYS 29 Cb 0.41 -2.51 -0.03 0.00 -0.02 0.00 0.00 35.03 32.88 2x65 n LYS 29 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2x65 h LEU 30 N 5.98 0.05 -7.99 -0.35 3.38 -1.92 -3.44 115.31 111.02 2x65 h LEU 30 Ca 0.19 -0.05 -0.35 0.00 0.09 0.00 0.00 57.88 57.76 2x65 h LEU 30 Cb 0.74 -0.02 -0.28 0.00 0.09 0.00 0.00 40.66 41.20 2x65 h LEU 30 CO 1.14 0.91 -0.76 -0.36 0.09 0.00 0.00 178.44 179.46 2x65 s PHE 31 N -3.02 0.64 -1.83 1.13 0.08 -1.26 -4.90 117.98 108.81 2x65 s PHE 31 Ca -0.00 -0.15 0.00 0.00 0.12 0.00 0.00 56.93 56.89 2x65 s PHE 31 Cb 0.11 -0.41 0.00 0.00 -0.57 0.00 0.00 43.02 42.15 2x65 s PHE 31 CO 0.81 -0.01 0.00 0.41 -0.10 0.00 0.00 175.22 176.32 2x65 n GLY 32 N 2.77 0.92 2.58 4.36 0.00 -1.26 -2.23 105.19 112.32 2x65 n GLY 32 Ca -0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.69 2x65 n GLY 32 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2x65 n ASN 33 N -1.44 -5.24 -4.03 1.61 5.15 -1.26 -4.99 115.26 105.07 2x65 n ASN 33 Ca -0.20 -0.03 -0.15 0.00 -0.60 0.00 0.00 54.58 53.60 2x65 n ASN 33 Cb 0.63 -4.35 -0.13 0.00 -0.53 0.00 0.00 39.78 35.40 2x65 n ASN 33 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2x65 s LYS 34 N -5.22 0.53 0.62 1.20 1.02 -0.95 -5.04 119.74 111.91 2x65 s LYS 34 Ca 0.08 -0.51 -0.19 0.00 0.02 0.00 0.00 55.97 55.37 2x65 s LYS 34 Cb -0.04 -0.42 -0.02 0.00 -0.52 0.00 0.00 37.83 36.83 2x65 s LYS 34 CO 0.10 0.10 1.28 -1.54 -0.92 0.00 0.00 175.35 174.36 2x65 s SER 35 N -0.89 4.83 0.29 2.83 1.04 -1.26 -4.24 113.70 116.30 2x65 s SER 35 Ca -0.03 2.58 -0.02 0.00 0.48 0.00 0.00 55.95 58.96 2x65 s SER 35 Cb -0.06 -2.62 0.63 0.00 0.10 0.00 0.00 66.02 64.08 2x65 s SER 35 CO 0.00 -1.85 1.60 -0.07 0.98 0.00 0.00 173.24 173.90 2x65 h LEU 36 N 0.74 -0.42 -0.44 2.42 3.38 -1.19 -1.42 115.31 118.38 2x65 h LEU 36 Ca -0.51 0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 2x65 h LEU 36 Cb 1.32 0.43 -0.02 0.00 0.09 0.00 0.00 40.66 42.49 2x65 h LEU 36 CO 0.54 -0.28 0.15 -0.03 0.09 0.00 0.00 178.44 178.91 2x65 h MET 37 N 0.06 0.67 -0.02 1.13 4.05 -1.05 -1.83 114.93 117.94 2x65 h MET 37 Ca 0.53 -0.14 0.01 0.00 -0.28 0.00 0.00 59.70 59.83 2x65 h MET 37 Cb 1.03 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 31.72 2x65 h MET 37 CO -0.83 0.64 -0.04 -0.09 0.23 0.00 0.00 176.91 176.82 2x65 h ARG 38 N 0.57 -0.06 -0.96 0.39 9.65 -1.56 0.67 114.38 123.07 2x65 h ARG 38 Ca 0.14 0.00 0.08 0.00 -1.10 0.00 0.00 59.98 59.11 2x65 h ARG 38 Cb 0.24 0.01 -0.07 0.00 -1.39 0.00 0.00 29.97 28.76 2x65 h ARG 38 CO -0.01 -0.04 0.62 -1.49 2.80 0.00 0.00 179.97 181.86 2x65 h TRP 39 N -0.06 1.12 -0.17 2.20 4.06 -1.22 -0.15 115.95 121.73 2x65 h TRP 39 Ca 0.03 0.03 -0.00 0.00 2.06 0.00 0.00 58.89 61.00 2x65 h TRP 39 Cb 0.09 -0.36 -0.01 0.00 -1.00 0.00 0.00 29.16 27.88 2x65 h TRP 39 CO -0.12 0.54 0.09 1.15 -3.56 0.00 0.00 178.44 176.54 2x65 h THR 40 N 1.06 1.10 -0.42 1.49 2.02 -0.38 -1.54 112.91 116.24 2x65 h THR 40 Ca 0.43 -0.27 0.04 0.00 0.77 0.00 0.00 66.41 67.38 2x65 h THR 40 Cb 0.28 0.97 -0.04 0.00 -1.74 0.00 0.00 68.15 67.62 2x65 h THR 40 CO -0.19 0.09 0.20 0.15 0.37 0.00 0.00 175.52 176.15 2x65 h PHE 41 N 0.18 0.37 -0.16 3.16 3.57 -0.32 -1.38 116.94 122.35 2x65 h PHE 41 Ca 0.06 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.54 2x65 h PHE 41 Cb 0.07 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 2x65 h PHE 41 CO -0.04 0.18 -0.08 0.93 -2.23 0.00 0.00 178.31 177.07 2x65 h GLU 42 N 0.40 0.25 -0.20 1.11 5.08 -0.86 0.29 114.58 120.66 2x65 h GLU 42 Ca 0.18 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.45 2x65 h GLU 42 Cb 0.11 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2x65 h GLU 42 CO -0.14 0.35 -0.06 -0.09 -1.00 0.00 0.00 179.01 178.07 2x65 h ARG 43 N 0.24 0.39 -0.71 2.33 2.43 -0.59 -2.94 114.38 115.54 2x65 h ARG 43 Ca 0.05 -0.16 0.03 0.00 -0.81 0.00 0.00 59.98 59.10 2x65 h ARG 43 Cb 0.31 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.79 2x65 h ARG 43 CO 0.02 0.66 0.44 0.28 -1.51 0.00 0.00 179.97 179.85 2x65 h VAL 44 N 0.11 1.08 0.00 0.20 2.07 -0.74 -2.91 116.25 116.07 2x65 h VAL 44 Ca 0.05 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.28 2x65 h VAL 44 Cb 0.52 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 2x65 h VAL 44 CO 0.02 0.16 0.00 -0.07 0.02 0.00 0.00 177.57 177.70 2x65 h LEU 45 N 0.85 0.00 -1.32 2.57 3.38 -0.81 -1.28 115.31 118.70 2x65 h LEU 45 Ca 0.29 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.41 2x65 h LEU 45 Cb 0.04 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.72 2x65 h LEU 45 CO -0.12 0.00 0.58 -0.08 0.09 0.00 0.00 178.44 178.91 2x65 h GLU 46 N 0.00 0.61 0.00 1.13 4.57 -1.34 -3.22 114.58 116.34 2x65 h GLU 46 Ca 0.00 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2x65 h GLU 46 Cb 0.27 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 2x65 h GLU 46 CO 0.00 0.41 -0.30 0.39 -1.18 0.00 0.00 179.01 178.33 2x65 n GLU 47 N -4.56 4.54 -4.62 1.92 -0.58 -0.96 -5.08 120.64 111.30 2x65 n GLU 47 Ca 0.18 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.62 2x65 n GLU 47 Cb 0.52 -0.62 -0.13 0.00 -0.57 0.00 0.00 31.44 30.64 2x65 n GLU 47 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 2x65 s MET 48 N -1.22 1.99 0.07 3.49 -1.94 -0.52 -5.10 119.30 116.07 2x65 s MET 48 Ca 0.00 -1.03 -0.30 0.00 -1.71 0.00 0.00 55.69 52.65 2x65 s MET 48 Cb 0.00 -2.15 -0.06 0.00 2.01 0.00 0.00 34.83 34.63 2x65 s MET 48 CO 0.00 0.53 1.16 0.34 -0.01 0.00 0.00 175.02 177.03 2x65 s ASP 49 N -1.54 7.14 0.57 3.03 -1.08 -1.26 -4.41 116.67 119.13 2x65 s ASP 49 Ca 0.15 1.99 0.28 0.00 -0.52 0.00 0.00 52.55 54.45 2x65 s ASP 49 Cb -0.10 -2.58 1.49 0.00 -1.46 0.00 0.00 42.92 40.27 2x65 s ASP 49 CO 0.06 -0.41 1.94 1.55 0.52 0.00 0.00 175.17 178.83 2x65 h PRO 50 N 6.53 0.00 0.00 4.34 0.13 -1.94 0.10 132.00 141.16 2x65 h PRO 50 Ca -0.42 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.70 2x65 h PRO 50 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 2x65 h PRO 50 CO 0.79 0.00 -0.04 1.57 -0.23 0.00 0.00 178.00 180.09 2x65 h LYS 51 N 0.00 0.00 -0.49 0.86 2.10 -1.92 -1.74 116.57 115.38 2x65 h LYS 51 Ca 0.22 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.87 2x65 h LYS 51 Cb 1.09 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.42 2x65 h LYS 51 CO -0.00 0.04 0.00 -0.25 -2.00 0.00 0.00 179.45 177.24 2x65 n ASP 52 N -3.47 2.98 -4.41 7.07 8.00 0.02 -4.86 116.55 121.87 2x65 n ASP 52 Ca -0.02 -1.96 -0.33 0.00 0.71 0.00 0.00 54.79 53.18 2x65 n ASP 52 Cb 0.16 -0.33 -0.13 0.00 -0.02 0.00 0.00 41.12 40.80 2x65 n ASP 52 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2x65 s VAL 53 N -1.35 3.38 -0.08 2.53 1.01 -0.66 -1.42 120.40 123.81 2x65 s VAL 53 Ca 0.38 -0.54 0.04 0.00 0.00 0.00 0.00 61.98 61.86 2x65 s VAL 53 Cb 0.20 -2.45 -0.01 0.00 0.00 0.00 0.00 36.38 34.12 2x65 s VAL 53 CO 0.27 0.51 -0.20 -0.63 0.00 0.00 0.00 175.10 175.05 2x65 s ILE 54 N 0.42 2.49 -0.21 2.22 -1.09 -0.10 -4.83 121.20 120.10 2x65 s ILE 54 Ca -0.07 -0.90 -0.04 0.00 -2.23 0.00 0.00 60.65 57.41 2x65 s ILE 54 Cb -0.15 -1.97 -0.02 0.00 -1.58 0.00 0.00 42.46 38.75 2x65 s ILE 54 CO 0.04 0.56 -0.02 -0.69 -1.23 0.00 0.00 174.94 173.60 2x65 s VAL 55 N -0.07 3.66 -0.24 2.92 1.01 -0.32 -0.30 120.40 127.06 2x65 s VAL 55 Ca -0.05 -0.40 -0.08 0.00 0.00 0.00 0.00 61.98 61.45 2x65 s VAL 55 Cb -0.14 -2.66 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 2x65 s VAL 55 CO 0.04 0.42 0.08 -0.69 0.00 0.00 0.00 175.10 174.96 2x65 s VAL 56 N 1.24 4.52 0.15 2.92 1.01 -0.88 -0.35 120.40 129.01 2x65 s VAL 56 Ca 0.03 -0.10 -0.18 0.00 0.00 0.00 0.00 61.98 61.73 2x65 s VAL 56 Cb -0.14 -3.11 0.04 0.00 0.00 0.00 0.00 36.38 33.17 2x65 s VAL 56 CO -0.00 0.35 0.47 0.28 0.00 0.00 0.00 175.10 176.20 2x65 s THR 57 N 1.44 0.04 0.48 3.92 -1.32 -0.15 -2.38 115.64 117.68 2x65 s THR 57 Ca 0.06 -0.51 -0.22 0.00 -1.21 0.00 0.00 61.69 59.81 2x65 s THR 57 Cb -0.15 -1.24 -0.07 0.00 -1.51 0.00 0.00 72.50 69.53 2x65 s THR 57 CO 0.04 -0.20 1.16 -2.28 -2.21 0.00 0.00 174.62 171.14 2x65 s HIS 58 N -3.81 2.81 0.42 9.09 2.46 -1.26 0.16 115.29 125.15 2x65 s HIS 58 Ca 0.04 1.53 0.13 0.00 0.47 0.00 0.00 55.06 57.24 2x65 s HIS 58 Cb 0.01 -3.37 0.99 0.00 -0.13 0.00 0.00 32.58 30.08 2x65 s HIS 58 CO -0.10 -1.56 1.96 1.57 -2.47 0.00 0.00 174.74 174.14 2x65 h LYS 59 N 1.81 0.45 -0.12 2.88 2.10 -1.71 -1.43 116.57 120.55 2x65 h LYS 59 Ca -0.50 -0.03 -0.01 0.00 -2.00 0.00 0.00 60.65 58.12 2x65 h LYS 59 Cb 1.25 -0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 32.48 2x65 h LYS 59 CO 0.59 0.30 0.03 -0.44 -2.00 0.00 0.00 179.45 177.93 2x65 h ASP 60 N 0.46 0.14 -0.03 7.07 3.32 -1.90 -2.68 116.42 122.80 2x65 h ASP 60 Ca 0.30 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.35 2x65 h ASP 60 Cb 0.57 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.09 2x65 h ASP 60 CO -0.09 0.15 0.00 -1.22 -1.72 0.00 0.00 179.24 176.35 2x65 n TYR 61 N -4.47 0.01 -0.02 4.55 4.01 -0.54 -4.37 117.16 116.33 2x65 n TYR 61 Ca -0.01 -0.01 -0.11 0.00 -0.16 0.00 0.00 57.90 57.61 2x65 n TYR 61 Cb 0.12 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.10 2x65 n TYR 61 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2x65 h VAL 62 N 2.75 1.10 -0.30 -0.72 2.07 -1.51 -0.76 116.25 118.88 2x65 h VAL 62 Ca 0.00 -0.29 -0.09 0.00 0.82 0.00 0.00 66.70 67.14 2x65 h VAL 62 Cb 0.59 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 2x65 h VAL 62 CO 0.00 0.09 -0.18 -0.33 0.02 0.00 0.00 177.57 177.18 2x65 h GLU 63 N 0.09 0.55 0.00 1.57 4.39 -1.80 -0.31 114.58 119.08 2x65 h GLU 63 Ca 0.04 -0.18 -0.19 0.00 0.34 0.00 0.00 59.36 59.37 2x65 h GLU 63 Cb 0.09 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.67 2x65 h GLU 63 CO -0.01 0.70 -0.90 -0.09 -1.16 0.00 0.00 179.01 177.56 2x65 h ARG 64 N 0.49 0.01 -0.26 2.33 2.43 -1.80 -2.69 114.38 114.89 2x65 h ARG 64 Ca 0.08 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 2x65 h ARG 64 Cb 0.59 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 2x65 h ARG 64 CO 0.04 0.90 0.09 1.15 -1.51 0.00 0.00 179.97 180.64 2x65 h THR 65 N 0.00 1.19 -1.00 0.20 2.02 -0.75 0.15 112.91 114.72 2x65 h THR 65 Ca -0.01 -0.58 0.15 0.00 0.77 0.00 0.00 66.41 66.74 2x65 h THR 65 Cb 1.59 1.09 -0.09 0.00 -1.74 0.00 0.00 68.15 69.00 2x65 h THR 65 CO 0.12 0.19 0.62 0.11 0.37 0.00 0.00 175.52 176.93 2x65 h LYS 66 N 0.26 0.86 -0.01 6.66 1.57 -0.99 0.40 116.57 125.32 2x65 h LYS 66 Ca 0.08 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 2x65 h LYS 66 Cb 0.21 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.33 2x65 h LYS 66 CO -0.00 0.57 -0.04 -0.22 -0.57 0.00 0.00 179.45 179.19 2x65 h LYS 67 N 0.89 0.04 -0.95 3.15 3.64 -1.13 -2.98 116.57 119.23 2x65 h LYS 67 Ca 0.53 -0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.98 2x65 h LYS 67 Cb 0.67 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.43 2x65 h LYS 67 CO -0.32 0.67 0.61 0.93 -2.27 0.00 0.00 179.45 179.07 2x65 h GLU 68 N -0.57 0.94 -2.19 1.90 4.39 -0.36 -3.34 114.58 115.35 2x65 h GLU 68 Ca -0.00 -0.06 -0.60 0.00 0.34 0.00 0.00 59.36 59.05 2x65 h GLU 68 Cb 0.67 -0.21 -0.42 0.00 -0.10 0.00 0.00 28.75 28.69 2x65 h GLU 68 CO 0.01 0.62 -0.66 1.28 -1.16 0.00 0.00 179.01 179.10 2x65 n LEU 69 N -4.55 3.26 0.28 1.33 4.77 0.10 -4.90 117.00 117.28 2x65 n LEU 69 Ca 0.17 -5.34 0.15 0.00 -0.03 0.00 0.00 56.01 50.96 2x65 n LEU 69 Cb 0.31 -0.49 0.77 0.00 -2.33 0.00 0.00 43.42 41.68 2x65 n LEU 69 CO 0.30 2.05 1.00 1.55 -1.33 0.00 0.00 177.39 180.96 2x65 h PRO 70 N 4.18 0.00 0.00 3.23 0.13 -1.65 -2.49 132.00 135.41 2x65 h PRO 70 Ca 0.18 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.30 2x65 h PRO 70 Cb 0.69 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.82 2x65 h PRO 70 CO 0.78 0.08 -0.07 0.93 -0.23 0.00 0.00 178.00 179.49 2x65 h GLU 71 N 0.00 0.00 -6.43 0.86 3.07 -1.91 -3.44 114.58 106.73 2x65 h GLU 71 Ca -0.00 0.00 -0.54 0.00 -0.50 0.00 0.00 59.36 58.32 2x65 h GLU 71 Cb 0.37 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.27 2x65 h GLU 71 CO 0.01 0.07 0.55 -1.17 -1.40 0.00 0.00 179.01 177.08 2x65 s LEU 72 N -6.38 4.35 0.35 1.33 2.96 -0.94 -4.87 118.68 115.48 2x65 s LEU 72 Ca 0.02 1.89 -0.28 0.00 -0.22 0.00 0.00 54.13 55.54 2x65 s LEU 72 Cb 0.09 -3.57 -0.11 0.00 0.50 0.00 0.00 46.19 43.10 2x65 s LEU 72 CO 0.59 -0.45 1.39 -2.84 -1.32 0.00 0.00 176.35 173.72 2x65 s PRO 73 N 1.33 4.23 0.25 0.98 0.02 -1.26 -4.90 135.00 135.65 2x65 s PRO 73 Ca 0.57 2.39 -0.05 0.00 0.02 0.00 0.00 61.00 63.93 2x65 s PRO 73 Cb -0.27 -3.02 0.36 0.00 0.02 0.00 0.00 34.50 31.60 2x65 s PRO 73 CO 0.27 -0.36 1.84 -0.44 -0.33 0.00 0.00 177.00 177.99 2x65 h ASP 74 N 3.19 0.82 -0.01 2.53 5.19 -1.95 0.17 116.42 126.37 2x65 h ASP 74 Ca -0.50 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 55.94 2x65 h ASP 74 Cb 1.23 -0.15 -0.00 0.00 0.18 0.00 0.00 39.33 40.60 2x65 h ASP 74 CO 0.65 0.51 0.01 1.05 -3.12 0.00 0.00 179.24 178.34 2x65 h GLU 75 N 0.95 0.00 -0.10 3.56 9.09 -2.01 -1.05 114.58 125.03 2x65 h GLU 75 Ca 0.39 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.80 2x65 h GLU 75 Cb 0.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.33 2x65 h GLU 75 CO -0.19 0.00 0.00 0.09 0.05 0.00 0.00 179.01 178.96 2x65 n ASN 76 N -3.37 1.13 -4.52 3.06 4.13 0.60 -4.66 115.26 111.65 2x65 n ASN 76 Ca -0.03 -1.57 -0.41 0.00 1.68 0.00 0.00 54.58 54.25 2x65 n ASN 76 Cb 0.09 -0.06 -0.10 0.00 -1.54 0.00 0.00 39.78 38.17 2x65 n ASN 76 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2x65 s ILE 77 N -1.88 5.27 -0.37 2.41 1.01 -0.40 -1.17 121.20 126.07 2x65 s ILE 77 Ca 0.33 -0.29 -0.17 0.00 0.00 0.00 0.00 60.65 60.52 2x65 s ILE 77 Cb 0.17 -3.77 0.00 0.00 0.01 0.00 0.00 42.46 38.87 2x65 s ILE 77 CO 0.27 -0.09 0.45 -0.63 0.00 0.00 0.00 174.94 174.94 2x65 s ILE 78 N 1.74 5.08 -0.29 2.92 -1.09 0.53 -4.99 121.20 125.10 2x65 s ILE 78 Ca 0.06 0.07 -0.27 0.00 -2.23 0.00 0.00 60.65 58.29 2x65 s ILE 78 Cb -0.18 -3.94 0.01 0.00 -1.58 0.00 0.00 42.46 36.77 2x65 s ILE 78 CO 0.11 -0.23 0.95 0.00 -1.23 0.00 0.00 174.94 174.53 2x65 s ALA 79 N 2.22 3.56 0.13 9.38 0.00 -1.26 -0.98 121.76 134.82 2x65 s ALA 79 Ca 0.15 -0.14 -0.24 0.00 0.00 0.00 0.00 51.96 51.73 2x65 s ALA 79 Cb -0.16 -3.49 -0.07 0.00 0.00 0.00 0.00 23.12 19.39 2x65 s ALA 79 CO 0.13 -1.26 0.72 -1.21 0.00 0.00 0.00 175.76 174.14 2x65 s GLU 80 N 3.26 4.46 0.39 0.00 2.02 0.42 -4.78 118.70 124.48 2x65 s GLU 80 Ca 0.40 1.04 0.12 0.00 0.02 0.00 0.00 54.97 56.54 2x65 s GLU 80 Cb -0.14 -3.27 0.78 0.00 0.10 0.00 0.00 34.13 31.61 2x65 s GLU 80 CO 0.12 0.56 1.88 -1.35 0.02 0.00 0.00 175.26 176.49 2x65 h PRO 81 N 4.50 0.06 -2.49 0.39 0.11 -1.90 -2.29 132.00 130.39 2x65 h PRO 81 Ca -0.47 -0.02 0.15 0.00 0.11 0.00 0.00 66.00 65.77 2x65 h PRO 81 Cb 1.21 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 32.24 2x65 h PRO 81 CO 0.66 0.34 0.43 0.00 -0.21 0.00 0.00 178.00 179.22 2x65 s MET 82 N -4.40 1.33 -0.49 1.05 0.23 -1.26 -4.90 119.30 110.86 2x65 s MET 82 Ca -0.04 -0.74 -0.29 0.00 -1.03 0.00 0.00 55.69 53.59 2x65 s MET 82 Cb 0.15 0.45 0.03 0.00 -1.53 0.00 0.00 34.83 33.93 2x65 s MET 82 CO 0.72 -0.61 1.15 0.15 -2.03 0.00 0.00 175.02 174.40 2x65 s LYS 83 N -3.38 3.70 -0.01 3.16 1.02 -1.26 -4.84 119.74 118.13 2x65 s LYS 83 Ca 0.12 0.53 0.05 0.00 0.02 0.00 0.00 55.97 56.70 2x65 s LYS 83 Cb -0.02 -3.92 0.14 0.00 -0.52 0.00 0.00 37.83 33.50 2x65 s LYS 83 CO 0.03 -1.42 1.11 1.63 -0.92 0.00 0.00 175.35 175.78 2x65 n LYS 84 N 7.93 2.86 -0.41 1.68 4.01 -1.26 -4.93 118.16 128.04 2x65 n LYS 84 Ca 0.12 -1.79 0.06 0.00 -0.51 0.00 0.00 58.31 56.18 2x65 n LYS 84 Cb 0.49 -1.15 -0.01 0.00 -0.51 0.00 0.00 35.03 33.85 2x65 n LYS 84 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 2x65 n ASN 85 N -0.21 -3.77 0.16 4.39 2.85 -1.26 -1.91 115.26 115.51 2x65 n ASN 85 Ca 0.06 0.44 0.04 0.00 -0.11 0.00 0.00 54.58 55.01 2x65 n ASN 85 Cb 0.35 -1.25 0.15 0.00 1.24 0.00 0.00 39.78 40.28 2x65 n ASN 85 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 2x65 h THR 86 N -0.38 0.83 -0.37 -0.44 1.35 -1.89 -3.31 112.91 108.70 2x65 h THR 86 Ca 0.01 -1.93 -0.02 0.00 -0.55 0.00 0.00 66.41 63.92 2x65 h THR 86 Cb 0.38 2.23 -0.02 0.00 -1.73 0.00 0.00 68.15 69.01 2x65 h THR 86 CO 0.00 0.43 0.16 0.00 -0.25 0.00 0.00 175.52 175.87 2x65 h ALA 87 N 1.56 0.48 -0.27 6.62 0.00 -1.57 0.23 119.26 126.30 2x65 h ALA 87 Ca -0.00 -0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.62 2x65 h ALA 87 Cb 1.20 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 2x65 h ALA 87 CO 0.06 0.06 -0.50 -1.35 0.00 0.00 0.00 179.25 177.52 2x65 h PRO 88 N 0.46 0.75 -0.16 0.00 0.11 -1.76 -1.89 132.00 129.51 2x65 h PRO 88 Ca 0.13 -0.45 0.04 0.00 0.11 0.00 0.00 66.00 65.83 2x65 h PRO 88 Cb 0.16 0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.27 2x65 h PRO 88 CO -0.01 1.07 -0.09 0.00 -0.21 0.00 0.00 178.00 178.76 2x65 h ALA 89 N 0.84 0.05 -0.75 -0.75 0.00 -1.60 -1.49 119.26 115.56 2x65 h ALA 89 Ca 0.02 0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.06 2x65 h ALA 89 Cb 1.08 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 19.02 2x65 h ALA 89 CO 0.11 -0.53 0.44 0.00 0.00 0.00 0.00 179.25 179.27 2x65 h PHE 91 N 0.81 -0.11 -0.14 0.00 3.04 -0.93 0.29 116.94 119.90 2x65 h PHE 91 Ca 0.33 -0.00 -0.17 0.00 3.98 0.00 0.00 57.97 62.11 2x65 h PHE 91 Cb 0.16 0.04 -0.01 0.00 2.56 0.00 0.00 35.95 38.70 2x65 h PHE 91 CO -0.06 0.05 -0.61 -0.84 -2.02 0.00 0.00 178.31 174.83 2x65 h ILE 92 N -0.24 1.34 -0.32 1.41 3.07 -1.07 -0.84 117.51 120.85 2x65 h ILE 92 Ca -0.01 -1.92 -0.09 0.00 1.55 0.00 0.00 64.86 64.39 2x65 h ILE 92 Cb 0.20 1.90 -0.01 0.00 -0.27 0.00 0.00 36.82 38.65 2x65 h ILE 92 CO 0.02 0.59 -0.16 1.23 -1.05 0.00 0.00 178.15 178.77 2x65 h GLY 93 N 1.16 0.74 1.46 0.16 0.00 -1.28 -3.16 103.07 102.15 2x65 h GLY 93 Ca -0.01 -0.67 -0.06 0.00 0.00 0.00 0.00 47.33 46.59 2x65 h GLY 93 CO 0.11 0.61 0.00 -0.84 0.00 0.00 0.00 176.54 176.42 2x65 h THR 94 N 0.45 1.22 -0.03 4.70 2.02 -0.79 -2.34 112.91 118.15 2x65 h THR 94 Ca 0.07 -0.90 0.01 0.00 0.77 0.00 0.00 66.41 66.36 2x65 h THR 94 Cb 0.70 0.90 -0.00 0.00 -1.74 0.00 0.00 68.15 68.01 2x65 h THR 94 CO 0.05 0.31 0.07 0.50 0.37 0.00 0.00 175.52 176.82 2x65 h LYS 95 N 0.63 0.00 0.00 6.66 3.64 -1.12 -1.64 116.57 124.74 2x65 h LYS 95 Ca 0.13 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2x65 h LYS 95 Cb 0.39 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 2x65 h LYS 95 CO 0.01 0.00 0.00 -0.07 -2.27 0.00 0.00 179.45 177.12 2x65 h LEU 96 N 0.00 0.00-10.50 5.20 3.38 -1.45 -3.45 115.31 108.49 2x65 h LEU 96 Ca 0.01 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.51 2x65 h LEU 96 Cb 0.15 0.00 0.08 0.00 0.09 0.00 0.00 40.66 40.97 2x65 h LEU 96 CO -0.00 0.00 0.32 0.00 0.09 0.00 0.00 178.44 178.85 2x65 s ALA 97 N -3.19 3.01 0.52 1.53 0.00 -0.62 -5.07 121.76 117.94 2x65 s ALA 97 Ca 0.08 -0.59 -0.19 0.00 0.00 0.00 0.00 51.96 51.26 2x65 s ALA 97 Cb 0.11 -2.83 -0.07 0.00 0.00 0.00 0.00 23.12 20.33 2x65 s ALA 97 CO 0.55 -1.17 1.08 0.34 0.00 0.00 0.00 175.76 176.56 2x65 s ASP 98 N -4.41 6.03 0.33 0.00 2.15 -1.26 -4.95 116.67 114.55 2x65 s ASP 98 Ca 0.58 2.01 0.11 0.00 0.43 0.00 0.00 52.55 55.69 2x65 s ASP 98 Cb -0.11 -2.57 0.99 0.00 -0.30 0.00 0.00 42.92 40.94 2x65 s ASP 98 CO 0.48 -1.00 1.67 0.44 -0.17 0.00 0.00 175.17 176.59 2x65 h ASP 99 N 1.29 0.44 -0.23 -0.34 3.32 -1.94 -1.28 116.42 117.67 2x65 h ASP 99 Ca -0.49 0.19 0.00 0.00 0.02 0.00 0.00 57.03 56.74 2x65 h ASP 99 Cb 1.24 0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.94 2x65 h ASP 99 CO 0.58 -0.11 0.00 -0.67 -1.72 0.00 0.00 179.24 177.32 2x65 n ASP 100 N -5.07 2.90 -4.73 6.45 2.03 -1.26 -1.14 116.55 115.73 2x65 n ASP 100 Ca 0.29 -1.91 -0.40 0.00 0.52 0.00 0.00 54.79 53.29 2x65 n ASP 100 Cb 0.90 -0.14 -0.05 0.00 -0.72 0.00 0.00 41.12 41.11 2x65 n ASP 100 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 2x65 s GLU 101 N -1.72 4.46 0.50 -0.67 2.12 -0.48 -4.86 118.70 118.05 2x65 s GLU 101 Ca 0.35 0.99 -0.21 0.00 0.36 0.00 0.00 54.97 56.46 2x65 s GLU 101 Cb 0.21 -3.42 -0.07 0.00 0.26 0.00 0.00 34.13 31.12 2x65 s GLU 101 CO 0.30 0.14 1.14 -2.14 -0.54 0.00 0.00 175.26 174.17 2x65 s PRO 102 N 0.49 3.58 -0.15 4.30 0.02 -1.26 -1.14 135.00 140.84 2x65 s PRO 102 Ca 0.39 1.68 -0.01 0.00 0.02 0.00 0.00 61.00 63.08 2x65 s PRO 102 Cb -0.19 -2.21 0.04 0.00 0.02 0.00 0.00 34.50 32.16 2x65 s PRO 102 CO 0.21 -0.68 -0.03 0.08 -0.33 0.00 0.00 177.00 176.25 2x65 s VAL 103 N -1.66 0.86 -0.29 3.83 1.01 0.17 -1.22 120.40 123.10 2x65 s VAL 103 Ca 0.68 -0.45 -0.22 0.00 0.00 0.00 0.00 61.98 61.99 2x65 s VAL 103 Cb -0.26 -1.09 -0.01 0.00 0.00 0.00 0.00 36.38 35.03 2x65 s VAL 103 CO 0.30 0.11 0.71 -0.22 0.00 0.00 0.00 175.10 176.00 2x65 s LEU 104 N 1.74 4.10 -0.28 3.92 2.96 0.59 -2.27 118.68 129.44 2x65 s LEU 104 Ca 0.02 0.62 -0.09 0.00 -0.22 0.00 0.00 54.13 54.46 2x65 s LEU 104 Cb -0.15 -2.95 -0.02 0.00 0.50 0.00 0.00 46.19 43.57 2x65 s LEU 104 CO -0.07 -0.51 0.13 -0.69 -1.32 0.00 0.00 176.35 173.88 2x65 s VAL 105 N 2.74 4.59 -0.06 1.68 1.01 0.65 0.68 120.40 131.69 2x65 s VAL 105 Ca 0.29 -0.24 0.03 0.00 0.00 0.00 0.00 61.98 62.06 2x65 s VAL 105 Cb -0.15 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 32.99 2x65 s VAL 105 CO 0.11 0.20 -0.16 -0.76 0.00 0.00 0.00 175.10 174.49 2x65 s LEU 106 N 1.63 1.84 0.48 3.92 1.43 0.11 -1.34 118.68 126.75 2x65 s LEU 106 Ca 0.06 -0.36 -0.22 0.00 -1.03 0.00 0.00 54.13 52.57 2x65 s LEU 106 Cb -0.16 -0.98 -0.07 0.00 0.03 0.00 0.00 46.19 45.01 2x65 s LEU 106 CO 0.06 0.11 1.15 -2.16 0.23 0.00 0.00 176.35 175.74 2x65 s PRO 107 N 0.33 3.67 0.24 1.29 0.04 -1.26 -0.22 135.00 139.09 2x65 s PRO 107 Ca -0.10 1.73 0.26 0.00 0.04 0.00 0.00 61.00 62.92 2x65 s PRO 107 Cb -0.14 -2.31 0.79 0.00 0.04 0.00 0.00 34.50 32.88 2x65 s PRO 107 CO 0.04 -0.61 1.76 0.00 0.04 0.00 0.00 177.00 178.22 2x65 h ALA 108 N 1.85 1.00 -0.31 8.56 0.00 -1.69 -3.38 119.26 125.29 2x65 h ALA 108 Ca -0.49 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.17 2x65 h ALA 108 Cb 1.25 0.00 -0.29 0.00 0.00 0.00 0.00 17.79 18.75 2x65 h ALA 108 CO 0.59 0.00 -0.84 -0.40 0.00 0.00 0.00 179.25 178.61 2x65 n ASP 109 N -2.35 2.48 -4.97 0.00 5.68 -1.26 -2.85 116.55 113.28 2x65 n ASP 109 Ca 0.05 -3.07 -0.19 0.00 -0.50 0.00 0.00 54.79 51.08 2x65 n ASP 109 Cb 0.42 -0.42 0.01 0.00 -1.14 0.00 0.00 41.12 39.99 2x65 n ASP 109 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 2x65 s HIS 110 N -2.80 2.45 -0.12 2.11 3.76 -1.26 -4.65 115.29 114.78 2x65 s HIS 110 Ca 0.39 -0.52 -0.00 0.00 -0.15 0.00 0.00 55.06 54.77 2x65 s HIS 110 Cb 0.38 -2.25 0.03 0.00 1.11 0.00 0.00 32.58 31.84 2x65 s HIS 110 CO -0.05 -0.46 -0.07 0.50 -0.85 0.00 0.00 174.74 173.81 2x65 s ARG 111 N -4.33 1.47 -0.32 1.40 3.52 -0.10 -4.86 118.95 115.72 2x65 s ARG 111 Ca 0.53 -0.28 -0.01 0.00 -0.13 0.00 0.00 55.73 55.84 2x65 s ARG 111 Cb -0.07 -1.63 0.11 0.00 -1.56 0.00 0.00 34.95 31.80 2x65 s ARG 111 CO 0.32 -0.29 0.12 0.42 -0.81 0.00 0.00 175.30 175.05 2x65 s ILE 112 N 1.71 0.88 0.25 4.11 1.01 -1.26 -1.80 121.20 126.11 2x65 s ILE 112 Ca 0.04 -1.52 0.09 0.00 0.00 0.00 0.00 60.65 59.27 2x65 s ILE 112 Cb -0.13 -1.66 -0.05 0.00 0.01 0.00 0.00 42.46 40.63 2x65 s ILE 112 CO -0.08 -0.71 1.57 1.55 0.00 0.00 0.00 174.94 177.27 2x65 h PRO 113 N 7.91 0.04 -4.66 2.79 0.13 -1.99 -3.39 132.00 132.83 2x65 h PRO 113 Ca -0.12 -0.03 -0.72 0.00 -0.87 0.00 0.00 66.00 64.27 2x65 h PRO 113 Cb 1.00 0.01 -0.20 0.00 0.13 0.00 0.00 31.00 31.94 2x65 h PRO 113 CO 0.46 0.68 0.48 0.34 -0.23 0.00 0.00 178.00 179.73 2x65 s ASP 114 N -6.85 6.55 0.43 1.44 -1.08 -1.26 -4.86 116.67 111.05 2x65 s ASP 114 Ca -0.02 -2.04 0.22 0.00 -0.52 0.00 0.00 52.55 50.19 2x65 s ASP 114 Cb 0.12 -2.33 0.97 0.00 -1.46 0.00 0.00 42.92 40.22 2x65 s ASP 114 CO 0.77 -0.96 1.87 0.71 0.52 0.00 0.00 175.17 178.08 2x65 h THR 115 N 5.58 0.76 -0.01 1.71 1.35 -1.97 -1.15 112.91 119.18 2x65 h THR 115 Ca 0.03 -1.11 -0.14 0.00 -0.55 0.00 0.00 66.41 64.64 2x65 h THR 115 Cb 1.04 1.69 0.01 0.00 -1.73 0.00 0.00 68.15 69.16 2x65 h THR 115 CO 1.01 0.26 -0.54 0.11 -0.25 0.00 0.00 175.52 176.11 2x65 h LYS 116 N 0.00 0.39 -0.65 4.72 1.79 -1.97 -2.23 116.57 118.62 2x65 h LYS 116 Ca -0.00 -0.40 -0.00 0.00 -2.18 0.00 0.00 60.65 58.06 2x65 h LYS 116 Cb 0.67 0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 31.40 2x65 h LYS 116 CO 0.03 1.07 0.38 0.87 -1.08 0.00 0.00 179.45 180.73 2x65 h LYS 117 N -0.14 0.87 0.20 3.15 1.79 -1.86 0.11 116.57 120.70 2x65 h LYS 117 Ca -0.06 -0.07 0.01 0.00 -2.18 0.00 0.00 60.65 58.34 2x65 h LYS 117 Cb 1.25 -0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 31.69 2x65 h LYS 117 CO 0.11 0.62 -0.26 0.35 -1.08 0.00 0.00 179.45 179.18 2x65 h PHE 118 N 0.89 -0.69 -0.08 -1.35 3.57 -1.17 -1.92 116.94 116.18 2x65 h PHE 118 Ca 0.23 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.66 2x65 h PHE 118 Cb -0.03 0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 2x65 h PHE 118 CO 0.00 -0.37 -0.33 -1.49 -2.23 0.00 0.00 178.31 173.89 2x65 h TRP 119 N -0.52 0.18 -0.37 0.41 4.06 -1.15 -1.07 115.95 117.49 2x65 h TRP 119 Ca 0.01 -0.04 0.08 0.00 2.06 0.00 0.00 58.89 61.00 2x65 h TRP 119 Cb 0.50 -0.04 -0.08 0.00 -1.00 0.00 0.00 29.16 28.54 2x65 h TRP 119 CO -0.20 0.47 -0.20 -0.22 -3.56 0.00 0.00 178.44 174.73 2x65 h LYS 120 N 0.14 -0.14 -0.24 0.49 3.64 -0.48 -0.54 116.57 119.44 2x65 h LYS 120 Ca 0.02 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 2x65 h LYS 120 Cb 0.65 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.50 2x65 h LYS 120 CO 0.05 -0.09 -0.01 1.15 -2.27 0.00 0.00 179.45 178.28 2x65 h THR 121 N -0.14 1.26 -0.83 1.00 2.02 -0.91 -2.42 112.91 112.89 2x65 h THR 121 Ca 0.18 -0.93 0.06 0.00 0.77 0.00 0.00 66.41 66.49 2x65 h THR 121 Cb 0.43 1.39 -0.06 0.00 -1.74 0.00 0.00 68.15 68.16 2x65 h THR 121 CO -0.45 0.29 0.51 0.58 0.37 0.00 0.00 175.52 176.82 2x65 h VAL 122 N 0.20 1.03 -0.45 3.16 2.07 -1.11 -1.12 116.25 120.03 2x65 h VAL 122 Ca 0.07 -0.32 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 2x65 h VAL 122 Cb 0.43 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 2x65 h VAL 122 CO 0.01 0.17 0.14 0.11 0.02 0.00 0.00 177.57 178.02 2x65 h LYS 123 N 0.94 0.66 -0.43 1.57 1.57 -0.84 0.46 116.57 120.50 2x65 h LYS 123 Ca 0.36 -0.11 -0.14 0.00 -1.87 0.00 0.00 60.65 58.90 2x65 h LYS 123 Cb 0.17 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 2x65 h LYS 123 CO -0.17 0.58 -0.28 -0.22 -0.57 0.00 0.00 179.45 178.78 2x65 h LYS 124 N 0.65 0.93 -0.43 3.15 3.64 -0.93 -1.78 116.57 121.80 2x65 h LYS 124 Ca 0.15 -0.43 -0.11 0.00 -1.27 0.00 0.00 60.65 59.00 2x65 h LYS 124 Cb 0.20 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 2x65 h LYS 124 CO -0.01 1.08 -0.17 0.00 -2.27 0.00 0.00 179.45 178.09 2x65 h ALA 125 N 0.88 0.90 -0.13 5.00 0.00 -0.70 -1.34 119.26 123.88 2x65 h ALA 125 Ca 0.09 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2x65 h ALA 125 Cb 0.86 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2x65 h ALA 125 CO 0.08 0.63 0.05 -0.07 0.00 0.00 0.00 179.25 179.93 2x65 h LEU 126 N 0.72 0.17 -0.65 0.00 3.38 -0.70 0.40 115.31 118.63 2x65 h LEU 126 Ca 0.11 -0.16 0.04 0.00 0.09 0.00 0.00 57.88 57.95 2x65 h LEU 126 Cb 0.68 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.34 2x65 h LEU 126 CO 0.05 0.29 0.39 -0.78 0.09 0.00 0.00 178.44 178.48 2x65 h ASP 127 N 0.05 0.62 -0.53 -0.43 3.58 -1.24 -1.59 116.42 116.88 2x65 h ASP 127 Ca 0.04 0.01 -0.11 0.00 0.42 0.00 0.00 57.03 57.39 2x65 h ASP 127 Cb 0.17 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.08 2x65 h ASP 127 CO -0.00 0.42 -0.10 0.00 -2.88 0.00 0.00 179.24 176.68 2x65 h ALA 128 N 1.30 0.79 -0.98 -0.78 0.00 -0.94 -2.68 119.26 115.97 2x65 h ALA 128 Ca 0.27 -0.35 0.11 0.00 0.00 0.00 0.00 54.91 54.94 2x65 h ALA 128 Cb 0.07 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 17.58 2x65 h ALA 128 CO -0.13 0.67 0.61 1.25 0.00 0.00 0.00 179.25 181.66 2x65 h LEU 129 N 0.90 0.91 -1.08 0.00 5.85 0.47 -0.25 115.31 122.11 2x65 h LEU 129 Ca 0.14 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.87 2x65 h LEU 129 Cb 0.67 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.53 2x65 h LEU 129 CO 0.05 0.50 0.22 -0.33 -0.34 0.00 0.00 178.44 178.54 2x65 h GLU 130 N 0.99 0.88 0.09 1.25 4.39 -0.98 -1.14 114.58 120.06 2x65 h GLU 130 Ca 0.48 -0.14 -0.14 0.00 0.34 0.00 0.00 59.36 59.90 2x65 h GLU 130 Cb 0.44 -0.15 0.01 0.00 -0.10 0.00 0.00 28.75 28.95 2x65 h GLU 130 CO -0.25 0.73 -0.63 0.87 -1.16 0.00 0.00 179.01 178.57 2x65 h LYS 131 N 0.86 0.20 0.00 2.33 1.57 -1.11 -3.41 116.57 117.01 2x65 h LYS 131 Ca 0.20 -0.34 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 2x65 h LYS 131 Cb 0.19 0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2x65 h LYS 131 CO -0.02 1.16 -1.01 0.66 -0.57 0.00 0.00 179.45 179.67 2x65 n TYR 132 N -4.26 0.00 -4.76 -1.35 4.01 -0.20 -5.10 117.16 105.50 2x65 n TYR 132 Ca -0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.60 2x65 n TYR 132 Cb 0.72 -0.13 0.00 0.00 -0.31 0.00 0.00 39.34 39.63 2x65 n TYR 132 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2x65 n ASP 133 N -1.57 -3.57 0.00 7.72 8.00 -0.43 -5.03 116.55 121.66 2x65 n ASP 133 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2x65 n ASP 133 Cb 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 2x65 n ASP 133 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2x65 n GLY 134 N 0.00 -2.54 3.48 0.44 0.00 -1.26 -4.83 105.19 100.49 2x65 n GLY 134 Ca 0.00 -1.94 -0.35 0.00 0.00 0.00 0.00 46.02 43.72 2x65 n GLY 134 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x65 s LEU 135 N 0.00 3.44 -0.15 0.99 1.43 0.38 -4.62 118.68 120.15 2x65 s LEU 135 Ca 0.00 -0.15 -0.07 0.00 -1.03 0.00 0.00 54.13 52.87 2x65 s LEU 135 Cb 0.00 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 2x65 s LEU 135 CO 0.00 0.04 0.11 -0.36 0.23 0.00 0.00 176.35 176.37 2x65 s PHE 136 N 1.15 3.44 0.39 0.29 0.40 -0.06 -0.08 117.98 123.51 2x65 s PHE 136 Ca 0.04 0.36 0.08 0.00 -0.60 0.00 0.00 56.93 56.81 2x65 s PHE 136 Cb -0.14 -2.01 -0.06 0.00 0.51 0.00 0.00 43.02 41.31 2x65 s PHE 136 CO 0.03 0.49 0.05 0.95 0.70 0.00 0.00 175.22 177.43 2x65 s THR 137 N -0.38 2.25 -0.17 0.64 -4.23 0.42 -1.44 115.64 112.74 2x65 s THR 137 Ca 0.11 -1.92 -0.00 0.00 -1.18 0.00 0.00 61.69 58.69 2x65 s THR 137 Cb -0.12 -2.92 0.04 0.00 1.34 0.00 0.00 72.50 70.84 2x65 s THR 137 CO 0.01 -0.06 -0.06 -0.36 -0.54 0.00 0.00 174.62 173.62 2x65 s PHE 138 N -2.63 1.75 -0.12 3.99 0.40 -1.25 -2.04 117.98 118.08 2x65 s PHE 138 Ca 0.37 -1.11 -0.08 0.00 -0.60 0.00 0.00 56.93 55.50 2x65 s PHE 138 Cb 0.05 -1.34 -0.04 0.00 0.51 0.00 0.00 43.02 42.20 2x65 s PHE 138 CO 0.20 -0.62 0.16 0.20 0.70 0.00 0.00 175.22 175.85 2x65 s GLY 139 N 1.62 2.17 0.04 4.36 0.00 0.13 -1.86 107.32 113.78 2x65 s GLY 139 Ca 0.01 -0.61 0.03 0.00 0.00 0.00 0.00 44.72 44.15 2x65 s GLY 139 CO -0.08 -0.26 -0.00 -0.42 0.00 0.00 0.00 173.10 172.33 2x65 s ILE 140 N -0.85 4.06 -0.09 0.90 -1.09 -0.60 -1.47 121.20 122.06 2x65 s ILE 140 Ca 0.15 -0.79 -0.30 0.00 -2.23 0.00 0.00 60.65 57.48 2x65 s ILE 140 Cb -0.12 -2.86 -0.03 0.00 -1.58 0.00 0.00 42.46 37.86 2x65 s ILE 140 CO 0.04 0.26 1.39 -0.69 -1.23 0.00 0.00 174.94 174.71 2x65 s VAL 141 N -1.19 3.97 0.12 2.92 1.01 -1.26 -0.84 120.40 125.13 2x65 s VAL 141 Ca 0.22 1.23 -0.30 0.00 0.00 0.00 0.00 61.98 63.13 2x65 s VAL 141 Cb -0.12 -3.79 -0.07 0.00 0.00 0.00 0.00 36.38 32.41 2x65 s VAL 141 CO 0.14 -0.08 1.15 -2.16 0.00 0.00 0.00 175.10 174.15 2x65 s PRO 142 N 3.33 4.51 -0.00 2.72 0.04 -1.26 -4.88 135.00 139.44 2x65 s PRO 142 Ca 0.62 1.75 0.14 0.00 0.04 0.00 0.00 61.00 63.55 2x65 s PRO 142 Cb -0.27 -3.31 -0.17 0.00 0.04 0.00 0.00 34.50 30.79 2x65 s PRO 142 CO 0.22 -0.10 0.54 0.25 0.04 0.00 0.00 177.00 177.95 2x65 n THR 143 N 3.15 0.00 -3.84 1.26 -2.24 -1.26 -5.04 114.28 106.32 2x65 n THR 143 Ca 0.06 -0.20 -0.09 0.00 -2.27 0.00 0.00 64.05 61.55 2x65 n THR 143 Cb 0.46 0.84 -0.07 0.00 -2.10 0.00 0.00 70.33 69.46 2x65 n THR 143 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2x65 s ARG 144 N -2.45 0.92 -1.45 -0.78 1.70 -1.26 -5.06 118.95 110.56 2x65 s ARG 144 Ca 0.03 -0.95 -0.12 0.00 -0.47 0.00 0.00 55.73 54.22 2x65 s ARG 144 Cb 0.10 0.37 -0.04 0.00 -0.57 0.00 0.00 34.95 34.81 2x65 s ARG 144 CO 0.58 -0.31 2.56 -0.35 -1.08 0.00 0.00 175.30 176.70 2x65 n PRO 145 N -0.11 3.12 -2.17 3.89 -0.04 -1.26 -4.96 135.00 133.47 2x65 n PRO 145 Ca -0.14 -2.27 -0.42 0.00 -0.04 0.00 0.00 63.50 60.63 2x65 n PRO 145 Cb 0.63 -2.96 -0.03 0.00 -0.04 0.00 0.00 33.50 31.10 2x65 n PRO 145 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2x65 s GLU 146 N 2.83 4.33 0.00 0.54 2.56 -1.26 -4.81 118.70 122.89 2x65 s GLU 146 Ca 0.58 2.08 0.22 0.00 0.00 0.00 0.00 54.97 57.84 2x65 s GLU 146 Cb 0.16 -3.24 -0.07 0.00 2.00 0.00 0.00 34.13 32.98 2x65 s GLU 146 CO -0.06 -0.41 1.01 0.25 -0.56 0.00 0.00 175.26 175.50 2x65 n THR 147 N 3.70 0.00 1.23 -1.70 -2.24 -1.26 -4.12 114.28 109.90 2x65 n THR 147 Ca 0.10 -0.20 0.13 0.00 -2.27 0.00 0.00 64.05 61.81 2x65 n THR 147 Cb 0.42 1.19 0.30 0.00 -2.10 0.00 0.00 70.33 70.14 2x65 n THR 147 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x65 n GLY 148 N 1.42 0.49 3.97 3.38 0.00 -1.26 -4.15 105.19 109.05 2x65 n GLY 148 Ca 0.08 -0.57 -0.21 0.00 0.00 0.00 0.00 46.02 45.32 2x65 n GLY 148 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2x65 s TYR 149 N -2.02 3.23 0.25 1.61 2.02 -1.26 -4.77 117.35 116.41 2x65 s TYR 149 Ca 0.32 0.00 -0.13 0.00 -0.37 0.00 0.00 57.07 56.90 2x65 s TYR 149 Cb 0.20 -2.02 -0.08 0.00 -0.40 0.00 0.00 41.96 39.66 2x65 s TYR 149 CO 0.33 -0.04 0.63 0.20 -1.57 0.00 0.00 175.55 175.10 2x65 s GLY 150 N -4.15 2.35 -0.09 0.71 0.00 -1.26 -0.88 107.32 104.00 2x65 s GLY 150 Ca 0.44 -0.11 0.03 0.00 0.00 0.00 0.00 44.72 45.08 2x65 s GLY 150 CO 0.33 0.09 -0.18 -0.19 0.00 0.00 0.00 173.10 173.15 2x65 s TYR 151 N -1.81 2.66 -0.29 1.90 1.51 0.16 -0.42 117.35 121.06 2x65 s TYR 151 Ca 0.48 -0.67 -0.06 0.00 -1.01 0.00 0.00 57.07 55.81 2x65 s TYR 151 Cb -0.12 -1.73 0.01 0.00 -0.11 0.00 0.00 41.96 40.02 2x65 s TYR 151 CO 0.19 -0.20 0.06 0.42 -1.11 0.00 0.00 175.55 174.92 2x65 s ILE 152 N 0.07 3.79 -0.17 2.71 1.01 0.48 -0.23 121.20 128.85 2x65 s ILE 152 Ca -0.08 -0.75 -0.29 0.00 0.00 0.00 0.00 60.65 59.54 2x65 s ILE 152 Cb -0.15 -2.95 -0.00 0.00 0.01 0.00 0.00 42.46 39.37 2x65 s ILE 152 CO 0.05 0.10 1.05 -0.70 0.00 0.00 0.00 174.94 175.45 2x65 s GLU 153 N 1.47 4.32 0.02 2.79 2.12 0.18 -1.33 118.70 128.27 2x65 s GLU 153 Ca 0.02 1.41 -0.30 0.00 0.36 0.00 0.00 54.97 56.46 2x65 s GLU 153 Cb -0.17 -3.61 -0.07 0.00 0.26 0.00 0.00 34.13 30.54 2x65 s GLU 153 CO 0.01 -0.52 1.53 0.42 -0.54 0.00 0.00 175.26 176.17 2x65 s ILE 154 N 2.76 3.41 0.00 -3.70 1.01 0.36 -1.35 121.20 123.69 2x65 s ILE 154 Ca 0.47 0.80 0.00 0.00 0.00 0.00 0.00 60.65 61.91 2x65 s ILE 154 Cb -0.17 -3.51 0.00 0.00 0.01 0.00 0.00 42.46 38.79 2x65 s ILE 154 CO 0.12 -0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.66 2x65 n GLY 155 N 3.85 2.74 3.77 6.18 0.00 0.17 -4.58 105.19 117.31 2x65 n GLY 155 Ca 0.15 -1.88 -0.41 0.00 0.00 0.00 0.00 46.02 43.88 2x65 n GLY 155 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2x65 s GLU 156 N 3.46 4.22 -0.30 1.61 2.12 -1.26 -4.45 118.70 124.11 2x65 s GLU 156 Ca 0.00 2.40 -0.28 0.00 0.36 0.00 0.00 54.97 57.45 2x65 s GLU 156 Cb 0.00 -3.03 -0.03 0.00 0.26 0.00 0.00 34.13 31.33 2x65 s GLU 156 CO 0.00 -0.40 1.91 -2.00 -0.54 0.00 0.00 175.26 174.23 2x65 s GLU 157 N -1.54 3.29 -0.02 4.30 2.12 -1.26 -0.59 118.70 125.00 2x65 s GLU 157 Ca 0.54 1.60 -0.24 0.00 0.36 0.00 0.00 54.97 57.23 2x65 s GLU 157 Cb -0.44 -4.24 -0.20 0.00 0.26 0.00 0.00 34.13 29.51 2x65 s GLU 157 CO 0.55 -1.92 1.18 -0.07 -0.54 0.00 0.00 175.26 174.47 2x65 h LEU 158 N 14.03 0.16 -8.24 2.70 3.38 -1.33 -3.47 115.31 122.55 2x65 h LEU 158 Ca -0.36 -0.60 -0.06 0.00 0.09 0.00 0.00 57.88 56.94 2x65 h LEU 158 Cb 1.19 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.81 2x65 h LEU 158 CO 1.01 0.74 -0.08 -1.83 0.09 0.00 0.00 178.44 178.37 2x65 s GLU 159 N -3.80 1.63 -0.02 1.13 -1.05 -1.10 -5.04 118.70 110.45 2x65 s GLU 159 Ca -0.16 -1.29 -0.39 0.00 -0.15 0.00 0.00 54.97 52.99 2x65 s GLU 159 Cb 0.02 0.49 -0.18 0.00 -0.44 0.00 0.00 34.13 34.02 2x65 s GLU 159 CO 0.72 -0.69 1.35 -1.91 0.95 0.00 0.00 175.26 175.67 2x65 n GLU 160 N -0.41 0.80 0.00 -4.83 0.00 -1.26 -0.77 120.64 114.17 2x65 n GLU 160 Ca -0.02 0.29 0.00 0.00 0.00 0.00 0.00 57.16 57.43 2x65 n GLU 160 Cb 0.62 -1.90 0.00 0.00 0.00 0.00 0.00 31.44 30.16 2x65 n GLU 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2x65 n GLY 161 N 2.60 1.99 2.93 8.31 0.00 -1.26 -5.00 105.19 114.76 2x65 n GLY 161 Ca 0.21 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.99 2x65 n GLY 161 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x65 s VAL 162 N -2.45 0.86 0.14 1.61 1.01 0.05 -3.81 120.40 117.80 2x65 s VAL 162 Ca 0.00 -0.27 0.07 0.00 0.00 0.00 0.00 61.98 61.78 2x65 s VAL 162 Cb 0.00 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 2x65 s VAL 162 CO 0.00 0.31 -0.16 -1.00 0.00 0.00 0.00 175.10 174.25 2x65 s HIS 163 N 1.10 1.58 0.82 5.22 3.76 -0.39 -0.87 115.29 126.51 2x65 s HIS 163 Ca -0.07 -0.51 -0.11 0.00 -0.15 0.00 0.00 55.06 54.22 2x65 s HIS 163 Cb -0.14 -0.81 0.08 0.00 1.11 0.00 0.00 32.58 32.82 2x65 s HIS 163 CO -0.01 0.22 1.09 0.15 -0.85 0.00 0.00 174.74 175.34 2x65 s LYS 164 N -2.65 1.89 -0.37 1.40 1.02 0.25 -0.88 119.74 120.40 2x65 s LYS 164 Ca 0.11 0.93 -0.06 0.00 0.02 0.00 0.00 55.97 56.97 2x65 s LYS 164 Cb -0.06 -1.87 0.06 0.00 -0.52 0.00 0.00 37.83 35.44 2x65 s LYS 164 CO 0.04 -1.84 0.15 0.08 -0.92 0.00 0.00 175.35 172.87 2x65 s VAL 165 N -2.96 3.78 0.29 3.17 1.01 -0.60 0.46 120.40 125.55 2x65 s VAL 165 Ca 0.62 -1.34 0.00 0.00 0.00 0.00 0.00 61.98 61.26 2x65 s VAL 165 Cb -0.17 -3.24 0.28 0.00 0.00 0.00 0.00 36.38 33.25 2x65 s VAL 165 CO 0.56 -0.33 1.90 0.00 0.00 0.00 0.00 175.10 177.24 2x65 h ALA 166 N 8.23 1.49 -2.09 5.51 0.00 -1.46 -3.45 119.26 127.50 2x65 h ALA 166 Ca -0.22 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.70 2x65 h ALA 166 Cb 1.08 -0.28 -0.18 0.00 0.00 0.00 0.00 17.79 18.41 2x65 h ALA 166 CO 0.65 0.37 0.37 1.14 0.00 0.00 0.00 179.25 181.78 2x65 s GLN 167 N -5.93 0.90 -0.17 0.00 -2.07 -1.25 -4.99 119.66 106.16 2x65 s GLN 167 Ca -0.12 -0.02 0.01 0.00 -1.82 0.00 0.00 55.36 53.42 2x65 s GLN 167 Cb 0.20 0.42 0.02 0.00 -1.09 0.00 0.00 33.01 32.56 2x65 s GLN 167 CO 0.80 -0.33 -0.20 0.12 -1.32 0.00 0.00 175.29 174.37 2x65 s PHE 168 N -2.00 2.68 -0.21 9.60 2.19 -1.26 0.48 117.98 129.46 2x65 s PHE 168 Ca -0.03 -1.54 0.01 0.00 0.33 0.00 0.00 56.93 55.70 2x65 s PHE 168 Cb -0.01 -1.86 0.04 0.00 -1.31 0.00 0.00 43.02 39.89 2x65 s PHE 168 CO -0.00 -0.76 -0.11 0.50 1.83 0.00 0.00 175.22 176.68 2x65 s ARG 169 N 1.22 2.17 -0.22 10.12 6.06 0.68 -4.46 118.95 134.52 2x65 s ARG 169 Ca 0.03 -0.93 -0.18 0.00 -2.50 0.00 0.00 55.73 52.15 2x65 s ARG 169 Cb -0.13 -2.51 -0.03 0.00 0.06 0.00 0.00 34.95 32.33 2x65 s ARG 169 CO -0.11 -0.43 0.50 -2.00 -2.50 0.00 0.00 175.30 170.76 2x65 s GLU 170 N 1.34 4.14 -0.92 5.12 2.56 -1.26 0.36 118.70 130.04 2x65 s GLU 170 Ca -0.02 0.34 -0.08 0.00 0.00 0.00 0.00 54.97 55.22 2x65 s GLU 170 Cb -0.16 -3.59 -0.01 0.00 2.00 0.00 0.00 34.13 32.36 2x65 s GLU 170 CO -0.08 -0.20 0.74 1.63 -0.56 0.00 0.00 175.26 176.78 2x65 n LYS 171 N 5.00 -1.44 -1.65 4.30 5.02 -0.06 -4.94 118.16 124.39 2x65 n LYS 171 Ca -0.05 0.93 -0.32 0.00 -2.02 0.00 0.00 58.31 56.84 2x65 n LYS 171 Cb 0.50 -4.50 0.05 0.00 -0.02 0.00 0.00 35.03 31.07 2x65 n LYS 171 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2x65 s PRO 172 N -4.55 2.76 0.96 1.97 0.04 -1.26 -4.97 135.00 129.96 2x65 s PRO 172 Ca 0.21 1.25 -0.11 0.00 0.04 0.00 0.00 61.00 62.39 2x65 s PRO 172 Cb -0.06 -1.95 0.17 0.00 0.04 0.00 0.00 34.50 32.69 2x65 s PRO 172 CO 0.82 -1.26 1.09 0.16 0.04 0.00 0.00 177.00 177.85 2x65 s ASP 173 N -2.96 2.74 0.13 6.66 3.84 -1.26 -4.62 116.67 121.20 2x65 s ASP 173 Ca 0.64 1.75 -0.24 0.00 -0.00 0.00 0.00 52.55 54.71 2x65 s ASP 173 Cb -0.18 -2.37 -0.04 0.00 -1.38 0.00 0.00 42.92 38.96 2x65 s ASP 173 CO 0.46 -3.14 1.66 0.25 -0.00 0.00 0.00 175.17 174.40 2x65 h LEU 174 N -1.89 -0.56 -0.80 2.11 5.85 -1.96 -0.66 115.31 117.40 2x65 h LEU 174 Ca -0.50 0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.26 2x65 h LEU 174 Cb 1.29 0.25 -0.03 0.00 0.37 0.00 0.00 40.66 42.53 2x65 h LEU 174 CO 0.49 -0.24 0.29 -0.33 -0.34 0.00 0.00 178.44 178.31 2x65 h GLU 175 N -0.27 1.18 -0.32 1.25 4.39 -1.96 0.67 114.58 119.52 2x65 h GLU 175 Ca 0.08 -0.23 0.01 0.00 0.34 0.00 0.00 59.36 59.56 2x65 h GLU 175 Cb 0.38 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.82 2x65 h GLU 175 CO -0.22 0.97 0.20 1.15 -1.16 0.00 0.00 179.01 179.94 2x65 h THR 176 N 1.15 1.05 -0.77 1.13 2.02 -1.84 -2.61 112.91 113.04 2x65 h THR 176 Ca 0.26 -0.14 -0.02 0.00 0.77 0.00 0.00 66.41 67.28 2x65 h THR 176 Cb 0.24 0.62 -0.04 0.00 -1.74 0.00 0.00 68.15 67.24 2x65 h THR 176 CO -0.02 0.07 0.41 0.00 0.37 0.00 0.00 175.52 176.36 2x65 h ALA 177 N 1.13 1.27 -0.07 6.16 0.00 -0.26 -1.07 119.26 126.41 2x65 h ALA 177 Ca 0.12 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2x65 h ALA 177 Cb -0.02 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 2x65 h ALA 177 CO -0.05 0.59 -0.09 0.87 0.00 0.00 0.00 179.25 180.57 2x65 h LYS 178 N 1.08 -0.11 -0.44 0.00 1.57 -0.79 -2.04 116.57 115.84 2x65 h LYS 178 Ca 0.27 0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 59.00 2x65 h LYS 178 Cb 0.04 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 2x65 h LYS 178 CO -0.04 -0.07 0.02 0.87 -0.57 0.00 0.00 179.45 179.66 2x65 h LYS 179 N -0.11 0.70 0.43 3.15 1.57 -1.03 -0.84 116.57 120.44 2x65 h LYS 179 Ca 0.06 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 2x65 h LYS 179 Cb 0.20 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.42 2x65 h LYS 179 CO -0.14 0.70 -0.22 0.74 -0.57 0.00 0.00 179.45 179.96 2x65 h PHE 180 N 0.66 -0.58 -0.63 -1.35 0.04 -1.06 -1.75 116.94 112.28 2x65 h PHE 180 Ca 0.14 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.89 2x65 h PHE 180 Cb 0.38 0.20 -0.03 0.00 2.20 0.00 0.00 35.95 38.69 2x65 h PHE 180 CO 0.02 -0.35 0.35 0.28 -0.60 0.00 0.00 178.31 178.00 2x65 h VAL 181 N -0.60 1.19 0.00 -0.55 2.07 -1.05 -2.42 116.25 114.88 2x65 h VAL 181 Ca -0.06 -0.45 -0.07 0.00 0.82 0.00 0.00 66.70 66.94 2x65 h VAL 181 Cb 0.47 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2x65 h VAL 181 CO 0.08 0.20 -0.33 -0.08 0.02 0.00 0.00 177.57 177.47 2x65 h GLU 182 N 0.87 0.00 -0.05 1.57 4.81 -1.05 -3.15 114.58 117.58 2x65 h GLU 182 Ca 0.22 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.30 2x65 h GLU 182 Cb 0.01 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 2x65 h GLU 182 CO -0.04 0.33 -0.64 0.66 -0.73 0.00 0.00 179.01 178.59 2x65 h SER 183 N 0.00 0.22 0.00 1.04 4.64 -0.79 -3.48 113.55 115.18 2x65 h SER 183 Ca -0.00 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 2x65 h SER 183 Cb 0.99 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 2x65 h SER 183 CO 0.04 0.80 0.00 0.61 -0.87 0.00 0.00 176.83 177.42 2x65 n GLY 184 N 0.34 0.60 1.07 -0.77 0.00 -1.19 -4.91 105.19 100.33 2x65 n GLY 184 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.11 2x65 n GLY 184 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x65 n ARG 185 N -2.80 2.39 -4.29 1.61 1.74 -1.26 -4.98 116.66 109.07 2x65 n ARG 185 Ca 0.00 -2.15 -0.24 0.00 -0.77 0.00 0.00 57.85 54.69 2x65 n ARG 185 Cb 0.00 -1.48 -0.12 0.00 -1.02 0.00 0.00 32.46 29.83 2x65 n ARG 185 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2x65 s PHE 186 N -1.58 1.80 0.21 -1.55 0.40 -1.26 -0.49 117.98 115.51 2x65 s PHE 186 Ca 0.34 -0.42 0.11 0.00 -0.60 0.00 0.00 56.93 56.37 2x65 s PHE 186 Cb 0.21 -0.98 -0.05 0.00 0.51 0.00 0.00 43.02 42.71 2x65 s PHE 186 CO 0.30 0.21 -0.21 -0.51 0.70 0.00 0.00 175.22 175.71 2x65 s LEU 187 N -1.94 2.54 0.25 -0.37 1.43 -0.44 -4.53 118.68 115.61 2x65 s LEU 187 Ca 0.07 -0.87 -0.30 0.00 -1.03 0.00 0.00 54.13 52.00 2x65 s LEU 187 Cb -0.10 -1.22 -0.09 0.00 0.03 0.00 0.00 46.19 44.81 2x65 s LEU 187 CO 0.04 0.10 1.03 0.26 0.23 0.00 0.00 176.35 178.02 2x65 s TRP 188 N -1.86 3.74 -0.04 0.29 0.51 -0.02 -0.39 118.94 121.18 2x65 s TRP 188 Ca 0.23 1.78 -0.30 0.00 -2.12 0.00 0.00 56.10 55.69 2x65 s TRP 188 Cb -0.07 -3.16 -0.05 0.00 -0.81 0.00 0.00 33.47 29.38 2x65 s TRP 188 CO 0.12 -0.15 1.37 1.21 -0.51 0.00 0.00 176.95 178.99 2x65 s ASN 189 N -0.92 6.88 0.00 2.95 2.47 0.44 -1.56 114.94 125.20 2x65 s ASN 189 Ca 0.44 2.02 0.29 0.00 0.42 0.00 0.00 52.86 56.03 2x65 s ASN 189 Cb -0.29 -2.55 1.34 0.00 -1.45 0.00 0.00 41.25 38.29 2x65 s ASN 189 CO 0.37 -0.72 1.95 -1.54 -3.72 0.00 0.00 177.10 173.43 2x65 n SER 190 N 5.67 0.15 0.00 -4.21 3.41 -0.78 -4.58 113.62 113.28 2x65 n SER 190 Ca 0.13 -0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 2x65 n SER 190 Cb 0.44 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 2x65 n SER 190 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2x65 n GLY 191 N 1.34 0.80 3.75 5.00 0.00 -1.26 -4.99 105.19 109.82 2x65 n GLY 191 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 2x65 n GLY 191 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2x65 s MET 192 N -0.35 2.77 0.10 1.61 0.23 -1.26 -4.47 119.30 117.93 2x65 s MET 192 Ca 0.00 -0.80 0.02 0.00 -1.03 0.00 0.00 55.69 53.88 2x65 s MET 192 Cb 0.00 -2.63 -0.04 0.00 -1.53 0.00 0.00 34.83 30.62 2x65 s MET 192 CO 0.00 0.53 -0.07 -0.06 -2.03 0.00 0.00 175.02 173.39 2x65 s PHE 193 N -1.48 0.91 -0.03 3.16 0.08 -0.45 -3.96 117.98 116.22 2x65 s PHE 193 Ca 0.29 -0.89 0.00 0.00 0.12 0.00 0.00 56.93 56.45 2x65 s PHE 193 Cb -0.11 -0.52 0.03 0.00 -0.57 0.00 0.00 43.02 41.84 2x65 s PHE 193 CO 0.21 -0.13 0.01 -1.17 -0.10 0.00 0.00 175.22 174.04 2x65 s LEU 194 N -3.02 1.15 0.14 -0.37 2.96 -0.52 -0.25 118.68 118.77 2x65 s LEU 194 Ca 0.12 -0.01 -0.20 0.00 -0.22 0.00 0.00 54.13 53.82 2x65 s LEU 194 Cb 0.05 -0.18 0.05 0.00 0.50 0.00 0.00 46.19 46.61 2x65 s LEU 194 CO -0.04 -0.11 0.51 -1.66 -1.32 0.00 0.00 176.35 173.73 2x65 s TRP 195 N 1.03 -0.39 0.15 5.38 -2.14 -0.96 -0.89 118.94 121.11 2x65 s TRP 195 Ca -0.10 0.15 -0.30 0.00 2.66 0.00 0.00 56.10 58.51 2x65 s TRP 195 Cb -0.13 0.42 -0.07 0.00 -3.10 0.00 0.00 33.47 30.59 2x65 s TRP 195 CO -0.02 -0.78 1.03 0.15 -2.66 0.00 0.00 176.95 174.67 2x65 s LYS 196 N -3.72 4.65 0.15 3.25 1.02 -1.26 0.42 119.74 124.25 2x65 s LYS 196 Ca 0.02 1.59 -0.29 0.00 0.02 0.00 0.00 55.97 57.31 2x65 s LYS 196 Cb 0.00 -3.32 -0.03 0.00 -0.52 0.00 0.00 37.83 33.96 2x65 s LYS 196 CO -0.12 0.15 1.56 0.00 -0.92 0.00 0.00 175.35 176.03 2x65 h ALA 197 N 5.28 -0.52 -0.62 5.17 0.00 -1.17 -1.93 119.26 125.48 2x65 h ALA 197 Ca -0.44 0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.60 2x65 h ALA 197 Cb 1.21 1.01 -0.06 0.00 0.00 0.00 0.00 17.79 19.95 2x65 h ALA 197 CO 0.72 -0.92 0.31 -0.09 0.00 0.00 0.00 179.25 179.27 2x65 h ARG 198 N -0.31 0.55 -0.66 0.00 2.43 -1.36 -1.44 114.38 113.58 2x65 h ARG 198 Ca 0.13 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 2x65 h ARG 198 Cb 0.58 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.98 2x65 h ARG 198 CO -0.63 0.36 0.20 1.49 -1.51 0.00 0.00 179.97 179.88 2x65 h GLU 199 N 0.57 1.02 -0.33 0.20 4.81 -1.58 -1.27 114.58 118.00 2x65 h GLU 199 Ca 0.29 -0.21 -0.15 0.00 -0.13 0.00 0.00 59.36 59.15 2x65 h GLU 199 Cb 0.24 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 2x65 h GLU 199 CO -0.21 0.88 -0.41 0.35 -0.73 0.00 0.00 179.01 178.89 2x65 h PHE 200 N 0.98 0.98 -0.30 0.92 3.57 -1.10 -1.95 116.94 120.04 2x65 h PHE 200 Ca 0.22 -0.30 0.02 0.00 3.53 0.00 0.00 57.97 61.44 2x65 h PHE 200 Cb 0.29 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 2x65 h PHE 200 CO 0.02 1.08 0.15 0.82 -2.23 0.00 0.00 178.31 178.16 2x65 h ILE 201 N 0.66 1.00 -0.37 1.41 2.04 -0.82 -0.96 117.51 120.46 2x65 h ILE 201 Ca 0.05 -0.11 -0.07 0.00 1.00 0.00 0.00 64.86 65.73 2x65 h ILE 201 Cb 0.98 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.70 2x65 h ILE 201 CO 0.09 0.06 -0.05 -0.33 0.00 0.00 0.00 178.15 177.92 2x65 h GLU 202 N 0.32 0.60 -0.04 2.37 4.39 -1.22 -1.53 114.58 119.46 2x65 h GLU 202 Ca 0.12 -0.15 -0.06 0.00 0.34 0.00 0.00 59.36 59.61 2x65 h GLU 202 Cb 0.03 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 2x65 h GLU 202 CO -0.08 0.66 -0.24 0.93 -1.16 0.00 0.00 179.01 179.12 2x65 h GLU 203 N 0.56 0.07 -0.21 2.33 4.39 -0.83 -2.01 114.58 118.88 2x65 h GLU 203 Ca 0.11 -0.02 -0.17 0.00 0.34 0.00 0.00 59.36 59.62 2x65 h GLU 203 Cb 0.43 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.08 2x65 h GLU 203 CO 0.02 0.31 -0.55 0.28 -1.16 0.00 0.00 179.01 177.91 2x65 h VAL 204 N 0.06 1.30 -0.21 3.13 2.07 -0.55 0.12 116.25 122.17 2x65 h VAL 204 Ca 0.01 -1.77 0.04 0.00 0.82 0.00 0.00 66.70 65.80 2x65 h VAL 204 Cb 0.47 1.85 -0.07 0.00 -1.52 0.00 0.00 31.29 32.02 2x65 h VAL 204 CO 0.03 0.56 -0.54 0.50 0.02 0.00 0.00 177.57 178.14 2x65 h LYS 205 N 0.46 -0.51 0.60 1.57 3.64 -0.84 0.68 116.57 122.18 2x65 h LYS 205 Ca -0.01 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 2x65 h LYS 205 Cb 1.17 0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 33.11 2x65 h LYS 205 CO 0.12 -0.34 -0.35 0.28 -2.27 0.00 0.00 179.45 176.89 2x65 h VAL 206 N -0.53 0.00 -0.75 2.00 2.07 -1.41 -3.23 116.25 114.40 2x65 h VAL 206 Ca 0.05 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.51 2x65 h VAL 206 Cb 0.66 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 2x65 h VAL 206 CO -0.48 0.00 0.24 0.00 0.02 0.00 0.00 177.57 177.35 2x65 s GLU 208 N -5.42 0.92 0.48 0.00 2.56 0.24 -4.89 118.70 112.58 2x65 s GLU 208 Ca -0.12 -1.32 0.15 0.00 0.00 0.00 0.00 54.97 53.68 2x65 s GLU 208 Cb 0.15 -0.61 1.12 0.00 2.00 0.00 0.00 34.13 36.79 2x65 s GLU 208 CO 0.84 -1.31 2.06 -1.00 -0.56 0.00 0.00 175.26 175.29 2x65 h PRO 209 N 5.73 0.01 -0.67 4.30 0.13 -1.56 -2.74 132.00 137.20 2x65 h PRO 209 Ca 0.13 -0.00 0.07 0.00 -0.87 0.00 0.00 66.00 65.33 2x65 h PRO 209 Cb 1.04 -0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.13 2x65 h PRO 209 CO 0.17 0.10 0.44 0.66 -0.23 0.00 0.00 178.00 179.15 2x65 h SER 210 N 0.01 0.56 0.05 1.44 4.64 -1.90 0.39 113.55 118.74 2x65 h SER 210 Ca 0.00 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2x65 h SER 210 Cb 0.17 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 2x65 h SER 210 CO 0.01 0.35 -0.02 0.40 -0.87 0.00 0.00 176.83 176.70 2x65 h ILE 211 N 0.63 1.32 0.12 0.95 2.04 -1.84 -3.32 117.51 117.42 2x65 h ILE 211 Ca 0.30 -1.44 -0.01 0.00 1.00 0.00 0.00 64.86 64.72 2x65 h ILE 211 Cb 0.35 2.24 0.00 0.00 -0.74 0.00 0.00 36.82 38.66 2x65 h ILE 211 CO -0.10 0.35 -0.06 0.22 0.00 0.00 0.00 178.15 178.56 2x65 h TYR 212 N -0.73 -0.15 0.00 1.37 5.03 -1.30 -1.71 116.97 119.48 2x65 h TYR 212 Ca -0.01 -0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.27 2x65 h TYR 212 Cb 0.62 0.05 -0.00 0.00 1.55 0.00 0.00 36.73 38.95 2x65 h TYR 212 CO 0.14 -0.01 -0.12 0.93 -1.32 0.00 0.00 178.16 177.78 2x65 h GLU 213 N -0.26 0.00 0.00 1.82 4.39 -1.15 0.04 114.58 119.42 2x65 h GLU 213 Ca -0.02 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.51 2x65 h GLU 213 Cb 0.21 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.83 2x65 h GLU 213 CO 0.03 0.12 -1.18 -0.91 -1.16 0.00 0.00 179.01 175.91 2x65 h ASN 214 N 0.00 0.00 0.00 1.42 2.35 -1.61 -3.39 115.58 114.34 2x65 h ASN 214 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2x65 h ASN 214 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 2x65 h ASN 214 CO 0.02 0.66 -1.40 0.18 -1.65 0.00 0.00 177.43 175.23 2x65 n LEU 215 N -3.04 0.24 -0.32 1.61 4.77 -0.66 -4.66 117.00 114.94 2x65 n LEU 215 Ca -0.07 -0.17 0.22 0.00 -0.03 0.00 0.00 56.01 55.97 2x65 n LEU 215 Cb 0.85 0.00 0.49 0.00 -2.33 0.00 0.00 43.42 42.43 2x65 n LEU 215 CO 0.43 0.06 1.21 0.07 -1.33 0.00 0.00 177.39 177.83 2x65 h LYS 216 N 0.00 0.41 -0.02 3.23 2.10 -1.20 0.16 116.57 121.25 2x65 h LYS 216 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 2x65 h LYS 216 Cb 0.61 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 31.85 2x65 h LYS 216 CO 0.00 0.27 -0.34 -0.40 -2.00 0.00 0.00 179.45 176.98 2x65 n ASP 217 N -4.65 2.15 -4.74 7.07 5.75 -1.26 -4.99 116.55 115.88 2x65 n ASP 217 Ca 0.25 -1.57 -0.41 0.00 -0.01 0.00 0.00 54.79 53.05 2x65 n ASP 217 Cb 0.85 0.33 -0.04 0.00 -1.03 0.00 0.00 41.12 41.23 2x65 n ASP 217 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2x65 s VAL 218 N -2.36 4.07 -0.46 2.12 1.01 0.54 -5.00 120.40 120.32 2x65 s VAL 218 Ca 0.22 1.82 -0.26 0.00 0.00 0.00 0.00 61.98 63.76 2x65 s VAL 218 Cb 0.19 -4.16 0.03 0.00 0.00 0.00 0.00 36.38 32.43 2x65 s VAL 218 CO 0.50 0.33 0.95 -0.62 0.00 0.00 0.00 175.10 176.26 2x65 s ASP 219 N -0.29 6.51 0.58 3.32 2.15 -1.26 -4.94 116.67 122.74 2x65 s ASP 219 Ca 0.47 0.14 0.28 0.00 0.43 0.00 0.00 52.55 53.87 2x65 s ASP 219 Cb -0.27 -2.46 1.63 0.00 -0.30 0.00 0.00 42.92 41.52 2x65 s ASP 219 CO 0.33 -1.07 2.11 -0.65 -0.17 0.00 0.00 175.17 175.72 2x65 h PRO 220 N 9.10 0.00 0.00 4.34 0.11 -1.94 -2.17 132.00 141.43 2x65 h PRO 220 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2x65 h PRO 220 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2x65 h PRO 220 CO 1.04 0.00 -0.06 0.00 -0.21 0.00 0.00 178.00 178.77 2x65 h ARG 221 N 0.00 0.00 -5.68 1.05 3.08 -1.96 -3.42 114.38 107.45 2x65 h ARG 221 Ca 0.08 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.52 2x65 h ARG 221 Cb 0.43 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.35 2x65 h ARG 221 CO -0.00 0.00 0.58 1.21 -1.07 0.00 0.00 179.97 180.69 2x65 s ASN 222 N -5.85 6.24 0.20 7.04 3.84 -0.82 -4.93 114.94 120.67 2x65 s ASN 222 Ca 0.07 -0.68 -0.10 0.00 0.21 0.00 0.00 52.86 52.36 2x65 s ASN 222 Cb 0.07 -2.43 0.14 0.00 -0.55 0.00 0.00 41.25 38.47 2x65 s ASN 222 CO 0.66 -1.37 1.82 0.15 -2.79 0.00 0.00 177.10 175.58 2x65 h PHE 223 N 9.48 0.99 -0.11 0.43 3.57 -1.84 -0.97 116.94 128.49 2x65 h PHE 223 Ca -0.28 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.20 2x65 h PHE 223 Cb 1.07 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.49 2x65 h PHE 223 CO 0.95 0.69 0.06 0.93 -2.23 0.00 0.00 178.31 178.71 2x65 h GLU 224 N 1.00 0.15 -0.16 1.11 4.39 -1.95 0.26 114.58 119.37 2x65 h GLU 224 Ca 0.26 -0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.89 2x65 h GLU 224 Cb 0.02 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 2x65 h GLU 224 CO -0.04 0.17 -0.12 1.49 -1.16 0.00 0.00 179.01 179.35 2x65 h GLU 225 N 0.08 0.25 -0.12 2.33 4.81 -1.85 -2.53 114.58 117.56 2x65 h GLU 225 Ca 0.04 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.14 2x65 h GLU 225 Cb 0.06 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.41 2x65 h GLU 225 CO -0.01 0.38 -0.21 1.25 -0.73 0.00 0.00 179.01 179.70 2x65 h LEU 226 N 0.24 0.39 -0.68 1.64 5.85 -0.54 -2.40 115.31 119.81 2x65 h LEU 226 Ca 0.05 -0.54 0.09 0.00 0.84 0.00 0.00 57.88 58.32 2x65 h LEU 226 Cb 0.36 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.21 2x65 h LEU 226 CO 0.02 0.86 0.34 0.50 -0.34 0.00 0.00 178.44 179.81 2x65 h LYS 227 N -0.06 0.56 -0.07 1.25 3.64 -0.30 0.27 116.57 121.86 2x65 h LYS 227 Ca 0.01 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 2x65 h LYS 227 Cb 0.78 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.47 2x65 h LYS 227 CO 0.05 0.37 -0.00 0.87 -2.27 0.00 0.00 179.45 178.47 2x65 h LYS 228 N 0.58 0.13 -0.18 1.90 1.57 -1.47 -2.86 116.57 116.24 2x65 h LYS 228 Ca 0.33 -0.04 0.04 0.00 -1.87 0.00 0.00 60.65 59.12 2x65 h LYS 228 Cb 0.34 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.60 2x65 h LYS 228 CO -0.26 0.41 -0.11 0.00 -0.57 0.00 0.00 179.45 178.92 2x65 h ALA 229 N 0.71 0.03 0.00 3.86 0.00 -0.94 -2.81 119.26 120.11 2x65 h ALA 229 Ca 0.02 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2x65 h ALA 229 Cb 0.36 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 2x65 h ALA 229 CO 0.00 -0.55 -0.01 1.88 0.00 0.00 0.00 179.25 180.58 2x65 h TYR 230 N -0.11 0.00 -0.29 0.00 0.99 -0.46 -2.00 116.97 115.11 2x65 h TYR 230 Ca 0.10 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.70 2x65 h TYR 230 Cb 0.26 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 37.99 2x65 h TYR 230 CO -0.26 0.01 -0.34 0.93 -0.00 0.00 0.00 178.16 178.50 2x65 h GLU 231 N 0.00 0.74 0.00 4.88 5.08 -1.26 -2.74 114.58 121.27 2x65 h GLU 231 Ca -0.00 -0.41 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 2x65 h GLU 231 Cb 0.03 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2x65 h GLU 231 CO 0.00 1.03 0.00 1.63 -1.00 0.00 0.00 179.01 180.68 2x65 n LYS 232 N -4.21 0.08 -3.56 2.33 5.02 -0.79 -4.81 118.16 112.23 2x65 n LYS 232 Ca -0.04 0.31 -0.38 0.00 -2.02 0.00 0.00 58.31 56.19 2x65 n LYS 232 Cb 0.51 -1.66 -0.06 0.00 -0.02 0.00 0.00 35.03 33.80 2x65 n LYS 232 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2x65 s VAL 233 N -3.13 5.17 0.46 -0.18 1.01 -0.99 -4.96 120.40 117.77 2x65 s VAL 233 Ca 0.06 0.69 -0.22 0.00 0.00 0.00 0.00 61.98 62.51 2x65 s VAL 233 Cb 0.10 -3.65 -0.08 0.00 0.00 0.00 0.00 36.38 32.75 2x65 s VAL 233 CO 0.33 0.54 1.09 -2.16 0.00 0.00 0.00 175.10 174.90 2x65 s PRO 234 N -0.72 3.82 -0.39 2.72 0.04 -1.26 -4.95 135.00 134.26 2x65 s PRO 234 Ca 0.21 1.55 -0.23 0.00 0.04 0.00 0.00 61.00 62.57 2x65 s PRO 234 Cb -0.15 -2.29 0.01 0.00 0.04 0.00 0.00 34.50 32.12 2x65 s PRO 234 CO 0.10 -0.45 0.80 0.45 0.04 0.00 0.00 177.00 177.94 2x65 s SER 235 N -1.67 6.53 -0.12 6.66 0.15 -1.26 -4.85 113.70 119.13 2x65 s SER 235 Ca 0.65 0.27 -0.29 0.00 0.70 0.00 0.00 55.95 57.27 2x65 s SER 235 Cb -0.22 -2.40 0.08 0.00 -1.71 0.00 0.00 66.02 61.77 2x65 s SER 235 CO 0.27 -0.79 0.75 -0.51 1.20 0.00 0.00 173.24 174.16 2x65 s ILE 236 N 3.20 0.00 0.76 6.45 2.07 -0.80 -4.95 121.20 127.93 2x65 s ILE 236 Ca 0.32 0.00 -0.11 0.00 -1.41 0.00 0.00 60.65 59.45 2x65 s ILE 236 Cb -0.13 -1.00 0.05 0.00 0.13 0.00 0.00 42.46 41.51 2x65 s ILE 236 CO 0.19 0.00 1.08 -0.94 -1.91 0.00 0.00 174.94 173.36 2x65 s SER 237 N -0.81 4.71 0.36 4.50 1.04 -1.26 -1.87 113.70 120.37 2x65 s SER 237 Ca -0.07 1.61 0.15 0.00 0.48 0.00 0.00 55.95 58.11 2x65 s SER 237 Cb -0.01 -2.38 0.69 0.00 0.10 0.00 0.00 66.02 64.42 2x65 s SER 237 CO 0.06 -1.87 1.78 1.62 0.98 0.00 0.00 173.24 175.81 2x65 h VAL 238 N -1.02 1.17 -0.13 5.02 3.04 -1.91 -0.47 116.25 121.96 2x65 h VAL 238 Ca -0.45 -1.47 -0.01 0.00 -1.01 0.00 0.00 66.70 63.77 2x65 h VAL 238 Cb 1.24 1.82 -0.01 0.00 -2.01 0.00 0.00 31.29 32.33 2x65 h VAL 238 CO 0.55 0.40 0.05 0.44 -1.01 0.00 0.00 177.57 178.00 2x65 h ASP 239 N 0.00 0.18 0.14 3.17 3.32 -1.95 0.24 116.42 121.53 2x65 h ASP 239 Ca -0.00 -0.19 -0.22 0.00 0.02 0.00 0.00 57.03 56.64 2x65 h ASP 239 Cb 0.78 -0.05 0.02 0.00 0.22 0.00 0.00 39.33 40.31 2x65 h ASP 239 CO 0.05 0.32 -0.96 1.88 -1.72 0.00 0.00 179.24 178.82 2x65 h TYR 240 N 0.04 0.69 -0.58 4.55 0.05 -1.95 0.14 116.97 119.90 2x65 h TYR 240 Ca 0.04 -0.48 0.00 0.00 0.05 0.00 0.00 58.73 58.35 2x65 h TYR 240 Cb 0.20 -0.04 -0.03 0.00 1.01 0.00 0.00 36.73 37.87 2x65 h TYR 240 CO -0.01 1.36 0.37 0.00 -1.05 0.00 0.00 178.16 178.83 2x65 h ALA 241 N 0.14 0.74 0.00 3.88 0.00 -1.07 -3.42 119.26 119.54 2x65 h ALA 241 Ca -0.16 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2x65 h ALA 241 Cb 1.73 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.28 2x65 h ALA 241 CO 0.18 0.20 -0.64 0.28 0.00 0.00 0.00 179.25 179.27 2x65 n VAL 242 N -4.65 0.13 -0.09 0.00 0.31 0.72 -4.44 118.33 110.31 2x65 n VAL 242 Ca 0.04 0.04 -0.10 0.00 -0.01 0.00 0.00 64.34 64.31 2x65 n VAL 242 Cb 0.04 -1.26 -0.02 0.00 -0.91 0.00 0.00 33.84 31.69 2x65 n VAL 242 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 2x65 h MET 243 N 0.00 0.43 -0.03 5.55 2.86 -0.77 0.20 114.93 123.17 2x65 h MET 243 Ca 0.00 -0.07 0.01 0.00 -2.06 0.00 0.00 59.70 57.58 2x65 h MET 243 Cb 0.64 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.23 2x65 h MET 243 CO 0.00 0.41 0.04 0.93 1.06 0.00 0.00 176.91 179.36 2x65 h GLU 244 N 0.34 0.00 0.00 1.72 5.08 -0.96 -3.20 114.58 117.56 2x65 h GLU 244 Ca 0.10 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.41 2x65 h GLU 244 Cb 0.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2x65 h GLU 244 CO -0.01 0.00 -1.69 1.63 -1.00 0.00 0.00 179.01 177.94 2x65 n LYS 245 N -3.61 0.73 -2.21 2.33 5.02 -0.61 -4.76 118.16 115.05 2x65 n LYS 245 Ca -0.02 -0.10 -0.37 0.00 -2.02 0.00 0.00 58.31 55.80 2x65 n LYS 245 Cb 0.13 -1.33 -0.00 0.00 -0.02 0.00 0.00 35.03 33.81 2x65 n LYS 245 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2x65 s SER 246 N -3.81 5.97 0.00 4.39 0.15 0.61 -4.94 113.70 116.07 2x65 s SER 246 Ca -0.05 2.32 0.25 0.00 0.70 0.00 0.00 55.95 59.16 2x65 s SER 246 Cb 0.08 -2.60 0.49 0.00 -1.71 0.00 0.00 66.02 62.28 2x65 s SER 246 CO 0.57 -1.05 1.40 0.29 1.20 0.00 0.00 173.24 175.64 2x65 n LYS 247 N -0.74 1.02 -2.91 5.44 5.02 -1.26 -4.51 118.16 120.21 2x65 n LYS 247 Ca 0.09 -0.71 -0.19 0.00 -2.02 0.00 0.00 58.31 55.48 2x65 n LYS 247 Cb 0.48 -1.49 -0.01 0.00 -0.02 0.00 0.00 35.03 33.99 2x65 n LYS 247 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 2x65 n LYS 248 N -0.38 1.89 -3.51 1.97 2.85 -1.26 -5.04 118.16 114.68 2x65 n LYS 248 Ca 0.11 -3.86 -0.37 0.00 -1.05 0.00 0.00 58.31 53.15 2x65 n LYS 248 Cb 0.39 -1.80 -0.06 0.00 -0.65 0.00 0.00 35.03 32.91 2x65 n LYS 248 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 2x65 s VAL 249 N -3.50 5.04 0.13 0.58 1.01 -1.26 -0.47 120.40 121.92 2x65 s VAL 249 Ca 0.40 0.71 0.07 0.00 0.00 0.00 0.00 61.98 63.16 2x65 s VAL 249 Cb 0.37 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 2x65 s VAL 249 CO -0.08 0.45 -0.17 -0.13 0.00 0.00 0.00 175.10 175.17 2x65 s ARG 250 N -1.44 1.13 -0.04 2.72 3.00 0.89 -1.55 118.95 123.66 2x65 s ARG 250 Ca 0.28 -1.27 0.04 0.00 0.00 0.00 0.00 55.73 54.78 2x65 s ARG 250 Cb -0.16 -1.16 -0.00 0.00 0.00 0.00 0.00 34.95 33.63 2x65 s ARG 250 CO 0.15 0.24 -0.16 0.54 0.00 0.00 0.00 175.30 176.07 2x65 s VAL 251 N -1.86 1.37 0.11 3.52 0.11 -0.06 -0.43 120.40 123.17 2x65 s VAL 251 Ca 0.10 -0.69 0.06 0.00 -2.93 0.00 0.00 61.98 58.53 2x65 s VAL 251 Cb -0.07 -1.18 -0.04 0.00 -1.53 0.00 0.00 36.38 33.57 2x65 s VAL 251 CO 0.05 0.40 -0.02 0.68 -3.33 0.00 0.00 175.10 172.87 2x65 s VAL 252 N 0.03 3.82 0.14 2.04 -7.23 -0.86 -1.27 120.40 117.07 2x65 s VAL 252 Ca -0.03 -1.15 -0.29 0.00 -1.81 0.00 0.00 61.98 58.69 2x65 s VAL 252 Cb -0.11 -2.84 -0.07 0.00 0.56 0.00 0.00 36.38 33.92 2x65 s VAL 252 CO 0.02 0.06 0.91 -0.54 -0.31 0.00 0.00 175.10 175.24 2x65 s LYS 253 N -2.46 4.70 0.05 4.82 1.02 -1.25 -0.69 119.74 125.93 2x65 s LYS 253 Ca 0.25 1.38 -0.31 0.00 0.02 0.00 0.00 55.97 57.32 2x65 s LYS 253 Cb -0.11 -3.34 -0.06 0.00 -0.52 0.00 0.00 37.83 33.80 2x65 s LYS 253 CO 0.18 0.35 1.33 0.00 -0.92 0.00 0.00 175.35 176.28 2x65 s ALA 254 N -0.46 3.53 -1.68 5.17 0.00 -0.54 -4.82 121.76 122.95 2x65 s ALA 254 Ca 0.43 0.93 0.01 0.00 0.00 0.00 0.00 51.96 53.33 2x65 s ALA 254 Cb -0.24 -3.53 0.03 0.00 0.00 0.00 0.00 23.12 19.38 2x65 s ALA 254 CO 0.29 -0.68 0.87 -0.25 0.00 0.00 0.00 175.76 176.00 2x65 n ASP 255 N 4.51 0.47 -3.91 0.00 8.00 -1.26 -4.92 116.55 119.44 2x65 n ASP 255 Ca 0.11 -2.01 -0.10 0.00 0.71 0.00 0.00 54.79 53.50 2x65 n ASP 255 Cb 0.44 -0.17 -0.10 0.00 -0.02 0.00 0.00 41.12 41.27 2x65 n ASP 255 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2x65 s PHE 256 N -1.69 0.14 0.28 1.24 -0.12 -1.26 -4.80 117.98 111.78 2x65 s PHE 256 Ca 0.02 -0.35 -0.30 0.00 -0.05 0.00 0.00 56.93 56.25 2x65 s PHE 256 Cb 0.01 -0.11 -0.11 0.00 -0.63 0.00 0.00 43.02 42.18 2x65 s PHE 256 CO 0.01 -0.30 1.52 -1.21 -0.05 0.00 0.00 175.22 175.19 2x65 s GLU 257 N -1.86 4.18 0.00 1.99 2.02 -1.26 -5.03 118.70 118.74 2x65 s GLU 257 Ca -0.11 2.46 -0.07 0.00 0.02 0.00 0.00 54.97 57.27 2x65 s GLU 257 Cb -0.06 -3.05 0.00 0.00 0.10 0.00 0.00 34.13 31.12 2x65 s GLU 257 CO -0.01 -0.53 0.13 -0.46 0.02 0.00 0.00 175.26 174.41 2x65 s TRP 258 N -0.12 0.04 -0.09 1.61 -0.00 -1.26 -4.26 118.94 114.86 2x65 s TRP 258 Ca 0.61 -0.12 -0.12 0.00 -0.00 0.00 0.00 56.10 56.47 2x65 s TRP 258 Cb -0.45 -0.05 0.03 0.00 -0.00 0.00 0.00 33.47 33.00 2x65 s TRP 258 CO 0.47 -0.27 0.31 0.45 -0.00 0.00 0.00 176.95 177.91 2x65 s SER 259 N -1.31 -0.29 0.00 5.86 0.15 -0.74 -5.01 113.70 112.36 2x65 s SER 259 Ca -0.14 0.49 0.28 0.00 0.70 0.00 0.00 55.95 57.28 2x65 s SER 259 Cb -0.07 0.56 1.21 0.00 -1.71 0.00 0.00 66.02 66.01 2x65 s SER 259 CO 0.01 -0.19 1.83 -0.90 1.20 0.00 0.00 173.24 175.19 2x65 n ASP 260 N 2.51 1.14 -3.77 5.45 5.75 -1.26 -0.92 116.55 125.45 2x65 n ASP 260 Ca -0.15 -1.41 -0.34 0.00 -0.01 0.00 0.00 54.79 52.88 2x65 n ASP 260 Cb 0.57 -0.01 0.03 0.00 -1.03 0.00 0.00 41.12 40.68 2x65 n ASP 260 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2x65 n LEU 261 N -0.10 -2.21 -0.20 -2.12 4.77 -1.26 -4.72 117.00 111.16 2x65 n LEU 261 Ca 0.20 -1.05 -0.04 0.00 -0.03 0.00 0.00 56.01 55.08 2x65 n LEU 261 Cb 0.29 -2.15 0.14 0.00 -2.33 0.00 0.00 43.42 39.37 2x65 n LEU 261 CO 0.16 0.49 1.01 1.23 -1.33 0.00 0.00 177.39 178.95 2x65 h GLY 262 N -1.85 1.07 -0.95 -0.72 0.00 -1.95 -3.48 103.07 95.18 2x65 h GLY 262 Ca -0.65 -0.60 0.02 0.00 0.00 0.00 0.00 47.33 46.11 2x65 h GLY 262 CO 0.47 0.56 0.32 1.16 0.00 0.00 0.00 176.54 179.05 2x65 n ASN 263 N -4.27 -1.82 0.09 0.19 0.23 -1.26 -4.83 115.26 103.58 2x65 n ASN 263 Ca 0.05 -2.19 0.17 0.00 -0.53 0.00 0.00 54.58 52.09 2x65 n ASN 263 Cb 0.21 3.02 0.71 0.00 -2.08 0.00 0.00 39.78 41.64 2x65 n ASN 263 CO 0.00 0.00 0.00 -0.50 -0.93 0.00 0.00 177.26 175.83 2x65 h TRP 264 N 1.85 0.00 -0.27 -2.53 4.06 -1.84 0.59 115.95 117.81 2x65 h TRP 264 Ca -0.27 0.00 -0.10 0.00 2.06 0.00 0.00 58.89 60.58 2x65 h TRP 264 Cb 1.05 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.19 2x65 h TRP 264 CO 0.00 0.00 -0.26 1.03 -3.56 0.00 0.00 178.44 175.65 2x65 h SER 265 N 0.00 0.53 -0.82 -3.49 0.87 -1.92 -1.69 113.55 107.02 2x65 h SER 265 Ca 0.17 -0.19 0.06 0.00 -1.23 0.00 0.00 61.79 60.61 2x65 h SER 265 Cb 0.73 -0.15 -0.05 0.00 -0.44 0.00 0.00 62.40 62.49 2x65 h SER 265 CO -0.00 0.79 0.54 0.28 -0.53 0.00 0.00 176.83 177.90 2x65 h SER 266 N 0.46 0.79 -0.26 6.23 0.02 -1.27 -0.31 113.55 119.21 2x65 h SER 266 Ca 0.06 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.91 2x65 h SER 266 Cb 0.70 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 63.07 2x65 h SER 266 CO 0.05 0.51 -0.26 0.58 -1.14 0.00 0.00 176.83 176.57 2x65 h VAL 267 N 0.90 1.31 -0.98 2.27 2.07 -1.30 -3.03 116.25 117.49 2x65 h VAL 267 Ca 0.35 -1.43 0.01 0.00 0.82 0.00 0.00 66.70 66.45 2x65 h VAL 267 Cb 0.23 1.63 -0.05 0.00 -1.52 0.00 0.00 31.29 31.58 2x65 h VAL 267 CO -0.13 0.45 0.65 -0.09 0.02 0.00 0.00 177.57 178.47 2x65 h ARG 268 N 0.37 1.28 -0.76 1.57 1.12 -0.44 -0.98 114.38 116.54 2x65 h ARG 268 Ca 0.04 -0.08 0.14 0.00 -1.11 0.00 0.00 59.98 58.97 2x65 h ARG 268 Cb 0.83 -0.29 -0.05 0.00 -0.01 0.00 0.00 29.97 30.45 2x65 h ARG 268 CO 0.07 0.85 0.50 1.49 -3.11 0.00 0.00 179.97 179.77 2x65 h GLU 269 N 1.32 0.46 0.17 0.20 4.57 -0.97 0.61 114.58 120.94 2x65 h GLU 269 Ca 0.36 -0.03 -0.34 0.00 -1.18 0.00 0.00 59.36 58.17 2x65 h GLU 269 Cb -0.15 -0.10 0.01 0.00 -0.16 0.00 0.00 28.75 28.34 2x65 h GLU 269 CO -0.08 0.30 -1.70 0.82 -1.18 0.00 0.00 179.01 177.18 2x65 h ILE 270 N 0.47 0.94 0.00 2.32 2.04 -1.21 -3.39 117.51 118.68 2x65 h ILE 270 Ca 0.37 -2.48 -0.13 0.00 1.00 0.00 0.00 64.86 63.62 2x65 h ILE 270 Cb 0.78 2.74 -0.02 0.00 -0.74 0.00 0.00 36.82 39.58 2x65 h ILE 270 CO -0.13 0.83 -1.62 -0.62 0.00 0.00 0.00 178.15 176.62 2x65 n GLU 271 N -3.66 0.64 0.00 2.37 1.02 -0.47 -5.09 120.64 115.45 2x65 n GLU 271 Ca -0.25 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 56.96 2x65 n GLU 271 Cb 1.04 -1.70 0.00 0.00 -0.02 0.00 0.00 31.44 30.75 2x65 n GLU 271 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2x65 n GLY 272 N 1.38 0.66 3.47 0.62 0.00 0.21 -5.00 105.19 106.53 2x65 n GLY 272 Ca -0.10 -1.78 -0.31 0.00 0.00 0.00 0.00 46.02 43.83 2x65 n GLY 272 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2x65 n TYR 273 N 0.74 -0.80 -3.88 1.61 4.01 -1.26 -4.81 117.16 112.76 2x65 n TYR 273 Ca 0.00 0.15 -0.36 0.00 -0.16 0.00 0.00 57.90 57.52 2x65 n TYR 273 Cb 0.00 -1.77 -0.06 0.00 -0.31 0.00 0.00 39.34 37.20 2x65 n TYR 273 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2x65 s THR 274 N -2.43 5.49 0.25 -0.72 2.01 0.86 -4.99 115.64 116.12 2x65 s THR 274 Ca 0.63 0.16 -0.10 0.00 0.31 0.00 0.00 61.69 62.69 2x65 s THR 274 Cb -0.21 -3.43 -0.07 0.00 0.01 0.00 0.00 72.50 68.80 2x65 s THR 274 CO 0.64 0.57 0.57 -1.83 -0.69 0.00 0.00 174.62 173.89 2x65 s GLU 275 N -1.18 3.80 0.61 4.92 -1.05 -1.26 -4.68 118.70 119.86 2x65 s GLU 275 Ca 0.17 0.28 -0.19 0.00 -0.15 0.00 0.00 54.97 55.08 2x65 s GLU 275 Cb -0.12 -2.62 -0.03 0.00 -0.44 0.00 0.00 34.13 30.92 2x65 s GLU 275 CO 0.07 0.28 1.22 -1.91 0.95 0.00 0.00 175.26 175.86 2x65 n GLU 276 N -0.29 1.19 -1.41 -4.83 2.13 -1.26 -4.80 120.64 111.37 2x65 n GLU 276 Ca 0.01 0.46 -0.00 0.00 0.66 0.00 0.00 57.16 58.28 2x65 n GLU 276 Cb 0.53 -2.44 0.00 0.00 0.27 0.00 0.00 31.44 29.79 2x65 n GLU 276 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2x65 n SER 277 N -1.38 -0.06 0.10 4.31 3.41 0.32 -4.92 113.62 115.39 2x65 n SER 277 Ca 0.14 -1.04 0.11 0.00 -0.26 0.00 0.00 58.87 57.83 2x65 n SER 277 Cb 0.47 0.10 0.45 0.00 -0.26 0.00 0.00 64.21 64.98 2x65 n SER 277 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2x65 n ASP 278 N -0.69 0.54 -0.00 4.04 8.00 -1.26 -2.93 116.55 124.24 2x65 n ASP 278 Ca -0.00 0.62 0.02 0.00 0.71 0.00 0.00 54.79 56.14 2x65 n ASP 278 Cb 0.02 -0.74 -0.03 0.00 -0.02 0.00 0.00 41.12 40.35 2x65 n ASP 278 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2x65 n GLU 279 N -2.08 5.23 -3.72 -1.24 1.02 -1.26 -4.83 120.64 113.75 2x65 n GLU 279 Ca 0.03 -0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.89 2x65 n GLU 279 Cb 0.25 -0.75 -0.16 0.00 -0.02 0.00 0.00 31.44 30.76 2x65 n GLU 279 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2x65 s VAL 280 N -1.50 0.54 -0.22 2.62 1.01 -1.15 -1.15 120.40 120.55 2x65 s VAL 280 Ca 0.02 -0.72 -0.06 0.00 0.00 0.00 0.00 61.98 61.22 2x65 s VAL 280 Cb 0.04 -1.14 -0.02 0.00 0.00 0.00 0.00 36.38 35.25 2x65 s VAL 280 CO 0.21 -0.33 0.03 -0.63 0.00 0.00 0.00 175.10 174.38 2x65 s ILE 281 N 1.83 4.08 -0.23 2.22 1.09 -0.43 -0.52 121.20 129.24 2x65 s ILE 281 Ca 0.02 -0.26 -0.01 0.00 -1.10 0.00 0.00 60.65 59.30 2x65 s ILE 281 Cb -0.17 -2.87 0.03 0.00 -1.06 0.00 0.00 42.46 38.38 2x65 s ILE 281 CO -0.13 0.39 -0.09 -0.76 -0.10 0.00 0.00 174.94 174.25 2x65 s LEU 282 N 1.31 2.99 -0.20 2.97 1.43 -1.26 -0.99 118.68 124.93 2x65 s LEU 282 Ca 0.04 -0.84 -0.00 0.00 -1.03 0.00 0.00 54.13 52.30 2x65 s LEU 282 Cb -0.15 -1.63 0.01 0.00 0.03 0.00 0.00 46.19 44.46 2x65 s LEU 282 CO 0.02 -0.10 -0.15 -0.69 0.23 0.00 0.00 176.35 175.66 2x65 s VAL 283 N 1.31 2.46 -1.58 -1.59 1.01 -0.86 -4.71 120.40 116.45 2x65 s VAL 283 Ca 0.01 -0.83 -0.15 0.00 0.00 0.00 0.00 61.98 61.00 2x65 s VAL 283 Cb -0.16 -2.08 0.11 0.00 0.00 0.00 0.00 36.38 34.25 2x65 s VAL 283 CO -0.06 0.48 0.88 0.47 0.00 0.00 0.00 175.10 176.88 2x65 n ASP 284 N 4.67 -4.30 -3.79 3.32 8.00 -1.26 -1.09 116.55 122.09 2x65 n ASP 284 Ca -0.20 -0.82 -0.23 0.00 0.71 0.00 0.00 54.79 54.25 2x65 n ASP 284 Cb 0.50 -3.46 -0.17 0.00 -0.02 0.00 0.00 41.12 37.96 2x65 n ASP 284 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2x65 s SER 285 N -3.24 1.61 0.19 -2.24 0.01 -1.26 -3.13 113.70 105.65 2x65 s SER 285 Ca 0.68 -0.11 0.09 0.00 1.31 0.00 0.00 55.95 57.92 2x65 s SER 285 Cb -0.35 -0.48 -0.04 0.00 0.21 0.00 0.00 66.02 65.36 2x65 s SER 285 CO 0.83 -0.18 -0.08 -1.81 0.41 0.00 0.00 173.24 172.41 2x65 s ASP 286 N 1.90 4.31 -1.07 2.44 1.01 -1.23 -4.84 116.67 119.18 2x65 s ASP 286 Ca 0.04 -0.58 -0.14 0.00 0.71 0.00 0.00 52.55 52.59 2x65 s ASP 286 Cb -0.12 -0.75 -0.03 0.00 1.01 0.00 0.00 42.92 43.03 2x65 s ASP 286 CO -0.05 0.09 0.84 0.54 0.21 0.00 0.00 175.17 176.79 2x65 n ARG 287 N -0.08 -1.63 -4.41 8.23 1.74 -1.26 -1.41 116.66 117.84 2x65 n ARG 287 Ca -0.10 0.68 -0.32 0.00 -0.77 0.00 0.00 57.85 57.34 2x65 n ARG 287 Cb 0.56 -4.84 -0.10 0.00 -1.02 0.00 0.00 32.46 27.06 2x65 n ARG 287 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2x65 s VAL 288 N -3.40 3.66 -0.22 1.55 -7.23 -1.26 -1.28 120.40 112.22 2x65 s VAL 288 Ca 0.44 -0.82 0.02 0.00 -1.81 0.00 0.00 61.98 59.80 2x65 s VAL 288 Cb -0.11 -2.61 0.05 0.00 0.56 0.00 0.00 36.38 34.26 2x65 s VAL 288 CO 0.81 0.35 -0.12 0.12 -0.31 0.00 0.00 175.10 175.95 2x65 s PHE 289 N -1.04 2.78 -0.07 2.82 5.36 -0.26 -0.10 117.98 127.47 2x65 s PHE 289 Ca 0.18 -1.88 0.01 0.00 -0.96 0.00 0.00 56.93 54.28 2x65 s PHE 289 Cb -0.11 -1.78 0.02 0.00 -0.34 0.00 0.00 43.02 40.80 2x65 s PHE 289 CO 0.09 -0.81 -0.09 0.08 -1.46 0.00 0.00 175.22 173.04 2x65 s VAL 290 N 1.27 0.93 -0.30 3.12 1.01 -1.26 -0.16 120.40 125.02 2x65 s VAL 290 Ca -0.03 -0.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.62 2x65 s VAL 290 Cb -0.17 -0.91 0.06 0.00 0.00 0.00 0.00 36.38 35.35 2x65 s VAL 290 CO -0.08 0.32 -0.01 -0.54 0.00 0.00 0.00 175.10 174.80 2x65 s LYS 291 N 1.07 2.36 0.49 2.72 -0.14 -0.28 -4.92 119.74 121.04 2x65 s LYS 291 Ca -0.07 -1.32 -0.13 0.00 -1.36 0.00 0.00 55.97 53.09 2x65 s LYS 291 Cb -0.14 -3.16 -0.06 0.00 -1.68 0.00 0.00 37.83 32.79 2x65 s LYS 291 CO -0.01 -0.64 0.91 0.95 -0.76 0.00 0.00 175.35 175.80 2x65 s THR 292 N 1.21 4.67 0.00 2.17 -4.23 -1.26 -1.60 115.64 116.61 2x65 s THR 292 Ca -0.05 0.89 0.00 0.00 -1.18 0.00 0.00 61.69 61.35 2x65 s THR 292 Cb -0.20 -3.76 0.00 0.00 1.34 0.00 0.00 72.50 69.88 2x65 s THR 292 CO -0.02 -0.72 0.00 1.57 -0.54 0.00 0.00 174.62 174.91 2x65 n HIS 293 N -1.72 0.00 -0.34 3.99 -0.00 -1.25 -4.83 115.22 111.07 2x65 n HIS 293 Ca 0.05 0.00 0.02 0.00 0.46 0.00 0.00 57.72 58.25 2x65 n HIS 293 Cb 0.54 0.00 0.03 0.00 -0.12 0.00 0.00 29.99 30.44 2x65 n HIS 293 CO 0.00 0.00 0.00 0.27 0.46 0.00 0.00 176.34 177.07 2x65 n ASN 294 N -0.11 1.97 -3.54 0.26 6.94 -1.26 -5.05 115.26 114.47 2x65 n ASN 294 Ca 0.00 -2.22 -0.11 0.00 -0.02 0.00 0.00 54.58 52.23 2x65 n ASN 294 Cb 0.00 -0.11 -0.03 0.00 -2.36 0.00 0.00 39.78 37.29 2x65 n ASN 294 CO 0.00 0.00 0.00 -1.59 -1.03 0.00 0.00 177.26 174.64 2x65 s LYS 295 N -1.40 1.33 0.53 -3.83 -2.85 -1.26 -5.15 119.74 107.10 2x65 s LYS 295 Ca 0.08 -0.61 -0.21 0.00 -1.00 0.00 0.00 55.97 54.22 2x65 s LYS 295 Cb 0.07 0.57 -0.05 0.00 -2.06 0.00 0.00 37.83 36.35 2x65 s LYS 295 CO 0.01 -0.58 1.27 -2.14 0.10 0.00 0.00 175.35 174.01 2x65 s PRO 296 N -3.79 3.29 -0.14 1.78 0.02 -1.26 -4.92 135.00 129.97 2x65 s PRO 296 Ca 0.03 2.00 0.02 0.00 0.02 0.00 0.00 61.00 63.08 2x65 s PRO 296 Cb -0.01 -2.23 0.00 0.00 0.02 0.00 0.00 34.50 32.28 2x65 s PRO 296 CO -0.09 -1.00 -0.19 0.42 -0.33 0.00 0.00 177.00 175.80 2x65 s ILE 297 N -1.44 2.31 -0.12 2.83 1.01 -0.30 -5.02 121.20 120.47 2x65 s ILE 297 Ca 0.70 -0.90 -0.01 0.00 0.00 0.00 0.00 60.65 60.44 2x65 s ILE 297 Cb -0.35 -1.94 -0.03 0.00 0.01 0.00 0.00 42.46 40.16 2x65 s ILE 297 CO 0.40 0.54 -0.07 0.00 0.00 0.00 0.00 174.94 175.81 2x65 s ALA 298 N 0.79 2.90 -0.21 9.38 0.00 -1.26 -1.31 121.76 132.05 2x65 s ALA 298 Ca -0.07 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.05 2x65 s ALA 298 Cb -0.16 -1.37 0.03 0.00 0.00 0.00 0.00 23.12 21.62 2x65 s ALA 298 CO -0.01 0.33 -0.16 0.08 0.00 0.00 0.00 175.76 176.00 2x65 s VAL 299 N 0.01 2.19 -0.16 0.00 1.01 -0.16 -4.98 120.40 118.31 2x65 s VAL 299 Ca -0.01 -1.10 0.01 0.00 0.00 0.00 0.00 61.98 60.87 2x65 s VAL 299 Cb -0.14 -2.03 0.02 0.00 0.00 0.00 0.00 36.38 34.24 2x65 s VAL 299 CO 0.03 0.37 -0.16 -0.69 0.00 0.00 0.00 175.10 174.65 2x65 s VAL 300 N 1.25 1.71 -0.07 2.92 1.01 -1.26 -2.03 120.40 123.94 2x65 s VAL 300 Ca 0.01 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.27 2x65 s VAL 300 Cb -0.15 -1.59 0.00 0.00 0.00 0.00 0.00 36.38 34.64 2x65 s VAL 300 CO -0.10 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.09 2x65 n GLY 301 N 4.70 0.43 2.87 4.51 0.00 -0.25 -4.99 105.19 112.45 2x65 n GLY 301 Ca -0.18 -1.06 -0.14 0.00 0.00 0.00 0.00 46.02 44.64 2x65 n GLY 301 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x65 s LEU 302 N -0.15 1.77 0.21 0.99 1.43 -1.18 -4.94 118.68 116.79 2x65 s LEU 302 Ca 0.00 -0.02 0.09 0.00 -1.03 0.00 0.00 54.13 53.17 2x65 s LEU 302 Cb 0.00 -0.09 -0.05 0.00 0.03 0.00 0.00 46.19 46.08 2x65 s LEU 302 CO 0.00 -0.02 -0.16 -0.44 0.23 0.00 0.00 176.35 175.96 2x65 s SER 303 N 0.26 2.77 -1.06 2.29 0.01 -1.26 -3.51 113.70 113.20 2x65 s SER 303 Ca -0.02 -0.98 -0.01 0.00 1.31 0.00 0.00 55.95 56.25 2x65 s SER 303 Cb -0.04 -0.17 0.00 0.00 0.21 0.00 0.00 66.02 66.02 2x65 s SER 303 CO -0.01 -0.10 0.89 0.47 0.41 0.00 0.00 173.24 174.91 2x65 n ASP 304 N -0.23 -2.67 -4.16 2.44 8.00 -0.40 -4.89 116.55 114.63 2x65 n ASP 304 Ca -0.09 -0.52 -0.18 0.00 0.71 0.00 0.00 54.79 54.70 2x65 n ASP 304 Cb 0.59 -4.49 -0.12 0.00 -0.02 0.00 0.00 41.12 37.08 2x65 n ASP 304 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2x65 s VAL 305 N -3.31 1.10 -0.12 2.53 -7.23 -1.16 -0.81 120.40 111.41 2x65 s VAL 305 Ca 0.09 -1.26 -0.00 0.00 -1.81 0.00 0.00 61.98 59.00 2x65 s VAL 305 Cb -0.04 -1.05 -0.02 0.00 0.56 0.00 0.00 36.38 35.83 2x65 s VAL 305 CO 0.63 -0.20 -0.11 -0.63 -0.31 0.00 0.00 175.10 174.48 2x65 s ILE 306 N -1.22 3.27 -0.10 -0.62 1.01 0.14 -1.10 121.20 122.58 2x65 s ILE 306 Ca -0.02 -0.60 -0.00 0.00 0.00 0.00 0.00 60.65 60.03 2x65 s ILE 306 Cb -0.10 -2.37 0.02 0.00 0.01 0.00 0.00 42.46 40.03 2x65 s ILE 306 CO 0.02 0.54 -0.07 -0.69 0.00 0.00 0.00 174.94 174.74 2x65 s VAL 307 N 0.08 0.92 -0.13 2.92 1.01 0.78 -0.60 120.40 125.39 2x65 s VAL 307 Ca -0.04 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 61.71 2x65 s VAL 307 Cb -0.14 -0.96 0.02 0.00 0.00 0.00 0.00 36.38 35.30 2x65 s VAL 307 CO 0.04 0.35 -0.11 -0.63 0.00 0.00 0.00 175.10 174.74 2x65 s ILE 308 N 1.69 1.32 -0.18 2.22 -1.09 -0.22 -1.13 121.20 123.81 2x65 s ILE 308 Ca 0.04 -0.48 -0.02 0.00 -2.23 0.00 0.00 60.65 57.96 2x65 s ILE 308 Cb -0.13 -1.27 -0.01 0.00 -1.58 0.00 0.00 42.46 39.47 2x65 s ILE 308 CO -0.07 0.42 -0.09 -0.62 -1.23 0.00 0.00 174.94 173.34 2x65 s ASP 309 N 1.52 4.08 0.15 3.58 2.15 -0.63 -0.81 116.67 126.72 2x65 s ASP 309 Ca 0.04 -0.38 -0.05 0.00 0.43 0.00 0.00 52.55 52.59 2x65 s ASP 309 Cb -0.13 -1.66 -0.03 0.00 -0.30 0.00 0.00 42.92 40.80 2x65 s ASP 309 CO -0.09 0.06 0.17 0.42 -0.17 0.00 0.00 175.17 175.56 2x65 s THR 310 N 0.97 0.08 0.63 1.71 -4.23 -0.53 -3.82 115.64 110.45 2x65 s THR 310 Ca -0.01 -1.68 0.31 0.00 -1.18 0.00 0.00 61.69 59.12 2x65 s THR 310 Cb -0.15 -1.99 0.35 0.00 1.34 0.00 0.00 72.50 72.05 2x65 s THR 310 CO -0.01 -0.36 1.99 -0.65 -0.54 0.00 0.00 174.62 175.06 2x65 h PRO 311 N 2.70 0.00 0.00 3.99 0.11 -1.99 -1.25 132.00 135.57 2x65 h PRO 311 Ca -0.33 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.74 2x65 h PRO 311 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2x65 h PRO 311 CO 0.54 0.00 -0.17 -0.91 -0.21 0.00 0.00 178.00 177.24 2x65 h ASN 312 N 0.00 0.00 0.00 -2.05 2.35 -1.96 -3.49 115.58 110.42 2x65 h ASN 312 Ca 0.07 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 2x65 h ASN 312 Cb 0.69 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.06 2x65 h ASN 312 CO -0.00 0.17 0.00 0.61 -1.65 0.00 0.00 177.43 176.56 2x65 n GLY 313 N 1.11 -0.25 3.11 2.83 0.00 -0.47 -5.03 105.19 106.48 2x65 n GLY 313 Ca 0.03 -1.26 -0.28 0.00 0.00 0.00 0.00 46.02 44.52 2x65 n GLY 313 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x65 s ILE 314 N -2.00 1.52 -0.13 -0.61 1.01 -1.26 -1.45 121.20 118.28 2x65 s ILE 314 Ca 0.00 -0.71 -0.03 0.00 0.00 0.00 0.00 60.65 59.91 2x65 s ILE 314 Cb 0.00 -1.34 -0.03 0.00 0.01 0.00 0.00 42.46 41.10 2x65 s ILE 314 CO 0.00 0.44 -0.02 -0.22 0.00 0.00 0.00 174.94 175.14 2x65 s LEU 315 N 0.46 3.41 -0.23 2.97 2.96 0.01 -4.97 118.68 123.29 2x65 s LEU 315 Ca -0.15 -0.02 0.00 0.00 -0.22 0.00 0.00 54.13 53.75 2x65 s LEU 315 Cb -0.16 -1.81 0.06 0.00 0.50 0.00 0.00 46.19 44.78 2x65 s LEU 315 CO 0.05 0.24 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.66 2x65 s ILE 316 N -0.07 1.36 -0.06 6.68 1.01 -1.26 -1.05 121.20 127.81 2x65 s ILE 316 Ca 0.03 -1.13 -0.01 0.00 0.00 0.00 0.00 60.65 59.54 2x65 s ILE 316 Cb -0.13 -1.68 0.03 0.00 0.01 0.00 0.00 42.46 40.69 2x65 s ILE 316 CO 0.02 -0.14 0.00 0.00 0.00 0.00 0.00 174.94 174.83 2x65 s LYS 318 N 1.81 4.16 0.18 0.00 2.47 -1.26 0.27 119.74 127.37 2x65 s LYS 318 Ca 0.02 2.51 -0.19 0.00 -1.56 0.00 0.00 55.97 56.76 2x65 s LYS 318 Cb -0.13 -3.22 0.13 0.00 -1.46 0.00 0.00 37.83 33.15 2x65 s LYS 318 CO -0.04 -0.72 1.62 0.93 0.16 0.00 0.00 175.35 177.29 2x65 h GLU 319 N 7.21 -0.13 0.00 4.03 5.08 -1.31 0.12 114.58 129.58 2x65 h GLU 319 Ca -0.43 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 2x65 h GLU 319 Cb 1.20 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2x65 h GLU 319 CO 0.94 -0.08 0.00 -0.85 -1.00 0.00 0.00 179.01 178.02 2x65 n GLU 320 N -5.41 0.02 -0.17 2.33 0.00 -1.26 -1.43 120.64 114.70 2x65 n GLU 320 Ca 0.04 0.38 0.12 0.00 0.00 0.00 0.00 57.16 57.69 2x65 n GLU 320 Cb 0.32 -1.54 0.25 0.00 0.00 0.00 0.00 31.44 30.47 2x65 n GLU 320 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2x65 n TYR 321 N -1.57 0.46 -0.25 -1.84 4.02 0.03 -4.68 117.16 113.32 2x65 n TYR 321 Ca 0.02 -0.23 0.30 0.00 -0.01 0.00 0.00 57.90 57.98 2x65 n TYR 321 Cb 0.10 0.00 0.70 0.00 -0.02 0.00 0.00 39.34 40.11 2x65 n TYR 321 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2x65 h ALA 322 N 4.41 2.84 -0.16 -0.72 0.00 -1.26 0.17 119.26 124.54 2x65 h ALA 322 Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2x65 h ALA 322 Cb 0.89 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2x65 h ALA 322 CO 0.00 -1.15 -0.02 1.96 0.00 0.00 0.00 179.25 180.05 2x65 h GLN 323 N 0.07 0.24 0.00 0.00 1.08 -1.86 -3.10 115.11 111.54 2x65 h GLN 323 Ca 0.50 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.67 2x65 h GLN 323 Cb 1.86 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 29.25 2x65 h GLN 323 CO -0.05 0.28 0.00 1.63 -0.95 0.00 0.00 178.83 179.74 2x65 n LYS 324 N -4.38 0.39 0.15 1.46 4.76 0.58 -2.35 118.16 118.78 2x65 n LYS 324 Ca -0.01 0.07 0.16 0.00 -2.87 0.00 0.00 58.31 55.67 2x65 n LYS 324 Cb 0.18 -1.50 0.75 0.00 -1.84 0.00 0.00 35.03 32.62 2x65 n LYS 324 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2x65 h VAL 325 N 0.00 0.65 -0.58 -0.18 2.07 -1.68 0.28 116.25 116.81 2x65 h VAL 325 Ca 0.00 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.64 2x65 h VAL 325 Cb 0.14 0.83 -0.11 0.00 -1.52 0.00 0.00 31.29 30.64 2x65 h VAL 325 CO 0.00 0.00 -0.14 -0.09 0.02 0.00 0.00 177.57 177.36 2x65 h ARG 326 N 0.00 0.00 -0.20 1.57 2.43 -1.66 -1.50 114.38 115.02 2x65 h ARG 326 Ca 0.12 -0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.23 2x65 h ARG 326 Cb 0.56 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 2x65 h ARG 326 CO -0.00 0.00 -0.15 0.93 -1.51 0.00 0.00 179.97 179.24 2x65 h GLU 327 N 0.00 0.33 -0.69 0.20 4.39 -0.68 -1.97 114.58 116.16 2x65 h GLU 327 Ca 0.28 -0.09 0.03 0.00 0.34 0.00 0.00 59.36 59.92 2x65 h GLU 327 Cb 0.42 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.99 2x65 h GLU 327 CO -0.59 0.49 0.43 0.28 -1.16 0.00 0.00 179.01 178.45 2x65 h VAL 328 N 0.31 1.08 -0.53 3.13 2.07 -1.09 -2.28 116.25 118.95 2x65 h VAL 328 Ca 0.06 -0.29 -0.12 0.00 0.82 0.00 0.00 66.70 67.17 2x65 h VAL 328 Cb 0.46 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 2x65 h VAL 328 CO 0.03 0.15 -0.15 0.58 0.02 0.00 0.00 177.57 178.20 2x65 h VAL 329 N 0.83 1.27 -0.97 2.57 2.07 -0.76 -1.53 116.25 119.72 2x65 h VAL 329 Ca 0.28 -1.31 0.11 0.00 0.82 0.00 0.00 66.70 66.60 2x65 h VAL 329 Cb 0.04 1.01 -0.08 0.00 -1.52 0.00 0.00 31.29 30.74 2x65 h VAL 329 CO -0.12 0.46 0.61 0.11 0.02 0.00 0.00 177.57 178.65 2x65 h LYS 330 N 0.91 0.95 0.08 1.57 1.57 -1.03 -1.01 116.57 119.61 2x65 h LYS 330 Ca 0.13 -0.06 -0.26 0.00 -1.87 0.00 0.00 60.65 58.59 2x65 h LYS 330 Cb 0.72 -0.21 0.01 0.00 0.08 0.00 0.00 32.23 32.83 2x65 h LYS 330 CO 0.06 0.63 -1.14 0.87 -0.57 0.00 0.00 179.45 179.29 2x65 h LYS 331 N 0.98 0.42 -0.04 3.15 1.57 -1.23 -3.23 116.57 118.19 2x65 h LYS 331 Ca 0.47 -0.57 -0.23 0.00 -1.87 0.00 0.00 60.65 58.45 2x65 h LYS 331 Cb 0.43 0.19 0.01 0.00 0.08 0.00 0.00 32.23 32.94 2x65 h LYS 331 CO -0.25 1.23 -0.92 1.25 -0.57 0.00 0.00 179.45 180.18 2x65 h LEU 332 N 0.18 0.73 -4.96 2.94 5.85 -0.81 -3.33 115.31 115.91 2x65 h LEU 332 Ca -0.13 -0.55 -0.59 0.00 0.84 0.00 0.00 57.88 57.44 2x65 h LEU 332 Cb 1.82 -0.22 -0.42 0.00 0.37 0.00 0.00 40.66 42.21 2x65 h LEU 332 CO 0.20 1.35 -0.68 0.49 -0.34 0.00 0.00 178.44 179.46 2x65 n PHE 333 N -3.83 3.79 0.80 1.25 3.72 -0.43 -5.09 117.46 117.67 2x65 n PHE 333 Ca -0.08 -3.62 0.10 0.00 -0.05 0.00 0.00 57.45 53.79 2x65 n PHE 333 Cb 0.82 -0.32 0.08 0.00 -0.94 0.00 0.00 39.48 39.12 2x65 n PHE 333 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58