#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1brm s LYS 2 N 0.00 3.86 -0.52 0.03 1.02 -1.26 -4.72 119.74 118.15 1brm s LYS 2 Ca 0.00 0.85 -0.22 0.00 0.02 0.00 0.00 55.97 56.62 1brm s LYS 2 Cb 0.00 -2.16 0.04 0.00 -0.52 0.00 0.00 37.83 35.20 1brm s LYS 2 CO 0.00 -0.29 0.81 -0.80 -0.92 0.00 0.00 175.35 174.15 1brm s ASN 3 N -3.29 6.31 -0.18 2.83 0.01 -1.26 -0.86 114.94 118.51 1brm s ASN 3 Ca 0.57 -0.49 -0.07 0.00 -0.71 0.00 0.00 52.86 52.16 1brm s ASN 3 Cb -0.10 -2.38 -0.04 0.00 0.41 0.00 0.00 41.25 39.14 1brm s ASN 3 CO 0.35 -1.06 0.05 -0.69 -1.51 0.00 0.00 177.10 174.24 1brm s VAL 4 N 3.41 4.69 -0.12 1.60 1.01 0.26 -1.04 120.40 130.22 1brm s VAL 4 Ca 0.25 -0.07 -0.03 0.00 0.00 0.00 0.00 61.98 62.14 1brm s VAL 4 Cb -0.15 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 1brm s VAL 4 CO 0.17 0.46 -0.00 -0.83 0.00 0.00 0.00 175.10 174.91 1brm s GLY 5 N 0.38 1.82 -0.14 4.51 0.00 0.57 0.26 107.32 114.72 1brm s GLY 5 Ca 0.02 -0.80 0.00 0.00 0.00 0.00 0.00 44.72 43.95 1brm s GLY 5 CO 0.00 -0.37 -0.15 -1.36 0.00 0.00 0.00 173.10 171.23 1brm s PHE 6 N -0.41 2.77 -0.05 1.90 0.08 0.12 -0.33 117.98 122.05 1brm s PHE 6 Ca 0.08 -0.91 0.06 0.00 0.12 0.00 0.00 56.93 56.28 1brm s PHE 6 Cb -0.12 -1.86 -0.01 0.00 -0.57 0.00 0.00 43.02 40.46 1brm s PHE 6 CO 0.02 -0.38 -0.24 0.42 -0.10 0.00 0.00 175.22 174.94 1brm s ILE 7 N 0.62 1.93 -0.66 0.64 1.01 -0.62 -2.16 121.20 121.96 1brm s ILE 7 Ca -0.09 -1.00 0.00 0.00 0.00 0.00 0.00 60.65 59.56 1brm s ILE 7 Cb -0.16 -1.63 0.00 0.00 0.01 0.00 0.00 42.46 40.68 1brm s ILE 7 CO 0.03 0.54 0.00 0.61 0.00 0.00 0.00 174.94 176.12 1brm n GLY 8 N 2.97 0.85 0.00 6.18 0.00 -1.26 -0.88 105.19 113.05 1brm n GLY 8 Ca -0.17 -0.65 0.02 0.00 0.00 0.00 0.00 46.02 45.21 1brm n GLY 8 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1brm n TRP 9 N -2.78 0.00 -0.02 1.61 4.27 -1.26 -1.49 117.44 117.77 1brm n TRP 9 Ca -0.06 0.00 0.03 0.00 -3.89 0.00 0.00 57.50 53.58 1brm n TRP 9 Cb 0.22 0.00 -0.10 0.00 -1.36 0.00 0.00 31.31 30.08 1brm n TRP 9 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 1brm n ARG 10 N -0.78 0.84 -0.28 -2.67 1.74 -1.26 -3.24 116.66 111.01 1brm n ARG 10 Ca 0.03 -0.09 -0.29 0.00 -0.77 0.00 0.00 57.85 56.73 1brm n ARG 10 Cb 0.01 -1.30 0.28 0.00 -1.02 0.00 0.00 32.46 30.43 1brm n ARG 10 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1brm n GLY 11 N 1.91 -3.59 0.20 -0.13 0.00 -0.55 -4.41 105.19 98.62 1brm n GLY 11 Ca -0.07 -1.57 -0.15 0.00 0.00 0.00 0.00 46.02 44.23 1brm n GLY 11 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1brm h MET 12 N -3.47 -0.41 -0.23 1.61 4.05 -1.93 0.11 114.93 114.66 1brm h MET 12 Ca -0.42 0.03 0.03 0.00 -0.28 0.00 0.00 59.70 59.05 1brm h MET 12 Cb 1.30 0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 32.17 1brm h MET 12 CO 0.27 -0.24 0.07 0.28 0.23 0.00 0.00 176.91 177.52 1brm h VAL 13 N -0.49 0.93 -0.42 -5.77 2.07 -1.90 -2.29 116.25 108.38 1brm h VAL 13 Ca -0.04 -0.06 0.08 0.00 0.82 0.00 0.00 66.70 67.50 1brm h VAL 13 Cb 0.37 0.74 -0.08 0.00 -1.52 0.00 0.00 31.29 30.81 1brm h VAL 13 CO 0.07 0.03 -0.10 1.23 0.02 0.00 0.00 177.57 178.82 1brm h GLY 14 N 0.17 0.31 1.37 2.17 0.00 -1.63 -0.85 103.07 104.62 1brm h GLY 14 Ca 0.10 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.57 1brm h GLY 14 CO -0.11 -0.16 0.40 1.76 0.00 0.00 0.00 176.54 178.43 1brm h SER 15 N 0.01 0.73 -0.45 0.19 0.02 -0.43 -0.21 113.55 113.41 1brm h SER 15 Ca 0.20 -0.03 -0.12 0.00 -0.84 0.00 0.00 61.79 61.01 1brm h SER 15 Cb 0.30 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.64 1brm h SER 15 CO -0.42 0.55 -0.16 0.58 -1.14 0.00 0.00 176.83 176.23 1brm h VAL 16 N 0.86 1.27 -0.30 2.27 2.07 -0.76 -1.37 116.25 120.28 1brm h VAL 16 Ca 0.23 -1.30 -0.03 0.00 0.82 0.00 0.00 66.70 66.42 1brm h VAL 16 Cb -0.07 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1brm h VAL 16 CO -0.05 0.45 0.09 0.25 0.02 0.00 0.00 177.57 178.33 1brm h LEU 17 N 0.83 0.44 0.61 2.57 5.85 -0.32 -0.61 115.31 124.69 1brm h LEU 17 Ca 0.12 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 1brm h LEU 17 Cb 0.71 -0.12 0.01 0.00 0.37 0.00 0.00 40.66 41.63 1brm h LEU 17 CO 0.05 0.54 -0.29 0.24 -0.34 0.00 0.00 178.44 178.64 1brm h MET 18 N 0.33 -0.79 -0.50 1.25 2.86 -0.95 -0.19 114.93 116.94 1brm h MET 18 Ca 0.10 0.05 0.10 0.00 -2.06 0.00 0.00 59.70 57.89 1brm h MET 18 Cb 0.26 0.18 -0.09 0.00 0.06 0.00 0.00 31.60 32.00 1brm h MET 18 CO -0.00 -0.50 -0.07 1.96 1.06 0.00 0.00 176.91 179.35 1brm h GLN 19 N -0.87 0.04 -0.48 1.72 4.20 -1.24 0.33 115.11 118.81 1brm h GLN 19 Ca -0.08 -0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.63 1brm h GLN 19 Cb 0.65 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.39 1brm h GLN 19 CO 0.14 0.03 0.31 0.00 -0.67 0.00 0.00 178.83 178.64 1brm h ARG 20 N 0.05 0.62 -0.12 1.46 2.47 -1.02 -0.13 114.38 117.71 1brm h ARG 20 Ca 0.25 -0.04 -0.00 0.00 -1.26 0.00 0.00 59.98 58.93 1brm h ARG 20 Cb 0.38 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 28.55 1brm h ARG 20 CO -0.48 0.41 0.08 0.52 0.56 0.00 0.00 179.97 181.06 1brm h MET 21 N 0.64 0.17 -0.77 0.04 2.86 0.27 -0.97 114.93 117.17 1brm h MET 21 Ca 0.18 -0.01 0.12 0.00 -2.06 0.00 0.00 59.70 57.93 1brm h MET 21 Cb -0.06 -0.04 -0.09 0.00 0.06 0.00 0.00 31.60 31.48 1brm h MET 21 CO -0.05 0.15 0.36 0.28 1.06 0.00 0.00 176.91 178.72 1brm h VAL 22 N 0.14 0.76 -0.50 -2.22 2.07 -0.08 0.39 116.25 116.81 1brm h VAL 22 Ca 0.04 -0.19 0.02 0.00 0.82 0.00 0.00 66.70 67.39 1brm h VAL 22 Cb 0.02 0.14 -0.03 0.00 -1.52 0.00 0.00 31.29 29.90 1brm h VAL 22 CO -0.01 0.10 0.30 -0.33 0.02 0.00 0.00 177.57 177.66 1brm h GLU 23 N 0.56 0.59 -0.57 1.57 5.08 -0.23 -2.69 114.58 118.90 1brm h GLU 23 Ca 0.40 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 1brm h GLU 23 Cb 0.53 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1brm h GLU 23 CO -0.34 0.39 0.00 0.39 -1.00 0.00 0.00 179.01 178.45 1brm n GLU 24 N -4.80 2.32 -3.80 2.33 -0.58 -0.44 -4.95 120.64 110.71 1brm n GLU 24 Ca 0.03 -2.04 -0.27 0.00 -0.42 0.00 0.00 57.16 54.46 1brm n GLU 24 Cb 0.07 -1.44 0.04 0.00 -0.57 0.00 0.00 31.44 29.54 1brm n GLU 24 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1brm n ARG 25 N 1.16 -5.95 0.21 3.49 1.74 0.13 -4.87 116.66 112.56 1brm n ARG 25 Ca 0.19 0.65 0.15 0.00 -0.77 0.00 0.00 57.85 58.07 1brm n ARG 25 Cb 0.48 -5.53 0.61 0.00 -1.02 0.00 0.00 32.46 27.00 1brm n ARG 25 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1brm h ASP 26 N -2.17 0.00 -0.13 0.55 5.19 -1.54 -3.11 116.42 115.20 1brm h ASP 26 Ca -0.58 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.83 1brm h ASP 26 Cb 1.37 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.88 1brm h ASP 26 CO 0.63 0.00 0.00 0.49 -3.12 0.00 0.00 179.24 177.24 1brm n PHE 27 N -2.67 0.17 0.10 4.55 3.72 -1.26 -4.03 117.46 118.03 1brm n PHE 27 Ca 0.01 -0.08 0.11 0.00 -0.05 0.00 0.00 57.45 57.44 1brm n PHE 27 Cb 0.25 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.68 1brm n PHE 27 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1brm n ASP 28 N -0.12 0.28 -1.06 4.37 8.00 -1.18 -4.24 116.55 122.60 1brm n ASP 28 Ca 0.10 0.02 0.12 0.00 0.71 0.00 0.00 54.79 55.74 1brm n ASP 28 Cb 0.17 1.51 0.19 0.00 -0.02 0.00 0.00 41.12 42.97 1brm n ASP 28 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1brm n ALA 29 N -2.18 2.44 -4.17 2.24 0.00 -1.26 -4.96 120.51 112.62 1brm n ALA 29 Ca -0.02 -0.87 -0.21 0.00 0.00 0.00 0.00 53.44 52.33 1brm n ALA 29 Cb 0.55 -0.87 -0.06 0.00 0.00 0.00 0.00 19.45 19.06 1brm n ALA 29 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1brm n ILE 30 N 1.38 0.00 -4.06 0.00 -5.35 -1.26 -4.17 119.36 105.90 1brm n ILE 30 Ca 0.18 -2.02 -0.32 0.00 -0.27 0.00 0.00 62.75 60.32 1brm n ILE 30 Cb 0.59 0.88 -0.15 0.00 -1.74 0.00 0.00 39.64 39.22 1brm n ILE 30 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1brm s ARG 31 N -3.21 2.18 0.27 6.28 3.00 -0.04 -4.90 118.95 122.53 1brm s ARG 31 Ca 0.26 -1.33 -0.29 0.00 -1.00 0.00 0.00 55.73 53.37 1brm s ARG 31 Cb 0.01 -2.87 -0.09 0.00 0.00 0.00 0.00 34.95 32.00 1brm s ARG 31 CO 0.18 -0.58 0.97 -1.25 0.00 0.00 0.00 175.30 174.63 1brm s PRO 32 N 1.12 4.73 -0.22 5.12 0.04 -1.26 -0.57 135.00 143.96 1brm s PRO 32 Ca -0.08 1.50 -0.02 0.00 0.04 0.00 0.00 61.00 62.44 1brm s PRO 32 Cb -0.20 -3.12 0.07 0.00 0.04 0.00 0.00 34.50 31.29 1brm s PRO 32 CO -0.05 0.38 0.03 0.08 0.04 0.00 0.00 177.00 177.48 1brm s VAL 33 N -1.30 0.73 -0.03 -0.36 1.01 0.14 -4.91 120.40 115.68 1brm s VAL 33 Ca 0.44 -0.78 -0.14 0.00 0.00 0.00 0.00 61.98 61.51 1brm s VAL 33 Cb -0.25 -1.24 -0.05 0.00 0.00 0.00 0.00 36.38 34.84 1brm s VAL 33 CO 0.31 -0.25 0.37 -0.36 0.00 0.00 0.00 175.10 175.17 1brm s PHE 34 N 1.75 3.70 0.32 5.22 0.08 -1.26 0.10 117.98 127.89 1brm s PHE 34 Ca -0.00 0.91 0.10 0.00 0.12 0.00 0.00 56.93 58.06 1brm s PHE 34 Cb -0.17 -2.25 -0.05 0.00 -0.57 0.00 0.00 43.02 39.97 1brm s PHE 34 CO -0.10 0.63 -0.06 -0.06 -0.10 0.00 0.00 175.22 175.53 1brm s PHE 35 N -0.96 2.48 -0.30 0.36 0.40 -0.92 -1.18 117.98 117.86 1brm s PHE 35 Ca 0.22 -0.40 -0.07 0.00 -0.60 0.00 0.00 56.93 56.08 1brm s PHE 35 Cb -0.16 -1.32 0.18 0.00 0.51 0.00 0.00 43.02 42.23 1brm s PHE 35 CO 0.12 0.57 0.84 0.45 0.70 0.00 0.00 175.22 177.89 1brm s SER 36 N -3.65 -0.90 0.65 1.36 0.15 -0.96 -4.63 113.70 105.73 1brm s SER 36 Ca 0.33 0.56 0.20 0.00 0.70 0.00 0.00 55.95 57.75 1brm s SER 36 Cb -0.01 1.75 1.05 0.00 -1.71 0.00 0.00 66.02 67.10 1brm s SER 36 CO 0.18 -0.17 1.58 0.71 1.20 0.00 0.00 173.24 176.75 1brm h THR 37 N 5.64 0.05 0.00 6.45 1.35 -1.97 -3.29 112.91 121.15 1brm h THR 37 Ca -0.18 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 1brm h THR 37 Cb 1.17 0.40 0.00 0.00 -1.73 0.00 0.00 68.15 67.99 1brm h THR 37 CO 0.07 0.00 0.00 -0.24 -0.25 0.00 0.00 175.52 175.10 1brm n SER 38 N -2.92 0.00 -2.43 5.36 2.88 -1.26 -4.71 113.62 110.54 1brm n SER 38 Ca 0.02 0.15 -0.29 0.00 -1.33 0.00 0.00 58.87 57.42 1brm n SER 38 Cb 0.71 -0.25 0.01 0.00 -0.75 0.00 0.00 64.21 63.93 1brm n SER 38 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1brm n GLN 39 N -1.57 2.39 -1.45 -1.46 6.02 -1.25 -4.99 117.38 115.07 1brm n GLN 39 Ca 0.00 -2.59 -0.58 0.00 -0.01 0.00 0.00 57.00 53.82 1brm n GLN 39 Cb 0.00 -2.08 -0.10 0.00 1.02 0.00 0.00 30.24 29.08 1brm n GLN 39 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1brm n LEU 40 N 0.15 1.44 0.00 1.08 4.77 -1.24 -0.82 117.00 122.38 1brm n LEU 40 Ca 0.48 0.75 0.00 0.00 -0.03 0.00 0.00 56.01 57.21 1brm n LEU 40 Cb 0.50 -1.03 0.00 0.00 -2.33 0.00 0.00 43.42 40.57 1brm n LEU 40 CO 0.46 -0.72 0.00 0.61 -1.33 0.00 0.00 177.39 176.41 1brm n GLY 41 N 6.21 1.33 1.80 -0.72 0.00 0.37 -4.95 105.19 109.22 1brm n GLY 41 Ca 0.43 -0.38 -0.17 0.00 0.00 0.00 0.00 46.02 45.90 1brm n GLY 41 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1brm n GLN 42 N 0.00 -3.46 -1.91 1.61 1.13 -0.00 -3.99 117.38 110.76 1brm n GLN 42 Ca 0.00 -0.80 -0.39 0.00 -1.94 0.00 0.00 57.00 53.87 1brm n GLN 42 Cb 0.00 -1.07 0.01 0.00 0.11 0.00 0.00 30.24 29.30 1brm n GLN 42 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1brm s ALA 43 N -2.06 3.16 0.13 -1.58 0.00 -1.26 -1.14 121.76 119.01 1brm s ALA 43 Ca 0.37 1.34 0.02 0.00 0.00 0.00 0.00 51.96 53.69 1brm s ALA 43 Cb -0.07 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.48 1brm s ALA 43 CO 0.31 -1.07 0.24 0.00 0.00 0.00 0.00 175.76 175.24 1brm s ALA 44 N -1.26 3.91 0.59 0.00 0.00 -0.71 -4.56 121.76 119.73 1brm s ALA 44 Ca 0.62 -1.02 -0.19 0.00 0.00 0.00 0.00 51.96 51.37 1brm s ALA 44 Cb -0.40 -1.72 -0.03 0.00 0.00 0.00 0.00 23.12 20.96 1brm s ALA 44 CO 0.51 0.60 1.23 -1.25 0.00 0.00 0.00 175.76 176.85 1brm s PRO 45 N -3.04 2.95 -0.77 0.00 0.04 -1.26 -4.74 135.00 128.17 1brm s PRO 45 Ca 0.34 1.89 0.02 0.00 0.04 0.00 0.00 61.00 63.28 1brm s PRO 45 Cb -0.11 -1.95 0.34 0.00 0.04 0.00 0.00 34.50 32.82 1brm s PRO 45 CO 0.27 -1.24 1.47 -1.13 0.04 0.00 0.00 177.00 176.41 1brm n SER 46 N -1.56 6.08 -0.07 6.66 3.41 -1.26 -4.78 113.62 122.09 1brm n SER 46 Ca 0.14 -3.72 0.00 0.00 -0.26 0.00 0.00 58.87 55.03 1brm n SER 46 Cb 0.49 -0.86 0.00 0.00 -0.26 0.00 0.00 64.21 63.58 1brm n SER 46 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1brm n PHE 47 N -0.25 0.00 -2.66 7.33 3.72 -1.26 -3.43 117.46 120.91 1brm n PHE 47 Ca 0.42 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.78 1brm n PHE 47 Cb 0.35 -0.01 -0.00 0.00 -0.94 0.00 0.00 39.48 38.88 1brm n PHE 47 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1brm n GLY 48 N -0.06 -0.59 2.42 1.37 0.00 -1.26 -4.69 105.19 102.37 1brm n GLY 48 Ca 0.00 -0.02 -0.15 0.00 0.00 0.00 0.00 46.02 45.86 1brm n GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1brm n GLY 49 N -0.51 -0.42 3.81 -0.02 0.00 -1.22 -4.95 105.19 101.88 1brm n GLY 49 Ca -0.26 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.53 1brm n GLY 49 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1brm s THR 50 N -2.71 4.46 -0.00 2.61 2.01 -1.26 -5.12 115.64 115.63 1brm s THR 50 Ca 0.00 -1.30 -0.01 0.00 0.31 0.00 0.00 61.69 60.69 1brm s THR 50 Cb 0.00 -3.36 -0.00 0.00 0.01 0.00 0.00 72.50 69.14 1brm s THR 50 CO 0.00 -0.27 0.02 0.42 -0.69 0.00 0.00 174.62 174.10 1brm s THR 51 N -2.00 0.03 0.00 -0.82 -4.23 -1.26 -4.37 115.64 102.99 1brm s THR 51 Ca 0.32 -0.27 0.00 0.00 -1.18 0.00 0.00 61.69 60.56 1brm s THR 51 Cb -0.09 -0.12 0.00 0.00 1.34 0.00 0.00 72.50 73.63 1brm s THR 51 CO 0.24 -0.15 0.00 0.61 -0.54 0.00 0.00 174.62 174.79 1brm n GLY 52 N 2.60 -0.04 3.88 3.99 0.00 -1.26 -5.06 105.19 109.30 1brm n GLY 52 Ca -0.16 -0.99 -0.34 0.00 0.00 0.00 0.00 46.02 44.54 1brm n GLY 52 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1brm s THR 53 N -2.00 5.13 -0.16 2.61 -4.23 -1.26 -1.74 115.64 113.99 1brm s THR 53 Ca 0.00 0.31 -0.29 0.00 -1.18 0.00 0.00 61.69 60.53 1brm s THR 53 Cb 0.00 -3.63 -0.02 0.00 1.34 0.00 0.00 72.50 70.18 1brm s THR 53 CO 0.00 0.22 1.42 -0.76 -0.54 0.00 0.00 174.62 174.96 1brm s LEU 54 N -2.13 4.14 0.63 4.79 1.43 -0.29 -4.71 118.68 122.55 1brm s LEU 54 Ca 0.35 1.77 -0.08 0.00 -1.03 0.00 0.00 54.13 55.14 1brm s LEU 54 Cb -0.13 -3.54 0.01 0.00 0.03 0.00 0.00 46.19 42.56 1brm s LEU 54 CO 0.20 -0.91 0.98 -1.10 0.23 0.00 0.00 176.35 175.74 1brm s GLN 55 N 3.88 2.92 -0.37 1.70 -1.52 -0.33 0.14 119.66 126.09 1brm s GLN 55 Ca 0.62 0.20 -0.29 0.00 -1.95 0.00 0.00 55.36 53.94 1brm s GLN 55 Cb -0.25 -2.17 0.01 0.00 -0.22 0.00 0.00 33.01 30.38 1brm s GLN 55 CO 0.22 -0.82 1.26 0.34 -0.25 0.00 0.00 175.29 176.03 1brm s ASP 56 N -4.32 6.62 0.66 5.90 -1.08 -1.26 -2.26 116.67 120.92 1brm s ASP 56 Ca 0.55 0.93 0.33 0.00 -0.52 0.00 0.00 52.55 53.84 1brm s ASP 56 Cb -0.11 -2.54 1.80 0.00 -1.46 0.00 0.00 42.92 40.61 1brm s ASP 56 CO 0.48 -1.17 2.03 0.00 0.52 0.00 0.00 175.17 177.03 1brm h ALA 57 N 9.43 1.35 -0.31 3.66 0.00 -1.91 0.77 119.26 132.24 1brm h ALA 57 Ca -0.25 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1brm h ALA 57 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1brm h ALA 57 CO 1.07 -0.28 0.00 1.19 0.00 0.00 0.00 179.25 181.23 1brm n PHE 58 N -3.06 0.72 -2.68 0.00 3.72 -1.26 -4.88 117.46 110.03 1brm n PHE 58 Ca -0.01 -0.68 -0.42 0.00 -0.05 0.00 0.00 57.45 56.29 1brm n PHE 58 Cb 0.33 -0.17 -0.03 0.00 -0.94 0.00 0.00 39.48 38.67 1brm n PHE 58 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1brm s ASP 59 N -1.44 6.43 0.28 4.37 -1.08 0.26 -4.85 116.67 120.65 1brm s ASP 59 Ca 0.33 -1.35 0.01 0.00 -0.52 0.00 0.00 52.55 51.02 1brm s ASP 59 Cb 0.23 -2.51 0.56 0.00 -1.46 0.00 0.00 42.92 39.74 1brm s ASP 59 CO 0.13 -1.46 1.82 -0.07 0.52 0.00 0.00 175.17 176.11 1brm h LEU 60 N 12.13 0.87 -0.08 -1.34 3.38 -1.90 -0.65 115.31 127.72 1brm h LEU 60 Ca 0.05 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.08 1brm h LEU 60 Cb 1.03 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 1brm h LEU 60 CO 1.30 0.44 0.02 -0.33 0.09 0.00 0.00 178.44 179.96 1brm h GLU 61 N 0.93 0.06 -0.11 1.13 5.08 -1.97 0.35 114.58 120.05 1brm h GLU 61 Ca 0.50 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.82 1brm h GLU 61 Cb 0.54 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1brm h GLU 61 CO -0.29 0.04 -0.12 0.00 -1.00 0.00 0.00 179.01 177.65 1brm h ALA 62 N 1.05 1.61 -0.07 3.43 0.00 -1.70 -2.79 119.26 120.80 1brm h ALA 62 Ca 0.04 -0.17 -0.23 0.00 0.00 0.00 0.00 54.91 54.54 1brm h ALA 62 Cb 0.02 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 17.76 1brm h ALA 62 CO -0.04 0.29 -0.86 -0.07 0.00 0.00 0.00 179.25 178.56 1brm h LEU 63 N 0.16 0.88 -2.25 0.00 3.38 -0.59 -3.12 115.31 113.77 1brm h LEU 63 Ca 0.03 -0.69 -0.01 0.00 0.09 0.00 0.00 57.88 57.31 1brm h LEU 63 Cb 0.31 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1brm h LEU 63 CO 0.02 1.44 -0.03 0.11 0.09 0.00 0.00 178.44 180.07 1brm h LYS 64 N 0.39 0.00 0.00 1.13 1.57 -0.69 -1.46 116.57 117.52 1brm h LYS 64 Ca -0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1brm h LYS 64 Cb 1.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.82 1brm h LYS 64 CO 0.17 0.03 0.00 0.00 -0.57 0.00 0.00 179.45 179.08 1brm n ALA 65 N -2.37 1.76 -2.27 3.86 0.00 -1.10 -4.81 120.51 115.58 1brm n ALA 65 Ca -0.03 0.04 -0.29 0.00 0.00 0.00 0.00 53.44 53.17 1brm n ALA 65 Cb 0.12 -1.38 -0.02 0.00 0.00 0.00 0.00 19.45 18.17 1brm n ALA 65 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1brm s LEU 66 N -4.21 3.79 -0.15 0.00 1.43 -0.55 -4.95 118.68 114.03 1brm s LEU 66 Ca 0.06 0.98 0.02 0.00 -1.03 0.00 0.00 54.13 54.16 1brm s LEU 66 Cb 0.10 -3.88 -0.23 0.00 0.03 0.00 0.00 46.19 42.21 1brm s LEU 66 CO 0.40 -0.44 0.22 0.47 0.23 0.00 0.00 176.35 177.24 1brm n ASP 67 N -1.62 1.59 -4.00 2.29 8.00 -0.21 -4.78 116.55 117.83 1brm n ASP 67 Ca 0.01 0.12 -0.13 0.00 0.71 0.00 0.00 54.79 55.50 1brm n ASP 67 Cb 0.54 -0.36 -0.13 0.00 -0.02 0.00 0.00 41.12 41.16 1brm n ASP 67 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1brm s ILE 68 N -2.55 0.38 -0.08 0.53 1.01 -1.02 -0.95 121.20 118.53 1brm s ILE 68 Ca -0.21 -0.67 0.01 0.00 0.00 0.00 0.00 60.65 59.78 1brm s ILE 68 Cb 0.07 -0.42 0.02 0.00 0.01 0.00 0.00 42.46 42.15 1brm s ILE 68 CO 0.74 -0.20 -0.11 -0.63 0.00 0.00 0.00 174.94 174.74 1brm s ILE 69 N -0.85 1.13 -0.34 2.92 1.01 -0.16 -0.32 121.20 124.59 1brm s ILE 69 Ca -0.06 -0.44 -0.00 0.00 0.00 0.00 0.00 60.65 60.15 1brm s ILE 69 Cb -0.06 -1.07 0.08 0.00 0.01 0.00 0.00 42.46 41.42 1brm s ILE 69 CO -0.00 0.37 0.07 -0.69 0.00 0.00 0.00 174.94 174.69 1brm s VAL 70 N 0.99 2.85 -0.07 2.92 1.01 0.55 -0.25 120.40 128.38 1brm s VAL 70 Ca -0.08 -1.86 -0.03 0.00 0.00 0.00 0.00 61.98 60.00 1brm s VAL 70 Cb -0.15 -2.86 -0.04 0.00 0.00 0.00 0.00 36.38 33.34 1brm s VAL 70 CO -0.00 -0.41 0.07 0.42 0.00 0.00 0.00 175.10 175.17 1brm s THR 71 N 1.12 4.80 -0.03 3.92 -4.23 -0.42 -1.60 115.64 119.20 1brm s THR 71 Ca 0.03 -0.15 0.10 0.00 -1.18 0.00 0.00 61.69 60.49 1brm s THR 71 Cb -0.21 -3.09 0.18 0.00 1.34 0.00 0.00 72.50 70.72 1brm s THR 71 CO -0.04 0.54 1.08 0.00 -0.54 0.00 0.00 174.62 175.66 1brm h GLN 73 N 0.34 0.03 0.00 0.00 5.75 -1.82 -3.44 115.11 115.98 1brm h GLN 73 Ca -0.06 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.38 1brm h GLN 73 Cb 1.46 0.02 0.00 0.00 1.07 0.00 0.00 27.48 30.03 1brm h GLN 73 CO 0.03 0.91 0.00 0.41 -2.65 0.00 0.00 178.83 177.53 1brm n GLY 74 N 1.43 2.49 0.24 2.39 0.00 -1.26 -4.74 105.19 105.73 1brm n GLY 74 Ca -0.05 -2.10 0.09 0.00 0.00 0.00 0.00 46.02 43.96 1brm n GLY 74 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1brm h GLY 75 N 0.00 0.00 0.98 -0.02 0.00 -1.97 -2.08 103.07 99.98 1brm h GLY 75 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1brm h GLY 75 CO 0.00 0.00 0.27 -0.55 0.00 0.00 0.00 176.54 176.26 1brm h ASP 76 N 0.00 0.73 0.56 0.19 5.19 -1.98 0.35 116.42 121.45 1brm h ASP 76 Ca -0.00 -0.13 -0.03 0.00 -0.62 0.00 0.00 57.03 56.25 1brm h ASP 76 Cb 0.44 -0.19 0.01 0.00 0.18 0.00 0.00 39.33 39.77 1brm h ASP 76 CO 0.03 0.65 -0.27 0.22 -3.12 0.00 0.00 179.24 176.75 1brm h TYR 77 N 0.75 -0.69 -0.70 4.55 3.20 -1.80 -3.11 116.97 119.17 1brm h TYR 77 Ca 0.19 -0.02 0.15 0.00 3.14 0.00 0.00 58.73 62.20 1brm h TYR 77 Cb 0.12 0.23 -0.12 0.00 1.54 0.00 0.00 36.73 38.49 1brm h TYR 77 CO -0.00 -0.42 -0.05 1.15 -1.64 0.00 0.00 178.16 177.20 1brm h THR 78 N -1.19 0.37 0.00 1.81 2.02 -1.32 0.23 112.91 114.82 1brm h THR 78 Ca -0.08 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.08 1brm h THR 78 Cb 0.58 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 1brm h THR 78 CO 0.13 0.01 0.00 0.78 0.37 0.00 0.00 175.52 176.81 1brm h ASN 79 N 0.07 0.00 0.00 4.18 2.35 -0.37 -2.03 115.58 119.78 1brm h ASN 79 Ca 0.37 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.79 1brm h ASN 79 Cb 0.61 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.93 1brm h ASN 79 CO -0.64 0.00 -2.06 1.21 -1.65 0.00 0.00 177.43 174.29 1brm n GLU 80 N -2.36 0.57 0.04 0.81 2.13 0.63 -4.71 120.64 117.75 1brm n GLU 80 Ca 0.00 0.27 -0.11 0.00 0.66 0.00 0.00 57.16 57.98 1brm n GLU 80 Cb 0.14 -1.49 -0.08 0.00 0.27 0.00 0.00 31.44 30.28 1brm n GLU 80 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 1brm h ILE 81 N -1.00 0.91 -0.95 6.31 1.08 -1.09 -3.34 117.51 119.44 1brm h ILE 81 Ca -0.49 -1.18 0.09 0.00 -0.39 0.00 0.00 64.86 62.88 1brm h ILE 81 Cb 1.42 1.54 -0.11 0.00 -3.07 0.00 0.00 36.82 36.60 1brm h ILE 81 CO -0.30 0.24 -0.56 0.00 -0.69 0.00 0.00 178.15 176.84 1brm n TYR 82 N -4.90 -0.41 0.01 1.37 9.36 -0.76 -0.89 117.16 120.93 1brm n TYR 82 Ca -0.08 1.18 0.00 0.00 3.32 0.00 0.00 57.90 62.33 1brm n TYR 82 Cb 0.27 -0.58 0.32 0.00 -0.63 0.00 0.00 39.34 38.72 1brm n TYR 82 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1brm h PRO 83 N 0.00 0.50 -0.63 2.98 0.13 -1.76 -0.97 132.00 132.25 1brm h PRO 83 Ca 0.15 -0.10 -0.01 0.00 -0.87 0.00 0.00 66.00 65.17 1brm h PRO 83 Cb 0.39 -0.08 -0.03 0.00 0.13 0.00 0.00 31.00 31.41 1brm h PRO 83 CO -0.89 0.52 0.35 0.87 -0.23 0.00 0.00 178.00 178.62 1brm h LYS 84 N 0.48 0.86 0.03 0.86 1.57 -1.13 0.15 116.57 119.39 1brm h LYS 84 Ca 0.11 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1brm h LYS 84 Cb 0.30 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1brm h LYS 84 CO 0.01 0.62 -0.01 -0.07 -0.57 0.00 0.00 179.45 179.43 1brm h LEU 85 N 0.87 -0.03 -0.56 2.94 3.38 -0.67 -2.88 115.31 118.35 1brm h LEU 85 Ca 0.22 -0.68 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1brm h LEU 85 Cb 0.01 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 1brm h LEU 85 CO -0.04 0.72 0.36 0.03 0.09 0.00 0.00 178.44 179.60 1brm h ARG 86 N -0.85 0.75 0.00 1.13 2.47 -1.10 -0.93 114.38 115.85 1brm h ARG 86 Ca -0.00 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 1brm h ARG 86 Cb 0.72 -0.16 0.00 0.00 -1.65 0.00 0.00 29.97 28.87 1brm h ARG 86 CO 0.01 0.52 0.00 0.93 0.56 0.00 0.00 179.97 181.99 1brm h GLU 87 N 0.76 0.00 -0.07 0.04 5.08 -0.82 -0.38 114.58 119.19 1brm h GLU 87 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1brm h GLU 87 Cb -0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1brm h GLU 87 CO -0.04 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 176.84 1brm n SER 88 N -2.68 1.81 0.00 1.42 3.41 -0.45 -4.93 113.62 112.19 1brm n SER 88 Ca 0.00 -1.63 0.00 0.00 -0.26 0.00 0.00 58.87 56.98 1brm n SER 88 Cb 0.22 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 1brm n SER 88 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1brm n GLY 89 N 1.20 0.65 3.67 5.00 0.00 -0.15 -5.04 105.19 110.53 1brm n GLY 89 Ca 0.18 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.71 1brm n GLY 89 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1brm n TRP 90 N -2.00 2.25 -1.35 1.61 -0.00 -0.66 -4.88 117.44 112.42 1brm n TRP 90 Ca 0.00 0.15 0.00 0.00 -0.00 0.00 0.00 57.50 57.66 1brm n TRP 90 Cb 0.00 -2.59 0.21 0.00 -0.00 0.00 0.00 31.31 28.92 1brm n TRP 90 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 177.69 178.73 1brm n GLN 91 N 5.26 1.98 -1.79 5.87 6.02 -1.26 -4.47 117.38 128.99 1brm n GLN 91 Ca 0.21 -3.09 -0.29 0.00 -0.01 0.00 0.00 57.00 53.82 1brm n GLN 91 Cb 0.28 -1.78 0.15 0.00 1.02 0.00 0.00 30.24 29.91 1brm n GLN 91 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1brm s GLY 92 N -2.52 1.67 0.10 1.08 0.00 -1.26 -4.98 107.32 101.41 1brm s GLY 92 Ca 0.42 -0.89 -0.24 0.00 0.00 0.00 0.00 44.72 44.01 1brm s GLY 92 CO 0.01 -0.24 0.74 -0.19 0.00 0.00 0.00 173.10 173.42 1brm s TYR 93 N -3.62 3.82 -0.26 1.90 2.02 -0.13 -4.81 117.35 116.29 1brm s TYR 93 Ca 0.68 1.51 0.03 0.00 -0.37 0.00 0.00 57.07 58.92 1brm s TYR 93 Cb -0.08 -2.74 0.06 0.00 -0.40 0.00 0.00 41.96 38.79 1brm s TYR 93 CO 0.52 0.43 -0.10 -0.46 -1.57 0.00 0.00 175.55 174.37 1brm s TRP 94 N -0.71 3.11 -0.37 2.71 -0.11 0.13 -0.99 118.94 122.70 1brm s TRP 94 Ca 0.36 -2.22 -0.10 0.00 1.22 0.00 0.00 56.10 55.35 1brm s TRP 94 Cb -0.21 -1.87 0.03 0.00 -1.50 0.00 0.00 33.47 29.92 1brm s TRP 94 CO 0.24 -0.86 0.18 0.42 -4.62 0.00 0.00 176.95 172.31 1brm s ILE 95 N 1.16 4.37 0.12 5.86 1.01 0.65 -0.72 121.20 133.64 1brm s ILE 95 Ca -0.08 -0.94 0.09 0.00 0.00 0.00 0.00 60.65 59.72 1brm s ILE 95 Cb -0.20 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 38.78 1brm s ILE 95 CO -0.05 -0.23 -0.20 -0.62 0.00 0.00 0.00 174.94 173.83 1brm s ASP 96 N 1.52 3.74 -0.11 3.58 -1.08 -0.51 -1.31 116.67 122.50 1brm s ASP 96 Ca 0.01 -0.61 0.20 0.00 -0.52 0.00 0.00 52.55 51.63 1brm s ASP 96 Cb -0.19 -0.46 -0.29 0.00 -1.46 0.00 0.00 42.92 40.51 1brm s ASP 96 CO 0.06 0.18 0.28 0.00 0.52 0.00 0.00 175.17 176.21 1brm n ALA 97 N 0.84 2.18 -1.77 3.66 0.00 -1.11 -0.74 120.51 123.58 1brm n ALA 97 Ca -0.16 -0.89 -0.37 0.00 0.00 0.00 0.00 53.44 52.02 1brm n ALA 97 Cb 0.53 -0.47 -0.00 0.00 0.00 0.00 0.00 19.45 19.51 1brm n ALA 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1brm s ALA 98 N -3.01 2.89 0.00 0.00 0.00 -1.26 -4.58 121.76 115.80 1brm s ALA 98 Ca -0.09 0.93 0.22 0.00 0.00 0.00 0.00 51.96 53.02 1brm s ALA 98 Cb 0.10 -3.39 0.64 0.00 0.00 0.00 0.00 23.12 20.47 1brm s ALA 98 CO 0.86 -0.73 1.70 0.66 0.00 0.00 0.00 175.76 178.25 1brm h SER 99 N 1.80 0.00 -0.52 0.00 4.64 -1.93 -3.38 113.55 114.15 1brm h SER 99 Ca -0.50 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 60.91 1brm h SER 99 Cb 1.25 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.25 1brm h SER 99 CO 0.59 0.28 -0.18 -1.20 -0.87 0.00 0.00 176.83 175.45 1brm n SER 100 N -3.31 -0.29 -0.16 4.97 7.64 -1.26 -0.67 113.62 120.54 1brm n SER 100 Ca 0.01 0.91 0.12 0.00 1.01 0.00 0.00 58.87 60.92 1brm n SER 100 Cb 0.52 -0.23 0.20 0.00 -1.01 0.00 0.00 64.21 63.69 1brm n SER 100 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1brm n LEU 101 N -4.80 1.00 -0.32 -3.43 4.77 -1.26 -4.50 117.00 108.45 1brm n LEU 101 Ca 0.06 -0.29 0.18 0.00 -0.03 0.00 0.00 56.01 55.93 1brm n LEU 101 Cb 0.23 -0.13 0.36 0.00 -2.33 0.00 0.00 43.42 41.55 1brm n LEU 101 CO -0.07 0.21 0.91 0.03 -1.33 0.00 0.00 177.39 177.14 1brm h ARG 102 N 0.80 0.08 -0.22 3.23 3.08 -1.14 0.55 114.38 120.75 1brm h ARG 102 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1brm h ARG 102 Cb 0.54 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.57 1brm h ARG 102 CO 0.00 0.05 0.00 -1.33 -1.07 0.00 0.00 179.97 177.62 1brm n MET 103 N -5.35 1.81 -2.19 0.04 2.81 -1.26 -4.61 117.12 108.37 1brm n MET 103 Ca 0.26 -1.23 -0.40 0.00 -1.81 0.00 0.00 57.70 54.52 1brm n MET 103 Cb 0.85 -1.39 -0.02 0.00 -0.71 0.00 0.00 33.22 31.95 1brm n MET 103 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1brm s LYS 104 N -1.72 4.22 0.51 0.03 -0.14 0.18 -4.91 119.74 117.92 1brm s LYS 104 Ca 0.31 2.05 0.29 0.00 -1.36 0.00 0.00 55.97 57.26 1brm s LYS 104 Cb 0.17 -2.91 1.31 0.00 -1.68 0.00 0.00 37.83 34.72 1brm s LYS 104 CO 0.25 -0.24 1.99 -0.44 -0.76 0.00 0.00 175.35 176.14 1brm h ASP 105 N 3.07 0.00 -0.57 2.83 3.32 -1.91 -2.46 116.42 120.70 1brm h ASP 105 Ca -0.49 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.52 1brm h ASP 105 Cb 1.23 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.76 1brm h ASP 105 CO 0.64 0.13 0.05 -0.90 -1.72 0.00 0.00 179.24 177.44 1brm n ASP 106 N -3.40 5.38 -4.25 6.45 5.75 -1.26 -4.93 116.55 120.30 1brm n ASP 106 Ca -0.01 -3.01 -0.22 0.00 -0.01 0.00 0.00 54.79 51.55 1brm n ASP 106 Cb 0.31 -0.68 -0.12 0.00 -1.03 0.00 0.00 41.12 39.59 1brm n ASP 106 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1brm s ALA 107 N -2.83 1.59 -0.06 2.12 0.00 -0.93 -4.22 121.76 117.43 1brm s ALA 107 Ca 0.54 -1.17 0.05 0.00 0.00 0.00 0.00 51.96 51.38 1brm s ALA 107 Cb 0.42 -0.19 -0.01 0.00 0.00 0.00 0.00 23.12 23.34 1brm s ALA 107 CO 0.15 0.28 -0.22 0.42 0.00 0.00 0.00 175.76 176.39 1brm s ILE 108 N -1.26 1.85 -0.30 0.00 1.01 -0.38 -4.75 121.20 117.36 1brm s ILE 108 Ca 0.04 -0.94 -0.26 0.00 0.00 0.00 0.00 60.65 59.49 1brm s ILE 108 Cb -0.10 -1.57 0.01 0.00 0.01 0.00 0.00 42.46 40.81 1brm s ILE 108 CO 0.04 0.52 0.92 -0.63 0.00 0.00 0.00 174.94 175.78 1brm s ILE 109 N -0.03 4.68 -0.02 2.92 1.01 -1.26 -0.66 121.20 127.84 1brm s ILE 109 Ca -0.06 1.46 -0.21 0.00 0.00 0.00 0.00 60.65 61.84 1brm s ILE 109 Cb -0.14 -4.26 -0.05 0.00 0.01 0.00 0.00 42.46 38.02 1brm s ILE 109 CO 0.04 -0.33 0.61 0.27 0.00 0.00 0.00 174.94 175.53 1brm s ILE 110 N 3.23 4.95 -0.41 2.92 -4.36 0.10 -4.80 121.20 122.84 1brm s ILE 110 Ca 0.38 1.26 0.02 0.00 -0.26 0.00 0.00 60.65 62.06 1brm s ILE 110 Cb -0.13 -3.94 0.26 0.00 1.25 0.00 0.00 42.46 39.89 1brm s ILE 110 CO 0.13 0.38 1.08 -0.11 0.24 0.00 0.00 174.94 176.67 1brm n LEU 111 N 2.97 -2.07 -0.31 0.37 7.94 -1.26 -4.38 117.00 120.25 1brm n LEU 111 Ca -0.06 -2.57 0.17 0.00 -1.11 0.00 0.00 56.01 52.44 1brm n LEU 111 Cb 0.51 0.72 0.35 0.00 0.53 0.00 0.00 43.42 45.54 1brm n LEU 111 CO 0.44 1.79 1.00 -2.24 -1.11 0.00 0.00 177.39 177.27 1brm h ASP 112 N 3.48 0.16 0.15 1.96 2.03 -1.91 0.48 116.42 122.77 1brm h ASP 112 Ca -0.19 0.20 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1brm h ASP 112 Cb 1.12 0.23 0.00 0.00 -0.83 0.00 0.00 39.33 39.85 1brm h ASP 112 CO 0.07 -0.15 0.00 -0.65 -1.03 0.00 0.00 179.24 177.48 1brm h PRO 113 N 0.25 0.00 0.00 4.15 0.11 -1.99 -1.79 132.00 132.72 1brm h PRO 113 Ca 0.61 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 66.48 1brm h PRO 113 Cb 1.30 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.37 1brm h PRO 113 CO -0.64 0.00 -1.83 0.28 -0.21 0.00 0.00 178.00 175.60 1brm n VAL 114 N -2.44 0.82 -2.30 3.15 0.31 0.11 -4.83 118.33 113.15 1brm n VAL 114 Ca -0.01 -0.24 -0.21 0.00 -0.01 0.00 0.00 64.34 63.87 1brm n VAL 114 Cb 0.08 -1.52 0.02 0.00 -0.91 0.00 0.00 33.84 31.51 1brm n VAL 114 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1brm n ASN 115 N -3.47 4.21 -0.26 4.52 6.94 0.13 -4.84 115.26 122.48 1brm n ASN 115 Ca -0.28 -3.46 0.02 0.00 -0.02 0.00 0.00 54.58 50.84 1brm n ASN 115 Cb 0.72 -0.41 0.15 0.00 -2.36 0.00 0.00 39.78 37.89 1brm n ASN 115 CO 0.00 0.00 0.00 -0.61 -1.03 0.00 0.00 177.26 175.62 1brm h GLN 116 N 2.41 0.65 -0.82 -3.83 5.75 -1.51 -1.32 115.11 116.44 1brm h GLN 116 Ca 0.25 -0.04 0.04 0.00 -0.15 0.00 0.00 58.65 58.76 1brm h GLN 116 Cb 1.30 -0.15 -0.05 0.00 1.07 0.00 0.00 27.48 29.65 1brm h GLN 116 CO 0.70 0.43 0.54 0.38 -2.65 0.00 0.00 178.83 178.23 1brm h ASP 117 N 0.66 0.86 0.77 -0.69 2.03 -1.88 0.16 116.42 118.33 1brm h ASP 117 Ca 0.37 -0.01 -0.11 0.00 -0.73 0.00 0.00 57.03 56.55 1brm h ASP 117 Cb 0.39 -0.20 -0.02 0.00 -0.83 0.00 0.00 39.33 38.68 1brm h ASP 117 CO -0.27 0.59 -0.54 0.58 -1.03 0.00 0.00 179.24 178.57 1brm h VAL 118 N 1.00 1.21 0.04 4.15 2.07 -1.64 -1.03 116.25 122.05 1brm h VAL 118 Ca 0.33 -1.96 -0.00 0.00 0.82 0.00 0.00 66.70 65.89 1brm h VAL 118 Cb 0.08 2.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1brm h VAL 118 CO -0.10 0.53 -0.02 0.40 0.02 0.00 0.00 177.57 178.39 1brm h ILE 119 N 0.00 1.34 -0.41 4.57 2.04 -0.53 -2.34 117.51 122.18 1brm h ILE 119 Ca -0.01 -1.61 0.06 0.00 1.00 0.00 0.00 64.86 64.30 1brm h ILE 119 Cb 1.07 2.35 -0.05 0.00 -0.74 0.00 0.00 36.82 39.45 1brm h ILE 119 CO 0.07 0.39 0.12 0.74 0.00 0.00 0.00 178.15 179.46 1brm h THR 120 N -0.81 0.84 0.75 -0.27 2.02 -0.72 0.28 112.91 114.99 1brm h THR 120 Ca -0.01 -0.09 -0.03 0.00 0.77 0.00 0.00 66.41 67.05 1brm h THR 120 Cb 0.67 0.55 -0.00 0.00 -1.74 0.00 0.00 68.15 67.63 1brm h THR 120 CO 0.01 0.05 -0.47 -0.78 0.37 0.00 0.00 175.52 174.70 1brm h ASP 121 N 0.26 -1.20 -0.55 4.18 3.58 -1.26 -1.27 116.42 120.16 1brm h ASP 121 Ca 0.19 0.07 0.12 0.00 0.42 0.00 0.00 57.03 57.83 1brm h ASP 121 Cb 0.20 0.35 -0.03 0.00 1.72 0.00 0.00 39.33 41.58 1brm h ASP 121 CO -0.22 -0.72 0.38 1.23 -2.88 0.00 0.00 179.24 177.02 1brm h GLY 122 N -1.15 0.32 1.00 -0.78 0.00 -1.15 0.15 103.07 101.45 1brm h GLY 122 Ca -0.10 -0.09 -0.03 0.00 0.00 0.00 0.00 47.33 47.12 1brm h GLY 122 CO 0.09 0.05 0.31 1.41 0.00 0.00 0.00 176.54 178.39 1brm h LEU 123 N 0.21 0.86 -0.76 3.11 3.38 0.14 0.11 115.31 122.36 1brm h LEU 123 Ca 0.26 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 1brm h LEU 123 Cb 0.74 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1brm h LEU 123 CO -0.05 0.76 -0.33 0.78 0.09 0.00 0.00 178.44 179.69 1brm h ASN 124 N 0.90 0.00 -0.34 -0.43 2.35 0.34 -3.06 115.58 115.34 1brm h ASN 124 Ca 0.22 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 1brm h ASN 124 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1brm h ASN 124 CO -0.03 0.33 0.00 0.59 -1.65 0.00 0.00 177.43 176.68 1brm n ASN 125 N -3.39 2.64 -0.54 5.81 3.02 0.11 -4.91 115.26 118.01 1brm n ASN 125 Ca 0.01 -2.21 -0.02 0.00 -0.03 0.00 0.00 54.58 52.32 1brm n ASN 125 Cb 0.53 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 1brm n ASN 125 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1brm n GLY 126 N 0.75 0.56 3.64 7.41 0.00 -1.02 -5.01 105.19 111.51 1brm n GLY 126 Ca 0.13 -0.69 -0.39 0.00 0.00 0.00 0.00 46.02 45.08 1brm n GLY 126 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1brm s ILE 127 N -2.59 5.16 -0.53 -0.61 -1.09 0.34 -4.93 121.20 116.95 1brm s ILE 127 Ca 0.03 0.70 0.08 0.00 -2.23 0.00 0.00 60.65 59.24 1brm s ILE 127 Cb -0.01 -3.74 0.22 0.00 -1.58 0.00 0.00 42.46 37.35 1brm s ILE 127 CO 0.04 0.19 1.18 0.54 -1.23 0.00 0.00 174.94 175.66 1brm n ARG 128 N 4.97 2.85 -3.97 2.79 5.12 -1.26 -4.58 116.66 122.58 1brm n ARG 128 Ca -0.07 -1.96 -0.30 0.00 -1.93 0.00 0.00 57.85 53.59 1brm n ARG 128 Cb 0.51 -1.24 -0.16 0.00 -1.16 0.00 0.00 32.46 30.41 1brm n ARG 128 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1brm s THR 129 N -1.23 1.45 -0.13 0.55 2.01 -1.26 0.17 115.64 117.21 1brm s THR 129 Ca 0.18 -0.73 0.00 0.00 0.31 0.00 0.00 61.69 61.45 1brm s THR 129 Cb 0.11 -1.48 0.02 0.00 0.01 0.00 0.00 72.50 71.16 1brm s THR 129 CO 0.10 0.28 -0.11 -0.36 -0.69 0.00 0.00 174.62 173.84 1brm s PHE 130 N 1.51 1.79 0.02 4.92 0.08 0.10 -1.25 117.98 125.15 1brm s PHE 130 Ca 0.02 -0.94 0.06 0.00 0.12 0.00 0.00 56.93 56.19 1brm s PHE 130 Cb -0.14 -1.39 -0.03 0.00 -0.57 0.00 0.00 43.02 40.89 1brm s PHE 130 CO -0.09 -0.57 -0.18 0.08 -0.10 0.00 0.00 175.22 174.36 1brm s VAL 131 N 1.56 2.80 0.48 -0.44 1.01 0.16 -1.42 120.40 124.55 1brm s VAL 131 Ca 0.04 -1.09 -0.20 0.00 0.00 0.00 0.00 61.98 60.73 1brm s VAL 131 Cb -0.13 -2.15 -0.09 0.00 0.00 0.00 0.00 36.38 34.01 1brm s VAL 131 CO -0.09 0.40 1.01 -0.83 0.00 0.00 0.00 175.10 175.59 1brm s GLY 132 N -1.25 2.40 0.17 4.51 0.00 0.08 0.02 107.32 113.24 1brm s GLY 132 Ca 0.14 0.49 0.03 0.00 0.00 0.00 0.00 44.72 45.37 1brm s GLY 132 CO 0.04 0.79 0.23 0.61 0.00 0.00 0.00 173.10 174.77 1brm n GLY 133 N -0.55 1.91 3.56 0.20 0.00 -1.26 -4.75 105.19 104.30 1brm n GLY 133 Ca 0.08 -2.15 -0.49 0.00 0.00 0.00 0.00 46.02 43.46 1brm n GLY 133 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1brm n ASN 134 N -2.81 1.08 0.23 1.61 2.85 -1.26 -4.82 115.26 112.14 1brm n ASN 134 Ca 0.05 1.14 0.16 0.00 -0.11 0.00 0.00 54.58 55.82 1brm n ASN 134 Cb 0.17 -1.18 0.76 0.00 1.24 0.00 0.00 39.78 40.77 1brm n ASN 134 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1brm n THR 136 N -2.67 1.52 -0.14 0.00 -2.24 -1.26 -3.80 114.28 105.70 1brm n THR 136 Ca -0.01 -0.14 -0.04 0.00 -2.27 0.00 0.00 64.05 61.60 1brm n THR 136 Cb 0.15 -2.03 0.03 0.00 -2.10 0.00 0.00 70.33 66.38 1brm n THR 136 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1brm h VAL 137 N -1.00 0.57 -0.01 2.28 2.07 -1.78 0.15 116.25 118.53 1brm h VAL 137 Ca -0.44 -0.01 0.02 0.00 0.82 0.00 0.00 66.70 67.09 1brm h VAL 137 Cb 1.34 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.61 1brm h VAL 137 CO -0.26 0.01 -0.42 0.28 0.02 0.00 0.00 177.57 177.19 1brm h SER 138 N 0.03 -1.30 -0.92 0.57 0.02 -1.32 0.14 113.55 110.76 1brm h SER 138 Ca 0.22 0.15 0.07 0.00 -0.84 0.00 0.00 61.79 61.39 1brm h SER 138 Cb 0.34 0.50 -0.07 0.00 0.14 0.00 0.00 62.40 63.30 1brm h SER 138 CO -0.44 -0.40 0.58 -0.07 -1.14 0.00 0.00 176.83 175.35 1brm h LEU 139 N -0.52 0.90 -0.34 5.07 3.38 -1.56 -0.03 115.31 122.22 1brm h LEU 139 Ca 0.01 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1brm h LEU 139 Cb 0.56 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1brm h LEU 139 CO -0.29 0.56 0.22 -0.03 0.09 0.00 0.00 178.44 178.99 1brm h MET 140 N 1.03 0.45 -0.49 1.13 4.05 -0.04 -2.14 114.93 118.90 1brm h MET 140 Ca 0.41 -0.03 -0.11 0.00 -0.28 0.00 0.00 59.70 59.69 1brm h MET 140 Cb 0.23 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 30.91 1brm h MET 140 CO -0.19 0.31 -0.14 -0.07 0.23 0.00 0.00 176.91 177.05 1brm h LEU 141 N 0.45 0.94 -1.59 3.39 3.38 -0.13 0.28 115.31 122.03 1brm h LEU 141 Ca 0.12 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.79 1brm h LEU 141 Cb -0.04 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 1brm h LEU 141 CO -0.03 1.07 0.28 0.24 0.09 0.00 0.00 178.44 180.10 1brm h MET 142 N 0.83 0.55 0.00 1.13 2.86 -0.79 0.27 114.93 119.79 1brm h MET 142 Ca 0.13 -0.03 -0.08 0.00 -2.06 0.00 0.00 59.70 57.66 1brm h MET 142 Cb 0.68 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 1brm h MET 142 CO 0.05 0.36 -0.53 0.77 1.06 0.00 0.00 176.91 178.62 1brm h SER 143 N 0.56 0.00 -0.29 1.22 0.02 -1.01 -3.38 113.55 110.66 1brm h SER 143 Ca 0.16 -0.44 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 1brm h SER 143 Cb -0.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.49 1brm h SER 143 CO -0.03 1.02 0.00 0.18 -1.14 0.00 0.00 176.83 176.86 1brm n LEU 144 N -4.58 2.74 -0.13 5.07 4.77 0.96 -4.54 117.00 121.28 1brm n LEU 144 Ca -0.15 -1.38 -0.08 0.00 -0.03 0.00 0.00 56.01 54.37 1brm n LEU 144 Cb 0.41 -0.46 -0.02 0.00 -2.33 0.00 0.00 43.42 41.02 1brm n LEU 144 CO 0.18 0.44 0.63 1.23 -1.33 0.00 0.00 177.39 178.54 1brm h GLY 145 N 4.79 -0.27 -0.29 -0.72 0.00 -0.63 -1.44 103.07 104.52 1brm h GLY 145 Ca 0.00 0.43 0.31 0.00 0.00 0.00 0.00 47.33 48.07 1brm h GLY 145 CO 0.15 -0.20 0.75 -1.33 0.00 0.00 0.00 176.54 175.90 1brm h GLY 146 N -0.25 0.78 0.99 4.60 0.00 -1.80 0.36 103.07 107.75 1brm h GLY 146 Ca 0.18 -0.12 -0.18 0.00 0.00 0.00 0.00 47.33 47.20 1brm h GLY 146 CO -0.56 -0.11 -0.62 1.41 0.00 0.00 0.00 176.54 176.66 1brm h LEU 147 N 0.23 0.75 -0.15 3.11 3.38 -1.55 -3.01 115.31 118.07 1brm h LEU 147 Ca 0.60 -0.64 -0.17 0.00 0.09 0.00 0.00 57.88 57.76 1brm h LEU 147 Cb 1.86 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 42.39 1brm h LEU 147 CO -0.20 1.27 -0.56 -0.26 0.09 0.00 0.00 178.44 178.78 1brm h PHE 148 N 0.28 0.86 0.00 1.13 0.04 -1.05 -1.86 116.94 116.35 1brm h PHE 148 Ca -0.04 -0.36 0.00 0.00 2.80 0.00 0.00 57.97 60.37 1brm h PHE 148 Cb 1.26 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 39.27 1brm h PHE 148 CO 0.10 1.15 0.00 0.00 -0.60 0.00 0.00 178.31 178.97 1brm n ALA 149 N -2.56 1.28 -0.77 2.45 0.00 0.12 -1.03 120.51 119.99 1brm n ALA 149 Ca -0.07 -0.01 0.07 0.00 0.00 0.00 0.00 53.44 53.42 1brm n ALA 149 Cb 0.63 -1.06 0.10 0.00 0.00 0.00 0.00 19.45 19.12 1brm n ALA 149 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1brm n ASN 150 N -1.37 2.22 -3.93 0.00 5.03 -1.14 -4.99 115.26 111.07 1brm n ASN 150 Ca 0.01 -2.76 -0.26 0.00 0.87 0.00 0.00 54.58 52.45 1brm n ASN 150 Cb 0.03 -0.30 -0.01 0.00 -1.02 0.00 0.00 39.78 38.48 1brm n ASN 150 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 1brm n ASP 151 N -1.15 -0.81 -0.38 6.41 2.03 -0.20 -4.88 116.55 117.57 1brm n ASP 151 Ca 0.11 -0.97 0.06 0.00 0.52 0.00 0.00 54.79 54.51 1brm n ASP 151 Cb 0.53 -3.22 0.02 0.00 -0.72 0.00 0.00 41.12 37.74 1brm n ASP 151 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1brm n LEU 152 N -4.39 1.68 -4.76 -2.67 4.77 -0.71 -4.84 117.00 106.08 1brm n LEU 152 Ca -0.27 -0.88 -0.35 0.00 -0.03 0.00 0.00 56.01 54.48 1brm n LEU 152 Cb 0.67 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.68 1brm n LEU 152 CO 0.75 0.32 -0.17 -0.69 -1.33 0.00 0.00 177.39 176.27 1brm s VAL 153 N -1.32 5.42 -0.25 4.08 1.01 -1.25 0.28 120.40 128.38 1brm s VAL 153 Ca 0.12 0.21 -0.15 0.00 0.00 0.00 0.00 61.98 62.17 1brm s VAL 153 Cb 0.10 -3.46 -0.15 0.00 0.00 0.00 0.00 36.38 32.86 1brm s VAL 153 CO 0.24 0.47 -0.13 -0.67 0.00 0.00 0.00 175.10 175.01 1brm n ASP 154 N 3.20 1.94 -3.56 3.32 2.03 -0.23 -4.77 116.55 118.48 1brm n ASP 154 Ca -0.17 0.32 -0.08 0.00 0.52 0.00 0.00 54.79 55.38 1brm n ASP 154 Cb 0.53 -0.84 -0.02 0.00 -0.72 0.00 0.00 41.12 40.07 1brm n ASP 154 CO 0.00 0.00 0.00 -1.66 -1.92 0.00 0.00 177.20 173.62 1brm s TRP 155 N -2.47 -0.35 -0.06 -0.67 1.48 -1.24 -3.97 118.94 111.67 1brm s TRP 155 Ca -0.35 0.12 0.03 0.00 -1.06 0.00 0.00 56.10 54.85 1brm s TRP 155 Cb 0.11 0.58 0.00 0.00 -1.16 0.00 0.00 33.47 33.01 1brm s TRP 155 CO 0.54 -0.76 -0.15 0.08 -4.06 0.00 0.00 176.95 172.60 1brm s VAL 156 N -3.43 1.34 -0.16 -0.66 1.01 0.76 -2.02 120.40 117.24 1brm s VAL 156 Ca 0.06 -0.63 -0.03 0.00 0.00 0.00 0.00 61.98 61.37 1brm s VAL 156 Cb -0.02 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.16 1brm s VAL 156 CO -0.06 0.39 -0.04 -0.55 0.00 0.00 0.00 175.10 174.84 1brm s SER 157 N 0.33 4.73 0.05 3.32 0.15 -0.99 -1.75 113.70 119.53 1brm s SER 157 Ca -0.10 -0.15 0.03 0.00 0.70 0.00 0.00 55.95 56.43 1brm s SER 157 Cb -0.14 -1.77 -0.02 0.00 -1.71 0.00 0.00 66.02 62.38 1brm s SER 157 CO 0.03 0.16 -0.10 -0.69 1.20 0.00 0.00 173.24 173.85 1brm s VAL 158 N 0.39 0.72 -0.06 4.45 1.01 -0.04 -1.79 120.40 125.07 1brm s VAL 158 Ca -0.04 -1.10 -0.01 0.00 0.00 0.00 0.00 61.98 60.82 1brm s VAL 158 Cb -0.14 -0.74 0.03 0.00 0.00 0.00 0.00 36.38 35.52 1brm s VAL 158 CO 0.03 -0.30 -0.00 0.00 0.00 0.00 0.00 175.10 174.83 1brm s ALA 159 N -1.28 0.65 0.13 5.51 0.00 -0.86 -0.31 121.76 125.59 1brm s ALA 159 Ca -0.07 -0.08 0.06 0.00 0.00 0.00 0.00 51.96 51.88 1brm s ALA 159 Cb -0.10 -0.66 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 1brm s ALA 159 CO 0.01 -0.36 -0.01 0.95 0.00 0.00 0.00 175.76 176.34 1brm s THR 160 N 1.75 3.80 -0.65 0.00 -4.23 -0.61 -1.07 115.64 114.61 1brm s THR 160 Ca 0.01 -1.23 0.05 0.00 -1.18 0.00 0.00 61.69 59.34 1brm s THR 160 Cb -0.13 -2.85 0.16 0.00 1.34 0.00 0.00 72.50 71.02 1brm s THR 160 CO -0.04 0.01 0.45 -0.31 -0.54 0.00 0.00 174.62 174.18 1brm s TYR 161 N -1.50 3.31 0.21 3.99 1.51 0.77 -2.11 117.35 123.54 1brm s TYR 161 Ca 0.26 -3.23 -0.25 0.00 -1.01 0.00 0.00 57.07 52.84 1brm s TYR 161 Cb -0.10 -2.57 -0.08 0.00 -0.11 0.00 0.00 41.96 39.09 1brm s TYR 161 CO 0.18 -0.60 0.82 -0.65 -1.11 0.00 0.00 175.55 174.19 1brm s GLN 162 N -1.16 4.56 0.88 -0.62 -0.21 0.10 -1.68 119.66 121.53 1brm s GLN 162 Ca 0.24 1.19 -0.13 0.00 0.02 0.00 0.00 55.36 56.68 1brm s GLN 162 Cb -0.07 -3.13 0.13 0.00 1.00 0.00 0.00 33.01 30.94 1brm s GLN 162 CO -0.14 0.49 1.20 0.00 -2.12 0.00 0.00 175.29 174.72 1brm s ALA 163 N -1.29 2.32 0.07 6.09 0.00 -1.20 -0.82 121.76 126.92 1brm s ALA 163 Ca 0.40 -0.77 0.10 0.00 0.00 0.00 0.00 51.96 51.69 1brm s ALA 163 Cb -0.22 -2.93 -0.04 0.00 0.00 0.00 0.00 23.12 19.93 1brm s ALA 163 CO 0.26 -2.04 1.38 0.00 0.00 0.00 0.00 175.76 175.36 1brm h ALA 164 N -1.33 0.52 -0.07 0.00 0.00 -1.10 -3.12 119.26 114.15 1brm h ALA 164 Ca -0.46 -0.74 0.02 0.00 0.00 0.00 0.00 54.91 53.73 1brm h ALA 164 Cb 1.31 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1brm h ALA 164 CO 0.58 1.01 0.16 0.66 0.00 0.00 0.00 179.25 181.66 1brm h SER 165 N 0.00 0.00 0.61 0.00 4.64 -1.21 0.61 113.55 118.19 1brm h SER 165 Ca -0.01 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.28 1brm h SER 165 Cb 1.57 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.65 1brm h SER 165 CO 0.11 0.00 -0.14 1.23 -0.87 0.00 0.00 176.83 177.16 1brm h GLY 166 N 0.00 0.00 0.12 -0.77 0.00 -1.81 -3.11 103.07 97.50 1brm h GLY 166 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.07 1brm h GLY 166 CO -0.00 0.00 -1.60 0.61 0.00 0.00 0.00 176.54 175.55 1brm n GLY 167 N -0.34 -0.73 0.00 4.60 0.00 0.21 -5.10 105.19 103.83 1brm n GLY 167 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1brm n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1brm n GLY 168 N 1.54 1.79 0.36 -0.02 0.00 -0.79 -4.88 105.19 103.20 1brm n GLY 168 Ca -0.35 -1.37 0.04 0.00 0.00 0.00 0.00 46.02 44.34 1brm n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1brm h ALA 169 N 0.00 1.55 -0.42 4.61 0.00 -1.86 -1.62 119.26 121.51 1brm h ALA 169 Ca 0.00 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.91 1brm h ALA 169 Cb 0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1brm h ALA 169 CO 0.00 0.34 0.24 0.00 0.00 0.00 0.00 179.25 179.82 1brm h ARG 170 N 0.97 0.46 -0.35 0.00 3.08 -1.94 -0.34 114.38 116.26 1brm h ARG 170 Ca 0.36 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.38 1brm h ARG 170 Cb 0.16 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 1brm h ARG 170 CO -0.12 0.31 0.23 0.45 -1.07 0.00 0.00 179.97 179.77 1brm h HIS 171 N 0.48 0.45 -0.45 3.04 3.86 -1.61 0.21 115.15 121.13 1brm h HIS 171 Ca 0.17 0.01 -0.11 0.00 -1.16 0.00 0.00 60.37 59.29 1brm h HIS 171 Cb 0.04 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.34 1brm h HIS 171 CO -0.08 0.28 -0.14 0.52 0.86 0.00 0.00 177.93 179.37 1brm h MET 172 N 0.48 0.85 0.00 2.45 2.86 -1.17 -1.04 114.93 119.36 1brm h MET 172 Ca 0.13 -0.31 -0.06 0.00 -2.06 0.00 0.00 59.70 57.40 1brm h MET 172 Cb -0.05 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 1brm h MET 172 CO -0.03 0.94 -0.29 0.00 1.06 0.00 0.00 176.91 178.58 1brm h ARG 173 N 0.75 0.00 -0.10 1.72 3.08 -0.71 -2.43 114.38 116.69 1brm h ARG 173 Ca 0.12 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.93 1brm h ARG 173 Cb 0.66 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.72 1brm h ARG 173 CO 0.05 0.29 -0.87 1.49 -1.07 0.00 0.00 179.97 179.86 1brm h GLU 174 N 0.00 0.75 0.79 0.04 4.81 -0.06 -2.76 114.58 118.15 1brm h GLU 174 Ca -0.00 -0.67 -0.04 0.00 -0.13 0.00 0.00 59.36 58.51 1brm h GLU 174 Cb 0.72 0.16 0.01 0.00 0.63 0.00 0.00 28.75 30.27 1brm h GLU 174 CO 0.04 1.27 -0.38 1.25 -0.73 0.00 0.00 179.01 180.46 1brm h LEU 175 N 0.49 -0.90 -1.35 1.64 5.85 -0.89 0.50 115.31 120.63 1brm h LEU 175 Ca -0.08 0.02 0.14 0.00 0.84 0.00 0.00 57.88 58.81 1brm h LEU 175 Cb 1.50 0.23 -0.06 0.00 0.37 0.00 0.00 40.66 42.70 1brm h LEU 175 CO 0.17 -0.62 0.56 -0.07 -0.34 0.00 0.00 178.44 178.14 1brm h LEU 176 N -1.11 0.60 0.16 2.25 3.38 -1.55 -0.27 115.31 118.77 1brm h LEU 176 Ca -0.11 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1brm h LEU 176 Cb 0.83 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1brm h LEU 176 CO 0.18 0.31 -0.08 0.74 0.09 0.00 0.00 178.44 179.68 1brm h THR 177 N 0.64 0.98 -0.87 0.22 2.02 -1.24 -2.60 112.91 112.06 1brm h THR 177 Ca 0.43 -0.81 0.19 0.00 0.77 0.00 0.00 66.41 66.99 1brm h THR 177 Cb 0.73 1.46 -0.11 0.00 -1.74 0.00 0.00 68.15 68.49 1brm h THR 177 CO -0.18 0.18 0.40 1.56 0.37 0.00 0.00 175.52 177.85 1brm h GLN 178 N -0.62 0.46 -0.85 6.66 4.20 -0.07 0.65 115.11 125.55 1brm h GLN 178 Ca -0.02 -0.03 0.11 0.00 0.06 0.00 0.00 58.65 58.77 1brm h GLN 178 Cb 0.46 -0.10 -0.06 0.00 0.30 0.00 0.00 27.48 28.08 1brm h GLN 178 CO 0.04 0.31 0.55 0.52 -0.67 0.00 0.00 178.83 179.57 1brm h MET 179 N 0.48 0.76 -0.05 1.46 2.86 -0.92 -1.49 114.93 118.02 1brm h MET 179 Ca 0.52 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 58.02 1brm h MET 179 Cb 0.90 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.37 1brm h MET 179 CO -0.47 0.50 -0.41 0.78 1.06 0.00 0.00 176.91 178.37 1brm h GLY 180 N 0.78 0.12 1.46 8.32 0.00 0.71 -2.27 103.07 112.19 1brm h GLY 180 Ca 0.40 -0.11 -0.23 0.00 0.00 0.00 0.00 47.33 47.40 1brm h GLY 180 CO -0.17 0.10 -0.92 0.45 0.00 0.00 0.00 176.54 175.99 1brm h HIS 181 N 0.09 0.71 -0.01 5.60 -0.00 -0.90 -1.78 115.15 118.86 1brm h HIS 181 Ca 0.01 -0.37 -0.09 0.00 -0.00 0.00 0.00 60.37 59.91 1brm h HIS 181 Cb 0.77 -0.09 -0.01 0.00 -0.00 0.00 0.00 27.41 28.08 1brm h HIS 181 CO 0.01 1.19 -0.41 -0.07 -0.00 0.00 0.00 177.93 178.64 1brm h LEU 182 N 0.29 0.01 0.00 2.43 3.38 -1.32 -2.70 115.31 117.40 1brm h LEU 182 Ca -0.08 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1brm h LEU 182 Cb 1.55 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.30 1brm h LEU 182 CO 0.17 0.43 -0.07 0.22 0.09 0.00 0.00 178.44 179.27 1brm h TYR 183 N 0.01 0.00 -0.83 1.13 3.20 -1.38 -3.37 116.97 115.74 1brm h TYR 183 Ca -0.00 0.00 0.21 0.00 3.14 0.00 0.00 58.73 62.07 1brm h TYR 183 Cb 0.74 0.00 -0.14 0.00 1.54 0.00 0.00 36.73 38.87 1brm h TYR 183 CO 0.00 0.00 0.10 0.78 -1.64 0.00 0.00 178.16 177.40 1brm h GLY 184 N -0.53 1.08 -0.06 1.82 0.00 -1.44 0.36 103.07 104.30 1brm h GLY 184 Ca 0.00 0.06 0.25 0.00 0.00 0.00 0.00 47.33 47.64 1brm h GLY 184 CO 0.00 -0.34 0.79 0.84 0.00 0.00 0.00 176.54 177.83 1brm h HIS 185 N 0.14 0.00 0.00 5.60 -0.00 -1.66 -0.51 115.15 118.71 1brm h HIS 185 Ca 0.48 0.00 -0.05 0.00 -0.00 0.00 0.00 60.37 60.81 1brm h HIS 185 Cb 0.92 0.00 -0.10 0.00 -0.00 0.00 0.00 27.41 28.23 1brm h HIS 185 CO -0.37 0.00 -0.58 0.28 -0.00 0.00 0.00 177.93 177.26 1brm n VAL 186 N -3.76 0.38 -0.20 5.26 0.31 0.09 -4.85 118.33 115.55 1brm n VAL 186 Ca 0.18 -0.76 0.00 0.00 -0.01 0.00 0.00 64.34 63.76 1brm n VAL 186 Cb 1.08 0.49 0.25 0.00 -0.91 0.00 0.00 33.84 34.75 1brm n VAL 186 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1brm h ALA 187 N 0.32 1.46 -0.56 3.52 0.00 0.13 -2.65 119.26 121.48 1brm h ALA 187 Ca -0.06 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1brm h ALA 187 Cb 1.45 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1brm h ALA 187 CO 0.03 0.49 0.00 -0.25 0.00 0.00 0.00 179.25 179.52 1brm n ASP 188 N -4.41 0.00 -0.31 0.00 8.00 -1.26 -3.29 116.55 115.27 1brm n ASP 188 Ca 0.08 0.91 0.16 0.00 0.71 0.00 0.00 54.79 56.64 1brm n ASP 188 Cb 0.04 -0.41 0.35 0.00 -0.02 0.00 0.00 41.12 41.09 1brm n ASP 188 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 1brm h GLU 189 N 0.00 0.34 -0.11 -1.24 9.09 -1.89 0.51 114.58 121.29 1brm h GLU 189 Ca 0.00 -0.02 0.03 0.00 0.05 0.00 0.00 59.36 59.42 1brm h GLU 189 Cb 0.00 -0.08 -0.00 0.00 -1.65 0.00 0.00 28.75 27.02 1brm h GLU 189 CO 0.00 0.23 0.13 -0.07 0.05 0.00 0.00 179.01 179.35 1brm h LEU 190 N 0.36 0.00 0.20 3.06 3.38 -1.53 -1.90 115.31 118.87 1brm h LEU 190 Ca 0.60 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 58.28 1brm h LEU 190 Cb 1.22 0.00 0.03 0.00 0.09 0.00 0.00 40.66 42.00 1brm h LEU 190 CO -0.57 0.00 -1.37 0.00 0.09 0.00 0.00 178.44 176.59 1brm h ALA 191 N 1.83 -0.06 -1.84 1.53 0.00 0.03 -3.42 119.26 117.33 1brm h ALA 191 Ca 0.05 -0.89 -0.57 0.00 0.00 0.00 0.00 54.91 53.50 1brm h ALA 191 Cb 0.32 0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 1brm h ALA 191 CO -0.00 0.69 0.93 0.95 0.00 0.00 0.00 179.25 181.82 1brm s THR 192 N -2.54 4.24 0.51 0.00 -4.23 -0.72 -4.88 115.64 108.02 1brm s THR 192 Ca -0.13 1.35 0.39 0.00 -1.18 0.00 0.00 61.69 62.13 1brm s THR 192 Cb 0.04 -4.41 0.39 0.00 1.34 0.00 0.00 72.50 69.85 1brm s THR 192 CO 0.88 -0.72 2.20 -0.65 -0.54 0.00 0.00 174.62 175.79 1brm h PRO 193 N 9.08 0.00 -2.14 3.99 0.11 -1.82 -3.04 132.00 138.19 1brm h PRO 193 Ca -0.23 0.00 -0.76 0.00 0.11 0.00 0.00 66.00 65.12 1brm h PRO 193 Cb 1.07 0.00 -0.25 0.00 0.11 0.00 0.00 31.00 31.93 1brm h PRO 193 CO 1.08 0.00 1.09 -1.13 -0.21 0.00 0.00 178.00 178.83 1brm n SER 194 N -2.90 7.41 -4.23 -2.05 3.41 -1.26 -4.95 113.62 109.05 1brm n SER 194 Ca -0.03 -3.67 -0.28 0.00 -0.26 0.00 0.00 58.87 54.63 1brm n SER 194 Cb 0.09 -1.14 -0.16 0.00 -0.26 0.00 0.00 64.21 62.74 1brm n SER 194 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1brm s SER 195 N -0.93 2.56 -0.26 4.04 1.04 -1.15 -5.10 113.70 113.89 1brm s SER 195 Ca 0.48 -0.40 -0.29 0.00 0.48 0.00 0.00 55.95 56.22 1brm s SER 195 Cb 0.32 -0.38 -0.02 0.00 0.10 0.00 0.00 66.02 66.05 1brm s SER 195 CO -0.27 0.25 1.66 0.00 0.98 0.00 0.00 173.24 175.86 1brm s ALA 196 N -0.41 3.14 0.38 5.32 0.00 -1.26 -4.90 121.76 124.03 1brm s ALA 196 Ca 0.06 0.38 0.16 0.00 0.00 0.00 0.00 51.96 52.56 1brm s ALA 196 Cb -0.09 -3.90 1.04 0.00 0.00 0.00 0.00 23.12 20.16 1brm s ALA 196 CO -0.00 -2.17 1.78 0.97 0.00 0.00 0.00 175.76 176.34 1brm h ILE 197 N 6.36 0.58 0.00 0.00 6.09 -1.99 0.84 117.51 129.38 1brm h ILE 197 Ca -0.33 -0.16 0.00 0.00 -1.37 0.00 0.00 64.86 63.00 1brm h ILE 197 Cb 1.16 0.08 0.00 0.00 0.47 0.00 0.00 36.82 38.52 1brm h ILE 197 CO 1.01 0.08 0.00 -0.07 -3.07 0.00 0.00 178.15 176.11 1brm h LEU 198 N 0.46 0.00 0.16 2.19 3.38 -1.98 -1.37 115.31 118.16 1brm h LEU 198 Ca 0.57 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 58.19 1brm h LEU 198 Cb 1.35 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.10 1brm h LEU 198 CO -0.30 0.00 -1.84 0.44 0.09 0.00 0.00 178.44 176.83 1brm h ASP 199 N 0.00 0.54 -0.44 -0.43 3.32 0.28 -2.02 116.42 117.68 1brm h ASP 199 Ca 0.00 -0.92 -0.13 0.00 0.02 0.00 0.00 57.03 56.00 1brm h ASP 199 Cb 0.55 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1brm h ASP 199 CO 0.00 1.80 -0.23 0.16 -1.72 0.00 0.00 179.24 179.25 1brm h ILE 200 N 0.09 1.27 -0.04 0.35 3.07 -1.26 -2.28 117.51 118.71 1brm h ILE 200 Ca -0.37 -1.38 -0.09 0.00 1.55 0.00 0.00 64.86 64.57 1brm h ILE 200 Cb 2.08 1.23 -0.01 0.00 -0.27 0.00 0.00 36.82 39.84 1brm h ILE 200 CO 0.15 0.47 -0.40 -0.08 -1.05 0.00 0.00 178.15 177.24 1brm h GLU 201 N 0.75 0.09 -0.30 0.16 4.22 -1.36 -2.21 114.58 115.93 1brm h GLU 201 Ca 0.10 -0.04 -0.13 0.00 0.08 0.00 0.00 59.36 59.36 1brm h GLU 201 Cb 0.80 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 1brm h GLU 201 CO 0.07 0.48 -0.36 -0.09 -2.18 0.00 0.00 179.01 176.93 1brm h ARG 202 N 0.08 0.69 0.51 1.92 2.43 -1.10 -0.72 114.38 118.18 1brm h ARG 202 Ca 0.01 -0.33 -0.02 0.00 -0.81 0.00 0.00 59.98 58.82 1brm h ARG 202 Cb 0.74 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.29 1brm h ARG 202 CO 0.06 0.94 -0.24 0.87 -1.51 0.00 0.00 179.97 180.08 1brm h LYS 203 N 0.58 -0.65 -0.72 0.20 1.57 -1.08 -1.36 116.57 115.10 1brm h LYS 203 Ca 0.06 0.04 0.13 0.00 -1.87 0.00 0.00 60.65 59.01 1brm h LYS 203 Cb 0.88 0.15 -0.09 0.00 0.08 0.00 0.00 32.23 33.25 1brm h LYS 203 CO 0.08 -0.44 0.29 -0.39 -0.57 0.00 0.00 179.45 178.42 1brm h VAL 204 N -0.92 0.70 -0.73 0.50 -1.51 -1.48 0.50 116.25 113.31 1brm h VAL 204 Ca -0.07 -0.16 0.09 0.00 -1.23 0.00 0.00 66.70 65.34 1brm h VAL 204 Cb 0.52 0.21 -0.05 0.00 -2.13 0.00 0.00 31.29 29.84 1brm h VAL 204 CO 0.11 0.08 0.48 0.74 -1.23 0.00 0.00 177.57 177.76 1brm h THR 205 N 0.45 0.94 0.00 7.19 2.02 -1.13 0.24 112.91 122.62 1brm h THR 205 Ca 0.38 -0.22 -0.24 0.00 0.77 0.00 0.00 66.41 67.11 1brm h THR 205 Cb 0.54 0.25 -0.04 0.00 -1.74 0.00 0.00 68.15 67.17 1brm h THR 205 CO -0.37 0.12 -1.24 0.74 0.37 0.00 0.00 175.52 175.14 1brm h THR 206 N 0.64 1.43 -0.28 3.16 2.02 0.66 -3.28 112.91 117.25 1brm h THR 206 Ca 0.33 -3.18 -0.07 0.00 0.77 0.00 0.00 66.41 64.26 1brm h THR 206 Cb 0.45 2.71 -0.01 0.00 -1.74 0.00 0.00 68.15 69.57 1brm h THR 206 CO -0.12 0.82 -0.11 0.25 0.37 0.00 0.00 175.52 176.73 1brm h LEU 207 N 0.00 0.59 -1.08 2.58 5.85 0.83 -0.01 115.31 124.08 1brm h LEU 207 Ca -0.10 -0.39 0.00 0.00 0.84 0.00 0.00 57.88 58.22 1brm h LEU 207 Cb 1.86 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.72 1brm h LEU 207 CO 0.12 0.85 0.08 0.41 -0.34 0.00 0.00 178.44 179.55 1brm n THR 208 N -4.46 1.05 0.25 1.05 -1.04 -0.03 -0.53 114.28 110.57 1brm n THR 208 Ca -0.03 0.70 0.03 0.00 -2.04 0.00 0.00 64.05 62.71 1brm n THR 208 Cb 0.34 -1.70 0.01 0.00 -1.82 0.00 0.00 70.33 67.16 1brm n THR 208 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1brm n ARG 209 N -2.08 1.57 0.03 -2.82 1.74 -0.78 -4.67 116.66 109.65 1brm n ARG 209 Ca -0.01 -0.58 -0.12 0.00 -0.77 0.00 0.00 57.85 56.37 1brm n ARG 209 Cb 0.11 -1.00 0.00 0.00 -1.02 0.00 0.00 32.46 30.55 1brm n ARG 209 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1brm h SER 210 N 0.80 0.63 0.00 0.55 4.64 0.11 -3.48 113.55 116.80 1brm h SER 210 Ca 0.00 -0.40 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1brm h SER 210 Cb 0.21 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1brm h SER 210 CO 0.00 1.16 0.00 0.61 -0.87 0.00 0.00 176.83 177.73 1brm n GLY 211 N 0.57 1.60 0.00 -0.77 0.00 -1.25 -4.91 105.19 100.43 1brm n GLY 211 Ca -0.05 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.01 1brm n GLY 211 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1brm n GLU 212 N -1.32 0.06 -2.89 1.61 1.02 -1.26 -4.69 120.64 113.17 1brm n GLU 212 Ca 0.00 0.27 -0.40 0.00 -0.02 0.00 0.00 57.16 57.01 1brm n GLU 212 Cb 0.00 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 29.87 1brm n GLU 212 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1brm s LEU 213 N -2.79 4.52 -0.71 -4.62 1.02 -1.26 -5.00 118.68 109.83 1brm s LEU 213 Ca 0.07 1.64 -0.27 0.00 0.02 0.00 0.00 54.13 55.59 1brm s LEU 213 Cb 0.06 -3.39 0.02 0.00 0.02 0.00 0.00 46.19 42.91 1brm s LEU 213 CO 0.15 0.05 1.38 -2.16 0.02 0.00 0.00 176.35 175.79 1brm s PRO 214 N -0.39 3.11 -0.31 1.29 0.04 -1.26 -4.85 135.00 132.63 1brm s PRO 214 Ca 0.41 -0.06 0.08 0.00 0.04 0.00 0.00 61.00 61.47 1brm s PRO 214 Cb -0.22 -4.21 0.46 0.00 0.04 0.00 0.00 34.50 30.57 1brm s PRO 214 CO 0.27 -2.22 1.17 1.33 0.04 0.00 0.00 177.00 177.59 1brm n VAL 215 N 6.54 2.40 0.29 -0.36 0.24 -1.26 -4.84 118.33 121.34 1brm n VAL 215 Ca 0.06 -4.19 -0.15 0.00 -2.04 0.00 0.00 64.34 58.02 1brm n VAL 215 Cb 0.50 -0.95 -0.08 0.00 -1.47 0.00 0.00 33.84 31.84 1brm n VAL 215 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1brm h ASP 216 N 2.27 -0.63 -0.14 -1.34 3.32 -1.89 0.15 116.42 118.16 1brm h ASP 216 Ca 0.32 -0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.26 1brm h ASP 216 Cb 1.44 0.16 -0.00 0.00 0.22 0.00 0.00 39.33 41.15 1brm h ASP 216 CO 0.72 -0.31 -0.14 0.78 -1.72 0.00 0.00 179.24 178.57 1brm h ASN 217 N -0.97 0.36 1.65 6.45 2.35 -1.94 -3.30 115.58 120.18 1brm h ASN 217 Ca -0.08 -0.49 -0.06 0.00 -0.55 0.00 0.00 56.30 55.13 1brm h ASN 217 Cb 0.64 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.90 1brm h ASN 217 CO 0.13 0.77 -0.36 -0.26 -1.65 0.00 0.00 177.43 176.06 1brm h PHE 218 N -0.05 0.00 0.00 1.19 0.04 -1.91 -3.48 116.94 112.73 1brm h PHE 218 Ca 0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.79 1brm h PHE 218 Cb 0.68 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.83 1brm h PHE 218 CO 0.09 0.27 0.00 0.41 -0.60 0.00 0.00 178.31 178.47 1brm n GLY 219 N 1.18 1.93 3.25 -1.45 0.00 0.51 -4.90 105.19 105.71 1brm n GLY 219 Ca 0.02 -0.31 -0.15 0.00 0.00 0.00 0.00 46.02 45.58 1brm n GLY 219 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1brm s VAL 220 N -0.19 1.23 0.66 1.61 -7.23 -1.26 -4.86 120.40 110.36 1brm s VAL 220 Ca 0.00 -2.02 -0.18 0.00 -1.81 0.00 0.00 61.98 57.97 1brm s VAL 220 Cb 0.00 -1.81 -0.00 0.00 0.56 0.00 0.00 36.38 35.12 1brm s VAL 220 CO 0.00 -0.69 1.29 -2.84 -0.31 0.00 0.00 175.10 172.55 1brm s PRO 221 N -3.59 2.47 0.00 4.82 0.02 -1.26 -4.90 135.00 132.56 1brm s PRO 221 Ca 0.16 2.05 0.00 0.00 0.02 0.00 0.00 61.00 63.23 1brm s PRO 221 Cb 0.01 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.70 1brm s PRO 221 CO 0.01 -1.66 0.00 -0.11 -0.33 0.00 0.00 177.00 174.92 1brm n LEU 222 N -2.01 2.15 -4.65 -5.54 7.94 -1.26 -4.58 117.00 109.05 1brm n LEU 222 Ca 0.16 0.00 -0.42 0.00 -1.11 0.00 0.00 56.01 54.63 1brm n LEU 222 Cb 0.48 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 44.40 1brm n LEU 222 CO 0.47 0.36 1.48 0.00 -1.11 0.00 0.00 177.39 178.59 1brm s ALA 223 N -1.93 3.48 -0.11 1.96 0.00 -1.26 -1.03 121.76 122.87 1brm s ALA 223 Ca 0.00 0.97 0.00 0.00 0.00 0.00 0.00 51.96 52.93 1brm s ALA 223 Cb 0.00 -3.82 0.00 0.00 0.00 0.00 0.00 23.12 19.30 1brm s ALA 223 CO 0.00 -1.66 0.00 0.41 0.00 0.00 0.00 175.76 174.51 1brm n GLY 224 N 4.48 0.41 0.00 0.00 0.00 -1.26 -4.95 105.19 103.87 1brm n GLY 224 Ca 0.19 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.25 1brm n GLY 224 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1brm n SER 225 N 1.80 0.00 -3.81 1.61 2.88 -0.19 -5.16 113.62 110.76 1brm n SER 225 Ca -0.01 -0.25 -0.06 0.00 -1.33 0.00 0.00 58.87 57.22 1brm n SER 225 Cb 0.22 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.67 1brm n SER 225 CO 0.00 0.00 0.00 -1.48 -1.23 0.00 0.00 175.04 172.33 1brm s LEU 226 N 0.00 -0.23 -0.20 2.46 0.05 -1.26 -4.45 118.68 115.06 1brm s LEU 226 Ca 0.00 -0.51 -0.04 0.00 0.05 0.00 0.00 54.13 53.63 1brm s LEU 226 Cb 0.00 2.49 0.07 0.00 -2.05 0.00 0.00 46.19 46.69 1brm s LEU 226 CO 0.00 -1.15 0.08 -0.63 -0.55 0.00 0.00 176.35 174.10 1brm s ILE 227 N -3.65 0.09 -0.90 1.48 1.01 -0.43 -4.96 121.20 113.84 1brm s ILE 227 Ca 0.11 -0.38 -0.07 0.00 0.00 0.00 0.00 60.65 60.31 1brm s ILE 227 Cb -0.04 -0.78 -0.11 0.00 0.01 0.00 0.00 42.46 41.54 1brm s ILE 227 CO 0.05 -0.34 2.66 -0.81 0.00 0.00 0.00 174.94 176.50 1brm n PRO 228 N 5.21 2.51 -3.64 2.79 -0.04 -1.26 -0.81 135.00 139.75 1brm n PRO 228 Ca -0.07 -1.52 -0.05 0.00 -0.04 0.00 0.00 63.50 61.82 1brm n PRO 228 Cb 0.47 -2.41 -0.07 0.00 -0.04 0.00 0.00 33.50 31.46 1brm n PRO 228 CO 0.00 0.00 0.00 -0.46 -0.04 0.00 0.00 175.50 175.00 1brm s TRP 229 N 2.38 -0.50 -0.18 0.54 -0.11 -1.23 -4.95 118.94 114.90 1brm s TRP 229 Ca 0.54 1.08 0.01 0.00 1.22 0.00 0.00 56.10 58.95 1brm s TRP 229 Cb 0.17 0.35 0.02 0.00 -1.50 0.00 0.00 33.47 32.52 1brm s TRP 229 CO -0.03 -0.25 -0.18 0.42 -4.62 0.00 0.00 176.95 172.29 1brm s ILE 230 N 0.87 2.00 -0.85 5.86 -1.09 -1.26 -4.62 121.20 122.10 1brm s ILE 230 Ca -0.04 -0.97 -0.25 0.00 -2.23 0.00 0.00 60.65 57.16 1brm s ILE 230 Cb -0.04 -1.85 -0.11 0.00 -1.58 0.00 0.00 42.46 38.88 1brm s ILE 230 CO -0.12 0.47 2.23 -1.81 -1.23 0.00 0.00 174.94 174.48 1brm s ASP 231 N 1.30 4.31 0.00 3.58 1.01 -1.26 -5.16 116.67 120.45 1brm s ASP 231 Ca 0.04 -0.29 0.00 0.00 0.71 0.00 0.00 52.55 53.01 1brm s ASP 231 Cb -0.14 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.24 1brm s ASP 231 CO -0.12 -3.53 0.00 0.29 0.21 0.00 0.00 175.17 172.02 1brm n LYS 232 N 8.79 0.00 0.00 8.23 4.76 -1.26 -5.20 118.16 133.48 1brm n LYS 232 Ca 0.44 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.88 1brm n LYS 232 Cb 0.45 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.64 1brm n LYS 232 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 1brm n GLU 241 N 0.00 0.00 -0.62 1.97 4.07 -1.26 -5.26 120.64 119.55 1brm n GLU 241 Ca 0.00 0.00 0.09 0.00 -0.06 0.00 0.00 57.16 57.19 1brm n GLU 241 Cb 0.00 0.00 0.35 0.00 -0.06 0.00 0.00 31.44 31.73 1brm n GLU 241 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1brm n GLU 242 N 0.00 3.79 -0.23 5.31 -0.58 -1.26 -4.53 120.64 123.14 1brm n GLU 242 Ca 0.00 -2.88 0.03 0.00 -0.42 0.00 0.00 57.16 53.88 1brm n GLU 242 Cb 0.00 -1.91 0.15 0.00 -0.57 0.00 0.00 31.44 29.11 1brm n GLU 242 CO 0.00 0.00 0.00 -1.49 -0.48 0.00 0.00 177.13 175.16 1brm h TRP 243 N 3.80 0.39 0.00 -0.32 -0.00 -2.01 -1.72 115.95 116.10 1brm h TRP 243 Ca 0.00 0.04 -0.05 0.00 -0.00 0.00 0.00 58.89 58.87 1brm h TRP 243 Cb 1.49 -0.07 -0.01 0.00 -0.00 0.00 0.00 29.16 30.57 1brm h TRP 243 CO 0.76 0.04 -0.36 -0.22 -0.00 0.00 0.00 178.44 178.66 1brm h LYS 244 N 0.38 0.00 0.00 0.49 1.63 -1.82 -3.48 116.57 113.77 1brm h LYS 244 Ca 0.36 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.16 1brm h LYS 244 Cb 0.53 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.16 1brm h LYS 244 CO -0.39 0.23 0.00 0.41 -3.45 0.00 0.00 179.45 176.25 1brm n GLY 245 N 1.17 1.24 0.15 5.01 0.00 -0.65 -4.56 105.19 107.56 1brm n GLY 245 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 1brm n GLY 245 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1brm h GLN 246 N 0.00 0.42 0.74 1.61 4.15 -1.76 -0.07 115.11 120.20 1brm h GLN 246 Ca 0.00 -0.07 -0.03 0.00 0.77 0.00 0.00 58.65 59.32 1brm h GLN 246 Cb 0.00 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.62 1brm h GLN 246 CO 0.00 0.42 -0.40 0.00 -1.93 0.00 0.00 178.83 176.92 1brm h ALA 247 N 0.98 -1.07 -0.79 3.38 0.00 -1.91 -1.37 119.26 118.48 1brm h ALA 247 Ca 0.10 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 54.88 1brm h ALA 247 Cb 0.15 0.47 -0.07 0.00 0.00 0.00 0.00 17.79 18.33 1brm h ALA 247 CO -0.01 -1.11 0.44 0.93 0.00 0.00 0.00 179.25 179.50 1brm h GLU 248 N -1.06 0.71 -0.13 0.00 5.08 -1.94 0.21 114.58 117.45 1brm h GLU 248 Ca -0.10 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.23 1brm h GLU 248 Cb 0.83 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 1brm h GLU 248 CO 0.13 0.47 0.05 1.15 -1.00 0.00 0.00 179.01 179.81 1brm h THR 249 N 0.74 0.97 -0.09 1.13 2.02 -0.85 0.16 112.91 116.99 1brm h THR 249 Ca 0.38 -0.04 -0.09 0.00 0.77 0.00 0.00 66.41 67.43 1brm h THR 249 Cb 0.37 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 1brm h THR 249 CO -0.25 0.02 -0.36 0.78 0.37 0.00 0.00 175.52 176.08 1brm h ASN 250 N 0.11 0.19 -0.07 4.18 2.35 -0.48 -2.39 115.58 119.48 1brm h ASN 250 Ca 0.06 -0.07 -0.12 0.00 -0.55 0.00 0.00 56.30 55.62 1brm h ASN 250 Cb 0.03 -0.05 0.01 0.00 0.05 0.00 0.00 38.32 38.35 1brm h ASN 250 CO -0.06 0.54 -0.43 0.50 -1.65 0.00 0.00 177.43 176.33 1brm h LYS 251 N 0.16 0.42 -0.84 0.81 3.64 -0.20 0.53 116.57 121.08 1brm h LYS 251 Ca 0.02 -0.35 0.03 0.00 -1.27 0.00 0.00 60.65 59.07 1brm h LYS 251 Cb 0.71 0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 32.57 1brm h LYS 251 CO 0.05 0.99 0.56 0.82 -2.27 0.00 0.00 179.45 179.60 1brm h ILE 252 N -0.05 1.16 -0.01 2.00 2.04 -0.64 -1.22 117.51 120.79 1brm h ILE 252 Ca -0.03 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.46 1brm h ILE 252 Cb 1.09 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1brm h ILE 252 CO 0.09 0.20 -0.25 0.18 0.00 0.00 0.00 178.15 178.36 1brm n LEU 253 N -4.44 1.08 -4.02 1.44 4.77 -0.91 -4.60 117.00 110.32 1brm n LEU 253 Ca 0.11 -0.29 -0.37 0.00 -0.03 0.00 0.00 56.01 55.43 1brm n LEU 253 Cb 0.09 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 41.06 1brm n LEU 253 CO 0.35 0.20 -0.22 -3.20 -1.33 0.00 0.00 177.39 173.19 1brm n ASN 254 N -0.59 -2.69 -4.77 -1.43 5.15 0.09 -4.89 115.26 106.12 1brm n ASN 254 Ca 0.12 -1.19 -0.31 0.00 -0.60 0.00 0.00 54.58 52.61 1brm n ASN 254 Cb 0.35 -2.25 0.09 0.00 -0.53 0.00 0.00 39.78 37.44 1brm n ASN 254 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1brm s THR 255 N -3.77 3.39 -0.02 -0.44 -4.23 -0.65 -4.98 115.64 104.94 1brm s THR 255 Ca 0.31 0.45 0.06 0.00 -1.18 0.00 0.00 61.69 61.33 1brm s THR 255 Cb -0.15 -2.98 -0.24 0.00 1.34 0.00 0.00 72.50 70.47 1brm s THR 255 CO 0.94 -0.59 0.74 0.77 -0.54 0.00 0.00 174.62 175.94 1brm h SER 256 N -1.09 0.13 -4.42 3.99 4.64 -1.92 -3.47 113.55 111.41 1brm h SER 256 Ca -0.44 -0.24 -0.34 0.00 -0.47 0.00 0.00 61.79 60.30 1brm h SER 256 Cb 1.23 -0.04 -0.24 0.00 -0.31 0.00 0.00 62.40 63.04 1brm h SER 256 CO 0.52 1.21 -0.76 -0.44 -0.87 0.00 0.00 176.83 176.49 1brm s SER 257 N -6.47 1.09 0.05 4.97 0.01 -1.26 -5.11 113.70 106.98 1brm s SER 257 Ca -0.07 -0.42 -0.30 0.00 1.31 0.00 0.00 55.95 56.46 1brm s SER 257 Cb 0.08 -0.03 -0.09 0.00 0.21 0.00 0.00 66.02 66.18 1brm s SER 257 CO 0.82 -0.07 1.95 -0.69 0.41 0.00 0.00 173.24 175.66 1brm s VAL 258 N -0.93 2.94 -0.45 3.43 1.01 -1.26 -4.96 120.40 120.17 1brm s VAL 258 Ca -0.03 0.02 -0.17 0.00 0.00 0.00 0.00 61.98 61.80 1brm s VAL 258 Cb -0.08 -3.02 0.04 0.00 0.00 0.00 0.00 36.38 33.33 1brm s VAL 258 CO 0.01 -0.00 0.46 -0.63 0.00 0.00 0.00 175.10 174.93 1brm s ILE 259 N 4.18 5.09 0.18 2.22 1.01 -1.26 -5.03 121.20 127.58 1brm s ILE 259 Ca 0.87 -0.56 -0.33 0.00 0.00 0.00 0.00 60.65 60.64 1brm s ILE 259 Cb -0.43 -4.11 -0.14 0.00 0.01 0.00 0.00 42.46 37.79 1brm s ILE 259 CO 0.41 -0.53 1.52 -2.65 0.00 0.00 0.00 174.94 173.68 1brm n PRO 260 N 5.61 2.07 -3.60 2.79 -0.02 -1.25 -4.86 135.00 135.73 1brm n PRO 260 Ca -0.08 0.74 -0.29 0.00 -2.02 0.00 0.00 63.50 61.85 1brm n PRO 260 Cb 0.46 -2.48 -0.15 0.00 -0.02 0.00 0.00 33.50 31.31 1brm n PRO 260 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1brm s VAL 261 N 0.61 0.20 0.24 -1.45 1.01 -1.26 -0.17 120.40 119.58 1brm s VAL 261 Ca 0.76 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.89 1brm s VAL 261 Cb -0.68 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 1brm s VAL 261 CO 0.42 -0.66 0.18 -0.62 0.00 0.00 0.00 175.10 174.41 1brm s ASP 262 N 1.97 0.67 0.00 3.32 -1.08 -0.72 -4.20 116.67 116.63 1brm s ASP 262 Ca 0.08 -1.51 0.00 0.00 -0.52 0.00 0.00 52.55 50.60 1brm s ASP 262 Cb -0.16 0.43 0.00 0.00 -1.46 0.00 0.00 42.92 41.73 1brm s ASP 262 CO -0.31 -0.91 0.00 0.61 0.52 0.00 0.00 175.17 175.08 1brm n GLY 263 N -0.39 -0.35 2.84 2.66 0.00 -1.26 -0.86 105.19 107.83 1brm n GLY 263 Ca 0.04 -0.58 -0.14 0.00 0.00 0.00 0.00 46.02 45.34 1brm n GLY 263 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1brm s LEU 264 N 0.00 1.20 -0.19 0.99 1.43 0.57 -4.95 118.68 117.74 1brm s LEU 264 Ca 0.00 0.11 -0.07 0.00 -1.03 0.00 0.00 54.13 53.14 1brm s LEU 264 Cb 0.00 0.08 -0.04 0.00 0.03 0.00 0.00 46.19 46.26 1brm s LEU 264 CO 0.00 -0.10 0.05 0.00 0.23 0.00 0.00 176.35 176.53 1brm s VAL 266 N 0.49 1.38 -0.22 0.00 1.01 -0.89 -3.48 120.40 118.67 1brm s VAL 266 Ca 0.02 -0.77 -0.17 0.00 0.00 0.00 0.00 61.98 61.06 1brm s VAL 266 Cb -0.13 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.07 1brm s VAL 266 CO 0.01 0.37 0.45 -0.60 0.00 0.00 0.00 175.10 175.32 1brm s ARG 267 N -0.47 4.13 0.35 2.72 3.52 0.01 0.01 118.95 129.22 1brm s ARG 267 Ca 0.07 0.25 0.09 0.00 -0.13 0.00 0.00 55.73 56.01 1brm s ARG 267 Cb -0.07 -3.58 -0.06 0.00 -1.56 0.00 0.00 34.95 29.68 1brm s ARG 267 CO -0.00 -0.16 -0.01 0.14 -0.81 0.00 0.00 175.30 174.45 1brm s VAL 268 N 1.70 2.43 -1.08 7.11 -7.23 -0.00 -1.32 120.40 122.02 1brm s VAL 268 Ca 0.20 -2.03 -0.07 0.00 -1.81 0.00 0.00 61.98 58.28 1brm s VAL 268 Cb -0.15 -2.78 -0.07 0.00 0.56 0.00 0.00 36.38 33.93 1brm s VAL 268 CO 0.09 -0.17 2.41 0.61 -0.31 0.00 0.00 175.10 177.73 1brm n GLY 269 N -0.93 3.42 3.52 2.32 0.00 -1.26 -4.44 105.19 107.82 1brm n GLY 269 Ca -0.04 -1.05 -0.24 0.00 0.00 0.00 0.00 46.02 44.69 1brm n GLY 269 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1brm s ALA 270 N 2.91 2.87 -0.19 4.61 0.00 -1.26 -5.04 121.76 125.67 1brm s ALA 270 Ca 0.49 -1.80 -0.19 0.00 0.00 0.00 0.00 51.96 50.46 1brm s ALA 270 Cb 0.13 -0.42 -0.15 0.00 0.00 0.00 0.00 23.12 22.68 1brm s ALA 270 CO -0.04 0.28 0.14 -0.07 0.00 0.00 0.00 175.76 176.07 1brm h LEU 271 N 2.17 0.00 0.00 0.00 3.38 -1.94 -0.64 115.31 118.29 1brm h LEU 271 Ca -0.41 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.15 1brm h LEU 271 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 1brm h LEU 271 CO 0.60 1.29 -0.73 0.54 0.09 0.00 0.00 178.44 180.23 1brm n ARG 272 N -4.49 2.15 -2.71 1.13 1.74 -1.26 -0.83 116.66 112.40 1brm n ARG 272 Ca -0.25 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.44 1brm n ARG 272 Cb 0.57 -0.87 -0.06 0.00 -1.02 0.00 0.00 32.46 31.09 1brm n ARG 272 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1brm s HIS 274 N -1.32 2.98 0.06 0.00 3.76 -0.10 -3.27 115.29 117.40 1brm s HIS 274 Ca 0.45 -0.82 0.04 0.00 -0.15 0.00 0.00 55.06 54.58 1brm s HIS 274 Cb -0.25 -2.12 -0.04 0.00 1.11 0.00 0.00 32.58 31.29 1brm s HIS 274 CO 0.31 -0.49 -0.02 -1.12 -0.85 0.00 0.00 174.74 172.57 1brm s SER 275 N 1.43 4.93 0.00 1.40 0.01 -0.68 -2.49 113.70 118.31 1brm s SER 275 Ca 0.05 -0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.16 1brm s SER 275 Cb -0.14 -1.18 -0.00 0.00 0.21 0.00 0.00 66.02 64.90 1brm s SER 275 CO -0.02 0.22 -0.00 -1.10 0.41 0.00 0.00 173.24 172.75 1brm s GLN 276 N -1.98 0.02 -0.20 12.44 -0.21 0.02 -0.16 119.66 129.59 1brm s GLN 276 Ca 0.23 -0.04 -0.04 0.00 0.02 0.00 0.00 55.36 55.52 1brm s GLN 276 Cb -0.11 0.01 -0.01 0.00 1.00 0.00 0.00 33.01 33.89 1brm s GLN 276 CO 0.14 -0.00 -0.04 0.00 -2.12 0.00 0.00 175.29 173.27 1brm s ALA 277 N -0.10 2.86 0.26 6.09 0.00 -0.24 -0.45 121.76 130.18 1brm s ALA 277 Ca -0.01 -1.07 0.10 0.00 0.00 0.00 0.00 51.96 50.98 1brm s ALA 277 Cb -0.01 -1.66 -0.05 0.00 0.00 0.00 0.00 23.12 21.41 1brm s ALA 277 CO -0.00 -0.25 -0.09 -0.06 0.00 0.00 0.00 175.76 175.36 1brm s PHE 278 N 1.17 2.54 -0.36 0.00 0.08 0.15 -2.04 117.98 119.52 1brm s PHE 278 Ca 0.02 -0.26 0.00 0.00 0.12 0.00 0.00 56.93 56.81 1brm s PHE 278 Cb -0.14 -1.13 0.14 0.00 -0.57 0.00 0.00 43.02 41.32 1brm s PHE 278 CO -0.01 0.64 0.23 0.99 -0.10 0.00 0.00 175.22 176.97 1brm s THR 279 N -2.31 0.15 -0.19 0.64 2.01 -0.74 -2.36 115.64 112.84 1brm s THR 279 Ca 0.30 -1.80 -0.21 0.00 0.31 0.00 0.00 61.69 60.29 1brm s THR 279 Cb -0.06 -1.12 -0.03 0.00 0.01 0.00 0.00 72.50 71.30 1brm s THR 279 CO 0.17 -1.02 0.62 -0.63 -0.69 0.00 0.00 174.62 173.07 1brm s ILE 280 N 0.96 5.04 -0.80 1.82 1.09 0.14 -2.34 121.20 127.10 1brm s ILE 280 Ca 0.20 1.16 -0.22 0.00 -1.10 0.00 0.00 60.65 60.69 1brm s ILE 280 Cb -0.20 -3.93 0.08 0.00 -1.06 0.00 0.00 42.46 37.35 1brm s ILE 280 CO -0.01 0.13 1.14 -0.75 -0.10 0.00 0.00 174.94 175.34 1brm s LYS 281 N 1.80 3.33 0.66 2.79 2.47 -0.86 -0.43 119.74 129.50 1brm s LYS 281 Ca 0.28 -1.04 -0.18 0.00 -1.56 0.00 0.00 55.97 53.48 1brm s LYS 281 Cb -0.16 -4.59 -0.01 0.00 -1.46 0.00 0.00 37.83 31.61 1brm s LYS 281 CO 0.11 -1.92 1.19 1.28 0.16 0.00 0.00 175.35 176.17 1brm n LEU 282 N 7.84 5.27 0.12 5.43 4.77 0.16 -1.07 117.00 139.51 1brm n LEU 282 Ca 0.11 0.79 0.13 0.00 -0.03 0.00 0.00 56.01 57.01 1brm n LEU 282 Cb 0.48 -1.51 0.44 0.00 -2.33 0.00 0.00 43.42 40.50 1brm n LEU 282 CO 0.62 -1.31 0.88 0.29 -1.33 0.00 0.00 177.39 176.53 1brm n LYS 283 N -1.80 0.24 -3.57 3.23 5.02 0.14 -4.67 118.16 116.76 1brm n LYS 283 Ca 0.15 0.29 -0.12 0.00 -2.02 0.00 0.00 58.31 56.62 1brm n LYS 283 Cb 0.48 -1.83 -0.05 0.00 -0.02 0.00 0.00 35.03 33.61 1brm n LYS 283 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1brm s LYS 284 N -3.18 0.67 -0.13 1.97 -2.85 -1.26 -5.06 119.74 109.90 1brm s LYS 284 Ca 0.08 0.16 -0.36 0.00 -1.00 0.00 0.00 55.97 54.85 1brm s LYS 284 Cb 0.11 0.32 -0.13 0.00 -2.06 0.00 0.00 37.83 36.06 1brm s LYS 284 CO 0.53 -0.21 1.79 -3.47 0.10 0.00 0.00 175.35 174.09 1brm n ASP 285 N 0.75 2.98 -3.79 0.03 -0.08 -1.26 -4.90 116.55 110.29 1brm n ASP 285 Ca -0.12 1.02 -0.18 0.00 -1.51 0.00 0.00 54.79 54.01 1brm n ASP 285 Cb 0.58 -1.29 -0.17 0.00 2.34 0.00 0.00 41.12 42.59 1brm n ASP 285 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1brm s VAL 286 N 3.55 0.12 0.45 5.18 1.01 -1.26 -5.09 120.40 124.36 1brm s VAL 286 Ca 0.94 0.16 -0.22 0.00 0.00 0.00 0.00 61.98 62.85 1brm s VAL 286 Cb -0.84 -0.25 -0.11 0.00 0.00 0.00 0.00 36.38 35.19 1brm s VAL 286 CO 0.56 0.15 0.76 -0.24 0.00 0.00 0.00 175.10 176.32 1brm n SER 287 N 4.40 0.06 -0.11 3.32 2.88 -1.26 -4.78 113.62 118.14 1brm n SER 287 Ca -0.22 0.94 -0.12 0.00 -1.33 0.00 0.00 58.87 58.14 1brm n SER 287 Cb 0.50 -1.23 -0.03 0.00 -0.75 0.00 0.00 64.21 62.70 1brm n SER 287 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 1brm h ILE 288 N 1.01 1.29 -0.16 2.46 5.03 -1.99 -1.86 117.51 123.29 1brm h ILE 288 Ca -0.43 -1.29 0.05 0.00 -0.12 0.00 0.00 64.86 63.07 1brm h ILE 288 Cb 1.37 1.41 -0.01 0.00 -3.03 0.00 0.00 36.82 36.57 1brm h ILE 288 CO 0.53 0.42 0.18 -0.65 -0.68 0.00 0.00 178.15 177.95 1brm h PRO 289 N 0.47 0.00 0.23 2.37 0.11 -1.99 -0.20 132.00 132.99 1brm h PRO 289 Ca 0.07 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.17 1brm h PRO 289 Cb 0.71 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.82 1brm h PRO 289 CO 0.05 0.00 -0.11 1.15 -0.21 0.00 0.00 178.00 178.88 1brm h THR 290 N 0.00 0.00 -0.94 -1.15 2.02 -1.83 -2.56 112.91 108.45 1brm h THR 290 Ca 0.08 -0.62 0.29 0.00 0.77 0.00 0.00 66.41 66.93 1brm h THR 290 Cb 0.43 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.68 1brm h THR 290 CO -0.00 0.00 0.29 0.58 0.37 0.00 0.00 175.52 176.76 1brm h VAL 291 N -0.93 0.20 -0.11 3.16 2.07 -0.64 0.77 116.25 120.77 1brm h VAL 291 Ca -0.03 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 1brm h VAL 291 Cb 0.24 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.04 1brm h VAL 291 CO 0.05 0.03 0.05 -0.33 0.02 0.00 0.00 177.57 177.39 1brm h GLU 292 N 0.15 0.16 -0.32 1.57 5.08 -1.13 -1.23 114.58 118.85 1brm h GLU 292 Ca 0.64 -0.02 0.07 0.00 -1.00 0.00 0.00 59.36 59.05 1brm h GLU 292 Cb 1.40 -0.03 -0.08 0.00 0.50 0.00 0.00 28.75 30.54 1brm h GLU 292 CO -0.73 0.23 -0.26 0.93 -1.00 0.00 0.00 179.01 178.18 1brm h GLU 293 N 0.05 -0.21 -0.63 2.33 5.08 0.91 -1.86 114.58 120.24 1brm h GLU 293 Ca 0.04 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1brm h GLU 293 Cb 0.12 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 1brm h GLU 293 CO -0.00 -0.14 0.29 -0.07 -1.00 0.00 0.00 179.01 178.08 1brm h LEU 294 N -0.22 0.82 -0.41 1.33 3.38 -0.90 -2.61 115.31 116.69 1brm h LEU 294 Ca 0.16 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1brm h LEU 294 Cb 0.48 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1brm h LEU 294 CO -0.45 0.71 0.06 -0.07 0.09 0.00 0.00 178.44 178.77 1brm h LEU 295 N 0.90 0.66 -0.52 1.67 3.38 -0.45 -2.99 115.31 117.97 1brm h LEU 295 Ca 0.22 -0.27 -0.16 0.00 0.09 0.00 0.00 57.88 57.76 1brm h LEU 295 Cb 0.12 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1brm h LEU 295 CO -0.03 0.76 -0.51 0.00 0.09 0.00 0.00 178.44 178.76 1brm h ALA 296 N 0.92 0.70 -0.00 1.53 0.00 -1.30 -3.23 119.26 117.89 1brm h ALA 296 Ca 0.12 -0.49 -0.08 0.00 0.00 0.00 0.00 54.91 54.46 1brm h ALA 296 Cb 0.39 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1brm h ALA 296 CO 0.01 0.68 -0.39 0.00 0.00 0.00 0.00 179.25 179.55 1brm h ALA 297 N 0.96 1.35 -0.61 0.00 0.00 -1.47 -3.24 119.26 116.25 1brm h ALA 297 Ca 0.02 -0.36 0.10 0.00 0.00 0.00 0.00 54.91 54.67 1brm h ALA 297 Cb 1.05 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.71 1brm h ALA 297 CO 0.10 0.49 0.21 1.25 0.00 0.00 0.00 179.25 181.30 1brm h HIS 298 N 0.00 0.35 -2.15 0.00 6.17 -1.54 -3.45 115.15 114.54 1brm h HIS 298 Ca -0.00 0.03 -0.01 0.00 0.71 0.00 0.00 60.37 61.09 1brm h HIS 298 Cb 0.69 -0.07 -0.18 0.00 2.52 0.00 0.00 27.41 30.38 1brm h HIS 298 CO 0.00 0.07 0.28 0.54 0.71 0.00 0.00 177.93 179.53 1brm s ASN 299 N -5.37 -0.57 0.00 3.26 2.20 -1.22 -4.98 114.94 108.26 1brm s ASN 299 Ca -0.13 0.46 0.10 0.00 -0.94 0.00 0.00 52.86 52.35 1brm s ASN 299 Cb 0.17 0.50 0.61 0.00 -2.00 0.00 0.00 41.25 40.53 1brm s ASN 299 CO 0.74 -0.64 1.04 -0.81 -2.94 0.00 0.00 177.10 174.49 1brm n PRO 300 N 0.52 0.43 -0.00 3.55 -0.04 -1.26 -2.56 135.00 135.63 1brm n PRO 300 Ca -0.16 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.38 1brm n PRO 300 Cb 0.59 -1.37 -0.11 0.00 -0.04 0.00 0.00 33.50 32.57 1brm n PRO 300 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1brm n TRP 301 N -0.87 0.00 -2.61 0.54 8.01 -1.26 -4.68 117.44 116.56 1brm n TRP 301 Ca 0.08 0.00 -0.43 0.00 -1.31 0.00 0.00 57.50 55.83 1brm n TRP 301 Cb 0.04 -0.21 0.00 0.00 -2.01 0.00 0.00 31.31 29.13 1brm n TRP 301 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1brm n ALA 302 N -1.76 4.38 -2.30 6.99 0.00 -1.06 -0.16 120.51 126.60 1brm n ALA 302 Ca -0.00 -4.17 -0.43 0.00 0.00 0.00 0.00 53.44 48.84 1brm n ALA 302 Cb 0.34 -3.17 -0.02 0.00 0.00 0.00 0.00 19.45 16.60 1brm n ALA 302 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1brm s LYS 303 N 1.82 4.07 -0.23 0.00 2.20 -1.25 -4.24 119.74 122.12 1brm s LYS 303 Ca 0.44 1.64 -0.24 0.00 -0.36 0.00 0.00 55.97 57.45 1brm s LYS 303 Cb 0.03 -3.87 -0.01 0.00 -1.51 0.00 0.00 37.83 32.47 1brm s LYS 303 CO 0.01 -0.93 0.82 0.08 -0.36 0.00 0.00 175.35 174.97 1brm s VAL 304 N 4.09 4.85 -0.26 4.02 1.01 -1.26 -0.56 120.40 132.28 1brm s VAL 304 Ca 0.61 1.56 -0.11 0.00 0.00 0.00 0.00 61.98 64.04 1brm s VAL 304 Cb -0.23 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 31.99 1brm s VAL 304 CO 0.21 -0.06 0.17 -0.69 0.00 0.00 0.00 175.10 174.74 1brm s VAL 305 N 2.73 5.28 0.83 2.92 1.01 0.92 -4.95 120.40 129.14 1brm s VAL 305 Ca 0.35 0.16 -0.13 0.00 0.00 0.00 0.00 61.98 62.36 1brm s VAL 305 Cb -0.15 -3.49 0.07 0.00 0.00 0.00 0.00 36.38 32.80 1brm s VAL 305 CO 0.08 0.29 1.04 -2.65 0.00 0.00 0.00 175.10 173.86 1brm n PRO 306 N 4.76 0.08 -0.92 2.72 -0.02 -1.26 -4.16 135.00 136.21 1brm n PRO 306 Ca -0.14 0.10 -0.11 0.00 -2.02 0.00 0.00 63.50 61.33 1brm n PRO 306 Cb 0.52 -2.31 -0.15 0.00 -0.02 0.00 0.00 33.50 31.54 1brm n PRO 306 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1brm n ASN 307 N -2.86 4.95 -4.61 2.55 4.05 -1.26 -4.52 115.26 113.56 1brm n ASN 307 Ca 0.12 -2.42 -0.33 0.00 0.45 0.00 0.00 54.58 52.41 1brm n ASN 307 Cb 0.51 -1.32 -0.10 0.00 1.23 0.00 0.00 39.78 40.09 1brm n ASN 307 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 177.26 172.40 1brm s ASP 308 N 2.05 4.74 0.09 1.20 1.01 -1.26 -5.02 116.67 119.48 1brm s ASP 308 Ca 0.59 -0.09 -0.26 0.00 0.71 0.00 0.00 52.55 53.50 1brm s ASP 308 Cb 0.28 -1.15 -0.11 0.00 1.01 0.00 0.00 42.92 42.95 1brm s ASP 308 CO 0.00 0.30 1.43 -0.09 0.21 0.00 0.00 175.17 177.01 1brm h ARG 309 N 4.62 -0.49 0.06 8.23 2.43 -1.99 -2.11 114.38 125.12 1brm h ARG 309 Ca -0.49 0.03 0.01 0.00 -0.81 0.00 0.00 59.98 58.73 1brm h ARG 309 Cb 1.17 0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 30.80 1brm h ARG 309 CO 0.54 -0.33 -0.34 0.93 -1.51 0.00 0.00 179.97 179.26 1brm h GLU 310 N -0.51 -0.46 -0.66 0.20 3.07 -1.97 -2.06 114.58 112.19 1brm h GLU 310 Ca 0.01 0.03 0.07 0.00 -0.50 0.00 0.00 59.36 58.97 1brm h GLU 310 Cb 0.55 0.10 -0.06 0.00 -0.84 0.00 0.00 28.75 28.51 1brm h GLU 310 CO -0.29 -0.31 0.35 0.97 -1.40 0.00 0.00 179.01 178.34 1brm h ILE 311 N -0.48 0.93 -0.54 3.13 2.10 -1.92 -1.14 117.51 119.60 1brm h ILE 311 Ca -0.00 -0.22 0.11 0.00 1.08 0.00 0.00 64.86 65.83 1brm h ILE 311 Cb 0.49 0.24 -0.09 0.00 -1.09 0.00 0.00 36.82 36.37 1brm h ILE 311 CO -0.20 0.12 0.01 0.74 -1.08 0.00 0.00 178.15 177.73 1brm h THR 312 N 0.63 0.58 0.00 2.19 2.02 -1.20 0.55 112.91 117.68 1brm h THR 312 Ca 0.31 -0.04 -0.06 0.00 0.77 0.00 0.00 66.41 67.38 1brm h THR 312 Cb 0.24 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 1brm h THR 312 CO -0.21 0.02 -0.29 0.24 0.37 0.00 0.00 175.52 175.66 1brm h MET 313 N 0.12 0.00 0.07 6.66 2.86 -0.77 -1.54 114.93 122.34 1brm h MET 313 Ca 0.27 0.00 -0.28 0.00 -2.06 0.00 0.00 59.70 57.64 1brm h MET 313 Cb 0.42 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.06 1brm h MET 313 CO -0.45 0.29 -1.41 -0.09 1.06 0.00 0.00 176.91 176.31 1brm h ARG 314 N 0.00 0.16 0.00 1.72 2.43 0.46 -3.43 114.38 115.71 1brm h ARG 314 Ca -0.00 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 58.90 1brm h ARG 314 Cb 0.71 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 1brm h ARG 314 CO 0.04 1.01 -0.93 0.39 -1.51 0.00 0.00 179.97 178.96 1brm n GLU 315 N -3.38 2.70 -1.51 0.20 1.02 0.16 -4.82 120.64 115.02 1brm n GLU 315 Ca -0.12 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.74 1brm n GLU 315 Cb 1.02 -0.96 -0.05 0.00 -0.02 0.00 0.00 31.44 31.43 1brm n GLU 315 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1brm n LEU 316 N -1.74 6.54 -3.93 -4.62 7.94 -0.58 -4.63 117.00 115.98 1brm n LEU 316 Ca 0.00 -4.11 -0.10 0.00 -1.11 0.00 0.00 56.01 50.69 1brm n LEU 316 Cb 0.32 -1.22 -0.12 0.00 0.53 0.00 0.00 43.42 42.94 1brm n LEU 316 CO 0.00 1.72 -0.33 0.42 -1.11 0.00 0.00 177.39 178.09 1brm s THR 317 N -2.44 0.07 0.23 1.96 -4.23 -1.26 -4.93 115.64 105.04 1brm s THR 317 Ca 0.58 -0.62 -0.10 0.00 -1.18 0.00 0.00 61.69 60.37 1brm s THR 317 Cb 0.39 -0.22 0.27 0.00 1.34 0.00 0.00 72.50 74.28 1brm s THR 317 CO -0.23 -0.34 1.63 -0.65 -0.54 0.00 0.00 174.62 174.48 1brm h PRO 318 N 5.04 0.05 -1.09 3.99 0.11 -1.95 0.42 132.00 138.57 1brm h PRO 318 Ca -0.30 -0.00 0.30 0.00 0.11 0.00 0.00 66.00 66.11 1brm h PRO 318 Cb 1.21 -0.01 -0.06 0.00 0.11 0.00 0.00 31.00 32.24 1brm h PRO 318 CO 0.43 0.03 0.75 0.00 -0.21 0.00 0.00 178.00 179.00 1brm h ALA 319 N 1.69 2.73 0.11 -0.75 0.00 -1.96 0.22 119.26 121.30 1brm h ALA 319 Ca 0.36 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.97 1brm h ALA 319 Cb 0.60 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1brm h ALA 319 CO -0.68 -1.09 -1.56 0.00 0.00 0.00 0.00 179.25 175.92 1brm h ALA 320 N 1.51 0.30 0.16 0.00 0.00 -0.50 -3.40 119.26 117.34 1brm h ALA 320 Ca 0.56 -1.14 -0.36 0.00 0.00 0.00 0.00 54.91 53.97 1brm h ALA 320 Cb 1.89 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 19.98 1brm h ALA 320 CO -0.12 1.16 -1.85 0.28 0.00 0.00 0.00 179.25 178.72 1brm h VAL 321 N 0.07 0.81 -0.71 0.00 2.07 -0.25 -3.47 116.25 114.77 1brm h VAL 321 Ca -0.25 -2.44 -0.60 0.00 0.82 0.00 0.00 66.70 64.23 1brm h VAL 321 Cb 2.02 2.67 0.02 0.00 -1.52 0.00 0.00 31.29 34.47 1brm h VAL 321 CO 0.16 0.88 0.29 0.41 0.02 0.00 0.00 177.57 179.32 1brm n THR 322 N -3.55 0.00 -0.81 2.57 -1.04 0.59 -0.46 114.28 111.57 1brm n THR 322 Ca -0.28 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.73 1brm n THR 322 Cb 1.07 -0.20 0.00 0.00 -1.82 0.00 0.00 70.33 69.38 1brm n THR 322 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1brm n GLY 323 N 2.05 1.06 3.74 3.41 0.00 -1.26 -5.03 105.19 109.16 1brm n GLY 323 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 1brm n GLY 323 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1brm s THR 324 N -3.69 3.06 -1.70 2.61 -4.23 0.39 -5.02 115.64 107.06 1brm s THR 324 Ca 0.00 -1.67 0.14 0.00 -1.18 0.00 0.00 61.69 58.99 1brm s THR 324 Cb 0.00 -2.99 0.47 0.00 1.34 0.00 0.00 72.50 71.32 1brm s THR 324 CO 0.00 -0.18 1.37 0.18 -0.54 0.00 0.00 174.62 175.45 1brm n LEU 325 N -1.17 3.03 -4.76 4.79 4.77 -1.26 -4.49 117.00 117.91 1brm n LEU 325 Ca -0.03 -1.52 -0.40 0.00 -0.03 0.00 0.00 56.01 54.03 1brm n LEU 325 Cb 0.61 -0.40 -0.06 0.00 -2.33 0.00 0.00 43.42 41.25 1brm n LEU 325 CO 0.43 0.65 0.46 -0.89 -1.33 0.00 0.00 177.39 176.71 1brm s THR 326 N -1.50 4.56 -0.54 -5.08 2.01 -1.26 -4.82 115.64 109.01 1brm s THR 326 Ca 0.35 1.65 0.06 0.00 0.31 0.00 0.00 61.69 64.05 1brm s THR 326 Cb 0.20 -4.12 0.22 0.00 0.01 0.00 0.00 72.50 68.81 1brm s THR 326 CO 0.21 0.45 0.55 0.35 -0.69 0.00 0.00 174.62 175.48 1brm n THR 327 N 2.17 0.61 -2.13 -0.82 -2.24 0.77 -4.42 114.28 108.22 1brm n THR 327 Ca -0.04 -4.44 -0.36 0.00 -2.27 0.00 0.00 64.05 56.93 1brm n THR 327 Cb 0.49 -1.99 0.01 0.00 -2.10 0.00 0.00 70.33 66.75 1brm n THR 327 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1brm s PRO 328 N -1.38 3.35 -0.06 -0.78 0.04 -1.15 -3.77 135.00 131.25 1brm s PRO 328 Ca 0.34 1.80 0.05 0.00 0.04 0.00 0.00 61.00 63.23 1brm s PRO 328 Cb 0.09 -2.14 -0.01 0.00 0.04 0.00 0.00 34.50 32.49 1brm s PRO 328 CO -0.11 -0.90 -0.22 0.08 0.04 0.00 0.00 177.00 175.89 1brm s VAL 329 N -1.59 1.82 0.15 -0.36 1.01 0.28 -2.22 120.40 119.48 1brm s VAL 329 Ca 0.71 -0.92 -0.02 0.00 0.00 0.00 0.00 61.98 61.75 1brm s VAL 329 Cb -0.29 -1.55 0.01 0.00 0.00 0.00 0.00 36.38 34.55 1brm s VAL 329 CO 0.34 0.51 0.23 0.61 0.00 0.00 0.00 175.10 176.79 1brm n GLY 330 N 3.15 2.40 3.38 4.51 0.00 0.04 -0.06 105.19 118.61 1brm n GLY 330 Ca -0.18 -1.37 -0.24 0.00 0.00 0.00 0.00 46.02 44.22 1brm n GLY 330 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1brm n ARG 331 N -0.23 -5.15 -2.75 1.61 5.12 -1.26 -0.40 116.66 113.59 1brm n ARG 331 Ca -0.01 0.73 -0.43 0.00 -1.93 0.00 0.00 57.85 56.21 1brm n ARG 331 Cb 0.24 -5.59 -0.03 0.00 -1.16 0.00 0.00 32.46 25.92 1brm n ARG 331 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1brm s LEU 332 N -6.86 4.05 -0.08 0.55 1.43 -1.25 -3.96 118.68 112.55 1brm s LEU 332 Ca 0.45 1.09 -0.30 0.00 -1.03 0.00 0.00 54.13 54.34 1brm s LEU 332 Cb -0.21 -3.39 0.12 0.00 0.03 0.00 0.00 46.19 42.73 1brm s LEU 332 CO 0.55 -0.69 0.96 0.00 0.23 0.00 0.00 176.35 177.41 1brm s ARG 333 N 3.21 0.68 0.00 1.70 1.70 -1.20 -4.84 118.95 120.20 1brm s ARG 333 Ca 0.40 -0.13 -0.30 0.00 -0.47 0.00 0.00 55.73 55.23 1brm s ARG 333 Cb -0.14 0.32 -0.03 0.00 -0.57 0.00 0.00 34.95 34.52 1brm s ARG 333 CO 0.10 -0.27 1.02 0.15 -1.08 0.00 0.00 175.30 175.22 1brm s LYS 334 N -2.37 4.53 0.81 3.89 -0.14 -1.26 -1.99 119.74 123.21 1brm s LYS 334 Ca 0.03 1.48 -0.12 0.00 -1.36 0.00 0.00 55.97 56.00 1brm s LYS 334 Cb -0.01 -3.45 0.08 0.00 -1.68 0.00 0.00 37.83 32.77 1brm s LYS 334 CO -0.05 -0.10 1.10 -0.51 -0.76 0.00 0.00 175.35 175.03 1brm s LEU 335 N 1.09 2.55 0.59 3.17 1.43 -0.92 -4.95 118.68 121.64 1brm s LEU 335 Ca 0.53 1.28 0.37 0.00 -1.03 0.00 0.00 54.13 55.28 1brm s LEU 335 Cb -0.22 -3.87 1.78 0.00 0.03 0.00 0.00 46.19 43.91 1brm s LEU 335 CO 0.28 -2.02 2.14 0.78 0.23 0.00 0.00 176.35 177.76 1brm h ASN 336 N -1.12 0.00 0.00 2.29 2.35 -1.96 -2.86 115.58 114.27 1brm h ASN 336 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 1brm h ASN 336 Cb 1.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.64 1brm h ASN 336 CO 0.59 0.02 0.00 1.15 -1.65 0.00 0.00 177.43 177.54 1brm n MET 337 N -3.16 0.74 0.00 0.81 0.00 -1.26 -4.93 117.12 109.32 1brm n MET 337 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.69 1brm n MET 337 Cb 0.21 -1.25 0.00 0.00 0.00 0.00 0.00 33.22 32.18 1brm n MET 337 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1brm n GLY 338 N 0.36 4.16 0.02 3.17 0.00 -1.08 -4.87 105.19 106.95 1brm n GLY 338 Ca 0.09 -1.56 0.15 0.00 0.00 0.00 0.00 46.02 44.70 1brm n GLY 338 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1brm n PRO 339 N -1.96 0.55 0.00 1.61 -0.05 -1.26 -2.46 135.00 131.43 1brm n PRO 339 Ca 0.00 -0.04 0.14 0.00 -0.05 0.00 0.00 63.50 63.55 1brm n PRO 339 Cb 0.00 -1.50 0.53 0.00 -0.05 0.00 0.00 33.50 32.49 1brm n PRO 339 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 175.50 175.84 1brm n GLU 340 N -1.19 0.99 -4.18 0.54 1.02 -1.26 -4.40 120.64 112.16 1brm n GLU 340 Ca 0.16 -0.48 -0.34 0.00 -0.02 0.00 0.00 57.16 56.47 1brm n GLU 340 Cb 0.23 -1.49 -0.12 0.00 -0.02 0.00 0.00 31.44 30.04 1brm n GLU 340 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1brm s PHE 341 N -2.34 3.10 0.07 -0.32 0.40 -1.03 0.35 117.98 118.21 1brm s PHE 341 Ca 0.31 -0.23 0.08 0.00 -0.60 0.00 0.00 56.93 56.49 1brm s PHE 341 Cb 0.20 -2.04 -0.03 0.00 0.51 0.00 0.00 43.02 41.66 1brm s PHE 341 CO 0.45 -0.04 -0.23 -1.17 0.70 0.00 0.00 175.22 174.93 1brm s LEU 342 N 0.58 2.21 0.08 -0.37 2.96 0.42 -2.16 118.68 122.41 1brm s LEU 342 Ca -0.00 -0.60 0.10 0.00 -0.22 0.00 0.00 54.13 53.41 1brm s LEU 342 Cb -0.14 -1.04 -0.03 0.00 0.50 0.00 0.00 46.19 45.48 1brm s LEU 342 CO 0.02 0.16 -0.26 -0.94 -1.32 0.00 0.00 176.35 174.01 1brm s SER 343 N -1.45 3.14 -0.07 3.68 1.04 -0.84 0.25 113.70 119.45 1brm s SER 343 Ca 0.09 -0.65 -0.25 0.00 0.48 0.00 0.00 55.95 55.61 1brm s SER 343 Cb -0.09 -0.25 0.06 0.00 0.10 0.00 0.00 66.02 65.84 1brm s SER 343 CO 0.03 0.21 0.56 0.00 0.98 0.00 0.00 173.24 175.02 1brm s ALA 344 N -0.93 -1.45 -0.09 5.32 0.00 -1.00 -3.24 121.76 120.37 1brm s ALA 344 Ca 0.12 1.10 0.02 0.00 0.00 0.00 0.00 51.96 53.20 1brm s ALA 344 Cb -0.10 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.91 1brm s ALA 344 CO 0.04 -0.33 -0.14 0.12 0.00 0.00 0.00 175.76 175.45 1brm s PHE 345 N -1.00 1.81 0.19 0.00 5.36 0.46 0.33 117.98 125.13 1brm s PHE 345 Ca -0.10 -0.80 0.10 0.00 -0.96 0.00 0.00 56.93 55.17 1brm s PHE 345 Cb -0.02 -1.31 -0.04 0.00 -0.34 0.00 0.00 43.02 41.30 1brm s PHE 345 CO 0.07 -0.41 -0.20 0.95 -1.46 0.00 0.00 175.22 174.16 1brm s THR 346 N 0.90 2.11 0.03 0.12 -4.23 0.40 -0.78 115.64 114.19 1brm s THR 346 Ca -0.09 -2.05 0.02 0.00 -1.18 0.00 0.00 61.69 58.39 1brm s THR 346 Cb -0.15 -2.02 -0.02 0.00 1.34 0.00 0.00 72.50 71.65 1brm s THR 346 CO 0.00 -0.27 -0.07 -0.69 -0.54 0.00 0.00 174.62 173.06 1brm s VAL 347 N -2.02 0.49 -0.27 2.29 1.01 -0.94 -0.80 120.40 120.15 1brm s VAL 347 Ca 0.20 -0.81 -0.26 0.00 0.00 0.00 0.00 61.98 61.12 1brm s VAL 347 Cb -0.06 -0.52 0.14 0.00 0.00 0.00 0.00 36.38 35.94 1brm s VAL 347 CO 0.09 -0.23 1.16 -0.83 0.00 0.00 0.00 175.10 175.29 1brm s GLY 348 N -1.12 -0.01 0.06 4.51 0.00 -1.04 -2.93 107.32 106.79 1brm s GLY 348 Ca -0.06 2.86 -0.31 0.00 0.00 0.00 0.00 44.72 47.21 1brm s GLY 348 CO 0.00 1.76 1.50 -0.35 0.00 0.00 0.00 173.10 176.01 1brm s ASP 349 N -0.00 6.74 0.28 1.64 -1.08 -1.26 -0.92 116.67 122.07 1brm s ASP 349 Ca 0.04 2.32 0.09 0.00 -0.52 0.00 0.00 52.55 54.48 1brm s ASP 349 Cb -0.04 -2.57 0.39 0.00 -1.46 0.00 0.00 42.92 39.24 1brm s ASP 349 CO -0.08 -0.77 1.64 -0.61 0.52 0.00 0.00 175.17 175.87 1brm h GLN 350 N 7.74 0.09 0.00 4.34 -0.00 -1.42 -3.23 115.11 122.64 1brm h GLN 350 Ca -0.41 -0.06 -0.12 0.00 -0.00 0.00 0.00 58.65 58.06 1brm h GLN 350 Cb 1.19 0.01 -0.02 0.00 0.00 0.00 0.00 27.48 28.66 1brm h GLN 350 CO 0.91 0.62 -0.59 -0.07 0.00 0.00 0.00 178.83 179.70 1brm h LEU 351 N 0.07 0.00 0.00 -2.39 3.38 -1.89 -1.83 115.31 112.64 1brm h LEU 351 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1brm h LEU 351 Cb 1.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1brm h LEU 351 CO 0.08 0.59 0.00 0.18 0.09 0.00 0.00 178.44 179.37 1brm n LEU 352 N -3.63 0.00 0.28 1.67 4.77 -1.23 -2.06 117.00 116.80 1brm n LEU 352 Ca -0.01 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.10 1brm n LEU 352 Cb 0.63 0.00 0.82 0.00 -2.33 0.00 0.00 43.42 42.54 1brm n LEU 352 CO 0.41 0.00 1.08 -0.50 -1.33 0.00 0.00 177.39 177.05 1brm h TRP 353 N 0.00 0.00 0.00 -1.77 4.06 -1.81 0.40 115.95 116.83 1brm h TRP 353 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1brm h TRP 353 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 1brm h TRP 353 CO 0.00 0.03 -0.12 0.41 -3.56 0.00 0.00 178.44 175.20 1brm n GLY 354 N -1.26 -1.46 0.15 1.49 0.00 -1.12 -4.62 105.19 98.37 1brm n GLY 354 Ca -0.03 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1brm n GLY 354 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1brm n ALA 355 N -1.52 2.00 -0.02 4.61 0.00 -0.33 -4.28 120.51 120.97 1brm n ALA 355 Ca 0.07 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.35 1brm n ALA 355 Cb 0.35 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.67 1brm n ALA 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1brm h ALA 356 N 0.03 0.00 -0.96 0.00 0.00 -0.76 -3.38 119.26 114.19 1brm h ALA 356 Ca 0.00 -0.51 0.19 0.00 0.00 0.00 0.00 54.91 54.58 1brm h ALA 356 Cb 0.00 0.03 -0.18 0.00 0.00 0.00 0.00 17.79 17.64 1brm h ALA 356 CO 0.00 0.12 -0.25 -1.91 0.00 0.00 0.00 179.25 177.21 1brm n GLU 357 N -4.46 -0.10 -0.17 0.00 4.07 -0.02 0.09 120.64 120.06 1brm n GLU 357 Ca -0.11 1.49 0.06 0.00 -0.06 0.00 0.00 57.16 58.55 1brm n GLU 357 Cb 0.55 -2.23 0.36 0.00 -0.06 0.00 0.00 31.44 30.06 1brm n GLU 357 CO 0.00 0.00 0.00 -1.35 -0.06 0.00 0.00 177.13 175.72 1brm h PRO 358 N 0.00 0.72 0.34 5.31 0.11 -1.76 -2.30 132.00 134.41 1brm h PRO 358 Ca 0.45 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.50 1brm h PRO 358 Cb 0.69 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.64 1brm h PRO 358 CO -0.99 0.47 -0.16 -0.07 -0.21 0.00 0.00 178.00 177.05 1brm h LEU 359 N 0.74 -0.38 -0.95 2.35 3.38 -0.55 -2.06 115.31 117.83 1brm h LEU 359 Ca 0.30 -0.16 0.28 0.00 0.09 0.00 0.00 57.88 58.38 1brm h LEU 359 Cb 0.23 0.10 -0.14 0.00 0.09 0.00 0.00 40.66 40.94 1brm h LEU 359 CO -0.09 -0.00 0.45 -0.09 0.09 0.00 0.00 178.44 178.79 1brm h ARG 360 N -0.83 0.31 0.02 1.13 2.43 -1.00 0.11 114.38 116.56 1brm h ARG 360 Ca -0.05 -0.02 -0.21 0.00 -0.81 0.00 0.00 59.98 58.89 1brm h ARG 360 Cb 0.52 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 1brm h ARG 360 CO 0.08 0.21 -1.00 0.00 -1.51 0.00 0.00 179.97 177.74 1brm h ARG 361 N 0.32 0.06 -0.40 0.20 3.08 -1.42 -2.78 114.38 113.45 1brm h ARG 361 Ca 0.65 -0.09 -0.07 0.00 0.07 0.00 0.00 59.98 60.54 1brm h ARG 361 Cb 1.38 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.45 1brm h ARG 361 CO -0.60 1.01 -0.01 1.98 -1.07 0.00 0.00 179.97 181.27 1brm h MET 362 N 0.02 0.71 -0.76 0.04 4.05 -0.29 -2.38 114.93 116.32 1brm h MET 362 Ca -0.03 -0.23 0.05 0.00 -0.28 0.00 0.00 59.70 59.20 1brm h MET 362 Cb 1.73 -0.06 -0.05 0.00 -0.80 0.00 0.00 31.60 32.42 1brm h MET 362 CO 0.14 0.80 0.47 1.25 0.23 0.00 0.00 176.91 179.80 1brm h LEU 363 N 0.53 0.75 -0.95 3.39 5.85 -1.19 -1.68 115.31 122.01 1brm h LEU 363 Ca 0.11 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.88 1brm h LEU 363 Cb 0.49 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.32 1brm h LEU 363 CO 0.02 0.50 0.62 -0.09 -0.34 0.00 0.00 178.44 179.15 1brm h ARG 364 N 0.89 1.16 -0.65 1.25 2.43 -1.19 -0.21 114.38 118.06 1brm h ARG 364 Ca 0.32 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.42 1brm h ARG 364 Cb 0.10 -0.26 -0.03 0.00 -0.42 0.00 0.00 29.97 29.36 1brm h ARG 364 CO -0.14 0.77 0.38 1.96 -1.51 0.00 0.00 179.97 181.42 1brm h GLN 365 N 1.19 0.89 0.00 0.20 4.20 -0.81 -2.91 115.11 117.86 1brm h GLN 365 Ca 0.38 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 59.00 1brm h GLN 365 Cb 0.02 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 27.61 1brm h GLN 365 CO -0.13 0.65 -0.13 -0.07 -0.67 0.00 0.00 178.83 178.48 1brm h LEU 366 N 0.88 0.00 0.00 1.46 3.38 -0.98 -3.52 115.31 116.54 1brm h LEU 366 Ca 0.23 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1brm h LEU 366 Cb -0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1brm h LEU 366 CO -0.04 0.01 0.00 0.00 0.09 0.00 0.00 178.44 178.50