#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 2.83 -0.41 0.03 1.02 -1.26 -4.77 119.74 117.18 1brm s LYS 2 Ca 0.00 0.32 -0.12 0.00 0.02 0.00 0.00 55.97 56.19 1brm s LYS 2 Cb 0.00 -2.08 0.05 0.00 -0.52 0.00 0.00 37.83 35.27 1brm s LYS 2 CO 0.00 -0.98 0.27 -0.80 -0.92 0.00 0.00 175.35 172.92 1brm s ASN 3 N -4.36 5.86 -0.18 2.83 0.01 -1.26 -0.40 114.94 117.44 1brm s ASN 3 Ca 0.57 -1.15 -0.06 0.00 -0.71 0.00 0.00 52.86 51.51 1brm s ASN 3 Cb -0.11 -2.07 -0.04 0.00 0.41 0.00 0.00 41.25 39.44 1brm s ASN 3 CO 0.50 -0.48 0.03 -0.69 -1.51 0.00 0.00 177.10 174.95 1brm s VAL 4 N 1.57 4.50 -0.12 1.60 1.01 0.04 -1.07 120.40 127.93 1brm s VAL 4 Ca 0.03 -0.14 -0.04 0.00 0.00 0.00 0.00 61.98 61.84 1brm s VAL 4 Cb -0.21 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 33.12 1brm s VAL 4 CO 0.06 0.46 0.02 -0.83 0.00 0.00 0.00 175.10 174.81 1brm s GLY 5 N 0.44 1.87 -0.14 4.51 0.00 0.56 0.00 107.32 114.57 1brm s GLY 5 Ca 0.01 -0.78 0.00 0.00 0.00 0.00 0.00 44.72 43.95 1brm s GLY 5 CO 0.01 -0.35 -0.15 -1.36 0.00 0.00 0.00 173.10 171.25 1brm s PHE 6 N -0.46 2.77 -0.04 1.90 0.08 0.48 -0.33 117.98 122.39 1brm s PHE 6 Ca 0.09 -0.85 0.06 0.00 0.12 0.00 0.00 56.93 56.34 1brm s PHE 6 Cb -0.12 -1.85 -0.01 0.00 -0.57 0.00 0.00 43.02 40.47 1brm s PHE 6 CO 0.02 -0.35 -0.22 0.42 -0.10 0.00 0.00 175.22 175.00 1brm s ILE 7 N 0.56 1.75 -1.02 0.64 1.01 -0.67 -2.60 121.20 120.87 1brm s ILE 7 Ca -0.09 -0.92 -0.01 0.00 0.00 0.00 0.00 60.65 59.63 1brm s ILE 7 Cb -0.16 -1.47 0.00 0.00 0.01 0.00 0.00 42.46 40.84 1brm s ILE 7 CO 0.04 0.49 0.16 0.61 0.00 0.00 0.00 174.94 176.24 1brm n GLY 8 N 2.81 -0.11 0.04 6.18 0.00 -1.26 -0.76 105.19 112.10 1brm n GLY 8 Ca -0.17 -0.30 0.15 0.00 0.00 0.00 0.00 46.02 45.70 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 -4.01 0.00 -0.03 1.61 4.27 -1.26 -3.28 117.44 114.74 1brm n TRP 9 Ca -0.12 0.00 -0.05 0.00 -3.89 0.00 0.00 57.50 53.44 1brm n TRP 9 Cb 0.60 -0.18 -0.13 0.00 -1.36 0.00 0.00 31.31 30.23 1brm n TRP 9 CO 0.00 0.00 0.00 2.89 -2.29 0.00 0.00 177.69 178.29 1brm n ARG 10 N -1.09 0.65 -0.66 -2.67 1.85 -1.26 -2.75 116.66 110.72 1brm n ARG 10 Ca 0.17 0.17 -0.22 0.00 -1.00 0.00 0.00 57.85 56.97 1brm n ARG 10 Cb 0.22 -1.71 0.19 0.00 -1.05 0.00 0.00 32.46 30.11 1brm n ARG 10 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1brm n GLY 11 N 1.55 -2.88 0.14 2.89 0.00 -1.21 -4.51 105.19 101.17 1brm n GLY 11 Ca -0.18 -1.45 -0.05 0.00 0.00 0.00 0.00 46.02 44.34 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 0.00 -0.22 -0.93 1.61 4.05 -1.93 0.15 114.93 117.66 1brm h MET 12 Ca -0.30 0.02 0.14 0.00 -0.28 0.00 0.00 59.70 59.28 1brm h MET 12 Cb 0.92 0.05 -0.09 0.00 -0.80 0.00 0.00 31.60 31.68 1brm h MET 12 CO 0.19 -0.15 0.55 0.28 0.23 0.00 0.00 176.91 178.01 1brm h VAL 13 N -0.23 0.81 0.40 -5.77 2.07 -1.90 -1.68 116.25 109.96 1brm h VAL 13 Ca -0.01 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.22 1brm h VAL 13 Cb 0.22 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 29.93 1brm h VAL 13 CO -0.06 0.15 -0.21 1.23 0.02 0.00 0.00 177.57 178.70 1brm h GLY 14 N 0.80 -0.59 1.43 2.17 0.00 -1.57 0.76 103.07 106.07 1brm h GLY 14 Ca 0.49 0.23 0.02 0.00 0.00 0.00 0.00 47.33 48.07 1brm h GLY 14 CO -0.32 -0.22 0.26 1.76 0.00 0.00 0.00 176.54 178.03 1brm h SER 15 N -0.57 0.00 0.25 0.19 0.02 0.19 0.46 113.55 114.09 1brm h SER 15 Ca -0.05 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.56 1brm h SER 15 Cb 0.44 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 1brm h SER 15 CO 0.08 0.00 -1.82 0.58 -1.14 0.00 0.00 176.83 174.52 1brm h VAL 16 N 0.00 0.81 -0.45 2.27 2.07 -0.77 -3.10 116.25 117.07 1brm h VAL 16 Ca 0.04 -2.51 -0.07 0.00 0.82 0.00 0.00 66.70 64.98 1brm h VAL 16 Cb 0.57 2.59 -0.02 0.00 -1.52 0.00 0.00 31.29 32.91 1brm h VAL 16 CO -0.00 0.82 -0.00 0.25 0.02 0.00 0.00 177.57 178.65 1brm h LEU 17 N 0.07 0.79 0.65 2.57 5.85 0.18 -0.81 115.31 124.60 1brm h LEU 17 Ca -0.36 -0.31 -0.03 0.00 0.84 0.00 0.00 57.88 58.02 1brm h LEU 17 Cb 2.04 -0.21 0.01 0.00 0.37 0.00 0.00 40.66 42.87 1brm h LEU 17 CO 0.12 0.90 -0.31 0.24 -0.34 0.00 0.00 178.44 179.05 1brm h MET 18 N 0.65 -0.84 -0.56 1.25 2.86 -0.42 -0.07 114.93 117.80 1brm h MET 18 Ca 0.13 0.06 0.11 0.00 -2.06 0.00 0.00 59.70 57.94 1brm h MET 18 Cb 0.50 0.19 -0.10 0.00 0.06 0.00 0.00 31.60 32.26 1brm h MET 18 CO 0.02 -0.53 -0.02 0.37 1.06 0.00 0.00 176.91 177.82 1brm h GLN 19 N -0.98 0.09 -0.46 1.72 4.15 -1.53 0.35 115.11 118.44 1brm h GLN 19 Ca -0.09 -0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.34 1brm h GLN 19 Cb 0.70 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.34 1brm h GLN 19 CO 0.15 0.06 0.29 0.00 -1.93 0.00 0.00 178.83 177.39 1brm h ARG 20 N 0.10 0.56 -0.00 1.69 2.47 -1.05 -0.07 114.38 118.07 1brm h ARG 20 Ca 0.28 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.97 1brm h ARG 20 Cb 0.44 -0.13 -0.00 0.00 -1.65 0.00 0.00 29.97 28.63 1brm h ARG 20 CO -0.49 0.37 -0.02 0.52 0.56 0.00 0.00 179.97 180.92 1brm h MET 21 N 0.58 -0.03 -0.81 0.04 2.86 0.54 -0.95 114.93 117.15 1brm h MET 21 Ca 0.18 0.00 0.12 0.00 -2.06 0.00 0.00 59.70 57.94 1brm h MET 21 Cb -0.02 0.01 -0.08 0.00 0.06 0.00 0.00 31.60 31.57 1brm h MET 21 CO -0.07 -0.02 0.43 0.28 1.06 0.00 0.00 176.91 178.59 1brm h VAL 22 N -0.03 0.81 -0.37 -2.22 2.07 -0.04 0.36 116.25 116.83 1brm h VAL 22 Ca 0.01 -0.23 0.03 0.00 0.82 0.00 0.00 66.70 67.33 1brm h VAL 22 Cb 0.04 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 29.85 1brm h VAL 22 CO -0.02 0.12 0.18 -0.33 0.02 0.00 0.00 177.57 177.54 1brm h GLU 23 N 0.67 0.35 -0.61 1.57 5.08 -0.20 -2.70 114.58 118.74 1brm h GLU 23 Ca 0.42 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.76 1brm h GLU 23 Cb 0.51 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1brm h GLU 23 CO -0.31 0.23 0.00 0.39 -1.00 0.00 0.00 179.01 178.32 1brm n GLU 24 N -4.95 2.91 -3.95 2.33 -0.58 -0.44 -4.93 120.64 111.03 1brm n GLU 24 Ca 0.01 -1.96 -0.27 0.00 -0.42 0.00 0.00 57.16 54.52 1brm n GLU 24 Cb 0.10 -1.71 -0.01 0.00 -0.57 0.00 0.00 31.44 29.25 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 0.68 -3.89 0.18 3.49 1.74 0.00 -4.86 116.66 114.01 1brm n ARG 25 Ca 0.18 0.47 0.07 0.00 -0.77 0.00 0.00 57.85 57.79 1brm n ARG 25 Cb 0.66 -4.89 0.21 0.00 -1.02 0.00 0.00 32.46 27.42 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 -1.82 0.00 1.43 0.55 3.32 -1.52 -3.26 116.42 115.11 1brm h ASP 26 Ca -0.61 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.44 1brm h ASP 26 Cb 1.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.92 1brm h ASP 26 CO 0.65 0.30 0.00 -0.26 -1.72 0.00 0.00 179.24 178.21 1brm h PHE 27 N 0.00 0.00 -0.97 4.55 0.04 -1.89 -3.34 116.94 115.32 1brm h PHE 27 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1brm h PHE 27 Cb 1.09 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 39.19 1brm h PHE 27 CO 0.00 0.00 0.61 -0.44 -0.60 0.00 0.00 178.31 177.88 1brm h ASP 28 N 0.00 1.15 -0.39 2.17 3.32 -1.90 -2.99 116.42 117.78 1brm h ASP 28 Ca 0.00 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1brm h ASP 28 Cb 0.71 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1brm h ASP 28 CO 0.00 0.86 0.00 0.00 -1.72 0.00 0.00 179.24 178.38 1brm n ALA 29 N -2.39 3.37 -2.68 3.45 0.00 -1.25 -4.94 120.51 116.07 1brm n ALA 29 Ca 0.11 -1.26 -0.10 0.00 0.00 0.00 0.00 53.44 52.19 1brm n ALA 29 Cb 0.04 -1.08 -0.08 0.00 0.00 0.00 0.00 19.45 18.33 1brm n ALA 29 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1brm s ILE 30 N -2.13 0.02 -0.45 0.00 -5.25 -1.13 -4.42 121.20 107.84 1brm s ILE 30 Ca 0.36 -1.65 -0.08 0.00 -0.99 0.00 0.00 60.65 58.29 1brm s ILE 30 Cb 0.27 -2.24 0.11 0.00 2.95 0.00 0.00 42.46 43.55 1brm s ILE 30 CO 0.11 -0.07 0.30 -0.13 -1.79 0.00 0.00 174.94 173.36 1brm s ARG 31 N -4.06 2.42 -0.07 0.37 0.52 0.46 -4.93 118.95 113.65 1brm s ARG 31 Ca 0.28 -1.71 -0.30 0.00 -0.52 0.00 0.00 55.73 53.48 1brm s ARG 31 Cb 0.03 -3.83 -0.03 0.00 0.52 0.00 0.00 34.95 31.64 1brm s ARG 31 CO 0.08 -1.12 1.30 -1.25 0.02 0.00 0.00 175.30 174.33 1brm s PRO 32 N 1.33 4.29 -0.17 3.54 0.04 -1.26 -0.78 135.00 142.00 1brm s PRO 32 Ca 0.05 1.78 0.01 0.00 0.04 0.00 0.00 61.00 62.88 1brm s PRO 32 Cb -0.25 -3.64 0.01 0.00 0.04 0.00 0.00 34.50 30.66 1brm s PRO 32 CO -0.01 -0.57 -0.19 0.08 0.04 0.00 0.00 177.00 176.35 1brm s VAL 33 N 2.71 2.20 -0.11 -0.36 1.01 0.10 -4.96 120.40 120.99 1brm s VAL 33 Ca 0.59 -0.91 -0.05 0.00 0.00 0.00 0.00 61.98 61.61 1brm s VAL 33 Cb -0.26 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 1brm s VAL 33 CO 0.22 0.53 0.09 -0.36 0.00 0.00 0.00 175.10 175.57 1brm s PHE 34 N 1.14 3.42 0.17 5.22 0.08 -1.26 -0.38 117.98 126.37 1brm s PHE 34 Ca 0.01 0.38 0.11 0.00 0.12 0.00 0.00 56.93 57.55 1brm s PHE 34 Cb -0.14 -1.90 -0.04 0.00 -0.57 0.00 0.00 43.02 40.37 1brm s PHE 34 CO -0.08 0.60 -0.24 -0.06 -0.10 0.00 0.00 175.22 175.34 1brm s PHE 35 N -0.88 2.34 -0.39 0.36 0.40 -1.07 0.11 117.98 118.86 1brm s PHE 35 Ca 0.14 -0.35 -0.01 0.00 -0.60 0.00 0.00 56.93 56.10 1brm s PHE 35 Cb -0.12 -1.20 0.19 0.00 0.51 0.00 0.00 43.02 42.40 1brm s PHE 35 CO 0.03 0.44 0.90 0.45 0.70 0.00 0.00 175.22 177.74 1brm s SER 36 N -2.45 -0.83 0.18 1.36 0.15 0.65 -4.66 113.70 108.10 1brm s SER 36 Ca 0.19 -0.65 0.04 0.00 0.70 0.00 0.00 55.95 56.23 1brm s SER 36 Cb -0.09 1.07 0.51 0.00 -1.71 0.00 0.00 66.02 65.80 1brm s SER 36 CO 0.09 -0.07 0.87 0.35 1.20 0.00 0.00 173.24 175.68 1brm n THR 37 N 3.48 -0.23 -0.18 6.45 -2.24 -1.26 -0.11 114.28 120.20 1brm n THR 37 Ca 0.11 1.19 -0.02 0.00 -2.27 0.00 0.00 64.05 63.06 1brm n THR 37 Cb 0.61 -1.79 0.08 0.00 -2.10 0.00 0.00 70.33 67.13 1brm n THR 37 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1brm h SER 38 N 0.00 0.17 -2.12 3.42 0.87 -1.95 -3.37 113.55 110.57 1brm h SER 38 Ca 0.37 0.07 -0.56 0.00 -1.23 0.00 0.00 61.79 60.45 1brm h SER 38 Cb 0.83 0.06 -0.37 0.00 -0.44 0.00 0.00 62.40 62.48 1brm h SER 38 CO -0.50 0.12 -1.01 0.00 -0.53 0.00 0.00 176.83 174.91 1brm n GLN 39 N -5.02 0.42 -2.09 2.24 6.02 0.85 -5.12 117.38 114.68 1brm n GLN 39 Ca 0.06 -3.12 -0.40 0.00 -0.01 0.00 0.00 57.00 53.54 1brm n GLN 39 Cb 0.23 -1.47 -0.01 0.00 1.02 0.00 0.00 30.24 30.01 1brm n GLN 39 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 1brm s LEU 40 N -0.43 4.27 0.00 1.08 2.34 -1.22 -3.34 118.68 121.39 1brm s LEU 40 Ca 0.34 2.64 0.00 0.00 0.06 0.00 0.00 54.13 57.16 1brm s LEU 40 Cb 0.10 -3.85 0.00 0.00 -0.56 0.00 0.00 46.19 41.88 1brm s LEU 40 CO -0.16 -0.75 0.00 0.61 -1.06 0.00 0.00 176.35 174.99 1brm n GLY 41 N 0.70 2.20 2.99 -3.48 0.00 0.20 -4.96 105.19 102.84 1brm n GLY 41 Ca 0.03 -0.42 -0.25 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.68 -2.19 1.61 6.02 -1.21 -4.04 117.38 116.89 1brm n GLN 42 Ca 0.00 -0.20 -0.42 0.00 -0.01 0.00 0.00 57.00 56.38 1brm n GLN 42 Cb 0.00 -1.20 -0.03 0.00 1.02 0.00 0.00 30.24 30.03 1brm n GLN 42 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1brm s ALA 43 N -2.05 3.56 0.53 -1.58 0.00 -1.26 -1.47 121.76 119.49 1brm s ALA 43 Ca 0.31 1.12 0.03 0.00 0.00 0.00 0.00 51.96 53.42 1brm s ALA 43 Cb 0.02 -3.51 0.03 0.00 0.00 0.00 0.00 23.12 19.66 1brm s ALA 43 CO 0.45 -0.58 0.74 0.00 0.00 0.00 0.00 175.76 176.37 1brm s ALA 44 N 0.65 4.03 0.82 0.00 0.00 -1.04 -4.69 121.76 121.53 1brm s ALA 44 Ca 0.61 -1.42 -0.11 0.00 0.00 0.00 0.00 51.96 51.04 1brm s ALA 44 Cb -0.37 -1.97 0.08 0.00 0.00 0.00 0.00 23.12 20.86 1brm s ALA 44 CO 0.34 -0.67 1.09 -1.25 0.00 0.00 0.00 175.76 175.27 1brm s PRO 45 N -4.69 1.87 -0.65 0.00 0.04 -1.26 -4.82 135.00 125.49 1brm s PRO 45 Ca 0.57 0.78 0.02 0.00 0.04 0.00 0.00 61.00 62.41 1brm s PRO 45 Cb -0.10 -1.88 0.37 0.00 0.04 0.00 0.00 34.50 32.93 1brm s PRO 45 CO 0.37 -1.81 1.42 -1.13 0.04 0.00 0.00 177.00 175.90 1brm n SER 46 N -3.58 5.77 0.24 6.66 3.41 -1.26 -4.76 113.62 120.10 1brm n SER 46 Ca 0.07 -3.74 -0.10 0.00 -0.26 0.00 0.00 58.87 54.84 1brm n SER 46 Cb 0.55 -0.73 -0.05 0.00 -0.26 0.00 0.00 64.21 63.72 1brm n SER 46 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 1brm h PHE 47 N 2.98 -0.58 0.00 7.33 0.04 -1.94 -2.79 116.94 121.97 1brm h PHE 47 Ca 0.37 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 61.13 1brm h PHE 47 Cb 0.52 0.19 0.00 0.00 2.20 0.00 0.00 35.95 38.86 1brm h PHE 47 CO 0.99 -0.36 0.00 0.41 -0.60 0.00 0.00 178.31 178.74 1brm n GLY 48 N -0.77 -0.63 2.34 -1.45 0.00 -1.26 -4.78 105.19 98.64 1brm n GLY 48 Ca -0.08 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.87 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 0.36 0.87 3.84 -0.02 0.00 -1.05 -4.88 105.19 104.31 1brm n GLY 49 Ca 0.00 -0.40 -0.37 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.10 5.03 -0.23 2.61 2.01 -1.26 -5.06 115.64 116.63 1brm s THR 50 Ca 0.00 0.76 -0.18 0.00 0.31 0.00 0.00 61.69 62.58 1brm s THR 50 Cb 0.00 -3.70 -0.03 0.00 0.01 0.00 0.00 72.50 68.78 1brm s THR 50 CO 0.00 0.50 0.52 0.42 -0.69 0.00 0.00 174.62 175.36 1brm s THR 51 N -1.17 5.08 0.37 -0.82 -4.23 -1.26 -4.59 115.64 109.02 1brm s THR 51 Ca 0.27 0.91 -0.11 0.00 -1.18 0.00 0.00 61.69 61.58 1brm s THR 51 Cb -0.16 -3.83 0.04 0.00 1.34 0.00 0.00 72.50 69.89 1brm s THR 51 CO 0.15 0.12 0.68 0.61 -0.54 0.00 0.00 174.62 175.64 1brm n GLY 52 N 4.17 1.32 3.29 3.99 0.00 -1.26 -5.12 105.19 111.58 1brm n GLY 52 Ca -0.04 -1.35 -0.20 0.00 0.00 0.00 0.00 46.02 44.43 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 -2.32 1.59 0.17 2.61 -4.23 -1.26 -2.50 115.64 109.70 1brm s THR 53 Ca 0.19 -1.78 -0.30 0.00 -1.18 0.00 0.00 61.69 58.61 1brm s THR 53 Cb -0.04 -1.67 -0.08 0.00 1.34 0.00 0.00 72.50 72.05 1brm s THR 53 CO 0.14 -0.33 1.26 -0.76 -0.54 0.00 0.00 174.62 174.39 1brm s LEU 54 N -2.48 4.42 0.45 4.79 1.43 -0.54 -4.53 118.68 122.22 1brm s LEU 54 Ca 0.12 2.28 0.08 0.00 -1.03 0.00 0.00 54.13 55.57 1brm s LEU 54 Cb -0.06 -3.60 0.02 0.00 0.03 0.00 0.00 46.19 42.58 1brm s LEU 54 CO 0.05 -0.47 0.61 -1.10 0.23 0.00 0.00 176.35 175.68 1brm s GLN 55 N 0.09 2.74 -0.29 1.70 -1.52 0.31 0.62 119.66 123.31 1brm s GLN 55 Ca 0.56 -1.27 -0.28 0.00 -1.95 0.00 0.00 55.36 52.41 1brm s GLN 55 Cb -0.34 -2.73 0.01 0.00 -0.22 0.00 0.00 33.01 29.73 1brm s GLN 55 CO 0.36 -0.38 1.02 0.34 -0.25 0.00 0.00 175.29 176.38 1brm s ASP 56 N -4.40 6.95 0.55 5.90 -1.08 -1.26 -0.26 116.67 123.07 1brm s ASP 56 Ca 0.56 1.10 0.25 0.00 -0.52 0.00 0.00 52.55 53.94 1brm s ASP 56 Cb -0.09 -2.52 1.46 0.00 -1.46 0.00 0.00 42.92 40.30 1brm s ASP 56 CO 0.34 -0.78 2.03 0.00 0.52 0.00 0.00 175.17 177.29 1brm h ALA 57 N 7.90 2.22 -0.38 3.66 0.00 -1.89 -1.81 119.26 128.97 1brm h ALA 57 Ca -0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1brm h ALA 57 Cb 1.07 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1brm h ALA 57 CO 1.00 -0.48 0.00 1.19 0.00 0.00 0.00 179.25 180.95 1brm n PHE 58 N -4.19 1.12 -2.78 0.00 3.72 -1.26 -4.88 117.46 109.20 1brm n PHE 58 Ca 0.06 -0.76 -0.43 0.00 -0.05 0.00 0.00 57.45 56.27 1brm n PHE 58 Cb 0.47 -0.29 -0.02 0.00 -0.94 0.00 0.00 39.48 38.70 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 -1.46 6.64 0.55 4.37 -1.08 -0.68 -4.87 116.67 120.14 1brm s ASP 59 Ca 0.42 -1.96 0.30 0.00 -0.52 0.00 0.00 52.55 50.79 1brm s ASP 59 Cb 0.32 -2.47 1.46 0.00 -1.46 0.00 0.00 42.92 40.77 1brm s ASP 59 CO 0.13 -1.20 1.89 -0.07 0.52 0.00 0.00 175.17 176.45 1brm h LEU 60 N 11.33 0.00 -0.24 -1.34 3.38 -1.89 0.79 115.31 127.34 1brm h LEU 60 Ca 0.21 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.06 1brm h LEU 60 Cb 0.99 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.74 1brm h LEU 60 CO 1.26 0.00 -0.30 -0.33 0.09 0.00 0.00 178.44 179.16 1brm h GLU 61 N 0.00 0.62 -0.18 1.13 5.08 -1.98 -0.42 114.58 118.84 1brm h GLU 61 Ca 0.34 -0.35 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 1brm h GLU 61 Cb 1.49 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.75 1brm h GLU 61 CO -0.00 0.96 -0.25 0.00 -1.00 0.00 0.00 179.01 178.72 1brm h ALA 62 N 0.65 1.25 -0.05 3.43 0.00 -1.28 -2.80 119.26 120.46 1brm h ALA 62 Ca 0.03 -0.31 -0.25 0.00 0.00 0.00 0.00 54.91 54.38 1brm h ALA 62 Cb 0.88 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 18.58 1brm h ALA 62 CO 0.07 0.50 -0.93 -0.07 0.00 0.00 0.00 179.25 178.82 1brm h LEU 63 N 0.30 0.91 -2.12 0.00 3.38 -1.05 -3.12 115.31 113.60 1brm h LEU 63 Ca 0.05 -0.70 -0.01 0.00 0.09 0.00 0.00 57.88 57.31 1brm h LEU 63 Cb 0.60 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 1brm h LEU 63 CO 0.04 1.48 -0.04 0.11 0.09 0.00 0.00 178.44 180.12 1brm h LYS 64 N 0.42 0.00 0.00 1.13 1.57 -0.94 -1.36 116.57 117.40 1brm h LYS 64 Ca -0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1brm h LYS 64 Cb 1.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.89 1brm h LYS 64 CO 0.19 0.04 0.00 0.00 -0.57 0.00 0.00 179.45 179.11 1brm h ALA 65 N 1.96 1.00 -2.31 3.86 0.00 -1.43 -3.45 119.26 118.88 1brm h ALA 65 Ca -0.00 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.41 1brm h ALA 65 Cb 0.09 0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.90 1brm h ALA 65 CO 0.01 0.00 0.11 -0.51 0.00 0.00 0.00 179.25 178.86 1brm s LEU 66 N -4.61 3.72 -0.17 0.00 1.43 -0.51 -4.95 118.68 113.58 1brm s LEU 66 Ca 0.04 1.02 0.02 0.00 -1.03 0.00 0.00 54.13 54.18 1brm s LEU 66 Cb 0.09 -3.94 -0.22 0.00 0.03 0.00 0.00 46.19 42.15 1brm s LEU 66 CO 0.41 -0.49 0.17 0.47 0.23 0.00 0.00 176.35 177.14 1brm n ASP 67 N -1.81 1.63 -4.00 2.29 8.00 -0.24 -4.78 116.55 117.64 1brm n ASP 67 Ca 0.01 0.09 -0.14 0.00 0.71 0.00 0.00 54.79 55.47 1brm n ASP 67 Cb 0.55 -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 -2.54 0.41 -0.08 0.53 1.01 -1.00 -0.95 121.20 118.58 1brm s ILE 68 Ca -0.23 -0.66 0.02 0.00 0.00 0.00 0.00 60.65 59.78 1brm s ILE 68 Cb 0.08 -0.43 0.02 0.00 0.01 0.00 0.00 42.46 42.13 1brm s ILE 68 CO 0.73 -0.18 -0.11 -0.63 0.00 0.00 0.00 174.94 174.74 1brm s ILE 69 N -0.82 1.14 -0.34 2.92 1.01 -0.13 -0.32 121.20 124.66 1brm s ILE 69 Ca -0.05 -0.45 0.00 0.00 0.00 0.00 0.00 60.65 60.15 1brm s ILE 69 Cb -0.06 -1.06 0.08 0.00 0.01 0.00 0.00 42.46 41.43 1brm s ILE 69 CO 0.00 0.36 0.06 -0.69 0.00 0.00 0.00 174.94 174.67 1brm s VAL 70 N 0.91 2.72 -0.06 2.92 1.01 0.55 -0.22 120.40 128.22 1brm s VAL 70 Ca -0.10 -1.92 -0.02 0.00 0.00 0.00 0.00 61.98 59.94 1brm s VAL 70 Cb -0.15 -2.80 -0.04 0.00 0.00 0.00 0.00 36.38 33.40 1brm s VAL 70 CO 0.01 -0.42 0.06 0.42 0.00 0.00 0.00 175.10 175.17 1brm s THR 71 N 1.09 4.75 -0.02 3.92 -4.23 -0.38 -1.66 115.64 119.09 1brm s THR 71 Ca 0.03 -0.20 0.10 0.00 -1.18 0.00 0.00 61.69 60.44 1brm s THR 71 Cb -0.20 -3.08 0.17 0.00 1.34 0.00 0.00 72.50 70.73 1brm s THR 71 CO -0.05 0.51 1.08 0.00 -0.54 0.00 0.00 174.62 175.62 1brm h GLN 73 N 0.34 0.05 0.00 0.00 5.75 -1.78 -3.44 115.11 116.02 1brm h GLN 73 Ca -0.07 -0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.35 1brm h GLN 73 Cb 1.48 0.03 0.00 0.00 1.07 0.00 0.00 27.48 30.06 1brm h GLN 73 CO 0.03 0.94 0.00 0.41 -2.65 0.00 0.00 178.83 177.56 1brm n GLY 74 N 1.43 2.44 0.24 2.39 0.00 -1.26 -4.75 105.19 105.67 1brm n GLY 74 Ca -0.05 -2.11 0.09 0.00 0.00 0.00 0.00 46.02 43.95 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 0.97 -0.02 0.00 -1.97 -2.05 103.07 100.00 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 0.23 -0.55 0.00 0.00 0.00 176.54 176.22 1brm h ASP 76 N 0.00 0.67 0.57 0.19 5.19 -1.98 0.33 116.42 121.39 1brm h ASP 76 Ca -0.00 -0.14 -0.03 0.00 -0.62 0.00 0.00 57.03 56.24 1brm h ASP 76 Cb 0.44 -0.17 0.01 0.00 0.18 0.00 0.00 39.33 39.78 1brm h ASP 76 CO 0.02 0.62 -0.28 0.22 -3.12 0.00 0.00 179.24 176.71 1brm h TYR 77 N 0.66 -0.71 -0.70 4.55 3.20 -1.80 -3.09 116.97 119.08 1brm h TYR 77 Ca 0.17 -0.02 0.15 0.00 3.14 0.00 0.00 58.73 62.17 1brm h TYR 77 Cb 0.15 0.24 -0.13 0.00 1.54 0.00 0.00 36.73 38.52 1brm h TYR 77 CO -0.00 -0.44 -0.11 1.15 -1.64 0.00 0.00 178.16 177.11 1brm h THR 78 N -1.21 0.33 0.00 1.81 2.02 -1.34 0.23 112.91 114.75 1brm h THR 78 Ca -0.08 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.09 1brm h THR 78 Cb 0.59 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 67.29 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 0.04 0.00 0.00 4.18 2.35 -0.40 -2.00 115.58 119.75 1brm h ASN 79 Ca 0.36 0.00 -0.35 0.00 -0.55 0.00 0.00 56.30 55.76 1brm h ASN 79 Cb 0.57 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.89 1brm h ASN 79 CO -0.69 0.00 -2.11 1.21 -1.65 0.00 0.00 177.43 174.19 1brm n GLU 80 N -2.37 0.57 0.04 0.81 2.13 0.62 -4.71 120.64 117.73 1brm n GLU 80 Ca -0.00 0.27 -0.10 0.00 0.66 0.00 0.00 57.16 57.99 1brm n GLU 80 Cb 0.13 -1.50 -0.08 0.00 0.27 0.00 0.00 31.44 30.26 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 0.86 -0.92 6.31 1.08 -1.08 -3.33 117.51 119.43 1brm h ILE 81 Ca -0.52 -1.19 0.08 0.00 -0.39 0.00 0.00 64.86 62.84 1brm h ILE 81 Cb 1.45 1.47 -0.11 0.00 -3.07 0.00 0.00 36.82 36.56 1brm h ILE 81 CO -0.32 0.23 -0.54 0.00 -0.69 0.00 0.00 178.15 176.83 1brm n TYR 82 N -4.90 -0.40 -0.02 1.37 9.36 -0.75 -0.84 117.16 120.98 1brm n TYR 82 Ca -0.07 1.15 0.00 0.00 3.32 0.00 0.00 57.90 62.30 1brm n TYR 82 Cb 0.26 -0.57 0.30 0.00 -0.63 0.00 0.00 39.34 38.70 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 0.56 -0.58 2.98 0.13 -1.76 -0.86 132.00 132.46 1brm h PRO 83 Ca 0.15 -0.11 -0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1brm h PRO 83 Cb 0.38 -0.09 -0.03 0.00 0.13 0.00 0.00 31.00 31.39 1brm h PRO 83 CO -0.87 0.55 0.35 0.87 -0.23 0.00 0.00 178.00 178.67 1brm h LYS 84 N 0.55 0.78 0.03 0.86 1.57 -1.10 0.18 116.57 119.44 1brm h LYS 84 Ca 0.12 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1brm h LYS 84 Cb 0.27 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.41 1brm h LYS 84 CO 0.00 0.55 -0.01 -0.07 -0.57 0.00 0.00 179.45 179.35 1brm h LEU 85 N 0.80 -0.03 -0.55 2.94 3.38 -0.64 -2.88 115.31 118.33 1brm h LEU 85 Ca 0.21 -0.68 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1brm h LEU 85 Cb -0.03 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1brm h LEU 85 CO -0.04 0.74 0.36 0.03 0.09 0.00 0.00 178.44 179.61 1brm h ARG 86 N -0.88 0.74 0.00 1.13 2.47 -1.07 -1.03 114.38 115.73 1brm h ARG 86 Ca -0.00 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 1brm h ARG 86 Cb 0.71 -0.16 0.00 0.00 -1.65 0.00 0.00 29.97 28.87 1brm h ARG 86 CO 0.01 0.50 0.00 0.93 0.56 0.00 0.00 179.97 181.97 1brm h GLU 87 N 0.75 0.00 -0.07 0.04 4.39 -0.77 -0.34 114.58 118.58 1brm h GLU 87 Ca 0.20 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.90 1brm h GLU 87 Cb -0.07 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 1brm h GLU 87 CO -0.04 0.00 0.00 -1.13 -1.16 0.00 0.00 179.01 176.68 1brm n SER 88 N -2.84 1.72 0.00 1.42 3.41 -0.49 -4.93 113.62 111.90 1brm n SER 88 Ca 0.00 -1.61 0.00 0.00 -0.26 0.00 0.00 58.87 57.00 1brm n SER 88 Cb 0.22 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 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 1.19 0.65 3.68 5.00 0.00 -0.14 -5.03 105.19 110.53 1brm n GLY 89 Ca 0.18 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.72 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 2.30 -1.33 1.61 -0.00 -0.64 -4.88 117.44 112.50 1brm n TRP 90 Ca 0.00 0.11 0.01 0.00 -0.00 0.00 0.00 57.50 57.61 1brm n TRP 90 Cb 0.00 -2.61 0.21 0.00 -0.00 0.00 0.00 31.31 28.90 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 5.41 2.01 -1.79 5.87 6.02 -1.26 -4.46 117.38 129.18 1brm n GLN 91 Ca 0.21 -3.07 -0.30 0.00 -0.01 0.00 0.00 57.00 53.83 1brm n GLN 91 Cb 0.29 -1.78 0.16 0.00 1.02 0.00 0.00 30.24 29.93 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 -2.49 1.69 0.09 1.08 0.00 -1.26 -4.98 107.32 101.44 1brm s GLY 92 Ca 0.42 -0.96 -0.25 0.00 0.00 0.00 0.00 44.72 43.94 1brm s GLY 92 CO 0.01 -0.27 0.75 -0.19 0.00 0.00 0.00 173.10 173.41 1brm s TYR 93 N -3.65 3.80 -0.26 1.90 2.02 -0.13 -4.81 117.35 116.23 1brm s TYR 93 Ca 0.70 1.52 0.03 0.00 -0.37 0.00 0.00 57.07 58.94 1brm s TYR 93 Cb -0.07 -2.78 0.06 0.00 -0.40 0.00 0.00 41.96 38.77 1brm s TYR 93 CO 0.52 0.38 -0.10 -0.46 -1.57 0.00 0.00 175.55 174.32 1brm s TRP 94 N -0.52 3.15 -0.36 2.71 -0.11 0.13 -0.96 118.94 122.98 1brm s TRP 94 Ca 0.37 -2.26 -0.10 0.00 1.22 0.00 0.00 56.10 55.34 1brm s TRP 94 Cb -0.21 -1.89 0.03 0.00 -1.50 0.00 0.00 33.47 29.90 1brm s TRP 94 CO 0.24 -0.87 0.17 0.42 -4.62 0.00 0.00 176.95 172.30 1brm s ILE 95 N 1.14 4.35 0.12 5.86 1.01 0.69 -0.67 121.20 133.69 1brm s ILE 95 Ca -0.08 -0.91 0.09 0.00 0.00 0.00 0.00 60.65 59.75 1brm s ILE 95 Cb -0.20 -3.43 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 1brm s ILE 95 CO -0.05 -0.20 -0.20 -0.62 0.00 0.00 0.00 174.94 173.87 1brm s ASP 96 N 1.52 3.77 -0.12 3.58 -1.08 -0.46 -1.25 116.67 122.62 1brm s ASP 96 Ca 0.01 -0.59 0.20 0.00 -0.52 0.00 0.00 52.55 51.65 1brm s ASP 96 Cb -0.19 -0.48 -0.29 0.00 -1.46 0.00 0.00 42.92 40.50 1brm s ASP 96 CO 0.06 0.18 0.25 0.00 0.52 0.00 0.00 175.17 176.18 1brm n ALA 97 N 0.85 2.07 -1.77 3.66 0.00 -1.11 -0.70 120.51 123.51 1brm n ALA 97 Ca -0.16 -0.98 -0.37 0.00 0.00 0.00 0.00 53.44 51.93 1brm n ALA 97 Cb 0.53 -0.43 0.00 0.00 0.00 0.00 0.00 19.45 19.54 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 -2.94 2.88 -0.02 0.00 0.00 -1.26 -4.57 121.76 115.85 1brm s ALA 98 Ca -0.09 0.96 0.22 0.00 0.00 0.00 0.00 51.96 53.05 1brm s ALA 98 Cb 0.09 -3.40 0.65 0.00 0.00 0.00 0.00 23.12 20.46 1brm s ALA 98 CO 0.86 -0.79 1.71 0.66 0.00 0.00 0.00 175.76 178.21 1brm h SER 99 N 1.76 0.00 -0.53 0.00 4.64 -1.93 -3.39 113.55 114.10 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 1.26 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.26 1brm h SER 99 CO 0.59 0.25 -0.20 -1.20 -0.87 0.00 0.00 176.83 175.40 1brm n SER 100 N -3.29 -0.32 -0.15 4.97 7.64 -1.26 -0.67 113.62 120.53 1brm n SER 100 Ca 0.01 0.93 0.12 0.00 1.01 0.00 0.00 58.87 60.94 1brm n SER 100 Cb 0.51 -0.22 0.23 0.00 -1.01 0.00 0.00 64.21 63.72 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 0.93 -0.32 -3.43 4.77 -1.26 -4.49 117.00 108.40 1brm n LEU 101 Ca 0.06 -0.25 0.20 0.00 -0.03 0.00 0.00 56.01 55.99 1brm n LEU 101 Cb 0.22 -0.14 0.39 0.00 -2.33 0.00 0.00 43.42 41.56 1brm n LEU 101 CO -0.07 0.19 0.95 0.03 -1.33 0.00 0.00 177.39 177.16 1brm h ARG 102 N 0.75 0.11 -0.24 3.23 3.08 -1.15 0.71 114.38 120.86 1brm h ARG 102 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1brm h ARG 102 Cb 0.53 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1brm h ARG 102 CO 0.00 0.07 0.00 -1.33 -1.07 0.00 0.00 179.97 177.64 1brm n MET 103 N -5.29 1.89 -2.18 0.04 2.81 -1.26 -4.62 117.12 108.51 1brm n MET 103 Ca 0.27 -1.35 -0.40 0.00 -1.81 0.00 0.00 57.70 54.41 1brm n MET 103 Cb 0.90 -1.40 -0.02 0.00 -0.71 0.00 0.00 33.22 31.99 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 -1.68 4.26 0.51 0.03 -0.14 0.24 -4.91 119.74 118.05 1brm s LYS 104 Ca 0.32 2.09 0.28 0.00 -1.36 0.00 0.00 55.97 57.30 1brm s LYS 104 Cb 0.18 -2.96 1.32 0.00 -1.68 0.00 0.00 37.83 34.69 1brm s LYS 104 CO 0.26 -0.22 2.00 -0.44 -0.76 0.00 0.00 175.35 176.18 1brm h ASP 105 N 3.17 0.00 -0.61 2.83 3.32 -1.91 -2.37 116.42 120.86 1brm h ASP 105 Ca -0.49 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.50 1brm h ASP 105 Cb 1.23 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.74 1brm h ASP 105 CO 0.65 0.14 0.08 -0.90 -1.72 0.00 0.00 179.24 177.48 1brm n ASP 106 N -3.46 5.39 -4.25 6.45 5.75 -1.26 -4.92 116.55 120.24 1brm n ASP 106 Ca -0.01 -3.03 -0.21 0.00 -0.01 0.00 0.00 54.79 51.52 1brm n ASP 106 Cb 0.30 -0.70 -0.12 0.00 -1.03 0.00 0.00 41.12 39.57 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 -2.85 1.59 -0.06 2.12 0.00 -0.89 -4.21 121.76 117.46 1brm s ALA 107 Ca 0.54 -1.19 0.05 0.00 0.00 0.00 0.00 51.96 51.36 1brm s ALA 107 Cb 0.42 -0.18 -0.01 0.00 0.00 0.00 0.00 23.12 23.36 1brm s ALA 107 CO 0.15 0.26 -0.23 0.42 0.00 0.00 0.00 175.76 176.36 1brm s ILE 108 N -1.37 1.86 -0.30 0.00 1.01 -0.38 -4.75 121.20 117.27 1brm s ILE 108 Ca 0.05 -0.95 -0.25 0.00 0.00 0.00 0.00 60.65 59.49 1brm s ILE 108 Cb -0.09 -1.59 0.01 0.00 0.01 0.00 0.00 42.46 40.80 1brm s ILE 108 CO 0.04 0.52 0.88 -0.63 0.00 0.00 0.00 174.94 175.75 1brm s ILE 109 N -0.04 4.71 -0.01 2.92 1.01 -1.26 -0.64 121.20 127.89 1brm s ILE 109 Ca -0.05 1.38 -0.21 0.00 0.00 0.00 0.00 60.65 61.77 1brm s ILE 109 Cb -0.14 -4.23 -0.05 0.00 0.01 0.00 0.00 42.46 38.06 1brm s ILE 109 CO 0.04 -0.30 0.62 0.27 0.00 0.00 0.00 174.94 175.56 1brm s ILE 110 N 3.15 4.93 -0.41 2.92 -4.36 0.95 -4.77 121.20 123.60 1brm s ILE 110 Ca 0.36 1.29 0.02 0.00 -0.26 0.00 0.00 60.65 62.06 1brm s ILE 110 Cb -0.14 -3.95 0.26 0.00 1.25 0.00 0.00 42.46 39.88 1brm s ILE 110 CO 0.13 0.39 1.09 -0.11 0.24 0.00 0.00 174.94 176.67 1brm n LEU 111 N 2.91 -2.05 -0.32 0.37 7.94 -1.26 -4.40 117.00 120.20 1brm n LEU 111 Ca -0.06 -2.55 0.17 0.00 -1.11 0.00 0.00 56.01 52.46 1brm n LEU 111 Cb 0.51 0.72 0.36 0.00 0.53 0.00 0.00 43.42 45.54 1brm n LEU 111 CO 0.44 1.79 1.04 -2.24 -1.11 0.00 0.00 177.39 177.31 1brm h ASP 112 N 3.47 0.30 0.10 1.96 2.03 -1.91 0.45 116.42 122.82 1brm h ASP 112 Ca -0.20 0.18 0.00 0.00 -0.73 0.00 0.00 57.03 56.28 1brm h ASP 112 Cb 1.13 0.18 0.00 0.00 -0.83 0.00 0.00 39.33 39.80 1brm h ASP 112 CO 0.06 -0.09 0.00 -0.65 -1.03 0.00 0.00 179.24 177.53 1brm h PRO 113 N 0.32 0.00 0.00 4.15 0.11 -2.00 -1.54 132.00 133.05 1brm h PRO 113 Ca 0.62 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 66.50 1brm h PRO 113 Cb 1.28 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.36 1brm h PRO 113 CO -0.60 0.00 -1.77 0.28 -0.21 0.00 0.00 178.00 175.71 1brm n VAL 114 N -2.35 0.75 -2.17 3.15 0.31 0.85 -4.84 118.33 114.04 1brm n VAL 114 Ca -0.01 -0.21 -0.22 0.00 -0.01 0.00 0.00 64.34 63.89 1brm n VAL 114 Cb 0.06 -1.59 0.02 0.00 -0.91 0.00 0.00 33.84 31.43 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 -3.52 4.56 -0.30 4.52 0.23 0.12 -4.84 115.26 116.03 1brm n ASN 115 Ca -0.27 -3.59 0.02 0.00 -0.53 0.00 0.00 54.58 50.22 1brm n ASN 115 Cb 0.70 -0.37 0.16 0.00 -2.08 0.00 0.00 39.78 38.19 1brm n ASN 115 CO 0.00 0.00 0.00 -0.61 -0.93 0.00 0.00 177.26 175.72 1brm h GLN 116 N 2.29 0.85 -0.47 -3.83 5.75 -1.46 -1.23 115.11 117.02 1brm h GLN 116 Ca 0.31 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.75 1brm h GLN 116 Cb 1.41 -0.19 -0.02 0.00 1.07 0.00 0.00 27.48 29.74 1brm h GLN 116 CO 0.72 0.56 0.25 0.38 -2.65 0.00 0.00 178.83 178.10 1brm h ASP 117 N 0.88 0.57 0.56 -0.69 2.03 -1.88 0.21 116.42 118.09 1brm h ASP 117 Ca 0.40 -0.04 -0.12 0.00 -0.73 0.00 0.00 57.03 56.53 1brm h ASP 117 Cb 0.30 -0.14 -0.02 0.00 -0.83 0.00 0.00 39.33 38.64 1brm h ASP 117 CO -0.22 0.46 -0.58 0.58 -1.03 0.00 0.00 179.24 178.45 1brm h VAL 118 N 0.65 1.41 0.06 4.15 2.07 -1.63 -0.88 116.25 122.08 1brm h VAL 118 Ca 0.17 -1.99 -0.00 0.00 0.82 0.00 0.00 66.70 65.70 1brm h VAL 118 Cb 0.03 2.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.86 1brm h VAL 118 CO -0.03 0.57 -0.03 0.40 0.02 0.00 0.00 177.57 178.50 1brm h ILE 119 N 0.02 1.23 -0.45 4.57 2.04 -0.46 -2.36 117.51 122.10 1brm h ILE 119 Ca -0.01 -1.52 0.07 0.00 1.00 0.00 0.00 64.86 64.40 1brm h ILE 119 Cb 1.03 2.15 -0.06 0.00 -0.74 0.00 0.00 36.82 39.20 1brm h ILE 119 CO 0.08 0.35 0.12 0.74 0.00 0.00 0.00 178.15 179.44 1brm h THR 120 N -0.83 0.80 0.44 -0.27 2.02 -0.62 0.31 112.91 114.77 1brm h THR 120 Ca -0.01 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 67.06 1brm h THR 120 Cb 0.64 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 1brm h THR 120 CO 0.01 0.05 -0.41 0.44 0.37 0.00 0.00 175.52 175.99 1brm h ASP 121 N 0.28 -1.10 -0.65 4.18 5.19 -1.23 -1.07 116.42 122.00 1brm h ASP 121 Ca 0.22 0.08 0.15 0.00 -0.62 0.00 0.00 57.03 56.86 1brm h ASP 121 Cb 0.25 0.36 -0.04 0.00 0.18 0.00 0.00 39.33 40.08 1brm h ASP 121 CO -0.26 -0.55 0.45 1.23 -3.12 0.00 0.00 179.24 176.99 1brm h GLY 122 N -0.84 0.41 1.00 2.75 0.00 -1.13 0.22 103.07 105.48 1brm h GLY 122 Ca -0.06 -0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 1brm h GLY 122 CO -0.03 0.04 0.35 -2.00 0.00 0.00 0.00 176.54 174.90 1brm h LEU 123 N 0.25 0.74 -0.78 3.11 5.85 0.24 0.11 115.31 124.83 1brm h LEU 123 Ca 0.32 -0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.87 1brm h LEU 123 Cb 0.90 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 1brm h LEU 123 CO -0.07 0.59 -0.44 0.78 -0.34 0.00 0.00 178.44 178.96 1brm h ASN 124 N 0.82 0.00 -0.30 1.25 2.35 0.58 -3.08 115.58 117.21 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 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1brm h ASN 124 CO -0.04 0.44 0.00 0.59 -1.65 0.00 0.00 177.43 176.77 1brm n ASN 125 N -3.52 2.51 -0.70 5.81 3.02 0.24 -4.91 115.26 117.71 1brm n ASN 125 Ca -0.00 -2.22 -0.04 0.00 -0.03 0.00 0.00 54.58 52.29 1brm n ASN 125 Cb 0.56 -0.41 0.01 0.00 -0.61 0.00 0.00 39.78 39.32 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 0.64 0.49 3.63 7.41 0.00 -1.01 -5.01 105.19 111.34 1brm n GLY 126 Ca 0.12 -0.64 -0.39 0.00 0.00 0.00 0.00 46.02 45.11 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 -2.63 5.15 -0.61 -0.61 -1.09 0.32 -4.93 121.20 116.80 1brm s ILE 127 Ca 0.05 0.72 0.08 0.00 -2.23 0.00 0.00 60.65 59.28 1brm s ILE 127 Cb -0.02 -3.75 0.24 0.00 -1.58 0.00 0.00 42.46 37.34 1brm s ILE 127 CO 0.06 0.17 1.20 0.54 -1.23 0.00 0.00 174.94 175.67 1brm n ARG 128 N 5.09 2.87 -4.01 2.79 5.12 -1.26 -4.59 116.66 122.67 1brm n ARG 128 Ca -0.07 -1.97 -0.31 0.00 -1.93 0.00 0.00 57.85 53.57 1brm n ARG 128 Cb 0.51 -1.24 -0.16 0.00 -1.16 0.00 0.00 32.46 30.40 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 -1.18 1.70 -0.12 0.55 2.01 -1.26 0.17 115.64 117.51 1brm s THR 129 Ca 0.19 -1.00 0.00 0.00 0.31 0.00 0.00 61.69 61.19 1brm s THR 129 Cb 0.11 -1.73 0.02 0.00 0.01 0.00 0.00 72.50 70.91 1brm s THR 129 CO 0.11 0.22 -0.11 -0.36 -0.69 0.00 0.00 174.62 173.79 1brm s PHE 130 N 1.38 1.74 0.05 4.92 0.08 0.15 -1.24 117.98 125.07 1brm s PHE 130 Ca -0.00 -0.90 0.09 0.00 0.12 0.00 0.00 56.93 56.23 1brm s PHE 130 Cb -0.16 -1.36 -0.03 0.00 -0.57 0.00 0.00 43.02 40.90 1brm s PHE 130 CO -0.09 -0.55 -0.24 0.08 -0.10 0.00 0.00 175.22 174.32 1brm s VAL 131 N 1.52 2.35 0.52 -0.44 1.01 0.19 -1.35 120.40 124.19 1brm s VAL 131 Ca 0.03 -1.37 -0.18 0.00 0.00 0.00 0.00 61.98 60.45 1brm s VAL 131 Cb -0.13 -1.95 -0.07 0.00 0.00 0.00 0.00 36.38 34.23 1brm s VAL 131 CO -0.08 0.33 1.02 -0.83 0.00 0.00 0.00 175.10 175.54 1brm s GLY 132 N -1.40 2.28 0.00 4.51 0.00 0.12 -0.04 107.32 112.80 1brm s GLY 132 Ca 0.13 0.42 0.00 0.00 0.00 0.00 0.00 44.72 45.27 1brm s GLY 132 CO 0.03 0.73 0.00 0.61 0.00 0.00 0.00 173.10 174.47 1brm n GLY 133 N -0.81 1.57 3.62 0.20 0.00 -1.26 -4.75 105.19 103.76 1brm n GLY 133 Ca 0.08 -2.06 -0.44 0.00 0.00 0.00 0.00 46.02 43.60 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 -2.44 1.71 0.14 1.61 2.85 -1.26 -4.85 115.26 113.01 1brm n ASN 134 Ca 0.00 1.18 0.04 0.00 -0.11 0.00 0.00 54.58 55.69 1brm n ASN 134 Cb 0.00 -1.33 0.46 0.00 1.24 0.00 0.00 39.78 40.15 1brm n ASN 134 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1brm h THR 136 N 0.21 1.64 -0.72 0.00 1.35 -1.90 -3.07 112.91 110.44 1brm h THR 136 Ca 0.05 -2.25 0.11 0.00 -0.55 0.00 0.00 66.41 63.77 1brm h THR 136 Cb 0.21 3.12 -0.08 0.00 -1.73 0.00 0.00 68.15 69.67 1brm h THR 136 CO 0.01 0.56 0.33 0.58 -0.25 0.00 0.00 175.52 176.74 1brm h VAL 137 N -1.00 0.79 0.30 6.82 2.07 -1.80 0.62 116.25 124.04 1brm h VAL 137 Ca -0.01 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.32 1brm h VAL 137 Cb 0.94 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 1brm h VAL 137 CO -0.01 0.10 -0.41 0.28 0.02 0.00 0.00 177.57 177.55 1brm h SER 138 N 0.54 -1.16 -0.98 0.57 0.02 -1.46 -0.03 113.55 111.06 1brm h SER 138 Ca 0.37 0.10 0.08 0.00 -0.84 0.00 0.00 61.79 61.50 1brm h SER 138 Cb 0.45 0.40 -0.07 0.00 0.14 0.00 0.00 62.40 63.31 1brm h SER 138 CO -0.31 -0.50 0.62 -0.07 -1.14 0.00 0.00 176.83 175.43 1brm h LEU 139 N -0.73 0.96 -0.42 5.07 3.38 -1.34 -0.10 115.31 122.13 1brm h LEU 139 Ca -0.04 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1brm h LEU 139 Cb 0.66 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1brm h LEU 139 CO -0.11 0.58 0.23 -0.03 0.09 0.00 0.00 178.44 179.20 1brm h MET 140 N 1.07 0.57 -0.51 1.13 4.05 -0.55 -2.15 114.93 118.56 1brm h MET 140 Ca 0.45 -0.06 -0.13 0.00 -0.28 0.00 0.00 59.70 59.68 1brm h MET 140 Cb 0.28 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 30.95 1brm h MET 140 CO -0.21 0.45 -0.18 -0.07 0.23 0.00 0.00 176.91 177.14 1brm h LEU 141 N 0.54 1.03 -1.55 3.39 3.38 -0.33 0.31 115.31 122.09 1brm h LEU 141 Ca 0.15 -0.37 0.03 0.00 0.09 0.00 0.00 57.88 57.77 1brm h LEU 141 Cb 0.04 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 1brm h LEU 141 CO -0.02 1.18 0.34 0.24 0.09 0.00 0.00 178.44 180.26 1brm h MET 142 N 0.88 0.58 0.00 1.13 2.86 -0.83 0.30 114.93 119.86 1brm h MET 142 Ca 0.12 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.66 1brm h MET 142 Cb 0.75 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.27 1brm h MET 142 CO 0.06 0.38 -0.46 0.77 1.06 0.00 0.00 176.91 178.72 1brm h SER 143 N 0.60 0.00 -0.32 1.22 0.02 -1.05 -3.38 113.55 110.63 1brm h SER 143 Ca 0.20 -0.47 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 1brm h SER 143 Cb 0.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.60 1brm h SER 143 CO -0.05 1.00 0.00 0.18 -1.14 0.00 0.00 176.83 176.82 1brm n LEU 144 N -4.59 2.90 -0.15 5.07 4.77 0.11 -4.56 117.00 120.54 1brm n LEU 144 Ca -0.14 -1.46 -0.07 0.00 -0.03 0.00 0.00 56.01 54.31 1brm n LEU 144 Cb 0.40 -0.47 -0.01 0.00 -2.33 0.00 0.00 43.42 41.01 1brm n LEU 144 CO 0.18 0.46 0.63 1.23 -1.33 0.00 0.00 177.39 178.57 1brm h GLY 145 N 4.76 -0.20 -0.19 -0.72 0.00 -0.58 -1.37 103.07 104.76 1brm h GLY 145 Ca 0.00 0.42 0.30 0.00 0.00 0.00 0.00 47.33 48.05 1brm h GLY 145 CO 0.16 -0.21 0.74 -1.33 0.00 0.00 0.00 176.54 175.90 1brm h GLY 146 N -0.22 0.64 1.00 4.60 0.00 -1.79 0.36 103.07 107.66 1brm h GLY 146 Ca 0.19 -0.11 -0.18 0.00 0.00 0.00 0.00 47.33 47.23 1brm h GLY 146 CO -0.59 -0.08 -0.66 1.41 0.00 0.00 0.00 176.54 176.63 1brm h LEU 147 N 0.20 0.75 -0.16 3.11 3.38 -1.52 -3.01 115.31 118.06 1brm h LEU 147 Ca 0.57 -0.66 -0.19 0.00 0.09 0.00 0.00 57.88 57.69 1brm h LEU 147 Cb 1.82 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 42.35 1brm h LEU 147 CO -0.16 1.29 -0.63 -0.26 0.09 0.00 0.00 178.44 178.78 1brm h PHE 148 N 0.26 0.93 0.00 1.13 0.04 -1.05 -1.82 116.94 116.43 1brm h PHE 148 Ca -0.05 -0.40 0.00 0.00 2.80 0.00 0.00 57.97 60.32 1brm h PHE 148 Cb 1.30 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 39.30 1brm h PHE 148 CO 0.11 1.20 0.00 0.00 -0.60 0.00 0.00 178.31 179.02 1brm n ALA 149 N -2.58 1.32 -0.72 2.45 0.00 0.12 -1.17 120.51 119.93 1brm n ALA 149 Ca -0.07 -0.02 0.07 0.00 0.00 0.00 0.00 53.44 53.42 1brm n ALA 149 Cb 0.67 -1.08 0.10 0.00 0.00 0.00 0.00 19.45 19.14 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 -1.39 2.31 -3.89 0.00 5.03 -1.14 -4.99 115.26 111.20 1brm n ASN 150 Ca 0.02 -2.73 -0.25 0.00 0.87 0.00 0.00 54.58 52.49 1brm n ASN 150 Cb 0.05 -0.30 -0.01 0.00 -1.02 0.00 0.00 39.78 38.50 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 -1.08 -0.63 -0.35 6.41 2.03 -0.32 -4.88 116.55 117.73 1brm n ASP 151 Ca 0.11 -0.96 0.06 0.00 0.52 0.00 0.00 54.79 54.52 1brm n ASP 151 Cb 0.53 -3.31 0.02 0.00 -0.72 0.00 0.00 41.12 37.64 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 -4.37 1.61 -4.76 -2.67 4.77 -0.70 -4.88 117.00 106.01 1brm n LEU 152 Ca -0.30 -0.88 -0.35 0.00 -0.03 0.00 0.00 56.01 54.45 1brm n LEU 152 Cb 0.68 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.69 1brm n LEU 152 CO 0.74 0.31 -0.17 -0.69 -1.33 0.00 0.00 177.39 176.25 1brm s VAL 153 N -1.21 5.42 -0.24 4.08 1.01 -1.25 -2.69 120.40 125.51 1brm s VAL 153 Ca 0.11 0.22 -0.14 0.00 0.00 0.00 0.00 61.98 62.17 1brm s VAL 153 Cb 0.09 -3.47 -0.16 0.00 0.00 0.00 0.00 36.38 32.85 1brm s VAL 153 CO 0.21 0.47 -0.12 -0.67 0.00 0.00 0.00 175.10 175.00 1brm n ASP 154 N 3.23 1.95 -3.55 3.32 2.03 0.04 -4.85 116.55 118.71 1brm n ASP 154 Ca -0.17 0.30 -0.09 0.00 0.52 0.00 0.00 54.79 55.36 1brm n ASP 154 Cb 0.53 -0.82 -0.02 0.00 -0.72 0.00 0.00 41.12 40.09 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 -1.23 -3.96 118.94 111.68 1brm s TRP 155 Ca -0.34 0.14 0.03 0.00 -1.06 0.00 0.00 56.10 54.87 1brm s TRP 155 Cb 0.11 0.58 0.00 0.00 -1.16 0.00 0.00 33.47 33.00 1brm s TRP 155 CO 0.55 -0.75 -0.16 0.08 -4.06 0.00 0.00 176.95 172.61 1brm s VAL 156 N -3.41 1.39 -0.15 -0.66 1.01 0.83 -2.30 120.40 117.10 1brm s VAL 156 Ca 0.06 -0.66 -0.03 0.00 0.00 0.00 0.00 61.98 61.34 1brm s VAL 156 Cb -0.02 -1.22 -0.03 0.00 0.00 0.00 0.00 36.38 35.12 1brm s VAL 156 CO -0.07 0.41 -0.04 -0.55 0.00 0.00 0.00 175.10 174.85 1brm s SER 157 N 0.33 4.75 0.05 3.32 0.15 -0.98 -1.67 113.70 119.64 1brm s SER 157 Ca -0.10 -0.14 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 62.37 1brm s SER 157 CO 0.04 0.17 -0.09 -0.69 1.20 0.00 0.00 173.24 173.87 1brm s VAL 158 N 0.36 0.61 -0.06 4.45 1.01 -0.06 -1.72 120.40 124.99 1brm s VAL 158 Ca -0.05 -1.10 -0.01 0.00 0.00 0.00 0.00 61.98 60.83 1brm s VAL 158 Cb -0.14 -0.66 0.03 0.00 0.00 0.00 0.00 36.38 35.60 1brm s VAL 158 CO 0.03 -0.36 -0.00 0.00 0.00 0.00 0.00 175.10 174.77 1brm s ALA 159 N -1.36 0.63 0.13 5.51 0.00 -0.85 -0.30 121.76 125.53 1brm s ALA 159 Ca -0.09 -0.07 0.06 0.00 0.00 0.00 0.00 51.96 51.86 1brm s ALA 159 Cb -0.10 -0.66 -0.04 0.00 0.00 0.00 0.00 23.12 22.32 1brm s ALA 159 CO 0.01 -0.37 0.00 0.95 0.00 0.00 0.00 175.76 176.35 1brm s THR 160 N 1.77 3.88 -0.65 0.00 -4.23 -0.62 -1.10 115.64 114.69 1brm s THR 160 Ca 0.02 -1.21 0.05 0.00 -1.18 0.00 0.00 61.69 59.37 1brm s THR 160 Cb -0.13 -2.90 0.16 0.00 1.34 0.00 0.00 72.50 70.98 1brm s THR 160 CO -0.04 -0.00 0.44 -0.31 -0.54 0.00 0.00 174.62 174.17 1brm s TYR 161 N -1.52 3.24 0.22 3.99 1.51 0.93 -2.11 117.35 123.61 1brm s TYR 161 Ca 0.27 -3.20 -0.25 0.00 -1.01 0.00 0.00 57.07 52.88 1brm s TYR 161 Cb -0.10 -2.53 -0.09 0.00 -0.11 0.00 0.00 41.96 39.13 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 -1.11 4.56 0.85 -0.62 -0.21 0.97 -1.58 119.66 122.52 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 -3.11 0.11 0.00 1.00 0.00 0.00 33.01 30.95 1brm s GLN 162 CO -0.14 0.48 1.21 0.00 -2.12 0.00 0.00 175.29 174.72 1brm s ALA 163 N -1.31 2.49 0.04 6.09 0.00 -1.20 -0.82 121.76 127.05 1brm s ALA 163 Ca 0.41 -0.78 0.11 0.00 0.00 0.00 0.00 51.96 51.70 1brm s ALA 163 Cb -0.21 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 19.99 1brm s ALA 163 CO 0.26 -1.91 1.40 0.00 0.00 0.00 0.00 175.76 175.51 1brm h ALA 164 N -1.23 0.56 -0.05 0.00 0.00 -1.13 -3.10 119.26 114.32 1brm h ALA 164 Ca -0.46 -0.68 0.01 0.00 0.00 0.00 0.00 54.91 53.79 1brm h ALA 164 Cb 1.31 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1brm h ALA 164 CO 0.59 0.93 0.13 0.66 0.00 0.00 0.00 179.25 181.56 1brm h SER 165 N 0.00 0.00 0.64 0.00 4.64 -1.21 0.58 113.55 118.20 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 1.51 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.60 1brm h SER 165 CO 0.10 0.00 -0.15 1.23 -0.87 0.00 0.00 176.83 177.14 1brm h GLY 166 N 0.00 0.00 0.21 -0.77 0.00 -1.81 -3.11 103.07 97.59 1brm h GLY 166 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.04 1brm h GLY 166 CO -0.00 0.00 -1.75 0.61 0.00 0.00 0.00 176.54 175.40 1brm n GLY 167 N -0.29 -0.67 0.00 4.60 0.00 0.20 -5.10 105.19 103.93 1brm n GLY 167 Ca -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 1.66 2.19 0.36 -0.02 0.00 -0.74 -4.88 105.19 103.77 1brm n GLY 168 Ca -0.36 -1.39 0.05 0.00 0.00 0.00 0.00 46.02 44.32 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 1.60 -0.74 4.61 0.00 -1.86 -1.23 119.26 121.65 1brm h ALA 169 Ca 0.00 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.91 1brm h ALA 169 Cb 0.00 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.51 1brm h ALA 169 CO 0.00 0.27 0.48 0.00 0.00 0.00 0.00 179.25 180.00 1brm h ARG 170 N 0.91 0.92 0.50 0.00 3.08 -1.94 -1.36 114.38 116.50 1brm h ARG 170 Ca 0.36 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.33 1brm h ARG 170 Cb 0.24 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1brm h ARG 170 CO -0.13 0.61 -0.24 0.45 -1.07 0.00 0.00 179.97 179.58 1brm h HIS 171 N 0.95 -0.63 -0.83 3.04 3.86 -1.54 0.14 115.15 120.14 1brm h HIS 171 Ca 0.28 -0.01 0.19 0.00 -1.16 0.00 0.00 60.37 59.67 1brm h HIS 171 Cb -0.05 0.21 -0.06 0.00 1.06 0.00 0.00 27.41 28.58 1brm h HIS 171 CO -0.03 -0.36 0.56 0.52 0.86 0.00 0.00 177.93 179.49 1brm h MET 172 N -0.75 0.33 0.08 2.45 2.86 -1.16 0.15 114.93 118.89 1brm h MET 172 Ca -0.07 -0.02 -0.27 0.00 -2.06 0.00 0.00 59.70 57.28 1brm h MET 172 Cb 0.55 -0.07 0.02 0.00 0.06 0.00 0.00 31.60 32.16 1brm h MET 172 CO 0.11 0.22 -1.15 0.00 1.06 0.00 0.00 176.91 177.16 1brm h ARG 173 N 0.34 0.51 -0.40 1.72 3.08 -0.90 -3.04 114.38 115.69 1brm h ARG 173 Ca 0.42 -0.65 -0.06 0.00 0.07 0.00 0.00 59.98 59.76 1brm h ARG 173 Cb 1.12 0.21 -0.02 0.00 0.08 0.00 0.00 29.97 31.36 1brm h ARG 173 CO -0.13 1.27 -0.00 1.49 -1.07 0.00 0.00 179.97 181.53 1brm h GLU 174 N 0.24 0.64 0.72 0.04 4.81 0.18 -1.04 114.58 120.17 1brm h GLU 174 Ca -0.14 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 58.90 1brm h GLU 174 Cb 1.82 -0.08 0.01 0.00 0.63 0.00 0.00 28.75 31.12 1brm h GLU 174 CO 0.21 0.66 -0.34 1.25 -0.73 0.00 0.00 179.01 180.06 1brm h LEU 175 N 0.61 -0.82 -0.50 1.64 5.85 -0.92 -1.21 115.31 119.96 1brm h LEU 175 Ca 0.13 0.03 0.10 0.00 0.84 0.00 0.00 57.88 58.97 1brm h LEU 175 Cb 0.39 0.21 -0.10 0.00 0.37 0.00 0.00 40.66 41.53 1brm h LEU 175 CO 0.01 -0.47 -0.16 -0.07 -0.34 0.00 0.00 178.44 177.42 1brm h LEU 176 N -1.19 -0.57 -0.27 2.25 3.38 -1.52 0.41 115.31 117.80 1brm h LEU 176 Ca -0.10 0.16 0.06 0.00 0.09 0.00 0.00 57.88 58.10 1brm h LEU 176 Cb 0.74 0.35 -0.08 0.00 0.09 0.00 0.00 40.66 41.76 1brm h LEU 176 CO 0.16 -0.20 -0.28 0.74 0.09 0.00 0.00 178.44 178.95 1brm h THR 177 N -0.04 0.32 -0.59 0.22 2.02 -1.18 -1.06 112.91 112.59 1brm h THR 177 Ca 0.24 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.54 1brm h THR 177 Cb 0.41 0.32 -0.10 0.00 -1.74 0.00 0.00 68.15 67.03 1brm h THR 177 CO -0.54 0.00 -0.06 1.56 0.37 0.00 0.00 175.52 176.86 1brm h GLN 178 N -0.28 0.07 0.00 6.66 4.20 0.30 1.03 115.11 127.09 1brm h GLN 178 Ca 0.14 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 1brm h GLN 178 Cb 0.50 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.27 1brm h GLN 178 CO -0.43 0.04 0.07 -1.33 -0.67 0.00 0.00 178.83 176.51 1brm n MET 179 N -5.33 0.10 0.00 1.46 2.81 -0.30 -1.45 117.12 114.42 1brm n MET 179 Ca 0.08 0.59 -0.20 0.00 -1.81 0.00 0.00 57.70 56.35 1brm n MET 179 Cb 0.33 -1.91 -0.14 0.00 -0.71 0.00 0.00 33.22 30.79 1brm n MET 179 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1brm h GLY 180 N 0.00 0.24 0.97 3.03 0.00 0.16 -3.13 103.07 104.35 1brm h GLY 180 Ca 0.00 -0.62 -0.00 0.00 0.00 0.00 0.00 47.33 46.71 1brm h GLY 180 CO 0.00 0.55 0.09 0.45 0.00 0.00 0.00 176.54 177.63 1brm h HIS 181 N -0.45 0.19 0.06 5.60 -0.00 -0.94 -0.47 115.15 119.14 1brm h HIS 181 Ca -0.23 0.00 0.02 0.00 -0.00 0.00 0.00 60.37 60.16 1brm h HIS 181 Cb 1.61 -0.06 -0.04 0.00 -0.00 0.00 0.00 27.41 28.92 1brm h HIS 181 CO 0.16 0.16 -0.25 -0.07 -0.00 0.00 0.00 177.93 177.93 1brm h LEU 182 N 0.17 -0.72 0.54 2.43 3.38 -1.60 -1.29 115.31 118.23 1brm h LEU 182 Ca 0.05 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 1brm h LEU 182 Cb 0.02 0.28 0.01 0.00 0.09 0.00 0.00 40.66 41.06 1brm h LEU 182 CO -0.01 -0.33 -0.26 0.22 0.09 0.00 0.00 178.44 178.15 1brm h TYR 183 N -0.42 -0.68 -0.24 1.13 5.03 -1.47 -3.23 116.97 117.10 1brm h TYR 183 Ca 0.04 -0.02 0.03 0.00 2.58 0.00 0.00 58.73 61.37 1brm h TYR 183 Cb 0.47 0.22 -0.06 0.00 1.55 0.00 0.00 36.73 38.92 1brm h TYR 183 CO -0.26 -0.41 -0.43 0.78 -1.32 0.00 0.00 178.16 176.53 1brm h GLY 184 N -0.76 -1.22 -0.52 1.82 0.00 -0.99 0.39 103.07 101.79 1brm h GLY 184 Ca -0.07 0.72 0.12 0.00 0.00 0.00 0.00 47.33 48.10 1brm h GLY 184 CO 0.12 -0.27 -0.08 1.57 0.00 0.00 0.00 176.54 177.88 1brm n HIS 185 N -4.76 0.24 -1.59 5.60 -0.00 -0.50 0.90 115.22 115.10 1brm n HIS 185 Ca -0.03 0.63 -0.05 0.00 -0.00 0.00 0.00 57.72 58.27 1brm n HIS 185 Cb 0.27 -0.83 0.17 0.00 -0.00 0.00 0.00 29.99 29.60 1brm n HIS 185 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.34 177.67 1brm n VAL 186 N -4.77 2.47 -0.11 3.57 0.24 -0.82 -4.77 118.33 114.15 1brm n VAL 186 Ca 0.10 -3.16 -0.09 0.00 -2.04 0.00 0.00 64.34 59.14 1brm n VAL 186 Cb 0.31 -0.44 -0.02 0.00 -1.47 0.00 0.00 33.84 32.22 1brm n VAL 186 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1brm h ALA 187 N 1.21 0.43 0.33 2.33 0.00 0.27 -0.78 119.26 123.04 1brm h ALA 187 Ca 0.18 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1brm h ALA 187 Cb 1.38 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1brm h ALA 187 CO 0.35 0.01 -0.16 -0.44 0.00 0.00 0.00 179.25 179.01 1brm h ASP 188 N 0.39 -0.37 -0.50 0.00 5.19 -1.86 -2.42 116.42 116.84 1brm h ASP 188 Ca 0.11 -0.05 0.10 0.00 -0.62 0.00 0.00 57.03 56.57 1brm h ASP 188 Cb 0.15 0.10 -0.09 0.00 0.18 0.00 0.00 39.33 39.67 1brm h ASP 188 CO -0.01 -0.18 -0.10 -0.33 -3.12 0.00 0.00 179.24 175.49 1brm h GLU 189 N -0.54 0.02 0.00 3.56 3.07 -1.89 0.31 114.58 119.11 1brm h GLU 189 Ca -0.04 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1brm h GLU 189 Cb 0.40 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.31 1brm h GLU 189 CO 0.07 0.01 0.00 -0.07 -1.40 0.00 0.00 179.01 177.62 1brm h LEU 190 N 0.02 0.00 0.09 1.33 3.38 -1.00 -1.97 115.31 117.15 1brm h LEU 190 Ca 0.24 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.94 1brm h LEU 190 Cb 0.38 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1brm h LEU 190 CO -0.50 0.00 -1.31 0.00 0.09 0.00 0.00 178.44 176.72 1brm h ALA 191 N 2.01 0.25 -2.14 1.53 0.00 0.12 -3.44 119.26 117.60 1brm h ALA 191 Ca 0.00 -1.00 -0.57 0.00 0.00 0.00 0.00 54.91 53.34 1brm h ALA 191 Cb 0.07 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 1brm h ALA 191 CO 0.00 1.13 0.72 0.99 0.00 0.00 0.00 179.25 182.09 1brm s THR 192 N -2.65 4.71 0.37 0.00 2.01 -0.74 -4.91 115.64 114.42 1brm s THR 192 Ca -0.04 2.03 0.19 0.00 0.31 0.00 0.00 61.69 64.17 1brm s THR 192 Cb 0.08 -4.31 0.18 0.00 0.01 0.00 0.00 72.50 68.46 1brm s THR 192 CO 0.86 -0.12 1.92 -0.65 -0.69 0.00 0.00 174.62 175.94 1brm h PRO 193 N 7.33 0.00 -2.10 4.92 0.11 -1.85 -3.19 132.00 137.22 1brm h PRO 193 Ca -0.23 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.29 1brm h PRO 193 Cb 1.09 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 32.01 1brm h PRO 193 CO 0.94 0.26 0.81 -1.13 -0.21 0.00 0.00 178.00 178.66 1brm n SER 194 N -3.90 6.90 -4.54 -2.05 3.41 -1.26 -4.95 113.62 107.23 1brm n SER 194 Ca -0.02 -3.32 -0.31 0.00 -0.26 0.00 0.00 58.87 54.97 1brm n SER 194 Cb 0.34 -1.22 -0.11 0.00 -0.26 0.00 0.00 64.21 62.96 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 0.07 4.25 -0.56 4.04 1.04 -1.21 -5.08 113.70 116.25 1brm s SER 195 Ca 0.56 -0.31 -0.28 0.00 0.48 0.00 0.00 55.95 56.41 1brm s SER 195 Cb 0.36 -0.84 0.03 0.00 0.10 0.00 0.00 66.02 65.67 1brm s SER 195 CO -0.23 0.25 1.15 0.00 0.98 0.00 0.00 173.24 175.38 1brm s ALA 196 N -1.01 3.05 0.50 5.32 0.00 -1.26 -4.90 121.76 123.45 1brm s ALA 196 Ca 0.17 -0.81 0.34 0.00 0.00 0.00 0.00 51.96 51.66 1brm s ALA 196 Cb -0.11 -3.97 1.47 0.00 0.00 0.00 0.00 23.12 20.51 1brm s ALA 196 CO 0.08 -2.55 1.72 0.97 0.00 0.00 0.00 175.76 175.99 1brm h ILE 197 N 6.15 0.31 0.00 0.00 6.09 -1.98 0.93 117.51 129.01 1brm h ILE 197 Ca -0.25 -0.03 0.00 0.00 -1.37 0.00 0.00 64.86 63.21 1brm h ILE 197 Cb 1.06 0.20 0.00 0.00 0.47 0.00 0.00 36.82 38.55 1brm h ILE 197 CO 1.16 0.02 0.00 -0.07 -3.07 0.00 0.00 178.15 176.19 1brm h LEU 198 N 0.10 0.00 0.20 2.19 3.38 -1.98 -0.26 115.31 118.95 1brm h LEU 198 Ca 0.68 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 58.32 1brm h LEU 198 Cb 2.43 0.00 0.02 0.00 0.09 0.00 0.00 40.66 43.20 1brm h LEU 198 CO -0.15 0.00 -1.57 0.44 0.09 0.00 0.00 178.44 177.25 1brm h ASP 199 N 0.00 0.67 0.12 -0.43 3.32 0.48 -2.14 116.42 118.45 1brm h ASP 199 Ca 0.00 -0.84 -0.01 0.00 0.02 0.00 0.00 57.03 56.21 1brm h ASP 199 Cb 0.69 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.02 1brm h ASP 199 CO 0.00 1.68 -0.06 0.40 -1.72 0.00 0.00 179.24 179.54 1brm h ILE 200 N 0.12 0.99 0.00 0.35 2.04 -1.15 -2.56 117.51 117.29 1brm h ILE 200 Ca -0.28 -0.46 -0.03 0.00 1.00 0.00 0.00 64.86 65.09 1brm h ILE 200 Cb 2.11 1.28 -0.00 0.00 -0.74 0.00 0.00 36.82 39.47 1brm h ILE 200 CO 0.22 0.11 -0.13 -0.08 0.00 0.00 0.00 178.15 178.27 1brm h GLU 201 N -0.38 0.00 0.29 2.37 4.22 -1.16 -2.29 114.58 117.63 1brm h GLU 201 Ca -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.41 1brm h GLU 201 Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1brm h GLU 201 CO 0.03 0.13 -0.14 -0.09 -2.18 0.00 0.00 179.01 176.76 1brm h ARG 202 N 0.00 -0.38 0.35 1.92 2.43 -1.09 -1.87 114.38 115.75 1brm h ARG 202 Ca -0.00 0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1brm h ARG 202 Cb 0.42 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.03 1brm h ARG 202 CO 0.02 -0.11 -0.49 0.87 -1.51 0.00 0.00 179.97 178.75 1brm h LYS 203 N -0.63 -0.85 -0.66 0.20 1.79 -1.12 -1.08 116.57 114.22 1brm h LYS 203 Ca -0.04 0.06 0.14 0.00 -2.18 0.00 0.00 60.65 58.62 1brm h LYS 203 Cb 0.45 0.19 -0.12 0.00 -1.58 0.00 0.00 32.23 31.17 1brm h LYS 203 CO 0.07 -0.57 -0.12 0.28 -1.08 0.00 0.00 179.45 178.03 1brm h VAL 204 N -0.89 0.37 -0.38 0.50 2.07 -1.46 0.24 116.25 116.70 1brm h VAL 204 Ca -0.03 -0.01 -0.06 0.00 0.82 0.00 0.00 66.70 67.42 1brm h VAL 204 Cb 0.81 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 1brm h VAL 204 CO -0.14 0.01 -0.00 0.74 0.02 0.00 0.00 177.57 178.19 1brm h THR 205 N 0.03 1.21 -0.06 2.57 2.02 -1.07 -0.69 112.91 116.92 1brm h THR 205 Ca 0.33 -0.86 -0.20 0.00 0.77 0.00 0.00 66.41 66.45 1brm h THR 205 Cb 0.52 0.92 0.01 0.00 -1.74 0.00 0.00 68.15 67.87 1brm h THR 205 CO -0.65 0.30 -0.74 0.71 0.37 0.00 0.00 175.52 175.51 1brm h THR 206 N 0.58 1.34 -0.84 3.16 1.35 0.38 -3.13 112.91 115.74 1brm h THR 206 Ca 0.12 -2.03 0.03 0.00 -0.55 0.00 0.00 66.41 63.99 1brm h THR 206 Cb 0.37 2.29 -0.05 0.00 -1.73 0.00 0.00 68.15 69.02 1brm h THR 206 CO 0.01 0.62 0.54 0.25 -0.25 0.00 0.00 175.52 176.69 1brm h LEU 207 N 0.24 0.89 -2.07 3.87 5.85 -0.43 0.10 115.31 123.76 1brm h LEU 207 Ca -0.07 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1brm h LEU 207 Cb 1.40 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.23 1brm h LEU 207 CO 0.15 0.61 0.05 0.74 -0.34 0.00 0.00 178.44 179.65 1brm h THR 208 N 1.04 0.00 -0.05 1.05 2.02 -1.08 -0.09 112.91 115.81 1brm h THR 208 Ca 0.34 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.52 1brm h THR 208 Cb 0.02 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 67.12 1brm h THR 208 CO -0.12 0.00 0.00 0.54 0.37 0.00 0.00 175.52 176.31 1brm n ARG 209 N -2.62 0.52 0.21 6.66 1.74 0.16 -4.59 116.66 118.73 1brm n ARG 209 Ca -0.02 -1.05 0.09 0.00 -0.77 0.00 0.00 57.85 56.10 1brm n ARG 209 Cb 0.10 -1.11 0.35 0.00 -1.02 0.00 0.00 32.46 30.78 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 1.05 0.00 0.00 0.55 4.64 0.89 -3.47 113.55 117.22 1brm h SER 210 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1brm h SER 210 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1brm h SER 210 CO 0.00 0.24 0.00 0.61 -0.87 0.00 0.00 176.83 176.81 1brm n GLY 211 N 0.48 0.98 0.18 -0.77 0.00 -1.25 -4.88 105.19 99.92 1brm n GLY 211 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.17 1brm n GLY 211 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1brm h GLU 212 N 3.63 0.00 -6.66 1.61 5.08 -1.91 -3.44 114.58 112.89 1brm h GLU 212 Ca 0.00 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.85 1brm h GLU 212 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1brm h GLU 212 CO 0.00 0.00 0.41 -0.51 -1.00 0.00 0.00 179.01 177.91 1brm s LEU 213 N -5.21 4.53 -0.51 1.33 1.43 -1.26 -4.99 118.68 114.00 1brm s LEU 213 Ca 0.05 1.97 -0.27 0.00 -1.03 0.00 0.00 54.13 54.85 1brm s LEU 213 Cb 0.09 -3.60 0.03 0.00 0.03 0.00 0.00 46.19 42.74 1brm s LEU 213 CO 0.51 -0.08 1.08 -2.16 0.23 0.00 0.00 176.35 175.93 1brm s PRO 214 N -0.49 3.58 -0.28 1.29 0.04 -1.26 -4.88 135.00 133.00 1brm s PRO 214 Ca 0.46 0.30 0.10 0.00 0.04 0.00 0.00 61.00 61.90 1brm s PRO 214 Cb -0.27 -3.95 0.47 0.00 0.04 0.00 0.00 34.50 30.79 1brm s PRO 214 CO 0.33 -1.43 1.18 1.33 0.04 0.00 0.00 177.00 178.44 1brm n VAL 215 N 6.64 2.31 0.29 -0.36 0.24 -1.26 -4.88 118.33 121.31 1brm n VAL 215 Ca 0.09 -3.97 -0.17 0.00 -2.04 0.00 0.00 64.34 58.25 1brm n VAL 215 Cb 0.49 -0.71 -0.08 0.00 -1.47 0.00 0.00 33.84 32.06 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 2.21 -0.99 -0.16 -1.34 3.32 -1.89 0.68 116.42 118.25 1brm h ASP 216 Ca 0.28 0.07 -0.06 0.00 0.02 0.00 0.00 57.03 57.33 1brm h ASP 216 Cb 1.48 0.31 -0.00 0.00 0.22 0.00 0.00 39.33 41.34 1brm h ASP 216 CO 0.64 -0.56 -0.14 0.78 -1.72 0.00 0.00 179.24 178.24 1brm h ASN 217 N -0.86 0.41 1.64 6.45 2.35 -1.94 -3.30 115.58 120.33 1brm h ASN 217 Ca -0.05 -0.46 -0.05 0.00 -0.55 0.00 0.00 56.30 55.18 1brm h ASN 217 Cb 0.73 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.98 1brm h ASN 217 CO 0.01 0.79 -0.37 -0.26 -1.65 0.00 0.00 177.43 175.95 1brm h PHE 218 N 0.04 0.00 0.00 1.19 0.04 -1.93 -3.48 116.94 112.80 1brm h PHE 218 Ca 0.03 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.80 1brm h PHE 218 Cb 0.66 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.81 1brm h PHE 218 CO 0.08 0.22 0.00 0.41 -0.60 0.00 0.00 178.31 178.42 1brm n GLY 219 N 1.17 1.90 3.27 -1.45 0.00 0.24 -4.89 105.19 105.42 1brm n GLY 219 Ca 0.02 -0.29 -0.15 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.16 1.30 0.63 1.61 -7.23 -1.26 -4.85 120.40 110.44 1brm s VAL 220 Ca 0.00 -2.07 -0.19 0.00 -1.81 0.00 0.00 61.98 57.92 1brm s VAL 220 Cb 0.00 -1.86 -0.02 0.00 0.56 0.00 0.00 36.38 35.06 1brm s VAL 220 CO 0.00 -0.69 1.30 -2.84 -0.31 0.00 0.00 175.10 172.56 1brm s PRO 221 N -3.64 2.65 0.00 4.82 0.02 -1.26 -4.90 135.00 132.68 1brm s PRO 221 Ca 0.17 2.08 0.00 0.00 0.02 0.00 0.00 61.00 63.27 1brm s PRO 221 Cb 0.01 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.63 1brm s PRO 221 CO 0.02 -1.53 0.00 -0.11 -0.33 0.00 0.00 177.00 175.05 1brm n LEU 222 N -1.77 2.29 -4.64 -5.54 7.94 -1.26 -4.58 117.00 109.43 1brm n LEU 222 Ca 0.15 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 0.48 0.38 1.52 0.00 -1.11 0.00 0.00 177.39 178.66 1brm s ALA 223 N -1.98 3.39 0.00 1.96 0.00 -1.26 -1.12 121.76 122.74 1brm s ALA 223 Ca 0.00 0.94 0.00 0.00 0.00 0.00 0.00 51.96 52.90 1brm s ALA 223 Cb 0.00 -3.86 0.00 0.00 0.00 0.00 0.00 23.12 19.26 1brm s ALA 223 CO 0.00 -1.80 0.00 0.41 0.00 0.00 0.00 175.76 174.37 1brm n GLY 224 N 4.65 0.40 0.00 0.00 0.00 -1.26 -4.94 105.19 104.04 1brm n GLY 224 Ca 0.20 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 1.95 0.00 -3.76 1.61 2.88 -0.27 -5.16 113.62 110.86 1brm n SER 225 Ca 0.00 -0.27 -0.06 0.00 -1.33 0.00 0.00 58.87 57.21 1brm n SER 225 Cb 0.16 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.60 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 -0.22 -0.20 2.46 0.05 -1.26 -4.44 118.68 115.08 1brm s LEU 226 Ca 0.00 -0.59 -0.05 0.00 0.05 0.00 0.00 54.13 53.54 1brm s LEU 226 Cb 0.00 2.58 0.07 0.00 -2.05 0.00 0.00 46.19 46.79 1brm s LEU 226 CO 0.00 -1.25 0.09 -0.63 -0.55 0.00 0.00 176.35 174.01 1brm s ILE 227 N -3.61 -0.03 -0.88 1.48 1.01 -0.46 -4.96 121.20 113.76 1brm s ILE 227 Ca 0.12 -0.33 -0.07 0.00 0.00 0.00 0.00 60.65 60.37 1brm s ILE 227 Cb -0.05 -0.70 -0.11 0.00 0.01 0.00 0.00 42.46 41.61 1brm s ILE 227 CO 0.06 -0.37 2.66 -0.81 0.00 0.00 0.00 174.94 176.48 1brm n PRO 228 N 5.25 2.47 -3.64 2.79 -0.04 -1.26 -1.00 135.00 139.57 1brm n PRO 228 Ca -0.07 -1.50 -0.04 0.00 -0.04 0.00 0.00 63.50 61.85 1brm n PRO 228 Cb 0.47 -2.40 -0.07 0.00 -0.04 0.00 0.00 33.50 31.47 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 -0.56 -0.08 0.54 -0.11 -1.23 -4.95 118.94 114.93 1brm s TRP 229 Ca 0.54 1.16 0.04 0.00 1.22 0.00 0.00 56.10 59.06 1brm s TRP 229 Cb 0.17 0.36 -0.01 0.00 -1.50 0.00 0.00 33.47 32.49 1brm s TRP 229 CO -0.03 -0.28 -0.20 0.42 -4.62 0.00 0.00 176.95 172.24 1brm s ILE 230 N 1.14 2.44 -1.52 5.86 -1.09 -1.26 -4.63 121.20 122.14 1brm s ILE 230 Ca -0.07 -0.92 -0.09 0.00 -2.23 0.00 0.00 60.65 57.34 1brm s ILE 230 Cb -0.04 -1.94 -0.08 0.00 -1.58 0.00 0.00 42.46 38.82 1brm s ILE 230 CO -0.14 0.56 2.83 0.47 -1.23 0.00 0.00 174.94 177.44 1brm n ASP 231 N 3.02 8.14 0.00 3.58 9.92 -1.26 -5.16 116.55 134.80 1brm n ASP 231 Ca -0.18 -2.53 0.00 0.00 -0.53 0.00 0.00 54.79 51.55 1brm n ASP 231 Cb 0.52 -1.49 0.00 0.00 -0.64 0.00 0.00 41.12 39.51 1brm n ASP 231 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 1brm n TRP 243 N 3.71 0.00 0.15 1.24 7.02 -1.26 -5.16 117.44 123.14 1brm n TRP 243 Ca 0.73 0.00 0.03 0.00 -1.02 0.00 0.00 57.50 57.25 1brm n TRP 243 Cb 0.22 0.00 0.12 0.00 -2.42 0.00 0.00 31.31 29.23 1brm n TRP 243 CO 0.00 0.00 0.00 0.87 -2.02 0.00 0.00 177.69 176.54 1brm h LYS 244 N 0.00 0.00 0.00 -0.99 6.56 -1.96 -3.48 116.57 116.71 1brm h LYS 244 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1brm h LYS 244 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1brm h LYS 244 CO 0.00 0.48 0.00 0.41 -2.06 0.00 0.00 179.45 178.28 1brm n GLY 245 N 0.93 1.43 0.13 3.86 0.00 -1.26 -4.61 105.19 105.67 1brm n GLY 245 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 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 0.36 0.77 1.61 4.15 -1.93 -0.06 115.11 120.00 1brm h GLN 246 Ca 0.00 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.33 1brm h GLN 246 Cb 0.00 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.63 1brm h GLN 246 CO 0.00 0.38 -0.42 0.00 -1.93 0.00 0.00 178.83 176.86 1brm h ALA 247 N 0.97 -1.12 -0.81 3.38 0.00 -1.95 -1.29 119.26 118.44 1brm h ALA 247 Ca 0.08 -0.23 0.10 0.00 0.00 0.00 0.00 54.91 54.86 1brm h ALA 247 Cb 0.14 0.49 -0.08 0.00 0.00 0.00 0.00 17.79 18.35 1brm h ALA 247 CO -0.01 -1.14 0.44 0.93 0.00 0.00 0.00 179.25 179.48 1brm h GLU 248 N -1.10 0.71 -0.14 0.00 5.08 -1.97 0.20 114.58 117.35 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 0.87 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 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 0.73 0.97 -0.11 1.13 2.02 -0.83 0.16 112.91 116.98 1brm h THR 249 Ca 0.40 -0.04 -0.09 0.00 0.77 0.00 0.00 66.41 67.44 1brm h THR 249 Cb 0.41 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 1brm h THR 249 CO -0.27 0.02 -0.36 0.78 0.37 0.00 0.00 175.52 176.06 1brm h ASN 250 N 0.12 0.22 -0.09 4.18 2.35 -0.39 -2.35 115.58 119.63 1brm h ASN 250 Ca 0.06 -0.08 -0.14 0.00 -0.55 0.00 0.00 56.30 55.59 1brm h ASN 250 Cb 0.03 -0.06 0.01 0.00 0.05 0.00 0.00 38.32 38.35 1brm h ASN 250 CO -0.06 0.57 -0.47 0.50 -1.65 0.00 0.00 177.43 176.32 1brm h LYS 251 N 0.19 0.48 -0.75 0.81 3.64 -0.26 0.70 116.57 121.38 1brm h LYS 251 Ca 0.02 -0.40 0.01 0.00 -1.27 0.00 0.00 60.65 59.01 1brm h LYS 251 Cb 0.73 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.59 1brm h LYS 251 CO 0.05 1.03 0.50 0.82 -2.27 0.00 0.00 179.45 179.58 1brm h ILE 252 N 0.06 1.19 -0.01 2.00 2.04 -0.59 -1.19 117.51 121.01 1brm h ILE 252 Ca -0.03 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.48 1brm h ILE 252 Cb 1.12 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1brm h ILE 252 CO 0.10 0.19 -0.30 0.18 0.00 0.00 0.00 178.15 178.32 1brm n LEU 253 N -4.42 1.10 -3.98 1.44 4.77 -0.89 -4.59 117.00 110.43 1brm n LEU 253 Ca 0.08 -0.30 -0.37 0.00 -0.03 0.00 0.00 56.01 55.39 1brm n LEU 253 Cb 0.03 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1brm n LEU 253 CO 0.36 0.21 -0.19 -3.20 -1.33 0.00 0.00 177.39 173.23 1brm n ASN 254 N -0.63 -3.13 -4.79 -1.43 5.15 0.14 -4.88 115.26 105.69 1brm n ASN 254 Ca 0.12 -1.17 -0.34 0.00 -0.60 0.00 0.00 54.58 52.58 1brm n ASN 254 Cb 0.36 -2.38 -0.02 0.00 -0.53 0.00 0.00 39.78 37.21 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 -3.70 3.61 -0.74 -0.44 -4.23 -0.63 -4.97 115.64 104.54 1brm s THR 255 Ca 0.34 0.97 0.24 0.00 -1.18 0.00 0.00 61.69 62.06 1brm s THR 255 Cb -0.16 -3.39 0.03 0.00 1.34 0.00 0.00 72.50 70.32 1brm s THR 255 CO 0.93 -0.25 1.34 -1.54 -0.54 0.00 0.00 174.62 174.56 1brm n SER 256 N -1.21 0.62 -3.81 3.99 3.41 -1.26 -4.85 113.62 110.51 1brm n SER 256 Ca 0.10 0.01 -0.13 0.00 -0.26 0.00 0.00 58.87 58.60 1brm n SER 256 Cb 0.52 0.21 -0.13 0.00 -0.26 0.00 0.00 64.21 64.56 1brm n SER 256 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1brm s SER 257 N -3.85 -0.13 -0.17 4.04 0.01 -1.26 -5.12 113.70 107.21 1brm s SER 257 Ca 0.07 0.27 -0.29 0.00 1.31 0.00 0.00 55.95 57.32 1brm s SER 257 Cb 0.15 0.26 -0.05 0.00 0.21 0.00 0.00 66.02 66.59 1brm s SER 257 CO 0.72 -0.06 1.89 -0.69 0.41 0.00 0.00 173.24 175.51 1brm s VAL 258 N 0.23 3.32 -0.48 3.43 1.01 -1.26 -4.96 120.40 121.69 1brm s VAL 258 Ca -0.01 0.36 -0.18 0.00 0.00 0.00 0.00 61.98 62.15 1brm s VAL 258 Cb -0.02 -3.34 0.06 0.00 0.00 0.00 0.00 36.38 33.07 1brm s VAL 258 CO -0.01 -0.16 0.53 -0.63 0.00 0.00 0.00 175.10 174.83 1brm s ILE 259 N 6.14 5.02 0.16 2.22 1.01 -1.26 -5.03 121.20 129.46 1brm s ILE 259 Ca 0.85 -0.67 -0.34 0.00 0.00 0.00 0.00 60.65 60.49 1brm s ILE 259 Cb -0.31 -4.21 -0.15 0.00 0.01 0.00 0.00 42.46 37.80 1brm s ILE 259 CO 0.34 -0.68 1.38 -2.65 0.00 0.00 0.00 174.94 173.33 1brm n PRO 260 N 5.77 1.64 -3.60 2.79 -0.02 -1.25 -4.84 135.00 135.49 1brm n PRO 260 Ca -0.09 0.59 -0.29 0.00 -2.02 0.00 0.00 63.50 61.69 1brm n PRO 260 Cb 0.45 -2.24 -0.15 0.00 -0.02 0.00 0.00 33.50 31.54 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 0.31 0.21 0.23 -1.45 1.01 -1.26 -0.12 120.40 119.33 1brm s VAL 261 Ca 0.76 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.83 1brm s VAL 261 Cb -0.78 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 1brm s VAL 261 CO 0.46 -0.69 0.16 -0.62 0.00 0.00 0.00 175.10 174.41 1brm s ASP 262 N 1.96 0.51 0.00 3.32 -1.08 -0.67 -4.19 116.67 116.52 1brm s ASP 262 Ca 0.09 -1.47 0.00 0.00 -0.52 0.00 0.00 52.55 50.65 1brm s ASP 262 Cb -0.16 0.41 0.00 0.00 -1.46 0.00 0.00 42.92 41.70 1brm s ASP 262 CO -0.32 -0.88 0.00 0.61 0.52 0.00 0.00 175.17 175.10 1brm n GLY 263 N -0.35 -0.41 2.83 2.66 0.00 -1.26 -0.88 105.19 107.78 1brm n GLY 263 Ca 0.03 -0.50 -0.14 0.00 0.00 0.00 0.00 46.02 45.41 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 1.28 -0.19 0.99 1.43 0.59 -4.95 118.68 117.84 1brm s LEU 264 Ca 0.00 0.07 -0.07 0.00 -1.03 0.00 0.00 54.13 53.10 1brm s LEU 264 Cb 0.00 0.03 -0.04 0.00 0.03 0.00 0.00 46.19 46.21 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 0.50 1.30 -0.22 0.00 1.01 -0.90 -3.55 120.40 118.53 1brm s VAL 266 Ca 0.02 -0.70 -0.18 0.00 0.00 0.00 0.00 61.98 61.13 1brm s VAL 266 Cb -0.13 -1.08 -0.03 0.00 0.00 0.00 0.00 36.38 35.14 1brm s VAL 266 CO 0.01 0.37 0.50 -0.60 0.00 0.00 0.00 175.10 175.38 1brm s ARG 267 N -0.35 4.14 0.36 2.72 3.52 -0.17 -0.02 118.95 129.15 1brm s ARG 267 Ca 0.05 0.34 0.09 0.00 -0.13 0.00 0.00 55.73 56.09 1brm s ARG 267 Cb -0.07 -3.59 -0.06 0.00 -1.56 0.00 0.00 34.95 29.67 1brm s ARG 267 CO -0.00 -0.21 0.00 0.14 -0.81 0.00 0.00 175.30 174.41 1brm s VAL 268 N 1.86 2.42 -1.15 7.11 -7.23 -0.00 -1.35 120.40 122.05 1brm s VAL 268 Ca 0.22 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.31 1brm s VAL 268 Cb -0.15 -2.81 -0.08 0.00 0.56 0.00 0.00 36.38 33.90 1brm s VAL 268 CO 0.09 -0.15 2.52 0.61 -0.31 0.00 0.00 175.10 177.86 1brm n GLY 269 N -0.95 3.55 3.55 2.32 0.00 -1.26 -4.45 105.19 107.94 1brm n GLY 269 Ca -0.04 -1.12 -0.24 0.00 0.00 0.00 0.00 46.02 44.62 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 2.75 2.93 -0.19 4.61 0.00 -1.26 -5.04 121.76 125.56 1brm s ALA 270 Ca 0.53 -1.79 -0.19 0.00 0.00 0.00 0.00 51.96 50.51 1brm s ALA 270 Cb 0.14 -0.47 -0.15 0.00 0.00 0.00 0.00 23.12 22.64 1brm s ALA 270 CO -0.04 0.27 0.12 -0.07 0.00 0.00 0.00 175.76 176.03 1brm h LEU 271 N 2.10 0.00 0.00 0.00 3.38 -1.94 -0.78 115.31 118.06 1brm h LEU 271 Ca -0.42 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.17 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 1.32 -0.73 0.54 0.09 0.00 0.00 178.44 180.26 1brm n ARG 272 N -4.47 2.45 -2.76 1.13 1.74 -1.26 -0.82 116.66 112.66 1brm n ARG 272 Ca -0.27 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.43 1brm n ARG 272 Cb 0.59 -0.87 -0.06 0.00 -1.02 0.00 0.00 32.46 31.10 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 -1.41 2.97 0.06 0.00 3.76 -0.05 -3.25 115.29 117.37 1brm s HIS 274 Ca 0.46 -0.80 0.05 0.00 -0.15 0.00 0.00 55.06 54.61 1brm s HIS 274 Cb -0.22 -2.09 -0.04 0.00 1.11 0.00 0.00 32.58 31.34 1brm s HIS 274 CO 0.28 -0.46 -0.04 -1.12 -0.85 0.00 0.00 174.74 172.55 1brm s SER 275 N 1.33 4.80 -0.00 1.40 0.01 -0.62 -2.42 113.70 118.20 1brm s SER 275 Ca 0.04 -0.19 -0.00 0.00 1.31 0.00 0.00 55.95 57.10 1brm s SER 275 Cb -0.14 -1.11 -0.00 0.00 0.21 0.00 0.00 66.02 64.98 1brm s SER 275 CO -0.01 0.21 0.01 -1.10 0.41 0.00 0.00 173.24 172.76 1brm s GLN 276 N -1.98 0.05 -0.19 12.44 -0.21 -0.04 -0.05 119.66 129.68 1brm s GLN 276 Ca 0.22 -0.06 -0.03 0.00 0.02 0.00 0.00 55.36 55.51 1brm s GLN 276 Cb -0.11 0.02 -0.01 0.00 1.00 0.00 0.00 33.01 33.90 1brm s GLN 276 CO 0.14 -0.01 -0.06 0.00 -2.12 0.00 0.00 175.29 173.24 1brm s ALA 277 N -0.18 2.81 0.25 6.09 0.00 -0.26 -0.48 121.76 130.00 1brm s ALA 277 Ca -0.02 -1.04 0.11 0.00 0.00 0.00 0.00 51.96 51.01 1brm s ALA 277 Cb -0.01 -1.57 -0.05 0.00 0.00 0.00 0.00 23.12 21.49 1brm s ALA 277 CO -0.00 -0.15 -0.14 -0.06 0.00 0.00 0.00 175.76 175.41 1brm s PHE 278 N 1.01 2.44 -0.36 0.00 0.08 0.13 -2.00 117.98 119.28 1brm s PHE 278 Ca 0.00 -0.29 0.00 0.00 0.12 0.00 0.00 56.93 56.76 1brm s PHE 278 Cb -0.15 -1.10 0.14 0.00 -0.57 0.00 0.00 43.02 41.35 1brm s PHE 278 CO 0.00 0.64 0.22 0.99 -0.10 0.00 0.00 175.22 176.97 1brm s THR 279 N -2.27 0.20 -0.18 0.64 2.01 -0.70 -2.36 115.64 112.98 1brm s THR 279 Ca 0.29 -1.79 -0.20 0.00 0.31 0.00 0.00 61.69 60.30 1brm s THR 279 Cb -0.06 -1.16 -0.03 0.00 0.01 0.00 0.00 72.50 71.26 1brm s THR 279 CO 0.16 -1.00 0.57 -0.63 -0.69 0.00 0.00 174.62 173.03 1brm s ILE 280 N 0.99 5.08 -0.29 1.82 1.09 0.13 -2.33 121.20 127.69 1brm s ILE 280 Ca 0.19 1.07 -0.17 0.00 -1.10 0.00 0.00 60.65 60.63 1brm s ILE 280 Cb -0.22 -3.89 -0.02 0.00 -1.06 0.00 0.00 42.46 37.27 1brm s ILE 280 CO -0.00 0.17 0.48 -0.75 -0.10 0.00 0.00 174.94 174.74 1brm s LYS 281 N 1.60 3.91 0.54 2.79 2.20 -0.97 -0.18 119.74 129.64 1brm s LYS 281 Ca 0.27 0.11 -0.05 0.00 -0.36 0.00 0.00 55.97 55.93 1brm s LYS 281 Cb -0.16 -3.70 -0.01 0.00 -1.51 0.00 0.00 37.83 32.45 1brm s LYS 281 CO 0.10 -0.43 0.85 -0.51 -0.36 0.00 0.00 175.35 175.00 1brm s LEU 282 N 2.29 3.40 0.11 5.43 1.43 0.26 -0.78 118.68 130.82 1brm s LEU 282 Ca 0.19 0.77 0.26 0.00 -1.03 0.00 0.00 54.13 54.32 1brm s LEU 282 Cb -0.16 -3.65 0.64 0.00 0.03 0.00 0.00 46.19 43.05 1brm s LEU 282 CO 0.11 -0.87 1.56 0.29 0.23 0.00 0.00 176.35 177.67 1brm n LYS 283 N -2.44 0.20 -3.63 1.70 5.02 -1.09 -4.76 118.16 113.16 1brm n LYS 283 Ca 0.03 0.10 -0.10 0.00 -2.02 0.00 0.00 58.31 56.32 1brm n LYS 283 Cb 0.57 -1.67 -0.04 0.00 -0.02 0.00 0.00 35.03 33.87 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 -3.10 1.23 -0.68 1.97 -2.85 -1.26 -5.10 119.74 109.95 1brm s LYS 284 Ca 0.09 -0.71 -0.27 0.00 -1.00 0.00 0.00 55.97 54.08 1brm s LYS 284 Cb 0.14 0.51 0.00 0.00 -2.06 0.00 0.00 37.83 36.43 1brm s LYS 284 CO 0.65 -0.51 1.58 0.34 0.10 0.00 0.00 175.35 177.51 1brm s ASP 285 N -2.82 5.70 -0.19 0.03 -1.08 -1.26 -4.81 116.67 112.25 1brm s ASP 285 Ca 0.05 -0.07 -0.06 0.00 -0.52 0.00 0.00 52.55 51.95 1brm s ASP 285 Cb 0.00 -2.54 -0.03 0.00 -1.46 0.00 0.00 42.92 38.89 1brm s ASP 285 CO -0.09 -2.12 0.02 -0.69 0.52 0.00 0.00 175.17 172.81 1brm s VAL 286 N 7.46 4.24 0.77 1.11 1.01 -1.26 -5.09 120.40 128.64 1brm s VAL 286 Ca 0.52 -0.22 -0.15 0.00 0.00 0.00 0.00 61.98 62.13 1brm s VAL 286 Cb -0.10 -2.91 0.05 0.00 0.00 0.00 0.00 36.38 33.42 1brm s VAL 286 CO 0.17 0.44 1.14 -1.54 0.00 0.00 0.00 175.10 175.32 1brm n SER 287 N 3.91 0.96 -0.13 3.32 3.41 -1.26 -4.79 113.62 119.04 1brm n SER 287 Ca -0.17 0.63 -0.09 0.00 -0.26 0.00 0.00 58.87 58.99 1brm n SER 287 Cb 0.52 -1.48 -0.01 0.00 -0.26 0.00 0.00 64.21 62.98 1brm n SER 287 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1brm h ILE 288 N -0.58 1.16 -0.97 -1.33 5.03 -1.98 -1.62 117.51 117.22 1brm h ILE 288 Ca -0.47 -0.45 0.09 0.00 -0.12 0.00 0.00 64.86 63.91 1brm h ILE 288 Cb 1.31 0.75 -0.07 0.00 -3.03 0.00 0.00 36.82 35.78 1brm h ILE 288 CO 0.47 0.17 0.63 -0.65 -0.68 0.00 0.00 178.15 178.09 1brm h PRO 289 N 0.49 1.02 0.77 2.37 0.11 -1.99 0.36 132.00 135.13 1brm h PRO 289 Ca 0.13 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 66.15 1brm h PRO 289 Cb 0.10 -0.23 0.01 0.00 0.11 0.00 0.00 31.00 30.98 1brm h PRO 289 CO -0.02 0.68 -0.37 1.15 -0.21 0.00 0.00 178.00 179.23 1brm h THR 290 N 1.05 0.25 -0.78 -1.15 2.02 -1.83 -1.44 112.91 111.03 1brm h THR 290 Ca 0.45 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.81 1brm h THR 290 Cb 0.32 0.25 -0.14 0.00 -1.74 0.00 0.00 68.15 66.84 1brm h THR 290 CO -0.20 0.00 -0.01 0.58 0.37 0.00 0.00 175.52 176.26 1brm h VAL 291 N -1.03 0.30 -0.67 3.16 2.07 -0.58 0.47 116.25 119.97 1brm h VAL 291 Ca -0.10 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 1brm h VAL 291 Cb 0.79 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 1brm h VAL 291 CO 0.17 0.02 0.35 -0.33 0.02 0.00 0.00 177.57 177.80 1brm h GLU 292 N 0.09 0.94 0.18 1.57 5.08 -0.71 -1.29 114.58 120.44 1brm h GLU 292 Ca 0.43 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.67 1brm h GLU 292 Cb 0.76 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1brm h GLU 292 CO -0.70 0.71 -0.08 0.93 -1.00 0.00 0.00 179.01 178.86 1brm h GLU 293 N 0.94 -0.23 -0.90 2.33 5.08 0.94 -1.85 114.58 120.90 1brm h GLU 293 Ca 0.24 0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.65 1brm h GLU 293 Cb 0.06 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.31 1brm h GLU 293 CO -0.04 0.07 0.58 -0.07 -1.00 0.00 0.00 179.01 178.56 1brm h LEU 294 N -0.53 0.97 0.34 1.33 3.38 -0.81 -1.35 115.31 118.64 1brm h LEU 294 Ca -0.02 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1brm h LEU 294 Cb 0.40 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1brm h LEU 294 CO 0.04 0.67 -0.16 -0.07 0.09 0.00 0.00 178.44 179.01 1brm h LEU 295 N 1.14 -0.39 -1.26 1.67 3.38 -1.22 -2.59 115.31 116.04 1brm h LEU 295 Ca 0.36 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1brm h LEU 295 Cb -0.00 0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1brm h LEU 295 CO -0.12 -0.01 0.00 0.00 0.09 0.00 0.00 178.44 178.41 1brm h ALA 296 N -0.36 1.00 0.14 1.53 0.00 -1.32 -3.01 119.26 117.24 1brm h ALA 296 Ca -0.05 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.66 1brm h ALA 296 Cb 0.53 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.34 1brm h ALA 296 CO 0.08 0.00 -0.91 0.00 0.00 0.00 0.00 179.25 178.42 1brm h ALA 297 N 2.12 -0.07 -0.86 0.00 0.00 -1.17 -3.38 119.26 115.90 1brm h ALA 297 Ca 0.00 -0.75 0.14 0.00 0.00 0.00 0.00 54.91 54.30 1brm h ALA 297 Cb 0.28 0.14 -0.15 0.00 0.00 0.00 0.00 17.79 18.06 1brm h ALA 297 CO 0.00 0.44 -0.37 1.25 0.00 0.00 0.00 179.25 180.57 1brm h HIS 298 N -0.34 -1.04 -3.23 0.00 6.17 -1.32 -3.44 115.15 111.95 1brm h HIS 298 Ca -0.16 0.09 -0.05 0.00 0.71 0.00 0.00 60.37 60.96 1brm h HIS 298 Cb 1.68 0.58 -0.13 0.00 2.52 0.00 0.00 27.41 32.06 1brm h HIS 298 CO 0.19 -0.40 -0.01 0.54 0.71 0.00 0.00 177.93 178.96 1brm s ASN 299 N -5.29 -0.32 0.00 3.26 2.20 -1.26 -5.00 114.94 108.53 1brm s ASN 299 Ca -0.14 -0.19 0.08 0.00 -0.94 0.00 0.00 52.86 51.68 1brm s ASN 299 Cb 0.19 0.49 0.50 0.00 -2.00 0.00 0.00 41.25 40.44 1brm s ASN 299 CO 0.71 -0.85 0.97 -0.81 -2.94 0.00 0.00 177.10 174.18 1brm n PRO 300 N -0.13 0.54 -0.03 3.55 -0.04 -1.26 -2.81 135.00 134.81 1brm n PRO 300 Ca -0.17 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.31 1brm n PRO 300 Cb 0.63 -1.25 -0.11 0.00 -0.04 0.00 0.00 33.50 32.73 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 -0.75 0.00 -2.44 0.54 8.01 -1.26 -4.72 117.44 116.82 1brm n TRP 301 Ca 0.06 0.00 -0.42 0.00 -1.31 0.00 0.00 57.50 55.83 1brm n TRP 301 Cb 0.03 -0.47 -0.00 0.00 -2.01 0.00 0.00 31.31 28.86 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 -2.21 3.70 -2.53 6.99 0.00 -1.12 -0.38 120.51 124.95 1brm n ALA 302 Ca -0.10 -3.81 -0.43 0.00 0.00 0.00 0.00 53.44 49.10 1brm n ALA 302 Cb 0.60 -3.59 -0.02 0.00 0.00 0.00 0.00 19.45 16.44 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 4.23 4.15 -0.25 0.00 2.20 -1.25 -4.24 119.74 124.58 1brm s LYS 303 Ca 0.54 1.38 -0.24 0.00 -0.36 0.00 0.00 55.97 57.29 1brm s LYS 303 Cb 0.05 -3.75 -0.01 0.00 -1.51 0.00 0.00 37.83 32.62 1brm s LYS 303 CO 0.06 -0.80 0.82 0.08 -0.36 0.00 0.00 175.35 175.15 1brm s VAL 304 N 3.61 4.84 -0.27 4.02 1.01 -1.26 -0.47 120.40 131.88 1brm s VAL 304 Ca 0.50 1.52 -0.11 0.00 0.00 0.00 0.00 61.98 63.89 1brm s VAL 304 Cb -0.17 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 32.05 1brm s VAL 304 CO 0.14 -0.08 0.19 -0.69 0.00 0.00 0.00 175.10 174.66 1brm s VAL 305 N 2.84 5.31 0.83 2.92 1.01 0.85 -4.95 120.40 129.22 1brm s VAL 305 Ca 0.34 0.20 -0.13 0.00 0.00 0.00 0.00 61.98 62.39 1brm s VAL 305 Cb -0.15 -3.53 0.07 0.00 0.00 0.00 0.00 36.38 32.76 1brm s VAL 305 CO 0.08 0.27 0.99 -2.65 0.00 0.00 0.00 175.10 173.78 1brm n PRO 306 N 4.88 0.05 -0.88 2.72 -0.02 -1.26 -4.16 135.00 136.33 1brm n PRO 306 Ca -0.14 0.09 -0.10 0.00 -2.02 0.00 0.00 63.50 61.33 1brm n PRO 306 Cb 0.52 -2.26 -0.14 0.00 -0.02 0.00 0.00 33.50 31.60 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 -2.69 4.86 -4.61 2.55 4.05 -1.26 -4.51 115.26 113.64 1brm n ASN 307 Ca 0.12 -2.40 -0.32 0.00 0.45 0.00 0.00 54.58 52.43 1brm n ASN 307 Cb 0.51 -1.29 -0.10 0.00 1.23 0.00 0.00 39.78 40.13 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 2.07 4.73 0.09 1.20 1.01 -1.26 -5.02 116.67 119.49 1brm s ASP 308 Ca 0.55 -0.10 -0.29 0.00 0.71 0.00 0.00 52.55 53.42 1brm s ASP 308 Cb 0.26 -1.14 -0.12 0.00 1.01 0.00 0.00 42.92 42.93 1brm s ASP 308 CO 0.00 0.30 1.47 -0.09 0.21 0.00 0.00 175.17 177.06 1brm h ARG 309 N 4.60 -0.57 0.09 8.23 2.43 -1.99 -2.13 114.38 125.04 1brm h ARG 309 Ca -0.49 0.04 0.01 0.00 -0.81 0.00 0.00 59.98 58.73 1brm h ARG 309 Cb 1.17 0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 30.82 1brm h ARG 309 CO 0.54 -0.38 -0.34 0.93 -1.51 0.00 0.00 179.97 179.21 1brm h GLU 310 N -0.59 -0.48 -0.64 0.20 3.07 -1.97 -2.08 114.58 112.09 1brm h GLU 310 Ca 0.01 0.03 0.06 0.00 -0.50 0.00 0.00 59.36 58.95 1brm h GLU 310 Cb 0.63 0.11 -0.05 0.00 -0.84 0.00 0.00 28.75 28.59 1brm h GLU 310 CO -0.29 -0.32 0.35 -0.84 -1.40 0.00 0.00 179.01 176.51 1brm h ILE 311 N -0.49 0.97 -0.76 3.13 3.07 -1.92 -1.90 117.51 119.61 1brm h ILE 311 Ca -0.01 -0.22 0.12 0.00 1.55 0.00 0.00 64.86 66.30 1brm h ILE 311 Cb 0.49 0.26 -0.08 0.00 -0.27 0.00 0.00 36.82 37.22 1brm h ILE 311 CO -0.18 0.12 0.35 0.74 -1.05 0.00 0.00 178.15 178.13 1brm h THR 312 N 0.65 0.75 0.00 0.16 2.02 -1.22 0.27 112.91 115.55 1brm h THR 312 Ca 0.28 -0.19 -0.08 0.00 0.77 0.00 0.00 66.41 67.20 1brm h THR 312 Cb 0.17 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.73 1brm h THR 312 CO -0.18 0.10 -0.38 0.24 0.37 0.00 0.00 175.52 175.68 1brm h MET 313 N 0.55 0.00 0.00 6.66 2.86 -0.75 -1.69 114.93 122.55 1brm h MET 313 Ca 0.40 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.86 1brm h MET 313 Cb 0.52 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.15 1brm h MET 313 CO -0.34 0.38 -1.38 0.00 1.06 0.00 0.00 176.91 176.63 1brm h ARG 314 N 0.00 0.00 0.00 1.72 3.08 -0.33 -3.44 114.38 115.42 1brm h ARG 314 Ca -0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1brm h ARG 314 Cb 0.88 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.92 1brm h ARG 314 CO 0.05 0.34 -1.19 0.39 -1.07 0.00 0.00 179.97 178.49 1brm n GLU 315 N -2.94 1.99 -1.35 0.04 1.02 0.80 -4.77 120.64 115.42 1brm n GLU 315 Ca -0.10 0.01 -0.23 0.00 -0.02 0.00 0.00 57.16 56.82 1brm n GLU 315 Cb 0.86 -1.07 -0.09 0.00 -0.02 0.00 0.00 31.44 31.12 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 -2.33 6.14 -3.94 -4.62 7.94 -0.64 -4.61 117.00 114.95 1brm n LEU 316 Ca -0.05 -3.82 -0.10 0.00 -1.11 0.00 0.00 56.01 50.93 1brm n LEU 316 Cb 0.58 -1.29 -0.12 0.00 0.53 0.00 0.00 43.42 43.12 1brm n LEU 316 CO 0.05 1.73 -0.34 0.42 -1.11 0.00 0.00 177.39 178.13 1brm s THR 317 N -1.28 0.08 0.23 1.96 -4.23 -1.26 -4.93 115.64 106.21 1brm s THR 317 Ca 0.61 -0.67 -0.10 0.00 -1.18 0.00 0.00 61.69 60.36 1brm s THR 317 Cb 0.36 -0.22 0.25 0.00 1.34 0.00 0.00 72.50 74.23 1brm s THR 317 CO -0.16 -0.37 1.64 -0.65 -0.54 0.00 0.00 174.62 174.54 1brm h PRO 318 N 4.98 0.07 -1.09 3.99 0.11 -1.95 0.39 132.00 138.51 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 -0.02 -0.07 0.00 0.11 0.00 0.00 31.00 32.24 1brm h PRO 318 CO 0.43 0.05 0.75 0.00 -0.21 0.00 0.00 178.00 179.02 1brm h ALA 319 N 1.66 2.71 0.12 -0.75 0.00 -1.96 0.22 119.26 121.26 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 18.45 1brm h ALA 319 CO -0.63 -1.07 -1.55 0.00 0.00 0.00 0.00 179.25 176.00 1brm h ALA 320 N 1.52 0.26 0.15 0.00 0.00 -0.55 -3.39 119.26 117.25 1brm h ALA 320 Ca 0.56 -1.11 -0.35 0.00 0.00 0.00 0.00 54.91 54.01 1brm h ALA 320 Cb 1.87 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 19.96 1brm h ALA 320 CO -0.13 1.13 -1.83 0.28 0.00 0.00 0.00 179.25 178.70 1brm h VAL 321 N 0.07 0.82 -0.75 0.00 2.07 -0.26 -3.47 116.25 114.73 1brm h VAL 321 Ca -0.25 -2.48 -0.63 0.00 0.82 0.00 0.00 66.70 64.16 1brm h VAL 321 Cb 2.02 2.64 0.02 0.00 -1.52 0.00 0.00 31.29 34.46 1brm h VAL 321 CO 0.16 0.86 0.28 0.41 0.02 0.00 0.00 177.57 179.30 1brm n THR 322 N -3.51 0.00 -0.82 2.57 -1.04 0.59 -0.50 114.28 111.58 1brm n THR 322 Ca -0.26 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.75 1brm n THR 322 Cb 1.06 -0.18 0.00 0.00 -1.82 0.00 0.00 70.33 69.39 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 2.06 1.05 3.73 3.41 0.00 -1.26 -5.03 105.19 109.14 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 -3.70 2.96 -1.74 2.61 -4.23 0.35 -5.02 115.64 106.87 1brm s THR 324 Ca 0.00 -1.70 0.15 0.00 -1.18 0.00 0.00 61.69 58.96 1brm s THR 324 Cb 0.00 -2.97 0.49 0.00 1.34 0.00 0.00 72.50 71.37 1brm s THR 324 CO 0.00 -0.17 1.40 0.18 -0.54 0.00 0.00 174.62 175.49 1brm n LEU 325 N -1.15 3.14 -4.76 4.79 4.77 -1.26 -4.49 117.00 118.03 1brm n LEU 325 Ca -0.03 -1.57 -0.40 0.00 -0.03 0.00 0.00 56.01 53.98 1brm n LEU 325 Cb 0.61 -0.41 -0.06 0.00 -2.33 0.00 0.00 43.42 41.24 1brm n LEU 325 CO 0.43 0.69 0.49 -0.89 -1.33 0.00 0.00 177.39 176.78 1brm s THR 326 N -1.45 4.48 -0.53 -5.08 2.01 -1.26 -4.81 115.64 108.99 1brm s THR 326 Ca 0.37 1.71 0.06 0.00 0.31 0.00 0.00 61.69 64.13 1brm s THR 326 Cb 0.21 -4.15 0.22 0.00 0.01 0.00 0.00 72.50 68.79 1brm s THR 326 CO 0.22 0.47 0.56 0.35 -0.69 0.00 0.00 174.62 175.52 1brm n THR 327 N 2.01 0.64 -1.92 -0.82 -2.24 0.49 -4.42 114.28 108.02 1brm n THR 327 Ca -0.04 -4.46 -0.38 0.00 -2.27 0.00 0.00 64.05 56.90 1brm n THR 327 Cb 0.49 -1.99 0.03 0.00 -2.10 0.00 0.00 70.33 66.76 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 -1.43 3.28 -0.07 -0.78 0.04 -1.15 -3.74 135.00 131.15 1brm s PRO 328 Ca 0.34 2.09 0.05 0.00 0.04 0.00 0.00 61.00 63.52 1brm s PRO 328 Cb 0.10 -2.27 -0.00 0.00 0.04 0.00 0.00 34.50 32.37 1brm s PRO 328 CO -0.11 -1.04 -0.22 0.08 0.04 0.00 0.00 177.00 175.76 1brm s VAL 329 N -1.38 1.82 0.18 -0.36 1.01 0.38 -2.29 120.40 119.77 1brm s VAL 329 Ca 0.70 -0.92 -0.02 0.00 0.00 0.00 0.00 61.98 61.74 1brm s VAL 329 Cb -0.37 -1.56 0.01 0.00 0.00 0.00 0.00 36.38 34.46 1brm s VAL 329 CO 0.43 0.51 0.28 0.61 0.00 0.00 0.00 175.10 176.94 1brm n GLY 330 N 3.21 2.35 3.33 4.51 0.00 0.06 -0.10 105.19 118.54 1brm n GLY 330 Ca -0.18 -1.41 -0.24 0.00 0.00 0.00 0.00 46.02 44.18 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 -0.29 -5.20 -2.75 1.61 5.12 -1.26 -0.25 116.66 113.64 1brm n ARG 331 Ca -0.01 0.75 -0.43 0.00 -1.93 0.00 0.00 57.85 56.24 1brm n ARG 331 Cb 0.30 -5.62 -0.03 0.00 -1.16 0.00 0.00 32.46 25.94 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 -6.85 4.04 -0.10 0.55 1.43 -1.25 -3.97 118.68 112.53 1brm s LEU 332 Ca 0.43 1.06 -0.30 0.00 -1.03 0.00 0.00 54.13 54.29 1brm s LEU 332 Cb -0.20 -3.39 0.12 0.00 0.03 0.00 0.00 46.19 42.75 1brm s LEU 332 CO 0.53 -0.70 0.99 0.00 0.23 0.00 0.00 176.35 177.40 1brm s ARG 333 N 3.24 0.63 0.01 1.70 1.70 -1.20 -4.84 118.95 120.19 1brm s ARG 333 Ca 0.41 -0.11 -0.30 0.00 -0.47 0.00 0.00 55.73 55.26 1brm s ARG 333 Cb -0.14 0.29 -0.03 0.00 -0.57 0.00 0.00 34.95 34.50 1brm s ARG 333 CO 0.11 -0.25 1.03 0.15 -1.08 0.00 0.00 175.30 175.25 1brm s LYS 334 N -2.25 4.53 0.80 3.89 -0.14 -1.26 -2.01 119.74 123.29 1brm s LYS 334 Ca 0.03 1.49 -0.11 0.00 -1.36 0.00 0.00 55.97 56.02 1brm s LYS 334 Cb -0.01 -3.44 0.07 0.00 -1.68 0.00 0.00 37.83 32.77 1brm s LYS 334 CO -0.05 -0.10 1.09 -0.51 -0.76 0.00 0.00 175.35 175.03 1brm s LEU 335 N 1.06 2.61 0.60 3.17 1.43 -0.91 -4.95 118.68 121.69 1brm s LEU 335 Ca 0.53 1.34 0.38 0.00 -1.03 0.00 0.00 54.13 55.35 1brm s LEU 335 Cb -0.23 -3.95 1.83 0.00 0.03 0.00 0.00 46.19 43.87 1brm s LEU 335 CO 0.28 -1.99 2.16 0.78 0.23 0.00 0.00 176.35 177.81 1brm h ASN 336 N -1.10 0.00 0.00 2.29 2.35 -1.96 -2.92 115.58 114.24 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 0.01 0.00 1.15 -1.65 0.00 0.00 177.43 177.53 1brm n MET 337 N -3.13 0.77 0.00 0.81 0.00 -1.26 -4.93 117.12 109.38 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 0.20 -1.30 0.00 0.00 0.00 0.00 0.00 33.22 32.12 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 0.44 4.50 0.00 3.17 0.00 -1.10 -4.88 105.19 107.32 1brm n GLY 338 Ca 0.11 -1.37 0.12 0.00 0.00 0.00 0.00 46.02 44.89 1brm n GLY 338 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1brm n PRO 339 N -1.97 0.59 -0.04 1.61 -0.02 -1.26 -1.86 135.00 132.04 1brm n PRO 339 Ca 0.00 0.03 0.12 0.00 -2.02 0.00 0.00 63.50 61.63 1brm n PRO 339 Cb 0.00 -1.50 0.33 0.00 -0.02 0.00 0.00 33.50 32.31 1brm n PRO 339 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1brm n GLU 340 N -1.13 1.99 -4.32 -0.52 1.02 -1.26 -4.44 120.64 111.98 1brm n GLU 340 Ca 0.16 -1.46 -0.34 0.00 -0.02 0.00 0.00 57.16 55.49 1brm n GLU 340 Cb 0.14 -1.46 -0.13 0.00 -0.02 0.00 0.00 31.44 29.96 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 -1.90 2.97 0.07 -0.32 0.40 -0.78 0.92 117.98 119.34 1brm s PHE 341 Ca 0.34 -0.53 0.09 0.00 -0.60 0.00 0.00 56.93 56.23 1brm s PHE 341 Cb 0.20 -1.99 -0.03 0.00 0.51 0.00 0.00 43.02 41.71 1brm s PHE 341 CO 0.31 -0.22 -0.24 -1.17 0.70 0.00 0.00 175.22 174.61 1brm s LEU 342 N 0.71 2.21 0.08 -0.37 2.96 0.75 -2.13 118.68 122.90 1brm s LEU 342 Ca -0.02 -0.61 0.10 0.00 -0.22 0.00 0.00 54.13 53.38 1brm s LEU 342 Cb -0.15 -1.10 -0.03 0.00 0.50 0.00 0.00 46.19 45.41 1brm s LEU 342 CO 0.02 0.18 -0.26 -0.94 -1.32 0.00 0.00 176.35 174.03 1brm s SER 343 N -1.46 3.18 -0.07 3.68 1.04 -0.85 0.21 113.70 119.43 1brm s SER 343 Ca 0.10 -0.66 -0.25 0.00 0.48 0.00 0.00 55.95 55.62 1brm s SER 343 Cb -0.10 -0.25 0.05 0.00 0.10 0.00 0.00 66.02 65.83 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 -1.44 -0.10 5.32 0.00 -1.00 -3.22 121.76 120.40 1brm s ALA 344 Ca 0.12 1.08 0.02 0.00 0.00 0.00 0.00 51.96 53.18 1brm s ALA 344 Cb -0.10 -0.13 0.02 0.00 0.00 0.00 0.00 23.12 22.91 1brm s ALA 344 CO 0.04 -0.32 -0.14 0.12 0.00 0.00 0.00 175.76 175.46 1brm s PHE 345 N -1.00 1.79 0.22 0.00 5.36 0.65 0.22 117.98 125.23 1brm s PHE 345 Ca -0.10 -0.81 0.11 0.00 -0.96 0.00 0.00 56.93 55.17 1brm s PHE 345 Cb -0.02 -1.32 -0.05 0.00 -0.34 0.00 0.00 43.02 41.30 1brm s PHE 345 CO 0.07 -0.43 -0.20 0.95 -1.46 0.00 0.00 175.22 174.14 1brm s THR 346 N 0.99 2.22 0.02 0.12 -4.23 0.37 -0.76 115.64 114.37 1brm s THR 346 Ca -0.07 -2.15 0.01 0.00 -1.18 0.00 0.00 61.69 58.30 1brm s THR 346 Cb -0.15 -2.11 -0.02 0.00 1.34 0.00 0.00 72.50 71.56 1brm s THR 346 CO -0.01 -0.30 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.03 1brm s VAL 347 N -2.16 0.35 -0.27 2.29 1.01 -0.97 -0.86 120.40 119.79 1brm s VAL 347 Ca 0.23 -0.79 -0.26 0.00 0.00 0.00 0.00 61.98 61.16 1brm s VAL 347 Cb -0.06 -0.41 0.14 0.00 0.00 0.00 0.00 36.38 36.05 1brm s VAL 347 CO 0.11 -0.30 1.15 -0.83 0.00 0.00 0.00 175.10 175.22 1brm s GLY 348 N -1.17 -0.03 0.06 4.51 0.00 -1.02 -2.95 107.32 106.73 1brm s GLY 348 Ca -0.09 2.82 -0.31 0.00 0.00 0.00 0.00 44.72 47.14 1brm s GLY 348 CO -0.00 1.73 1.46 -0.35 0.00 0.00 0.00 173.10 175.93 1brm s ASP 349 N -0.05 6.78 0.25 1.64 -1.08 -1.26 -0.87 116.67 122.08 1brm s ASP 349 Ca 0.04 2.28 0.05 0.00 -0.52 0.00 0.00 52.55 54.40 1brm s ASP 349 Cb -0.04 -2.57 0.31 0.00 -1.46 0.00 0.00 42.92 39.15 1brm s ASP 349 CO -0.08 -0.74 1.60 -0.61 0.52 0.00 0.00 175.17 175.86 1brm h GLN 350 N 7.56 0.23 0.00 4.34 -0.00 -1.38 -3.22 115.11 122.64 1brm h GLN 350 Ca -0.40 -0.14 -0.10 0.00 -0.00 0.00 0.00 58.65 58.00 1brm h GLN 350 Cb 1.19 0.02 -0.01 0.00 0.00 0.00 0.00 27.48 28.68 1brm h GLN 350 CO 0.90 0.72 -0.46 -0.07 0.00 0.00 0.00 178.83 179.91 1brm h LEU 351 N 0.18 0.00 0.00 -2.39 3.38 -1.89 -1.76 115.31 112.82 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 1.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1brm h LEU 351 CO 0.09 0.46 0.00 0.18 0.09 0.00 0.00 178.44 179.26 1brm n LEU 352 N -3.55 0.00 0.28 1.67 4.77 -1.22 -1.96 117.00 116.99 1brm n LEU 352 Ca -0.00 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.11 1brm n LEU 352 Cb 0.57 0.00 0.81 0.00 -2.33 0.00 0.00 43.42 42.47 1brm n LEU 352 CO 0.39 0.00 1.06 -0.50 -1.33 0.00 0.00 177.39 177.01 1brm h TRP 353 N 0.00 0.00 0.00 -1.77 4.06 -1.81 0.17 115.95 116.61 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 0.05 -0.12 0.41 -3.56 0.00 0.00 178.44 175.22 1brm n GLY 354 N -1.15 -1.48 0.02 1.49 0.00 -1.13 -4.62 105.19 98.32 1brm n GLY 354 Ca -0.03 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.56 2.01 -0.03 4.61 0.00 -0.37 -4.20 120.51 120.96 1brm n ALA 355 Ca 0.06 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.35 1brm n ALA 355 Cb 0.36 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.69 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 0.00 0.01 -0.93 0.00 0.00 -0.71 -3.38 119.26 114.25 1brm h ALA 356 Ca 0.00 -0.48 0.18 0.00 0.00 0.00 0.00 54.91 54.61 1brm h ALA 356 Cb 0.00 0.02 -0.17 0.00 0.00 0.00 0.00 17.79 17.64 1brm h ALA 356 CO 0.00 0.06 -0.26 -1.91 0.00 0.00 0.00 179.25 177.13 1brm n GLU 357 N -4.53 -0.12 -0.14 0.00 4.07 -0.09 0.29 120.64 120.11 1brm n GLU 357 Ca -0.10 1.44 0.07 0.00 -0.06 0.00 0.00 57.16 58.51 1brm n GLU 357 Cb 0.50 -2.15 0.39 0.00 -0.06 0.00 0.00 31.44 30.11 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 0.66 0.35 5.31 0.11 -1.76 -2.28 132.00 134.38 1brm h PRO 358 Ca 0.42 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.47 1brm h PRO 358 Cb 0.65 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.61 1brm h PRO 358 CO -0.95 0.43 -0.17 -0.07 -0.21 0.00 0.00 178.00 177.04 1brm h LEU 359 N 0.68 -0.40 -0.95 2.35 3.38 -0.37 -2.09 115.31 117.91 1brm h LEU 359 Ca 0.29 -0.15 0.27 0.00 0.09 0.00 0.00 57.88 58.38 1brm h LEU 359 Cb 0.27 0.10 -0.14 0.00 0.09 0.00 0.00 40.66 40.98 1brm h LEU 359 CO -0.09 -0.02 0.45 -0.09 0.09 0.00 0.00 178.44 178.78 1brm h ARG 360 N -0.83 0.32 0.03 1.13 2.43 -0.99 0.37 114.38 116.84 1brm h ARG 360 Ca -0.05 -0.02 -0.22 0.00 -0.81 0.00 0.00 59.98 58.88 1brm h ARG 360 Cb 0.53 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.99 1brm h ARG 360 CO 0.08 0.21 -1.02 0.00 -1.51 0.00 0.00 179.97 177.73 1brm h ARG 361 N 0.33 0.10 -0.42 0.20 3.08 -1.42 -2.76 114.38 113.49 1brm h ARG 361 Ca 0.65 -0.15 -0.06 0.00 0.07 0.00 0.00 59.98 60.49 1brm h ARG 361 Cb 1.38 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 31.46 1brm h ARG 361 CO -0.60 1.03 0.03 1.98 -1.07 0.00 0.00 179.97 181.34 1brm h MET 362 N 0.04 0.71 -0.80 0.04 4.05 -0.26 -2.32 114.93 116.39 1brm h MET 362 Ca -0.05 -0.21 0.04 0.00 -0.28 0.00 0.00 59.70 59.21 1brm h MET 362 Cb 1.74 -0.07 -0.05 0.00 -0.80 0.00 0.00 31.60 32.42 1brm h MET 362 CO 0.15 0.77 0.50 1.25 0.23 0.00 0.00 176.91 179.81 1brm h LEU 363 N 0.56 0.82 -0.98 3.39 5.85 -1.16 -1.78 115.31 122.01 1brm h LEU 363 Ca 0.12 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.88 1brm h LEU 363 Cb 0.43 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.23 1brm h LEU 363 CO 0.01 0.55 0.64 -0.09 -0.34 0.00 0.00 178.44 179.22 1brm h ARG 364 N 0.96 1.21 -0.61 1.25 2.43 -1.17 -0.23 114.38 118.23 1brm h ARG 364 Ca 0.33 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.42 1brm h ARG 364 Cb 0.06 -0.27 -0.03 0.00 -0.42 0.00 0.00 29.97 29.31 1brm h ARG 364 CO -0.13 0.80 0.35 1.96 -1.51 0.00 0.00 179.97 181.44 1brm h GLN 365 N 1.25 0.85 0.00 0.20 4.20 -0.80 -2.96 115.11 117.85 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 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.59 1brm h GLN 365 CO -0.12 0.63 -0.12 -0.07 -0.67 0.00 0.00 178.83 178.48 1brm h LEU 366 N 0.83 0.00 0.00 1.46 3.38 -1.02 -3.52 115.31 116.44 1brm h LEU 366 Ca 0.22 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1brm h LEU 366 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1brm h LEU 366 CO -0.04 0.01 0.00 0.00 0.09 0.00 0.00 178.44 178.50