#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mp5 s LYS 2 N 0.00 4.30 -0.07 3.17 1.02 -1.26 -4.56 119.74 122.34 1mp5 s LYS 2 Ca 0.00 0.42 -0.30 0.00 0.02 0.00 0.00 55.97 56.11 1mp5 s LYS 2 Cb 0.00 -3.47 -0.08 0.00 -0.52 0.00 0.00 37.83 33.76 1mp5 s LYS 2 CO 0.00 0.08 2.06 2.41 -0.92 0.00 0.00 175.35 178.98 1mp5 n THR 3 N 3.90 0.60 -0.10 2.17 -1.04 0.10 -4.79 114.28 115.12 1mp5 n THR 3 Ca -0.07 -0.25 0.00 0.00 -2.04 0.00 0.00 64.05 61.69 1mp5 n THR 3 Cb 0.51 -2.36 0.00 0.00 -1.82 0.00 0.00 70.33 66.66 1mp5 n THR 3 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1mp5 n ARG 4 N 7.92 0.96 -5.14 -2.82 5.12 -1.26 -4.53 116.66 116.90 1mp5 n ARG 4 Ca 0.24 -0.94 -0.32 0.00 -1.93 0.00 0.00 57.85 54.91 1mp5 n ARG 4 Cb 0.41 -0.95 -0.15 0.00 -1.16 0.00 0.00 32.46 30.61 1mp5 n ARG 4 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1mp5 s LYS 5 N -0.46 2.49 0.07 5.56 1.02 -1.25 -3.04 119.74 124.12 1mp5 s LYS 5 Ca 0.00 -0.84 0.03 0.00 0.02 0.00 0.00 55.97 55.18 1mp5 s LYS 5 Cb 0.00 -2.22 -0.03 0.00 -0.52 0.00 0.00 37.83 35.06 1mp5 s LYS 5 CO 0.00 0.48 -0.10 0.20 -0.92 0.00 0.00 175.35 175.01 1mp5 s GLY 6 N -0.39 0.72 -0.11 -3.33 0.00 0.36 -0.64 107.32 103.94 1mp5 s GLY 6 Ca 0.03 -1.02 0.01 0.00 0.00 0.00 0.00 44.72 43.74 1mp5 s GLY 6 CO 0.02 -1.08 -0.10 -0.42 0.00 0.00 0.00 173.10 171.51 1mp5 s ILE 7 N -1.98 1.17 -0.38 0.90 1.01 0.01 -0.21 121.20 121.73 1mp5 s ILE 7 Ca -0.01 -0.41 -0.12 0.00 0.00 0.00 0.00 60.65 60.11 1mp5 s ILE 7 Cb -0.06 -1.13 0.03 0.00 0.01 0.00 0.00 42.46 41.31 1mp5 s ILE 7 CO 0.00 0.38 0.23 -0.63 0.00 0.00 0.00 174.94 174.92 1mp5 s ILE 8 N 1.36 4.71 -0.84 2.92 1.01 -0.09 -1.34 121.20 128.93 1mp5 s ILE 8 Ca -0.01 -0.83 -0.21 0.00 0.00 0.00 0.00 60.65 59.60 1mp5 s ILE 8 Cb -0.14 -3.63 0.09 0.00 0.01 0.00 0.00 42.46 38.80 1mp5 s ILE 8 CO -0.05 -0.26 1.12 -0.22 0.00 0.00 0.00 174.94 175.54 1mp5 s LEU 9 N 1.58 4.50 -0.57 2.97 2.96 -0.56 -1.38 118.68 128.18 1mp5 s LEU 9 Ca 0.03 -1.51 0.02 0.00 -0.22 0.00 0.00 54.13 52.44 1mp5 s LEU 9 Cb -0.19 -2.44 0.43 0.00 0.50 0.00 0.00 46.19 44.49 1mp5 s LEU 9 CO 0.07 -1.30 1.67 0.00 -1.32 0.00 0.00 176.35 175.47 1mp5 n ALA 10 N 7.43 5.83 -1.61 5.97 0.00 0.57 -1.48 120.51 137.23 1mp5 n ALA 10 Ca 0.15 -3.83 0.00 0.00 0.00 0.00 0.00 53.44 49.76 1mp5 n ALA 10 Cb 0.48 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.69 1mp5 n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mp5 n GLY 11 N -0.72 0.73 0.00 0.00 0.00 -1.11 -4.36 105.19 99.73 1mp5 n GLY 11 Ca 0.52 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.68 1mp5 n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mp5 n GLY 12 N 5.00 1.95 0.10 -0.02 0.00 -1.26 -4.83 105.19 106.13 1mp5 n GLY 12 Ca 0.00 -1.73 0.11 0.00 0.00 0.00 0.00 46.02 44.41 1mp5 n GLY 12 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1mp5 n SER 13 N -0.07 0.72 -1.27 1.61 3.41 -1.26 -4.78 113.62 111.98 1mp5 n SER 13 Ca 0.00 0.26 -0.12 0.00 -0.26 0.00 0.00 58.87 58.75 1mp5 n SER 13 Cb 0.00 0.66 -0.02 0.00 -0.26 0.00 0.00 64.21 64.59 1mp5 n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1mp5 n GLY 14 N 1.20 0.30 0.30 5.00 0.00 -1.26 -4.83 105.19 105.90 1mp5 n GLY 14 Ca -0.00 -0.39 0.11 0.00 0.00 0.00 0.00 46.02 45.73 1mp5 n GLY 14 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1mp5 h THR 15 N 0.00 0.41 -0.31 2.61 1.35 -1.93 0.20 112.91 115.25 1mp5 h THR 15 Ca -0.28 -0.09 0.09 0.00 -0.55 0.00 0.00 66.41 65.58 1mp5 h THR 15 Cb 1.09 0.12 -0.01 0.00 -1.73 0.00 0.00 68.15 67.62 1mp5 h THR 15 CO 0.35 0.05 0.30 0.03 -0.25 0.00 0.00 175.52 176.00 1mp5 h ARG 16 N 0.27 0.00 -0.69 4.72 3.08 -1.94 -1.60 114.38 118.22 1mp5 h ARG 16 Ca 0.51 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.56 1mp5 h ARG 16 Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.02 1mp5 h ARG 16 CO -0.59 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 179.59 1mp5 n LEU 17 N -3.91 4.26 -4.73 3.04 4.77 0.06 -4.93 117.00 115.56 1mp5 n LEU 17 Ca 0.05 -2.19 -0.38 0.00 -0.03 0.00 0.00 56.01 53.46 1mp5 n LEU 17 Cb 0.46 -0.52 0.06 0.00 -2.33 0.00 0.00 43.42 41.08 1mp5 n LEU 17 CO 0.29 0.91 0.94 -1.22 -1.33 0.00 0.00 177.39 176.98 1mp5 n TYR 18 N 1.39 2.11 0.49 -1.77 4.01 -0.60 -1.03 117.16 121.75 1mp5 n TYR 18 Ca 0.25 0.43 0.05 0.00 -0.16 0.00 0.00 57.90 58.46 1mp5 n TYR 18 Cb 0.73 -2.32 0.17 0.00 -0.31 0.00 0.00 39.34 37.62 1mp5 n TYR 18 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1mp5 n PRO 19 N -1.44 2.33 -0.02 -0.72 -0.04 -1.26 -4.89 135.00 128.96 1mp5 n PRO 19 Ca 0.13 -1.39 -0.12 0.00 -0.04 0.00 0.00 63.50 62.09 1mp5 n PRO 19 Cb 0.46 -1.57 -0.07 0.00 -0.04 0.00 0.00 33.50 32.29 1mp5 n PRO 19 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1mp5 h VAL 20 N 1.99 1.21 -0.02 0.52 2.07 -1.47 -2.71 116.25 117.84 1mp5 h VAL 20 Ca 0.00 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 66.85 1mp5 h VAL 20 Cb 0.83 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.08 1mp5 h VAL 20 CO 0.12 0.19 0.00 0.35 0.02 0.00 0.00 177.57 178.25 1mp5 n THR 21 N -4.86 0.03 0.05 2.57 -2.24 -1.15 -3.01 114.28 105.67 1mp5 n THR 21 Ca -0.06 -0.03 -0.03 0.00 -2.27 0.00 0.00 64.05 61.66 1mp5 n THR 21 Cb 0.17 -0.03 -0.08 0.00 -2.10 0.00 0.00 70.33 68.28 1mp5 n THR 21 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 1mp5 h MET 22 N 0.13 0.00 0.04 -0.78 -1.53 -1.78 -3.38 114.93 107.63 1mp5 h MET 22 Ca 0.00 0.00 -0.34 0.00 -3.44 0.00 0.00 59.70 55.92 1mp5 h MET 22 Cb 0.03 0.00 -0.04 0.00 -0.55 0.00 0.00 31.60 31.04 1mp5 h MET 22 CO 0.00 0.55 -1.88 0.00 0.14 0.00 0.00 176.91 175.73 1mp5 n ALA 23 N -2.38 0.97 -2.47 0.39 0.00 -1.17 -4.98 120.51 110.87 1mp5 n ALA 23 Ca -0.06 -0.70 -0.18 0.00 0.00 0.00 0.00 53.44 52.49 1mp5 n ALA 23 Cb 0.89 -0.43 -0.11 0.00 0.00 0.00 0.00 19.45 19.80 1mp5 n ALA 23 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1mp5 s VAL 24 N -2.47 1.42 0.47 0.00 1.01 -1.19 -5.14 120.40 114.50 1mp5 s VAL 24 Ca -0.29 -1.79 -0.21 0.00 0.00 0.00 0.00 61.98 59.69 1mp5 s VAL 24 Cb 0.08 -1.62 -0.09 0.00 0.00 0.00 0.00 36.38 34.75 1mp5 s VAL 24 CO 0.63 -0.42 1.02 -0.94 0.00 0.00 0.00 175.10 175.39 1mp5 s SER 25 N -2.56 6.49 0.14 3.32 1.04 -1.26 -3.94 113.70 116.93 1mp5 s SER 25 Ca 0.11 1.88 -0.24 0.00 0.48 0.00 0.00 55.95 58.18 1mp5 s SER 25 Cb -0.04 -2.56 -0.00 0.00 0.10 0.00 0.00 66.02 63.52 1mp5 s SER 25 CO 0.04 -0.67 1.62 -0.61 0.98 0.00 0.00 173.24 174.60 1mp5 h GLN 26 N 1.68 -0.31 0.00 4.02 4.15 -1.91 0.32 115.11 123.06 1mp5 h GLN 26 Ca -0.49 0.02 0.00 0.00 0.77 0.00 0.00 58.65 58.95 1mp5 h GLN 26 Cb 1.21 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.97 1mp5 h GLN 26 CO 0.60 -0.21 0.00 1.04 -1.93 0.00 0.00 178.83 178.33 1mp5 n GLN 27 N -5.39 0.01 0.00 1.69 3.00 -1.26 -0.46 117.38 114.98 1mp5 n GLN 27 Ca -0.02 0.37 0.08 0.00 -0.01 0.00 0.00 57.00 57.42 1mp5 n GLN 27 Cb 0.30 -1.50 -0.06 0.00 0.00 0.00 0.00 30.24 28.99 1mp5 n GLN 27 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1mp5 n LEU 28 N -1.39 1.16 -4.75 1.08 4.77 0.06 0.91 117.00 118.83 1mp5 n LEU 28 Ca 0.01 -0.61 -0.42 0.00 -0.03 0.00 0.00 56.01 54.96 1mp5 n LEU 28 Cb 0.02 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.10 1mp5 n LEU 28 CO 0.01 0.25 1.18 0.18 -1.33 0.00 0.00 177.39 177.68 1mp5 n LEU 29 N -0.86 4.47 -4.71 2.23 4.77 0.40 -4.30 117.00 119.00 1mp5 n LEU 29 Ca 0.05 1.18 -0.42 0.00 -0.03 0.00 0.00 56.01 56.79 1mp5 n LEU 29 Cb 0.30 -1.60 -0.03 0.00 -2.33 0.00 0.00 43.42 39.76 1mp5 n LEU 29 CO 0.28 0.12 0.96 -2.16 -1.33 0.00 0.00 177.39 175.26 1mp5 s PRO 30 N -1.19 4.38 -0.99 3.23 0.04 -1.26 -0.53 135.00 138.68 1mp5 s PRO 30 Ca 0.59 1.88 -0.09 0.00 0.04 0.00 0.00 61.00 63.42 1mp5 s PRO 30 Cb -0.49 -3.33 0.25 0.00 0.04 0.00 0.00 34.50 30.97 1mp5 s PRO 30 CO 0.55 -0.34 0.95 0.42 0.04 0.00 0.00 177.00 178.62 1mp5 s ILE 31 N 1.17 5.62 0.00 0.56 -1.09 0.62 -4.85 121.20 123.24 1mp5 s ILE 31 Ca 0.61 -3.20 0.00 0.00 -2.23 0.00 0.00 60.65 55.83 1mp5 s ILE 31 Cb -0.32 -4.42 0.00 0.00 -1.58 0.00 0.00 42.46 36.14 1mp5 s ILE 31 CO 0.29 -1.12 0.00 0.00 -1.23 0.00 0.00 174.94 172.88 1mp5 n TYR 32 N 3.04 0.00 0.68 3.97 9.36 -1.26 -3.53 117.16 129.42 1mp5 n TYR 32 Ca 0.20 0.00 0.07 0.00 3.32 0.00 0.00 57.90 61.49 1mp5 n TYR 32 Cb 0.41 0.00 -0.02 0.00 -0.63 0.00 0.00 39.34 39.10 1mp5 n TYR 32 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 1mp5 n ASP 33 N 4.33 1.32 -3.94 2.98 5.75 -1.26 -5.02 116.55 120.72 1mp5 n ASP 33 Ca 0.00 -1.16 -0.08 0.00 -0.01 0.00 0.00 54.79 53.54 1mp5 n ASP 33 Cb 0.00 0.62 -0.08 0.00 -1.03 0.00 0.00 41.12 40.63 1mp5 n ASP 33 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1mp5 s LYS 34 N -1.98 0.77 0.39 0.11 -2.85 -1.23 -5.02 119.74 109.93 1mp5 s LYS 34 Ca 0.11 -1.05 -0.25 0.00 -1.00 0.00 0.00 55.97 53.77 1mp5 s LYS 34 Cb 0.12 0.30 -0.09 0.00 -2.06 0.00 0.00 37.83 36.10 1mp5 s LYS 34 CO 0.44 -0.22 1.16 -1.25 0.10 0.00 0.00 175.35 175.58 1mp5 s PRO 35 N -3.88 4.10 0.20 1.78 0.04 -1.26 -0.28 135.00 135.70 1mp5 s PRO 35 Ca 0.06 1.81 -0.23 0.00 0.04 0.00 0.00 61.00 62.68 1mp5 s PRO 35 Cb 0.06 -2.70 0.11 0.00 0.04 0.00 0.00 34.50 32.01 1mp5 s PRO 35 CO -0.11 -0.27 1.55 1.98 0.04 0.00 0.00 177.00 180.20 1mp5 h MET 36 N 2.70 -0.05 -1.59 4.56 4.05 -0.74 0.18 114.93 124.04 1mp5 h MET 36 Ca -0.49 0.00 0.48 0.00 -0.28 0.00 0.00 59.70 59.41 1mp5 h MET 36 Cb 1.23 0.01 -0.09 0.00 -0.80 0.00 0.00 31.60 31.95 1mp5 h MET 36 CO 0.63 -0.03 1.12 0.97 0.23 0.00 0.00 176.91 179.82 1mp5 h ILE 37 N -0.05 0.14 -0.07 1.77 -0.00 0.44 0.10 117.51 119.84 1mp5 h ILE 37 Ca 0.26 -0.01 0.02 0.00 -0.00 0.00 0.00 64.86 65.13 1mp5 h ILE 37 Cb 0.54 0.10 -0.00 0.00 -0.00 0.00 0.00 36.82 37.45 1mp5 h ILE 37 CO -0.91 0.01 0.06 1.88 -0.00 0.00 0.00 178.15 179.18 1mp5 h TYR 38 N 0.04 0.00 0.41 2.19 -1.99 -0.90 -2.48 116.97 114.24 1mp5 h TYR 38 Ca 0.82 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 61.53 1mp5 h TYR 38 Cb 3.05 0.00 0.00 0.00 2.00 0.00 0.00 36.73 41.78 1mp5 h TYR 38 CO -0.00 0.00 -0.20 1.88 -0.00 0.00 0.00 178.16 179.84 1mp5 h TYR 39 N 0.00 -0.52 -0.83 4.88 -1.99 -0.95 -1.36 116.97 116.21 1mp5 h TYR 39 Ca 0.04 -0.01 0.04 0.00 2.00 0.00 0.00 58.73 60.80 1mp5 h TYR 39 Cb 0.15 0.17 -0.05 0.00 2.00 0.00 0.00 36.73 38.99 1mp5 h TYR 39 CO 0.00 -0.25 0.52 -1.00 -0.00 0.00 0.00 178.16 177.44 1mp5 h PRO 40 N -1.08 0.96 -0.99 4.88 0.13 -1.60 0.20 132.00 134.50 1mp5 h PRO 40 Ca -0.06 -0.06 0.11 0.00 -0.87 0.00 0.00 66.00 65.13 1mp5 h PRO 40 Cb 0.50 -0.22 -0.08 0.00 0.13 0.00 0.00 31.00 31.33 1mp5 h PRO 40 CO 0.09 0.64 0.63 1.25 -0.23 0.00 0.00 178.00 180.38 1mp5 h LEU 41 N 0.99 0.93 -1.05 1.56 5.85 -1.51 0.27 115.31 122.35 1mp5 h LEU 41 Ca 0.34 0.04 -0.06 0.00 0.84 0.00 0.00 57.88 59.05 1mp5 h LEU 41 Cb 0.08 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 1mp5 h LEU 41 CO -0.14 0.51 0.03 0.28 -0.34 0.00 0.00 178.44 178.78 1mp5 h SER 42 N 1.01 0.66 -0.39 1.25 0.02 0.18 -0.79 113.55 115.48 1mp5 h SER 42 Ca 0.48 -0.14 -0.08 0.00 -0.84 0.00 0.00 61.79 61.22 1mp5 h SER 42 Cb 0.44 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 1mp5 h SER 42 CO -0.24 0.72 -0.05 0.74 -1.14 0.00 0.00 176.83 176.86 1mp5 h THR 43 N 0.67 1.27 -0.53 -2.27 2.02 0.78 0.75 112.91 115.59 1mp5 h THR 43 Ca 0.14 -1.10 -0.01 0.00 0.77 0.00 0.00 66.41 66.22 1mp5 h THR 43 Cb 0.37 1.18 -0.03 0.00 -1.74 0.00 0.00 68.15 67.94 1mp5 h THR 43 CO 0.01 0.37 0.30 -0.07 0.37 0.00 0.00 175.52 176.50 1mp5 h LEU 44 N 0.55 0.65 -0.18 2.58 3.38 -0.72 -2.30 115.31 119.28 1mp5 h LEU 44 Ca 0.11 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1mp5 h LEU 44 Cb 0.55 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1mp5 h LEU 44 CO 0.03 0.54 0.10 0.24 0.09 0.00 0.00 178.44 179.44 1mp5 h MET 45 N 0.71 0.24 -0.11 1.13 2.86 -0.78 -1.10 114.93 117.88 1mp5 h MET 45 Ca 0.19 -0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.84 1mp5 h MET 45 Cb 0.02 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.62 1mp5 h MET 45 CO -0.03 0.21 0.17 -0.07 1.06 0.00 0.00 176.91 178.25 1mp5 h LEU 46 N 0.20 0.00 -0.11 1.22 3.38 -0.68 0.58 115.31 119.89 1mp5 h LEU 46 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1mp5 h LEU 46 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1mp5 h LEU 46 CO -0.01 0.00 -0.05 0.00 0.09 0.00 0.00 178.44 178.47 1mp5 n ALA 47 N -2.23 2.63 0.00 1.53 0.00 -0.47 -4.72 120.51 117.25 1mp5 n ALA 47 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1mp5 n ALA 47 Cb 0.27 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.30 1mp5 n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mp5 n GLY 48 N 1.25 1.73 3.66 0.00 0.00 0.20 -4.99 105.19 107.05 1mp5 n GLY 48 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1mp5 n GLY 48 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mp5 s ILE 49 N -2.33 3.35 -0.08 -0.61 1.01 -0.86 -4.86 121.20 116.81 1mp5 s ILE 49 Ca 0.00 0.49 0.05 0.00 0.00 0.00 0.00 60.65 61.19 1mp5 s ILE 49 Cb 0.00 -3.32 -0.07 0.00 0.01 0.00 0.00 42.46 39.08 1mp5 s ILE 49 CO 0.00 -0.04 0.15 0.54 0.00 0.00 0.00 174.94 175.59 1mp5 n ARG 50 N 7.02 1.89 -3.39 2.79 1.74 -1.25 -3.98 116.66 121.49 1mp5 n ARG 50 Ca 0.18 -0.03 -0.43 0.00 -0.77 0.00 0.00 57.85 56.79 1mp5 n ARG 50 Cb 0.42 -0.99 -0.09 0.00 -1.02 0.00 0.00 32.46 30.78 1mp5 n ARG 50 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1mp5 s ASP 51 N -2.22 6.15 0.05 0.55 2.15 -1.17 -0.94 116.67 121.25 1mp5 s ASP 51 Ca -0.01 -0.92 0.08 0.00 0.43 0.00 0.00 52.55 52.13 1mp5 s ASP 51 Cb 0.03 -2.19 -0.03 0.00 -0.30 0.00 0.00 42.92 40.44 1mp5 s ASP 51 CO 0.21 -0.55 -0.21 -0.63 -0.17 0.00 0.00 175.17 173.82 1mp5 s ILE 52 N 1.86 1.70 -0.24 4.11 1.01 -0.33 -0.49 121.20 128.82 1mp5 s ILE 52 Ca 0.07 -1.27 -0.01 0.00 0.00 0.00 0.00 60.65 59.45 1mp5 s ILE 52 Cb -0.19 -1.49 0.03 0.00 0.01 0.00 0.00 42.46 40.82 1mp5 s ILE 52 CO 0.10 0.16 -0.09 -0.22 0.00 0.00 0.00 174.94 174.89 1mp5 s LEU 53 N -1.32 3.02 -0.25 2.97 2.96 0.71 -1.09 118.68 125.68 1mp5 s LEU 53 Ca 0.07 -0.89 -0.18 0.00 -0.22 0.00 0.00 54.13 52.92 1mp5 s LEU 53 Cb -0.09 -1.62 -0.03 0.00 0.50 0.00 0.00 46.19 44.95 1mp5 s LEU 53 CO 0.02 -0.11 0.50 -0.63 -1.32 0.00 0.00 176.35 174.81 1mp5 s ILE 54 N 1.29 5.09 -0.27 6.68 -1.09 0.46 -0.92 121.20 132.45 1mp5 s ILE 54 Ca 0.00 0.85 -0.06 0.00 -2.23 0.00 0.00 60.65 59.21 1mp5 s ILE 54 Cb -0.16 -3.81 -0.00 0.00 -1.58 0.00 0.00 42.46 36.90 1mp5 s ILE 54 CO -0.06 0.10 0.05 -0.63 -1.23 0.00 0.00 174.94 173.17 1mp5 s ILE 55 N 2.20 3.85 0.39 2.92 1.01 -0.48 -1.53 121.20 129.56 1mp5 s ILE 55 Ca 0.21 -0.57 0.05 0.00 0.00 0.00 0.00 60.65 60.34 1mp5 s ILE 55 Cb -0.16 -2.90 -0.02 0.00 0.01 0.00 0.00 42.46 39.39 1mp5 s ILE 55 CO 0.09 0.21 0.18 -0.55 0.00 0.00 0.00 174.94 174.87 1mp5 s SER 56 N 1.51 2.49 0.69 3.58 0.15 -1.12 -0.31 113.70 120.68 1mp5 s SER 56 Ca 0.04 -1.73 -0.13 0.00 0.70 0.00 0.00 55.95 54.83 1mp5 s SER 56 Cb -0.16 0.57 0.01 0.00 -1.71 0.00 0.00 66.02 64.73 1mp5 s SER 56 CO 0.01 -1.00 1.09 0.42 1.20 0.00 0.00 173.24 174.96 1mp5 s THR 57 N -3.27 3.49 0.33 6.45 -4.23 -1.26 -0.63 115.64 116.52 1mp5 s THR 57 Ca 0.28 0.59 0.08 0.00 -1.18 0.00 0.00 61.69 61.46 1mp5 s THR 57 Cb 0.02 -3.14 0.32 0.00 1.34 0.00 0.00 72.50 71.04 1mp5 s THR 57 CO 0.19 -0.53 1.80 -0.65 -0.54 0.00 0.00 174.62 174.89 1mp5 h PRO 58 N -0.38 0.70 -0.17 3.99 0.11 -1.89 0.24 132.00 134.60 1mp5 h PRO 58 Ca -0.45 -0.04 -0.15 0.00 0.11 0.00 0.00 66.00 65.46 1mp5 h PRO 58 Cb 1.23 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1mp5 h PRO 58 CO 0.54 0.46 -0.50 1.96 -0.21 0.00 0.00 178.00 180.26 1mp5 h GLN 59 N 0.72 0.64 0.04 1.05 4.20 -1.93 -3.38 115.11 116.45 1mp5 h GLN 59 Ca 0.55 -0.46 -0.30 0.00 0.06 0.00 0.00 58.65 58.50 1mp5 h GLN 59 Cb 0.90 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.72 1mp5 h GLN 59 CO -0.32 1.08 -1.68 -0.44 -0.67 0.00 0.00 178.83 176.80 1mp5 h ASP 60 N 0.32 0.13 -0.94 1.46 3.32 -1.75 -3.40 116.42 115.55 1mp5 h ASP 60 Ca -0.01 -0.25 0.13 0.00 0.02 0.00 0.00 57.03 56.93 1mp5 h ASP 60 Cb 1.11 -0.04 -0.14 0.00 0.22 0.00 0.00 39.33 40.48 1mp5 h ASP 60 CO 0.11 1.22 -0.40 0.41 -1.72 0.00 0.00 179.24 178.85 1mp5 n THR 61 N -3.20 -0.53 -0.14 0.35 -1.04 0.77 0.92 114.28 111.41 1mp5 n THR 61 Ca -0.18 2.23 0.08 0.00 -2.04 0.00 0.00 64.05 64.13 1mp5 n THR 61 Cb 1.04 -2.90 0.40 0.00 -1.82 0.00 0.00 70.33 67.05 1mp5 n THR 61 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1mp5 h PRO 62 N 0.00 0.62 -0.43 -2.82 0.13 -1.79 -0.36 132.00 127.35 1mp5 h PRO 62 Ca 0.29 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 65.38 1mp5 h PRO 62 Cb 0.53 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 31.50 1mp5 h PRO 62 CO -0.93 0.41 0.26 0.00 -0.23 0.00 0.00 178.00 177.51 1mp5 h ARG 63 N 0.64 0.58 -0.28 0.86 2.47 0.32 -1.76 114.38 117.21 1mp5 h ARG 63 Ca 0.29 -0.04 -0.17 0.00 -1.26 0.00 0.00 59.98 58.80 1mp5 h ARG 63 Cb 0.32 -0.12 -0.00 0.00 -1.65 0.00 0.00 29.97 28.51 1mp5 h ARG 63 CO -0.09 0.41 -0.48 0.74 0.56 0.00 0.00 179.97 181.10 1mp5 h PHE 64 N 0.59 0.95 -0.20 3.04 0.05 -0.50 -2.57 116.94 118.29 1mp5 h PHE 64 Ca 0.16 -0.31 -0.00 0.00 3.82 0.00 0.00 57.97 61.63 1mp5 h PHE 64 Cb -0.02 -0.19 -0.01 0.00 2.00 0.00 0.00 35.95 37.73 1mp5 h PHE 64 CO 0.00 1.10 0.12 1.96 -0.18 0.00 0.00 178.31 181.31 1mp5 h GLN 65 N 0.61 0.27 -0.55 1.51 4.20 -0.91 0.45 115.11 120.69 1mp5 h GLN 65 Ca 0.03 -0.03 0.06 0.00 0.06 0.00 0.00 58.65 58.77 1mp5 h GLN 65 Cb 1.06 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.75 1mp5 h GLN 65 CO 0.10 0.24 0.37 0.37 -0.67 0.00 0.00 178.83 179.24 1mp5 h GLN 66 N 0.23 0.49 -0.03 1.46 4.15 -1.32 1.18 115.11 121.27 1mp5 h GLN 66 Ca 0.07 -0.03 -0.08 0.00 0.77 0.00 0.00 58.65 59.38 1mp5 h GLN 66 Cb 0.04 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.62 1mp5 h GLN 66 CO -0.01 0.32 -0.28 1.25 -1.93 0.00 0.00 178.83 178.18 1mp5 h LEU 67 N 0.50 0.30 0.00 -2.39 5.85 -0.89 -3.41 115.31 115.28 1mp5 h LEU 67 Ca 0.24 -0.70 -0.18 0.00 0.84 0.00 0.00 57.88 58.08 1mp5 h LEU 67 Cb 0.31 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1mp5 h LEU 67 CO -0.07 0.96 -1.78 0.18 -0.34 0.00 0.00 178.44 177.39 1mp5 n LEU 68 N -4.48 0.00 0.00 2.25 4.77 0.15 -5.10 117.00 114.59 1mp5 n LEU 68 Ca -0.09 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 1mp5 n LEU 68 Cb 0.50 0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.83 1mp5 n LEU 68 CO 0.40 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 1mp5 n GLY 69 N 2.17 0.40 0.00 -0.72 0.00 0.41 -2.38 105.19 105.06 1mp5 n GLY 69 Ca -0.16 -0.85 0.14 0.00 0.00 0.00 0.00 46.02 45.15 1mp5 n GLY 69 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1mp5 n ASP 70 N -1.74 0.00 0.00 1.61 5.68 -1.26 -4.76 116.55 116.07 1mp5 n ASP 70 Ca 0.00 -1.07 0.00 0.00 -0.50 0.00 0.00 54.79 53.22 1mp5 n ASP 70 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1mp5 n ASP 70 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1mp5 n GLY 71 N 0.91 1.37 0.48 6.12 0.00 -1.00 -0.27 105.19 112.81 1mp5 n GLY 71 Ca 0.21 0.00 0.29 0.00 0.00 0.00 0.00 46.02 46.53 1mp5 n GLY 71 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1mp5 h SER 72 N 0.00 0.00 0.21 1.61 4.64 -1.69 0.41 113.55 118.72 1mp5 h SER 72 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1mp5 h SER 72 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1mp5 h SER 72 CO 0.00 0.00 -0.15 0.06 -0.87 0.00 0.00 176.83 175.87 1mp5 h GLN 73 N 0.00 0.00 -0.45 4.77 -0.00 -1.87 -2.40 115.11 115.16 1mp5 h GLN 73 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.08 1mp5 h GLN 73 Cb 1.94 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 29.42 1mp5 h GLN 73 CO -0.00 0.15 0.00 0.91 -0.00 0.00 0.00 178.83 179.89 1mp5 n TRP 74 N -4.14 1.23 -2.05 0.06 8.01 0.14 -4.92 117.44 115.77 1mp5 n TRP 74 Ca -0.02 -0.71 -0.08 0.00 -1.31 0.00 0.00 57.50 55.37 1mp5 n TRP 74 Cb 0.23 -0.28 -0.01 0.00 -2.01 0.00 0.00 31.31 29.24 1mp5 n TRP 74 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1mp5 n GLY 75 N 0.35 0.15 3.34 6.99 0.00 -0.90 -4.54 105.19 110.58 1mp5 n GLY 75 Ca 0.22 -0.55 -0.26 0.00 0.00 0.00 0.00 46.02 45.44 1mp5 n GLY 75 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mp5 s LEU 76 N -2.37 2.32 -0.57 0.99 1.43 -0.97 -4.93 118.68 114.58 1mp5 s LEU 76 Ca 0.00 -0.73 -0.08 0.00 -1.03 0.00 0.00 54.13 52.29 1mp5 s LEU 76 Cb 0.00 -1.03 0.15 0.00 0.03 0.00 0.00 46.19 45.34 1mp5 s LEU 76 CO 0.00 0.10 0.43 0.21 0.23 0.00 0.00 176.35 177.33 1mp5 s ASN 77 N -2.06 5.71 -0.23 2.29 3.84 -0.11 -1.97 114.94 122.41 1mp5 s ASN 77 Ca 0.11 -2.33 -0.15 0.00 0.21 0.00 0.00 52.86 50.70 1mp5 s ASN 77 Cb -0.10 -1.99 -0.04 0.00 -0.55 0.00 0.00 41.25 38.58 1mp5 s ASN 77 CO 0.05 -0.57 0.35 -0.76 -2.79 0.00 0.00 177.10 173.38 1mp5 s LEU 78 N 0.73 4.11 0.25 3.21 1.43 0.63 -1.19 118.68 127.85 1mp5 s LEU 78 Ca 0.11 0.36 0.11 0.00 -1.03 0.00 0.00 54.13 53.68 1mp5 s LEU 78 Cb -0.22 -2.41 -0.05 0.00 0.03 0.00 0.00 46.19 43.55 1mp5 s LEU 78 CO -0.03 -0.09 -0.13 -1.10 0.23 0.00 0.00 176.35 175.23 1mp5 s GLN 79 N 1.55 1.91 -0.01 1.70 -0.21 -0.25 -4.56 119.66 119.80 1mp5 s GLN 79 Ca 0.16 -1.55 0.04 0.00 0.02 0.00 0.00 55.36 54.02 1mp5 s GLN 79 Cb -0.15 -1.96 -0.01 0.00 1.00 0.00 0.00 33.01 31.89 1mp5 s GLN 79 CO 0.08 0.37 -0.13 0.71 -2.12 0.00 0.00 175.29 174.19 1mp5 s TYR 80 N -2.23 1.19 0.03 0.91 1.51 -1.26 -0.40 117.35 117.09 1mp5 s TYR 80 Ca 0.29 -0.23 0.03 0.00 -1.01 0.00 0.00 57.07 56.15 1mp5 s TYR 80 Cb -0.06 -0.76 -0.02 0.00 -0.11 0.00 0.00 41.96 41.00 1mp5 s TYR 80 CO 0.16 -0.02 -0.11 0.15 -1.11 0.00 0.00 175.55 174.62 1mp5 s LYS 81 N -0.30 0.73 -0.24 -0.62 -0.14 -0.58 -4.95 119.74 113.64 1mp5 s LYS 81 Ca 0.05 -0.64 -0.09 0.00 -1.36 0.00 0.00 55.97 53.93 1mp5 s LYS 81 Cb -0.05 -0.67 -0.04 0.00 -1.68 0.00 0.00 37.83 35.39 1mp5 s LYS 81 CO -0.00 0.16 0.13 0.08 -0.76 0.00 0.00 175.35 174.96 1mp5 s VAL 82 N -0.83 5.06 -0.42 3.17 1.01 -1.26 -2.79 120.40 124.33 1mp5 s VAL 82 Ca -0.01 0.08 -0.18 0.00 0.00 0.00 0.00 61.98 61.86 1mp5 s VAL 82 Cb -0.07 -3.36 0.02 0.00 0.00 0.00 0.00 36.38 32.97 1mp5 s VAL 82 CO 0.01 0.35 0.49 -1.58 0.00 0.00 0.00 175.10 174.37 1mp5 s GLN 83 N 1.15 3.15 0.45 2.72 0.74 0.20 -4.92 119.66 123.15 1mp5 s GLN 83 Ca 0.06 -0.65 0.11 0.00 0.05 0.00 0.00 55.36 54.94 1mp5 s GLN 83 Cb -0.14 -3.96 1.01 0.00 1.10 0.00 0.00 33.01 31.02 1mp5 s GLN 83 CO 0.05 -0.89 2.06 -1.35 -0.55 0.00 0.00 175.29 174.61 1mp5 h PRO 84 N 8.76 0.36 -2.71 1.67 0.11 -1.96 -3.32 132.00 134.91 1mp5 h PRO 84 Ca -0.26 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.71 1mp5 h PRO 84 Cb 1.11 -0.08 -0.23 0.00 0.11 0.00 0.00 31.00 31.91 1mp5 h PRO 84 CO 0.82 0.24 -0.19 0.45 -0.21 0.00 0.00 178.00 179.11 1mp5 s SER 85 N -6.67 -0.41 -0.65 -2.05 0.15 -1.26 -4.84 113.70 97.97 1mp5 s SER 85 Ca -0.07 0.69 -0.05 0.00 0.70 0.00 0.00 55.95 57.22 1mp5 s SER 85 Cb 0.18 0.74 -0.07 0.00 -1.71 0.00 0.00 66.02 65.15 1mp5 s SER 85 CO 0.72 -0.25 2.10 -0.81 1.20 0.00 0.00 173.24 176.20 1mp5 n PRO 86 N 2.37 1.76 0.00 5.44 -0.04 -1.26 -4.66 135.00 138.61 1mp5 n PRO 86 Ca -0.15 -1.19 0.02 0.00 -0.04 0.00 0.00 63.50 62.13 1mp5 n PRO 86 Cb 0.57 -2.26 0.09 0.00 -0.04 0.00 0.00 33.50 31.86 1mp5 n PRO 86 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1mp5 n ASP 87 N 3.85 0.00 0.00 3.54 8.00 -1.26 -4.89 116.55 125.78 1mp5 n ASP 87 Ca 0.38 0.25 0.00 0.00 0.71 0.00 0.00 54.79 56.13 1mp5 n ASP 87 Cb 0.22 -0.30 0.00 0.00 -0.02 0.00 0.00 41.12 41.02 1mp5 n ASP 87 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mp5 n GLY 88 N -0.99 4.33 0.35 0.44 0.00 -1.26 -0.17 105.19 107.88 1mp5 n GLY 88 Ca 0.02 -1.49 -0.02 0.00 0.00 0.00 0.00 46.02 44.52 1mp5 n GLY 88 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1mp5 h LEU 89 N 0.00 1.02 -2.33 0.99 3.38 -1.89 -2.09 115.31 114.39 1mp5 h LEU 89 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1mp5 h LEU 89 Cb 0.00 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.50 1mp5 h LEU 89 CO 0.00 0.72 0.02 0.00 0.09 0.00 0.00 178.44 179.27 1mp5 h ALA 90 N 1.35 1.68 0.00 1.53 0.00 -1.41 -1.04 119.26 121.36 1mp5 h ALA 90 Ca 0.35 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 1mp5 h ALA 90 Cb -0.08 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1mp5 h ALA 90 CO -0.09 -0.03 -0.02 0.37 0.00 0.00 0.00 179.25 179.48 1mp5 h GLN 91 N 0.00 0.00 0.00 0.00 4.15 -1.58 -2.02 115.11 115.67 1mp5 h GLN 91 Ca 0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.43 1mp5 h GLN 91 Cb 0.04 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.73 1mp5 h GLN 91 CO -0.00 0.02 0.07 0.00 -1.93 0.00 0.00 178.83 177.00 1mp5 h ALA 92 N 1.98 1.07 0.00 3.38 0.00 -1.30 -0.66 119.26 123.72 1mp5 h ALA 92 Ca -0.00 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.71 1mp5 h ALA 92 Cb 0.23 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1mp5 h ALA 92 CO 0.00 -0.07 -1.70 1.19 0.00 0.00 0.00 179.25 178.68 1mp5 n PHE 93 N -2.80 0.69 -0.00 0.00 3.01 -0.76 -3.04 117.46 114.57 1mp5 n PHE 93 Ca -0.02 0.23 -0.18 0.00 1.01 0.00 0.00 57.45 58.49 1mp5 n PHE 93 Cb 0.13 -1.02 -0.08 0.00 -0.01 0.00 0.00 39.48 38.49 1mp5 n PHE 93 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1mp5 h ILE 94 N 0.00 1.29 0.00 4.37 2.04 -1.28 -1.74 117.51 122.19 1mp5 h ILE 94 Ca -0.24 -2.04 -0.08 0.00 1.00 0.00 0.00 64.86 63.51 1mp5 h ILE 94 Cb 1.70 2.14 -0.01 0.00 -0.74 0.00 0.00 36.82 39.90 1mp5 h ILE 94 CO 0.04 0.64 -0.39 0.40 0.00 0.00 0.00 178.15 178.84 1mp5 h ILE 95 N 0.44 0.96 -0.38 -0.67 1.08 -1.44 -3.09 117.51 114.41 1mp5 h ILE 95 Ca -0.07 -1.50 -0.15 0.00 -0.39 0.00 0.00 64.86 62.75 1mp5 h ILE 95 Cb 1.46 1.89 -0.09 0.00 -3.07 0.00 0.00 36.82 37.01 1mp5 h ILE 95 CO 0.17 0.38 0.01 0.61 -0.69 0.00 0.00 178.15 178.62 1mp5 n GLY 96 N 0.10 4.58 0.46 5.37 0.00 -1.17 -4.72 105.19 109.81 1mp5 n GLY 96 Ca -0.01 -1.15 -0.18 0.00 0.00 0.00 0.00 46.02 44.68 1mp5 n GLY 96 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1mp5 h GLU 97 N 1.27 -1.04 -0.44 1.61 4.81 -1.23 0.72 114.58 120.29 1mp5 h GLU 97 Ca 0.19 0.07 0.08 0.00 -0.13 0.00 0.00 59.36 59.57 1mp5 h GLU 97 Cb 1.70 0.24 -0.02 0.00 0.63 0.00 0.00 28.75 31.29 1mp5 h GLU 97 CO 0.40 -0.70 0.30 1.49 -0.73 0.00 0.00 179.01 179.77 1mp5 h GLU 98 N -1.08 0.22 -0.06 1.92 4.81 -1.85 0.52 114.58 119.06 1mp5 h GLU 98 Ca -0.10 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.11 1mp5 h GLU 98 Cb 0.87 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.20 1mp5 h GLU 98 CO 0.10 0.14 -0.02 0.35 -0.73 0.00 0.00 179.01 178.86 1mp5 h PHE 99 N 0.22 0.13 0.02 0.92 3.57 -1.70 -3.30 116.94 116.80 1mp5 h PHE 99 Ca 0.20 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.67 1mp5 h PHE 99 Cb 0.50 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.21 1mp5 h PHE 99 CO -0.00 0.46 -0.01 0.82 -2.23 0.00 0.00 178.31 177.35 1mp5 h ILE 100 N -0.24 1.13 0.00 1.41 2.04 0.15 -3.48 117.51 118.51 1mp5 h ILE 100 Ca 0.01 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1mp5 h ILE 100 Cb 0.42 1.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.93 1mp5 h ILE 100 CO 0.01 0.11 0.00 0.61 0.00 0.00 0.00 178.15 178.88 1mp5 n GLY 101 N -0.58 1.39 0.20 5.37 0.00 0.07 -2.37 105.19 109.27 1mp5 n GLY 101 Ca -0.08 -0.61 0.06 0.00 0.00 0.00 0.00 46.02 45.39 1mp5 n GLY 101 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1mp5 n HIS 102 N 4.44 0.11 -3.18 1.61 8.25 -1.26 -4.89 115.22 120.30 1mp5 n HIS 102 Ca 0.00 -0.06 -0.22 0.00 -0.26 0.00 0.00 57.72 57.18 1mp5 n HIS 102 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1mp5 n HIS 102 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1mp5 s ASP 103 N -1.27 5.93 0.37 0.41 1.01 -1.00 -4.70 116.67 117.43 1mp5 s ASP 103 Ca 0.18 0.17 -0.20 0.00 0.71 0.00 0.00 52.55 53.40 1mp5 s ASP 103 Cb 0.09 -1.51 -0.10 0.00 1.01 0.00 0.00 42.92 42.41 1mp5 s ASP 103 CO 0.14 -0.57 0.89 -1.81 0.21 0.00 0.00 175.17 174.02 1mp5 s ASP 104 N -4.18 6.98 0.01 0.27 1.01 -1.26 -3.90 116.67 115.60 1mp5 s ASP 104 Ca 0.46 1.61 0.02 0.00 0.71 0.00 0.00 52.55 55.34 1mp5 s ASP 104 Cb -0.10 -2.50 -0.01 0.00 1.01 0.00 0.00 42.92 41.32 1mp5 s ASP 104 CO 0.36 -0.25 -0.06 0.00 0.21 0.00 0.00 175.17 175.43 1mp5 s ALA 106 N -0.60 3.86 -0.03 0.00 0.00 0.19 -1.79 121.76 123.39 1mp5 s ALA 106 Ca -0.03 -0.99 0.05 0.00 0.00 0.00 0.00 51.96 50.99 1mp5 s ALA 106 Cb -0.05 -1.90 -0.01 0.00 0.00 0.00 0.00 23.12 21.16 1mp5 s ALA 106 CO -0.00 0.33 -0.17 -1.17 0.00 0.00 0.00 175.76 174.75 1mp5 s LEU 107 N -3.65 1.95 -0.11 0.00 2.96 0.21 -0.81 118.68 119.24 1mp5 s LEU 107 Ca 0.37 -0.33 -0.05 0.00 -0.22 0.00 0.00 54.13 53.89 1mp5 s LEU 107 Cb -0.10 -0.93 0.05 0.00 0.50 0.00 0.00 46.19 45.70 1mp5 s LEU 107 CO 0.30 0.17 0.24 0.54 -1.32 0.00 0.00 176.35 176.29 1mp5 s VAL 108 N -0.11 -0.12 0.52 1.68 0.11 -0.45 0.09 120.40 122.13 1mp5 s VAL 108 Ca -0.00 0.18 -0.20 0.00 -2.93 0.00 0.00 61.98 59.03 1mp5 s VAL 108 Cb -0.10 -0.39 -0.06 0.00 -1.53 0.00 0.00 36.38 34.30 1mp5 s VAL 108 CO 0.01 0.08 1.13 -0.76 -3.33 0.00 0.00 175.10 172.23 1mp5 s LEU 109 N 1.52 3.81 0.00 2.54 1.43 -0.79 -1.50 118.68 125.70 1mp5 s LEU 109 Ca -0.07 2.19 0.11 0.00 -1.03 0.00 0.00 54.13 55.34 1mp5 s LEU 109 Cb -0.11 -4.51 0.49 0.00 0.03 0.00 0.00 46.19 42.09 1mp5 s LEU 109 CO -0.08 -1.14 1.36 0.61 0.23 0.00 0.00 176.35 177.33 1mp5 n GLY 110 N 0.21 -0.89 0.41 -3.19 0.00 -0.55 -2.17 105.19 99.01 1mp5 n GLY 110 Ca 0.11 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.17 1mp5 n GLY 110 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1mp5 n ASP 111 N -1.49 2.94 -4.51 1.61 5.68 -1.26 -3.77 116.55 115.75 1mp5 n ASP 111 Ca 0.03 -2.89 -0.43 0.00 -0.50 0.00 0.00 54.79 50.99 1mp5 n ASP 111 Cb 0.13 -0.42 -0.05 0.00 -1.14 0.00 0.00 41.12 39.64 1mp5 n ASP 111 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 1mp5 s ASN 112 N -2.23 6.34 -0.33 -1.12 3.04 -0.92 -4.69 114.94 115.02 1mp5 s ASN 112 Ca 0.32 -0.40 -0.08 0.00 0.04 0.00 0.00 52.86 52.74 1mp5 s ASN 112 Cb 0.27 -2.39 0.02 0.00 -1.54 0.00 0.00 41.25 37.61 1mp5 s ASN 112 CO 0.06 -1.07 0.13 -0.63 -3.04 0.00 0.00 177.10 172.55 1mp5 s ILE 113 N 3.48 4.17 -0.14 -5.21 1.01 -1.26 -3.57 121.20 119.68 1mp5 s ILE 113 Ca 0.27 -0.83 -0.01 0.00 0.00 0.00 0.00 60.65 60.08 1mp5 s ILE 113 Cb -0.14 -3.26 -0.02 0.00 0.01 0.00 0.00 42.46 39.06 1mp5 s ILE 113 CO 0.19 -0.08 -0.09 -0.36 0.00 0.00 0.00 174.94 174.59 1mp5 s PHE 114 N 1.50 2.89 -0.01 3.97 0.40 -1.26 -2.13 117.98 123.35 1mp5 s PHE 114 Ca 0.01 -0.48 0.01 0.00 -0.60 0.00 0.00 56.93 55.87 1mp5 s PHE 114 Cb -0.18 -1.88 0.00 0.00 0.51 0.00 0.00 43.02 41.47 1mp5 s PHE 114 CO 0.04 -0.12 -0.02 -0.47 0.70 0.00 0.00 175.22 175.35 1mp5 s TYR 115 N 0.30 0.21 0.00 0.36 5.04 -0.40 -4.99 117.35 117.87 1mp5 s TYR 115 Ca -0.07 -0.02 0.00 0.00 -2.44 0.00 0.00 57.07 54.53 1mp5 s TYR 115 Cb -0.15 -0.18 0.00 0.00 0.35 0.00 0.00 41.96 41.98 1mp5 s TYR 115 CO 0.04 -0.03 0.00 0.41 -1.34 0.00 0.00 175.55 174.64 1mp5 n GLY 116 N 3.27 2.67 3.75 8.97 0.00 -1.26 0.37 105.19 122.96 1mp5 n GLY 116 Ca -0.16 -1.02 -0.40 0.00 0.00 0.00 0.00 46.02 44.44 1mp5 n GLY 116 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1mp5 s HIS 117 N -2.00 3.79 -0.75 1.61 2.46 -1.26 -3.98 115.29 115.15 1mp5 s HIS 117 Ca 0.00 1.81 -0.03 0.00 0.47 0.00 0.00 55.06 57.31 1mp5 s HIS 117 Cb 0.00 -3.12 0.00 0.00 -0.13 0.00 0.00 32.58 29.33 1mp5 s HIS 117 CO 0.00 -0.02 0.46 -0.25 -2.47 0.00 0.00 174.74 172.46 1mp5 n ASP 118 N 1.31 -4.09 -0.34 9.88 8.00 -1.26 -4.94 116.55 125.11 1mp5 n ASP 118 Ca -0.01 -0.21 -0.01 0.00 0.71 0.00 0.00 54.79 55.27 1mp5 n ASP 118 Cb 0.46 -2.82 0.12 0.00 -0.02 0.00 0.00 41.12 38.86 1mp5 n ASP 118 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1mp5 h LEU 119 N -1.05 0.98 -0.57 0.64 5.85 -2.00 -1.82 115.31 117.34 1mp5 h LEU 119 Ca -0.28 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.38 1mp5 h LEU 119 Cb 1.19 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.98 1mp5 h LEU 119 CO 0.29 0.67 0.17 -0.65 -0.34 0.00 0.00 178.44 178.58 1mp5 h PRO 120 N 1.14 0.89 -0.28 5.25 0.11 -1.92 -2.62 132.00 134.57 1mp5 h PRO 120 Ca 0.36 -0.20 -0.10 0.00 0.11 0.00 0.00 66.00 66.18 1mp5 h PRO 120 Cb 0.01 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 30.98 1mp5 h PRO 120 CO -0.12 0.81 -0.25 1.57 -0.21 0.00 0.00 178.00 179.80 1mp5 h LYS 121 N 0.80 0.55 -0.43 1.05 2.10 -1.88 0.19 116.57 118.95 1mp5 h LYS 121 Ca 0.18 -0.21 0.01 0.00 -2.00 0.00 0.00 60.65 58.64 1mp5 h LYS 121 Cb 0.30 -0.03 -0.02 0.00 -0.90 0.00 0.00 32.23 31.58 1mp5 h LYS 121 CO -0.00 0.75 0.29 1.25 -2.00 0.00 0.00 179.45 179.73 1mp5 h LEU 122 N 0.48 0.46 0.00 7.07 6.46 -1.07 -2.36 115.31 126.35 1mp5 h LEU 122 Ca 0.07 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.82 1mp5 h LEU 122 Cb 0.68 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.50 1mp5 h LEU 122 CO 0.05 0.33 -0.94 0.23 -0.62 0.00 0.00 178.44 177.50 1mp5 n MET 123 N -4.48 0.13 -0.05 1.25 2.81 -0.87 -4.52 117.12 111.39 1mp5 n MET 123 Ca 0.04 -0.01 -0.08 0.00 -1.81 0.00 0.00 57.70 55.83 1mp5 n MET 123 Cb 0.09 -1.53 -0.02 0.00 -0.71 0.00 0.00 33.22 31.05 1mp5 n MET 123 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 1mp5 h GLU 124 N 0.00 -0.25 -0.84 0.03 4.81 -0.07 0.26 114.58 118.52 1mp5 h GLU 124 Ca 0.00 0.02 0.11 0.00 -0.13 0.00 0.00 59.36 59.36 1mp5 h GLU 124 Cb 0.60 0.06 -0.08 0.00 0.63 0.00 0.00 28.75 29.96 1mp5 h GLU 124 CO 0.00 -0.17 0.47 0.00 -0.73 0.00 0.00 179.01 178.58 1mp5 h ALA 125 N 0.76 1.21 -0.31 2.92 0.00 -1.80 -1.36 119.26 120.69 1mp5 h ALA 125 Ca 0.14 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1mp5 h ALA 125 Cb 0.48 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1mp5 h ALA 125 CO -0.40 0.06 0.17 0.00 0.00 0.00 0.00 179.25 179.07 1mp5 h ALA 126 N 1.48 0.40 -0.97 0.00 0.00 -1.44 0.52 119.26 119.24 1mp5 h ALA 126 Ca 0.42 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.27 1mp5 h ALA 126 Cb 0.44 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 1mp5 h ALA 126 CO -0.28 -0.07 0.64 0.28 0.00 0.00 0.00 179.25 179.83 1mp5 h VAL 127 N 0.38 1.20 0.00 0.00 2.07 0.05 -3.02 116.25 116.93 1mp5 h VAL 127 Ca 0.11 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.20 1mp5 h VAL 127 Cb 0.07 -0.17 0.00 0.00 -1.52 0.00 0.00 31.29 29.67 1mp5 h VAL 127 CO -0.02 0.23 -0.81 0.59 0.02 0.00 0.00 177.57 177.59 1mp5 n ASN 128 N -4.44 0.65 -4.53 0.57 3.02 -0.73 -0.72 115.26 109.07 1mp5 n ASN 128 Ca 0.12 -0.06 -0.55 0.00 -0.03 0.00 0.00 54.58 54.07 1mp5 n ASN 128 Cb 0.06 0.46 -0.08 0.00 -0.61 0.00 0.00 39.78 39.61 1mp5 n ASN 128 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1mp5 n LYS 129 N -2.00 1.00 -0.27 3.52 4.81 0.16 -4.65 118.16 120.73 1mp5 n LYS 129 Ca 0.03 0.32 0.08 0.00 -0.87 0.00 0.00 58.31 57.86 1mp5 n LYS 129 Cb 0.43 -2.20 0.21 0.00 0.02 0.00 0.00 35.03 33.49 1mp5 n LYS 129 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1mp5 h GLU 130 N 9.84 0.19 -3.49 1.64 4.39 -1.89 -3.44 114.58 121.82 1mp5 h GLU 130 Ca -0.33 -0.01 -0.13 0.00 0.34 0.00 0.00 59.36 59.23 1mp5 h GLU 130 Cb 1.33 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.90 1mp5 h GLU 130 CO 1.00 0.13 0.07 -1.54 -1.16 0.00 0.00 179.01 177.52 1mp5 s SER 131 N -5.18 0.40 0.00 1.42 1.04 -1.26 -4.39 113.70 105.73 1mp5 s SER 131 Ca -0.13 -1.29 0.00 0.00 0.48 0.00 0.00 55.95 55.01 1mp5 s SER 131 Cb 0.23 0.77 0.00 0.00 0.10 0.00 0.00 66.02 67.12 1mp5 s SER 131 CO 0.76 -1.52 0.00 0.61 0.98 0.00 0.00 173.24 174.07 1mp5 n GLY 132 N -0.55 0.90 3.50 7.32 0.00 -1.26 -4.96 105.19 110.13 1mp5 n GLY 132 Ca -0.04 -1.49 -0.12 0.00 0.00 0.00 0.00 46.02 44.36 1mp5 n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mp5 s ALA 133 N -1.99 -1.76 -0.03 4.61 0.00 0.31 -2.57 121.76 120.33 1mp5 s ALA 133 Ca 0.00 1.03 0.01 0.00 0.00 0.00 0.00 51.96 53.00 1mp5 s ALA 133 Cb 0.00 0.26 0.02 0.00 0.00 0.00 0.00 23.12 23.40 1mp5 s ALA 133 CO 0.00 -0.57 -0.02 0.99 0.00 0.00 0.00 175.76 176.16 1mp5 s THR 134 N -2.50 0.27 0.42 0.00 2.01 0.25 0.10 115.64 116.20 1mp5 s THR 134 Ca -0.01 -0.01 0.03 0.00 0.31 0.00 0.00 61.69 62.01 1mp5 s THR 134 Cb -0.01 -0.32 -0.04 0.00 0.01 0.00 0.00 72.50 72.14 1mp5 s THR 134 CO -0.04 0.15 0.07 0.68 -0.69 0.00 0.00 174.62 174.79 1mp5 s VAL 135 N 0.75 1.02 -0.01 3.82 -7.23 -0.39 -1.27 120.40 117.08 1mp5 s VAL 135 Ca -0.08 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.14 1mp5 s VAL 135 Cb -0.11 -2.46 -0.01 0.00 0.56 0.00 0.00 36.38 34.36 1mp5 s VAL 135 CO -0.01 0.00 -0.17 -0.36 -0.31 0.00 0.00 175.10 174.25 1mp5 s PHE 136 N -3.09 1.51 -0.14 2.82 0.40 -1.26 -1.04 117.98 117.18 1mp5 s PHE 136 Ca 0.23 -0.29 -0.05 0.00 -0.60 0.00 0.00 56.93 56.21 1mp5 s PHE 136 Cb 0.04 -0.97 -0.04 0.00 0.51 0.00 0.00 43.02 42.56 1mp5 s PHE 136 CO 0.12 -0.03 0.05 0.00 0.70 0.00 0.00 175.22 176.05 1mp5 s ALA 137 N -0.37 3.42 -0.04 5.36 0.00 0.32 -1.44 121.76 129.01 1mp5 s ALA 137 Ca 0.06 -0.75 -0.01 0.00 0.00 0.00 0.00 51.96 51.26 1mp5 s ALA 137 Cb -0.07 -1.75 0.03 0.00 0.00 0.00 0.00 23.12 21.33 1mp5 s ALA 137 CO -0.00 0.39 0.02 -0.47 0.00 0.00 0.00 175.76 175.70 1mp5 s TYR 138 N -0.29 0.24 -0.03 0.00 5.04 -0.36 0.11 117.35 122.06 1mp5 s TYR 138 Ca 0.08 0.07 -0.30 0.00 -2.44 0.00 0.00 57.07 54.48 1mp5 s TYR 138 Cb -0.12 -0.46 -0.06 0.00 0.35 0.00 0.00 41.96 41.67 1mp5 s TYR 138 CO 0.02 -0.17 1.54 -1.58 -1.34 0.00 0.00 175.55 174.01 1mp5 s HIS 139 N 1.52 2.41 0.24 4.97 5.65 -1.26 -1.28 115.29 127.54 1mp5 s HIS 139 Ca -0.03 0.49 0.04 0.00 0.25 0.00 0.00 55.06 55.81 1mp5 s HIS 139 Cb -0.13 -3.80 -0.05 0.00 -1.18 0.00 0.00 32.58 27.42 1mp5 s HIS 139 CO -0.03 -3.20 -0.01 0.14 -0.65 0.00 0.00 174.74 170.99 1mp5 s VAL 140 N 3.25 1.11 -0.38 0.89 -7.23 -0.59 -4.96 120.40 112.49 1mp5 s VAL 140 Ca 0.69 -2.04 0.22 0.00 -1.81 0.00 0.00 61.98 59.03 1mp5 s VAL 140 Cb -0.33 -2.36 0.26 0.00 0.56 0.00 0.00 36.38 34.52 1mp5 s VAL 140 CO 0.27 -0.32 1.52 -1.13 -0.31 0.00 0.00 175.10 175.14 1mp5 h ASN 141 N 2.45 0.00 -2.18 4.85 -0.73 -1.94 -3.39 115.58 114.64 1mp5 h ASN 141 Ca -0.38 0.00 -0.58 0.00 1.87 0.00 0.00 56.30 57.20 1mp5 h ASN 141 Cb 1.22 0.00 -0.40 0.00 0.27 0.00 0.00 38.32 39.41 1mp5 h ASN 141 CO 0.65 0.08 -0.84 -0.90 -0.37 0.00 0.00 177.43 176.05 1mp5 n ASP 142 N -3.08 1.92 -0.25 1.15 5.68 -1.26 -4.95 116.55 115.75 1mp5 n ASP 142 Ca 0.03 -3.04 0.01 0.00 -0.50 0.00 0.00 54.79 51.29 1mp5 n ASP 142 Cb 0.56 -0.66 0.24 0.00 -1.14 0.00 0.00 41.12 40.13 1mp5 n ASP 142 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 1mp5 h PRO 143 N 4.27 1.01 0.00 0.11 0.11 -1.86 -1.83 132.00 133.81 1mp5 h PRO 143 Ca 0.15 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1mp5 h PRO 143 Cb 0.78 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.66 1mp5 h PRO 143 CO 0.64 0.67 0.20 0.93 -0.21 0.00 0.00 178.00 180.23 1mp5 h GLU 144 N 1.05 0.00 0.00 1.05 3.07 -1.93 0.75 114.58 118.57 1mp5 h GLU 144 Ca 0.32 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.18 1mp5 h GLU 144 Cb -0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.89 1mp5 h GLU 144 CO -0.08 0.00 0.00 0.00 -1.40 0.00 0.00 179.01 177.53 1mp5 h ARG 145 N 0.00 0.00 0.00 2.33 3.08 -1.67 -3.38 114.38 114.74 1mp5 h ARG 145 Ca 0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 1mp5 h ARG 145 Cb 0.40 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 1mp5 h ARG 145 CO 0.00 0.00 -0.07 0.66 -1.07 0.00 0.00 179.97 179.49 1mp5 n TYR 146 N -2.93 0.07 -2.84 3.04 4.02 0.26 -4.81 117.16 113.97 1mp5 n TYR 146 Ca 0.04 -0.40 -0.41 0.00 -0.01 0.00 0.00 57.90 57.11 1mp5 n TYR 146 Cb 0.50 -0.02 -0.04 0.00 -0.02 0.00 0.00 39.34 39.76 1mp5 n TYR 146 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1mp5 s GLY 147 N -1.40 2.43 -0.15 2.72 0.00 -1.26 -0.51 107.32 109.14 1mp5 s GLY 147 Ca 0.02 0.23 -0.06 0.00 0.00 0.00 0.00 44.72 44.91 1mp5 s GLY 147 CO 0.02 1.63 0.07 0.14 0.00 0.00 0.00 173.10 174.96 1mp5 s VAL 148 N 1.61 4.91 -0.12 1.40 1.01 0.27 -0.62 120.40 128.86 1mp5 s VAL 148 Ca 0.43 -0.00 -0.09 0.00 0.00 0.00 0.00 61.98 62.32 1mp5 s VAL 148 Cb -0.18 -3.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 1mp5 s VAL 148 CO 0.18 0.52 0.19 0.54 0.00 0.00 0.00 175.10 176.53 1mp5 s VAL 149 N -0.19 5.40 -0.05 2.92 0.11 -0.56 -0.61 120.40 127.42 1mp5 s VAL 149 Ca 0.08 0.33 -0.02 0.00 -2.93 0.00 0.00 61.98 59.44 1mp5 s VAL 149 Cb -0.12 -3.48 -0.04 0.00 -1.53 0.00 0.00 36.38 31.21 1mp5 s VAL 149 CO 0.01 0.56 0.08 -0.70 -3.33 0.00 0.00 175.10 171.72 1mp5 s GLU 150 N -0.65 3.15 0.02 1.54 2.12 0.00 -4.49 118.70 120.40 1mp5 s GLU 150 Ca 0.15 -0.38 0.08 0.00 0.36 0.00 0.00 54.97 55.18 1mp5 s GLU 150 Cb -0.13 -2.93 -0.02 0.00 0.26 0.00 0.00 34.13 31.31 1mp5 s GLU 150 CO 0.04 0.69 -0.23 -0.06 -0.54 0.00 0.00 175.26 175.17 1mp5 s PHE 151 N -1.10 1.99 0.83 5.30 0.40 -1.26 -0.51 117.98 123.64 1mp5 s PHE 151 Ca 0.19 -0.38 -0.14 0.00 -0.60 0.00 0.00 56.93 56.00 1mp5 s PHE 151 Cb -0.12 -1.22 0.19 0.00 0.51 0.00 0.00 43.02 42.38 1mp5 s PHE 151 CO 0.09 0.06 1.11 -0.40 0.70 0.00 0.00 175.22 176.78 1mp5 n ASP 152 N 2.06 -0.01 -0.22 1.36 5.68 -0.70 -4.83 116.55 119.88 1mp5 n ASP 152 Ca -0.16 -1.39 0.10 0.00 -0.50 0.00 0.00 54.79 52.84 1mp5 n ASP 152 Cb 0.53 -0.86 0.39 0.00 -1.14 0.00 0.00 41.12 40.04 1mp5 n ASP 152 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1mp5 h GLN 153 N 0.00 0.66 0.00 0.11 7.50 -2.01 0.16 115.11 121.52 1mp5 h GLN 153 Ca -0.36 -0.04 0.00 0.00 0.50 0.00 0.00 58.65 58.75 1mp5 h GLN 153 Cb 1.00 -0.15 0.00 0.00 0.05 0.00 0.00 27.48 28.38 1mp5 h GLN 153 CO 0.25 0.43 0.00 0.00 -1.50 0.00 0.00 178.83 178.02 1mp5 n ALA 154 N -2.45 1.86 -0.19 3.87 0.00 -1.26 -4.90 120.51 117.44 1mp5 n ALA 154 Ca 0.14 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1mp5 n ALA 154 Cb 0.39 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1mp5 n ALA 154 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mp5 n GLY 155 N 0.43 0.69 3.71 0.00 0.00 0.55 -5.07 105.19 105.51 1mp5 n GLY 155 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1mp5 n GLY 155 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mp5 s THR 156 N -2.27 4.92 -0.01 2.61 2.01 -1.26 -4.69 115.64 116.96 1mp5 s THR 156 Ca 0.00 1.85 -0.30 0.00 0.31 0.00 0.00 61.69 63.55 1mp5 s THR 156 Cb 0.00 -4.23 -0.07 0.00 0.01 0.00 0.00 72.50 68.21 1mp5 s THR 156 CO 0.00 0.18 1.85 0.00 -0.69 0.00 0.00 174.62 175.96 1mp5 s ALA 157 N 1.00 3.57 0.00 7.40 0.00 -1.26 -1.72 121.76 130.75 1mp5 s ALA 157 Ca 0.47 1.15 0.00 0.00 0.00 0.00 0.00 51.96 53.58 1mp5 s ALA 157 Cb -0.20 -3.81 0.00 0.00 0.00 0.00 0.00 23.12 19.11 1mp5 s ALA 157 CO 0.24 -1.54 0.09 1.33 0.00 0.00 0.00 175.76 175.88 1mp5 n VAL 158 N 5.60 0.00 -3.95 0.00 0.24 0.34 -4.96 118.33 115.59 1mp5 n VAL 158 Ca 0.19 -0.38 -0.08 0.00 -2.04 0.00 0.00 64.34 62.03 1mp5 n VAL 158 Cb 0.42 1.06 -0.09 0.00 -1.47 0.00 0.00 33.84 33.76 1mp5 n VAL 158 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1mp5 s SER 159 N -0.57 0.25 -0.14 -1.34 0.15 -1.13 -4.97 113.70 105.95 1mp5 s SER 159 Ca 0.00 -0.71 -0.04 0.00 0.70 0.00 0.00 55.95 55.89 1mp5 s SER 159 Cb 0.00 0.26 0.07 0.00 -1.71 0.00 0.00 66.02 64.64 1mp5 s SER 159 CO 0.00 -0.61 0.24 -0.76 1.20 0.00 0.00 173.24 173.31 1mp5 s LEU 160 N -2.61 -0.24 -0.03 3.45 1.43 -1.26 -0.82 118.68 118.60 1mp5 s LEU 160 Ca 0.02 0.38 0.06 0.00 -1.03 0.00 0.00 54.13 53.56 1mp5 s LEU 160 Cb 0.04 0.58 -0.01 0.00 0.03 0.00 0.00 46.19 46.82 1mp5 s LEU 160 CO -0.08 -0.26 -0.22 -1.61 0.23 0.00 0.00 176.35 174.41 1mp5 s GLU 161 N 2.38 2.00 -0.28 1.70 0.41 0.22 -4.94 118.70 120.19 1mp5 s GLU 161 Ca 0.03 -0.78 -0.22 0.00 -0.41 0.00 0.00 54.97 53.60 1mp5 s GLU 161 Cb -0.13 -1.81 -0.01 0.00 -1.78 0.00 0.00 34.13 30.41 1mp5 s GLU 161 CO -0.09 0.39 0.69 -2.00 -0.49 0.00 0.00 175.26 173.76 1mp5 s GLU 162 N -0.28 4.01 -1.11 1.61 2.56 -1.26 0.95 118.70 125.18 1mp5 s GLU 162 Ca 0.02 0.51 -0.32 0.00 0.00 0.00 0.00 54.97 55.18 1mp5 s GLU 162 Cb -0.11 -3.70 0.04 0.00 2.00 0.00 0.00 34.13 32.37 1mp5 s GLU 162 CO 0.01 -0.54 0.62 1.63 -0.56 0.00 0.00 175.26 176.42 1mp5 n LYS 163 N 5.92 -0.29 -1.57 4.30 5.02 0.33 -4.88 118.16 126.99 1mp5 n LYS 163 Ca 0.01 0.03 -0.32 0.00 -2.02 0.00 0.00 58.31 56.01 1mp5 n LYS 163 Cb 0.49 -2.16 0.06 0.00 -0.02 0.00 0.00 35.03 33.40 1mp5 n LYS 163 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1mp5 s PRO 164 N -7.24 2.75 0.14 1.97 0.04 -1.26 -4.95 135.00 126.45 1mp5 s PRO 164 Ca 0.44 1.14 -0.04 0.00 0.04 0.00 0.00 61.00 62.58 1mp5 s PRO 164 Cb -0.25 -1.96 -0.05 0.00 0.04 0.00 0.00 34.50 32.28 1mp5 s PRO 164 CO 0.90 -1.26 1.34 -0.07 0.04 0.00 0.00 177.00 177.95 1mp5 h LEU 165 N -0.55 0.53 -6.96 -3.56 3.38 -1.93 -3.39 115.31 102.83 1mp5 h LEU 165 Ca -0.45 -0.40 -0.61 0.00 0.09 0.00 0.00 57.88 56.51 1mp5 h LEU 165 Cb 1.22 -0.16 -0.40 0.00 0.09 0.00 0.00 40.66 41.41 1mp5 h LEU 165 CO 0.55 1.18 -0.72 -1.10 0.09 0.00 0.00 178.44 178.44 1mp5 s GLN 166 N -3.39 1.59 -0.04 1.13 -0.21 -1.26 -5.02 119.66 112.47 1mp5 s GLN 166 Ca -0.06 -2.42 -0.37 0.00 0.02 0.00 0.00 55.36 52.53 1mp5 s GLN 166 Cb 0.09 -2.58 -0.16 0.00 1.00 0.00 0.00 33.01 31.37 1mp5 s GLN 166 CO 0.86 -1.22 1.55 -2.30 -2.12 0.00 0.00 175.29 172.06 1mp5 n PRO 167 N 3.01 1.37 0.00 2.91 -0.02 -1.26 -4.84 135.00 136.17 1mp5 n PRO 167 Ca 0.14 0.50 0.07 0.00 -2.02 0.00 0.00 63.50 62.19 1mp5 n PRO 167 Cb 0.36 -2.19 0.43 0.00 -0.02 0.00 0.00 33.50 32.08 1mp5 n PRO 167 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1mp5 n LYS 168 N 3.93 0.92 -3.78 -0.52 5.02 -1.26 -4.84 118.16 117.62 1mp5 n LYS 168 Ca 0.21 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 1mp5 n LYS 168 Cb 0.19 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 33.96 1mp5 n LYS 168 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1mp5 s SER 169 N -1.53 -0.05 -0.08 4.39 1.04 -1.26 -4.72 113.70 111.49 1mp5 s SER 169 Ca 0.22 -0.31 0.16 0.00 0.48 0.00 0.00 55.95 56.50 1mp5 s SER 169 Cb 0.10 0.28 0.56 0.00 0.10 0.00 0.00 66.02 67.06 1mp5 s SER 169 CO 0.17 -0.54 1.47 0.59 0.98 0.00 0.00 173.24 175.91 1mp5 n ASN 170 N -0.78 3.98 -4.56 7.02 3.02 -1.26 -4.86 115.26 117.82 1mp5 n ASN 170 Ca -0.04 -2.36 -0.40 0.00 -0.03 0.00 0.00 54.58 51.75 1mp5 n ASN 170 Cb 0.61 -0.46 -0.10 0.00 -0.61 0.00 0.00 39.78 39.22 1mp5 n ASN 170 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1mp5 s TYR 171 N -1.67 3.22 0.24 3.10 1.51 -1.26 -1.54 117.35 120.95 1mp5 s TYR 171 Ca 0.41 0.03 0.04 0.00 -1.01 0.00 0.00 57.07 56.54 1mp5 s TYR 171 Cb 0.26 -2.54 -0.03 0.00 -0.11 0.00 0.00 41.96 39.54 1mp5 s TYR 171 CO 0.20 -0.32 0.37 0.00 -1.11 0.00 0.00 175.55 174.69 1mp5 s ALA 172 N 1.89 3.91 -0.17 3.71 0.00 -0.40 -1.50 121.76 129.20 1mp5 s ALA 172 Ca 0.10 -1.16 -0.22 0.00 0.00 0.00 0.00 51.96 50.67 1mp5 s ALA 172 Cb -0.17 -1.78 -0.03 0.00 0.00 0.00 0.00 23.12 21.15 1mp5 s ALA 172 CO 0.11 0.25 0.68 0.08 0.00 0.00 0.00 175.76 176.88 1mp5 s VAL 173 N -1.99 5.00 1.05 0.00 1.01 0.21 -1.22 120.40 124.45 1mp5 s VAL 173 Ca 0.35 1.31 -0.18 0.00 0.00 0.00 0.00 61.98 63.46 1mp5 s VAL 173 Cb -0.09 -3.99 0.26 0.00 0.00 0.00 0.00 36.38 32.55 1mp5 s VAL 173 CO 0.30 0.13 1.05 0.35 0.00 0.00 0.00 175.10 176.92 1mp5 n THR 174 N 4.50 0.00 -0.05 3.92 -2.24 -0.52 -4.65 114.28 115.23 1mp5 n THR 174 Ca -0.00 -0.56 0.01 0.00 -2.27 0.00 0.00 64.05 61.23 1mp5 n THR 174 Cb 0.50 -1.31 0.20 0.00 -2.10 0.00 0.00 70.33 67.62 1mp5 n THR 174 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mp5 n GLY 175 N -3.72 2.45 3.14 3.38 0.00 -1.26 -4.80 105.19 104.38 1mp5 n GLY 175 Ca 0.14 -0.51 -0.30 0.00 0.00 0.00 0.00 46.02 45.35 1mp5 n GLY 175 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1mp5 s LEU 176 N -1.54 1.94 0.05 0.99 2.96 -1.26 -1.88 118.68 119.94 1mp5 s LEU 176 Ca 0.30 -0.50 0.01 0.00 -0.22 0.00 0.00 54.13 53.71 1mp5 s LEU 176 Cb 0.23 -1.26 -0.03 0.00 0.50 0.00 0.00 46.19 45.63 1mp5 s LEU 176 CO 0.08 0.08 -0.05 -0.36 -1.32 0.00 0.00 176.35 174.78 1mp5 s PHE 177 N 0.69 0.57 -0.11 5.38 0.40 0.11 -4.15 117.98 120.87 1mp5 s PHE 177 Ca -0.12 -0.66 -0.01 0.00 -0.60 0.00 0.00 56.93 55.53 1mp5 s PHE 177 Cb -0.16 -0.36 0.03 0.00 0.51 0.00 0.00 43.02 43.04 1mp5 s PHE 177 CO 0.02 -0.17 -0.01 -0.06 0.70 0.00 0.00 175.22 175.71 1mp5 s PHE 178 N -2.17 0.91 0.26 0.36 0.40 -0.40 0.68 117.98 118.02 1mp5 s PHE 178 Ca -0.05 -0.44 0.07 0.00 -0.60 0.00 0.00 56.93 55.90 1mp5 s PHE 178 Cb -0.05 -0.94 -0.05 0.00 0.51 0.00 0.00 43.02 42.49 1mp5 s PHE 178 CO -0.02 -0.43 -0.07 0.71 0.70 0.00 0.00 175.22 176.10 1mp5 s TYR 179 N 1.89 1.86 0.12 0.36 1.51 -0.74 -0.58 117.35 121.77 1mp5 s TYR 179 Ca 0.04 -0.69 -0.00 0.00 -1.01 0.00 0.00 57.07 55.40 1mp5 s TYR 179 Cb -0.13 -1.02 0.03 0.00 -0.11 0.00 0.00 41.96 40.72 1mp5 s TYR 179 CO -0.06 0.27 0.17 -0.40 -1.11 0.00 0.00 175.55 174.41 1mp5 n ASP 180 N -0.52 0.18 0.14 2.29 5.68 -1.06 -1.37 116.55 121.90 1mp5 n ASP 180 Ca -0.06 -1.16 0.05 0.00 -0.50 0.00 0.00 54.79 53.11 1mp5 n ASP 180 Cb 0.63 -0.11 0.49 0.00 -1.14 0.00 0.00 41.12 40.98 1mp5 n ASP 180 CO 0.00 0.00 0.00 -1.13 -1.33 0.00 0.00 177.20 174.74 1mp5 h ASN 181 N -0.13 0.20 0.18 -1.12 -0.00 -1.84 -2.81 115.58 110.05 1mp5 h ASN 181 Ca -0.06 -0.02 0.00 0.00 -0.00 0.00 0.00 56.30 56.23 1mp5 h ASN 181 Cb 0.19 -0.05 0.00 0.00 -0.00 0.00 0.00 38.32 38.46 1mp5 h ASN 181 CO 0.06 0.23 0.00 -1.54 -0.00 0.00 0.00 177.43 176.18 1mp5 n SER 182 N -4.41 0.00 -0.12 1.15 3.41 -1.26 -3.06 113.62 109.32 1mp5 n SER 182 Ca -0.01 0.06 -0.05 0.00 -0.26 0.00 0.00 58.87 58.62 1mp5 n SER 182 Cb 0.16 -0.25 0.15 0.00 -0.26 0.00 0.00 64.21 64.01 1mp5 n SER 182 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1mp5 h VAL 183 N 0.00 1.24 0.73 -3.33 3.04 -1.87 -2.33 116.25 113.73 1mp5 h VAL 183 Ca 0.00 -0.99 -0.03 0.00 -1.01 0.00 0.00 66.70 64.67 1mp5 h VAL 183 Cb 0.09 0.83 -0.00 0.00 -2.01 0.00 0.00 31.29 30.20 1mp5 h VAL 183 CO 0.00 0.35 -0.44 0.58 -1.01 0.00 0.00 177.57 177.06 1mp5 h VAL 184 N 0.77 0.00 -0.23 1.51 2.07 -1.80 0.34 116.25 118.91 1mp5 h VAL 184 Ca 0.15 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.67 1mp5 h VAL 184 Cb 0.44 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 1mp5 h VAL 184 CO 0.02 0.00 0.12 -0.33 0.02 0.00 0.00 177.57 177.40 1mp5 h GLU 185 N -1.09 0.31 0.19 1.57 4.39 -1.80 0.16 114.58 118.31 1mp5 h GLU 185 Ca -0.10 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.57 1mp5 h GLU 185 Cb 0.87 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.45 1mp5 h GLU 185 CO 0.11 0.24 -0.09 1.98 -1.16 0.00 0.00 179.01 180.08 1mp5 h MET 186 N 0.32 -0.24 -0.56 2.33 4.05 -1.15 -2.62 114.93 117.06 1mp5 h MET 186 Ca 0.08 0.02 -0.07 0.00 -0.28 0.00 0.00 59.70 59.45 1mp5 h MET 186 Cb 0.02 0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 30.85 1mp5 h MET 186 CO -0.01 -0.10 0.08 0.00 0.23 0.00 0.00 176.91 177.10 1mp5 h ALA 187 N 0.48 0.74 0.00 0.39 0.00 -0.30 -2.44 119.26 118.13 1mp5 h ALA 187 Ca -0.03 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1mp5 h ALA 187 Cb 0.25 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1mp5 h ALA 187 CO 0.04 0.50 0.00 0.87 0.00 0.00 0.00 179.25 180.66 1mp5 h LYS 188 N 0.82 0.00 -0.03 0.00 1.57 -0.58 -0.96 116.57 117.40 1mp5 h LYS 188 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1mp5 h LYS 188 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1mp5 h LYS 188 CO 0.01 0.00 -0.03 -1.71 -0.57 0.00 0.00 179.45 177.15 1mp5 n ASN 189 N -2.66 2.74 -4.77 0.86 5.15 -0.92 -4.97 115.26 110.69 1mp5 n ASN 189 Ca -0.02 -1.87 -0.38 0.00 -0.60 0.00 0.00 54.58 51.70 1mp5 n ASN 189 Cb 0.05 0.03 -0.04 0.00 -0.53 0.00 0.00 39.78 39.30 1mp5 n ASN 189 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1mp5 s LEU 190 N -1.84 4.34 0.12 1.20 1.43 -0.37 -5.05 118.68 118.50 1mp5 s LEU 190 Ca 0.25 2.18 0.05 0.00 -1.03 0.00 0.00 54.13 55.57 1mp5 s LEU 190 Cb 0.18 -3.91 -0.04 0.00 0.03 0.00 0.00 46.19 42.45 1mp5 s LEU 190 CO 0.29 -0.35 0.07 -0.54 0.23 0.00 0.00 176.35 176.05 1mp5 s LYS 191 N -1.99 2.76 0.59 1.70 1.02 -1.26 -5.02 119.74 117.55 1mp5 s LYS 191 Ca 0.52 -0.82 -0.19 0.00 0.02 0.00 0.00 55.97 55.49 1mp5 s LYS 191 Cb -0.28 -2.62 -0.05 0.00 -0.52 0.00 0.00 37.83 34.36 1mp5 s LYS 191 CO 0.35 0.52 1.04 -0.35 -0.92 0.00 0.00 175.35 175.99 1mp5 n PRO 192 N 0.15 1.03 -1.70 -1.68 -0.04 -1.26 -4.76 135.00 126.74 1mp5 n PRO 192 Ca -0.09 0.39 -0.08 0.00 -0.04 0.00 0.00 63.50 63.69 1mp5 n PRO 192 Cb 0.53 -2.23 0.03 0.00 -0.04 0.00 0.00 33.50 31.79 1mp5 n PRO 192 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1mp5 n SER 193 N -0.79 0.77 -0.20 3.54 3.41 -0.95 -4.80 113.62 114.59 1mp5 n SER 193 Ca 0.13 -1.57 -0.05 0.00 -0.26 0.00 0.00 58.87 57.12 1mp5 n SER 193 Cb 0.46 -0.17 0.01 0.00 -0.26 0.00 0.00 64.21 64.25 1mp5 n SER 193 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mp5 h ALA 194 N 0.25 -0.05 0.00 7.33 0.00 -1.95 1.69 119.26 126.53 1mp5 h ALA 194 Ca -0.11 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1mp5 h ALA 194 Cb 0.47 0.79 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1mp5 h ALA 194 CO 0.15 -0.68 0.00 2.89 0.00 0.00 0.00 179.25 181.61 1mp5 n ARG 195 N -5.43 0.95 -4.04 0.00 1.85 -1.26 -4.83 116.66 103.89 1mp5 n ARG 195 Ca 0.04 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 56.60 1mp5 n ARG 195 Cb 0.35 -1.36 -0.02 0.00 -1.05 0.00 0.00 32.46 30.38 1mp5 n ARG 195 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1mp5 n GLY 196 N 0.15 -0.29 3.18 2.89 0.00 0.58 -4.98 105.19 106.71 1mp5 n GLY 196 Ca 0.00 0.15 -0.17 0.00 0.00 0.00 0.00 46.02 45.99 1mp5 n GLY 196 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mp5 s GLU 197 N -6.69 0.83 -1.25 1.61 2.02 -1.25 -4.68 118.70 109.29 1mp5 s GLU 197 Ca 0.24 -1.01 -0.18 0.00 0.02 0.00 0.00 54.97 54.03 1mp5 s GLU 197 Cb -0.13 -0.76 0.08 0.00 0.10 0.00 0.00 34.13 33.42 1mp5 s GLU 197 CO 0.90 0.16 1.66 -0.51 0.02 0.00 0.00 175.26 177.49 1mp5 s LEU 198 N -1.94 3.91 0.02 1.80 1.43 0.75 -2.23 118.68 122.42 1mp5 s LEU 198 Ca 0.00 -2.35 -0.36 0.00 -1.03 0.00 0.00 54.13 50.40 1mp5 s LEU 198 Cb -0.08 -2.56 -0.14 0.00 0.03 0.00 0.00 46.19 43.43 1mp5 s LEU 198 CO 0.02 -1.18 1.61 -0.62 0.23 0.00 0.00 176.35 176.40 1mp5 n GLU 199 N 8.21 1.75 0.15 1.70 -0.58 -1.26 -1.14 120.64 129.47 1mp5 n GLU 199 Ca 0.45 0.63 0.13 0.00 -0.42 0.00 0.00 57.16 57.96 1mp5 n GLU 199 Cb 0.46 -2.37 0.49 0.00 -0.57 0.00 0.00 31.44 29.45 1mp5 n GLU 199 CO 0.00 0.00 0.00 0.97 -0.48 0.00 0.00 177.13 177.62 1mp5 h ILE 200 N 4.18 0.00 -0.39 -3.67 6.09 -1.92 -2.51 117.51 119.29 1mp5 h ILE 200 Ca -0.47 -0.37 -0.16 0.00 -1.37 0.00 0.00 64.86 62.50 1mp5 h ILE 200 Cb 1.29 1.21 -0.01 0.00 0.47 0.00 0.00 36.82 39.78 1mp5 h ILE 200 CO 0.88 0.00 -0.37 0.74 -3.07 0.00 0.00 178.15 176.33 1mp5 h THR 201 N 0.00 1.27 -0.20 2.19 2.02 -1.99 -2.01 112.91 114.19 1mp5 h THR 201 Ca 0.00 -1.55 0.01 0.00 0.77 0.00 0.00 66.41 65.64 1mp5 h THR 201 Cb 0.50 1.36 -0.01 0.00 -1.74 0.00 0.00 68.15 68.25 1mp5 h THR 201 CO 0.00 0.52 0.10 0.44 0.37 0.00 0.00 175.52 176.95 1mp5 h ASP 202 N 0.76 0.15 -0.00 4.18 3.32 -1.83 0.91 116.42 123.92 1mp5 h ASP 202 Ca 0.07 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.15 1mp5 h ASP 202 Cb 0.96 -0.02 -0.06 0.00 0.22 0.00 0.00 39.33 40.43 1mp5 h ASP 202 CO 0.09 0.12 -0.47 0.40 -1.72 0.00 0.00 179.24 177.67 1mp5 h ILE 203 N 0.22 0.09 -0.82 0.35 1.08 -1.55 -1.54 117.51 115.32 1mp5 h ILE 203 Ca 0.08 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.64 1mp5 h ILE 203 Cb 0.01 0.09 -0.06 0.00 -3.07 0.00 0.00 36.82 33.79 1mp5 h ILE 203 CO -0.05 0.00 0.54 0.78 -0.69 0.00 0.00 178.15 178.73 1mp5 h ASN 204 N -0.62 0.72 0.05 1.72 2.35 -1.04 -1.52 115.58 117.24 1mp5 h ASN 204 Ca 0.03 0.02 0.02 0.00 -0.55 0.00 0.00 56.30 55.82 1mp5 h ASN 204 Cb 0.69 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.89 1mp5 h ASN 204 CO -0.34 0.43 -0.20 0.03 -1.65 0.00 0.00 177.43 175.71 1mp5 h ARG 205 N 0.80 -0.34 -0.48 0.81 2.47 -0.17 0.63 114.38 118.10 1mp5 h ARG 205 Ca 0.38 0.02 0.10 0.00 -1.26 0.00 0.00 59.98 59.22 1mp5 h ARG 205 Cb 0.40 0.08 -0.09 0.00 -1.65 0.00 0.00 29.97 28.71 1mp5 h ARG 205 CO -0.15 -0.22 -0.08 0.82 0.56 0.00 0.00 179.97 180.89 1mp5 h ILE 206 N -0.35 0.55 -0.48 2.04 1.08 -0.30 0.15 117.51 120.20 1mp5 h ILE 206 Ca 0.04 -0.01 -0.02 0.00 -0.39 0.00 0.00 64.86 64.48 1mp5 h ILE 206 Cb 0.40 0.51 -0.02 0.00 -3.07 0.00 0.00 36.82 34.63 1mp5 h ILE 206 CO -0.15 0.01 0.22 1.88 -0.69 0.00 0.00 178.15 179.42 1mp5 h TYR 207 N 0.03 0.65 -0.15 1.37 -1.99 -1.09 -2.84 116.97 112.95 1mp5 h TYR 207 Ca 0.24 -0.02 -0.13 0.00 2.00 0.00 0.00 58.73 60.82 1mp5 h TYR 207 Cb 0.36 -0.21 0.00 0.00 2.00 0.00 0.00 36.73 38.89 1mp5 h TYR 207 CO -0.38 0.49 -0.41 1.98 -0.00 0.00 0.00 178.16 179.84 1mp5 h MET 208 N 0.67 0.55 -0.88 4.88 4.05 0.12 0.44 114.93 124.75 1mp5 h MET 208 Ca 0.17 -0.38 0.15 0.00 -0.28 0.00 0.00 59.70 59.36 1mp5 h MET 208 Cb 0.09 0.06 -0.10 0.00 -0.80 0.00 0.00 31.60 30.85 1mp5 h MET 208 CO -0.02 1.00 0.48 0.93 0.23 0.00 0.00 176.91 179.53 1mp5 h GLU 209 N 0.18 0.65 0.00 0.39 5.08 -0.59 0.28 114.58 120.57 1mp5 h GLU 209 Ca -0.01 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1mp5 h GLU 209 Cb 1.02 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.13 1mp5 h GLU 209 CO 0.09 0.43 0.00 1.04 -1.00 0.00 0.00 179.01 179.57 1mp5 n GLN 210 N -4.84 0.02 -1.91 2.33 6.02 -1.09 -4.92 117.38 112.99 1mp5 n GLN 210 Ca 0.18 0.09 -0.07 0.00 -0.01 0.00 0.00 57.00 57.19 1mp5 n GLN 210 Cb 0.45 -1.53 -0.01 0.00 1.02 0.00 0.00 30.24 30.18 1mp5 n GLN 210 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1mp5 n GLY 211 N 1.08 0.29 0.55 1.08 0.00 0.98 -4.92 105.19 104.24 1mp5 n GLY 211 Ca 0.06 -0.62 0.05 0.00 0.00 0.00 0.00 46.02 45.51 1mp5 n GLY 211 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mp5 n ARG 212 N -1.97 2.57 -3.57 1.61 1.74 0.15 -4.94 116.66 112.25 1mp5 n ARG 212 Ca -0.08 -1.88 -0.41 0.00 -0.77 0.00 0.00 57.85 54.71 1mp5 n ARG 212 Cb 0.48 -1.23 -0.10 0.00 -1.02 0.00 0.00 32.46 30.59 1mp5 n ARG 212 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1mp5 s LEU 213 N -0.98 5.00 -0.18 0.55 2.96 -0.99 0.11 118.68 125.15 1mp5 s LEU 213 Ca 0.19 -1.21 -0.21 0.00 -0.22 0.00 0.00 54.13 52.69 1mp5 s LEU 213 Cb 0.10 -2.04 -0.03 0.00 0.50 0.00 0.00 46.19 44.73 1mp5 s LEU 213 CO 0.14 -0.47 0.65 -0.44 -1.32 0.00 0.00 176.35 174.91 1mp5 s SER 214 N 1.88 6.73 -0.87 3.68 0.01 0.29 -4.86 113.70 120.56 1mp5 s SER 214 Ca 0.03 0.89 -0.12 0.00 1.31 0.00 0.00 55.95 58.06 1mp5 s SER 214 Cb -0.21 -2.36 0.23 0.00 0.21 0.00 0.00 66.02 63.88 1mp5 s SER 214 CO 0.05 -0.27 0.81 -0.69 0.41 0.00 0.00 173.24 173.56 1mp5 s VAL 215 N 1.83 5.53 0.13 3.43 1.01 -1.26 -1.26 120.40 129.80 1mp5 s VAL 215 Ca 0.30 -2.73 -0.31 0.00 0.00 0.00 0.00 61.98 59.25 1mp5 s VAL 215 Cb -0.16 -4.40 -0.08 0.00 0.00 0.00 0.00 36.38 31.74 1mp5 s VAL 215 CO 0.11 -1.05 1.35 0.00 0.00 0.00 0.00 175.10 175.51 1mp5 s ALA 216 N -0.17 3.56 -0.10 5.51 0.00 -0.21 -4.76 121.76 125.58 1mp5 s ALA 216 Ca 0.21 1.09 -0.27 0.00 0.00 0.00 0.00 51.96 52.99 1mp5 s ALA 216 Cb -0.11 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.48 1mp5 s ALA 216 CO -0.08 -0.58 0.88 -1.64 0.00 0.00 0.00 175.76 174.34 1mp5 s MET 217 N 0.77 4.40 -0.47 0.00 -1.94 -1.26 -0.52 119.30 120.28 1mp5 s MET 217 Ca 0.62 1.17 -0.11 0.00 -1.71 0.00 0.00 55.69 55.66 1mp5 s MET 217 Cb -0.36 -3.52 0.11 0.00 2.01 0.00 0.00 34.83 33.06 1mp5 s MET 217 CO 0.32 -0.20 0.35 1.41 -0.01 0.00 0.00 175.02 176.89 1mp5 s MET 218 N 1.66 2.66 0.96 2.03 0.00 0.30 -4.88 119.30 122.04 1mp5 s MET 218 Ca 0.43 -1.63 -0.10 0.00 0.00 0.00 0.00 55.69 54.39 1mp5 s MET 218 Cb -0.18 -3.97 0.17 0.00 0.00 0.00 0.00 34.83 30.85 1mp5 s MET 218 CO 0.18 -1.13 1.12 0.41 0.00 0.00 0.00 175.02 175.59 1mp5 n GLY 219 N 5.00 -0.67 0.00 2.11 0.00 -1.26 -4.35 105.19 106.02 1mp5 n GLY 219 Ca -0.10 -0.80 0.01 0.00 0.00 0.00 0.00 46.02 45.14 1mp5 n GLY 219 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1mp5 n ARG 220 N -4.35 0.01 0.00 1.61 1.85 -1.26 -1.39 116.66 113.12 1mp5 n ARG 220 Ca 0.10 0.42 0.14 0.00 -1.00 0.00 0.00 57.85 57.52 1mp5 n ARG 220 Cb 0.52 -1.50 0.66 0.00 -1.05 0.00 0.00 32.46 31.09 1mp5 n ARG 220 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1mp5 n GLY 221 N -1.17 -1.38 3.95 2.89 0.00 -1.26 -4.74 105.19 103.48 1mp5 n GLY 221 Ca 0.01 -0.14 -0.21 0.00 0.00 0.00 0.00 46.02 45.69 1mp5 n GLY 221 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mp5 s TYR 222 N -2.80 3.32 -0.06 1.61 1.51 -0.49 -4.66 117.35 115.78 1mp5 s TYR 222 Ca 0.20 -0.08 0.04 0.00 -1.01 0.00 0.00 57.07 56.23 1mp5 s TYR 222 Cb 0.20 -1.62 -0.00 0.00 -0.11 0.00 0.00 41.96 40.42 1mp5 s TYR 222 CO 0.51 0.37 -0.20 0.00 -1.11 0.00 0.00 175.55 175.11 1mp5 s ALA 223 N -2.05 1.80 -0.74 3.71 0.00 0.16 -4.97 121.76 119.67 1mp5 s ALA 223 Ca 0.36 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.55 1mp5 s ALA 223 Cb -0.09 -0.63 0.19 0.00 0.00 0.00 0.00 23.12 22.60 1mp5 s ALA 223 CO 0.29 0.29 0.59 1.87 0.00 0.00 0.00 175.76 178.80 1mp5 n TRP 224 N 3.27 3.49 -1.66 0.00 -0.00 -1.26 -1.28 117.44 120.00 1mp5 n TRP 224 Ca -0.19 -4.25 -0.51 0.00 -0.00 0.00 0.00 57.50 52.56 1mp5 n TRP 224 Cb 0.53 -0.73 -0.05 0.00 -0.00 0.00 0.00 31.31 31.05 1mp5 n TRP 224 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 1mp5 n LEU 225 N 1.89 2.65 -4.80 5.87 4.77 -0.90 -4.94 117.00 121.52 1mp5 n LEU 225 Ca 0.21 1.06 -0.35 0.00 -0.03 0.00 0.00 56.01 56.91 1mp5 n LEU 225 Cb 0.36 -1.28 -0.07 0.00 -2.33 0.00 0.00 43.42 40.10 1mp5 n LEU 225 CO 0.31 -0.46 0.65 -0.62 -1.33 0.00 0.00 177.39 175.94 1mp5 s ASP 226 N 2.23 7.15 -0.11 -1.43 2.15 -1.26 -4.24 116.67 121.16 1mp5 s ASP 226 Ca 0.88 1.76 0.21 0.00 0.43 0.00 0.00 52.55 55.84 1mp5 s ASP 226 Cb -0.85 -2.56 0.45 0.00 -0.30 0.00 0.00 42.92 39.66 1mp5 s ASP 226 CO 0.50 -0.20 1.17 0.35 -0.17 0.00 0.00 175.17 176.82 1mp5 n THR 227 N 0.01 0.84 0.04 1.71 -2.24 -1.26 -4.20 114.28 109.18 1mp5 n THR 227 Ca 0.04 -2.03 -0.10 0.00 -2.27 0.00 0.00 64.05 59.69 1mp5 n THR 227 Cb 0.52 0.70 -0.13 0.00 -2.10 0.00 0.00 70.33 69.31 1mp5 n THR 227 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1mp5 h GLY 228 N 1.42 0.09 -1.58 3.38 0.00 -1.93 -3.46 103.07 101.00 1mp5 h GLY 228 Ca -0.13 -0.24 -0.56 0.00 0.00 0.00 0.00 47.33 46.40 1mp5 h GLY 228 CO 0.15 0.21 -0.58 -0.51 0.00 0.00 0.00 176.54 175.80 1mp5 s THR 229 N -2.66 1.36 0.24 4.70 -4.23 -1.26 -4.74 115.64 109.05 1mp5 s THR 229 Ca -0.03 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.44 1mp5 s THR 229 Cb 0.09 -2.72 0.11 0.00 1.34 0.00 0.00 72.50 71.32 1mp5 s THR 229 CO 0.83 0.00 1.74 0.45 -0.54 0.00 0.00 174.62 177.10 1mp5 h HIS 230 N 1.86 0.97 -1.00 3.99 3.86 -1.91 -1.59 115.15 121.33 1mp5 h HIS 230 Ca -0.42 -0.13 0.01 0.00 -1.16 0.00 0.00 60.37 58.67 1mp5 h HIS 230 Cb 1.26 -0.27 -0.05 0.00 1.06 0.00 0.00 27.41 29.41 1mp5 h HIS 230 CO 0.88 0.86 0.66 0.37 0.86 0.00 0.00 177.93 181.55 1mp5 h GLN 231 N 0.86 1.32 0.00 2.45 5.75 -2.00 -2.00 115.11 121.49 1mp5 h GLN 231 Ca 0.17 -0.08 -0.12 0.00 -0.15 0.00 0.00 58.65 58.46 1mp5 h GLN 231 Cb 0.44 -0.30 -0.02 0.00 1.07 0.00 0.00 27.48 28.68 1mp5 h GLN 231 CO 0.02 0.88 -0.59 0.66 -2.65 0.00 0.00 178.83 177.15 1mp5 h SER 232 N 1.36 0.00 -0.34 -0.69 4.64 -1.77 -2.43 113.55 114.32 1mp5 h SER 232 Ca 0.37 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.55 1mp5 h SER 232 Cb -0.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 61.93 1mp5 h SER 232 CO -0.08 0.59 -0.29 -0.07 -0.87 0.00 0.00 176.83 176.11 1mp5 h LEU 233 N 0.00 0.89 -0.37 5.97 3.38 -0.65 0.92 115.31 125.44 1mp5 h LEU 233 Ca -0.01 -0.36 -0.19 0.00 0.09 0.00 0.00 57.88 57.42 1mp5 h LEU 233 Cb 1.30 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1mp5 h LEU 233 CO 0.08 1.11 -0.79 -0.29 0.09 0.00 0.00 178.44 178.63 1mp5 h ILE 234 N 0.72 1.43 -0.36 1.22 2.10 -1.39 -0.70 117.51 120.53 1mp5 h ILE 234 Ca 0.08 -2.35 -0.16 0.00 1.08 0.00 0.00 64.86 63.52 1mp5 h ILE 234 Cb 0.84 2.28 -0.01 0.00 -1.09 0.00 0.00 36.82 38.84 1mp5 h ILE 234 CO 0.07 0.69 -0.40 -0.33 -1.08 0.00 0.00 178.15 177.11 1mp5 h GLU 235 N 0.18 0.88 -0.65 2.19 5.08 -1.28 0.34 114.58 121.32 1mp5 h GLU 235 Ca -0.04 -0.47 -0.01 0.00 -1.00 0.00 0.00 59.36 57.85 1mp5 h GLU 235 Cb 1.38 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.62 1mp5 h GLU 235 CO 0.13 1.11 0.38 0.00 -1.00 0.00 0.00 179.01 179.62 1mp5 h ALA 236 N 0.83 0.83 -0.12 3.43 0.00 -0.74 0.81 119.26 124.29 1mp5 h ALA 236 Ca 0.06 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1mp5 h ALA 236 Cb 0.98 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1mp5 h ALA 236 CO 0.09 0.32 0.01 0.77 0.00 0.00 0.00 179.25 180.44 1mp5 h SER 237 N 0.88 0.21 -0.87 0.00 0.02 -0.82 -1.14 113.55 111.83 1mp5 h SER 237 Ca 0.23 -0.29 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 1mp5 h SER 237 Cb 0.00 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.44 1mp5 h SER 237 CO -0.04 0.45 0.49 0.78 -1.14 0.00 0.00 176.83 177.37 1mp5 h ASN 238 N -0.04 1.07 0.63 3.07 2.35 0.20 -0.58 115.58 122.28 1mp5 h ASN 238 Ca 0.04 -0.09 -0.03 0.00 -0.55 0.00 0.00 56.30 55.67 1mp5 h ASN 238 Cb 0.34 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 1mp5 h ASN 238 CO 0.00 0.85 -0.42 0.15 -1.65 0.00 0.00 177.43 176.37 1mp5 h PHE 239 N 1.21 -1.12 -1.00 1.19 3.57 0.82 -0.04 116.94 121.57 1mp5 h PHE 239 Ca 0.31 -0.01 0.22 0.00 3.53 0.00 0.00 57.97 62.02 1mp5 h PHE 239 Cb 0.00 0.41 -0.10 0.00 2.79 0.00 0.00 35.95 39.05 1mp5 h PHE 239 CO 0.00 -0.61 0.63 0.82 -2.23 0.00 0.00 178.31 176.92 1mp5 h ILE 240 N -0.99 0.63 -0.32 1.41 1.08 -1.02 -1.32 117.51 116.98 1mp5 h ILE 240 Ca -0.08 -0.19 -0.08 0.00 -0.39 0.00 0.00 64.86 64.11 1mp5 h ILE 240 Cb 0.80 0.02 -0.01 0.00 -3.07 0.00 0.00 36.82 34.56 1mp5 h ILE 240 CO 0.06 0.10 -0.13 0.00 -0.69 0.00 0.00 178.15 177.49 1mp5 h ALA 241 N 1.64 0.44 -0.41 1.87 0.00 -0.54 -1.53 119.26 120.74 1mp5 h ALA 241 Ca 0.57 -0.32 0.05 0.00 0.00 0.00 0.00 54.91 55.21 1mp5 h ALA 241 Cb 1.18 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1mp5 h ALA 241 CO -0.33 0.33 0.28 1.15 0.00 0.00 0.00 179.25 180.68 1mp5 h THR 242 N 0.41 0.97 0.17 0.00 2.02 0.17 -0.03 112.91 116.62 1mp5 h THR 242 Ca 0.07 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 1mp5 h THR 242 Cb 0.65 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.67 1mp5 h THR 242 CO 0.04 0.06 -0.08 0.40 0.37 0.00 0.00 175.52 176.31 1mp5 h ILE 243 N 0.34 0.63 0.62 3.11 1.08 -1.35 -3.16 117.51 118.77 1mp5 h ILE 243 Ca 0.18 -1.12 -0.02 0.00 -0.39 0.00 0.00 64.86 63.51 1mp5 h ILE 243 Cb 0.28 1.09 -0.01 0.00 -3.07 0.00 0.00 36.82 35.11 1mp5 h ILE 243 CO -0.04 0.18 -0.46 -0.33 -0.69 0.00 0.00 178.15 176.81 1mp5 h GLU 244 N -0.95 -1.00 0.00 2.37 5.08 -0.88 -2.14 114.58 117.06 1mp5 h GLU 244 Ca -0.02 0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1mp5 h GLU 244 Cb 0.46 0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.94 1mp5 h GLU 244 CO 0.04 -0.67 0.14 0.39 -1.00 0.00 0.00 179.01 177.91 1mp5 n GLU 245 N -5.57 0.07 -0.05 2.33 -0.58 -0.06 0.30 120.64 117.08 1mp5 n GLU 245 Ca -0.13 0.52 -0.21 0.00 -0.42 0.00 0.00 57.16 56.92 1mp5 n GLU 245 Cb 0.46 -1.86 -0.13 0.00 -0.57 0.00 0.00 31.44 29.34 1mp5 n GLU 245 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 1mp5 n ARG 246 N -1.84 0.71 0.04 3.49 3.00 -0.88 -4.42 116.66 116.76 1mp5 n ARG 246 Ca -0.01 0.24 0.11 0.00 -0.00 0.00 0.00 57.85 58.20 1mp5 n ARG 246 Cb 0.15 -1.64 0.05 0.00 0.00 0.00 0.00 32.46 31.02 1mp5 n ARG 246 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1mp5 n GLN 247 N -3.48 0.31 -1.67 -0.14 6.02 -0.53 -4.91 117.38 112.97 1mp5 n GLN 247 Ca -0.37 0.02 -0.08 0.00 -0.01 0.00 0.00 57.00 56.56 1mp5 n GLN 247 Cb 1.01 -1.63 -0.02 0.00 1.02 0.00 0.00 30.24 30.62 1mp5 n GLN 247 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1mp5 n GLY 248 N 1.35 0.53 3.37 1.08 0.00 0.15 -5.00 105.19 106.66 1mp5 n GLY 248 Ca 0.02 -0.63 -0.22 0.00 0.00 0.00 0.00 46.02 45.19 1mp5 n GLY 248 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mp5 s LEU 249 N -2.01 2.48 0.01 0.99 1.43 -1.15 -5.05 118.68 115.39 1mp5 s LEU 249 Ca 0.00 -0.92 -0.01 0.00 -1.03 0.00 0.00 54.13 52.17 1mp5 s LEU 249 Cb 0.00 -0.88 -0.04 0.00 0.03 0.00 0.00 46.19 45.30 1mp5 s LEU 249 CO 0.00 -0.03 0.15 -0.54 0.23 0.00 0.00 176.35 176.16 1mp5 s LYS 250 N -3.06 3.28 -0.18 1.70 1.02 -1.26 -4.15 119.74 117.09 1mp5 s LYS 250 Ca 0.20 -0.42 -0.09 0.00 0.02 0.00 0.00 55.97 55.68 1mp5 s LYS 250 Cb -0.05 -2.99 -0.05 0.00 -0.52 0.00 0.00 37.83 34.23 1mp5 s LYS 250 CO 0.08 0.65 0.10 0.08 -0.92 0.00 0.00 175.35 175.34 1mp5 s VAL 251 N -1.32 5.16 -1.14 3.17 1.01 -1.26 -4.48 120.40 121.54 1mp5 s VAL 251 Ca 0.27 0.10 -0.00 0.00 0.00 0.00 0.00 61.98 62.35 1mp5 s VAL 251 Cb -0.12 -3.33 -0.00 0.00 0.00 0.00 0.00 36.38 32.93 1mp5 s VAL 251 CO 0.19 0.47 0.95 -1.20 0.00 0.00 0.00 175.10 175.51 1mp5 n SER 252 N 3.32 -2.04 -4.41 3.32 7.64 -1.26 -4.98 113.62 115.20 1mp5 n SER 252 Ca -0.17 -0.59 -0.44 0.00 1.01 0.00 0.00 58.87 58.68 1mp5 n SER 252 Cb 0.52 -4.89 -0.07 0.00 -1.01 0.00 0.00 64.21 58.77 1mp5 n SER 252 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1mp5 h PRO 254 N 8.88 -0.47 -0.88 0.00 0.11 -1.94 -1.04 132.00 136.66 1mp5 h PRO 254 Ca -0.28 0.03 0.22 0.00 0.11 0.00 0.00 66.00 66.09 1mp5 h PRO 254 Cb 1.10 0.11 -0.16 0.00 0.11 0.00 0.00 31.00 32.16 1mp5 h PRO 254 CO 0.93 -0.32 0.05 0.93 -0.21 0.00 0.00 178.00 179.38 1mp5 h GLU 255 N -0.49 0.08 0.83 1.05 3.07 -1.96 0.34 114.58 117.48 1mp5 h GLU 255 Ca 0.07 -0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.89 1mp5 h GLU 255 Cb 0.64 -0.02 0.01 0.00 -0.84 0.00 0.00 28.75 28.54 1mp5 h GLU 255 CO -0.46 0.05 -0.40 1.49 -1.40 0.00 0.00 179.01 178.30 1mp5 h GLU 256 N 0.08 -1.07 -0.44 2.33 4.81 -1.66 0.23 114.58 118.86 1mp5 h GLU 256 Ca 0.52 0.07 0.09 0.00 -0.13 0.00 0.00 59.36 59.91 1mp5 h GLU 256 Cb 1.00 0.24 -0.08 0.00 0.63 0.00 0.00 28.75 30.54 1mp5 h GLU 256 CO -0.78 -0.70 -0.11 0.82 -0.73 0.00 0.00 179.01 177.51 1mp5 h ILE 257 N -1.16 0.56 -0.43 2.32 2.04 0.04 1.01 117.51 121.88 1mp5 h ILE 257 Ca -0.11 -0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.83 1mp5 h ILE 257 Cb 0.86 0.55 -0.08 0.00 -0.74 0.00 0.00 36.82 37.41 1mp5 h ILE 257 CO 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 178.15 178.23 1mp5 h ALA 258 N 1.44 0.29 -0.30 1.87 0.00 -0.28 0.50 119.26 122.80 1mp5 h ALA 258 Ca 0.21 0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.26 1mp5 h ALA 258 Cb 0.33 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1mp5 h ALA 258 CO -0.46 -0.45 0.05 0.35 0.00 0.00 0.00 179.25 178.75 1mp5 h PHE 259 N 0.00 0.51 -0.44 0.00 3.57 0.16 0.85 116.94 121.60 1mp5 h PHE 259 Ca 0.21 -0.07 -0.03 0.00 3.53 0.00 0.00 57.97 61.61 1mp5 h PHE 259 Cb 0.32 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 1mp5 h PHE 259 CO -0.37 0.57 0.16 0.00 -2.23 0.00 0.00 178.31 176.43 1mp5 h ARG 260 N 0.31 0.66 -0.47 1.11 2.47 0.19 -2.33 114.38 116.32 1mp5 h ARG 260 Ca 0.09 -0.13 0.00 0.00 -1.26 0.00 0.00 59.98 58.68 1mp5 h ARG 260 Cb 0.33 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.54 1mp5 h ARG 260 CO 0.00 0.63 0.00 1.63 0.56 0.00 0.00 179.97 182.79 1mp5 n LYS 261 N -4.59 1.39 -1.15 0.04 5.02 0.17 -4.87 118.16 114.16 1mp5 n LYS 261 Ca 0.00 -0.42 -0.05 0.00 -2.02 0.00 0.00 58.31 55.83 1mp5 n LYS 261 Cb 0.16 -1.31 -0.02 0.00 -0.02 0.00 0.00 35.03 33.84 1mp5 n LYS 261 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1mp5 n ASN 262 N -0.06 -5.21 0.25 4.39 3.02 -0.88 -4.83 115.26 111.93 1mp5 n ASN 262 Ca 0.04 0.13 0.07 0.00 -0.03 0.00 0.00 54.58 54.79 1mp5 n ASN 262 Cb 0.22 -3.16 0.59 0.00 -0.61 0.00 0.00 39.78 36.82 1mp5 n ASN 262 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 1mp5 h PHE 263 N 0.00 0.00 -3.99 3.10 0.05 0.46 -3.43 116.94 113.13 1mp5 h PHE 263 Ca -0.10 0.00 -0.11 0.00 3.82 0.00 0.00 57.97 61.57 1mp5 h PHE 263 Cb 0.87 0.00 -0.15 0.00 2.00 0.00 0.00 35.95 38.66 1mp5 h PHE 263 CO 0.48 0.07 -0.54 0.96 -0.18 0.00 0.00 178.31 179.10 1mp5 s ILE 264 N -4.89 0.17 0.54 -0.55 -4.36 -0.69 -4.22 121.20 107.19 1mp5 s ILE 264 Ca -0.05 -1.42 0.07 0.00 -0.26 0.00 0.00 60.65 59.00 1mp5 s ILE 264 Cb 0.16 -1.29 0.07 0.00 1.25 0.00 0.00 42.46 42.66 1mp5 s ILE 264 CO 0.68 -0.78 0.61 -0.46 0.24 0.00 0.00 174.94 175.23 1mp5 n ASN 265 N 0.23 2.25 0.07 4.36 0.23 -1.26 -4.15 115.26 116.98 1mp5 n ASN 265 Ca -0.16 -2.58 -0.12 0.00 -0.53 0.00 0.00 54.58 51.20 1mp5 n ASN 265 Cb 0.61 -0.26 -0.05 0.00 -2.08 0.00 0.00 39.78 37.99 1mp5 n ASN 265 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1mp5 h ALA 266 N 0.35 -0.15 -0.85 -2.53 0.00 -1.98 -2.60 119.26 111.49 1mp5 h ALA 266 Ca -0.28 -0.00 0.13 0.00 0.00 0.00 0.00 54.91 54.75 1mp5 h ALA 266 Cb 1.19 0.19 -0.09 0.00 0.00 0.00 0.00 17.79 19.08 1mp5 h ALA 266 CO 0.42 -0.61 0.47 1.96 0.00 0.00 0.00 179.25 181.49 1mp5 h GLN 267 N -0.21 0.70 0.00 0.00 7.50 -1.99 0.23 115.11 121.34 1mp5 h GLN 267 Ca 0.03 -0.04 -0.05 0.00 0.50 0.00 0.00 58.65 59.09 1mp5 h GLN 267 Cb 0.24 -0.16 -0.01 0.00 0.05 0.00 0.00 27.48 27.61 1mp5 h GLN 267 CO -0.09 0.46 -0.25 1.96 -1.50 0.00 0.00 178.83 179.41 1mp5 h GLN 268 N 0.72 0.00 -0.40 1.46 4.20 -1.91 -2.01 115.11 117.16 1mp5 h GLN 268 Ca 0.44 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 59.09 1mp5 h GLN 268 Cb 0.54 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.30 1mp5 h GLN 268 CO -0.31 0.25 0.00 0.28 -0.67 0.00 0.00 178.83 178.38 1mp5 h VAL 269 N 0.00 1.26 -0.39 -0.54 2.07 -0.19 -1.10 116.25 117.36 1mp5 h VAL 269 Ca -0.00 -1.00 0.05 0.00 0.82 0.00 0.00 66.70 66.56 1mp5 h VAL 269 Cb 0.48 1.11 -0.04 0.00 -1.52 0.00 0.00 31.29 31.32 1mp5 h VAL 269 CO 0.03 0.34 0.14 0.40 0.02 0.00 0.00 177.57 178.51 1mp5 h ILE 270 N 0.54 0.89 -0.57 4.57 1.08 -0.66 0.39 117.51 123.76 1mp5 h ILE 270 Ca 0.11 -0.10 -0.01 0.00 -0.39 0.00 0.00 64.86 64.47 1mp5 h ILE 270 Cb 0.47 0.56 -0.03 0.00 -3.07 0.00 0.00 36.82 34.76 1mp5 h ILE 270 CO 0.02 0.06 0.30 -0.33 -0.69 0.00 0.00 178.15 177.51 1mp5 h GLU 271 N 0.30 0.80 -0.11 2.37 5.08 -1.27 1.21 114.58 122.96 1mp5 h GLU 271 Ca 0.18 -0.10 -0.10 0.00 -1.00 0.00 0.00 59.36 58.34 1mp5 h GLU 271 Cb 0.15 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1mp5 h GLU 271 CO -0.18 0.62 -0.39 -0.07 -1.00 0.00 0.00 179.01 177.99 1mp5 h LEU 272 N 0.77 0.25 0.00 1.33 3.38 -0.65 -2.87 115.31 117.51 1mp5 h LEU 272 Ca 0.20 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 1mp5 h LEU 272 Cb 0.06 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1mp5 h LEU 272 CO -0.03 0.62 -0.78 0.00 0.09 0.00 0.00 178.44 178.34 1mp5 h ALA 273 N 1.40 0.67 -0.31 1.53 0.00 0.39 -3.41 119.26 119.53 1mp5 h ALA 273 Ca 0.02 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.76 1mp5 h ALA 273 Cb 0.78 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 1mp5 h ALA 273 CO 0.06 0.24 -0.26 0.78 0.00 0.00 0.00 179.25 180.07 1mp5 h GLY 274 N 3.89 -1.69 1.90 0.00 0.00 0.17 0.78 103.07 108.12 1mp5 h GLY 274 Ca -0.03 0.89 0.01 0.00 0.00 0.00 0.00 47.33 48.20 1mp5 h GLY 274 CO 0.02 -0.50 0.04 -2.55 0.00 0.00 0.00 176.54 173.54 1mp5 h PRO 275 N -0.10 0.00 -0.47 4.80 0.11 -1.78 -1.81 132.00 132.75 1mp5 h PRO 275 Ca 0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1mp5 h PRO 275 Cb 0.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.34 1mp5 h PRO 275 CO -0.34 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.73 1mp5 n LEU 276 N -4.43 2.62 0.07 2.35 4.32 -0.44 -4.33 117.00 117.16 1mp5 n LEU 276 Ca -0.02 -1.29 0.04 0.00 -0.02 0.00 0.00 56.01 54.72 1mp5 n LEU 276 Cb 0.14 -0.31 0.21 0.00 -1.62 0.00 0.00 43.42 41.84 1mp5 n LEU 276 CO 0.33 0.65 0.64 -0.24 -1.22 0.00 0.00 177.39 177.55 1mp5 n SER 277 N 0.93 0.20 -2.46 -1.43 2.88 0.14 -1.64 113.62 112.25 1mp5 n SER 277 Ca 0.17 0.53 -0.34 0.00 -1.33 0.00 0.00 58.87 57.90 1mp5 n SER 277 Cb 0.42 -0.54 0.05 0.00 -0.75 0.00 0.00 64.21 63.39 1mp5 n SER 277 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1mp5 n LYS 278 N -1.75 2.89 -3.53 -1.46 2.85 -1.26 -4.80 118.16 111.10 1mp5 n LYS 278 Ca -0.01 -3.56 -0.08 0.00 -1.05 0.00 0.00 58.31 53.61 1mp5 n LYS 278 Cb 0.11 -2.28 -0.03 0.00 -0.65 0.00 0.00 35.03 32.18 1mp5 n LYS 278 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1mp5 s ASN 279 N -1.99 -0.34 0.14 -5.58 4.22 -0.65 -5.06 114.94 105.68 1mp5 s ASN 279 Ca 0.58 0.08 -0.25 0.00 -2.14 0.00 0.00 52.86 51.13 1mp5 s ASN 279 Cb 0.47 0.34 -0.01 0.00 1.28 0.00 0.00 41.25 43.32 1mp5 s ASN 279 CO -0.13 -0.52 1.63 -0.78 -2.04 0.00 0.00 177.10 175.26 1mp5 h ASP 280 N 2.11 -0.84 -0.90 3.54 -0.00 -1.93 -2.20 116.42 116.20 1mp5 h ASP 280 Ca -0.20 0.13 0.15 0.00 -0.00 0.00 0.00 57.03 57.11 1mp5 h ASP 280 Cb 1.22 0.37 -0.10 0.00 -0.00 0.00 0.00 39.33 40.82 1mp5 h ASP 280 CO 0.30 -0.32 0.50 0.22 -0.00 0.00 0.00 179.24 179.93 1mp5 h TYR 281 N -0.35 0.87 -0.18 0.28 3.20 -1.95 0.55 116.97 119.39 1mp5 h TYR 281 Ca 0.10 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.91 1mp5 h TYR 281 Cb 0.49 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 1mp5 h TYR 281 CO -0.36 0.23 -0.28 0.78 -1.64 0.00 0.00 178.16 176.88 1mp5 h GLY 282 N 0.70 0.38 1.33 1.82 0.00 -1.52 -2.47 103.07 103.30 1mp5 h GLY 282 Ca 0.49 -0.31 -0.17 0.00 0.00 0.00 0.00 47.33 47.34 1mp5 h GLY 282 CO -0.35 0.28 -0.55 0.50 0.00 0.00 0.00 176.54 176.41 1mp5 h LYS 283 N 0.31 0.71 -0.88 4.80 1.57 -0.53 -2.11 116.57 120.44 1mp5 h LYS 283 Ca 0.04 -0.45 0.05 0.00 -1.87 0.00 0.00 60.65 58.42 1mp5 h LYS 283 Cb 0.66 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.97 1mp5 h LYS 283 CO 0.05 1.07 0.56 -0.92 -0.57 0.00 0.00 179.45 179.64 1mp5 h TYR 284 N 0.54 1.04 0.12 -1.35 3.20 -0.59 0.66 116.97 120.59 1mp5 h TYR 284 Ca 0.01 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 1mp5 h TYR 284 Cb 1.13 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 39.06 1mp5 h TYR 284 CO 0.06 0.56 -0.06 -0.07 -1.64 0.00 0.00 178.16 177.01 1mp5 h LEU 285 N 1.05 -0.14 -0.46 2.82 3.38 -1.25 -1.94 115.31 118.77 1mp5 h LEU 285 Ca 0.37 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 1mp5 h LEU 285 Cb 0.09 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1mp5 h LEU 285 CO -0.15 0.10 0.28 -0.07 0.09 0.00 0.00 178.44 178.70 1mp5 h LEU 286 N -0.38 0.55 -2.16 1.67 3.38 -1.13 -1.65 115.31 115.58 1mp5 h LEU 286 Ca -0.02 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.92 1mp5 h LEU 286 Cb 0.31 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 1mp5 h LEU 286 CO 0.03 0.43 0.03 0.50 0.09 0.00 0.00 178.44 179.52 1mp5 h LYS 287 N 0.61 0.00 -0.50 1.13 3.64 -0.83 -1.68 116.57 118.94 1mp5 h LYS 287 Ca 0.17 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.43 1mp5 h LYS 287 Cb -0.02 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 1mp5 h LYS 287 CO -0.03 0.00 -0.15 1.98 -2.27 0.00 0.00 179.45 178.98 1mp5 h MET 288 N 0.00 0.96 -0.03 1.90 4.05 -0.48 -3.51 114.93 117.82 1mp5 h MET 288 Ca 0.02 -0.37 0.00 0.00 -0.28 0.00 0.00 59.70 59.07 1mp5 h MET 288 Cb 0.07 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 30.82 1mp5 h MET 288 CO -0.00 1.03 0.00 1.33 0.23 0.00 0.00 176.91 179.50