#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r8y n ASP 2 N 0.00 3.75 -3.66 6.55 2.03 -1.26 -5.03 116.55 118.93 1r8y n ASP 2 Ca 0.00 -3.32 -0.00 0.00 0.52 0.00 0.00 54.79 51.99 1r8y n ASP 2 Cb 0.00 -0.80 -0.01 0.00 -0.72 0.00 0.00 41.12 39.60 1r8y n ASP 2 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1r8y s SER 3 N -1.76 -0.10 1.03 1.67 1.04 -1.26 -5.18 113.70 109.15 1r8y s SER 3 Ca 0.32 -0.22 -0.14 0.00 0.48 0.00 0.00 55.95 56.40 1r8y s SER 3 Cb 0.04 0.27 0.13 0.00 0.10 0.00 0.00 66.02 66.56 1r8y s SER 3 CO -0.08 -0.49 0.60 1.33 0.98 0.00 0.00 173.24 175.58 1r8y n VAL 4 N -0.47 0.00 -2.73 5.02 0.24 -1.26 -5.01 118.33 114.12 1r8y n VAL 4 Ca -0.08 -0.23 -0.09 0.00 -2.04 0.00 0.00 64.34 61.91 1r8y n VAL 4 Cb 0.62 -0.78 0.07 0.00 -1.47 0.00 0.00 33.84 32.28 1r8y n VAL 4 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1r8y n TYR 5 N -4.24 -0.95 -0.39 6.34 4.02 -1.26 -5.14 117.16 115.54 1r8y n TYR 5 Ca 0.06 -2.42 -0.13 0.00 -0.01 0.00 0.00 57.90 55.40 1r8y n TYR 5 Cb 0.55 0.70 0.01 0.00 -0.02 0.00 0.00 39.34 40.58 1r8y n TYR 5 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1r8y n ARG 6 N -0.23 0.00 0.11 -0.72 1.74 -1.26 -4.94 116.66 111.36 1r8y n ARG 6 Ca 0.05 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.90 1r8y n ARG 6 Cb 0.81 -0.33 -0.15 0.00 -1.02 0.00 0.00 32.46 31.77 1r8y n ARG 6 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1r8y h THR 7 N -0.06 1.37 -3.99 0.55 2.02 -2.07 -3.46 112.91 107.27 1r8y h THR 7 Ca -0.14 -2.64 -0.11 0.00 0.77 0.00 0.00 66.41 64.30 1r8y h THR 7 Cb 0.46 3.11 -0.15 0.00 -1.74 0.00 0.00 68.15 69.83 1r8y h THR 7 CO 0.13 0.77 -0.54 0.00 0.37 0.00 0.00 175.52 176.25 1r8y s ARG 8 N -2.53 0.67 0.49 6.66 1.70 -1.26 -5.15 118.95 119.53 1r8y s ARG 8 Ca -0.11 -1.01 -0.23 0.00 -0.47 0.00 0.00 55.73 53.92 1r8y s ARG 8 Cb 0.03 0.26 -0.07 0.00 -0.57 0.00 0.00 34.95 34.59 1r8y s ARG 8 CO 0.90 -0.17 1.19 0.43 -1.08 0.00 0.00 175.30 176.58 1r8y n SER 9 N 0.25 2.02 -4.70 -2.89 7.64 -1.26 -4.88 113.62 109.80 1r8y n SER 9 Ca -0.16 1.00 -0.43 0.00 1.01 0.00 0.00 58.87 60.28 1r8y n SER 9 Cb 0.61 -1.48 -0.03 0.00 -1.01 0.00 0.00 64.21 62.30 1r8y n SER 9 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1r8y n LEU 10 N -0.29 3.76 0.00 -3.43 4.77 -1.26 -2.72 117.00 117.83 1r8y n LEU 10 Ca 0.10 1.04 0.00 0.00 -0.03 0.00 0.00 56.01 57.12 1r8y n LEU 10 Cb 0.43 -1.52 0.00 0.00 -2.33 0.00 0.00 43.42 39.99 1r8y n LEU 10 CO 0.55 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 1r8y n GLY 11 N 3.92 0.39 3.98 -0.72 0.00 -1.26 -5.07 105.19 106.43 1r8y n GLY 11 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 1r8y n GLY 11 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1r8y s VAL 12 N -2.10 2.10 0.04 1.61 -7.23 -1.10 -5.08 120.40 108.64 1r8y s VAL 12 Ca 0.00 -0.52 -0.07 0.00 -1.81 0.00 0.00 61.98 59.58 1r8y s VAL 12 Cb 0.00 -2.59 -0.00 0.00 0.56 0.00 0.00 36.38 34.35 1r8y s VAL 12 CO 0.00 0.00 0.14 0.00 -0.31 0.00 0.00 175.10 174.93 1r8y s ALA 13 N -3.25 -0.19 0.38 1.32 0.00 -1.26 -4.58 121.76 114.18 1r8y s ALA 13 Ca 0.67 -0.44 0.07 0.00 0.00 0.00 0.00 51.96 52.26 1r8y s ALA 13 Cb -0.05 0.26 -0.07 0.00 0.00 0.00 0.00 23.12 23.26 1r8y s ALA 13 CO 0.46 -0.34 0.01 0.00 0.00 0.00 0.00 175.76 175.88 1r8y s ALA 14 N -2.60 2.92 -0.09 0.00 0.00 -1.26 -5.09 121.76 115.64 1r8y s ALA 14 Ca -0.05 -2.21 -0.21 0.00 0.00 0.00 0.00 51.96 49.49 1r8y s ALA 14 Cb -0.01 0.26 -0.17 0.00 0.00 0.00 0.00 23.12 23.19 1r8y s ALA 14 CO -0.04 -0.14 0.72 0.93 0.00 0.00 0.00 175.76 177.23 1r8y h GLU 15 N 1.90 -0.07 -0.86 0.00 3.07 -2.02 -3.28 114.58 113.32 1r8y h GLU 15 Ca -0.43 0.01 0.21 0.00 -0.50 0.00 0.00 59.36 58.64 1r8y h GLU 15 Cb 1.24 0.02 -0.12 0.00 -0.84 0.00 0.00 28.75 29.05 1r8y h GLU 15 CO 0.77 0.51 0.32 0.78 -1.40 0.00 0.00 179.01 179.99 1r8y h GLY 16 N -0.90 1.40 -4.46 -3.84 0.00 -2.08 -3.46 103.07 89.72 1r8y h GLY 16 Ca -0.01 -0.12 -0.59 0.00 0.00 0.00 0.00 47.33 46.62 1r8y h GLY 16 CO 0.01 -0.26 -0.23 1.08 0.00 0.00 0.00 176.54 177.14 1r8y s LEU 17 N -10.53 4.33 0.54 3.11 1.43 -1.24 -5.07 118.68 111.25 1r8y s LEU 17 Ca -0.12 0.80 -0.21 0.00 -1.03 0.00 0.00 54.13 53.57 1r8y s LEU 17 Cb 0.24 -3.07 -0.05 0.00 0.03 0.00 0.00 46.19 43.35 1r8y s LEU 17 CO 0.77 0.14 1.22 -2.84 0.23 0.00 0.00 176.35 175.88 1r8y s PRO 18 N -2.03 3.25 0.68 1.29 0.02 -1.26 -4.62 135.00 132.33 1r8y s PRO 18 Ca 0.35 1.88 -0.16 0.00 0.02 0.00 0.00 61.00 63.08 1r8y s PRO 18 Cb -0.14 -2.13 0.01 0.00 0.02 0.00 0.00 34.50 32.26 1r8y s PRO 18 CO 0.19 -0.99 1.21 -0.51 -0.33 0.00 0.00 177.00 176.56 1r8y s ASP 19 N -1.41 4.58 0.00 2.53 1.01 -1.26 -4.88 116.67 117.24 1r8y s ASP 19 Ca 0.72 2.37 0.00 0.00 0.71 0.00 0.00 52.55 56.35 1r8y s ASP 19 Cb -0.31 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.02 1r8y s ASP 19 CO 0.36 -2.00 0.00 0.00 0.21 0.00 0.00 175.17 173.73 1r8y n GLN 20 N -2.30 0.00 -0.12 8.23 1.13 -1.26 -0.71 117.38 122.35 1r8y n GLN 20 Ca 0.14 0.00 0.09 0.00 -1.94 0.00 0.00 57.00 55.29 1r8y n GLN 20 Cb 0.50 0.00 0.14 0.00 0.11 0.00 0.00 30.24 30.99 1r8y n GLN 20 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1r8y n TYR 21 N 0.00 0.00 0.32 1.08 4.01 -1.26 -4.83 117.16 116.48 1r8y n TYR 21 Ca 0.00 -1.01 0.19 0.00 -0.16 0.00 0.00 57.90 56.92 1r8y n TYR 21 Cb 0.00 -0.16 1.03 0.00 -0.31 0.00 0.00 39.34 39.90 1r8y n TYR 21 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1r8y h ALA 22 N 0.08 1.23 -0.38 -0.72 0.00 -1.25 -2.54 119.26 115.67 1r8y h ALA 22 Ca -0.00 -0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.63 1r8y h ALA 22 Cb 1.01 0.00 -0.37 0.00 0.00 0.00 0.00 17.79 18.43 1r8y h ALA 22 CO 0.00 -0.16 -0.98 -0.40 0.00 0.00 0.00 179.25 177.71 1r8y n ASP 23 N -3.11 2.23 -4.90 0.00 5.75 -1.26 -4.67 116.55 110.59 1r8y n ASP 23 Ca -0.02 -2.57 -0.28 0.00 -0.01 0.00 0.00 54.79 51.90 1r8y n ASP 23 Cb 0.21 -0.42 0.05 0.00 -1.03 0.00 0.00 41.12 39.94 1r8y n ASP 23 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1r8y s GLY 24 N -3.37 1.62 0.18 6.12 0.00 -0.96 -4.93 107.32 105.99 1r8y s GLY 24 Ca 0.35 -0.60 -0.13 0.00 0.00 0.00 0.00 44.72 44.34 1r8y s GLY 24 CO -0.05 -0.24 1.82 1.05 0.00 0.00 0.00 173.10 175.68 1r8y h GLU 25 N -0.53 0.63 -0.01 2.90 4.11 -1.96 -2.58 114.58 117.13 1r8y h GLU 25 Ca -0.45 -0.04 -0.00 0.00 0.07 0.00 0.00 59.36 58.94 1r8y h GLU 25 Cb 1.27 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.38 1r8y h GLU 25 CO 0.62 0.41 0.00 0.00 0.07 0.00 0.00 179.01 180.12 1r8y h ALA 26 N 1.25 0.01 -0.89 1.06 0.00 -1.95 -1.29 119.26 117.46 1r8y h ALA 26 Ca 0.23 -0.05 0.18 0.00 0.00 0.00 0.00 54.91 55.26 1r8y h ALA 26 Cb 0.04 -0.00 -0.11 0.00 0.00 0.00 0.00 17.79 17.73 1r8y h ALA 26 CO -0.11 -0.44 0.45 0.00 0.00 0.00 0.00 179.25 179.16 1r8y h ALA 27 N 0.90 1.39 -0.38 0.00 0.00 -1.83 0.56 119.26 119.90 1r8y h ALA 27 Ca 0.00 0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1r8y h ALA 27 Cb 0.11 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1r8y h ALA 27 CO -0.00 -0.16 0.21 -0.09 0.00 0.00 0.00 179.25 179.21 1r8y h ARG 28 N 0.58 0.41 -0.20 0.00 9.65 -0.85 -1.17 114.38 122.79 1r8y h ARG 28 Ca 0.51 -0.02 -0.17 0.00 -1.10 0.00 0.00 59.98 59.19 1r8y h ARG 28 Cb 0.82 -0.09 -0.00 0.00 -1.39 0.00 0.00 29.97 29.30 1r8y h ARG 28 CO -0.42 0.27 -0.58 0.28 2.80 0.00 0.00 179.97 182.33 1r8y h VAL 29 N 0.43 1.31 -0.37 0.20 2.07 -0.70 -2.96 116.25 116.23 1r8y h VAL 29 Ca 0.15 -1.82 -0.01 0.00 0.82 0.00 0.00 66.70 65.85 1r8y h VAL 29 Cb 0.03 1.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 1r8y h VAL 29 CO -0.08 0.57 0.21 -0.25 0.02 0.00 0.00 177.57 178.03 1r8y h TRP 30 N 0.49 0.49 -0.20 1.57 7.01 -0.40 -1.22 115.95 123.70 1r8y h TRP 30 Ca 0.00 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.00 1r8y h TRP 30 Cb 1.15 -0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 28.04 1r8y h TRP 30 CO 0.06 0.34 0.10 1.96 -2.79 0.00 0.00 178.44 178.11 1r8y h GLN 31 N 0.51 0.28 -0.75 2.65 4.20 -1.05 0.01 115.11 120.97 1r8y h GLN 31 Ca 0.13 -0.04 0.16 0.00 0.06 0.00 0.00 58.65 58.97 1r8y h GLN 31 Cb 0.01 -0.05 -0.11 0.00 0.30 0.00 0.00 27.48 27.63 1r8y h GLN 31 CO -0.02 0.29 0.22 -0.07 -0.67 0.00 0.00 178.83 178.57 1r8y h LEU 32 N 0.20 0.09 0.78 1.46 3.38 -1.43 -0.86 115.31 118.93 1r8y h LEU 32 Ca 0.07 0.14 -0.04 0.00 0.09 0.00 0.00 57.88 58.14 1r8y h LEU 32 Cb 0.09 0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.02 1r8y h LEU 32 CO -0.01 -0.00 -0.38 0.22 0.09 0.00 0.00 178.44 178.36 1r8y h TYR 33 N 0.32 -0.98 0.00 1.13 3.20 -0.42 0.32 116.97 120.53 1r8y h TYR 33 Ca 0.42 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.27 1r8y h TYR 33 Cb 0.71 0.32 0.00 0.00 1.54 0.00 0.00 36.73 39.30 1r8y h TYR 33 CO -0.23 -0.59 0.00 0.44 -1.64 0.00 0.00 178.16 176.14 1r8y n ILE 34 N -5.50 1.33 -0.06 1.81 -5.35 -0.08 -2.29 119.36 109.22 1r8y n ILE 34 Ca -0.14 0.62 -0.03 0.00 -0.27 0.00 0.00 62.75 62.92 1r8y n ILE 34 Cb 0.42 -1.61 -0.11 0.00 -1.74 0.00 0.00 39.64 36.61 1r8y n ILE 34 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1r8y n GLY 35 N -1.24 -0.71 2.23 3.28 0.00 -0.36 -4.61 105.19 103.78 1r8y n GLY 35 Ca -0.01 -0.27 -0.27 0.00 0.00 0.00 0.00 46.02 45.47 1r8y n GLY 35 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1r8y n ASP 36 N -2.41 5.50 -3.60 1.61 9.92 0.09 -4.20 116.55 123.45 1r8y n ASP 36 Ca -0.18 -3.76 -0.27 0.00 -0.53 0.00 0.00 54.79 50.05 1r8y n ASP 36 Cb 0.83 -0.52 -0.10 0.00 -0.64 0.00 0.00 41.12 40.70 1r8y n ASP 36 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1r8y n THR 37 N -0.68 1.82 -2.76 -3.53 -1.04 -1.23 -3.08 114.28 103.77 1r8y n THR 37 Ca 0.47 -4.97 -0.09 0.00 -2.04 0.00 0.00 64.05 57.41 1r8y n THR 37 Cb 0.81 -2.11 0.08 0.00 -1.82 0.00 0.00 70.33 67.29 1r8y n THR 37 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1r8y n ARG 38 N 1.38 1.04 -3.84 -2.82 3.00 -1.26 -4.85 116.66 109.31 1r8y n ARG 38 Ca 0.26 -2.04 -0.30 0.00 -0.01 0.00 0.00 57.85 55.75 1r8y n ARG 38 Cb 0.39 -0.95 -0.15 0.00 0.00 0.00 0.00 32.46 31.75 1r8y n ARG 38 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1r8y s SER 39 N -1.37 4.11 0.04 0.55 1.04 -1.26 -5.04 113.70 111.77 1r8y s SER 39 Ca 0.23 -1.63 -0.30 0.00 0.48 0.00 0.00 55.95 54.73 1r8y s SER 39 Cb 0.31 -1.10 -0.06 0.00 0.10 0.00 0.00 66.02 65.27 1r8y s SER 39 CO -0.06 -0.37 1.40 -0.60 0.98 0.00 0.00 173.24 174.60 1r8y s ARG 40 N 1.41 4.30 0.29 4.02 3.52 -1.26 -1.38 118.95 129.84 1r8y s ARG 40 Ca 0.06 2.00 -0.30 0.00 -0.13 0.00 0.00 55.73 57.37 1r8y s ARG 40 Cb -0.18 -3.47 -0.11 0.00 -1.56 0.00 0.00 34.95 29.63 1r8y s ARG 40 CO -0.16 -0.53 1.53 0.95 -0.81 0.00 0.00 175.30 176.28 1r8y s THR 41 N 1.99 2.26 0.22 4.11 -4.23 0.18 -4.89 115.64 115.27 1r8y s THR 41 Ca 0.64 0.22 -0.07 0.00 -1.18 0.00 0.00 61.69 61.30 1r8y s THR 41 Cb -0.33 -3.14 0.17 0.00 1.34 0.00 0.00 72.50 70.54 1r8y s THR 41 CO 0.28 0.04 1.80 0.00 -0.54 0.00 0.00 174.62 176.20 1r8y h ALA 42 N 4.73 1.08 -0.53 3.99 0.00 -1.92 -2.50 119.26 124.12 1r8y h ALA 42 Ca -0.47 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.30 1r8y h ALA 42 Cb 1.22 -0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.63 1r8y h ALA 42 CO 0.77 0.66 -0.31 0.39 0.00 0.00 0.00 179.25 180.76 1r8y n GLU 43 N -4.29 -0.23 0.22 0.00 -0.58 -1.26 -1.53 120.64 112.97 1r8y n GLU 43 Ca 0.08 1.00 -0.08 0.00 -0.42 0.00 0.00 57.16 57.73 1r8y n GLU 43 Cb 0.17 -1.48 -0.04 0.00 -0.57 0.00 0.00 31.44 29.52 1r8y n GLU 43 CO 0.00 0.00 0.00 -0.92 -0.48 0.00 0.00 177.13 175.73 1r8y h TYR 44 N 0.00 -0.51 -1.06 -0.32 3.20 -1.69 -1.86 116.97 114.73 1r8y h TYR 44 Ca 0.08 -0.01 0.28 0.00 3.14 0.00 0.00 58.73 62.22 1r8y h TYR 44 Cb 0.22 0.17 -0.10 0.00 1.54 0.00 0.00 36.73 38.55 1r8y h TYR 44 CO -0.74 -0.32 0.67 -0.22 -1.64 0.00 0.00 178.16 175.92 1r8y h LYS 45 N -0.57 0.38 -0.22 1.82 3.64 -1.38 0.41 116.57 120.65 1r8y h LYS 45 Ca -0.06 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.25 1r8y h LYS 45 Cb 0.42 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1r8y h LYS 45 CO 0.09 0.25 -0.08 0.00 -2.27 0.00 0.00 179.45 177.44 1r8y h ALA 46 N 1.63 0.31 0.52 5.00 0.00 -1.17 -2.60 119.26 122.95 1r8y h ALA 46 Ca 0.62 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 55.23 1r8y h ALA 46 Cb 1.56 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 19.28 1r8y h ALA 46 CO -0.33 0.12 -0.25 2.35 0.00 0.00 0.00 179.25 181.15 1r8y h TRP 47 N 0.16 -0.64 -0.28 0.00 7.01 0.63 0.47 115.95 123.30 1r8y h TRP 47 Ca 0.05 -0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.07 1r8y h TRP 47 Cb 0.56 0.21 -0.03 0.00 -2.10 0.00 0.00 29.16 27.80 1r8y h TRP 47 CO 0.06 -0.35 0.11 1.25 -2.79 0.00 0.00 178.44 176.71 1r8y h LEU 48 N -0.82 0.13 -1.17 0.65 5.85 -1.35 0.34 115.31 118.94 1r8y h LEU 48 Ca -0.07 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.62 1r8y h LEU 48 Cb 0.58 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 1r8y h LEU 48 CO 0.12 0.11 -0.04 -0.07 -0.34 0.00 0.00 178.44 178.21 1r8y h LEU 49 N 0.24 0.50 0.86 2.25 3.38 -1.53 -0.80 115.31 120.21 1r8y h LEU 49 Ca 0.12 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1r8y h LEU 49 Cb 0.08 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 40.71 1r8y h LEU 49 CO -0.12 0.60 -0.42 1.23 0.09 0.00 0.00 178.44 179.81 1r8y h GLY 50 N 0.87 -1.22 0.27 0.83 0.00 0.11 -2.72 103.07 101.20 1r8y h GLY 50 Ca 0.10 0.46 -0.00 0.00 0.00 0.00 0.00 47.33 47.89 1r8y h GLY 50 CO 0.02 -0.44 -0.44 -2.00 0.00 0.00 0.00 176.54 173.68 1r8y h LEU 51 N -1.17 -1.25 -0.77 3.11 5.85 -0.27 0.18 115.31 120.99 1r8y h LEU 51 Ca -0.12 0.12 0.17 0.00 0.84 0.00 0.00 57.88 58.89 1r8y h LEU 51 Cb 0.90 0.44 -0.12 0.00 0.37 0.00 0.00 40.66 42.25 1r8y h LEU 51 CO 0.19 -0.52 0.19 -0.07 -0.34 0.00 0.00 178.44 177.89 1r8y h LEU 52 N -0.75 0.01 -0.18 2.25 3.38 -1.21 -0.40 115.31 118.41 1r8y h LEU 52 Ca -0.03 0.16 -0.22 0.00 0.09 0.00 0.00 57.88 57.88 1r8y h LEU 52 Cb 0.69 0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 1r8y h LEU 52 CO -0.14 -0.06 -0.95 0.03 0.09 0.00 0.00 178.44 177.41 1r8y h ARG 53 N 0.26 0.24 -0.85 1.13 3.08 -1.41 0.73 114.38 117.56 1r8y h ARG 53 Ca 0.44 -0.29 0.17 0.00 0.07 0.00 0.00 59.98 60.37 1r8y h ARG 53 Cb 0.78 0.09 -0.10 0.00 0.08 0.00 0.00 29.97 30.81 1r8y h ARG 53 CO -0.54 1.03 0.41 0.37 -1.07 0.00 0.00 179.97 180.17 1r8y h GLN 54 N 0.12 0.52 -0.67 0.04 4.15 0.91 -1.45 115.11 118.74 1r8y h GLN 54 Ca -0.06 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.33 1r8y h GLN 54 Cb 1.61 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 29.18 1r8y h GLN 54 CO 0.15 0.34 0.00 0.72 -1.93 0.00 0.00 178.83 178.11 1r8y n HIS 55 N -4.94 1.33 -2.60 3.99 8.25 -0.38 -4.95 115.22 115.92 1r8y n HIS 55 Ca 0.18 -0.58 -0.21 0.00 -0.26 0.00 0.00 57.72 56.85 1r8y n HIS 55 Cb 0.50 -0.17 0.00 0.00 1.12 0.00 0.00 29.99 31.44 1r8y n HIS 55 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1r8y n GLY 56 N 1.26 -0.51 3.81 -1.41 0.00 -0.55 -4.98 105.19 102.81 1r8y n GLY 56 Ca 0.25 0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.98 1r8y n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r8y n HIS 58 N -1.02 0.00 -2.83 0.00 -0.00 -1.26 -4.74 115.22 105.37 1r8y n HIS 58 Ca 0.08 0.00 -0.43 0.00 0.46 0.00 0.00 57.72 57.83 1r8y n HIS 58 Cb 0.53 0.34 -0.04 0.00 -0.12 0.00 0.00 29.99 30.70 1r8y n HIS 58 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1r8y s ARG 59 N -1.74 3.50 0.02 1.57 0.52 -1.26 -2.27 118.95 119.29 1r8y s ARG 59 Ca 0.00 0.11 0.04 0.00 -0.52 0.00 0.00 55.73 55.36 1r8y s ARG 59 Cb 0.00 -3.94 -0.03 0.00 0.52 0.00 0.00 34.95 31.50 1r8y s ARG 59 CO 0.00 -1.24 -0.07 0.08 0.02 0.00 0.00 175.30 174.09 1r8y s VAL 60 N 3.73 3.58 -0.19 3.52 1.01 -0.35 -0.46 120.40 131.24 1r8y s VAL 60 Ca 0.36 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.48 1r8y s VAL 60 Cb -0.10 -2.58 0.02 0.00 0.00 0.00 0.00 36.38 33.72 1r8y s VAL 60 CO 0.26 0.34 -0.18 -0.22 0.00 0.00 0.00 175.10 175.29 1r8y s LEU 61 N -1.56 2.24 -0.42 3.92 2.96 -0.61 -1.02 118.68 124.20 1r8y s LEU 61 Ca 0.18 -0.67 -0.13 0.00 -0.22 0.00 0.00 54.13 53.29 1r8y s LEU 61 Cb -0.11 -1.50 0.05 0.00 0.50 0.00 0.00 46.19 45.12 1r8y s LEU 61 CO 0.09 -0.01 0.29 -0.62 -1.32 0.00 0.00 176.35 174.78 1r8y s ASP 62 N 1.30 5.92 0.00 3.68 -1.08 -0.19 0.52 116.67 126.82 1r8y s ASP 62 Ca 0.04 -1.15 0.25 0.00 -0.52 0.00 0.00 52.55 51.17 1r8y s ASP 62 Cb -0.13 -2.09 0.54 0.00 -1.46 0.00 0.00 42.92 39.77 1r8y s ASP 62 CO -0.12 -0.50 1.46 1.33 0.52 0.00 0.00 175.17 177.86 1r8y n VAL 63 N 5.08 0.09 -3.15 1.11 0.24 -0.49 -1.40 118.33 119.81 1r8y n VAL 63 Ca -0.11 -0.44 -0.18 0.00 -2.04 0.00 0.00 64.34 61.56 1r8y n VAL 63 Cb 0.45 1.01 -0.03 0.00 -1.47 0.00 0.00 33.84 33.81 1r8y n VAL 63 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1r8y n ALA 64 N 0.91 2.27 -0.10 2.33 0.00 -1.21 -4.57 120.51 120.14 1r8y n ALA 64 Ca 0.16 -3.49 -0.06 0.00 0.00 0.00 0.00 53.44 50.05 1r8y n ALA 64 Cb 0.50 -0.91 -0.00 0.00 0.00 0.00 0.00 19.45 19.04 1r8y n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r8y n GLY 66 N -1.39 2.37 0.07 0.00 0.00 -1.26 -2.16 105.19 102.82 1r8y n GLY 66 Ca 0.01 -0.43 0.08 0.00 0.00 0.00 0.00 46.02 45.68 1r8y n GLY 66 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1r8y n THR 67 N 0.00 0.03 -1.66 2.61 -2.24 -1.25 -3.66 114.28 108.11 1r8y n THR 67 Ca 0.00 -0.04 -0.05 0.00 -2.27 0.00 0.00 64.05 61.69 1r8y n THR 67 Cb 0.00 -0.16 -0.01 0.00 -2.10 0.00 0.00 70.33 68.06 1r8y n THR 67 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r8y n GLY 68 N 0.77 0.44 0.22 3.38 0.00 -0.92 -3.34 105.19 105.75 1r8y n GLY 68 Ca 0.12 -0.75 -0.03 0.00 0.00 0.00 0.00 46.02 45.35 1r8y n GLY 68 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1r8y h VAL 69 N 0.00 1.28 -0.11 1.61 -1.51 -1.91 0.15 116.25 115.76 1r8y h VAL 69 Ca -0.11 -1.36 -0.23 0.00 -1.23 0.00 0.00 66.70 63.77 1r8y h VAL 69 Cb 0.74 1.47 0.01 0.00 -2.13 0.00 0.00 31.29 31.38 1r8y h VAL 69 CO 0.14 0.42 -0.82 0.44 -1.23 0.00 0.00 177.57 176.53 1r8y h ASP 70 N 0.35 0.90 -0.26 4.19 3.32 -1.93 -2.82 116.42 120.18 1r8y h ASP 70 Ca 0.05 -0.66 0.04 0.00 0.02 0.00 0.00 57.03 56.47 1r8y h ASP 70 Cb 0.73 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.97 1r8y h ASP 70 CO 0.06 1.43 0.03 0.28 -1.72 0.00 0.00 179.24 179.31 1r8y h SER 71 N 0.45 -0.04 -0.92 6.45 0.02 -1.85 -2.18 113.55 115.48 1r8y h SER 71 Ca -0.07 0.05 0.10 0.00 -0.84 0.00 0.00 61.79 61.03 1r8y h SER 71 Cb 1.46 0.08 -0.07 0.00 0.14 0.00 0.00 62.40 64.01 1r8y h SER 71 CO 0.17 0.02 0.59 0.40 -1.14 0.00 0.00 176.83 176.86 1r8y h ILE 72 N 0.12 0.96 -0.82 3.27 2.04 -0.70 0.18 117.51 122.56 1r8y h ILE 72 Ca 0.12 -0.31 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 1r8y h ILE 72 Cb 0.14 -0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 36.15 1r8y h ILE 72 CO -0.18 0.17 0.44 -0.03 0.00 0.00 0.00 178.15 178.55 1r8y h MET 73 N 0.92 1.15 0.12 2.37 4.05 -1.16 -1.15 114.93 121.22 1r8y h MET 73 Ca 0.43 -0.14 -0.01 0.00 -0.28 0.00 0.00 59.70 59.71 1r8y h MET 73 Cb 0.43 -0.22 0.00 0.00 -0.80 0.00 0.00 31.60 31.00 1r8y h MET 73 CO -0.19 0.85 -0.06 -0.07 0.23 0.00 0.00 176.91 177.67 1r8y h LEU 74 N 1.15 -0.13 -0.88 3.39 3.38 -0.39 -2.48 115.31 119.33 1r8y h LEU 74 Ca 0.29 -0.36 0.21 0.00 0.09 0.00 0.00 57.88 58.11 1r8y h LEU 74 Cb 0.04 0.03 -0.16 0.00 0.09 0.00 0.00 40.66 40.66 1r8y h LEU 74 CO -0.05 0.32 -0.08 0.58 0.09 0.00 0.00 178.44 179.31 1r8y h VAL 75 N -0.62 0.15 -0.48 1.22 2.07 -0.51 0.16 116.25 118.23 1r8y h VAL 75 Ca -0.02 -0.01 -0.05 0.00 0.82 0.00 0.00 66.70 67.44 1r8y h VAL 75 Cb 0.48 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 1r8y h VAL 75 CO 0.03 0.01 0.10 -0.33 0.02 0.00 0.00 177.57 177.40 1r8y h GLU 76 N 0.04 0.79 -0.06 1.57 5.08 -1.23 -2.87 114.58 117.89 1r8y h GLU 76 Ca 0.48 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 1r8y h GLU 76 Cb 0.86 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1r8y h GLU 76 CO -0.85 0.77 0.00 0.39 -1.00 0.00 0.00 179.01 178.33 1r8y n GLU 77 N -4.46 0.97 -0.53 2.33 -0.58 -0.00 -4.85 120.64 113.52 1r8y n GLU 77 Ca 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 1r8y n GLU 77 Cb 0.23 -1.03 0.00 0.00 -0.57 0.00 0.00 31.44 30.07 1r8y n GLU 77 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1r8y n GLY 78 N 0.44 0.76 3.66 0.62 0.00 -0.93 -5.05 105.19 104.69 1r8y n GLY 78 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1r8y n GLY 78 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r8y s PHE 79 N -2.94 1.95 -0.28 1.61 0.08 -1.08 -5.01 117.98 112.31 1r8y s PHE 79 Ca 0.00 1.36 -0.04 0.00 0.12 0.00 0.00 56.93 58.38 1r8y s PHE 79 Cb 0.00 -3.18 0.02 0.00 -0.57 0.00 0.00 43.02 39.29 1r8y s PHE 79 CO 0.00 -2.81 0.00 -1.54 -0.10 0.00 0.00 175.22 170.77 1r8y s SER 80 N -3.05 4.72 -0.07 1.36 1.04 -0.96 -4.54 113.70 112.20 1r8y s SER 80 Ca 0.65 -0.87 0.03 0.00 0.48 0.00 0.00 55.95 56.24 1r8y s SER 80 Cb -0.21 -1.76 0.01 0.00 0.10 0.00 0.00 66.02 64.17 1r8y s SER 80 CO 0.59 -0.18 -0.15 0.54 0.98 0.00 0.00 173.24 175.02 1r8y s VAL 81 N 1.38 1.37 -0.18 5.02 0.11 -1.26 -1.21 120.40 125.62 1r8y s VAL 81 Ca 0.00 -0.63 -0.08 0.00 -2.93 0.00 0.00 61.98 58.35 1r8y s VAL 81 Cb -0.17 -1.22 -0.04 0.00 -1.53 0.00 0.00 36.38 33.41 1r8y s VAL 81 CO -0.01 0.41 0.08 -0.32 -3.33 0.00 0.00 175.10 171.93 1r8y s MET 82 N 0.50 3.99 -0.06 1.54 1.75 -0.19 -2.48 119.30 124.35 1r8y s MET 82 Ca -0.14 -0.30 0.04 0.00 -1.25 0.00 0.00 55.69 54.04 1r8y s MET 82 Cb -0.16 -3.26 0.00 0.00 2.84 0.00 0.00 34.83 34.25 1r8y s MET 82 CO 0.05 0.32 -0.17 -1.12 -0.65 0.00 0.00 175.02 173.45 1r8y s SER 83 N 0.26 2.22 0.11 1.11 0.01 0.08 -1.02 113.70 116.46 1r8y s SER 83 Ca 0.05 -0.38 0.05 0.00 1.31 0.00 0.00 55.95 56.99 1r8y s SER 83 Cb -0.12 -0.83 -0.04 0.00 0.21 0.00 0.00 66.02 65.25 1r8y s SER 83 CO -0.00 0.12 -0.13 0.68 0.41 0.00 0.00 173.24 174.31 1r8y s VAL 84 N 0.29 1.23 0.13 3.43 -7.23 -0.49 -1.92 120.40 115.84 1r8y s VAL 84 Ca -0.10 -1.62 -0.13 0.00 -1.81 0.00 0.00 61.98 58.32 1r8y s VAL 84 Cb -0.14 -1.41 0.02 0.00 0.56 0.00 0.00 36.38 35.40 1r8y s VAL 84 CO 0.04 -0.40 0.34 -0.62 -0.31 0.00 0.00 175.10 174.15 1r8y s ASP 85 N -2.31 -0.09 0.00 4.85 -1.08 -1.15 -1.74 116.67 115.15 1r8y s ASP 85 Ca 0.06 -0.52 0.24 0.00 -0.52 0.00 0.00 52.55 51.81 1r8y s ASP 85 Cb -0.06 0.44 0.33 0.00 -1.46 0.00 0.00 42.92 42.18 1r8y s ASP 85 CO 0.02 -0.85 1.29 0.00 0.52 0.00 0.00 175.17 176.16 1r8y n ALA 86 N -0.19 3.79 -2.53 3.66 0.00 -0.77 -0.62 120.51 123.85 1r8y n ALA 86 Ca -0.14 -0.43 -0.42 0.00 0.00 0.00 0.00 53.44 52.45 1r8y n ALA 86 Cb 0.63 -1.02 -0.08 0.00 0.00 0.00 0.00 19.45 18.98 1r8y n ALA 86 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1r8y s SER 87 N -2.92 6.26 0.23 0.00 0.15 -1.26 -4.94 113.70 111.22 1r8y s SER 87 Ca 0.12 -0.31 -0.07 0.00 0.70 0.00 0.00 55.95 56.39 1r8y s SER 87 Cb 0.17 -2.25 0.20 0.00 -1.71 0.00 0.00 66.02 62.44 1r8y s SER 87 CO 0.71 -0.54 1.85 0.44 1.20 0.00 0.00 173.24 176.91 1r8y h ASP 88 N 8.61 1.13 -0.06 5.45 3.32 -1.98 0.08 116.42 132.97 1r8y h ASP 88 Ca -0.27 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 56.66 1r8y h ASP 88 Cb 1.12 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 40.37 1r8y h ASP 88 CO 0.79 0.91 0.02 0.11 -1.72 0.00 0.00 179.24 179.35 1r8y h LYS 89 N 1.26 0.15 0.06 3.56 1.57 -2.00 -0.12 116.57 121.05 1r8y h LYS 89 Ca 0.31 -0.02 -0.28 0.00 -1.87 0.00 0.00 60.65 58.79 1r8y h LYS 89 Cb 0.05 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 1r8y h LYS 89 CO -0.05 0.16 -1.54 0.52 -0.57 0.00 0.00 179.45 177.97 1r8y h MET 90 N 0.15 0.13 -0.87 3.15 2.86 -1.84 -3.37 114.93 115.14 1r8y h MET 90 Ca 0.04 -0.22 0.14 0.00 -2.06 0.00 0.00 59.70 57.60 1r8y h MET 90 Cb 0.08 0.08 -0.07 0.00 0.06 0.00 0.00 31.60 31.76 1r8y h MET 90 CO -0.00 1.10 0.56 -0.07 1.06 0.00 0.00 176.91 179.57 1r8y h LEU 91 N -0.53 0.64 -0.69 1.22 3.38 -0.81 -0.39 115.31 118.13 1r8y h LEU 91 Ca -0.37 0.04 0.15 0.00 0.09 0.00 0.00 57.88 57.78 1r8y h LEU 91 Cb 1.62 -0.09 -0.13 0.00 0.09 0.00 0.00 40.66 42.15 1r8y h LEU 91 CO -0.07 0.33 -0.15 1.17 0.09 0.00 0.00 178.44 179.82 1r8y n LYS 92 N -4.55 -0.06 0.10 1.13 4.81 -0.07 -0.98 118.16 118.54 1r8y n LYS 92 Ca 0.17 1.08 -0.03 0.00 -0.87 0.00 0.00 58.31 58.65 1r8y n LYS 92 Cb 0.45 -1.62 0.00 0.00 0.02 0.00 0.00 35.03 33.89 1r8y n LYS 92 CO 0.00 0.00 0.00 1.88 1.17 0.00 0.00 177.40 180.45 1r8y h TYR 93 N 0.00 0.00 -0.17 5.64 0.05 -1.27 -1.56 116.97 119.65 1r8y h TYR 93 Ca 0.34 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 59.05 1r8y h TYR 93 Cb 0.56 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.29 1r8y h TYR 93 CO -0.51 0.78 -0.18 0.00 -1.05 0.00 0.00 178.16 177.19 1r8y h ALA 94 N 1.22 0.25 -0.54 3.88 0.00 -1.06 -2.63 119.26 120.39 1r8y h ALA 94 Ca -0.01 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1r8y h ALA 94 Cb 1.49 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 1r8y h ALA 94 CO 0.10 0.17 0.22 -0.07 0.00 0.00 0.00 179.25 179.67 1r8y h LEU 95 N 0.07 0.71 -0.60 0.00 3.38 -1.10 -1.43 115.31 116.34 1r8y h LEU 95 Ca 0.03 -0.09 -0.14 0.00 0.09 0.00 0.00 57.88 57.77 1r8y h LEU 95 Cb 0.73 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1r8y h LEU 95 CO 0.05 0.64 -0.40 0.50 0.09 0.00 0.00 178.44 179.32 1r8y h LYS 96 N 0.78 0.67 -0.07 1.13 3.64 -1.31 -1.62 116.57 119.79 1r8y h LYS 96 Ca 0.19 -0.34 -0.06 0.00 -1.27 0.00 0.00 60.65 59.16 1r8y h LYS 96 Cb 0.15 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1r8y h LYS 96 CO -0.02 0.95 -0.21 1.49 -2.27 0.00 0.00 179.45 179.39 1r8y h GLU 97 N 0.55 0.26 -0.45 1.90 4.57 -1.07 -2.03 114.58 118.32 1r8y h GLU 97 Ca 0.05 -0.19 0.08 0.00 -1.18 0.00 0.00 59.36 58.12 1r8y h GLU 97 Cb 0.92 0.03 -0.07 0.00 -0.16 0.00 0.00 28.75 29.48 1r8y h GLU 97 CO 0.08 0.81 0.02 -0.09 -1.18 0.00 0.00 179.01 178.65 1r8y h ARG 98 N -0.24 0.13 -0.62 1.92 2.43 -1.25 -1.08 114.38 115.66 1r8y h ARG 98 Ca -0.01 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.09 1r8y h ARG 98 Cb 0.83 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.33 1r8y h ARG 98 CO 0.04 0.08 0.14 2.35 -1.51 0.00 0.00 179.97 181.08 1r8y h TRP 99 N 0.13 1.02 -0.01 2.20 2.91 -1.32 -1.46 115.95 119.41 1r8y h TRP 99 Ca 0.22 -0.11 -0.03 0.00 1.13 0.00 0.00 58.89 60.10 1r8y h TRP 99 Cb 0.32 -0.29 -0.00 0.00 -0.51 0.00 0.00 29.16 28.67 1r8y h TRP 99 CO -0.28 0.84 -0.12 -0.91 -1.03 0.00 0.00 178.44 176.95 1r8y h ASN 100 N 0.93 0.02 -0.56 2.65 2.35 -0.71 -2.66 115.58 117.60 1r8y h ASN 100 Ca 0.20 -0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.71 1r8y h ASN 100 Cb 0.34 -0.01 -0.14 0.00 0.05 0.00 0.00 38.32 38.57 1r8y h ASN 100 CO 0.00 0.14 0.17 0.54 -1.65 0.00 0.00 177.43 176.63 1r8y n ARG 101 N -4.39 2.46 0.28 0.81 1.74 -0.47 -4.78 116.66 112.31 1r8y n ARG 101 Ca -0.02 -3.07 0.18 0.00 -0.77 0.00 0.00 57.85 54.16 1r8y n ARG 101 Cb 0.20 -1.98 0.83 0.00 -1.02 0.00 0.00 32.46 30.48 1r8y n ARG 101 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 1r8y h ARG 102 N 1.44 0.00 -0.01 5.56 0.11 -1.02 -2.11 114.38 118.36 1r8y h ARG 102 Ca 0.29 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.37 1r8y h ARG 102 Cb 2.04 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.12 1r8y h ARG 102 CO 0.60 0.00 -0.55 1.63 0.10 0.00 0.00 179.97 181.75 1r8y n LYS 103 N -2.96 0.58 -2.70 0.08 5.02 -1.26 -4.37 118.16 112.55 1r8y n LYS 103 Ca -0.00 -0.43 -0.43 0.00 -2.02 0.00 0.00 58.31 55.43 1r8y n LYS 103 Cb 0.21 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.71 1r8y n LYS 103 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1r8y s GLU 104 N -2.71 4.31 0.27 1.97 2.02 -0.79 -4.97 118.70 118.79 1r8y s GLU 104 Ca 0.16 1.31 -0.03 0.00 0.02 0.00 0.00 54.97 56.44 1r8y s GLU 104 Cb 0.18 -3.61 0.35 0.00 0.10 0.00 0.00 34.13 31.15 1r8y s GLU 104 CO 0.65 -0.51 1.84 -1.35 0.02 0.00 0.00 175.26 175.91 1r8y h PRO 105 N 7.35 0.95 -0.43 0.39 0.11 -1.87 -1.31 132.00 137.20 1r8y h PRO 105 Ca -0.24 -0.17 0.01 0.00 0.11 0.00 0.00 66.00 65.71 1r8y h PRO 105 Cb 1.09 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.02 1r8y h PRO 105 CO 0.92 0.80 0.28 0.77 -0.21 0.00 0.00 178.00 180.56 1r8y h SER 106 N 0.93 0.49 0.64 -2.05 0.02 -1.93 -0.20 113.55 111.45 1r8y h SER 106 Ca 0.21 -0.01 -0.15 0.00 -0.84 0.00 0.00 61.79 61.00 1r8y h SER 106 Cb 0.22 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 1r8y h SER 106 CO -0.02 0.35 -0.70 -0.26 -1.14 0.00 0.00 176.83 175.06 1r8y h PHE 107 N 0.57 0.08 0.00 3.45 0.04 -1.55 -2.64 116.94 116.89 1r8y h PHE 107 Ca 0.16 -0.04 -0.00 0.00 2.80 0.00 0.00 57.97 60.89 1r8y h PHE 107 Cb -0.06 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.08 1r8y h PHE 107 CO -0.00 0.74 -0.02 0.22 -0.60 0.00 0.00 178.31 178.65 1r8y h ASP 108 N 0.04 0.00 -0.60 2.17 3.58 -0.54 -2.31 116.42 118.76 1r8y h ASP 108 Ca -0.01 0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.31 1r8y h ASP 108 Cb 1.24 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 42.22 1r8y h ASP 108 CO 0.10 0.02 0.14 0.59 -2.88 0.00 0.00 179.24 177.21 1r8y n ASN 109 N -4.48 4.78 -4.73 2.28 3.02 -0.93 -4.89 115.26 110.32 1r8y n ASN 109 Ca -0.03 -3.16 -0.37 0.00 -0.03 0.00 0.00 54.58 50.99 1r8y n ASN 109 Cb 0.11 -0.69 -0.06 0.00 -0.61 0.00 0.00 39.78 38.52 1r8y n ASN 109 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 1r8y s TRP 110 N -2.93 3.50 -0.23 3.10 -0.00 -0.87 -4.60 118.94 116.91 1r8y s TRP 110 Ca 0.52 0.78 -0.05 0.00 -0.00 0.00 0.00 56.10 57.35 1r8y s TRP 110 Cb 0.42 -2.46 -0.02 0.00 -0.00 0.00 0.00 33.47 31.41 1r8y s TRP 110 CO 0.13 0.22 0.00 0.08 -0.00 0.00 0.00 176.95 177.38 1r8y s VAL 111 N 0.49 3.82 -0.16 5.86 1.01 -1.04 -5.03 120.40 125.35 1r8y s VAL 111 Ca 0.22 -0.34 0.01 0.00 0.00 0.00 0.00 61.98 61.87 1r8y s VAL 111 Cb -0.14 -2.75 0.01 0.00 0.00 0.00 0.00 36.38 33.49 1r8y s VAL 111 CO 0.08 0.40 -0.19 -0.63 0.00 0.00 0.00 175.10 174.75 1r8y s ILE 112 N 1.41 2.26 0.14 2.22 1.01 -1.26 -0.74 121.20 126.23 1r8y s ILE 112 Ca 0.05 -0.90 -0.10 0.00 0.00 0.00 0.00 60.65 59.70 1r8y s ILE 112 Cb -0.15 -1.93 0.00 0.00 0.01 0.00 0.00 42.46 40.39 1r8y s ILE 112 CO 0.00 0.53 0.28 -0.70 0.00 0.00 0.00 174.94 175.06 1r8y s GLU 113 N 0.97 1.06 -0.04 2.79 2.56 -0.81 -5.01 118.70 120.21 1r8y s GLU 113 Ca -0.03 -1.03 -0.16 0.00 0.00 0.00 0.00 54.97 53.75 1r8y s GLU 113 Cb -0.15 0.39 -0.05 0.00 2.00 0.00 0.00 34.13 36.32 1r8y s GLU 113 CO -0.04 -0.38 0.43 -1.21 -0.56 0.00 0.00 175.26 173.50 1r8y s GLU 114 N -3.91 4.09 -0.24 4.30 2.02 -1.26 -2.93 118.70 120.77 1r8y s GLU 114 Ca 0.11 0.42 -0.22 0.00 0.02 0.00 0.00 54.97 55.30 1r8y s GLU 114 Cb 0.03 -3.30 0.06 0.00 0.10 0.00 0.00 34.13 31.03 1r8y s GLU 114 CO -0.05 0.50 0.65 0.00 0.02 0.00 0.00 175.26 176.37 1r8y s ALA 115 N -0.48 -1.60 -0.07 5.21 0.00 0.21 -4.85 121.76 120.18 1r8y s ALA 115 Ca 0.24 1.82 -0.01 0.00 0.00 0.00 0.00 51.96 54.01 1r8y s ALA 115 Cb -0.16 -1.06 -0.03 0.00 0.00 0.00 0.00 23.12 21.87 1r8y s ALA 115 CO 0.12 -0.31 -0.01 1.21 0.00 0.00 0.00 175.76 176.78 1r8y s ASN 116 N 0.35 5.12 0.33 0.00 3.84 -1.26 -1.85 114.94 121.47 1r8y s ASN 116 Ca -0.00 0.10 0.01 0.00 0.21 0.00 0.00 52.86 53.18 1r8y s ASN 116 Cb -0.04 -1.40 0.57 0.00 -0.55 0.00 0.00 41.25 39.82 1r8y s ASN 116 CO 0.01 0.36 1.95 -0.50 -2.79 0.00 0.00 177.10 176.13 1r8y h TRP 117 N 5.08 0.80 0.00 0.43 6.55 -1.94 0.16 115.95 127.02 1r8y h TRP 117 Ca -0.50 -0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.32 1r8y h TRP 117 Cb 1.19 -0.26 0.00 0.00 -0.86 0.00 0.00 29.16 29.23 1r8y h TRP 117 CO 0.62 0.56 0.00 1.28 -1.05 0.00 0.00 178.44 179.85 1r8y n LEU 118 N -4.38 0.71 -0.43 -4.49 4.77 -1.26 -3.02 117.00 108.90 1r8y n LEU 118 Ca 0.05 0.68 0.04 0.00 -0.03 0.00 0.00 56.01 56.76 1r8y n LEU 118 Cb 0.11 -0.60 0.05 0.00 -2.33 0.00 0.00 43.42 40.65 1r8y n LEU 118 CO 0.37 -0.61 0.35 0.35 -1.33 0.00 0.00 177.39 176.52 1r8y n THR 119 N -2.29 0.69 -0.21 -5.08 -2.24 -0.58 -4.88 114.28 99.69 1r8y n THR 119 Ca 0.02 -0.92 0.17 0.00 -2.27 0.00 0.00 64.05 61.04 1r8y n THR 119 Cb 0.22 0.27 0.49 0.00 -2.10 0.00 0.00 70.33 69.21 1r8y n THR 119 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1r8y h LEU 120 N 0.10 0.42 -1.45 3.22 5.85 -0.64 0.10 115.31 122.91 1r8y h LEU 120 Ca -0.01 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 1r8y h LEU 120 Cb 1.29 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.26 1r8y h LEU 120 CO 0.01 0.20 -0.15 -2.24 -0.34 0.00 0.00 178.44 175.91 1r8y h ASP 121 N 0.44 0.16 -0.16 1.25 -0.00 -1.85 -2.03 116.42 114.23 1r8y h ASP 121 Ca 0.42 -0.03 0.00 0.00 -0.00 0.00 0.00 57.03 57.42 1r8y h ASP 121 Cb 0.97 -0.04 0.00 0.00 -0.00 0.00 0.00 39.33 40.25 1r8y h ASP 121 CO -0.15 0.33 0.00 0.29 -0.00 0.00 0.00 179.24 179.71 1r8y n LYS 122 N -4.28 2.33 -0.04 4.15 5.02 0.23 -4.49 118.16 121.08 1r8y n LYS 122 Ca -0.01 -1.96 -0.05 0.00 -2.02 0.00 0.00 58.31 54.26 1r8y n LYS 122 Cb 0.27 -1.48 -0.06 0.00 -0.02 0.00 0.00 35.03 33.74 1r8y n LYS 122 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1r8y n ASP 123 N 1.29 3.06 -4.31 4.39 9.92 -0.50 -4.99 116.55 125.42 1r8y n ASP 123 Ca 0.16 -0.02 -0.31 0.00 -0.53 0.00 0.00 54.79 54.09 1r8y n ASP 123 Cb 0.58 0.37 -0.16 0.00 -0.64 0.00 0.00 41.12 41.27 1r8y n ASP 123 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1r8y s VAL 124 N -2.20 2.12 -1.19 2.53 1.01 -0.78 -4.93 120.40 116.96 1r8y s VAL 124 Ca -0.08 -1.07 -0.12 0.00 0.00 0.00 0.00 61.98 60.71 1r8y s VAL 124 Cb 0.03 -1.75 0.21 0.00 0.00 0.00 0.00 36.38 34.87 1r8y s VAL 124 CO 0.30 0.58 1.38 0.18 0.00 0.00 0.00 175.10 177.54 1r8y n LEU 125 N 2.60 5.44 -0.02 3.92 4.77 -1.26 -4.68 117.00 127.76 1r8y n LEU 125 Ca -0.17 -4.66 0.00 0.00 -0.03 0.00 0.00 56.01 51.16 1r8y n LEU 125 Cb 0.51 -1.56 0.01 0.00 -2.33 0.00 0.00 43.42 40.05 1r8y n LEU 125 CO 0.24 0.98 0.03 -1.20 -1.33 0.00 0.00 177.39 176.11 1r8y n SER 126 N 4.55 -0.02 0.00 -1.43 7.64 -1.26 -4.84 113.62 118.26 1r8y n SER 126 Ca 0.33 0.09 0.00 0.00 1.01 0.00 0.00 58.87 60.30 1r8y n SER 126 Cb 0.41 -0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.58 1r8y n SER 126 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1r8y n GLY 127 N -1.03 2.50 0.06 0.23 0.00 -1.26 -1.94 105.19 103.75 1r8y n GLY 127 Ca 0.01 -0.30 0.11 0.00 0.00 0.00 0.00 46.02 45.84 1r8y n GLY 127 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1r8y n ASP 128 N 5.79 0.36 0.00 1.61 8.00 -1.26 -5.02 116.55 126.03 1r8y n ASP 128 Ca 0.00 0.56 0.00 0.00 0.71 0.00 0.00 54.79 56.06 1r8y n ASP 128 Cb 0.00 -0.65 0.00 0.00 -0.02 0.00 0.00 41.12 40.45 1r8y n ASP 128 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1r8y n GLY 129 N 0.58 2.17 3.75 0.44 0.00 -0.82 -4.28 105.19 107.05 1r8y n GLY 129 Ca 0.04 -2.15 -0.30 0.00 0.00 0.00 0.00 46.02 43.61 1r8y n GLY 129 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r8y s PHE 130 N -1.73 3.13 0.39 1.61 0.40 0.11 -4.58 117.98 117.31 1r8y s PHE 130 Ca 0.00 0.04 0.08 0.00 -0.60 0.00 0.00 56.93 56.46 1r8y s PHE 130 Cb 0.00 -1.59 0.78 0.00 0.51 0.00 0.00 43.02 42.72 1r8y s PHE 130 CO 0.00 0.51 1.93 -0.44 0.70 0.00 0.00 175.22 177.92 1r8y h ASP 131 N 3.25 0.30 -3.65 1.36 3.32 -1.10 -2.24 116.42 117.66 1r8y h ASP 131 Ca -0.47 -0.05 -0.16 0.00 0.02 0.00 0.00 57.03 56.37 1r8y h ASP 131 Cb 1.17 -0.08 -0.26 0.00 0.22 0.00 0.00 39.33 40.38 1r8y h ASP 131 CO 0.64 0.40 -0.38 0.00 -1.72 0.00 0.00 179.24 178.17 1r8y s ALA 132 N -4.88 -0.75 -0.15 3.45 0.00 -1.04 -1.80 121.76 116.60 1r8y s ALA 132 Ca -0.06 0.98 0.02 0.00 0.00 0.00 0.00 51.96 52.90 1r8y s ALA 132 Cb 0.16 -0.59 0.01 0.00 0.00 0.00 0.00 23.12 22.70 1r8y s ALA 132 CO 0.74 -0.17 -0.20 0.08 0.00 0.00 0.00 175.76 176.20 1r8y s VAL 133 N 0.58 2.19 0.02 0.00 1.01 0.12 -1.57 120.40 122.76 1r8y s VAL 133 Ca -0.03 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.06 1r8y s VAL 133 Cb -0.05 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 1r8y s VAL 133 CO -0.03 0.54 -0.11 0.27 0.00 0.00 0.00 175.10 175.76 1r8y s ILE 134 N 0.86 3.30 -0.44 2.22 -4.36 0.18 -0.61 121.20 122.35 1r8y s ILE 134 Ca -0.06 -0.96 0.05 0.00 -0.26 0.00 0.00 60.65 59.43 1r8y s ILE 134 Cb -0.15 -2.43 0.17 0.00 1.25 0.00 0.00 42.46 41.31 1r8y s ILE 134 CO -0.03 0.36 0.51 0.00 0.24 0.00 0.00 174.94 176.03 1r8y s LEU 136 N 0.81 2.54 -0.78 0.00 1.43 -1.26 -2.37 118.68 119.06 1r8y s LEU 136 Ca 0.27 -1.41 -0.02 0.00 -1.03 0.00 0.00 54.13 51.93 1r8y s LEU 136 Cb -0.03 -1.01 0.00 0.00 0.03 0.00 0.00 46.19 45.19 1r8y s LEU 136 CO -0.09 -0.99 0.30 0.61 0.23 0.00 0.00 176.35 176.41 1r8y n GLY 137 N -1.54 0.08 2.39 -3.19 0.00 -1.26 -3.80 105.19 97.87 1r8y n GLY 137 Ca -0.09 -0.33 -0.17 0.00 0.00 0.00 0.00 46.02 45.43 1r8y n GLY 137 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1r8y n ASN 138 N -0.37 -4.81 0.21 1.61 5.15 -1.26 -4.89 115.26 110.91 1r8y n ASN 138 Ca -0.06 0.16 0.10 0.00 -0.60 0.00 0.00 54.58 54.18 1r8y n ASN 138 Cb 0.56 -4.10 0.31 0.00 -0.53 0.00 0.00 39.78 36.02 1r8y n ASN 138 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1r8y h SER 139 N 0.00 0.00 0.92 1.20 0.02 -1.81 -2.82 113.55 111.05 1r8y h SER 139 Ca -0.38 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.48 1r8y h SER 139 Cb 1.25 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.78 1r8y h SER 139 CO 0.47 0.17 -0.42 0.15 -1.14 0.00 0.00 176.83 176.06 1r8y h PHE 140 N 0.00 0.00 0.00 3.45 3.57 -1.88 -1.81 116.94 120.27 1r8y h PHE 140 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1r8y h PHE 140 Cb 0.93 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.67 1r8y h PHE 140 CO 0.00 0.42 0.00 0.00 -2.23 0.00 0.00 178.31 176.50 1r8y n ALA 141 N -2.29 1.11 0.18 2.41 0.00 -1.06 -1.73 120.51 119.12 1r8y n ALA 141 Ca 0.00 0.03 0.05 0.00 0.00 0.00 0.00 53.44 53.52 1r8y n ALA 141 Cb 0.55 -1.09 0.30 0.00 0.00 0.00 0.00 19.45 19.22 1r8y n ALA 141 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1r8y h HIS 142 N 0.00 0.00 -3.49 0.00 3.86 -1.49 0.60 115.15 114.62 1r8y h HIS 142 Ca 0.00 0.00 -0.57 0.00 -1.16 0.00 0.00 60.37 58.64 1r8y h HIS 142 Cb 0.04 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 28.45 1r8y h HIS 142 CO 0.00 0.40 0.89 -1.17 0.86 0.00 0.00 177.93 178.91 1r8y s LEU 143 N -7.05 3.79 0.92 2.43 2.96 -0.71 -4.74 118.68 116.29 1r8y s LEU 143 Ca 0.00 0.78 -0.12 0.00 -0.22 0.00 0.00 54.13 54.57 1r8y s LEU 143 Cb 0.11 -3.55 0.14 0.00 0.50 0.00 0.00 46.19 43.39 1r8y s LEU 143 CO 0.70 -1.06 1.13 -2.16 -1.32 0.00 0.00 176.35 173.64 1r8y s PRO 144 N 4.03 1.06 -1.14 0.98 0.04 -1.26 -4.64 135.00 134.07 1r8y s PRO 144 Ca 0.47 0.34 -0.06 0.00 0.04 0.00 0.00 61.00 61.79 1r8y s PRO 144 Cb -0.10 -1.83 0.26 0.00 0.04 0.00 0.00 34.50 32.88 1r8y s PRO 144 CO 0.23 -2.26 1.58 -3.47 0.04 0.00 0.00 177.00 173.12 1r8y n ASP 145 N -3.82 5.98 -0.01 6.66 2.03 -1.26 -4.78 116.55 121.34 1r8y n ASP 145 Ca 0.06 -3.30 -0.07 0.00 0.52 0.00 0.00 54.79 52.00 1r8y n ASP 145 Cb 0.59 -1.34 0.10 0.00 -0.72 0.00 0.00 41.12 39.75 1r8y n ASP 145 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1r8y h LYS 147 N 0.47 0.41 0.00 0.00 1.57 -2.01 -3.49 116.57 113.53 1r8y h LYS 147 Ca 0.04 -0.28 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 1r8y h LYS 147 Cb 0.91 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.26 1r8y h LYS 147 CO 0.08 0.89 0.00 0.41 -0.57 0.00 0.00 179.45 180.26 1r8y n GLY 148 N 0.31 3.06 3.74 3.86 0.00 -1.15 -5.05 105.19 109.96 1r8y n GLY 148 Ca -0.03 -0.83 -0.34 0.00 0.00 0.00 0.00 46.02 44.81 1r8y n GLY 148 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1r8y s ASP 149 N 0.00 4.58 -0.10 1.61 1.47 -1.26 -4.90 116.67 118.07 1r8y s ASP 149 Ca 0.00 2.25 0.00 0.00 1.18 0.00 0.00 52.55 55.98 1r8y s ASP 149 Cb 0.00 -2.58 0.09 0.00 -0.34 0.00 0.00 42.92 40.09 1r8y s ASP 149 CO 0.00 -2.00 1.69 0.00 0.68 0.00 0.00 175.17 175.54 1r8y n GLN 150 N -2.50 1.26 -0.35 2.11 6.02 -1.26 -4.49 117.38 118.17 1r8y n GLN 150 Ca 0.13 -0.54 0.10 0.00 -0.01 0.00 0.00 57.00 56.67 1r8y n GLN 150 Cb 0.51 -1.21 0.27 0.00 1.02 0.00 0.00 30.24 30.83 1r8y n GLN 150 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1r8y h SER 151 N 0.79 0.82 0.10 1.08 4.64 -1.98 -1.48 113.55 117.51 1r8y h SER 151 Ca 0.11 0.08 -0.16 0.00 -0.47 0.00 0.00 61.79 61.34 1r8y h SER 151 Cb 1.10 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.11 1r8y h SER 151 CO 0.24 0.36 -0.56 -0.33 -0.87 0.00 0.00 176.83 175.67 1r8y h GLU 152 N 0.85 0.48 -0.23 4.77 5.08 -1.92 -2.04 114.58 121.57 1r8y h GLU 152 Ca 0.53 -0.31 0.01 0.00 -1.00 0.00 0.00 59.36 58.59 1r8y h GLU 152 Cb 0.70 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 1r8y h GLU 152 CO -0.33 0.91 0.13 0.45 -1.00 0.00 0.00 179.01 179.17 1r8y h HIS 153 N 0.37 0.24 0.00 4.33 3.86 -1.66 -0.12 115.15 122.17 1r8y h HIS 153 Ca 0.00 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 1r8y h HIS 153 Cb 1.09 -0.08 -0.00 0.00 1.06 0.00 0.00 27.41 29.48 1r8y h HIS 153 CO 0.04 0.14 -0.09 -0.09 0.86 0.00 0.00 177.93 178.79 1r8y h ARG 154 N 0.27 0.00 0.15 2.45 2.43 -1.06 -0.38 114.38 118.25 1r8y h ARG 154 Ca 0.09 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 59.00 1r8y h ARG 154 Cb 0.00 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.56 1r8y h ARG 154 CO -0.05 0.09 -1.23 1.25 -1.51 0.00 0.00 179.97 178.52 1r8y h LEU 155 N 0.00 0.51 -0.19 3.80 5.85 -1.01 -2.59 115.31 121.67 1r8y h LEU 155 Ca -0.00 -0.91 0.04 0.00 0.84 0.00 0.00 57.88 57.85 1r8y h LEU 155 Cb 0.18 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 1r8y h LEU 155 CO 0.01 1.57 -0.09 0.00 -0.34 0.00 0.00 178.44 179.59 1r8y h ALA 156 N 0.05 0.08 -0.47 1.25 0.00 -0.60 0.17 119.26 119.72 1r8y h ALA 156 Ca -0.24 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 1r8y h ALA 156 Cb 1.81 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 19.80 1r8y h ALA 156 CO 0.14 -0.52 -0.01 -0.07 0.00 0.00 0.00 179.25 178.79 1r8y h LEU 157 N -0.06 0.83 0.46 0.00 3.38 -1.21 -0.59 115.31 118.13 1r8y h LEU 157 Ca 0.10 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 1r8y h LEU 157 Cb 0.22 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1r8y h LEU 157 CO -0.24 0.94 -0.35 0.50 0.09 0.00 0.00 178.44 179.39 1r8y h LYS 158 N 0.70 -0.77 -0.13 1.13 3.64 -1.31 0.25 116.57 120.08 1r8y h LYS 158 Ca 0.13 0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.61 1r8y h LYS 158 Cb 0.52 0.18 -0.06 0.00 -0.41 0.00 0.00 32.23 32.46 1r8y h LYS 158 CO 0.03 -0.52 -0.34 -0.91 -2.27 0.00 0.00 179.45 175.45 1r8y h ASN 159 N -0.80 -1.04 -0.67 4.20 -0.26 -0.41 -0.65 115.58 115.94 1r8y h ASN 159 Ca -0.05 0.15 0.14 0.00 -0.56 0.00 0.00 56.30 55.99 1r8y h ASN 159 Cb 0.68 0.44 -0.11 0.00 -1.06 0.00 0.00 38.32 38.28 1r8y h ASN 159 CO 0.01 -0.37 0.07 0.40 -1.06 0.00 0.00 177.43 176.47 1r8y h ILE 160 N -0.41 0.49 0.00 2.81 2.04 -1.05 0.52 117.51 121.90 1r8y h ILE 160 Ca 0.09 -0.06 -0.04 0.00 1.00 0.00 0.00 64.86 65.86 1r8y h ILE 160 Cb 0.56 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 1r8y h ILE 160 CO -0.36 0.03 -0.17 0.00 0.00 0.00 0.00 178.15 177.64 1r8y h ALA 161 N 1.59 1.66 0.00 1.87 0.00 -0.04 -1.34 119.26 123.00 1r8y h ALA 161 Ca 0.36 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1r8y h ALA 161 Cb 0.61 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1r8y h ALA 161 CO -0.53 0.22 0.00 -1.13 0.00 0.00 0.00 179.25 177.81 1r8y n SER 162 N -4.26 0.52 0.18 0.00 3.41 0.16 -1.78 113.62 111.86 1r8y n SER 162 Ca -0.02 0.63 0.13 0.00 -0.26 0.00 0.00 58.87 59.34 1r8y n SER 162 Cb 0.24 -0.74 0.31 0.00 -0.26 0.00 0.00 64.21 63.77 1r8y n SER 162 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 1r8y h MET 163 N 0.00 0.00 -6.25 4.33 2.86 -1.12 -3.45 114.93 111.30 1r8y h MET 163 Ca 0.00 0.00 -0.55 0.00 -2.06 0.00 0.00 59.70 57.09 1r8y h MET 163 Cb 0.35 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.97 1r8y h MET 163 CO 0.00 0.00 0.29 0.08 1.06 0.00 0.00 176.91 178.34 1r8y s VAL 164 N -3.22 4.93 0.49 -2.22 1.01 -0.73 -0.71 120.40 119.95 1r8y s VAL 164 Ca 0.08 1.83 -0.18 0.00 0.00 0.00 0.00 61.98 63.70 1r8y s VAL 164 Cb 0.08 -4.21 -0.08 0.00 0.00 0.00 0.00 36.38 32.16 1r8y s VAL 164 CO 0.62 0.17 0.99 0.00 0.00 0.00 0.00 175.10 176.88 1r8y s ARG 165 N 1.06 3.94 0.18 2.72 1.70 -0.84 -4.69 118.95 123.02 1r8y s ARG 165 Ca 0.46 1.10 -0.33 0.00 -0.47 0.00 0.00 55.73 56.49 1r8y s ARG 165 Cb -0.19 -2.13 -0.15 0.00 -0.57 0.00 0.00 34.95 31.90 1r8y s ARG 165 CO 0.23 -0.28 1.23 -2.30 -1.08 0.00 0.00 175.30 173.10 1r8y n PRO 166 N -1.24 1.37 -1.36 3.89 -0.02 -1.26 -0.16 135.00 136.22 1r8y n PRO 166 Ca 0.07 0.49 -0.08 0.00 -2.02 0.00 0.00 63.50 61.96 1r8y n PRO 166 Cb 0.54 -2.03 -0.03 0.00 -0.02 0.00 0.00 33.50 31.95 1r8y n PRO 166 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r8y n GLY 167 N 2.10 0.91 3.39 -1.23 0.00 0.98 -4.81 105.19 106.52 1r8y n GLY 167 Ca 0.14 -0.64 -0.21 0.00 0.00 0.00 0.00 46.02 45.32 1r8y n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r8y n GLY 168 N -1.83 2.49 3.41 -0.02 0.00 0.77 -4.83 105.19 105.18 1r8y n GLY 168 Ca -0.09 -2.26 -0.32 0.00 0.00 0.00 0.00 46.02 43.35 1r8y n GLY 168 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r8y s LEU 169 N 0.00 2.55 -0.19 0.99 1.02 -0.74 -1.89 118.68 120.42 1r8y s LEU 169 Ca 0.37 -0.29 -0.01 0.00 0.02 0.00 0.00 54.13 54.22 1r8y s LEU 169 Cb -0.03 -1.51 0.00 0.00 0.02 0.00 0.00 46.19 44.67 1r8y s LEU 169 CO 0.23 0.30 -0.13 -0.22 0.02 0.00 0.00 176.35 176.56 1r8y s LEU 170 N -0.47 2.53 -0.30 1.79 2.96 0.31 0.15 118.68 125.64 1r8y s LEU 170 Ca 0.06 -0.49 -0.04 0.00 -0.22 0.00 0.00 54.13 53.43 1r8y s LEU 170 Cb -0.12 -1.60 0.03 0.00 0.50 0.00 0.00 46.19 45.00 1r8y s LEU 170 CO 0.02 0.02 0.04 -0.69 -1.32 0.00 0.00 176.35 174.42 1r8y s VAL 171 N 1.19 3.43 -0.02 1.68 1.01 0.22 -0.51 120.40 127.39 1r8y s VAL 171 Ca 0.02 -1.10 0.00 0.00 0.00 0.00 0.00 61.98 60.90 1r8y s VAL 171 Cb -0.14 -2.88 0.02 0.00 0.00 0.00 0.00 36.38 33.38 1r8y s VAL 171 CO -0.05 -0.04 0.00 -0.51 0.00 0.00 0.00 175.10 174.50 1r8y s ILE 172 N 1.36 0.12 0.39 2.22 2.07 -0.06 -0.54 121.20 126.76 1r8y s ILE 172 Ca -0.02 0.08 0.07 0.00 -1.41 0.00 0.00 60.65 59.38 1r8y s ILE 172 Cb -0.19 -0.20 -0.08 0.00 0.13 0.00 0.00 42.46 42.13 1r8y s ILE 172 CO 0.00 0.11 -0.01 1.51 -1.91 0.00 0.00 174.94 174.65 1r8y s ASP 173 N 0.81 3.73 -0.13 4.50 -4.77 -1.00 -0.84 116.67 118.98 1r8y s ASP 173 Ca -0.08 -1.33 -0.28 0.00 -3.30 0.00 0.00 52.55 47.56 1r8y s ASP 173 Cb -0.11 -0.37 0.07 0.00 -1.09 0.00 0.00 42.92 41.42 1r8y s ASP 173 CO -0.02 -0.41 0.68 -1.38 0.70 0.00 0.00 175.17 174.75 1r8y s HIS 174 N -2.73 -0.70 0.76 2.11 -3.43 -0.55 -4.35 115.29 106.40 1r8y s HIS 174 Ca 0.34 1.41 -0.15 0.00 -0.80 0.00 0.00 55.06 55.87 1r8y s HIS 174 Cb 0.08 0.35 0.05 0.00 -1.43 0.00 0.00 32.58 31.63 1r8y s HIS 174 CO 0.17 -0.51 1.22 -2.13 -2.00 0.00 0.00 174.74 171.49 1r8y n ARG 175 N 1.61 0.49 -2.20 -0.38 0.63 -1.26 -0.14 116.66 115.40 1r8y n ARG 175 Ca -0.17 0.24 -0.32 0.00 -0.92 0.00 0.00 57.85 56.68 1r8y n ARG 175 Cb 0.56 -2.46 -0.04 0.00 0.45 0.00 0.00 32.46 30.97 1r8y n ARG 175 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1r8y s ASN 176 N -1.87 5.53 0.00 6.15 3.84 0.14 -4.70 114.94 124.03 1r8y s ASN 176 Ca 0.76 -1.48 0.29 0.00 0.21 0.00 0.00 52.86 52.64 1r8y s ASN 176 Cb -0.32 -2.58 1.19 0.00 -0.55 0.00 0.00 41.25 38.99 1r8y s ASN 176 CO 0.47 -2.49 1.89 -1.22 -2.79 0.00 0.00 177.10 172.97 1r8y n TYR 177 N 12.64 0.00 -0.11 0.43 4.01 -1.26 -2.16 117.16 130.72 1r8y n TYR 177 Ca 0.43 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 58.03 1r8y n TYR 177 Cb 0.47 -0.47 -0.02 0.00 -0.31 0.00 0.00 39.34 39.00 1r8y n TYR 177 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1r8y h ASP 178 N 0.00 1.00 0.29 7.72 3.32 -1.85 -0.94 116.42 125.96 1r8y h ASP 178 Ca 0.00 -0.48 -0.01 0.00 0.02 0.00 0.00 57.03 56.56 1r8y h ASP 178 Cb 0.49 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.76 1r8y h ASP 178 CO 0.00 1.28 -0.14 0.22 -1.72 0.00 0.00 179.24 178.88 1r8y h TYR 179 N 0.75 -0.36 -0.61 4.55 3.20 -1.87 -2.85 116.97 119.77 1r8y h TYR 179 Ca 0.05 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.01 1r8y h TYR 179 Cb 1.03 0.12 -0.08 0.00 1.54 0.00 0.00 36.73 39.34 1r8y h TYR 179 CO 0.07 -0.05 0.21 0.82 -1.64 0.00 0.00 178.16 177.56 1r8y h ILE 180 N -0.68 0.74 0.00 1.81 2.04 -1.43 0.72 117.51 120.70 1r8y h ILE 180 Ca -0.04 -0.13 -0.18 0.00 1.00 0.00 0.00 64.86 65.51 1r8y h ILE 180 Cb 0.47 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 1r8y h ILE 180 CO 0.07 0.07 -0.83 -0.07 0.00 0.00 0.00 178.15 177.38 1r8y h LEU 181 N 0.37 0.11 -0.52 1.44 3.38 -1.26 1.53 115.31 120.38 1r8y h LEU 181 Ca 0.31 -0.09 -0.13 0.00 0.09 0.00 0.00 57.88 58.06 1r8y h LEU 181 Cb 0.41 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1r8y h LEU 181 CO -0.33 0.89 -0.62 0.77 0.09 0.00 0.00 178.44 179.24 1r8y h SER 182 N 0.05 0.00 0.03 -0.43 4.64 -1.21 -3.32 113.55 113.32 1r8y h SER 182 Ca -0.02 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.18 1r8y h SER 182 Cb 1.45 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.53 1r8y h SER 182 CO 0.12 0.62 -0.63 0.74 -0.87 0.00 0.00 176.83 176.81 1r8y h THR 183 N 0.00 1.42 0.00 2.95 2.02 -0.76 -3.48 112.91 115.06 1r8y h THR 183 Ca -0.01 -2.33 0.00 0.00 0.77 0.00 0.00 66.41 64.84 1r8y h THR 183 Cb 1.24 2.96 0.00 0.00 -1.74 0.00 0.00 68.15 70.61 1r8y h THR 183 CO 0.08 0.55 0.00 0.61 0.37 0.00 0.00 175.52 177.13 1r8y n GLY 184 N 1.59 0.58 3.18 2.16 0.00 0.52 -5.05 105.19 108.17 1r8y n GLY 184 Ca -0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 1r8y n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r8y s ALA 186 N -0.35 3.25 0.39 0.00 0.00 -1.26 -4.49 121.76 119.29 1r8y s ALA 186 Ca 0.05 -2.15 -0.27 0.00 0.00 0.00 0.00 51.96 49.60 1r8y s ALA 186 Cb -0.08 -2.59 -0.09 0.00 0.00 0.00 0.00 23.12 20.35 1r8y s ALA 186 CO -0.00 -1.63 1.31 -2.14 0.00 0.00 0.00 175.76 173.30 1r8y s PRO 187 N 1.40 4.07 0.32 0.00 0.02 -1.26 -4.92 135.00 134.63 1r8y s PRO 187 Ca 0.03 2.19 -0.22 0.00 0.02 0.00 0.00 61.00 63.03 1r8y s PRO 187 Cb -0.23 -2.84 -0.10 0.00 0.02 0.00 0.00 34.50 31.35 1r8y s PRO 187 CO 0.02 -0.42 0.86 -1.25 -0.33 0.00 0.00 177.00 175.87 1r8y s PRO 188 N -2.13 4.33 -1.05 5.54 0.04 -1.26 -4.34 135.00 136.13 1r8y s PRO 188 Ca 0.55 1.07 -0.05 0.00 0.04 0.00 0.00 61.00 62.61 1r8y s PRO 188 Cb -0.39 -2.61 0.01 0.00 0.04 0.00 0.00 34.50 31.54 1r8y s PRO 188 CO 0.51 0.21 0.90 0.41 0.04 0.00 0.00 177.00 179.08 1r8y n GLY 189 N 0.17 -0.23 0.18 0.56 0.00 -1.26 -4.94 105.19 99.67 1r8y n GLY 189 Ca 0.02 0.04 0.09 0.00 0.00 0.00 0.00 46.02 46.18 1r8y n GLY 189 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1r8y n LYS 190 N -3.92 1.31 -1.61 1.61 4.76 -1.26 -4.86 118.16 114.18 1r8y n LYS 190 Ca -0.07 -0.39 -0.56 0.00 -2.87 0.00 0.00 58.31 54.42 1r8y n LYS 190 Cb 0.58 -1.34 -0.08 0.00 -1.84 0.00 0.00 35.03 32.35 1r8y n LYS 190 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1r8y n ASN 191 N -0.83 2.17 -0.88 4.39 2.85 -1.26 -4.84 115.26 116.86 1r8y n ASN 191 Ca 0.05 0.89 0.11 0.00 -0.11 0.00 0.00 54.58 55.52 1r8y n ASN 191 Cb 0.33 -1.14 0.09 0.00 1.24 0.00 0.00 39.78 40.30 1r8y n ASN 191 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 1r8y n ILE 192 N 5.36 0.02 -0.01 -1.44 -6.64 -1.26 -4.02 119.36 111.37 1r8y n ILE 192 Ca 0.33 -0.51 -0.21 0.00 -1.77 0.00 0.00 62.75 60.59 1r8y n ILE 192 Cb 0.13 1.44 -0.14 0.00 -1.44 0.00 0.00 39.64 39.63 1r8y n ILE 192 CO 0.00 0.00 0.00 1.88 -1.77 0.00 0.00 176.55 176.66 1r8y h TYR 193 N 4.27 0.37 -3.51 4.28 0.05 -1.94 -3.40 116.97 117.10 1r8y h TYR 193 Ca 0.00 -0.27 -0.43 0.00 0.05 0.00 0.00 58.73 58.08 1r8y h TYR 193 Cb 0.91 -0.01 -0.33 0.00 1.01 0.00 0.00 36.73 38.30 1r8y h TYR 193 CO 0.01 1.49 -0.78 0.71 -1.05 0.00 0.00 178.16 178.53 1r8y s TYR 194 N -2.44 0.90 -0.17 4.88 2.02 -1.26 -0.65 117.35 120.63 1r8y s TYR 194 Ca -0.20 -0.27 -0.28 0.00 -0.37 0.00 0.00 57.07 55.95 1r8y s TYR 194 Cb 0.04 -0.73 -0.06 0.00 -0.40 0.00 0.00 41.96 40.81 1r8y s TYR 194 CO 0.75 -0.19 2.15 -1.59 -1.57 0.00 0.00 175.55 175.10 1r8y s LYS 195 N 0.73 3.34 -0.76 -0.62 -2.85 -0.48 -4.67 119.74 114.43 1r8y s LYS 195 Ca -0.11 2.12 -0.25 0.00 -1.00 0.00 0.00 55.97 56.72 1r8y s LYS 195 Cb -0.14 -4.32 -0.21 0.00 -2.06 0.00 0.00 37.83 31.10 1r8y s LYS 195 CO 0.01 -1.87 1.89 0.43 0.10 0.00 0.00 175.35 175.91 1r8y n SER 196 N 10.80 2.06 0.18 0.03 7.64 -1.26 -4.17 113.62 128.89 1r8y n SER 196 Ca 0.27 -2.60 0.05 0.00 1.01 0.00 0.00 58.87 57.60 1r8y n SER 196 Cb 0.44 -1.27 0.32 0.00 -1.01 0.00 0.00 64.21 62.69 1r8y n SER 196 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1r8y h ASP 197 N 9.69 0.00 -3.21 6.43 5.19 -1.86 -3.42 116.42 129.24 1r8y h ASP 197 Ca 0.24 0.00 -0.53 0.00 -0.62 0.00 0.00 57.03 56.12 1r8y h ASP 197 Cb 0.82 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.34 1r8y h ASP 197 CO 1.58 0.40 0.61 -1.48 -3.12 0.00 0.00 179.24 177.24 1r8y s LEU 198 N -7.19 4.39 -0.35 1.55 -0.00 -1.21 -5.02 118.68 110.85 1r8y s LEU 198 Ca -0.00 2.17 -0.29 0.00 -0.00 0.00 0.00 54.13 56.01 1r8y s LEU 198 Cb 0.11 -3.59 -0.00 0.00 -0.00 0.00 0.00 46.19 42.71 1r8y s LEU 198 CO 0.70 -0.50 1.52 -0.89 -0.00 0.00 0.00 176.35 177.17 1r8y s THR 199 N 0.80 3.80 0.01 5.48 2.01 -1.26 -5.01 115.64 121.47 1r8y s THR 199 Ca 0.59 0.84 0.00 0.00 0.31 0.00 0.00 61.69 63.44 1r8y s THR 199 Cb -0.33 -3.99 0.00 0.00 0.01 0.00 0.00 72.50 68.20 1r8y s THR 199 CO 0.31 -0.56 0.02 0.29 -0.69 0.00 0.00 174.62 173.99 1r8y n LYS 200 N 7.99 1.06 -3.64 4.92 4.76 -1.26 -3.72 118.16 128.27 1r8y n LYS 200 Ca 0.18 -0.07 -0.05 0.00 -2.87 0.00 0.00 58.31 55.50 1r8y n LYS 200 Cb 0.47 -0.00 -0.07 0.00 -1.84 0.00 0.00 35.03 33.59 1r8y n LYS 200 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1r8y s ASP 201 N -1.08 -0.77 -0.06 4.39 -1.08 0.09 -4.86 116.67 113.29 1r8y s ASP 201 Ca 0.01 1.23 0.03 0.00 -0.52 0.00 0.00 52.55 53.31 1r8y s ASP 201 Cb -0.00 1.33 0.01 0.00 -1.46 0.00 0.00 42.92 42.79 1r8y s ASP 201 CO 0.01 -0.19 -0.16 -0.63 0.52 0.00 0.00 175.17 174.71 1r8y s ILE 202 N 1.54 1.40 -0.21 4.11 1.01 -1.26 0.65 121.20 128.44 1r8y s ILE 202 Ca -0.10 -0.66 -0.02 0.00 0.00 0.00 0.00 60.65 59.88 1r8y s ILE 202 Cb -0.05 -1.23 0.01 0.00 0.01 0.00 0.00 42.46 41.20 1r8y s ILE 202 CO -0.18 0.41 -0.11 -0.89 0.00 0.00 0.00 174.94 174.17 1r8y s THR 203 N 0.39 2.77 -0.21 2.92 2.01 -0.94 -4.99 115.64 117.58 1r8y s THR 203 Ca -0.12 -0.74 -0.17 0.00 0.31 0.00 0.00 61.69 60.97 1r8y s THR 203 Cb -0.15 -2.24 -0.03 0.00 0.01 0.00 0.00 72.50 70.08 1r8y s THR 203 CO 0.04 0.45 0.48 -0.89 -0.69 0.00 0.00 174.62 174.01 1r8y s THR 204 N 1.38 5.13 -0.14 -0.82 2.01 -1.26 -2.01 115.64 119.93 1r8y s THR 204 Ca 0.05 0.85 0.02 0.00 0.31 0.00 0.00 61.69 62.93 1r8y s THR 204 Cb -0.14 -3.80 0.01 0.00 0.01 0.00 0.00 72.50 68.58 1r8y s THR 204 CO -0.07 0.18 -0.22 -0.44 -0.69 0.00 0.00 174.62 173.38 1r8y s SER 205 N 1.22 3.07 -0.14 3.53 0.01 0.30 -4.91 113.70 116.78 1r8y s SER 205 Ca 0.22 -0.59 -0.05 0.00 1.31 0.00 0.00 55.95 56.84 1r8y s SER 205 Cb -0.15 -1.42 -0.03 0.00 0.21 0.00 0.00 66.02 64.62 1r8y s SER 205 CO 0.09 0.08 0.02 -0.69 0.41 0.00 0.00 173.24 173.15 1r8y s VAL 206 N 0.82 4.41 -0.20 3.43 1.01 -1.26 -0.06 120.40 128.54 1r8y s VAL 206 Ca -0.07 -0.18 -0.04 0.00 0.00 0.00 0.00 61.98 61.68 1r8y s VAL 206 Cb -0.16 -2.93 -0.02 0.00 0.00 0.00 0.00 36.38 33.28 1r8y s VAL 206 CO -0.02 0.52 -0.03 -0.22 0.00 0.00 0.00 175.10 175.35 1r8y s LEU 207 N -0.05 3.06 -0.24 3.92 2.96 -0.19 -5.01 118.68 123.13 1r8y s LEU 207 Ca 0.04 -0.30 0.02 0.00 -0.22 0.00 0.00 54.13 53.67 1r8y s LEU 207 Cb -0.13 -1.77 0.05 0.00 0.50 0.00 0.00 46.19 44.84 1r8y s LEU 207 CO 0.02 0.03 -0.12 -0.89 -1.32 0.00 0.00 176.35 174.07 1r8y s THR 208 N 1.17 2.25 -0.23 3.68 2.01 -1.26 -1.08 115.64 122.18 1r8y s THR 208 Ca 0.02 -1.40 -0.10 0.00 0.31 0.00 0.00 61.69 60.52 1r8y s THR 208 Cb -0.14 -2.22 -0.05 0.00 0.01 0.00 0.00 72.50 70.10 1r8y s THR 208 CO 0.00 0.12 0.14 -0.69 -0.69 0.00 0.00 174.62 173.51 1r8y s VAL 209 N 1.17 5.25 -1.54 3.82 1.01 -0.85 -4.50 120.40 124.76 1r8y s VAL 209 Ca -0.05 0.14 -0.00 0.00 0.00 0.00 0.00 61.98 62.07 1r8y s VAL 209 Cb -0.18 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.76 1r8y s VAL 209 CO -0.07 0.36 0.01 0.59 0.00 0.00 0.00 175.10 175.99 1r8y n ASN 210 N 4.23 0.91 -1.07 3.32 3.02 -1.26 -0.29 115.26 124.13 1r8y n ASN 210 Ca -0.15 -1.27 -0.12 0.00 -0.03 0.00 0.00 54.58 53.01 1r8y n ASN 210 Cb 0.52 -1.58 -0.04 0.00 -0.61 0.00 0.00 39.78 38.08 1r8y n ASN 210 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1r8y n ASN 211 N -2.86 -4.24 -3.88 6.41 4.05 -1.26 -4.99 115.26 108.49 1r8y n ASN 211 Ca -0.32 0.19 -0.26 0.00 0.45 0.00 0.00 54.58 54.64 1r8y n ASN 211 Cb 0.69 -3.01 -0.17 0.00 1.23 0.00 0.00 39.78 38.52 1r8y n ASN 211 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 177.26 173.46 1r8y s LYS 212 N -3.54 1.33 0.14 1.20 2.20 0.60 -5.11 119.74 116.56 1r8y s LYS 212 Ca 0.00 -0.18 -0.35 0.00 -0.36 0.00 0.00 55.97 55.08 1r8y s LYS 212 Cb 0.00 -1.44 -0.15 0.00 -1.51 0.00 0.00 37.83 34.73 1r8y s LYS 212 CO 0.00 -0.26 1.42 0.00 -0.36 0.00 0.00 175.35 176.15 1r8y n ALA 213 N 4.94 0.15 0.00 3.13 0.00 -1.26 -2.02 120.51 125.45 1r8y n ALA 213 Ca -0.12 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.80 1r8y n ALA 213 Cb 0.50 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.75 1r8y n ALA 213 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1r8y n HIS 214 N 2.71 0.00 -3.70 0.00 -0.00 -0.24 -4.88 115.22 109.11 1r8y n HIS 214 Ca 0.17 0.00 -0.14 0.00 0.46 0.00 0.00 57.72 58.21 1r8y n HIS 214 Cb 0.24 0.00 -0.09 0.00 -0.12 0.00 0.00 29.99 30.03 1r8y n HIS 214 CO 0.00 0.00 0.00 1.41 0.46 0.00 0.00 176.34 178.21 1r8y s MET 215 N -1.61 0.63 -0.20 1.57 1.75 -1.13 -4.62 119.30 115.69 1r8y s MET 215 Ca 0.00 0.47 0.01 0.00 -1.25 0.00 0.00 55.69 54.93 1r8y s MET 215 Cb 0.00 0.30 0.03 0.00 2.84 0.00 0.00 34.83 38.00 1r8y s MET 215 CO 0.00 -0.11 -0.17 0.08 -0.65 0.00 0.00 175.02 174.17 1r8y s VAL 216 N -0.18 2.02 -0.19 10.11 1.01 -0.36 -1.02 120.40 131.79 1r8y s VAL 216 Ca -0.04 -1.10 -0.04 0.00 0.00 0.00 0.00 61.98 60.80 1r8y s VAL 216 Cb -0.03 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.40 1r8y s VAL 216 CO 0.02 0.36 -0.04 -0.89 0.00 0.00 0.00 175.10 174.55 1r8y s THR 217 N 1.26 3.61 -0.16 3.92 2.01 0.91 -0.97 115.64 126.21 1r8y s THR 217 Ca 0.01 -0.44 -0.04 0.00 0.31 0.00 0.00 61.69 61.53 1r8y s THR 217 Cb -0.15 -2.61 -0.03 0.00 0.01 0.00 0.00 72.50 69.72 1r8y s THR 217 CO -0.10 0.45 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.50 1r8y s LEU 218 N 0.97 3.33 -0.40 4.42 1.43 0.22 -0.54 118.68 128.12 1r8y s LEU 218 Ca 0.00 -0.11 -0.14 0.00 -1.03 0.00 0.00 54.13 52.86 1r8y s LEU 218 Cb -0.15 -1.81 0.02 0.00 0.03 0.00 0.00 46.19 44.28 1r8y s LEU 218 CO 0.01 0.16 0.27 -1.81 0.23 0.00 0.00 176.35 175.21 1r8y s ASP 219 N 0.43 6.01 -0.03 2.29 1.01 -0.85 -1.55 116.67 123.97 1r8y s ASP 219 Ca -0.03 -0.91 -0.20 0.00 0.71 0.00 0.00 52.55 52.12 1r8y s ASP 219 Cb -0.14 -2.12 -0.05 0.00 1.01 0.00 0.00 42.92 41.62 1r8y s ASP 219 CO 0.02 -0.43 0.57 -0.31 0.21 0.00 0.00 175.17 175.24 1r8y s TYR 220 N 1.65 3.64 -0.29 4.23 1.51 0.21 -2.23 117.35 126.07 1r8y s TYR 220 Ca 0.04 1.13 0.02 0.00 -1.01 0.00 0.00 57.07 57.26 1r8y s TYR 220 Cb -0.19 -2.60 0.07 0.00 -0.11 0.00 0.00 41.96 39.13 1r8y s TYR 220 CO 0.09 0.31 -0.05 0.99 -1.11 0.00 0.00 175.55 175.78 1r8y s THR 221 N 0.02 2.34 0.41 -0.71 2.01 0.21 -1.47 115.64 118.45 1r8y s THR 221 Ca 0.30 -1.78 0.08 0.00 0.31 0.00 0.00 61.69 60.59 1r8y s THR 221 Cb -0.17 -2.46 -0.03 0.00 0.01 0.00 0.00 72.50 69.85 1r8y s THR 221 CO 0.16 -0.19 0.33 -0.69 -0.69 0.00 0.00 174.62 173.54 1r8y s VAL 222 N 1.08 2.66 -0.72 3.82 1.01 0.33 -0.73 120.40 127.84 1r8y s VAL 222 Ca -0.03 -1.41 -0.27 0.00 0.00 0.00 0.00 61.98 60.27 1r8y s VAL 222 Cb -0.20 -3.01 0.01 0.00 0.00 0.00 0.00 36.38 33.19 1r8y s VAL 222 CO -0.05 -0.01 1.49 -1.58 0.00 0.00 0.00 175.10 174.94 1r8y s GLN 223 N -4.08 3.01 -0.22 2.72 0.74 -1.24 -1.49 119.66 119.10 1r8y s GLN 223 Ca 0.46 -0.01 -0.04 0.00 0.05 0.00 0.00 55.36 55.83 1r8y s GLN 223 Cb -0.02 -4.32 -0.01 0.00 1.10 0.00 0.00 33.01 29.76 1r8y s GLN 223 CO 0.27 -2.37 -0.04 -0.06 -0.55 0.00 0.00 175.29 172.54 1r8y s PHE 235 N 6.89 2.96 0.16 1.67 0.40 -1.26 -5.15 117.98 123.66 1r8y s PHE 235 Ca 0.47 -0.88 0.09 0.00 -0.60 0.00 0.00 56.93 56.01 1r8y s PHE 235 Cb -0.09 -2.10 -0.04 0.00 0.51 0.00 0.00 43.02 41.29 1r8y s PHE 235 CO 0.15 -0.51 -0.20 -1.12 0.70 0.00 0.00 175.22 174.24 1r8y s SER 236 N 1.43 2.80 -0.02 1.36 0.01 -0.56 -5.15 113.70 113.58 1r8y s SER 236 Ca 0.05 -0.85 0.05 0.00 1.31 0.00 0.00 55.95 56.51 1r8y s SER 236 Cb -0.14 -0.17 -0.01 0.00 0.21 0.00 0.00 66.02 65.90 1r8y s SER 236 CO -0.02 0.00 -0.17 -0.54 0.41 0.00 0.00 173.24 172.92 1r8y s LYS 237 N -2.69 1.48 0.13 12.44 1.02 -1.26 -0.52 119.74 130.35 1r8y s LYS 237 Ca 0.16 -0.60 -0.00 0.00 0.02 0.00 0.00 55.97 55.55 1r8y s LYS 237 Cb -0.07 -1.38 -0.04 0.00 -0.52 0.00 0.00 37.83 35.82 1r8y s LYS 237 CO 0.07 0.32 0.03 -0.59 -0.92 0.00 0.00 175.35 174.26 1r8y s PHE 238 N -0.25 0.92 0.04 3.18 -0.71 -0.54 -4.38 117.98 116.24 1r8y s PHE 238 Ca 0.03 -1.14 0.03 0.00 -1.04 0.00 0.00 56.93 54.81 1r8y s PHE 238 Cb -0.08 -0.53 -0.02 0.00 -1.21 0.00 0.00 43.02 41.18 1r8y s PHE 238 CO 0.00 -0.40 -0.10 0.50 -1.34 0.00 0.00 175.22 173.88 1r8y s ARG 239 N -3.99 0.66 -0.03 1.99 3.52 -1.26 -0.62 118.95 119.22 1r8y s ARG 239 Ca 0.22 -0.69 -0.10 0.00 -0.13 0.00 0.00 55.73 55.02 1r8y s ARG 239 Cb 0.07 -0.56 0.02 0.00 -1.56 0.00 0.00 34.95 32.92 1r8y s ARG 239 CO 0.01 0.13 0.22 -0.51 -0.81 0.00 0.00 175.30 174.34 1r8y s LEU 240 N -1.25 1.18 0.17 -0.88 1.43 -0.60 -5.00 118.68 113.73 1r8y s LEU 240 Ca -0.04 0.10 0.08 0.00 -1.03 0.00 0.00 54.13 53.25 1r8y s LEU 240 Cb -0.08 0.91 -0.04 0.00 0.03 0.00 0.00 46.19 47.01 1r8y s LEU 240 CO 0.01 -0.31 -0.17 -0.44 0.23 0.00 0.00 176.35 175.67 1r8y s SER 241 N -0.89 2.66 -0.01 2.29 0.01 -1.26 -0.61 113.70 115.89 1r8y s SER 241 Ca -0.10 -0.89 -0.03 0.00 1.31 0.00 0.00 55.95 56.24 1r8y s SER 241 Cb -0.05 -0.15 -0.00 0.00 0.21 0.00 0.00 66.02 66.02 1r8y s SER 241 CO 0.02 -0.06 0.06 -0.31 0.41 0.00 0.00 173.24 173.36 1r8y s TYR 242 N -2.22 0.03 -0.18 2.43 1.51 -0.15 -4.67 117.35 114.10 1r8y s TYR 242 Ca 0.17 -0.06 -0.24 0.00 -1.01 0.00 0.00 57.07 55.92 1r8y s TYR 242 Cb -0.05 -0.05 -0.02 0.00 -0.11 0.00 0.00 41.96 41.74 1r8y s TYR 242 CO 0.07 -0.14 0.79 -0.47 -1.11 0.00 0.00 175.55 174.69 1r8y s TYR 243 N -0.68 3.41 -1.15 2.71 5.04 0.21 -1.23 117.35 125.66 1r8y s TYR 243 Ca -0.08 1.18 -0.21 0.00 -2.44 0.00 0.00 57.07 55.53 1r8y s TYR 243 Cb -0.05 -2.97 0.03 0.00 0.35 0.00 0.00 41.96 39.32 1r8y s TYR 243 CO 0.00 -0.23 1.70 -1.25 -1.34 0.00 0.00 175.55 174.43 1r8y s PRO 244 N 2.13 3.48 -0.26 4.97 0.04 -1.26 -4.72 135.00 139.38 1r8y s PRO 244 Ca 0.36 -1.41 -0.29 0.00 0.04 0.00 0.00 61.00 59.70 1r8y s PRO 244 Cb -0.16 -5.39 -0.01 0.00 0.04 0.00 0.00 34.50 28.98 1r8y s PRO 244 CO 0.12 -2.63 1.35 -1.01 0.04 0.00 0.00 177.00 174.88 1r8y s HIS 245 N 6.13 2.60 0.56 0.56 3.76 -1.26 -4.97 115.29 122.67 1r8y s HIS 245 Ca 0.55 0.83 -0.15 0.00 -0.15 0.00 0.00 55.06 56.13 1r8y s HIS 245 Cb 0.01 -3.85 -0.06 0.00 1.11 0.00 0.00 32.58 29.79 1r8y s HIS 245 CO 0.02 -1.96 1.02 0.00 -0.85 0.00 0.00 174.74 172.97 1r8y h LEU 247 N 0.55 0.30 0.31 0.00 5.85 -1.95 -1.78 115.31 118.59 1r8y h LEU 247 Ca -0.46 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.12 1r8y h LEU 247 Cb 1.20 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 42.11 1r8y h LEU 247 CO 0.60 0.36 -0.50 0.00 -0.34 0.00 0.00 178.44 178.56 1r8y h ALA 248 N 0.96 -1.02 -0.42 1.25 0.00 -2.00 -1.75 119.26 116.27 1r8y h ALA 248 Ca 0.08 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.90 1r8y h ALA 248 Cb 0.14 0.78 -0.09 0.00 0.00 0.00 0.00 17.79 18.62 1r8y h ALA 248 CO -0.01 -1.13 -0.50 1.03 0.00 0.00 0.00 179.25 178.64 1r8y h SER 249 N -0.86 -1.68 -0.23 0.00 0.87 -1.95 -2.02 113.55 107.68 1r8y h SER 249 Ca -0.03 0.24 -0.00 0.00 -1.23 0.00 0.00 61.79 60.76 1r8y h SER 249 Cb 0.80 0.71 -0.01 0.00 -0.44 0.00 0.00 62.40 63.46 1r8y h SER 249 CO -0.17 -0.39 0.13 0.15 -0.53 0.00 0.00 176.83 176.02 1r8y h PHE 250 N -0.36 0.31 -0.68 2.24 3.57 -1.23 0.45 116.94 121.24 1r8y h PHE 250 Ca 0.11 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.70 1r8y h PHE 250 Cb 0.59 -0.10 -0.12 0.00 2.79 0.00 0.00 35.95 39.12 1r8y h PHE 250 CO -0.69 0.26 -0.42 1.15 -2.23 0.00 0.00 178.31 176.38 1r8y h THR 251 N 0.27 0.08 -0.38 4.41 2.02 -1.05 0.15 112.91 118.41 1r8y h THR 251 Ca 0.08 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.34 1r8y h THR 251 Cb 0.05 0.08 -0.08 0.00 -1.74 0.00 0.00 68.15 66.46 1r8y h THR 251 CO -0.01 0.00 -0.17 -0.33 0.37 0.00 0.00 175.52 175.37 1r8y h GLU 252 N -0.16 -0.10 0.01 6.66 4.39 -0.54 -0.84 114.58 124.00 1r8y h GLU 252 Ca 0.22 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.92 1r8y h GLU 252 Cb 0.56 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 1r8y h GLU 252 CO -0.76 -0.07 -0.00 -0.07 -1.16 0.00 0.00 179.01 176.96 1r8y h LEU 253 N -0.10 -0.01 -0.45 1.33 3.38 0.13 0.06 115.31 119.65 1r8y h LEU 253 Ca 0.19 -0.13 -0.16 0.00 0.09 0.00 0.00 57.88 57.87 1r8y h LEU 253 Cb 0.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1r8y h LEU 253 CO -0.45 0.12 -0.43 1.62 0.09 0.00 0.00 178.44 179.39 1r8y h VAL 254 N -0.14 1.28 -0.13 1.22 3.04 -0.77 -2.22 116.25 118.53 1r8y h VAL 254 Ca -0.00 -1.61 0.00 0.00 -1.01 0.00 0.00 66.70 64.08 1r8y h VAL 254 Cb 0.13 1.49 -0.01 0.00 -2.01 0.00 0.00 31.29 30.90 1r8y h VAL 254 CO 0.00 0.53 0.08 0.03 -1.01 0.00 0.00 177.57 177.20 1r8y h ARG 255 N 0.66 0.17 -0.59 4.17 3.08 -1.00 -2.17 114.38 118.69 1r8y h ARG 255 Ca 0.04 -0.01 0.10 0.00 0.07 0.00 0.00 59.98 60.19 1r8y h ARG 255 Cb 1.00 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.98 1r8y h ARG 255 CO 0.10 0.11 0.40 0.00 -1.07 0.00 0.00 179.97 179.51 1r8y h ALA 256 N 1.05 2.06 0.00 0.04 0.00 -0.83 -1.97 119.26 119.61 1r8y h ALA 256 Ca 0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1r8y h ALA 256 Cb -0.02 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1r8y h ALA 256 CO -0.01 -0.20 -0.05 0.00 0.00 0.00 0.00 179.25 178.99 1r8y h ALA 257 N 1.70 1.24 -0.01 0.00 0.00 -0.76 0.45 119.26 121.89 1r8y h ALA 257 Ca 0.28 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1r8y h ALA 257 Cb 0.59 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1r8y h ALA 257 CO -0.07 0.06 -0.38 1.19 0.00 0.00 0.00 179.25 180.05 1r8y n PHE 258 N -3.50 0.00 -2.16 0.00 3.72 -0.76 -4.64 117.46 110.12 1r8y n PHE 258 Ca -0.02 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.30 1r8y n PHE 258 Cb 0.17 -0.08 -0.00 0.00 -0.94 0.00 0.00 39.48 38.63 1r8y n PHE 258 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1r8y n GLY 259 N 1.38 0.03 3.90 1.37 0.00 0.15 -2.98 105.19 109.04 1r8y n GLY 259 Ca 0.10 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1r8y n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r8y n GLY 260 N -1.01 2.60 3.03 -0.02 0.00 -1.12 -4.92 105.19 103.75 1r8y n GLY 260 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 1r8y n GLY 260 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1r8y n ARG 261 N -1.90 2.23 -3.67 1.61 0.63 -1.16 -4.86 116.66 109.54 1r8y n ARG 261 Ca 0.00 -2.35 -0.10 0.00 -0.92 0.00 0.00 57.85 54.49 1r8y n ARG 261 Cb 0.00 -3.20 -0.02 0.00 0.45 0.00 0.00 32.46 29.69 1r8y n ARG 261 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1r8y s GLN 263 N -3.85 3.01 -0.07 0.00 -0.21 0.50 -4.91 119.66 114.13 1r8y s GLN 263 Ca 0.07 -0.86 0.02 0.00 0.02 0.00 0.00 55.36 54.61 1r8y s GLN 263 Cb -0.03 -2.32 0.02 0.00 1.00 0.00 0.00 33.01 31.67 1r8y s GLN 263 CO -0.03 0.22 -0.10 -1.58 -2.12 0.00 0.00 175.29 171.68 1r8y s HIS 264 N 0.24 1.34 -0.02 0.91 5.65 -1.26 -0.23 115.29 121.92 1r8y s HIS 264 Ca -0.15 -0.51 0.03 0.00 0.25 0.00 0.00 55.06 54.69 1r8y s HIS 264 Cb -0.17 -1.02 -0.00 0.00 -1.18 0.00 0.00 32.58 30.20 1r8y s HIS 264 CO 0.08 -0.29 -0.12 -1.12 -0.65 0.00 0.00 174.74 172.63 1r8y s SER 265 N 0.85 1.49 0.27 9.88 0.01 -0.79 -5.02 113.70 120.38 1r8y s SER 265 Ca -0.11 -0.23 -0.13 0.00 1.31 0.00 0.00 55.95 56.78 1r8y s SER 265 Cb -0.15 -0.31 -0.08 0.00 0.21 0.00 0.00 66.02 65.69 1r8y s SER 265 CO 0.02 0.12 0.65 0.54 0.41 0.00 0.00 173.24 174.97 1r8y s VAL 266 N -0.04 4.79 0.10 3.43 0.11 -1.26 -0.98 120.40 126.55 1r8y s VAL 266 Ca 0.00 0.76 0.09 0.00 -2.93 0.00 0.00 61.98 59.91 1r8y s VAL 266 Cb -0.08 -3.63 -0.04 0.00 -1.53 0.00 0.00 36.38 31.10 1r8y s VAL 266 CO 0.00 -0.09 -0.22 -0.76 -3.33 0.00 0.00 175.10 170.70 1r8y s LEU 267 N -2.79 2.50 0.00 2.54 1.43 0.80 -3.88 118.68 119.27 1r8y s LEU 267 Ca 0.50 -0.60 0.00 0.00 -1.03 0.00 0.00 54.13 52.99 1r8y s LEU 267 Cb -0.11 -1.40 0.00 0.00 0.03 0.00 0.00 46.19 44.71 1r8y s LEU 267 CO 0.19 0.20 0.00 0.61 0.23 0.00 0.00 176.35 177.58 1r8y n GLY 268 N 1.07 -0.75 0.09 -3.19 0.00 0.42 -2.19 105.19 100.64 1r8y n GLY 268 Ca -0.17 -0.06 0.03 0.00 0.00 0.00 0.00 46.02 45.82 1r8y n GLY 268 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1r8y n ASP 269 N 0.00 0.73 0.00 1.61 8.00 -1.26 -4.26 116.55 121.37 1r8y n ASP 269 Ca 0.00 0.31 0.00 0.00 0.71 0.00 0.00 54.79 55.81 1r8y n ASP 269 Cb 0.00 0.44 0.00 0.00 -0.02 0.00 0.00 41.12 41.54 1r8y n ASP 269 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1r8y n PHE 270 N -2.78 0.00 -0.54 1.24 0.99 -1.26 -4.89 117.46 110.23 1r8y n PHE 270 Ca -0.09 0.00 -0.29 0.00 -0.00 0.00 0.00 57.45 57.07 1r8y n PHE 270 Cb 0.77 0.00 0.23 0.00 -1.00 0.00 0.00 39.48 39.49 1r8y n PHE 270 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 1r8y n LYS 271 N -0.27 -2.12 -1.12 -1.08 5.02 -1.26 -4.98 118.16 112.34 1r8y n LYS 271 Ca 0.00 -0.59 -0.31 0.00 -2.02 0.00 0.00 58.31 55.40 1r8y n LYS 271 Cb 0.00 -2.08 0.12 0.00 -0.02 0.00 0.00 35.03 33.06 1r8y n LYS 271 CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 1r8y s PRO 272 N -4.19 1.67 -0.20 1.97 0.02 -1.26 0.16 135.00 133.16 1r8y s PRO 272 Ca 0.66 1.13 -0.00 0.00 0.02 0.00 0.00 61.00 62.80 1r8y s PRO 272 Cb -0.22 -1.83 0.05 0.00 0.02 0.00 0.00 34.50 32.51 1r8y s PRO 272 CO 0.65 -2.05 -0.05 -0.47 -0.33 0.00 0.00 177.00 174.76 1r8y s TYR 273 N -2.85 1.94 -0.17 6.54 5.04 -1.25 -3.87 117.35 122.72 1r8y s TYR 273 Ca 0.63 -1.35 -0.09 0.00 -2.44 0.00 0.00 57.07 53.82 1r8y s TYR 273 Cb -0.19 -1.41 -0.05 0.00 0.35 0.00 0.00 41.96 40.67 1r8y s TYR 273 CO 0.57 -0.69 0.15 -1.59 -1.34 0.00 0.00 175.55 172.65 1r8y s LYS 274 N 1.55 3.94 0.10 4.97 -2.85 -1.26 -4.90 119.74 121.30 1r8y s LYS 274 Ca -0.02 -0.16 -0.33 0.00 -1.00 0.00 0.00 55.97 54.47 1r8y s LYS 274 Cb -0.17 -3.34 -0.12 0.00 -2.06 0.00 0.00 37.83 32.14 1r8y s LYS 274 CO -0.07 0.46 1.76 -2.30 0.10 0.00 0.00 175.35 175.31 1r8y n PRO 275 N 2.98 2.51 -1.01 1.78 -0.02 -1.26 -2.04 135.00 137.93 1r8y n PRO 275 Ca -0.17 0.91 -0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1r8y n PRO 275 Cb 0.53 -2.76 -0.00 0.00 -0.02 0.00 0.00 33.50 31.25 1r8y n PRO 275 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r8y n GLY 276 N 4.01 0.46 3.52 -1.23 0.00 -1.26 -5.05 105.19 105.64 1r8y n GLY 276 Ca 0.18 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 45.31 1r8y n GLY 276 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1r8y s GLN 277 N -1.22 -0.66 0.05 1.61 -2.07 -0.87 -4.98 119.66 111.53 1r8y s GLN 277 Ca 0.00 0.93 -0.30 0.00 -1.82 0.00 0.00 55.36 54.17 1r8y s GLN 277 Cb 0.00 -1.58 -0.18 0.00 -1.09 0.00 0.00 33.01 30.17 1r8y s GLN 277 CO 0.00 -3.58 1.51 0.00 -1.32 0.00 0.00 175.29 171.91 1r8y h ALA 278 N -2.52 -0.74 -2.58 2.60 0.00 -1.97 -3.42 119.26 110.63 1r8y h ALA 278 Ca -0.59 -0.18 -0.53 0.00 0.00 0.00 0.00 54.91 53.61 1r8y h ALA 278 Cb 1.32 0.29 0.02 0.00 0.00 0.00 0.00 17.79 19.42 1r8y h ALA 278 CO 0.49 -0.87 0.61 -0.47 0.00 0.00 0.00 179.25 179.01 1r8y s TYR 279 N -5.67 3.36 -0.27 0.00 5.04 -1.26 -5.03 117.35 113.52 1r8y s TYR 279 Ca -0.16 1.24 -0.09 0.00 -2.44 0.00 0.00 57.07 55.61 1r8y s TYR 279 Cb 0.03 -3.51 -0.03 0.00 0.35 0.00 0.00 41.96 38.80 1r8y s TYR 279 CO 0.59 -1.62 0.12 0.14 -1.34 0.00 0.00 175.55 173.45 1r8y s VAL 280 N 0.63 4.68 0.73 3.14 -7.23 -1.26 -5.04 120.40 116.06 1r8y s VAL 280 Ca 0.58 -0.11 -0.11 0.00 -1.81 0.00 0.00 61.98 60.54 1r8y s VAL 280 Cb -0.33 -3.24 0.03 0.00 0.56 0.00 0.00 36.38 33.40 1r8y s VAL 280 CO 0.33 0.26 1.08 -2.84 -0.31 0.00 0.00 175.10 173.62 1r8y s PRO 281 N 1.66 2.58 -0.11 4.82 0.02 -1.26 -5.01 135.00 137.70 1r8y s PRO 281 Ca 0.06 1.08 -0.11 0.00 0.02 0.00 0.00 61.00 62.06 1r8y s PRO 281 Cb -0.16 -1.94 -0.27 0.00 0.02 0.00 0.00 34.50 32.16 1r8y s PRO 281 CO 0.06 -1.39 0.45 0.00 -0.33 0.00 0.00 177.00 175.80 1r8y s TYR 283 N -2.53 2.42 -0.20 0.00 1.51 -1.26 -0.69 117.35 116.61 1r8y s TYR 283 Ca -0.21 -0.31 -0.01 0.00 -1.01 0.00 0.00 57.07 55.53 1r8y s TYR 283 Cb 0.06 -1.16 0.01 0.00 -0.11 0.00 0.00 41.96 40.76 1r8y s TYR 283 CO 0.77 0.55 -0.13 -0.06 -1.11 0.00 0.00 175.55 175.57 1r8y s PHE 284 N -1.88 2.86 -0.18 2.71 0.08 0.80 -4.33 117.98 118.05 1r8y s PHE 284 Ca 0.24 -1.34 -0.07 0.00 0.12 0.00 0.00 56.93 55.89 1r8y s PHE 284 Cb -0.08 -2.00 -0.04 0.00 -0.57 0.00 0.00 43.02 40.33 1r8y s PHE 284 CO 0.13 -0.69 0.05 0.42 -0.10 0.00 0.00 175.22 175.02 1r8y s ILE 285 N 1.37 4.64 -0.19 0.64 1.01 -0.93 -1.48 121.20 126.27 1r8y s ILE 285 Ca 0.05 -0.09 -0.06 0.00 0.00 0.00 0.00 60.65 60.56 1r8y s ILE 285 Cb -0.14 -3.08 -0.03 0.00 0.01 0.00 0.00 42.46 39.22 1r8y s ILE 285 CO -0.09 0.47 0.02 -1.00 0.00 0.00 0.00 174.94 174.34 1r8y s HIS 286 N 0.37 3.10 -0.19 3.97 3.76 -0.02 0.28 115.29 126.56 1r8y s HIS 286 Ca 0.02 -0.25 0.01 0.00 -0.15 0.00 0.00 55.06 54.69 1r8y s HIS 286 Cb -0.13 -2.07 0.03 0.00 1.11 0.00 0.00 32.58 31.52 1r8y s HIS 286 CO 0.01 -0.08 -0.19 0.54 -0.85 0.00 0.00 174.74 174.17 1r8y s VAL 287 N 0.73 2.05 -0.05 -0.90 0.11 -0.15 -0.89 120.40 121.31 1r8y s VAL 287 Ca 0.01 -1.02 0.05 0.00 -2.93 0.00 0.00 61.98 58.09 1r8y s VAL 287 Cb -0.14 -1.90 -0.02 0.00 -1.53 0.00 0.00 36.38 32.79 1r8y s VAL 287 CO 0.02 0.46 -0.19 -0.76 -3.33 0.00 0.00 175.10 171.31 1r8y s LEU 288 N 1.27 2.47 -0.28 2.54 1.43 0.34 -1.88 118.68 124.57 1r8y s LEU 288 Ca 0.03 -0.32 -0.03 0.00 -1.03 0.00 0.00 54.13 52.78 1r8y s LEU 288 Cb -0.14 -1.48 0.03 0.00 0.03 0.00 0.00 46.19 44.63 1r8y s LEU 288 CO -0.12 0.31 0.00 -0.75 0.23 0.00 0.00 176.35 176.03 1r8y s LYS 289 N -0.55 2.79 0.33 1.70 2.47 0.68 -0.53 119.74 126.63 1r8y s LYS 289 Ca 0.07 -1.03 -0.29 0.00 -1.56 0.00 0.00 55.97 53.17 1r8y s LYS 289 Cb -0.11 -3.17 -0.12 0.00 -1.46 0.00 0.00 37.83 32.97 1r8y s LYS 289 CO 0.01 -0.48 1.44 1.17 0.16 0.00 0.00 175.35 177.65 1r8y n LYS 290 N 4.72 2.44 -3.80 4.03 4.81 -0.79 -0.37 118.16 129.19 1r8y n LYS 290 Ca -0.15 0.86 -0.30 0.00 -0.87 0.00 0.00 58.31 57.85 1r8y n LYS 290 Cb 0.46 -2.55 -0.13 0.00 0.02 0.00 0.00 35.03 32.83 1r8y n LYS 290 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 1r8y s THR 291 N -0.70 1.87 0.00 3.15 -4.23 -1.24 -0.02 115.64 114.47 1r8y s THR 291 Ca 0.58 -2.91 0.00 0.00 -1.18 0.00 0.00 61.69 58.19 1r8y s THR 291 Cb -0.53 -2.30 0.00 0.00 1.34 0.00 0.00 72.50 71.01 1r8y s THR 291 CO 0.58 -0.87 0.00 -0.67 -0.54 0.00 0.00 174.62 173.12