#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r8y s ASP 2 N 0.00 6.32 0.18 4.52 -0.00 -1.26 -5.02 116.67 121.42 1r8y s ASP 2 Ca 0.00 -3.11 0.08 0.00 -0.00 0.00 0.00 52.55 49.52 1r8y s ASP 2 Cb 0.00 -2.06 -0.04 0.00 -0.00 0.00 0.00 42.92 40.82 1r8y s ASP 2 CO 0.00 -0.39 -0.17 -0.44 -0.00 0.00 0.00 175.17 174.18 1r8y s SER 3 N 1.16 2.63 -0.69 0.27 0.01 -1.26 -5.14 113.70 110.67 1r8y s SER 3 Ca 0.22 -0.93 -0.07 0.00 1.31 0.00 0.00 55.95 56.48 1r8y s SER 3 Cb -0.12 -0.15 0.18 0.00 0.21 0.00 0.00 66.02 66.14 1r8y s SER 3 CO -0.08 -0.09 0.55 -0.69 0.41 0.00 0.00 173.24 173.34 1r8y s VAL 4 N -2.43 4.41 -0.14 3.43 1.01 -1.26 -5.02 120.40 120.40 1r8y s VAL 4 Ca 0.18 -2.74 -0.04 0.00 0.00 0.00 0.00 61.98 59.38 1r8y s VAL 4 Cb -0.04 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 1r8y s VAL 4 CO 0.07 -0.93 1.10 0.00 0.00 0.00 0.00 175.10 175.34 1r8y n TYR 5 N 3.71 0.12 -2.15 5.22 9.36 -1.26 -4.87 117.16 127.30 1r8y n TYR 5 Ca 0.09 -0.03 -0.36 0.00 3.32 0.00 0.00 57.90 60.92 1r8y n TYR 5 Cb 0.41 -0.77 0.01 0.00 -0.63 0.00 0.00 39.34 38.36 1r8y n TYR 5 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 1r8y s ARG 6 N 5.28 3.39 0.07 2.98 0.52 -1.26 -4.96 118.95 124.96 1r8y s ARG 6 Ca 0.12 1.80 -0.04 0.00 -0.52 0.00 0.00 55.73 57.09 1r8y s ARG 6 Cb -0.00 -2.17 -0.28 0.00 0.52 0.00 0.00 34.95 33.02 1r8y s ARG 6 CO 0.03 -0.86 1.10 1.15 0.02 0.00 0.00 175.30 176.74 1r8y h THR 7 N 1.40 1.46 -3.26 0.02 2.02 -2.08 -3.47 112.91 109.01 1r8y h THR 7 Ca -0.50 -3.04 -0.09 0.00 0.77 0.00 0.00 66.41 63.55 1r8y h THR 7 Cb 1.27 2.91 -0.17 0.00 -1.74 0.00 0.00 68.15 70.42 1r8y h THR 7 CO 0.58 0.88 -0.23 0.00 0.37 0.00 0.00 175.52 177.12 1r8y s ARG 8 N -2.65 0.82 0.52 6.66 1.70 -1.26 -5.15 118.95 119.59 1r8y s ARG 8 Ca -0.04 -0.48 -0.20 0.00 -0.47 0.00 0.00 55.73 54.54 1r8y s ARG 8 Cb 0.07 0.36 -0.10 0.00 -0.57 0.00 0.00 34.95 34.71 1r8y s ARG 8 CO 0.88 -0.26 0.59 0.43 -1.08 0.00 0.00 175.30 175.86 1r8y n SER 9 N 0.59 -0.71 -4.73 -2.89 7.64 -1.26 -4.88 113.62 107.38 1r8y n SER 9 Ca -0.19 0.80 -0.42 0.00 1.01 0.00 0.00 58.87 60.08 1r8y n SER 9 Cb 0.59 -1.19 -0.03 0.00 -1.01 0.00 0.00 64.21 62.58 1r8y n SER 9 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1r8y s LEU 10 N 0.72 4.37 0.00 -3.43 1.43 -1.26 -3.24 118.68 117.27 1r8y s LEU 10 Ca 0.67 2.76 0.00 0.00 -1.03 0.00 0.00 54.13 56.53 1r8y s LEU 10 Cb -0.49 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.13 1r8y s LEU 10 CO 0.55 -0.88 0.00 0.61 0.23 0.00 0.00 176.35 176.86 1r8y n GLY 11 N 3.49 0.70 3.98 -3.19 0.00 -1.26 -5.07 105.19 103.85 1r8y n GLY 11 Ca 0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.53 2.24 0.04 1.61 -7.23 -1.20 -5.08 120.40 108.24 1r8y s VAL 12 Ca 0.00 -0.57 -0.10 0.00 -1.81 0.00 0.00 61.98 59.50 1r8y s VAL 12 Cb 0.00 -2.67 0.01 0.00 0.56 0.00 0.00 36.38 34.28 1r8y s VAL 12 CO 0.00 0.00 0.22 0.00 -0.31 0.00 0.00 175.10 175.01 1r8y s ALA 13 N -3.10 -0.44 0.41 1.32 0.00 -1.26 -4.54 121.76 114.15 1r8y s ALA 13 Ca 0.64 -0.20 0.07 0.00 0.00 0.00 0.00 51.96 52.48 1r8y s ALA 13 Cb -0.07 0.27 -0.08 0.00 0.00 0.00 0.00 23.12 23.25 1r8y s ALA 13 CO 0.43 -0.36 0.02 0.00 0.00 0.00 0.00 175.76 175.86 1r8y s ALA 14 N -2.46 3.21 -0.10 0.00 0.00 -1.26 -5.09 121.76 116.06 1r8y s ALA 14 Ca -0.06 -2.28 -0.22 0.00 0.00 0.00 0.00 51.96 49.41 1r8y s ALA 14 Cb -0.01 0.13 -0.19 0.00 0.00 0.00 0.00 23.12 23.05 1r8y s ALA 14 CO -0.03 -0.12 0.69 0.93 0.00 0.00 0.00 175.76 177.22 1r8y h GLU 15 N 1.74 -0.04 -0.74 0.00 3.07 -2.02 -3.30 114.58 113.29 1r8y h GLU 15 Ca -0.44 0.00 0.15 0.00 -0.50 0.00 0.00 59.36 58.57 1r8y h GLU 15 Cb 1.24 0.01 -0.10 0.00 -0.84 0.00 0.00 28.75 29.06 1r8y h GLU 15 CO 0.80 0.61 0.26 0.78 -1.40 0.00 0.00 179.01 180.06 1r8y h GLY 16 N -0.93 1.09 -3.82 -3.84 0.00 -2.08 -3.46 103.07 90.03 1r8y h GLY 16 Ca -0.00 -0.11 -0.55 0.00 0.00 0.00 0.00 47.33 46.67 1r8y h GLY 16 CO 0.01 -0.13 -0.18 1.08 0.00 0.00 0.00 176.54 177.31 1r8y s LEU 17 N -10.49 4.20 0.46 3.11 1.43 -1.24 -5.07 118.68 111.08 1r8y s LEU 17 Ca -0.13 0.80 -0.24 0.00 -1.03 0.00 0.00 54.13 53.54 1r8y s LEU 17 Cb 0.21 -3.56 -0.07 0.00 0.03 0.00 0.00 46.19 42.80 1r8y s LEU 17 CO 0.76 -0.03 1.25 -2.84 0.23 0.00 0.00 176.35 175.71 1r8y s PRO 18 N -2.78 3.70 0.71 1.29 0.02 -1.26 -4.62 135.00 132.06 1r8y s PRO 18 Ca 0.45 1.99 -0.16 0.00 0.02 0.00 0.00 61.00 63.30 1r8y s PRO 18 Cb -0.11 -2.49 0.02 0.00 0.02 0.00 0.00 34.50 31.94 1r8y s PRO 18 CO 0.22 -0.66 1.26 -0.51 -0.33 0.00 0.00 177.00 176.98 1r8y s ASP 19 N -1.07 4.23 0.00 2.53 1.01 -1.26 -4.87 116.67 117.24 1r8y s ASP 19 Ca 0.63 2.52 0.00 0.00 0.71 0.00 0.00 52.55 56.41 1r8y s ASP 19 Cb -0.34 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 40.98 1r8y s ASP 19 CO 0.42 -2.25 0.00 0.00 0.21 0.00 0.00 175.17 173.55 1r8y n GLN 20 N -2.43 0.00 -0.27 8.23 1.13 -1.26 -1.68 117.38 121.09 1r8y n GLN 20 Ca 0.15 0.00 0.08 0.00 -1.94 0.00 0.00 57.00 55.29 1r8y n GLN 20 Cb 0.49 0.00 0.18 0.00 0.11 0.00 0.00 30.24 31.02 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 0.23 0.30 1.08 4.01 -1.26 -4.84 117.16 116.68 1r8y n TYR 21 Ca 0.00 -1.11 0.16 0.00 -0.16 0.00 0.00 57.90 56.79 1r8y n TYR 21 Cb 0.00 -0.22 0.92 0.00 -0.31 0.00 0.00 39.34 39.74 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 0.54 1.43 -0.42 -0.72 0.00 -1.66 -2.55 119.26 115.88 1r8y h ALA 22 Ca 0.02 -0.02 -0.31 0.00 0.00 0.00 0.00 54.91 54.60 1r8y h ALA 22 Cb 1.12 -0.00 -0.36 0.00 0.00 0.00 0.00 17.79 18.55 1r8y h ALA 22 CO 0.06 0.02 -0.92 -0.40 0.00 0.00 0.00 179.25 178.01 1r8y n ASP 23 N -3.73 2.67 -4.82 0.00 5.75 -1.26 -4.60 116.55 110.55 1r8y n ASP 23 Ca -0.03 -2.86 -0.33 0.00 -0.01 0.00 0.00 54.79 51.56 1r8y n ASP 23 Cb 0.10 -0.41 -0.04 0.00 -1.03 0.00 0.00 41.12 39.74 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 -3.40 2.26 0.00 6.12 0.00 -0.96 -4.92 107.32 106.42 1r8y s GLY 24 Ca 0.38 0.36 0.00 0.00 0.00 0.00 0.00 44.72 45.46 1r8y s GLY 24 CO -0.03 0.65 0.00 -2.21 0.00 0.00 0.00 173.10 171.50 1r8y n GLU 25 N -1.20 0.00 -0.06 2.90 4.07 -1.26 -1.69 120.64 123.40 1r8y n GLU 25 Ca 0.07 0.00 -0.15 0.00 -0.06 0.00 0.00 57.16 57.02 1r8y n GLU 25 Cb 0.54 0.00 -0.06 0.00 -0.06 0.00 0.00 31.44 31.86 1r8y n GLU 25 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1r8y h ALA 26 N 0.00 0.37 -0.80 4.31 0.00 -1.95 -2.85 119.26 118.35 1r8y h ALA 26 Ca 0.00 -0.51 0.03 0.00 0.00 0.00 0.00 54.91 54.42 1r8y h ALA 26 Cb 0.00 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 1r8y h ALA 26 CO 0.00 0.58 0.51 0.00 0.00 0.00 0.00 179.25 180.35 1r8y h ALA 27 N 0.62 1.04 -0.06 0.00 0.00 -1.79 -0.07 119.26 119.00 1r8y h ALA 27 Ca -0.00 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.90 1r8y h ALA 27 Cb 1.16 -0.28 -0.06 0.00 0.00 0.00 0.00 17.79 18.61 1r8y h ALA 27 CO 0.12 0.35 -0.47 -0.09 0.00 0.00 0.00 179.25 179.16 1r8y h ARG 28 N 1.01 -0.56 -0.20 0.00 2.43 -1.11 -1.03 114.38 114.93 1r8y h ARG 28 Ca 0.31 0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.43 1r8y h ARG 28 Cb -0.02 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 1r8y h ARG 28 CO -0.10 -0.38 -0.26 0.28 -1.51 0.00 0.00 179.97 178.00 1r8y h VAL 29 N -0.58 1.26 -0.38 0.20 2.07 -1.28 -2.89 116.25 114.65 1r8y h VAL 29 Ca 0.04 -1.23 -0.05 0.00 0.82 0.00 0.00 66.70 66.29 1r8y h VAL 29 Cb 0.67 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.82 1r8y h VAL 29 CO -0.37 0.38 0.04 -0.25 0.02 0.00 0.00 177.57 177.40 1r8y h TRP 30 N 0.33 0.60 -0.26 1.57 7.01 -0.34 -1.73 115.95 123.13 1r8y h TRP 30 Ca 0.05 -0.05 0.01 0.00 2.11 0.00 0.00 58.89 61.01 1r8y h TRP 30 Cb 0.64 -0.18 -0.02 0.00 -2.10 0.00 0.00 29.16 27.51 1r8y h TRP 30 CO 0.02 0.55 0.15 1.96 -2.79 0.00 0.00 178.44 178.33 1r8y h GLN 31 N 0.56 0.30 -0.94 2.65 4.20 -0.99 -0.83 115.11 120.05 1r8y h GLN 31 Ca 0.12 -0.02 0.19 0.00 0.06 0.00 0.00 58.65 59.00 1r8y h GLN 31 Cb 0.29 -0.07 -0.08 0.00 0.30 0.00 0.00 27.48 27.93 1r8y h GLN 31 CO 0.00 0.20 0.60 -0.07 -0.67 0.00 0.00 178.83 178.89 1r8y h LEU 32 N 0.30 0.59 0.37 1.46 3.38 -1.38 -0.38 115.31 119.65 1r8y h LEU 32 Ca 0.10 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 1r8y h LEU 32 Cb 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1r8y h LEU 32 CO -0.05 0.24 -0.18 0.22 0.09 0.00 0.00 178.44 178.76 1r8y h TYR 33 N 0.59 -0.46 0.00 1.13 3.20 -0.62 -2.50 116.97 118.30 1r8y h TYR 33 Ca 0.50 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.36 1r8y h TYR 33 Cb 1.00 0.15 0.00 0.00 1.54 0.00 0.00 36.73 39.42 1r8y h TYR 33 CO -0.00 -0.21 0.10 -0.84 -1.64 0.00 0.00 178.16 175.57 1r8y h ILE 34 N -1.08 0.00 0.00 1.81 3.07 -0.89 -1.34 117.51 119.08 1r8y h ILE 34 Ca -0.05 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.36 1r8y h ILE 34 Cb 0.46 0.60 0.00 0.00 -0.27 0.00 0.00 36.82 37.61 1r8y h ILE 34 CO 0.08 0.00 -1.10 0.61 -1.05 0.00 0.00 178.15 176.69 1r8y n GLY 35 N -1.23 -1.21 1.05 0.16 0.00 -0.18 -3.89 105.19 99.90 1r8y n GLY 35 Ca -0.02 -0.40 -0.01 0.00 0.00 0.00 0.00 46.02 45.59 1r8y n GLY 35 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1r8y n ASP 36 N -2.03 3.03 -3.87 1.61 3.85 -0.50 -4.50 116.55 114.14 1r8y n ASP 36 Ca 0.01 -2.06 0.00 0.00 -0.71 0.00 0.00 54.79 52.03 1r8y n ASP 36 Cb 0.45 -0.51 0.00 0.00 -1.35 0.00 0.00 41.12 39.71 1r8y n ASP 36 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 1r8y n THR 37 N 0.44 0.00 -3.80 2.12 -2.24 -1.25 -4.59 114.28 104.96 1r8y n THR 37 Ca 0.02 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.52 1r8y n THR 37 Cb 0.54 -0.18 0.04 0.00 -2.10 0.00 0.00 70.33 68.63 1r8y n THR 37 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1r8y n ARG 38 N 0.00 -6.25 -3.33 -0.78 1.74 -1.26 -4.88 116.66 101.89 1r8y n ARG 38 Ca 0.00 0.67 -0.13 0.00 -0.77 0.00 0.00 57.85 57.62 1r8y n ARG 38 Cb 0.00 -5.60 -0.07 0.00 -1.02 0.00 0.00 32.46 25.78 1r8y n ARG 38 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1r8y s SER 39 N -3.39 0.73 0.06 0.55 1.04 -1.26 -5.04 113.70 106.39 1r8y s SER 39 Ca 0.60 -1.21 -0.31 0.00 0.48 0.00 0.00 55.95 55.51 1r8y s SER 39 Cb -0.29 0.83 -0.07 0.00 0.10 0.00 0.00 66.02 66.59 1r8y s SER 39 CO 0.80 -0.27 1.45 -0.60 0.98 0.00 0.00 173.24 175.60 1r8y s ARG 40 N 1.75 4.28 0.25 4.02 3.52 -1.26 -2.08 118.95 129.42 1r8y s ARG 40 Ca 0.15 2.09 -0.31 0.00 -0.13 0.00 0.00 55.73 57.53 1r8y s ARG 40 Cb -0.13 -3.45 -0.12 0.00 -1.56 0.00 0.00 34.95 29.69 1r8y s ARG 40 CO -0.11 -0.56 1.65 0.25 -0.81 0.00 0.00 175.30 175.72 1r8y n THR 41 N 4.41 0.56 -0.25 4.11 -2.24 0.02 -4.90 114.28 115.99 1r8y n THR 41 Ca 0.13 -0.14 -0.06 0.00 -2.27 0.00 0.00 64.05 61.71 1r8y n THR 41 Cb 0.42 -1.94 0.05 0.00 -2.10 0.00 0.00 70.33 66.76 1r8y n THR 41 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1r8y h ALA 42 N 5.64 0.91 -0.33 6.98 0.00 -1.92 -2.42 119.26 128.12 1r8y h ALA 42 Ca -0.45 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.33 1r8y h ALA 42 Cb 1.22 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 1r8y h ALA 42 CO 0.86 0.49 -0.20 0.39 0.00 0.00 0.00 179.25 180.79 1r8y n GLU 43 N -4.42 -0.15 0.48 0.00 -0.58 -1.26 -1.18 120.64 113.53 1r8y n GLU 43 Ca 0.06 0.79 -0.20 0.00 -0.42 0.00 0.00 57.16 57.39 1r8y n GLU 43 Cb 0.14 -1.18 -0.09 0.00 -0.57 0.00 0.00 31.44 29.74 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 -1.11 -0.89 -0.32 3.20 -1.65 -2.34 116.97 113.85 1r8y h TYR 44 Ca 0.05 -0.03 0.09 0.00 3.14 0.00 0.00 58.73 61.99 1r8y h TYR 44 Cb 0.14 0.37 -0.12 0.00 1.54 0.00 0.00 36.73 38.66 1r8y h TYR 44 CO -0.62 -0.69 -0.48 1.17 -1.64 0.00 0.00 178.16 175.90 1r8y n LYS 45 N -5.60 -0.35 -0.20 1.82 4.81 -0.95 -0.85 118.16 116.84 1r8y n LYS 45 Ca -0.16 1.36 -0.03 0.00 -0.87 0.00 0.00 58.31 58.61 1r8y n LYS 45 Cb 0.48 -2.00 0.07 0.00 0.02 0.00 0.00 35.03 33.60 1r8y n LYS 45 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1r8y h ALA 46 N 0.64 0.77 0.43 3.14 0.00 -1.00 -1.99 119.26 121.24 1r8y h ALA 46 Ca 0.18 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1r8y h ALA 46 Cb 0.41 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1r8y h ALA 46 CO -0.85 -0.02 -0.20 2.35 0.00 0.00 0.00 179.25 180.52 1r8y h TRP 47 N 0.59 -0.53 -0.30 0.00 7.01 -0.44 0.85 115.95 123.14 1r8y h TRP 47 Ca 0.26 -0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.25 1r8y h TRP 47 Cb 0.15 0.18 -0.02 0.00 -2.10 0.00 0.00 29.16 27.37 1r8y h TRP 47 CO -0.09 -0.22 0.19 1.25 -2.79 0.00 0.00 178.44 176.78 1r8y h LEU 48 N -0.80 0.33 -0.80 0.65 5.85 -1.13 0.38 115.31 119.77 1r8y h LEU 48 Ca -0.06 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.62 1r8y h LEU 48 Cb 0.54 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 1r8y h LEU 48 CO 0.10 0.24 0.37 -0.07 -0.34 0.00 0.00 178.44 178.74 1r8y h LEU 49 N 0.39 1.06 0.39 2.25 3.38 -1.42 -0.47 115.31 120.90 1r8y h LEU 49 Ca 0.11 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1r8y h LEU 49 Cb -0.03 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 1r8y h LEU 49 CO -0.03 0.91 -0.29 1.23 0.09 0.00 0.00 178.44 180.35 1r8y h GLY 50 N 1.15 -0.72 0.56 0.83 0.00 0.57 -2.35 103.07 103.11 1r8y h GLY 50 Ca 0.27 0.33 -0.02 0.00 0.00 0.00 0.00 47.33 47.92 1r8y h GLY 50 CO -0.03 -0.27 -0.49 -2.00 0.00 0.00 0.00 176.54 173.74 1r8y h LEU 51 N -0.68 -1.34 -0.77 3.11 5.85 -0.06 0.25 115.31 121.68 1r8y h LEU 51 Ca -0.04 0.10 0.16 0.00 0.84 0.00 0.00 57.88 58.94 1r8y h LEU 51 Cb 0.58 0.44 -0.10 0.00 0.37 0.00 0.00 40.66 41.94 1r8y h LEU 51 CO 0.01 -0.67 0.28 -0.07 -0.34 0.00 0.00 178.44 177.65 1r8y h LEU 52 N -1.02 0.22 -0.22 2.25 3.38 -1.07 -1.31 115.31 117.55 1r8y h LEU 52 Ca -0.06 0.12 -0.21 0.00 0.09 0.00 0.00 57.88 57.82 1r8y h LEU 52 Cb 0.87 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 1r8y h LEU 52 CO -0.04 0.06 -0.92 0.03 0.09 0.00 0.00 178.44 177.66 1r8y h ARG 53 N 0.40 0.26 0.00 1.13 3.08 -1.32 0.13 114.38 118.05 1r8y h ARG 53 Ca 0.43 -0.29 -0.04 0.00 0.07 0.00 0.00 59.98 60.15 1r8y h ARG 53 Cb 0.70 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 1r8y h ARG 53 CO -0.44 1.01 -0.20 0.37 -1.07 0.00 0.00 179.97 179.64 1r8y h GLN 54 N 0.14 0.00 -0.65 0.04 -0.00 -0.08 -2.13 115.11 112.43 1r8y h GLN 54 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.59 1r8y h GLN 54 Cb 1.56 0.00 0.00 0.00 0.00 0.00 0.00 27.48 29.04 1r8y h GLN 54 CO 0.15 0.20 0.00 0.72 0.00 0.00 0.00 178.83 179.89 1r8y n HIS 55 N -3.96 1.37 -2.77 3.99 8.25 -0.58 -4.97 115.22 116.56 1r8y n HIS 55 Ca -0.02 -0.55 -0.20 0.00 -0.26 0.00 0.00 57.72 56.69 1r8y n HIS 55 Cb 0.28 -0.22 0.01 0.00 1.12 0.00 0.00 29.99 31.18 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 1.13 -0.51 3.78 -1.41 0.00 -0.80 -4.98 105.19 102.41 1r8y n GLY 56 Ca 0.24 0.06 -0.37 0.00 0.00 0.00 0.00 46.02 45.95 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 0.26 0.00 -2.80 0.00 -0.00 -1.26 -4.73 115.22 106.70 1r8y n HIS 58 Ca 0.03 0.00 -0.43 0.00 0.46 0.00 0.00 57.72 57.79 1r8y n HIS 58 Cb 0.50 0.38 -0.04 0.00 -0.12 0.00 0.00 29.99 30.72 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 -1.98 3.76 0.02 1.57 0.52 -1.26 -2.06 118.95 119.52 1r8y s ARG 59 Ca 0.00 0.48 0.08 0.00 -0.52 0.00 0.00 55.73 55.77 1r8y s ARG 59 Cb 0.00 -3.84 -0.03 0.00 0.52 0.00 0.00 34.95 31.61 1r8y s ARG 59 CO 0.00 -1.03 -0.24 0.08 0.02 0.00 0.00 175.30 174.12 1r8y s VAL 60 N 3.59 2.26 -0.17 3.52 1.01 -0.34 -0.81 120.40 129.46 1r8y s VAL 60 Ca 0.38 -1.23 0.01 0.00 0.00 0.00 0.00 61.98 61.14 1r8y s VAL 60 Cb -0.11 -1.86 0.01 0.00 0.00 0.00 0.00 36.38 34.42 1r8y s VAL 60 CO 0.21 0.44 -0.19 -0.22 0.00 0.00 0.00 175.10 175.34 1r8y s LEU 61 N -1.04 2.21 -0.33 3.92 2.96 -0.45 -1.07 118.68 124.88 1r8y s LEU 61 Ca 0.12 -0.60 -0.09 0.00 -0.22 0.00 0.00 54.13 53.34 1r8y s LEU 61 Cb -0.10 -1.49 0.01 0.00 0.50 0.00 0.00 46.19 45.11 1r8y s LEU 61 CO 0.01 0.04 0.14 -0.62 -1.32 0.00 0.00 176.35 174.61 1r8y s ASP 62 N 1.08 5.47 0.00 3.68 -1.08 -0.26 -0.74 116.67 124.81 1r8y s ASP 62 Ca -0.00 -0.77 0.23 0.00 -0.52 0.00 0.00 52.55 51.48 1r8y s ASP 62 Cb -0.14 -1.96 0.33 0.00 -1.46 0.00 0.00 42.92 39.68 1r8y s ASP 62 CO -0.07 -0.26 1.33 1.33 0.52 0.00 0.00 175.17 178.02 1r8y n VAL 63 N 4.94 0.32 -2.73 1.11 0.24 -0.83 -1.29 118.33 120.09 1r8y n VAL 63 Ca -0.13 -0.66 -0.12 0.00 -2.04 0.00 0.00 64.34 61.39 1r8y n VAL 63 Cb 0.47 1.16 0.02 0.00 -1.47 0.00 0.00 33.84 34.03 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 1.40 3.32 -0.33 2.33 0.00 -1.22 -4.61 120.51 121.40 1r8y n ALA 64 Ca 0.17 -3.25 -0.09 0.00 0.00 0.00 0.00 53.44 50.27 1r8y n ALA 64 Cb 0.59 -0.91 -0.08 0.00 0.00 0.00 0.00 19.45 19.05 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 -1.20 3.08 0.00 0.00 0.00 -1.26 -2.17 105.19 103.64 1r8y n GLY 66 Ca 0.02 -0.27 0.11 0.00 0.00 0.00 0.00 46.02 45.88 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 0.00 -1.17 2.61 -2.24 -1.26 -3.71 114.28 108.52 1r8y n THR 67 Ca 0.00 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.72 1r8y n THR 67 Cb 0.00 -0.51 -0.03 0.00 -2.10 0.00 0.00 70.33 67.69 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 0.61 0.81 0.36 3.38 0.00 -0.92 -3.06 105.19 106.36 1r8y n GLY 68 Ca 0.17 -0.50 0.05 0.00 0.00 0.00 0.00 46.02 45.74 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 1.05 -0.11 1.61 -1.51 -1.90 0.25 116.25 115.63 1r8y h VAL 69 Ca -0.12 -0.29 -0.17 0.00 -1.23 0.00 0.00 66.70 64.88 1r8y h VAL 69 Cb 0.48 0.11 -0.01 0.00 -2.13 0.00 0.00 31.29 29.75 1r8y h VAL 69 CO 0.18 0.16 -0.67 0.44 -1.23 0.00 0.00 177.57 176.45 1r8y h ASP 70 N 0.86 0.52 -0.36 4.19 3.32 -1.93 -2.49 116.42 120.53 1r8y h ASP 70 Ca 0.34 -0.32 -0.11 0.00 0.02 0.00 0.00 57.03 56.96 1r8y h ASP 70 Cb 0.22 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1r8y h ASP 70 CO -0.11 1.04 -0.19 0.28 -1.72 0.00 0.00 179.24 178.54 1r8y h SER 71 N 0.32 0.80 -0.83 6.45 0.02 -1.59 -1.99 113.55 116.73 1r8y h SER 71 Ca -0.02 -0.41 0.08 0.00 -0.84 0.00 0.00 61.79 60.60 1r8y h SER 71 Cb 1.22 -0.22 -0.07 0.00 0.14 0.00 0.00 62.40 63.48 1r8y h SER 71 CO 0.12 1.03 0.49 0.40 -1.14 0.00 0.00 176.83 177.73 1r8y h ILE 72 N 0.56 0.97 -0.75 3.27 2.04 -0.55 0.70 117.51 123.75 1r8y h ILE 72 Ca 0.08 -0.29 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 1r8y h ILE 72 Cb 0.74 0.03 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 1r8y h ILE 72 CO 0.06 0.16 0.43 -0.03 0.00 0.00 0.00 178.15 178.76 1r8y h MET 73 N 0.86 1.03 -0.08 2.37 4.05 -0.90 0.03 114.93 122.28 1r8y h MET 73 Ca 0.38 -0.10 -0.15 0.00 -0.28 0.00 0.00 59.70 59.55 1r8y h MET 73 Cb 0.28 -0.21 0.01 0.00 -0.80 0.00 0.00 31.60 30.87 1r8y h MET 73 CO -0.21 0.74 -0.53 -0.07 0.23 0.00 0.00 176.91 177.07 1r8y h LEU 74 N 1.04 0.60 -1.74 3.39 3.38 -0.43 -2.61 115.31 118.95 1r8y h LEU 74 Ca 0.27 -0.67 -0.00 0.00 0.09 0.00 0.00 57.88 57.57 1r8y h LEU 74 Cb -0.00 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1r8y h LEU 74 CO -0.05 1.17 0.14 0.58 0.09 0.00 0.00 178.44 180.38 1r8y h VAL 75 N 0.08 1.07 -0.14 1.22 2.07 0.93 -1.87 116.25 119.61 1r8y h VAL 75 Ca -0.04 -0.16 -0.16 0.00 0.82 0.00 0.00 66.70 67.16 1r8y h VAL 75 Cb 1.18 0.74 0.01 0.00 -1.52 0.00 0.00 31.29 31.70 1r8y h VAL 75 CO 0.11 0.07 -0.53 -0.33 0.02 0.00 0.00 177.57 176.91 1r8y h GLU 76 N 0.32 0.60 0.00 1.57 5.08 -1.02 -3.28 114.58 117.86 1r8y h GLU 76 Ca 0.09 -0.46 0.00 0.00 -1.00 0.00 0.00 59.36 57.98 1r8y h GLU 76 Cb -0.01 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1r8y h GLU 76 CO -0.02 1.09 0.00 0.39 -1.00 0.00 0.00 179.01 179.47 1r8y n GLU 77 N -4.18 0.76 -0.57 2.33 -0.58 -0.73 -4.87 120.64 112.80 1r8y n GLU 77 Ca -0.07 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.67 1r8y n GLU 77 Cb 0.61 -1.01 0.00 0.00 -0.57 0.00 0.00 31.44 30.47 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 0.26 0.75 3.77 0.62 0.00 -1.05 -5.06 105.19 104.50 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 -2.60 2.67 -0.30 1.61 0.08 -1.07 -5.02 117.98 113.35 1r8y s PHE 79 Ca 0.00 1.34 -0.07 0.00 0.12 0.00 0.00 56.93 58.32 1r8y s PHE 79 Cb 0.00 -3.06 0.01 0.00 -0.57 0.00 0.00 43.02 39.39 1r8y s PHE 79 CO 0.00 -1.85 0.10 -1.54 -0.10 0.00 0.00 175.22 171.83 1r8y s SER 80 N -3.61 5.22 -0.08 1.36 1.04 -0.88 -4.56 113.70 112.19 1r8y s SER 80 Ca 0.61 -0.71 0.02 0.00 0.48 0.00 0.00 55.95 56.35 1r8y s SER 80 Cb -0.16 -1.90 0.01 0.00 0.10 0.00 0.00 66.02 64.07 1r8y s SER 80 CO 0.56 -0.21 -0.15 0.54 0.98 0.00 0.00 173.24 174.96 1r8y s VAL 81 N 1.51 1.41 -0.21 5.02 0.11 -1.26 -1.20 120.40 125.79 1r8y s VAL 81 Ca 0.03 -0.63 -0.11 0.00 -2.93 0.00 0.00 61.98 58.34 1r8y s VAL 81 Cb -0.17 -1.27 -0.05 0.00 -1.53 0.00 0.00 36.38 33.36 1r8y s VAL 81 CO 0.03 0.42 0.16 -0.32 -3.33 0.00 0.00 175.10 172.06 1r8y s MET 82 N 0.68 4.17 -0.09 1.54 1.75 -0.23 -2.51 119.30 124.60 1r8y s MET 82 Ca -0.13 -0.20 0.04 0.00 -1.25 0.00 0.00 55.69 54.15 1r8y s MET 82 Cb -0.16 -3.45 0.00 0.00 2.84 0.00 0.00 34.83 34.06 1r8y s MET 82 CO 0.04 0.23 -0.22 -1.12 -0.65 0.00 0.00 175.02 173.29 1r8y s SER 83 N 0.56 2.85 0.14 1.11 0.01 0.51 -1.11 113.70 117.78 1r8y s SER 83 Ca 0.09 -0.51 0.08 0.00 1.31 0.00 0.00 55.95 56.91 1r8y s SER 83 Cb -0.12 -1.28 -0.04 0.00 0.21 0.00 0.00 66.02 64.79 1r8y s SER 83 CO 0.00 0.14 -0.17 0.68 0.41 0.00 0.00 173.24 174.30 1r8y s VAL 84 N 0.37 1.64 0.21 3.43 -7.23 -0.42 -1.53 120.40 116.87 1r8y s VAL 84 Ca -0.17 -1.81 -0.15 0.00 -1.81 0.00 0.00 61.98 58.03 1r8y s VAL 84 Cb -0.17 -1.71 0.01 0.00 0.56 0.00 0.00 36.38 35.07 1r8y s VAL 84 CO 0.08 -0.33 0.49 -0.62 -0.31 0.00 0.00 175.10 174.41 1r8y s ASP 85 N -2.52 -0.17 0.00 4.85 -1.08 -1.16 -1.75 116.67 114.84 1r8y s ASP 85 Ca 0.12 -0.66 0.20 0.00 -0.52 0.00 0.00 52.55 51.70 1r8y s ASP 85 Cb -0.06 0.57 -0.14 0.00 -1.46 0.00 0.00 42.92 41.84 1r8y s ASP 85 CO 0.05 -1.08 0.90 0.00 0.52 0.00 0.00 175.17 175.56 1r8y n ALA 86 N -0.34 4.14 -2.55 3.66 0.00 -0.98 -0.13 120.51 124.31 1r8y n ALA 86 Ca -0.07 -0.57 -0.41 0.00 0.00 0.00 0.00 53.44 52.38 1r8y n ALA 86 Cb 0.62 -0.71 -0.09 0.00 0.00 0.00 0.00 19.45 19.27 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 -2.65 6.25 0.13 0.00 0.15 -1.26 -4.94 113.70 111.39 1r8y s SER 87 Ca 0.11 -0.15 -0.15 0.00 0.70 0.00 0.00 55.95 56.46 1r8y s SER 87 Cb 0.15 -2.23 -0.00 0.00 -1.71 0.00 0.00 66.02 62.23 1r8y s SER 87 CO 0.70 -0.42 1.63 0.44 1.20 0.00 0.00 173.24 176.79 1r8y h ASP 88 N 8.47 0.65 -0.94 5.45 3.32 -1.98 -0.74 116.42 130.64 1r8y h ASP 88 Ca -0.29 -0.23 0.17 0.00 0.02 0.00 0.00 57.03 56.70 1r8y h ASP 88 Cb 1.13 -0.17 -0.08 0.00 0.22 0.00 0.00 39.33 40.43 1r8y h ASP 88 CO 0.74 0.71 0.60 0.11 -1.72 0.00 0.00 179.24 179.68 1r8y h LYS 89 N 0.55 0.65 0.06 3.56 1.79 -2.01 0.60 116.57 121.78 1r8y h LYS 89 Ca 0.13 -0.04 -0.19 0.00 -2.18 0.00 0.00 60.65 58.37 1r8y h LYS 89 Cb 0.32 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 1r8y h LYS 89 CO 0.00 0.43 -0.98 0.52 -1.08 0.00 0.00 179.45 178.34 1r8y h MET 90 N 0.67 0.13 -0.53 3.15 2.86 -1.87 -3.36 114.93 115.99 1r8y h MET 90 Ca 0.50 -0.22 0.14 0.00 -2.06 0.00 0.00 59.70 58.06 1r8y h MET 90 Cb 0.87 0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.59 1r8y h MET 90 CO -0.26 1.11 0.37 -0.07 1.06 0.00 0.00 176.91 179.12 1r8y h LEU 91 N -0.65 0.06 -0.76 1.22 3.38 -0.97 0.16 115.31 117.75 1r8y h LEU 91 Ca -0.23 0.00 0.11 0.00 0.09 0.00 0.00 57.88 57.86 1r8y h LEU 91 Cb 1.45 -0.01 -0.12 0.00 0.09 0.00 0.00 40.66 42.07 1r8y h LEU 91 CO -0.01 0.03 -0.31 1.17 0.09 0.00 0.00 178.44 179.41 1r8y n LYS 92 N -4.40 -0.19 0.07 1.13 4.81 0.19 -0.71 118.16 119.06 1r8y n LYS 92 Ca 0.09 1.17 -0.04 0.00 -0.87 0.00 0.00 58.31 58.67 1r8y n LYS 92 Cb 0.55 -1.74 0.18 0.00 0.02 0.00 0.00 35.03 34.04 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 0.35 -0.13 5.64 0.05 -1.17 -0.57 116.97 121.15 1r8y h TYR 93 Ca 0.26 -0.11 -0.15 0.00 0.05 0.00 0.00 58.73 58.78 1r8y h TYR 93 Cb 0.45 -0.07 0.01 0.00 1.01 0.00 0.00 36.73 38.12 1r8y h TYR 93 CO -0.67 0.70 -0.51 0.00 -1.05 0.00 0.00 178.16 176.63 1r8y h ALA 94 N 1.28 0.24 -0.69 3.88 0.00 -1.12 -2.42 119.26 120.43 1r8y h ALA 94 Ca 0.02 -0.50 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 1r8y h ALA 94 Cb 0.91 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 1r8y h ALA 94 CO 0.07 0.43 0.30 -0.07 0.00 0.00 0.00 179.25 179.98 1r8y h LEU 95 N 0.21 0.91 -1.05 0.00 3.38 -0.79 -1.59 115.31 116.39 1r8y h LEU 95 Ca -0.03 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.75 1r8y h LEU 95 Cb 1.14 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 1r8y h LEU 95 CO 0.11 0.80 -0.18 0.50 0.09 0.00 0.00 178.44 179.75 1r8y h LYS 96 N 0.99 0.47 -0.02 1.13 3.64 -1.09 -1.54 116.57 120.14 1r8y h LYS 96 Ca 0.24 -0.15 -0.09 0.00 -1.27 0.00 0.00 60.65 59.37 1r8y h LYS 96 Cb 0.15 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1r8y h LYS 96 CO -0.03 0.63 -0.34 1.49 -2.27 0.00 0.00 179.45 178.93 1r8y h GLU 97 N 0.43 0.27 -0.39 1.90 4.57 -1.15 -2.47 114.58 117.73 1r8y h GLU 97 Ca 0.07 -0.26 0.07 0.00 -1.18 0.00 0.00 59.36 58.06 1r8y h GLU 97 Cb 0.56 0.07 -0.06 0.00 -0.16 0.00 0.00 28.75 29.15 1r8y h GLU 97 CO 0.04 0.95 -0.00 -0.09 -1.18 0.00 0.00 179.01 178.73 1r8y h ARG 98 N -0.31 0.10 -0.68 1.92 2.43 -1.25 -1.32 114.38 115.27 1r8y h ARG 98 Ca -0.04 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1r8y h ARG 98 Cb 1.05 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.55 1r8y h ARG 98 CO 0.07 0.07 0.36 2.35 -1.51 0.00 0.00 179.97 181.31 1r8y h TRP 99 N 0.10 0.95 -0.58 2.20 2.91 -1.30 -0.71 115.95 119.51 1r8y h TRP 99 Ca 0.19 -0.03 0.07 0.00 1.13 0.00 0.00 58.89 60.26 1r8y h TRP 99 Cb 0.27 -0.30 -0.03 0.00 -0.51 0.00 0.00 29.16 28.59 1r8y h TRP 99 CO -0.27 0.68 0.39 -0.91 -1.03 0.00 0.00 178.44 177.30 1r8y h ASN 100 N 0.93 0.44 -0.61 2.65 2.35 -1.00 -2.35 115.58 117.99 1r8y h ASN 100 Ca 0.24 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.74 1r8y h ASN 100 Cb 0.06 -0.09 -0.15 0.00 0.05 0.00 0.00 38.32 38.19 1r8y h ASN 100 CO -0.04 0.28 0.22 0.54 -1.65 0.00 0.00 177.43 176.78 1r8y n ARG 101 N -4.47 2.60 0.23 0.81 1.74 -0.39 -4.75 116.66 112.42 1r8y n ARG 101 Ca 0.09 -3.07 0.08 0.00 -0.77 0.00 0.00 57.85 54.18 1r8y n ARG 101 Cb 0.29 -2.03 0.55 0.00 -1.02 0.00 0.00 32.46 30.25 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 1.56 0.00 0.00 5.56 0.11 -0.66 -2.60 114.38 118.35 1r8y h ARG 102 Ca 0.31 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 60.31 1r8y h ARG 102 Cb 2.14 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 33.20 1r8y h ARG 102 CO 0.65 0.21 -0.38 0.87 0.10 0.00 0.00 179.97 181.43 1r8y h LYS 103 N 0.00 0.00 -6.20 0.08 1.79 -1.85 -3.38 116.57 107.00 1r8y h LYS 103 Ca -0.00 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.91 1r8y h LYS 103 Cb 0.46 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.08 1r8y h LYS 103 CO 0.03 0.38 0.88 -1.21 -1.08 0.00 0.00 179.45 178.44 1r8y s GLU 104 N -3.88 4.25 0.27 3.15 2.02 -0.98 -4.93 118.70 118.61 1r8y s GLU 104 Ca -0.01 1.72 0.03 0.00 0.02 0.00 0.00 54.97 56.73 1r8y s GLU 104 Cb 0.13 -3.73 0.39 0.00 0.10 0.00 0.00 34.13 31.01 1r8y s GLU 104 CO 0.70 -0.66 1.69 -1.35 0.02 0.00 0.00 175.26 175.66 1r8y h PRO 105 N 8.15 0.42 -0.70 0.39 0.11 -1.87 -0.79 132.00 137.71 1r8y h PRO 105 Ca -0.29 -0.18 0.11 0.00 0.11 0.00 0.00 66.00 65.75 1r8y h PRO 105 Cb 1.12 -0.01 -0.05 0.00 0.11 0.00 0.00 31.00 32.17 1r8y h PRO 105 CO 0.95 0.70 0.47 0.66 -0.21 0.00 0.00 178.00 180.57 1r8y h SER 106 N 0.36 0.45 0.95 -2.05 4.64 -1.91 -1.94 113.55 114.06 1r8y h SER 106 Ca 0.04 0.02 -0.20 0.00 -0.47 0.00 0.00 61.79 61.18 1r8y h SER 106 Cb 0.76 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 62.74 1r8y h SER 106 CO 0.06 0.26 -1.11 -0.26 -0.87 0.00 0.00 176.83 174.91 1r8y h PHE 107 N 0.50 0.00 -0.46 4.77 0.04 -1.45 -3.18 116.94 117.15 1r8y h PHE 107 Ca 0.33 0.00 0.10 0.00 2.80 0.00 0.00 57.97 61.20 1r8y h PHE 107 Cb 0.62 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.74 1r8y h PHE 107 CO -0.00 0.84 0.32 0.22 -0.60 0.00 0.00 178.31 179.09 1r8y h ASP 108 N 0.00 0.16 -0.54 2.17 3.58 -0.53 -2.76 116.42 118.50 1r8y h ASP 108 Ca -0.09 0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.25 1r8y h ASP 108 Cb 1.72 -0.03 -0.07 0.00 1.72 0.00 0.00 39.33 42.67 1r8y h ASP 108 CO 0.09 0.10 0.11 0.59 -2.88 0.00 0.00 179.24 177.25 1r8y n ASN 109 N -4.45 4.52 -4.73 2.28 3.02 -1.08 -4.89 115.26 109.94 1r8y n ASN 109 Ca 0.07 -3.17 -0.38 0.00 -0.03 0.00 0.00 54.58 51.07 1r8y n ASN 109 Cb 0.41 -0.67 -0.06 0.00 -0.61 0.00 0.00 39.78 38.85 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 -2.94 3.52 -0.22 3.10 -0.00 -1.05 -4.60 118.94 116.76 1r8y s TRP 110 Ca 0.51 0.91 -0.05 0.00 -0.00 0.00 0.00 56.10 57.47 1r8y s TRP 110 Cb 0.41 -2.56 -0.02 0.00 -0.00 0.00 0.00 33.47 31.30 1r8y s TRP 110 CO 0.11 0.18 -0.01 0.08 -0.00 0.00 0.00 176.95 177.31 1r8y s VAL 111 N 0.57 3.66 -0.14 5.86 1.01 -1.05 -5.04 120.40 125.28 1r8y s VAL 111 Ca 0.26 -0.40 0.02 0.00 0.00 0.00 0.00 61.98 61.86 1r8y s VAL 111 Cb -0.15 -2.67 -0.00 0.00 0.00 0.00 0.00 36.38 33.56 1r8y s VAL 111 CO 0.11 0.41 -0.18 -0.63 0.00 0.00 0.00 175.10 174.80 1r8y s ILE 112 N 1.41 2.44 0.19 2.22 1.01 -1.26 -0.36 121.20 126.85 1r8y s ILE 112 Ca 0.05 -0.86 -0.11 0.00 0.00 0.00 0.00 60.65 59.73 1r8y s ILE 112 Cb -0.14 -2.00 -0.00 0.00 0.01 0.00 0.00 42.46 40.32 1r8y s ILE 112 CO -0.01 0.53 0.36 -0.70 0.00 0.00 0.00 174.94 175.12 1r8y s GLU 113 N 0.66 1.29 -0.01 2.79 2.56 -0.58 -5.00 118.70 120.40 1r8y s GLU 113 Ca -0.09 -1.18 -0.16 0.00 0.00 0.00 0.00 54.97 53.54 1r8y s GLU 113 Cb -0.16 0.41 -0.06 0.00 2.00 0.00 0.00 34.13 36.33 1r8y s GLU 113 CO 0.02 -0.50 0.44 -1.21 -0.56 0.00 0.00 175.26 173.46 1r8y s GLU 114 N -3.98 4.05 -0.28 4.30 2.02 -1.26 -2.96 118.70 120.60 1r8y s GLU 114 Ca 0.19 0.47 -0.23 0.00 0.02 0.00 0.00 54.97 55.42 1r8y s GLU 114 Cb 0.02 -3.27 0.09 0.00 0.10 0.00 0.00 34.13 31.07 1r8y s GLU 114 CO 0.03 0.57 0.80 0.00 0.02 0.00 0.00 175.26 176.67 1r8y s ALA 115 N -0.72 -1.87 -0.14 5.21 0.00 0.81 -4.84 121.76 120.22 1r8y s ALA 115 Ca 0.25 2.08 -0.04 0.00 0.00 0.00 0.00 51.96 54.25 1r8y s ALA 115 Cb -0.17 -1.31 -0.03 0.00 0.00 0.00 0.00 23.12 21.61 1r8y s ALA 115 CO 0.13 -0.33 -0.00 1.21 0.00 0.00 0.00 175.76 176.78 1r8y s ASN 116 N 0.64 5.14 0.28 0.00 3.84 -1.26 -2.32 114.94 121.26 1r8y s ASN 116 Ca -0.02 0.01 0.01 0.00 0.21 0.00 0.00 52.86 53.08 1r8y s ASN 116 Cb -0.05 -1.71 0.55 0.00 -0.55 0.00 0.00 41.25 39.49 1r8y s ASN 116 CO -0.05 0.24 1.83 -0.50 -2.79 0.00 0.00 177.10 175.83 1r8y h TRP 117 N 6.16 1.13 0.00 0.43 6.55 -1.94 0.83 115.95 129.11 1r8y h TRP 117 Ca -0.39 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.48 1r8y h TRP 117 Cb 1.19 -0.36 0.00 0.00 -0.86 0.00 0.00 29.16 29.13 1r8y h TRP 117 CO 0.57 0.44 0.00 1.28 -1.05 0.00 0.00 178.44 179.68 1r8y n LEU 118 N -4.63 0.25 -0.34 -4.49 4.77 -1.26 -2.69 117.00 108.62 1r8y n LEU 118 Ca 0.19 0.57 0.03 0.00 -0.03 0.00 0.00 56.01 56.77 1r8y n LEU 118 Cb 0.36 -0.54 0.05 0.00 -2.33 0.00 0.00 43.42 40.96 1r8y n LEU 118 CO 0.27 -0.40 0.36 0.35 -1.33 0.00 0.00 177.39 176.64 1r8y n THR 119 N -1.79 0.66 -0.10 -5.08 -2.24 -0.36 -4.90 114.28 100.46 1r8y n THR 119 Ca 0.03 -0.79 0.16 0.00 -2.27 0.00 0.00 64.05 61.18 1r8y n THR 119 Cb 0.18 0.25 0.56 0.00 -2.10 0.00 0.00 70.33 69.22 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 0.00 0.27 -1.44 3.22 5.85 -0.68 -0.89 115.31 121.64 1r8y h LEU 120 Ca 0.00 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 1r8y h LEU 120 Cb 1.25 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 1r8y h LEU 120 CO 0.00 0.15 -0.09 -2.24 -0.34 0.00 0.00 178.44 175.91 1r8y h ASP 121 N 0.29 0.24 -0.01 1.25 -0.00 -1.85 -1.86 116.42 114.47 1r8y h ASP 121 Ca 0.31 -0.04 0.00 0.00 -0.00 0.00 0.00 57.03 57.30 1r8y h ASP 121 Cb 0.83 -0.06 0.00 0.00 -0.00 0.00 0.00 39.33 40.10 1r8y h ASP 121 CO -0.08 0.36 -0.28 0.29 -0.00 0.00 0.00 179.24 179.54 1r8y n LYS 122 N -4.30 1.58 0.01 4.15 5.02 -0.50 -4.54 118.16 119.57 1r8y n LYS 122 Ca -0.01 -1.02 -0.18 0.00 -2.02 0.00 0.00 58.31 55.08 1r8y n LYS 122 Cb 0.24 -1.33 -0.14 0.00 -0.02 0.00 0.00 35.03 33.79 1r8y n LYS 122 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1r8y h ASP 123 N 2.31 0.34 -3.30 4.39 3.32 -1.04 -3.45 116.42 118.99 1r8y h ASP 123 Ca 0.00 -0.72 -0.66 0.00 0.02 0.00 0.00 57.03 55.67 1r8y h ASP 123 Cb 0.63 -0.11 -0.29 0.00 0.22 0.00 0.00 39.33 39.78 1r8y h ASP 123 CO 0.00 1.64 -0.77 -0.69 -1.72 0.00 0.00 179.24 177.71 1r8y s VAL 124 N -2.57 2.98 -0.92 -1.35 1.01 -0.72 -4.95 120.40 113.88 1r8y s VAL 124 Ca -0.17 -0.64 -0.24 0.00 0.00 0.00 0.00 61.98 60.93 1r8y s VAL 124 Cb 0.07 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 34.11 1r8y s VAL 124 CO 0.79 0.47 1.82 -1.48 0.00 0.00 0.00 175.10 176.70 1r8y s LEU 125 N 1.23 3.25 0.21 3.92 -0.00 -1.26 -4.69 118.68 121.33 1r8y s LEU 125 Ca 0.02 -0.85 -0.22 0.00 -0.00 0.00 0.00 54.13 53.09 1r8y s LEU 125 Cb -0.14 -2.56 0.14 0.00 -0.00 0.00 0.00 46.19 43.62 1r8y s LEU 125 CO -0.04 -2.42 1.55 -1.28 -0.00 0.00 0.00 176.35 174.15 1r8y h SER 126 N 10.98 -1.69 0.00 1.48 0.87 -1.91 -3.48 113.55 119.81 1r8y h SER 126 Ca 0.11 0.32 0.00 0.00 -1.23 0.00 0.00 61.79 60.99 1r8y h SER 126 Cb 1.01 0.83 0.00 0.00 -0.44 0.00 0.00 62.40 63.80 1r8y h SER 126 CO 1.27 -0.27 0.00 0.61 -0.53 0.00 0.00 176.83 177.91 1r8y n GLY 127 N -1.40 0.35 0.23 5.77 0.00 -1.26 -3.68 105.19 105.20 1r8y n GLY 127 Ca 0.07 -0.94 0.11 0.00 0.00 0.00 0.00 46.02 45.27 1r8y n GLY 127 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1r8y h ASP 128 N 7.91 0.00 -3.78 1.61 -0.00 -1.98 -3.49 116.42 116.68 1r8y h ASP 128 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 1r8y h ASP 128 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.33 1r8y h ASP 128 CO 0.00 0.14 0.00 0.61 -0.00 0.00 0.00 179.24 179.99 1r8y n GLY 129 N 0.52 2.55 3.79 7.15 0.00 -1.24 -4.47 105.19 113.49 1r8y n GLY 129 Ca 0.02 -1.76 -0.30 0.00 0.00 0.00 0.00 46.02 43.98 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 -1.74 3.21 0.28 1.61 0.40 -0.01 -4.62 117.98 117.10 1r8y s PHE 130 Ca 0.00 0.07 0.01 0.00 -0.60 0.00 0.00 56.93 56.41 1r8y s PHE 130 Cb 0.00 -1.61 0.39 0.00 0.51 0.00 0.00 43.02 42.31 1r8y s PHE 130 CO 0.00 0.53 1.74 -0.44 0.70 0.00 0.00 175.22 177.75 1r8y h ASP 131 N 3.10 0.59 -3.51 1.36 3.32 -1.30 -1.96 116.42 118.01 1r8y h ASP 131 Ca -0.47 -0.17 -0.20 0.00 0.02 0.00 0.00 57.03 56.21 1r8y h ASP 131 Cb 1.17 -0.16 -0.29 0.00 0.22 0.00 0.00 39.33 40.27 1r8y h ASP 131 CO 0.66 0.76 -0.51 0.00 -1.72 0.00 0.00 179.24 178.44 1r8y s ALA 132 N -4.69 -0.48 -0.11 3.45 0.00 -1.04 -1.46 121.76 117.42 1r8y s ALA 132 Ca -0.08 0.80 -0.01 0.00 0.00 0.00 0.00 51.96 52.67 1r8y s ALA 132 Cb 0.14 -0.50 -0.03 0.00 0.00 0.00 0.00 23.12 22.73 1r8y s ALA 132 CO 0.80 -0.16 -0.08 0.08 0.00 0.00 0.00 175.76 176.40 1r8y s VAL 133 N 0.87 3.58 0.11 0.00 1.01 0.12 -1.34 120.40 124.75 1r8y s VAL 133 Ca -0.06 -0.49 0.09 0.00 0.00 0.00 0.00 61.98 61.52 1r8y s VAL 133 Cb -0.08 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 1r8y s VAL 133 CO -0.05 0.54 -0.20 0.27 0.00 0.00 0.00 175.10 175.66 1r8y s ILE 134 N -0.11 2.68 -0.46 2.22 -4.36 0.08 -0.65 121.20 120.60 1r8y s ILE 134 Ca 0.01 -1.52 0.06 0.00 -0.26 0.00 0.00 60.65 58.94 1r8y s ILE 134 Cb -0.13 -2.20 0.18 0.00 1.25 0.00 0.00 42.46 41.56 1r8y s ILE 134 CO 0.03 0.14 0.58 0.00 0.24 0.00 0.00 174.94 175.92 1r8y n LEU 136 N 3.34 0.00 -1.69 0.00 4.77 -1.26 -2.62 117.00 119.54 1r8y n LEU 136 Ca 0.18 -2.25 -0.14 0.00 -0.03 0.00 0.00 56.01 53.78 1r8y n LEU 136 Cb 0.53 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1r8y n LEU 136 CO 0.02 -0.53 -0.12 0.61 -1.33 0.00 0.00 177.39 176.05 1r8y n GLY 137 N -0.28 -0.16 2.43 -0.72 0.00 -1.26 -3.61 105.19 101.60 1r8y n GLY 137 Ca -0.01 -0.28 -0.15 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.71 -4.83 0.24 1.61 5.15 -1.26 -4.90 115.26 110.57 1r8y n ASN 138 Ca -0.13 0.35 0.12 0.00 -0.60 0.00 0.00 54.58 54.32 1r8y n ASN 138 Cb 0.61 -3.69 0.55 0.00 -0.53 0.00 0.00 39.78 36.71 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 0.56 1.20 0.02 -1.83 -2.44 113.55 111.06 1r8y h SER 139 Ca -0.32 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.53 1r8y h SER 139 Cb 1.02 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.54 1r8y h SER 139 CO 0.46 0.16 -0.49 0.15 -1.14 0.00 0.00 176.83 175.96 1r8y h PHE 140 N 0.00 0.00 0.00 3.45 3.57 -1.88 -1.75 116.94 120.34 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 0.64 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.38 1r8y h PHE 140 CO 0.00 0.49 0.00 0.00 -2.23 0.00 0.00 178.31 176.57 1r8y n ALA 141 N -2.42 1.39 0.17 2.41 0.00 -0.92 -1.34 120.51 119.80 1r8y n ALA 141 Ca -0.01 -0.02 0.02 0.00 0.00 0.00 0.00 53.44 53.42 1r8y n ALA 141 Cb 0.52 -1.09 0.27 0.00 0.00 0.00 0.00 19.45 19.15 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 -1.48 0.50 115.15 114.54 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 0.06 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.47 1r8y h HIS 142 CO 0.00 0.48 0.93 -1.17 0.86 0.00 0.00 177.93 179.03 1r8y s LEU 143 N -7.49 3.73 0.82 2.43 2.96 -0.45 -4.75 118.68 115.94 1r8y s LEU 143 Ca -0.01 0.75 -0.12 0.00 -0.22 0.00 0.00 54.13 54.53 1r8y s LEU 143 Cb 0.12 -3.55 0.09 0.00 0.50 0.00 0.00 46.19 43.35 1r8y s LEU 143 CO 0.73 -1.16 1.12 -2.16 -1.32 0.00 0.00 176.35 173.56 1r8y s PRO 144 N 4.27 1.86 -1.07 0.98 0.04 -1.26 -4.67 135.00 135.15 1r8y s PRO 144 Ca 0.50 0.44 -0.03 0.00 0.04 0.00 0.00 61.00 61.95 1r8y s PRO 144 Cb -0.10 -1.91 0.31 0.00 0.04 0.00 0.00 34.50 32.84 1r8y s PRO 144 CO 0.27 -1.73 1.66 -3.47 0.04 0.00 0.00 177.00 173.76 1r8y n ASP 145 N -3.47 6.83 -0.05 6.66 2.03 -1.26 -4.82 116.55 122.46 1r8y n ASP 145 Ca 0.07 -3.52 -0.01 0.00 0.52 0.00 0.00 54.79 51.84 1r8y n ASP 145 Cb 0.58 -1.23 0.25 0.00 -0.72 0.00 0.00 41.12 39.99 1r8y n ASP 145 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1r8y n LYS 147 N -4.27 4.09 0.00 0.00 4.81 -1.26 -5.01 118.16 116.52 1r8y n LYS 147 Ca 0.02 -2.98 0.00 0.00 -0.87 0.00 0.00 58.31 54.49 1r8y n LYS 147 Cb 0.24 -2.03 0.00 0.00 0.02 0.00 0.00 35.03 33.26 1r8y n LYS 147 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1r8y n GLY 148 N 0.57 2.33 3.76 3.14 0.00 -1.07 -4.92 105.19 109.00 1r8y n GLY 148 Ca 0.25 -0.44 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 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 4.90 -0.05 1.61 1.47 -1.26 -4.89 116.67 118.46 1r8y s ASP 149 Ca 0.00 2.02 0.00 0.00 1.18 0.00 0.00 52.55 55.75 1r8y s ASP 149 Cb 0.00 -2.55 0.07 0.00 -0.34 0.00 0.00 42.92 40.10 1r8y s ASP 149 CO 0.00 -1.77 1.09 0.00 0.68 0.00 0.00 175.17 175.16 1r8y n GLN 150 N -2.61 1.14 -0.32 2.11 6.02 -1.26 -4.50 117.38 117.95 1r8y n GLN 150 Ca 0.11 -0.31 0.20 0.00 -0.01 0.00 0.00 57.00 56.98 1r8y n GLN 150 Cb 0.52 -1.13 0.46 0.00 1.02 0.00 0.00 30.24 31.11 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 0.11 0.53 1.06 1.08 4.64 -1.92 0.14 113.55 119.20 1r8y h SER 151 Ca 0.07 0.09 -0.13 0.00 -0.47 0.00 0.00 61.79 61.35 1r8y h SER 151 Cb 1.18 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.26 1r8y h SER 151 CO 0.11 0.13 -0.60 -0.33 -0.87 0.00 0.00 176.83 175.27 1r8y h GLU 152 N 0.48 0.00 -0.21 4.77 5.08 -1.93 -2.49 114.58 120.29 1r8y h GLU 152 Ca 0.59 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.93 1r8y h GLU 152 Cb 1.34 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 1r8y h GLU 152 CO -0.33 0.60 0.04 0.45 -1.00 0.00 0.00 179.01 178.77 1r8y h HIS 153 N 0.00 0.36 0.00 4.33 3.86 -1.06 -1.53 115.15 121.11 1r8y h HIS 153 Ca -0.01 -0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.15 1r8y h HIS 153 Cb 1.30 -0.10 -0.00 0.00 1.06 0.00 0.00 27.41 29.67 1r8y h HIS 153 CO 0.00 0.47 -0.03 0.00 0.86 0.00 0.00 177.93 179.24 1r8y h ARG 154 N 0.14 0.00 0.17 2.45 3.08 -1.28 0.47 114.38 119.41 1r8y h ARG 154 Ca 0.06 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.81 1r8y h ARG 154 Cb 0.30 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.37 1r8y h ARG 154 CO 0.00 0.03 -1.50 1.25 -1.07 0.00 0.00 179.97 178.68 1r8y h LEU 155 N 0.00 0.56 -0.36 3.04 5.85 -1.35 -2.56 115.31 120.49 1r8y h LEU 155 Ca -0.00 -0.91 0.05 0.00 0.84 0.00 0.00 57.88 57.86 1r8y h LEU 155 Cb 0.05 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.85 1r8y h LEU 155 CO 0.00 1.68 0.08 0.00 -0.34 0.00 0.00 178.44 179.86 1r8y h ALA 156 N 0.06 0.39 -0.38 1.25 0.00 -0.96 -2.59 119.26 117.04 1r8y h ALA 156 Ca -0.30 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.59 1r8y h ALA 156 Cb 1.95 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.82 1r8y h ALA 156 CO 0.15 -0.32 -0.12 -0.07 0.00 0.00 0.00 179.25 178.89 1r8y h LEU 157 N 0.20 0.76 -0.95 0.00 3.38 -1.00 -1.49 115.31 116.20 1r8y h LEU 157 Ca 0.17 -0.38 0.04 0.00 0.09 0.00 0.00 57.88 57.80 1r8y h LEU 157 Cb 0.19 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.68 1r8y h LEU 157 CO -0.22 0.96 0.62 0.11 0.09 0.00 0.00 178.44 180.00 1r8y h LYS 158 N 0.54 1.15 0.49 1.13 1.57 -1.43 -1.01 116.57 119.01 1r8y h LYS 158 Ca 0.09 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1r8y h LYS 158 Cb 0.65 -0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1r8y h LYS 158 CO 0.04 0.76 -0.23 -0.91 -0.57 0.00 0.00 179.45 178.54 1r8y h ASN 159 N 1.19 -0.55 -0.79 0.86 -0.26 -1.43 0.25 115.58 114.84 1r8y h ASN 159 Ca 0.38 -0.07 0.18 0.00 -0.56 0.00 0.00 56.30 56.24 1r8y h ASN 159 Cb 0.03 0.14 -0.14 0.00 -1.06 0.00 0.00 38.32 37.29 1r8y h ASN 159 CO -0.13 -0.16 -0.06 0.40 -1.06 0.00 0.00 177.43 176.42 1r8y h ILE 160 N -1.04 0.26 -0.51 2.81 2.04 -1.24 0.37 117.51 120.20 1r8y h ILE 160 Ca -0.07 -0.02 0.01 0.00 1.00 0.00 0.00 64.86 65.79 1r8y h ILE 160 Cb 0.59 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 1r8y h ILE 160 CO 0.11 0.01 0.34 0.00 0.00 0.00 0.00 178.15 178.61 1r8y h ALA 161 N 1.77 1.67 0.00 1.87 0.00 -1.06 -1.81 119.26 121.70 1r8y h ALA 161 Ca 0.42 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1r8y h ALA 161 Cb 0.74 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1r8y h ALA 161 CO -0.74 0.30 0.00 -1.13 0.00 0.00 0.00 179.25 177.67 1r8y n SER 162 N -4.46 0.56 0.19 0.00 3.41 0.13 -1.47 113.62 111.97 1r8y n SER 162 Ca 0.05 0.67 0.12 0.00 -0.26 0.00 0.00 58.87 59.45 1r8y n SER 162 Cb 0.08 -0.78 0.23 0.00 -0.26 0.00 0.00 64.21 63.48 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 -6.28 4.33 2.86 -1.02 -3.46 114.93 111.35 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 0.24 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.87 1r8y h MET 163 CO 0.00 0.00 0.36 0.08 1.06 0.00 0.00 176.91 178.41 1r8y s VAL 164 N -3.18 4.88 0.74 -2.22 1.01 -0.54 -0.83 120.40 120.26 1r8y s VAL 164 Ca 0.08 1.92 -0.15 0.00 0.00 0.00 0.00 61.98 63.83 1r8y s VAL 164 Cb 0.07 -4.26 0.03 0.00 0.00 0.00 0.00 36.38 32.23 1r8y s VAL 164 CO 0.65 0.14 1.13 0.54 0.00 0.00 0.00 175.10 177.55 1r8y n ARG 165 N 4.19 0.50 -1.72 2.72 1.74 -0.74 -4.71 116.66 118.63 1r8y n ARG 165 Ca 0.05 0.23 -0.43 0.00 -0.77 0.00 0.00 57.85 56.94 1r8y n ARG 165 Cb 0.50 -2.37 -0.01 0.00 -1.02 0.00 0.00 32.46 29.56 1r8y n ARG 165 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1r8y n PRO 166 N -2.44 2.40 -1.78 5.56 -0.02 -1.26 -1.34 135.00 136.11 1r8y n PRO 166 Ca 0.14 0.85 -0.13 0.00 -2.02 0.00 0.00 63.50 62.33 1r8y n PRO 166 Cb 0.50 -2.54 -0.03 0.00 -0.02 0.00 0.00 33.50 31.40 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 1.53 0.69 3.92 -1.23 0.00 -1.15 -4.92 105.19 104.04 1r8y n GLY 167 Ca 0.07 -0.37 -0.26 0.00 0.00 0.00 0.00 46.02 45.46 1r8y n GLY 167 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1r8y s GLY 168 N -2.65 2.32 -0.11 -0.02 0.00 -0.45 -4.78 107.32 101.62 1r8y s GLY 168 Ca 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 44.72 43.41 1r8y s GLY 168 CO 0.00 -1.92 -0.11 1.08 0.00 0.00 0.00 173.10 172.15 1r8y s LEU 169 N -4.33 2.86 -0.20 0.66 1.02 -0.54 -1.24 118.68 116.91 1r8y s LEU 169 Ca 0.36 -0.23 -0.02 0.00 0.02 0.00 0.00 54.13 54.26 1r8y s LEU 169 Cb -0.03 -1.64 -0.00 0.00 0.02 0.00 0.00 46.19 44.55 1r8y s LEU 169 CO 0.23 0.23 -0.09 -0.22 0.02 0.00 0.00 176.35 176.51 1r8y s LEU 170 N -0.01 2.68 -0.32 1.79 2.96 -0.82 0.15 118.68 125.10 1r8y s LEU 170 Ca -0.02 -0.46 -0.05 0.00 -0.22 0.00 0.00 54.13 53.38 1r8y s LEU 170 Cb -0.14 -1.66 0.04 0.00 0.50 0.00 0.00 46.19 44.93 1r8y s LEU 170 CO 0.04 -0.00 0.08 -0.69 -1.32 0.00 0.00 176.35 174.45 1r8y s VAL 171 N 1.35 3.62 -0.02 1.68 1.01 0.17 -1.78 120.40 126.44 1r8y s VAL 171 Ca 0.04 -1.12 0.00 0.00 0.00 0.00 0.00 61.98 60.90 1r8y s VAL 171 Cb -0.14 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.23 1r8y s VAL 171 CO -0.05 -0.12 0.00 -0.51 0.00 0.00 0.00 175.10 174.42 1r8y s ILE 172 N 1.38 0.11 0.42 2.22 2.07 -0.32 -0.69 121.20 126.40 1r8y s ILE 172 Ca -0.02 0.08 0.05 0.00 -1.41 0.00 0.00 60.65 59.35 1r8y s ILE 172 Cb -0.19 -0.19 -0.06 0.00 0.13 0.00 0.00 42.46 42.14 1r8y s ILE 172 CO 0.02 0.11 0.02 1.51 -1.91 0.00 0.00 174.94 174.68 1r8y s ASP 173 N 0.77 3.74 -0.08 4.50 -4.77 -1.08 -1.01 116.67 118.75 1r8y s ASP 173 Ca -0.07 -1.44 -0.30 0.00 -3.30 0.00 0.00 52.55 47.43 1r8y s ASP 173 Cb -0.10 -0.15 0.07 0.00 -1.09 0.00 0.00 42.92 41.65 1r8y s ASP 173 CO -0.02 -0.56 0.70 -1.38 0.70 0.00 0.00 175.17 174.61 1r8y s HIS 174 N -2.82 -0.66 0.76 2.11 -3.43 -0.50 -4.43 115.29 106.32 1r8y s HIS 174 Ca 0.29 1.18 -0.15 0.00 -0.80 0.00 0.00 55.06 55.57 1r8y s HIS 174 Cb 0.08 0.40 0.03 0.00 -1.43 0.00 0.00 32.58 31.66 1r8y s HIS 174 CO 0.15 -0.57 1.05 -2.13 -2.00 0.00 0.00 174.74 171.23 1r8y n ARG 175 N 1.07 0.41 -2.11 -0.38 0.63 -1.26 -0.42 116.66 114.59 1r8y n ARG 175 Ca -0.18 0.20 -0.29 0.00 -0.92 0.00 0.00 57.85 56.66 1r8y n ARG 175 Cb 0.57 -2.31 -0.05 0.00 0.45 0.00 0.00 32.46 31.13 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 -1.80 5.31 0.07 6.15 3.84 0.10 -4.68 114.94 123.93 1r8y s ASN 176 Ca 0.73 -0.67 0.25 0.00 0.21 0.00 0.00 52.86 53.39 1r8y s ASN 176 Cb -0.32 -2.56 0.60 0.00 -0.55 0.00 0.00 41.25 38.42 1r8y s ASN 176 CO 0.50 -2.57 1.51 -1.22 -2.79 0.00 0.00 177.10 172.53 1r8y n TYR 177 N 13.29 0.33 -0.18 0.43 4.01 -1.26 -2.32 117.16 131.46 1r8y n TYR 177 Ca 0.37 0.10 -0.10 0.00 -0.16 0.00 0.00 57.90 58.11 1r8y n TYR 177 Cb 0.48 -0.54 0.01 0.00 -0.31 0.00 0.00 39.34 38.98 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 0.85 0.28 7.72 3.32 -1.85 -0.46 116.42 126.28 1r8y h ASP 178 Ca 0.00 -0.29 -0.01 0.00 0.02 0.00 0.00 57.03 56.75 1r8y h ASP 178 Cb 0.62 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.95 1r8y h ASP 178 CO 0.00 0.93 -0.14 0.22 -1.72 0.00 0.00 179.24 178.53 1r8y h TYR 179 N 0.74 -0.35 -0.09 4.55 3.20 -1.93 -2.90 116.97 120.18 1r8y h TYR 179 Ca 0.15 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.05 1r8y h TYR 179 Cb 0.47 0.12 -0.05 0.00 1.54 0.00 0.00 36.73 38.81 1r8y h TYR 179 CO 0.04 -0.06 -0.22 0.82 -1.64 0.00 0.00 178.16 177.10 1r8y h ILE 180 N -0.64 0.47 -0.75 1.81 2.04 -1.36 0.79 117.51 119.88 1r8y h ILE 180 Ca -0.04 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.84 1r8y h ILE 180 Cb 0.45 0.47 -0.04 0.00 -0.74 0.00 0.00 36.82 36.96 1r8y h ILE 180 CO 0.06 0.00 0.48 -0.07 0.00 0.00 0.00 178.15 178.63 1r8y h LEU 181 N -0.30 0.81 -0.84 1.44 3.38 -1.19 2.62 115.31 121.23 1r8y h LEU 181 Ca 0.09 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 1r8y h LEU 181 Cb 0.42 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1r8y h LEU 181 CO -0.26 0.57 -0.55 0.77 0.09 0.00 0.00 178.44 179.05 1r8y h SER 182 N 0.96 0.08 0.08 -0.43 4.64 -1.18 -3.18 113.55 114.52 1r8y h SER 182 Ca 0.29 -0.04 -0.16 0.00 -0.47 0.00 0.00 61.79 61.40 1r8y h SER 182 Cb -0.04 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 1r8y h SER 182 CO -0.09 0.62 -0.80 0.74 -0.87 0.00 0.00 176.83 176.43 1r8y h THR 183 N 0.06 1.39 0.00 2.95 2.02 -0.57 -3.49 112.91 115.27 1r8y h THR 183 Ca -0.00 -2.41 0.00 0.00 0.77 0.00 0.00 66.41 64.77 1r8y h THR 183 Cb 1.00 3.01 0.00 0.00 -1.74 0.00 0.00 68.15 70.42 1r8y h THR 183 CO 0.08 0.63 0.00 0.61 0.37 0.00 0.00 175.52 177.21 1r8y n GLY 184 N 1.64 0.72 3.42 2.16 0.00 0.88 -5.05 105.19 108.96 1r8y n GLY 184 Ca -0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.77 3.25 0.36 0.00 0.00 -1.26 -4.52 121.76 118.81 1r8y s ALA 186 Ca 0.12 -2.12 -0.28 0.00 0.00 0.00 0.00 51.96 49.68 1r8y s ALA 186 Cb -0.10 -2.58 -0.11 0.00 0.00 0.00 0.00 23.12 20.32 1r8y s ALA 186 CO 0.02 -1.62 1.42 -2.14 0.00 0.00 0.00 175.76 173.45 1r8y s PRO 187 N 1.40 4.20 0.40 0.00 0.02 -1.26 -4.91 135.00 134.85 1r8y s PRO 187 Ca 0.03 2.44 -0.19 0.00 0.02 0.00 0.00 61.00 63.30 1r8y s PRO 187 Cb -0.22 -3.01 -0.10 0.00 0.02 0.00 0.00 34.50 31.19 1r8y s PRO 187 CO 0.02 -0.41 0.88 -1.25 -0.33 0.00 0.00 177.00 175.91 1r8y s PRO 188 N -1.96 4.14 -1.30 5.54 0.04 -1.26 -4.38 135.00 135.83 1r8y s PRO 188 Ca 0.52 0.97 -0.03 0.00 0.04 0.00 0.00 61.00 62.49 1r8y s PRO 188 Cb -0.44 -2.26 0.01 0.00 0.04 0.00 0.00 34.50 31.85 1r8y s PRO 188 CO 0.59 0.02 0.94 0.41 0.04 0.00 0.00 177.00 179.00 1r8y n GLY 189 N -0.61 -0.39 0.35 0.56 0.00 -1.26 -4.91 105.19 98.93 1r8y n GLY 189 Ca 0.06 0.15 0.09 0.00 0.00 0.00 0.00 46.02 46.31 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 -4.39 1.92 -1.67 1.61 4.76 -1.26 -4.95 118.16 114.18 1r8y n LYS 190 Ca -0.21 -2.61 -0.48 0.00 -2.87 0.00 0.00 58.31 52.15 1r8y n LYS 190 Cb 0.64 -1.58 -0.05 0.00 -1.84 0.00 0.00 35.03 32.20 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 -1.05 3.07 -0.06 4.39 2.85 -1.26 -4.86 115.26 118.34 1r8y n ASN 191 Ca 0.17 1.04 0.10 0.00 -0.11 0.00 0.00 54.58 55.79 1r8y n ASN 191 Cb 0.70 -1.37 -0.08 0.00 1.24 0.00 0.00 39.78 40.27 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 4.04 0.00 -0.08 -1.44 -5.35 -1.26 -4.08 119.36 111.18 1r8y n ILE 192 Ca 0.20 -0.03 -0.23 0.00 -0.27 0.00 0.00 62.75 62.42 1r8y n ILE 192 Cb 0.27 0.98 -0.12 0.00 -1.74 0.00 0.00 39.64 39.03 1r8y n ILE 192 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1r8y n TYR 193 N -1.33 0.75 -3.82 4.28 4.01 -1.26 -4.38 117.16 115.40 1r8y n TYR 193 Ca 0.05 0.25 -0.27 0.00 -0.16 0.00 0.00 57.90 57.76 1r8y n TYR 193 Cb 0.35 -1.09 -0.17 0.00 -0.31 0.00 0.00 39.34 38.13 1r8y n TYR 193 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1r8y s TYR 194 N -2.47 1.39 0.20 -0.72 2.02 -1.26 -0.80 117.35 115.72 1r8y s TYR 194 Ca -0.30 -0.94 -0.31 0.00 -0.37 0.00 0.00 57.07 55.16 1r8y s TYR 194 Cb 0.08 -1.17 -0.09 0.00 -0.40 0.00 0.00 41.96 40.38 1r8y s TYR 194 CO 0.62 -0.59 1.44 -1.59 -1.57 0.00 0.00 175.55 173.86 1r8y s LYS 195 N 1.74 4.29 -0.29 -0.62 -2.85 -0.88 -4.68 119.74 116.44 1r8y s LYS 195 Ca 0.00 2.24 -0.23 0.00 -1.00 0.00 0.00 55.97 56.98 1r8y s LYS 195 Cb -0.16 -3.15 -0.00 0.00 -2.06 0.00 0.00 37.83 32.45 1r8y s LYS 195 CO -0.07 -0.43 0.75 -1.12 0.10 0.00 0.00 175.35 174.57 1r8y s SER 196 N 0.63 6.65 -0.06 0.03 0.01 -1.26 -4.41 113.70 115.28 1r8y s SER 196 Ca 0.62 0.68 0.05 0.00 1.31 0.00 0.00 55.95 58.60 1r8y s SER 196 Cb -0.41 -2.39 0.24 0.00 0.21 0.00 0.00 66.02 63.68 1r8y s SER 196 CO 0.38 -0.55 0.96 0.47 0.41 0.00 0.00 173.24 174.91 1r8y n ASP 197 N 6.06 2.18 -3.79 2.44 8.00 -1.26 -4.79 116.55 125.39 1r8y n ASP 197 Ca 0.03 -2.22 -0.30 0.00 0.71 0.00 0.00 54.79 53.01 1r8y n ASP 197 Cb 0.48 -0.46 -0.15 0.00 -0.02 0.00 0.00 41.12 40.97 1r8y n ASP 197 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1r8y s LEU 198 N -0.89 2.56 -0.16 0.64 2.96 -1.26 -5.08 118.68 117.44 1r8y s LEU 198 Ca 0.17 -1.62 -0.29 0.00 -0.22 0.00 0.00 54.13 52.16 1r8y s LEU 198 Cb 0.12 -0.98 -0.04 0.00 0.50 0.00 0.00 46.19 45.79 1r8y s LEU 198 CO 0.06 -0.39 1.75 -0.89 -1.32 0.00 0.00 176.35 175.56 1r8y s THR 199 N 1.51 3.49 -0.09 3.68 2.01 -1.26 -4.96 115.64 120.03 1r8y s THR 199 Ca 0.08 0.56 -0.08 0.00 0.31 0.00 0.00 61.69 62.56 1r8y s THR 199 Cb -0.18 -3.48 0.02 0.00 0.01 0.00 0.00 72.50 68.88 1r8y s THR 199 CO -0.20 -0.18 0.24 -1.59 -0.69 0.00 0.00 174.62 172.20 1r8y s LYS 200 N 4.76 0.27 -0.12 4.92 -2.85 -1.26 -3.87 119.74 121.59 1r8y s LYS 200 Ca 0.78 0.33 -0.01 0.00 -1.00 0.00 0.00 55.97 56.07 1r8y s LYS 200 Cb -0.30 0.13 -0.02 0.00 -2.06 0.00 0.00 37.83 35.58 1r8y s LYS 200 CO 0.32 -0.04 -0.08 0.34 0.10 0.00 0.00 175.35 175.99 1r8y s ASP 201 N 0.15 4.45 -0.05 0.03 -1.08 0.40 -4.84 116.67 115.72 1r8y s ASP 201 Ca -0.00 -0.18 0.04 0.00 -0.52 0.00 0.00 52.55 51.89 1r8y s ASP 201 Cb -0.02 -1.54 -0.00 0.00 -1.46 0.00 0.00 42.92 39.90 1r8y s ASP 201 CO 0.00 0.22 -0.18 -0.63 0.52 0.00 0.00 175.17 175.10 1r8y s ILE 202 N 0.05 1.55 -0.20 4.11 1.01 -1.26 0.10 121.20 126.57 1r8y s ILE 202 Ca -0.02 -0.77 -0.01 0.00 0.00 0.00 0.00 60.65 59.84 1r8y s ILE 202 Cb -0.14 -1.34 0.01 0.00 0.01 0.00 0.00 42.46 41.00 1r8y s ILE 202 CO 0.03 0.44 -0.12 -0.89 0.00 0.00 0.00 174.94 174.41 1r8y s THR 203 N 0.12 2.74 -0.19 2.92 2.01 -0.81 -5.00 115.64 117.44 1r8y s THR 203 Ca -0.07 -0.72 -0.16 0.00 0.31 0.00 0.00 61.69 61.06 1r8y s THR 203 Cb -0.13 -2.21 -0.04 0.00 0.01 0.00 0.00 72.50 70.13 1r8y s THR 203 CO 0.03 0.47 0.38 -0.89 -0.69 0.00 0.00 174.62 173.93 1r8y s THR 204 N 1.39 5.22 -0.11 -0.82 2.01 -1.26 -1.97 115.64 120.10 1r8y s THR 204 Ca 0.05 0.69 0.02 0.00 0.31 0.00 0.00 61.69 62.77 1r8y s THR 204 Cb -0.14 -3.71 0.01 0.00 0.01 0.00 0.00 72.50 68.67 1r8y s THR 204 CO -0.08 0.29 -0.19 -0.44 -0.69 0.00 0.00 174.62 173.51 1r8y s SER 205 N 0.90 2.69 -0.17 3.53 0.01 -0.01 -4.93 113.70 115.71 1r8y s SER 205 Ca 0.19 -0.49 -0.05 0.00 1.31 0.00 0.00 55.95 56.91 1r8y s SER 205 Cb -0.14 -1.23 -0.03 0.00 0.21 0.00 0.00 66.02 64.83 1r8y s SER 205 CO 0.07 0.06 0.01 -0.69 0.41 0.00 0.00 173.24 173.10 1r8y s VAL 206 N 0.78 4.27 -0.23 3.43 1.01 -1.26 -0.23 120.40 128.17 1r8y s VAL 206 Ca -0.10 -0.22 -0.08 0.00 0.00 0.00 0.00 61.98 61.58 1r8y s VAL 206 Cb -0.16 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 1r8y s VAL 206 CO 0.01 0.47 0.09 -0.22 0.00 0.00 0.00 175.10 175.45 1r8y s LEU 207 N 0.41 3.65 -0.24 3.92 2.96 0.17 -5.01 118.68 124.53 1r8y s LEU 207 Ca -0.01 -0.08 -0.00 0.00 -0.22 0.00 0.00 54.13 53.82 1r8y s LEU 207 Cb -0.13 -1.97 0.03 0.00 0.50 0.00 0.00 46.19 44.62 1r8y s LEU 207 CO 0.02 0.03 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.10 1r8y s THR 208 N 1.24 2.58 -0.23 3.68 2.01 -1.26 -0.96 115.64 122.70 1r8y s THR 208 Ca 0.05 -1.18 -0.07 0.00 0.31 0.00 0.00 61.69 60.80 1r8y s THR 208 Cb -0.14 -2.34 -0.03 0.00 0.01 0.00 0.00 72.50 70.00 1r8y s THR 208 CO 0.04 0.18 0.05 -0.69 -0.69 0.00 0.00 174.62 173.51 1r8y s VAL 209 N 1.26 4.31 -1.27 3.82 1.01 -0.85 -4.60 120.40 124.08 1r8y s VAL 209 Ca -0.02 -0.18 -0.25 0.00 0.00 0.00 0.00 61.98 61.54 1r8y s VAL 209 Cb -0.17 -2.99 0.03 0.00 0.00 0.00 0.00 36.38 33.25 1r8y s VAL 209 CO -0.06 0.38 0.57 0.59 0.00 0.00 0.00 175.10 176.58 1r8y n ASN 210 N 4.52 -3.20 -2.08 3.32 3.02 -1.26 -0.89 115.26 118.68 1r8y n ASN 210 Ca -0.16 -1.24 -0.21 0.00 -0.03 0.00 0.00 54.58 52.94 1r8y n ASN 210 Cb 0.52 -2.02 -0.04 0.00 -0.61 0.00 0.00 39.78 37.62 1r8y n ASN 210 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1r8y n ASN 211 N -2.41 -5.70 -3.80 6.41 6.94 -1.26 -5.00 115.26 110.43 1r8y n ASN 211 Ca -0.16 0.20 -0.25 0.00 -0.02 0.00 0.00 54.58 54.35 1r8y n ASN 211 Cb 0.60 -4.86 -0.17 0.00 -2.36 0.00 0.00 39.78 32.99 1r8y n ASN 211 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1r8y s LYS 212 N -4.53 0.86 0.14 -3.83 2.20 -0.07 -5.11 119.74 109.40 1r8y s LYS 212 Ca 0.00 -0.15 -0.34 0.00 -0.36 0.00 0.00 55.97 55.11 1r8y s LYS 212 Cb 0.00 -1.47 -0.15 0.00 -1.51 0.00 0.00 37.83 34.69 1r8y s LYS 212 CO 0.00 -0.40 1.36 0.00 -0.36 0.00 0.00 175.35 175.95 1r8y n ALA 213 N 5.06 -0.15 0.00 3.13 0.00 -1.26 -2.01 120.51 125.27 1r8y n ALA 213 Ca -0.09 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1r8y n ALA 213 Cb 0.49 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.79 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 2.39 0.00 -3.66 0.00 -0.00 -0.14 -4.88 115.22 108.93 1r8y n HIS 214 Ca 0.16 0.00 -0.14 0.00 0.46 0.00 0.00 57.72 58.20 1r8y n HIS 214 Cb 0.24 0.00 -0.08 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 0.74 -0.19 1.57 1.75 -1.16 -4.66 119.30 115.74 1r8y s MET 215 Ca 0.00 0.59 0.01 0.00 -1.25 0.00 0.00 55.69 55.05 1r8y s MET 215 Cb 0.00 0.36 0.03 0.00 2.84 0.00 0.00 34.83 38.05 1r8y s MET 215 CO 0.00 -0.14 -0.17 0.08 -0.65 0.00 0.00 175.02 174.14 1r8y s VAL 216 N -0.15 1.98 -0.20 10.11 1.01 -0.18 -0.66 120.40 132.32 1r8y s VAL 216 Ca -0.03 -1.02 -0.04 0.00 0.00 0.00 0.00 61.98 60.88 1r8y s VAL 216 Cb -0.03 -1.87 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 1r8y s VAL 216 CO 0.03 0.40 -0.04 -0.89 0.00 0.00 0.00 175.10 174.60 1r8y s THR 217 N 1.29 3.61 -0.18 3.92 2.01 0.68 -0.13 115.64 126.85 1r8y s THR 217 Ca 0.02 -0.43 -0.05 0.00 0.31 0.00 0.00 61.69 61.54 1r8y s THR 217 Cb -0.14 -2.62 -0.03 0.00 0.01 0.00 0.00 72.50 69.72 1r8y s THR 217 CO -0.11 0.44 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.49 1r8y s LEU 218 N 1.05 3.31 -0.40 4.42 1.43 0.31 -0.83 118.68 127.97 1r8y s LEU 218 Ca 0.01 -0.14 -0.13 0.00 -1.03 0.00 0.00 54.13 52.84 1r8y s LEU 218 Cb -0.15 -1.82 0.03 0.00 0.03 0.00 0.00 46.19 44.28 1r8y s LEU 218 CO 0.00 0.13 0.27 -1.81 0.23 0.00 0.00 176.35 175.17 1r8y s ASP 219 N 0.63 5.95 0.01 2.29 1.01 -0.83 -1.25 116.67 124.47 1r8y s ASP 219 Ca -0.01 -0.98 -0.23 0.00 0.71 0.00 0.00 52.55 52.03 1r8y s ASP 219 Cb -0.14 -2.10 -0.05 0.00 1.01 0.00 0.00 42.92 41.64 1r8y s ASP 219 CO 0.02 -0.44 0.71 -0.31 0.21 0.00 0.00 175.17 175.36 1r8y s TYR 220 N 1.62 3.68 -0.36 4.23 1.51 0.15 -1.91 117.35 126.27 1r8y s TYR 220 Ca 0.04 1.35 0.02 0.00 -1.01 0.00 0.00 57.07 57.47 1r8y s TYR 220 Cb -0.19 -2.77 0.10 0.00 -0.11 0.00 0.00 41.96 38.99 1r8y s TYR 220 CO 0.08 0.25 0.09 0.99 -1.11 0.00 0.00 175.55 175.84 1r8y s THR 221 N 0.13 2.55 -0.09 -0.71 2.01 0.29 -1.29 115.64 118.53 1r8y s THR 221 Ca 0.37 -2.25 -0.07 0.00 0.31 0.00 0.00 61.69 60.04 1r8y s THR 221 Cb -0.19 -2.83 -0.04 0.00 0.01 0.00 0.00 72.50 69.45 1r8y s THR 221 CO 0.20 -0.61 0.17 -0.69 -0.69 0.00 0.00 174.62 173.01 1r8y s VAL 222 N 0.97 5.45 0.08 3.82 1.01 -0.18 -0.46 120.40 131.09 1r8y s VAL 222 Ca 0.10 0.22 -0.27 0.00 0.00 0.00 0.00 61.98 62.03 1r8y s VAL 222 Cb -0.20 -3.45 -0.06 0.00 0.00 0.00 0.00 36.38 32.67 1r8y s VAL 222 CO -0.07 0.57 0.83 0.00 0.00 0.00 0.00 175.10 176.43 1r8y s GLN 223 N -1.17 4.57 0.01 2.72 -2.07 -1.25 -1.31 119.66 121.16 1r8y s GLN 223 Ca 0.18 1.20 -0.01 0.00 -1.82 0.00 0.00 55.36 54.91 1r8y s GLN 223 Cb -0.13 -3.36 -0.04 0.00 -1.09 0.00 0.00 33.01 28.40 1r8y s GLN 223 CO 0.07 0.28 0.13 0.54 -1.32 0.00 0.00 175.29 174.99 1r8y s VAL 224 N -0.13 5.01 -0.65 3.63 0.11 -1.26 -4.95 120.40 122.15 1r8y s VAL 224 Ca 0.41 -0.36 -0.19 0.00 -2.93 0.00 0.00 61.98 58.91 1r8y s VAL 224 Cb -0.22 -3.34 -0.15 0.00 -1.53 0.00 0.00 36.38 31.14 1r8y s VAL 224 CO 0.25 0.30 1.73 -2.65 -3.33 0.00 0.00 175.10 171.40 1r8y n PRO 225 N 0.93 0.00 0.00 1.54 -0.01 -1.26 -3.16 135.00 133.05 1r8y n PRO 225 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.38 1r8y n PRO 225 Cb 0.52 -0.95 0.00 0.00 -0.01 0.00 0.00 33.50 33.06 1r8y n PRO 225 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1r8y n GLY 226 N 4.18 0.61 0.00 -1.23 0.00 -1.26 -5.20 105.19 102.29 1r8y n GLY 226 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.45 1r8y n GLY 226 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1r8y n THR 227 N 0.00 0.00 -4.18 2.61 5.66 -1.19 -5.28 114.28 111.90 1r8y n THR 227 Ca 0.00 0.04 -0.34 0.00 -3.05 0.00 0.00 64.05 60.70 1r8y n THR 227 Cb 0.00 -0.33 -0.15 0.00 -1.55 0.00 0.00 70.33 68.30 1r8y n THR 227 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 1r8y s PHE 235 N 0.00 2.85 0.20 1.09 0.40 -1.26 -4.88 117.98 116.38 1r8y s PHE 235 Ca 0.00 -1.14 0.10 0.00 -0.60 0.00 0.00 56.93 55.28 1r8y s PHE 235 Cb 0.00 -1.98 -0.04 0.00 0.51 0.00 0.00 43.02 41.50 1r8y s PHE 235 CO 0.00 -0.58 -0.19 -1.12 0.70 0.00 0.00 175.22 174.03 1r8y s SER 236 N 1.18 2.96 0.05 1.36 0.01 -0.42 -5.00 113.70 113.84 1r8y s SER 236 Ca 0.02 -0.92 0.09 0.00 1.31 0.00 0.00 55.95 56.44 1r8y s SER 236 Cb -0.14 -0.20 -0.03 0.00 0.21 0.00 0.00 66.02 65.86 1r8y s SER 236 CO -0.05 -0.02 -0.24 -0.75 0.41 0.00 0.00 173.24 172.60 1r8y s LYS 237 N -3.04 1.63 0.17 12.44 2.20 -1.26 -1.01 119.74 130.86 1r8y s LYS 237 Ca 0.20 -1.05 -0.08 0.00 -0.36 0.00 0.00 55.97 54.68 1r8y s LYS 237 Cb -0.05 -1.79 -0.01 0.00 -1.51 0.00 0.00 37.83 34.47 1r8y s LYS 237 CO 0.09 0.46 0.27 -0.59 -0.36 0.00 0.00 175.35 175.22 1r8y s PHE 238 N -0.81 0.49 0.01 4.03 -0.71 -0.41 -4.32 117.98 116.27 1r8y s PHE 238 Ca 0.10 -0.85 0.02 0.00 -1.04 0.00 0.00 56.93 55.16 1r8y s PHE 238 Cb -0.10 -0.11 -0.01 0.00 -1.21 0.00 0.00 43.02 41.60 1r8y s PHE 238 CO 0.02 -0.72 -0.07 0.50 -1.34 0.00 0.00 175.22 173.61 1r8y s ARG 239 N -3.99 0.52 -0.02 1.99 3.52 -1.26 0.32 118.95 120.01 1r8y s ARG 239 Ca 0.20 -0.37 -0.07 0.00 -0.13 0.00 0.00 55.73 55.36 1r8y s ARG 239 Cb 0.04 -0.45 0.01 0.00 -1.56 0.00 0.00 34.95 32.98 1r8y s ARG 239 CO 0.02 0.11 0.15 -0.51 -0.81 0.00 0.00 175.30 174.27 1r8y s LEU 240 N -0.54 1.46 0.18 -0.88 1.43 -0.38 -5.00 118.68 114.95 1r8y s LEU 240 Ca -0.01 0.02 0.11 0.00 -1.03 0.00 0.00 54.13 53.22 1r8y s LEU 240 Cb -0.04 0.65 -0.04 0.00 0.03 0.00 0.00 46.19 46.78 1r8y s LEU 240 CO 0.00 -0.25 -0.24 -0.44 0.23 0.00 0.00 176.35 175.65 1r8y s SER 241 N -0.80 3.39 0.03 2.29 0.01 -1.26 -0.53 113.70 116.83 1r8y s SER 241 Ca -0.09 -0.85 0.02 0.00 1.31 0.00 0.00 55.95 56.34 1r8y s SER 241 Cb -0.05 -0.25 -0.02 0.00 0.21 0.00 0.00 66.02 65.92 1r8y s SER 241 CO 0.01 0.12 -0.07 -0.31 0.41 0.00 0.00 173.24 173.40 1r8y s TYR 242 N -1.61 0.62 -0.19 2.43 1.51 0.81 -4.68 117.35 116.25 1r8y s TYR 242 Ca 0.20 -0.40 -0.24 0.00 -1.01 0.00 0.00 57.07 55.62 1r8y s TYR 242 Cb -0.08 -0.38 -0.02 0.00 -0.11 0.00 0.00 41.96 41.38 1r8y s TYR 242 CO 0.09 -0.07 0.78 -0.47 -1.11 0.00 0.00 175.55 174.78 1r8y s TYR 243 N -1.08 3.39 -1.21 2.71 5.04 0.18 -1.01 117.35 125.38 1r8y s TYR 243 Ca -0.07 1.16 -0.20 0.00 -2.44 0.00 0.00 57.07 55.51 1r8y s TYR 243 Cb -0.08 -2.97 0.03 0.00 0.35 0.00 0.00 41.96 39.30 1r8y s TYR 243 CO 0.00 -0.25 1.73 -1.25 -1.34 0.00 0.00 175.55 174.45 1r8y s PRO 244 N 2.19 3.58 -0.16 4.97 0.04 -1.26 -4.74 135.00 139.62 1r8y s PRO 244 Ca 0.35 -1.60 -0.29 0.00 0.04 0.00 0.00 61.00 59.50 1r8y s PRO 244 Cb -0.16 -5.43 -0.03 0.00 0.04 0.00 0.00 34.50 28.92 1r8y s PRO 244 CO 0.11 -2.61 1.47 -1.01 0.04 0.00 0.00 177.00 175.00 1r8y s HIS 245 N 5.86 2.39 0.47 0.56 3.76 -1.26 -4.96 115.29 122.11 1r8y s HIS 245 Ca 0.56 0.64 -0.19 0.00 -0.15 0.00 0.00 55.06 55.92 1r8y s HIS 245 Cb 0.02 -3.79 -0.10 0.00 1.11 0.00 0.00 32.58 29.83 1r8y s HIS 245 CO 0.05 -2.63 0.97 0.00 -0.85 0.00 0.00 174.74 172.28 1r8y h LEU 247 N 1.51 0.27 0.40 0.00 5.85 -1.94 -1.11 115.31 120.29 1r8y h LEU 247 Ca -0.48 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 1r8y h LEU 247 Cb 1.18 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.14 1r8y h LEU 247 CO 0.61 0.20 -0.48 0.00 -0.34 0.00 0.00 178.44 178.44 1r8y h ALA 248 N 1.16 -1.02 0.29 1.25 0.00 -2.00 -1.85 119.26 117.09 1r8y h ALA 248 Ca 0.14 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1r8y h ALA 248 Cb 0.03 0.71 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 1r8y h ALA 248 CO -0.08 -1.12 -0.51 1.03 0.00 0.00 0.00 179.25 178.57 1r8y h SER 249 N -0.91 -1.46 -0.53 0.00 0.87 -1.91 -2.29 113.55 107.32 1r8y h SER 249 Ca -0.04 0.14 0.08 0.00 -1.23 0.00 0.00 61.79 60.74 1r8y h SER 249 Cb 0.81 0.52 -0.07 0.00 -0.44 0.00 0.00 62.40 63.22 1r8y h SER 249 CO -0.10 -0.60 0.17 0.15 -0.53 0.00 0.00 176.83 175.91 1r8y h PHE 250 N -0.86 0.29 -0.53 2.24 3.57 -1.17 0.18 116.94 120.66 1r8y h PHE 250 Ca -0.03 0.03 0.07 0.00 3.53 0.00 0.00 57.97 61.58 1r8y h PHE 250 Cb 0.80 -0.05 -0.10 0.00 2.79 0.00 0.00 35.95 39.40 1r8y h PHE 250 CO -0.36 0.07 -0.48 1.15 -2.23 0.00 0.00 178.31 176.46 1r8y h THR 251 N 0.33 0.06 -0.46 4.41 2.02 -1.06 0.34 112.91 118.56 1r8y h THR 251 Ca 0.26 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.51 1r8y h THR 251 Cb 0.32 0.06 -0.09 0.00 -1.74 0.00 0.00 68.15 66.69 1r8y h THR 251 CO -0.29 0.00 -0.44 -0.33 0.37 0.00 0.00 175.52 174.83 1r8y h GLU 252 N -0.28 -0.29 0.01 6.66 4.39 -0.30 -0.85 114.58 123.91 1r8y h GLU 252 Ca 0.14 0.02 0.03 0.00 0.34 0.00 0.00 59.36 59.89 1r8y h GLU 252 Cb 0.57 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.25 1r8y h GLU 252 CO -0.66 -0.19 -0.20 -0.07 -1.16 0.00 0.00 179.01 176.72 1r8y h LEU 253 N -0.30 -0.59 -0.59 1.33 3.38 0.10 -0.85 115.31 117.79 1r8y h LEU 253 Ca 0.14 0.08 -0.12 0.00 0.09 0.00 0.00 57.88 58.07 1r8y h LEU 253 Cb 0.58 0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 1r8y h LEU 253 CO -0.61 -0.27 -0.22 1.62 0.09 0.00 0.00 178.44 179.05 1r8y h VAL 254 N -0.33 1.27 -0.42 1.22 3.04 -0.24 -2.46 116.25 118.34 1r8y h VAL 254 Ca 0.06 -1.36 -0.01 0.00 -1.01 0.00 0.00 66.70 64.37 1r8y h VAL 254 Cb 0.40 1.16 -0.02 0.00 -2.01 0.00 0.00 31.29 30.82 1r8y h VAL 254 CO -0.18 0.46 0.21 0.03 -1.01 0.00 0.00 177.57 177.08 1r8y h ARG 255 N 0.78 0.60 0.00 4.17 3.08 -0.96 -2.40 114.38 119.66 1r8y h ARG 255 Ca 0.10 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 1r8y h ARG 255 Cb 0.77 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.71 1r8y h ARG 255 CO 0.06 0.51 -0.05 0.00 -1.07 0.00 0.00 179.97 179.43 1r8y h ALA 256 N 1.06 1.75 0.00 0.04 0.00 -0.93 -2.14 119.26 119.04 1r8y h ALA 256 Ca 0.14 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1r8y h ALA 256 Cb 0.11 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1r8y h ALA 256 CO -0.02 0.06 -0.16 0.00 0.00 0.00 0.00 179.25 179.12 1r8y h ALA 257 N 1.95 1.30 -0.01 0.00 0.00 -0.95 -0.67 119.26 120.88 1r8y h ALA 257 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1r8y h ALA 257 Cb 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1r8y h ALA 257 CO 0.01 0.21 -0.30 1.19 0.00 0.00 0.00 179.25 180.36 1r8y n PHE 258 N -3.72 0.00 -2.46 0.00 3.72 -0.82 -4.56 117.46 109.62 1r8y n PHE 258 Ca -0.02 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.28 1r8y n PHE 258 Cb 0.28 -0.06 0.01 0.00 -0.94 0.00 0.00 39.48 38.77 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 1.35 0.08 4.13 1.37 0.00 -0.26 -3.48 105.19 108.37 1r8y n GLY 259 Ca 0.12 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.07 2.37 2.22 -0.02 0.00 -1.10 -4.89 105.19 102.70 1r8y n GLY 260 Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.65 1r8y n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r8y n ARG 261 N -0.79 3.13 -4.41 1.61 5.12 -1.23 -4.86 116.66 115.24 1r8y n ARG 261 Ca 0.00 -1.87 -0.20 0.00 -1.93 0.00 0.00 57.85 53.85 1r8y n ARG 261 Cb 0.00 -2.49 -0.10 0.00 -1.16 0.00 0.00 32.46 28.70 1r8y n ARG 261 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1r8y s GLN 263 N -3.87 2.63 -0.29 0.00 -0.21 -1.07 -4.95 119.66 111.89 1r8y s GLN 263 Ca 0.34 -1.43 -0.14 0.00 0.02 0.00 0.00 55.36 54.15 1r8y s GLN 263 Cb 0.07 -2.60 0.12 0.00 1.00 0.00 0.00 33.01 31.60 1r8y s GLN 263 CO 0.13 -0.37 0.77 -1.58 -2.12 0.00 0.00 175.29 172.13 1r8y s HIS 264 N -2.46 -1.00 0.01 0.91 5.65 -1.26 -3.43 115.29 113.71 1r8y s HIS 264 Ca 0.53 1.88 0.04 0.00 0.25 0.00 0.00 55.06 57.76 1r8y s HIS 264 Cb -0.07 0.60 -0.01 0.00 -1.18 0.00 0.00 32.58 31.92 1r8y s HIS 264 CO 0.32 -0.50 -0.12 -1.12 -0.65 0.00 0.00 174.74 172.67 1r8y s SER 265 N 2.05 1.42 -0.24 9.88 0.01 -0.48 -5.02 113.70 121.32 1r8y s SER 265 Ca -0.08 -0.32 -0.09 0.00 1.31 0.00 0.00 55.95 56.78 1r8y s SER 265 Cb -0.07 -0.12 -0.04 0.00 0.21 0.00 0.00 66.02 66.00 1r8y s SER 265 CO -0.18 0.08 0.11 0.54 0.41 0.00 0.00 173.24 174.19 1r8y s VAL 266 N -0.54 4.73 0.22 3.43 0.11 -1.26 -1.30 120.40 125.79 1r8y s VAL 266 Ca 0.03 -0.03 -0.05 0.00 -2.93 0.00 0.00 61.98 58.99 1r8y s VAL 266 Cb -0.06 -3.21 -0.05 0.00 -1.53 0.00 0.00 36.38 31.53 1r8y s VAL 266 CO 0.00 0.34 0.47 -0.76 -3.33 0.00 0.00 175.10 171.82 1r8y s LEU 267 N 1.39 4.16 0.00 2.54 1.43 0.55 -2.85 118.68 125.90 1r8y s LEU 267 Ca 0.06 0.66 0.00 0.00 -1.03 0.00 0.00 54.13 53.81 1r8y s LEU 267 Cb -0.15 -3.43 0.00 0.00 0.03 0.00 0.00 46.19 42.64 1r8y s LEU 267 CO 0.05 -0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.16 1r8y n GLY 268 N -0.48 0.91 0.10 -3.19 0.00 0.28 -2.49 105.19 100.32 1r8y n GLY 268 Ca -0.02 -0.02 0.03 0.00 0.00 0.00 0.00 46.02 46.01 1r8y n GLY 268 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1r8y h ASP 269 N 0.00 0.00 0.00 1.61 3.32 -1.88 -3.38 116.42 116.09 1r8y h ASP 269 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1r8y h ASP 269 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1r8y h ASP 269 CO 0.00 0.42 0.00 0.49 -1.72 0.00 0.00 179.24 178.43 1r8y n PHE 270 N -2.84 0.00 -2.68 4.55 0.99 -1.26 -4.88 117.46 111.33 1r8y n PHE 270 Ca -0.07 0.00 -0.29 0.00 -0.00 0.00 0.00 57.45 57.09 1r8y n PHE 270 Cb 0.76 0.00 -0.01 0.00 -1.00 0.00 0.00 39.48 39.22 1r8y n PHE 270 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.76 176.91 1r8y s LYS 271 N -0.65 3.65 0.95 -1.08 1.02 -1.26 -4.98 119.74 117.39 1r8y s LYS 271 Ca 0.00 0.36 -0.12 0.00 0.02 0.00 0.00 55.97 56.23 1r8y s LYS 271 Cb 0.00 -2.36 0.06 0.00 -0.52 0.00 0.00 37.83 35.01 1r8y s LYS 271 CO 0.00 -0.15 0.54 -2.30 -0.92 0.00 0.00 175.35 172.52 1r8y n PRO 272 N -1.85 -0.40 -4.02 -1.68 -0.02 -1.26 0.10 135.00 125.87 1r8y n PRO 272 Ca 0.02 -0.07 -0.31 0.00 -2.02 0.00 0.00 63.50 61.11 1r8y n PRO 272 Cb 0.54 -1.95 -0.15 0.00 -0.02 0.00 0.00 33.50 31.92 1r8y n PRO 272 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1r8y s TYR 273 N -2.44 2.94 -0.09 6.00 5.04 -1.13 -4.00 117.35 123.67 1r8y s TYR 273 Ca 0.59 -2.12 -0.21 0.00 -2.44 0.00 0.00 57.07 52.89 1r8y s TYR 273 Cb -0.21 -1.81 -0.04 0.00 0.35 0.00 0.00 41.96 40.25 1r8y s TYR 273 CO 0.66 -0.84 0.59 -1.59 -1.34 0.00 0.00 175.55 173.02 1r8y s LYS 274 N 1.21 4.39 0.14 4.97 -2.85 -1.26 -4.90 119.74 121.43 1r8y s LYS 274 Ca -0.07 0.66 -0.32 0.00 -1.00 0.00 0.00 55.97 55.24 1r8y s LYS 274 Cb -0.20 -3.44 -0.12 0.00 -2.06 0.00 0.00 37.83 32.02 1r8y s LYS 274 CO -0.06 0.12 1.76 -2.30 0.10 0.00 0.00 175.35 174.97 1r8y n PRO 275 N 3.70 2.60 -1.41 1.78 -0.02 -1.26 -2.28 135.00 138.12 1r8y n PRO 275 Ca -0.04 0.94 0.00 0.00 -2.02 0.00 0.00 63.50 62.38 1r8y n PRO 275 Cb 0.51 -2.79 0.00 0.00 -0.02 0.00 0.00 33.50 31.20 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 4.00 0.64 3.58 -1.23 0.00 -1.26 -5.04 105.19 105.88 1r8y n GLY 276 Ca 0.18 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 45.11 1r8y n GLY 276 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1r8y n GLN 277 N -1.46 -0.20 0.42 1.61 1.13 -0.96 -4.99 117.38 112.93 1r8y n GLN 277 Ca 0.00 0.00 -0.17 0.00 -1.94 0.00 0.00 57.00 54.89 1r8y n GLN 277 Cb 0.30 -2.18 -0.08 0.00 0.11 0.00 0.00 30.24 28.39 1r8y n GLN 277 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1r8y h ALA 278 N -1.45 -1.09 -2.69 -1.58 0.00 -1.96 -3.43 119.26 107.06 1r8y h ALA 278 Ca -0.44 -0.24 -0.52 0.00 0.00 0.00 0.00 54.91 53.71 1r8y h ALA 278 Cb 1.29 0.42 0.03 0.00 0.00 0.00 0.00 17.79 19.53 1r8y h ALA 278 CO 0.40 -1.02 0.65 -0.47 0.00 0.00 0.00 179.25 178.81 1r8y s TYR 279 N -5.20 3.24 -0.26 0.00 5.04 -1.26 -5.03 117.35 113.87 1r8y s TYR 279 Ca -0.16 1.23 -0.08 0.00 -2.44 0.00 0.00 57.07 55.61 1r8y s TYR 279 Cb 0.02 -3.61 -0.02 0.00 0.35 0.00 0.00 41.96 38.69 1r8y s TYR 279 CO 0.50 -1.90 0.09 0.14 -1.34 0.00 0.00 175.55 173.04 1r8y s VAL 280 N 0.04 4.37 0.73 3.14 -7.23 -1.26 -5.03 120.40 115.16 1r8y s VAL 280 Ca 0.56 -0.24 -0.11 0.00 -1.81 0.00 0.00 61.98 60.38 1r8y s VAL 280 Cb -0.37 -3.10 0.03 0.00 0.56 0.00 0.00 36.38 33.51 1r8y s VAL 280 CO 0.39 0.27 1.08 -2.84 -0.31 0.00 0.00 175.10 173.68 1r8y s PRO 281 N 1.61 2.60 -0.10 4.82 0.02 -1.26 -5.01 135.00 137.68 1r8y s PRO 281 Ca 0.06 1.08 -0.13 0.00 0.02 0.00 0.00 61.00 62.03 1r8y s PRO 281 Cb -0.16 -1.94 -0.27 0.00 0.02 0.00 0.00 34.50 32.15 1r8y s PRO 281 CO 0.04 -1.37 0.50 0.00 -0.33 0.00 0.00 177.00 175.85 1r8y s TYR 283 N -2.51 2.53 -0.22 0.00 1.51 -1.26 0.02 117.35 117.43 1r8y s TYR 283 Ca -0.20 -0.26 -0.02 0.00 -1.01 0.00 0.00 57.07 55.58 1r8y s TYR 283 Cb 0.05 -1.22 0.01 0.00 -0.11 0.00 0.00 41.96 40.69 1r8y s TYR 283 CO 0.77 0.53 -0.10 -0.06 -1.11 0.00 0.00 175.55 175.59 1r8y s PHE 284 N -1.80 2.94 -0.19 2.71 0.08 0.44 -4.31 117.98 117.85 1r8y s PHE 284 Ca 0.25 -1.35 -0.07 0.00 0.12 0.00 0.00 56.93 55.88 1r8y s PHE 284 Cb -0.08 -2.03 -0.04 0.00 -0.57 0.00 0.00 43.02 40.30 1r8y s PHE 284 CO 0.14 -0.69 0.04 0.42 -0.10 0.00 0.00 175.22 175.04 1r8y s ILE 285 N 1.37 4.50 -0.22 0.64 1.01 -1.04 -1.41 121.20 126.05 1r8y s ILE 285 Ca 0.04 -0.13 -0.08 0.00 0.00 0.00 0.00 60.65 60.48 1r8y s ILE 285 Cb -0.15 -3.03 -0.04 0.00 0.01 0.00 0.00 42.46 39.25 1r8y s ILE 285 CO -0.07 0.44 0.08 -1.00 0.00 0.00 0.00 174.94 174.39 1r8y s HIS 286 N 0.65 3.16 -0.11 3.97 3.76 -0.18 0.20 115.29 126.75 1r8y s HIS 286 Ca 0.02 -0.16 0.03 0.00 -0.15 0.00 0.00 55.06 54.80 1r8y s HIS 286 Cb -0.13 -2.18 0.01 0.00 1.11 0.00 0.00 32.58 31.38 1r8y s HIS 286 CO 0.02 -0.13 -0.21 0.54 -0.85 0.00 0.00 174.74 174.11 1r8y s VAL 287 N 1.11 1.90 0.23 -0.90 0.11 -0.42 -1.17 120.40 121.26 1r8y s VAL 287 Ca 0.05 -0.91 0.02 0.00 -2.93 0.00 0.00 61.98 58.20 1r8y s VAL 287 Cb -0.14 -1.66 -0.05 0.00 -1.53 0.00 0.00 36.38 32.99 1r8y s VAL 287 CO 0.03 0.52 0.05 -0.76 -3.33 0.00 0.00 175.10 171.61 1r8y s LEU 288 N 0.54 1.92 -0.06 2.54 1.43 -0.73 -1.38 118.68 122.94 1r8y s LEU 288 Ca -0.15 -1.29 -0.02 0.00 -1.03 0.00 0.00 54.13 51.65 1r8y s LEU 288 Cb -0.17 -0.08 0.03 0.00 0.03 0.00 0.00 46.19 46.00 1r8y s LEU 288 CO 0.05 -0.63 0.02 -0.54 0.23 0.00 0.00 176.35 175.48 1r8y s LYS 289 N -3.96 0.38 0.00 1.70 -0.14 -1.22 -1.94 119.74 114.57 1r8y s LYS 289 Ca 0.32 0.19 0.21 0.00 -1.36 0.00 0.00 55.97 55.33 1r8y s LYS 289 Cb 0.07 -0.84 1.25 0.00 -1.68 0.00 0.00 37.83 36.63 1r8y s LYS 289 CO 0.10 -0.32 1.63 1.63 -0.76 0.00 0.00 175.35 177.63