#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k2y s ALA 6 N 0.00 2.53 0.99 7.82 0.00 -1.26 -5.05 121.76 126.79 1k2y s ALA 6 Ca 0.00 1.09 -0.16 0.00 0.00 0.00 0.00 51.96 52.88 1k2y s ALA 6 Cb 0.00 -3.49 0.21 0.00 0.00 0.00 0.00 23.12 19.84 1k2y s ALA 6 CO 0.00 -1.28 1.29 -1.25 0.00 0.00 0.00 175.76 174.52 1k2y s PRO 7 N -3.30 0.45 -0.19 0.00 0.04 -1.26 -4.97 135.00 125.76 1k2y s PRO 7 Ca 0.78 -0.34 -0.23 0.00 0.04 0.00 0.00 61.00 61.25 1k2y s PRO 7 Cb -0.33 -1.82 -0.02 0.00 0.04 0.00 0.00 34.50 32.38 1k2y s PRO 7 CO 0.36 -2.55 0.75 0.99 0.04 0.00 0.00 177.00 176.58 1k2y s THR 8 N -3.76 4.93 0.13 1.26 2.01 -1.26 -4.79 115.64 114.17 1k2y s THR 8 Ca 0.73 1.44 0.05 0.00 0.31 0.00 0.00 61.69 64.22 1k2y s THR 8 Cb -0.05 -4.05 -0.04 0.00 0.01 0.00 0.00 72.50 68.37 1k2y s THR 8 CO 0.53 0.04 0.07 -0.76 -0.69 0.00 0.00 174.62 173.82 1k2y s LEU 9 N 2.17 3.65 0.13 4.42 1.43 -1.26 -5.07 118.68 124.14 1k2y s LEU 9 Ca 0.34 -0.16 -0.31 0.00 -1.03 0.00 0.00 54.13 52.97 1k2y s LEU 9 Cb -0.16 -2.30 -0.08 0.00 0.03 0.00 0.00 46.19 43.68 1k2y s LEU 9 CO 0.11 0.12 1.37 -2.16 0.23 0.00 0.00 176.35 176.01 1k2y s PRO 10 N -2.75 4.34 0.53 1.29 0.04 -1.26 -4.91 135.00 132.27 1k2y s PRO 10 Ca 0.29 2.06 0.27 0.00 0.04 0.00 0.00 61.00 63.65 1k2y s PRO 10 Cb -0.11 -3.24 1.49 0.00 0.04 0.00 0.00 34.50 32.69 1k2y s PRO 10 CO 0.21 -0.40 2.11 0.00 0.04 0.00 0.00 177.00 178.96 1k2y h ALA 11 N 6.53 1.39 0.00 8.56 0.00 -1.97 -3.11 119.26 130.66 1k2y h ALA 11 Ca -0.43 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 1k2y h ALA 11 Cb 1.21 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1k2y h ALA 11 CO 0.84 0.12 -0.03 0.66 0.00 0.00 0.00 179.25 180.85 1k2y h SER 12 N 0.00 0.00 1.60 0.00 4.64 -1.97 -2.13 113.55 115.69 1k2y h SER 12 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1k2y h SER 12 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1k2y h SER 12 CO 0.01 0.03 0.00 0.16 -0.87 0.00 0.00 176.83 176.16 1k2y h ILE 13 N 0.00 0.00 -2.76 0.95 3.07 -1.73 -3.42 117.51 113.62 1k2y h ILE 13 Ca -0.00 -0.65 -0.63 0.00 1.55 0.00 0.00 64.86 65.13 1k2y h ILE 13 Cb 0.12 1.63 -0.15 0.00 -0.27 0.00 0.00 36.82 38.16 1k2y h ILE 13 CO 0.00 0.00 0.49 -0.36 -1.05 0.00 0.00 178.15 177.24 1k2y s PHE 14 N -3.17 2.73 0.04 0.16 0.40 -0.80 -0.94 117.98 116.39 1k2y s PHE 14 Ca 0.09 -0.51 0.01 0.00 -0.60 0.00 0.00 56.93 55.91 1k2y s PHE 14 Cb 0.09 -4.21 0.01 0.00 0.51 0.00 0.00 43.02 39.42 1k2y s PHE 14 CO 0.61 -1.56 0.06 0.54 0.70 0.00 0.00 175.22 175.56 1k2y n ARG 15 N 7.52 0.99 -0.34 0.44 1.74 -0.15 -4.96 116.66 121.89 1k2y n ARG 15 Ca -0.04 -0.23 -0.03 0.00 -0.77 0.00 0.00 57.85 56.78 1k2y n ARG 15 Cb 0.45 -0.02 0.09 0.00 -1.02 0.00 0.00 32.46 31.97 1k2y n ARG 15 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1k2y h ALA 16 N 0.49 1.19 0.00 7.54 0.00 -1.95 -3.35 119.26 123.17 1k2y h ALA 16 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1k2y h ALA 16 Cb 0.09 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1k2y h ALA 16 CO 0.03 0.67 0.00 0.66 0.00 0.00 0.00 179.25 180.61 1k2y n TYR 17 N -4.34 0.00 -3.48 0.00 4.01 -1.26 0.24 117.16 112.32 1k2y n TYR 17 Ca 0.10 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.79 1k2y n TYR 17 Cb 0.08 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.13 1k2y n TYR 17 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1k2y n ASP 18 N -0.43 -1.35 -4.25 7.72 5.68 -1.26 -4.62 116.55 118.04 1k2y n ASP 18 Ca 0.00 -1.92 -0.29 0.00 -0.50 0.00 0.00 54.79 52.07 1k2y n ASP 18 Cb 0.03 2.25 -0.16 0.00 -1.14 0.00 0.00 41.12 42.10 1k2y n ASP 18 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1k2y s ILE 19 N -2.45 1.85 -0.11 2.12 1.01 -0.77 -0.98 121.20 121.87 1k2y s ILE 19 Ca 0.10 -0.98 -0.17 0.00 0.00 0.00 0.00 60.65 59.60 1k2y s ILE 19 Cb -0.03 -1.55 0.04 0.00 0.01 0.00 0.00 42.46 40.93 1k2y s ILE 19 CO 0.07 0.52 0.42 -0.60 0.00 0.00 0.00 174.94 175.35 1k2y s ARG 20 N -0.37 0.61 0.15 2.79 3.52 -0.12 -0.72 118.95 124.81 1k2y s ARG 20 Ca 0.04 0.35 -0.07 0.00 -0.13 0.00 0.00 55.73 55.92 1k2y s ARG 20 Cb -0.11 0.29 0.03 0.00 -1.56 0.00 0.00 34.95 33.60 1k2y s ARG 20 CO 0.01 -0.12 0.37 0.41 -0.81 0.00 0.00 175.30 175.16 1k2y n GLY 21 N 2.22 1.41 3.25 8.12 0.00 -0.33 -4.30 105.19 115.55 1k2y n GLY 21 Ca -0.16 -1.09 -0.34 0.00 0.00 0.00 0.00 46.02 44.42 1k2y n GLY 21 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k2y s VAL 22 N -2.54 2.88 0.17 1.61 1.01 -1.26 -1.59 120.40 120.67 1k2y s VAL 22 Ca 0.08 -0.66 -0.32 0.00 0.00 0.00 0.00 61.98 61.08 1k2y s VAL 22 Cb -0.02 -2.28 -0.10 0.00 0.00 0.00 0.00 36.38 33.98 1k2y s VAL 22 CO 0.05 0.47 1.59 -0.69 0.00 0.00 0.00 175.10 176.52 1k2y s VAL 23 N 1.34 2.57 0.00 2.92 1.01 0.47 -1.46 120.40 127.25 1k2y s VAL 23 Ca 0.04 0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.42 1k2y s VAL 23 Cb -0.14 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 32.99 1k2y s VAL 23 CO -0.06 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.68 1k2y n GLY 24 N 3.79 0.98 0.00 4.51 0.00 -0.13 -4.87 105.19 109.48 1k2y n GLY 24 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1k2y n GLY 24 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1k2y n ASP 25 N 0.00 0.00 0.01 1.61 2.03 -0.54 -4.93 116.55 114.73 1k2y n ASP 25 Ca 0.00 0.00 0.11 0.00 0.52 0.00 0.00 54.79 55.42 1k2y n ASP 25 Cb 0.00 0.00 0.08 0.00 -0.72 0.00 0.00 41.12 40.48 1k2y n ASP 25 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1k2y n THR 26 N -0.52 0.08 -4.32 5.18 -2.24 -0.59 -4.82 114.28 107.06 1k2y n THR 26 Ca 0.00 -0.11 -0.28 0.00 -2.27 0.00 0.00 64.05 61.39 1k2y n THR 26 Cb 0.00 0.38 -0.17 0.00 -2.10 0.00 0.00 70.33 68.44 1k2y n THR 26 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1k2y s LEU 27 N -3.41 1.62 0.39 3.22 2.96 -0.71 -4.78 118.68 117.97 1k2y s LEU 27 Ca 0.07 -0.40 0.04 0.00 -0.22 0.00 0.00 54.13 53.62 1k2y s LEU 27 Cb 0.16 -1.03 -0.05 0.00 0.50 0.00 0.00 46.19 45.77 1k2y s LEU 27 CO 0.78 -0.01 0.06 0.42 -1.32 0.00 0.00 176.35 176.28 1k2y s THR 28 N 1.14 1.13 0.36 3.68 -4.23 -1.26 -0.95 115.64 115.50 1k2y s THR 28 Ca -0.04 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.52 1k2y s THR 28 Cb -0.14 -2.58 0.29 0.00 1.34 0.00 0.00 72.50 71.40 1k2y s THR 28 CO -0.03 0.00 1.96 0.00 -0.54 0.00 0.00 174.62 176.01 1k2y h ALA 29 N 1.83 1.67 -0.58 3.99 0.00 -1.96 -1.67 119.26 122.54 1k2y h ALA 29 Ca -0.40 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.38 1k2y h ALA 29 Cb 1.26 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1k2y h ALA 29 CO 0.68 0.23 -0.05 1.49 0.00 0.00 0.00 179.25 181.61 1k2y h GLU 30 N 0.79 1.05 -0.18 0.00 4.81 -1.98 -2.51 114.58 116.56 1k2y h GLU 30 Ca 0.30 -0.35 0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1k2y h GLU 30 Cb 0.20 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 1k2y h GLU 30 CO -0.10 1.05 0.08 1.15 -0.73 0.00 0.00 179.01 180.46 1k2y h THR 31 N 0.94 0.98 -0.99 0.32 2.02 -1.71 -2.71 112.91 111.76 1k2y h THR 31 Ca 0.16 -0.06 0.09 0.00 0.77 0.00 0.00 66.41 67.37 1k2y h THR 31 Cb 0.61 0.79 -0.07 0.00 -1.74 0.00 0.00 68.15 67.74 1k2y h THR 31 CO 0.04 0.03 0.63 0.00 0.37 0.00 0.00 175.52 176.59 1k2y h ALA 32 N 1.10 1.48 0.03 6.16 0.00 -0.98 -0.01 119.26 127.04 1k2y h ALA 32 Ca 0.07 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1k2y h ALA 32 Cb 0.03 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1k2y h ALA 32 CO -0.06 0.33 -0.05 -0.92 0.00 0.00 0.00 179.25 178.54 1k2y h TYR 33 N 1.07 -0.13 -0.04 0.00 3.20 -1.16 -0.85 116.97 119.07 1k2y h TYR 33 Ca 0.46 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 62.21 1k2y h TYR 33 Cb 0.33 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 1k2y h TYR 33 CO -0.00 -0.08 -0.51 -1.49 -1.64 0.00 0.00 178.16 174.44 1k2y h TRP 34 N -0.11 0.11 -0.56 -3.82 4.06 -1.08 -1.16 115.95 113.41 1k2y h TRP 34 Ca 0.01 -0.04 -0.05 0.00 2.06 0.00 0.00 58.89 60.88 1k2y h TRP 34 Cb 0.12 -0.02 -0.02 0.00 -1.00 0.00 0.00 29.16 28.23 1k2y h TRP 34 CO -0.11 0.59 0.17 0.82 -3.56 0.00 0.00 178.44 176.34 1k2y h ILE 35 N 0.08 1.24 -0.79 1.49 2.04 -0.91 -0.19 117.51 120.46 1k2y h ILE 35 Ca -0.00 -0.81 0.03 0.00 1.00 0.00 0.00 64.86 65.08 1k2y h ILE 35 Cb 0.93 0.71 -0.05 0.00 -0.74 0.00 0.00 36.82 37.67 1k2y h ILE 35 CO 0.07 0.30 0.50 1.23 0.00 0.00 0.00 178.15 180.26 1k2y h GLY 36 N 0.78 1.15 1.12 5.37 0.00 -0.63 0.40 103.07 111.26 1k2y h GLY 36 Ca 0.18 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 47.11 1k2y h GLY 36 CO -0.00 0.32 0.43 3.21 0.00 0.00 0.00 176.54 180.50 1k2y h ARG 37 N 0.98 1.15 -0.16 4.80 2.47 -0.63 0.68 114.38 123.66 1k2y h ARG 37 Ca 0.32 -0.14 -0.06 0.00 -1.26 0.00 0.00 59.98 58.83 1k2y h ARG 37 Cb 0.02 -0.22 -0.00 0.00 -1.65 0.00 0.00 29.97 28.12 1k2y h ARG 37 CO -0.12 0.85 -0.15 0.00 0.56 0.00 0.00 179.97 181.12 1k2y h ALA 38 N 1.32 0.24 -0.50 0.04 0.00 -0.43 -1.22 119.26 118.71 1k2y h ALA 38 Ca 0.29 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1k2y h ALA 38 Cb 0.05 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1k2y h ALA 38 CO -0.04 0.12 0.13 0.82 0.00 0.00 0.00 179.25 180.28 1k2y h ILE 39 N 0.03 1.24 -0.74 0.00 2.04 -0.84 -1.70 117.51 117.54 1k2y h ILE 39 Ca 0.03 -0.83 -0.04 0.00 1.00 0.00 0.00 64.86 65.01 1k2y h ILE 39 Cb 0.67 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 37.54 1k2y h ILE 39 CO 0.04 0.30 0.29 1.23 0.00 0.00 0.00 178.15 180.01 1k2y h GLY 40 N 0.69 1.19 0.80 5.37 0.00 -0.80 0.11 103.07 110.43 1k2y h GLY 40 Ca 0.16 -0.65 0.03 0.00 0.00 0.00 0.00 47.33 46.87 1k2y h GLY 40 CO 0.00 0.62 0.21 1.76 0.00 0.00 0.00 176.54 179.13 1k2y h SER 41 N 1.06 0.32 -0.49 0.19 0.02 -1.03 -0.81 113.55 112.82 1k2y h SER 41 Ca 0.24 0.02 -0.11 0.00 -0.84 0.00 0.00 61.79 61.11 1k2y h SER 41 Cb 0.22 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 1k2y h SER 41 CO -0.02 0.23 -0.11 -0.08 -1.14 0.00 0.00 176.83 175.71 1k2y h GLU 42 N 0.43 0.94 -0.32 3.45 4.57 -0.90 -0.84 114.58 121.90 1k2y h GLU 42 Ca 0.18 -0.36 -0.00 0.00 -1.18 0.00 0.00 59.36 58.00 1k2y h GLU 42 Cb 0.07 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.60 1k2y h GLU 42 CO -0.12 1.02 0.19 1.03 -1.18 0.00 0.00 179.01 179.95 1k2y h SER 43 N 0.79 0.38 -0.88 1.04 0.87 -0.81 -1.46 113.55 113.48 1k2y h SER 43 Ca 0.12 -0.05 0.03 0.00 -1.23 0.00 0.00 61.79 60.66 1k2y h SER 43 Cb 0.67 -0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 62.48 1k2y h SER 43 CO 0.05 0.32 0.58 -0.07 -0.53 0.00 0.00 176.83 177.18 1k2y h LEU 44 N 0.41 0.96 -1.39 2.23 3.38 -1.04 0.36 115.31 120.22 1k2y h LEU 44 Ca 0.11 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 1k2y h LEU 44 Cb 0.01 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1k2y h LEU 44 CO -0.02 0.67 -0.14 0.00 0.09 0.00 0.00 178.44 179.04 1k2y h ALA 45 N 1.48 1.50 -0.29 1.53 0.00 -0.79 -1.03 119.26 121.65 1k2y h ALA 45 Ca 0.34 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1k2y h ALA 45 Cb -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1k2y h ALA 45 CO -0.10 0.36 0.00 0.54 0.00 0.00 0.00 179.25 180.05 1k2y n ARG 46 N -4.27 1.89 -0.83 0.00 5.12 -0.58 -4.91 116.66 113.08 1k2y n ARG 46 Ca -0.01 -1.13 0.00 0.00 -1.93 0.00 0.00 57.85 54.78 1k2y n ARG 46 Cb 0.28 -1.36 0.00 0.00 -1.16 0.00 0.00 32.46 30.21 1k2y n ARG 46 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1k2y n GLY 47 N 0.82 0.51 2.89 -0.13 0.00 -0.39 -4.96 105.19 103.94 1k2y n GLY 47 Ca 0.10 -0.67 -0.30 0.00 0.00 0.00 0.00 46.02 45.15 1k2y n GLY 47 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1k2y s GLU 48 N -1.27 1.27 0.27 1.61 2.56 0.03 -4.96 118.70 118.22 1k2y s GLU 48 Ca 0.00 -1.72 0.25 0.00 0.00 0.00 0.00 54.97 53.50 1k2y s GLU 48 Cb 0.00 -2.75 0.61 0.00 2.00 0.00 0.00 34.13 33.99 1k2y s GLU 48 CO 0.00 -0.99 1.67 -1.00 -0.56 0.00 0.00 175.26 174.38 1k2y h PRO 49 N 7.56 0.00 -5.31 4.30 0.13 -1.90 -3.18 132.00 133.59 1k2y h PRO 49 Ca -0.07 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.45 1k2y h PRO 49 Cb 1.00 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.00 1k2y h PRO 49 CO 0.52 0.00 -0.22 0.00 -0.23 0.00 0.00 178.00 178.07 1k2y s VAL 51 N 1.58 0.47 0.23 0.00 1.01 -0.68 -3.46 120.40 119.54 1k2y s VAL 51 Ca 0.17 -0.06 -0.19 0.00 0.00 0.00 0.00 61.98 61.90 1k2y s VAL 51 Cb -0.15 -0.53 -0.08 0.00 0.00 0.00 0.00 36.38 35.62 1k2y s VAL 51 CO 0.08 0.22 0.71 0.00 0.00 0.00 0.00 175.10 176.12 1k2y s ALA 52 N 1.09 3.42 -0.03 5.51 0.00 -0.60 -0.90 121.76 130.24 1k2y s ALA 52 Ca -0.08 0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.01 1k2y s ALA 52 Cb -0.14 -2.79 0.03 0.00 0.00 0.00 0.00 23.12 20.21 1k2y s ALA 52 CO -0.01 0.34 -0.01 0.08 0.00 0.00 0.00 175.76 176.16 1k2y s VAL 53 N -1.56 0.28 0.25 0.00 1.01 -0.01 -0.23 120.40 120.14 1k2y s VAL 53 Ca 0.44 0.03 0.01 0.00 0.00 0.00 0.00 61.98 62.46 1k2y s VAL 53 Cb -0.16 -0.36 -0.05 0.00 0.00 0.00 0.00 36.38 35.81 1k2y s VAL 53 CO 0.20 0.17 0.09 -0.83 0.00 0.00 0.00 175.10 174.74 1k2y s GLY 54 N 1.02 1.69 0.09 4.51 0.00 -0.64 -1.35 107.32 112.64 1k2y s GLY 54 Ca -0.10 -1.85 -0.03 0.00 0.00 0.00 0.00 44.72 42.75 1k2y s GLY 54 CO -0.01 -1.58 0.05 1.09 0.00 0.00 0.00 173.10 172.64 1k2y s ARG 55 N -4.03 0.78 0.00 2.90 1.70 -0.37 -0.63 118.95 119.30 1k2y s ARG 55 Ca 0.37 -1.25 0.00 0.00 -0.47 0.00 0.00 55.73 54.38 1k2y s ARG 55 Cb 0.08 0.25 0.00 0.00 -0.57 0.00 0.00 34.95 34.71 1k2y s ARG 55 CO 0.13 -0.20 0.00 -0.40 -1.08 0.00 0.00 175.30 173.75 1k2y n ASP 56 N 0.00 0.00 -1.50 -2.89 5.68 -0.74 -0.86 116.55 116.24 1k2y n ASP 56 Ca -0.11 -0.58 -0.01 0.00 -0.50 0.00 0.00 54.79 53.59 1k2y n ASP 56 Cb 0.62 0.00 0.22 0.00 -1.14 0.00 0.00 41.12 40.82 1k2y n ASP 56 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1k2y n GLY 57 N 5.00 2.76 3.81 6.12 0.00 -1.26 -4.81 105.19 116.80 1k2y n GLY 57 Ca 0.00 -0.62 -0.32 0.00 0.00 0.00 0.00 46.02 45.07 1k2y n GLY 57 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1k2y s ARG 58 N -2.13 3.24 0.42 1.61 0.52 -1.26 -3.38 118.95 117.98 1k2y s ARG 58 Ca 0.36 1.15 0.10 0.00 -0.52 0.00 0.00 55.73 56.81 1k2y s ARG 58 Cb 0.28 -2.02 0.94 0.00 0.52 0.00 0.00 34.95 34.66 1k2y s ARG 58 CO 0.09 -0.87 2.04 -0.07 0.02 0.00 0.00 175.30 176.51 1k2y h LEU 59 N 0.20 0.41 -0.20 2.53 3.38 -1.82 -1.31 115.31 118.49 1k2y h LEU 59 Ca -0.46 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1k2y h LEU 59 Cb 1.22 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1k2y h LEU 59 CO 0.57 0.28 -0.12 -1.54 0.09 0.00 0.00 178.44 177.72 1k2y n SER 60 N -4.48 0.43 0.29 -0.43 3.41 -1.26 -4.50 113.62 107.09 1k2y n SER 60 Ca 0.05 -0.48 -0.17 0.00 -0.26 0.00 0.00 58.87 58.02 1k2y n SER 60 Cb 0.17 -0.09 -0.08 0.00 -0.26 0.00 0.00 64.21 63.95 1k2y n SER 60 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1k2y h GLY 61 N 4.97 -0.84 0.54 5.00 0.00 -1.55 -1.56 103.07 109.63 1k2y h GLY 61 Ca 0.00 0.35 0.08 0.00 0.00 0.00 0.00 47.33 47.76 1k2y h GLY 61 CO 0.00 -0.31 0.32 -2.55 0.00 0.00 0.00 176.54 174.00 1k2y h PRO 62 N -0.79 0.55 -0.05 4.80 0.11 -1.79 -0.23 132.00 134.60 1k2y h PRO 62 Ca -0.06 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.01 1k2y h PRO 62 Cb 0.64 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.63 1k2y h PRO 62 CO 0.06 0.37 -0.01 1.49 -0.21 0.00 0.00 178.00 179.70 1k2y h GLU 63 N 0.57 0.09 -0.22 1.05 4.81 -1.84 -2.98 114.58 116.07 1k2y h GLU 63 Ca 0.31 -0.03 -0.15 0.00 -0.13 0.00 0.00 59.36 59.36 1k2y h GLU 63 Cb 0.29 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 1k2y h GLU 63 CO -0.24 0.41 -0.49 -0.07 -0.73 0.00 0.00 179.01 177.89 1k2y h LEU 64 N -0.24 0.64 -0.90 1.64 4.07 -1.12 -3.06 115.31 116.33 1k2y h LEU 64 Ca 0.01 -0.32 -0.08 0.00 0.08 0.00 0.00 57.88 57.57 1k2y h LEU 64 Cb 0.37 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 41.92 1k2y h LEU 64 CO 0.00 1.02 -0.09 1.62 -1.08 0.00 0.00 178.44 179.91 1k2y h VAL 65 N 0.46 1.25 -0.82 1.22 3.04 -1.09 -0.51 116.25 119.80 1k2y h VAL 65 Ca 0.02 -1.10 0.02 0.00 -1.01 0.00 0.00 66.70 64.63 1k2y h VAL 65 Cb 1.03 1.04 -0.05 0.00 -2.01 0.00 0.00 31.29 31.30 1k2y h VAL 65 CO 0.10 0.37 0.53 0.50 -1.01 0.00 0.00 177.57 178.06 1k2y h LYS 66 N 0.65 1.03 -0.42 4.17 1.63 -1.46 0.57 116.57 122.73 1k2y h LYS 66 Ca 0.12 -0.06 -0.13 0.00 -0.85 0.00 0.00 60.65 59.72 1k2y h LYS 66 Cb 0.54 -0.23 -0.01 0.00 -0.60 0.00 0.00 32.23 31.93 1k2y h LYS 66 CO 0.03 0.68 -0.26 1.96 -3.45 0.00 0.00 179.45 178.42 1k2y h GLN 67 N 1.06 0.92 -0.21 1.90 1.08 -1.35 -1.50 115.11 117.00 1k2y h GLN 67 Ca 0.31 -0.42 0.00 0.00 -1.45 0.00 0.00 58.65 57.09 1k2y h GLN 67 Cb -0.05 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.35 1k2y h GLN 67 CO -0.09 1.08 0.14 1.25 -0.95 0.00 0.00 178.83 180.26 1k2y h LEU 68 N 0.75 0.23 -0.74 1.46 5.85 -0.76 -0.18 115.31 121.92 1k2y h LEU 68 Ca 0.09 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 1k2y h LEU 68 Cb 0.83 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.77 1k2y h LEU 68 CO 0.07 0.17 0.41 0.40 -0.34 0.00 0.00 178.44 179.16 1k2y h ILE 69 N 0.28 1.22 -0.57 4.05 2.04 -0.81 -1.95 117.51 121.77 1k2y h ILE 69 Ca 0.08 -0.55 -0.08 0.00 1.00 0.00 0.00 64.86 65.31 1k2y h ILE 69 Cb -0.03 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.27 1k2y h ILE 69 CO -0.02 0.24 0.02 -0.61 0.00 0.00 0.00 178.15 177.78 1k2y h GLN 70 N 1.02 0.96 -0.84 2.37 5.75 -0.72 0.50 115.11 124.15 1k2y h GLN 70 Ca 0.26 -0.28 -0.02 0.00 -0.15 0.00 0.00 58.65 58.46 1k2y h GLN 70 Cb 0.02 -0.10 -0.04 0.00 1.07 0.00 0.00 27.48 28.43 1k2y h GLN 70 CO -0.04 0.94 0.44 0.78 -2.65 0.00 0.00 178.83 178.29 1k2y h GLY 71 N 1.00 1.27 0.86 2.39 0.00 -0.66 0.13 103.07 108.07 1k2y h GLY 71 Ca 0.17 -0.60 -0.03 0.00 0.00 0.00 0.00 47.33 46.86 1k2y h GLY 71 CO 0.02 0.57 0.02 1.41 0.00 0.00 0.00 176.54 178.57 1k2y h LEU 72 N 1.18 0.41 -1.06 3.11 3.38 -0.90 -2.98 115.31 118.46 1k2y h LEU 72 Ca 0.29 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1k2y h LEU 72 Cb 0.07 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 1k2y h LEU 72 CO -0.04 0.59 0.54 0.58 0.09 0.00 0.00 178.44 180.19 1k2y h VAL 73 N 0.22 1.24 0.00 1.22 2.07 -0.55 -2.13 116.25 118.31 1k2y h VAL 73 Ca 0.07 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 67.09 1k2y h VAL 73 Cb 0.37 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 1k2y h VAL 73 CO 0.01 0.25 0.00 0.47 0.02 0.00 0.00 177.57 178.31 1k2y n ASP 74 N -4.37 0.00 0.04 0.57 8.00 0.44 -0.88 116.55 120.34 1k2y n ASP 74 Ca 0.10 0.33 0.12 0.00 0.71 0.00 0.00 54.79 56.05 1k2y n ASP 74 Cb 0.05 -0.41 0.13 0.00 -0.02 0.00 0.00 41.12 40.87 1k2y n ASP 74 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1k2y n GLY 76 N 1.36 1.02 3.80 0.00 0.00 -0.06 -3.08 105.19 108.23 1k2y n GLY 76 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 1k2y n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k2y s GLN 78 N -3.42 3.04 -0.09 0.00 -1.52 0.18 -1.40 119.66 116.45 1k2y s GLN 78 Ca 0.66 -1.18 -0.17 0.00 -1.95 0.00 0.00 55.36 52.71 1k2y s GLN 78 Cb -0.15 -4.14 -0.05 0.00 -0.22 0.00 0.00 33.01 28.45 1k2y s GLN 78 CO 0.23 -1.17 0.46 0.08 -0.25 0.00 0.00 175.29 174.64 1k2y s VAL 79 N 2.13 5.15 -0.44 1.09 1.01 0.33 -1.69 120.40 127.96 1k2y s VAL 79 Ca 0.09 0.92 -0.14 0.00 0.00 0.00 0.00 61.98 62.85 1k2y s VAL 79 Cb -0.23 -3.79 0.06 0.00 0.00 0.00 0.00 36.38 32.43 1k2y s VAL 79 CO 0.09 0.39 0.34 -0.44 0.00 0.00 0.00 175.10 175.47 1k2y s SER 80 N 0.24 6.01 -0.55 3.32 0.01 -0.08 -0.48 113.70 122.17 1k2y s SER 80 Ca 0.25 -1.26 -0.20 0.00 1.31 0.00 0.00 55.95 56.05 1k2y s SER 80 Cb -0.15 -2.13 0.07 0.00 0.21 0.00 0.00 66.02 64.01 1k2y s SER 80 CO 0.11 -0.57 0.73 -0.62 0.41 0.00 0.00 173.24 173.30 1k2y s ASP 81 N 2.26 6.23 0.00 2.44 3.68 0.29 -0.83 116.67 130.75 1k2y s ASP 81 Ca 0.04 -0.93 0.23 0.00 2.13 0.00 0.00 52.55 54.02 1k2y s ASP 81 Cb -0.23 -2.33 0.63 0.00 -1.45 0.00 0.00 42.92 39.54 1k2y s ASP 81 CO 0.06 -1.05 1.50 1.33 0.13 0.00 0.00 175.17 177.14 1k2y n VAL 82 N 5.73 0.21 -4.68 1.11 0.24 -0.45 -1.15 118.33 119.34 1k2y n VAL 82 Ca -0.05 -0.46 0.00 0.00 -2.04 0.00 0.00 64.34 61.79 1k2y n VAL 82 Cb 0.45 0.75 0.00 0.00 -1.47 0.00 0.00 33.84 33.57 1k2y n VAL 82 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1k2y n GLY 83 N 1.27 0.80 3.62 7.63 0.00 -1.24 -4.58 105.19 112.70 1k2y n GLY 83 Ca 0.17 -0.73 -0.43 0.00 0.00 0.00 0.00 46.02 45.03 1k2y n GLY 83 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1k2y s MET 84 N 0.00 3.90 0.09 1.61 1.75 -1.26 -1.24 119.30 124.15 1k2y s MET 84 Ca 0.00 1.00 -0.11 0.00 -1.25 0.00 0.00 55.69 55.33 1k2y s MET 84 Cb 0.00 -3.85 0.01 0.00 2.84 0.00 0.00 34.83 33.83 1k2y s MET 84 CO 0.00 -1.14 0.26 0.14 -0.65 0.00 0.00 175.02 173.63 1k2y s VAL 85 N 4.23 0.11 0.65 10.11 -7.23 -0.04 -4.93 120.40 123.32 1k2y s VAL 85 Ca 0.51 -0.94 -0.18 0.00 -1.81 0.00 0.00 61.98 59.57 1k2y s VAL 85 Cb -0.13 -1.21 -0.01 0.00 0.56 0.00 0.00 36.38 35.60 1k2y s VAL 85 CO 0.23 -0.52 1.25 -2.65 -0.31 0.00 0.00 175.10 173.11 1k2y n PRO 86 N 0.05 1.04 -0.22 4.82 -0.02 -1.26 -4.20 135.00 135.20 1k2y n PRO 86 Ca -0.16 0.41 0.02 0.00 -2.02 0.00 0.00 63.50 61.75 1k2y n PRO 86 Cb 0.62 -2.49 0.13 0.00 -0.02 0.00 0.00 33.50 31.74 1k2y n PRO 86 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1k2y h THR 87 N 0.44 0.53 0.00 3.45 2.02 -1.17 0.13 112.91 118.31 1k2y h THR 87 Ca -0.50 -0.07 -0.01 0.00 0.77 0.00 0.00 66.41 66.60 1k2y h THR 87 Cb 1.34 0.32 -0.00 0.00 -1.74 0.00 0.00 68.15 68.07 1k2y h THR 87 CO 0.52 0.04 -0.06 1.55 0.37 0.00 0.00 175.52 177.93 1k2y h PRO 88 N 0.19 0.00 -0.08 6.66 0.13 -1.81 -0.98 132.00 136.12 1k2y h PRO 88 Ca 0.35 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.30 1k2y h PRO 88 Cb 0.57 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.70 1k2y h PRO 88 CO -0.50 0.06 -0.72 0.28 -0.23 0.00 0.00 178.00 176.89 1k2y h VAL 89 N 0.00 1.38 -0.50 1.56 2.07 -1.11 0.06 116.25 119.71 1k2y h VAL 89 Ca -0.00 -2.13 -0.02 0.00 0.82 0.00 0.00 66.70 65.37 1k2y h VAL 89 Cb 0.32 2.10 -0.02 0.00 -1.52 0.00 0.00 31.29 32.17 1k2y h VAL 89 CO 0.01 0.64 0.23 0.25 0.02 0.00 0.00 177.57 178.72 1k2y h LEU 90 N 0.28 0.66 -0.84 2.57 7.12 -0.91 -0.84 115.31 123.36 1k2y h LEU 90 Ca -0.03 -0.14 0.03 0.00 0.13 0.00 0.00 57.88 57.88 1k2y h LEU 90 Cb 1.30 -0.17 -0.05 0.00 -0.53 0.00 0.00 40.66 41.21 1k2y h LEU 90 CO 0.12 0.61 0.54 1.88 -0.13 0.00 0.00 178.44 181.47 1k2y h TYR 91 N 0.66 1.01 -0.10 1.25 0.99 -0.99 -1.51 116.97 118.28 1k2y h TYR 91 Ca 0.17 0.03 0.03 0.00 2.00 0.00 0.00 58.73 60.96 1k2y h TYR 91 Cb 0.13 -0.33 -0.03 0.00 1.00 0.00 0.00 36.73 37.50 1k2y h TYR 91 CO -0.00 0.58 -0.09 -0.92 -0.00 0.00 0.00 178.16 177.73 1k2y h TYR 92 N 1.04 -0.21 -0.76 4.88 3.20 -0.76 -1.76 116.97 122.60 1k2y h TYR 92 Ca 0.34 0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.34 1k2y h TYR 92 Cb 0.02 0.11 -0.08 0.00 1.54 0.00 0.00 36.73 38.32 1k2y h TYR 92 CO -0.02 -0.13 0.37 0.00 -1.64 0.00 0.00 178.16 176.73 1k2y h ALA 93 N 0.97 1.08 0.00 1.82 0.00 -0.65 0.08 119.26 122.56 1k2y h ALA 93 Ca 0.07 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1k2y h ALA 93 Cb 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1k2y h ALA 93 CO -0.16 -0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.01 1k2y n ALA 94 N -2.43 1.99 -0.09 0.00 0.00 -0.62 -1.11 120.51 118.26 1k2y n ALA 94 Ca 0.13 -0.09 -0.09 0.00 0.00 0.00 0.00 53.44 53.39 1k2y n ALA 94 Cb 0.34 -1.30 -0.14 0.00 0.00 0.00 0.00 19.45 18.35 1k2y n ALA 94 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1k2y n ASN 95 N -1.28 0.77 -0.01 0.00 3.02 -0.15 -4.41 115.26 113.20 1k2y n ASN 95 Ca 0.09 -0.01 0.08 0.00 -0.03 0.00 0.00 54.58 54.72 1k2y n ASN 95 Cb 0.14 0.86 -0.13 0.00 -0.61 0.00 0.00 39.78 40.05 1k2y n ASN 95 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1k2y n VAL 96 N -2.68 0.00 -1.97 2.41 0.24 -0.24 -5.00 118.33 111.10 1k2y n VAL 96 Ca -0.29 -0.36 -0.29 0.00 -2.04 0.00 0.00 64.34 61.36 1k2y n VAL 96 Cb 1.06 0.20 0.17 0.00 -1.47 0.00 0.00 33.84 33.80 1k2y n VAL 96 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1k2y s LEU 97 N -4.04 2.70 0.20 1.34 1.43 -0.27 -4.97 118.68 115.07 1k2y s LEU 97 Ca -0.05 0.30 -0.11 0.00 -1.03 0.00 0.00 54.13 53.24 1k2y s LEU 97 Cb 0.11 -2.43 0.16 0.00 0.03 0.00 0.00 46.19 44.06 1k2y s LEU 97 CO 0.69 -2.56 1.85 -0.08 0.23 0.00 0.00 176.35 176.48 1k2y h GLU 98 N -1.49 0.80 -6.81 1.70 4.81 -1.94 -3.44 114.58 108.21 1k2y h GLU 98 Ca -0.44 -0.05 -0.49 0.00 -0.13 0.00 0.00 59.36 58.26 1k2y h GLU 98 Cb 1.25 -0.18 0.03 0.00 0.63 0.00 0.00 28.75 30.48 1k2y h GLU 98 CO 0.42 0.53 0.02 0.20 -0.73 0.00 0.00 179.01 179.45 1k2y s GLY 99 N -2.86 1.45 -0.01 1.92 0.00 -1.26 -4.99 107.32 101.57 1k2y s GLY 99 Ca -0.13 -0.65 0.14 0.00 0.00 0.00 0.00 44.72 44.08 1k2y s GLY 99 CO 0.76 -0.51 1.34 0.28 0.00 0.00 0.00 173.10 174.97 1k2y n LYS 100 N -2.12 2.87 -4.06 2.90 5.02 -1.26 -4.60 118.16 116.91 1k2y n LYS 100 Ca -0.01 -2.24 -0.29 0.00 -2.02 0.00 0.00 58.31 53.75 1k2y n LYS 100 Cb 0.56 -1.38 -0.06 0.00 -0.02 0.00 0.00 35.03 34.13 1k2y n LYS 100 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1k2y s SER 101 N -1.03 5.50 0.00 4.39 0.01 -1.22 -0.85 113.70 120.50 1k2y s SER 101 Ca 0.30 -0.06 -0.26 0.00 1.31 0.00 0.00 55.95 57.25 1k2y s SER 101 Cb 0.17 -1.46 0.06 0.00 0.21 0.00 0.00 66.02 65.00 1k2y s SER 101 CO 0.20 0.14 0.59 -0.83 0.41 0.00 0.00 173.24 173.74 1k2y s GLY 102 N -2.61 -0.50 -0.04 3.44 0.00 0.34 -1.55 107.32 106.40 1k2y s GLY 102 Ca 0.30 0.93 0.01 0.00 0.00 0.00 0.00 44.72 45.96 1k2y s GLY 102 CO 0.22 0.61 -0.05 0.14 0.00 0.00 0.00 173.10 174.01 1k2y s VAL 103 N -1.82 0.59 -0.21 1.40 1.01 0.68 -1.02 120.40 121.04 1k2y s VAL 103 Ca -0.08 -0.17 -0.03 0.00 0.00 0.00 0.00 61.98 61.69 1k2y s VAL 103 Cb -0.01 -0.59 -0.01 0.00 0.00 0.00 0.00 36.38 35.77 1k2y s VAL 103 CO 0.04 0.23 -0.05 -0.32 0.00 0.00 0.00 175.10 174.99 1k2y s MET 104 N 0.77 3.40 -0.54 2.72 0.00 -0.15 -1.62 119.30 123.89 1k2y s MET 104 Ca -0.11 -0.62 -0.20 0.00 0.00 0.00 0.00 55.69 54.76 1k2y s MET 104 Cb -0.14 -2.96 0.06 0.00 0.00 0.00 0.00 34.83 31.79 1k2y s MET 104 CO 0.01 -0.13 0.70 -1.17 0.00 0.00 0.00 175.02 174.43 1k2y s LEU 105 N 1.29 4.89 -0.05 4.11 2.96 0.20 -1.05 118.68 131.03 1k2y s LEU 105 Ca 0.03 -0.93 -0.21 0.00 -0.22 0.00 0.00 54.13 52.80 1k2y s LEU 105 Cb -0.14 -2.47 0.04 0.00 0.50 0.00 0.00 46.19 44.12 1k2y s LEU 105 CO -0.02 -1.00 0.48 0.28 -1.32 0.00 0.00 176.35 174.76 1k2y s THR 106 N 2.90 0.03 -1.43 3.68 -1.32 -0.08 -1.78 115.64 117.64 1k2y s THR 106 Ca 0.17 -0.23 0.17 0.00 -1.21 0.00 0.00 61.69 60.59 1k2y s THR 106 Cb -0.19 -0.77 0.52 0.00 -1.51 0.00 0.00 72.50 70.55 1k2y s THR 106 CO 0.12 -0.13 1.44 0.61 -2.21 0.00 0.00 174.62 174.45 1k2y n GLY 107 N 1.34 2.68 7.00 6.08 0.00 -1.26 -1.82 105.19 119.21 1k2y n GLY 107 Ca -0.20 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1k2y n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k2y n ALA 108 N 1.10 0.00 0.34 4.61 0.00 -1.26 -1.56 120.51 123.73 1k2y n ALA 108 Ca 0.20 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.74 1k2y n ALA 108 Cb 0.59 0.00 0.17 0.00 0.00 0.00 0.00 19.45 20.21 1k2y n ALA 108 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1k2y n HIS 109 N 7.28 0.37 -1.71 0.00 1.44 -1.26 -3.61 115.22 117.73 1k2y n HIS 109 Ca 0.00 -0.22 -0.30 0.00 -2.01 0.00 0.00 57.72 55.20 1k2y n HIS 109 Cb 0.00 -0.00 0.09 0.00 0.12 0.00 0.00 29.99 30.19 1k2y n HIS 109 CO 0.00 0.00 0.00 -0.80 -2.81 0.00 0.00 176.34 172.73 1k2y s ASN 110 N -1.39 4.61 0.91 4.39 -0.87 -0.60 -4.49 114.94 117.50 1k2y s ASN 110 Ca 0.32 1.10 -0.11 0.00 -1.57 0.00 0.00 52.86 52.60 1k2y s ASN 110 Cb 0.19 -1.78 0.12 0.00 -0.02 0.00 0.00 41.25 39.76 1k2y s ASN 110 CO 0.27 -1.87 1.00 -2.65 -2.57 0.00 0.00 177.10 171.28 1k2y n PRO 111 N -3.34 -0.37 -0.36 -0.60 -0.02 -1.26 -4.83 135.00 124.21 1k2y n PRO 111 Ca 0.07 -0.04 0.27 0.00 -2.02 0.00 0.00 63.50 61.78 1k2y n PRO 111 Cb 0.58 -2.28 0.53 0.00 -0.02 0.00 0.00 33.50 32.32 1k2y n PRO 111 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1k2y h PRO 112 N -1.73 0.26 -0.00 0.52 0.11 -1.89 -1.35 132.00 127.91 1k2y h PRO 112 Ca -0.43 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1k2y h PRO 112 Cb 1.28 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1k2y h PRO 112 CO 0.40 0.17 -0.09 -0.25 -0.21 0.00 0.00 178.00 178.02 1k2y n ASP 113 N -4.84 0.27 -4.81 -2.05 8.00 -1.26 -4.65 116.55 107.21 1k2y n ASP 113 Ca 0.32 -0.28 -0.35 0.00 0.71 0.00 0.00 54.79 55.20 1k2y n ASP 113 Cb 1.09 -0.17 -0.07 0.00 -0.02 0.00 0.00 41.12 41.96 1k2y n ASP 113 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1k2y s TYR 114 N -2.61 3.48 0.25 1.24 1.51 -0.51 -0.40 117.35 120.30 1k2y s TYR 114 Ca 0.25 1.59 -0.05 0.00 -1.01 0.00 0.00 57.07 57.86 1k2y s TYR 114 Cb 0.20 -2.81 0.02 0.00 -0.11 0.00 0.00 41.96 39.26 1k2y s TYR 114 CO 0.50 0.07 0.41 -1.71 -1.11 0.00 0.00 175.55 173.70 1k2y n ASN 115 N -0.07 -1.17 0.00 2.29 2.85 -0.62 -4.29 115.26 114.25 1k2y n ASN 115 Ca 0.04 -2.22 0.00 0.00 -0.11 0.00 0.00 54.58 52.29 1k2y n ASN 115 Cb 0.52 2.06 0.00 0.00 1.24 0.00 0.00 39.78 43.60 1k2y n ASN 115 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1k2y n GLY 116 N -0.38 -1.51 2.78 8.20 0.00 -0.76 -1.18 105.19 112.34 1k2y n GLY 116 Ca -0.02 -1.07 -0.18 0.00 0.00 0.00 0.00 46.02 44.75 1k2y n GLY 116 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1k2y s PHE 117 N -2.75 0.32 -0.20 1.61 0.40 0.10 -0.90 117.98 116.56 1k2y s PHE 117 Ca 0.00 0.02 -0.06 0.00 -0.60 0.00 0.00 56.93 56.29 1k2y s PHE 117 Cb 0.00 -0.48 -0.03 0.00 0.51 0.00 0.00 43.02 43.02 1k2y s PHE 117 CO 0.00 -0.17 0.03 0.15 0.70 0.00 0.00 175.22 175.93 1k2y s LYS 118 N 1.37 3.74 -0.07 0.44 1.02 -0.21 -1.84 119.74 124.18 1k2y s LYS 118 Ca -0.05 -0.46 0.03 0.00 0.02 0.00 0.00 55.97 55.51 1k2y s LYS 118 Cb -0.13 -3.15 0.01 0.00 -0.52 0.00 0.00 37.83 34.04 1k2y s LYS 118 CO -0.03 0.07 -0.15 0.42 -0.92 0.00 0.00 175.35 174.75 1k2y s ILE 119 N 0.88 1.31 -0.09 2.17 1.01 -1.26 -0.97 121.20 124.24 1k2y s ILE 119 Ca 0.02 -0.59 0.02 0.00 0.00 0.00 0.00 60.65 60.11 1k2y s ILE 119 Cb -0.14 -1.17 0.01 0.00 0.01 0.00 0.00 42.46 41.17 1k2y s ILE 119 CO 0.02 0.39 -0.16 -0.69 0.00 0.00 0.00 174.94 174.51 1k2y s VAL 120 N 0.55 1.45 -0.11 2.92 1.01 -0.19 -3.76 120.40 122.28 1k2y s VAL 120 Ca -0.14 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.19 1k2y s VAL 120 Cb -0.16 -1.31 0.02 0.00 0.00 0.00 0.00 36.38 34.93 1k2y s VAL 120 CO 0.04 0.43 -0.11 -0.69 0.00 0.00 0.00 175.10 174.77 1k2y s VAL 121 N 0.71 1.22 -1.61 2.92 1.01 0.17 -0.51 120.40 124.31 1k2y s VAL 121 Ca -0.13 -0.44 -0.11 0.00 0.00 0.00 0.00 61.98 61.29 1k2y s VAL 121 Cb -0.16 -1.17 0.10 0.00 0.00 0.00 0.00 36.38 35.15 1k2y s VAL 121 CO 0.03 0.39 0.58 0.00 0.00 0.00 0.00 175.10 176.10 1k2y n ALA 122 N 4.55 -1.56 -0.36 5.51 0.00 -1.21 -1.86 120.51 125.58 1k2y n ALA 122 Ca -0.17 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1k2y n ALA 122 Cb 0.51 -2.55 0.00 0.00 0.00 0.00 0.00 19.45 17.41 1k2y n ALA 122 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k2y n GLY 123 N -1.68 0.83 3.07 0.00 0.00 -0.03 -4.97 105.19 102.41 1k2y n GLY 123 Ca -0.08 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.79 1k2y n GLY 123 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1k2y s GLU 124 N -0.56 0.61 0.59 1.61 4.04 -0.78 -5.11 118.70 119.10 1k2y s GLU 124 Ca 0.00 -0.70 -0.13 0.00 0.04 0.00 0.00 54.97 54.18 1k2y s GLU 124 Cb 0.00 -0.47 -0.05 0.00 0.02 0.00 0.00 34.13 33.63 1k2y s GLU 124 CO 0.00 0.10 1.02 0.95 -1.84 0.00 0.00 175.26 175.49 1k2y s THR 125 N -1.11 4.53 0.16 1.83 -4.23 -1.26 0.41 115.64 115.98 1k2y s THR 125 Ca -0.06 0.98 0.04 0.00 -1.18 0.00 0.00 61.69 61.47 1k2y s THR 125 Cb -0.09 -3.75 -0.04 0.00 1.34 0.00 0.00 72.50 69.97 1k2y s THR 125 CO 0.01 -0.92 0.23 -0.76 -0.54 0.00 0.00 174.62 172.63 1k2y s LEU 126 N -4.79 4.11 0.01 4.79 1.43 -1.25 -4.89 118.68 118.10 1k2y s LEU 126 Ca 0.57 0.03 -0.13 0.00 -1.03 0.00 0.00 54.13 53.57 1k2y s LEU 126 Cb -0.11 -2.69 0.02 0.00 0.03 0.00 0.00 46.19 43.44 1k2y s LEU 126 CO 0.45 0.05 0.27 0.00 0.23 0.00 0.00 176.35 177.35 1k2y s ALA 127 N -1.77 -0.64 0.00 4.21 0.00 -1.26 -4.53 121.76 117.77 1k2y s ALA 127 Ca 0.33 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.37 1k2y s ALA 127 Cb -0.10 0.19 0.00 0.00 0.00 0.00 0.00 23.12 23.20 1k2y s ALA 127 CO 0.26 -0.32 0.00 0.09 0.00 0.00 0.00 175.76 175.79 1k2y n ASN 128 N 0.98 0.00 0.06 0.00 3.02 0.65 -1.09 115.26 118.88 1k2y n ASN 128 Ca -0.20 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 54.47 1k2y n ASN 128 Cb 0.57 0.00 0.60 0.00 -0.61 0.00 0.00 39.78 40.34 1k2y n ASN 128 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1k2y h GLU 129 N 0.00 0.16 -0.32 3.52 4.39 -1.96 -1.52 114.58 118.85 1k2y h GLU 129 Ca 0.00 -0.01 -0.12 0.00 0.34 0.00 0.00 59.36 59.57 1k2y h GLU 129 Cb 0.00 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 1k2y h GLU 129 CO 0.00 0.10 -0.29 1.96 -1.16 0.00 0.00 179.01 179.62 1k2y h GLN 130 N 0.16 0.67 -0.22 2.33 4.20 -1.49 0.28 115.11 121.05 1k2y h GLN 130 Ca 0.17 -0.29 -0.16 0.00 0.06 0.00 0.00 58.65 58.43 1k2y h GLN 130 Cb 0.48 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.24 1k2y h GLN 130 CO -0.03 0.88 -0.50 0.82 -0.67 0.00 0.00 178.83 179.34 1k2y h ILE 131 N 0.57 1.31 -0.26 2.54 1.08 -1.49 -2.96 117.51 118.30 1k2y h ILE 131 Ca 0.07 -1.71 -0.01 0.00 -0.39 0.00 0.00 64.86 62.82 1k2y h ILE 131 Cb 0.79 1.82 -0.01 0.00 -3.07 0.00 0.00 36.82 36.35 1k2y h ILE 131 CO 0.06 0.54 0.12 1.56 -0.69 0.00 0.00 178.15 179.75 1k2y h GLN 132 N 0.44 0.35 -0.63 2.37 1.08 -0.99 -1.66 115.11 116.08 1k2y h GLN 132 Ca -0.00 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.15 1k2y h GLN 132 Cb 1.11 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 28.44 1k2y h GLN 132 CO 0.11 0.28 0.34 0.00 -0.95 0.00 0.00 178.83 178.61 1k2y h ALA 133 N 1.78 1.42 -0.37 3.87 0.00 -0.28 -0.31 119.26 125.36 1k2y h ALA 133 Ca 0.09 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1k2y h ALA 133 Cb 0.05 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1k2y h ALA 133 CO -0.01 0.48 0.22 -0.07 0.00 0.00 0.00 179.25 179.87 1k2y h LEU 134 N 0.87 0.45 -0.33 0.00 3.38 -1.21 -0.19 115.31 118.28 1k2y h LEU 134 Ca 0.22 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.16 1k2y h LEU 134 Cb 0.03 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1k2y h LEU 134 CO -0.04 0.38 0.13 -0.09 0.09 0.00 0.00 178.44 178.91 1k2y h ARG 135 N 0.48 0.27 -0.47 1.13 2.43 -1.20 -2.87 114.38 114.15 1k2y h ARG 135 Ca 0.13 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.31 1k2y h ARG 135 Cb 0.02 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.47 1k2y h ARG 135 CO -0.02 0.18 0.27 0.93 -1.51 0.00 0.00 179.97 179.82 1k2y h GLU 136 N 0.28 0.53 -1.00 0.20 5.08 -0.74 -2.23 114.58 116.69 1k2y h GLU 136 Ca 0.14 -0.03 0.22 0.00 -1.00 0.00 0.00 59.36 58.69 1k2y h GLU 136 Cb 0.10 -0.12 -0.11 0.00 0.50 0.00 0.00 28.75 29.12 1k2y h GLU 136 CO -0.14 0.35 0.61 0.00 -1.00 0.00 0.00 179.01 178.84 1k2y h ARG 137 N 0.55 0.61 0.04 2.33 3.08 -0.82 -0.51 114.38 119.66 1k2y h ARG 137 Ca 0.19 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.20 1k2y h ARG 137 Cb 0.02 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 29.94 1k2y h ARG 137 CO -0.09 0.40 -0.02 0.82 -1.07 0.00 0.00 179.97 180.01 1k2y h ILE 138 N 0.63 1.34 -0.76 2.04 2.04 -1.33 0.20 117.51 121.66 1k2y h ILE 138 Ca 0.60 -1.53 0.15 0.00 1.00 0.00 0.00 64.86 65.08 1k2y h ILE 138 Cb 1.12 2.30 -0.14 0.00 -0.74 0.00 0.00 36.82 39.36 1k2y h ILE 138 CO -0.39 0.37 -0.17 -0.33 0.00 0.00 0.00 178.15 177.63 1k2y h GLU 139 N -0.77 0.01 -0.04 2.37 5.08 -1.08 -2.61 114.58 117.53 1k2y h GLU 139 Ca -0.01 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1k2y h GLU 139 Cb 0.65 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1k2y h GLU 139 CO 0.01 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.65 1k2y n LYS 140 N -5.49 1.92 -3.10 2.33 5.02 -0.23 -4.94 118.16 113.67 1k2y n LYS 140 Ca 0.11 -1.34 -0.23 0.00 -2.02 0.00 0.00 58.31 54.83 1k2y n LYS 140 Cb 0.40 -1.47 0.03 0.00 -0.02 0.00 0.00 35.03 33.97 1k2y n LYS 140 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1k2y n ASN 141 N 0.62 -5.89 -4.23 4.39 3.02 -0.26 -4.89 115.26 108.02 1k2y n ASN 141 Ca 0.17 -0.32 -0.44 0.00 -0.03 0.00 0.00 54.58 53.97 1k2y n ASN 141 Cb 0.44 -4.75 0.00 0.00 -0.61 0.00 0.00 39.78 34.86 1k2y n ASN 141 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1k2y n ASP 142 N -2.53 5.37 -4.02 6.41 2.03 0.54 -4.94 116.55 119.40 1k2y n ASP 142 Ca -0.09 -3.07 -0.17 0.00 0.52 0.00 0.00 54.79 51.97 1k2y n ASP 142 Cb 0.61 -1.48 -0.14 0.00 -0.72 0.00 0.00 41.12 39.39 1k2y n ASP 142 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1k2y s LEU 143 N 0.14 2.05 0.65 -2.67 1.43 -1.26 -4.74 118.68 114.29 1k2y s LEU 143 Ca 0.39 -0.21 -0.13 0.00 -1.03 0.00 0.00 54.13 53.15 1k2y s LEU 143 Cb 0.00 -0.38 -0.01 0.00 0.03 0.00 0.00 46.19 45.83 1k2y s LEU 143 CO 0.00 0.06 1.06 0.00 0.23 0.00 0.00 176.35 177.70 1k2y s ALA 144 N -0.36 2.67 -0.03 4.21 0.00 -1.26 -5.06 121.76 121.93 1k2y s ALA 144 Ca 0.01 0.26 -0.01 0.00 0.00 0.00 0.00 51.96 52.22 1k2y s ALA 144 Cb -0.04 -3.21 0.03 0.00 0.00 0.00 0.00 23.12 19.90 1k2y s ALA 144 CO -0.00 -1.08 0.05 -1.54 0.00 0.00 0.00 175.76 173.19 1k2y s SER 145 N -3.25 0.52 0.28 0.00 1.04 -1.26 -4.37 113.70 106.65 1k2y s SER 145 Ca 0.61 0.07 -0.17 0.00 0.48 0.00 0.00 55.95 56.94 1k2y s SER 145 Cb -0.15 -0.09 0.06 0.00 0.10 0.00 0.00 66.02 65.94 1k2y s SER 145 CO 0.46 -0.18 0.87 0.61 0.98 0.00 0.00 173.24 175.97 1k2y n GLY 146 N 4.67 0.83 3.04 7.32 0.00 0.29 -4.75 105.19 116.59 1k2y n GLY 146 Ca -0.17 -1.19 -0.34 0.00 0.00 0.00 0.00 46.02 44.32 1k2y n GLY 146 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k2y s VAL 147 N -2.12 3.09 0.00 1.61 1.01 -1.26 -3.52 120.40 119.21 1k2y s VAL 147 Ca 0.18 -2.88 0.00 0.00 0.00 0.00 0.00 61.98 59.28 1k2y s VAL 147 Cb -0.04 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.25 1k2y s VAL 147 CO 0.08 -0.79 0.00 0.61 0.00 0.00 0.00 175.10 175.00 1k2y n GLY 148 N 3.61 0.22 3.32 4.51 0.00 -0.26 -4.76 105.19 111.82 1k2y n GLY 148 Ca 0.05 -1.79 -0.10 0.00 0.00 0.00 0.00 46.02 44.19 1k2y n GLY 148 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1k2y s SER 149 N -1.00 -0.10 -0.04 1.61 1.04 -0.49 -4.96 113.70 109.76 1k2y s SER 149 Ca 0.00 -0.51 0.03 0.00 0.48 0.00 0.00 55.95 55.95 1k2y s SER 149 Cb 0.00 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1k2y s SER 149 CO 0.00 -0.86 -0.13 -0.69 0.98 0.00 0.00 173.24 172.55 1k2y s VAL 150 N -3.85 1.09 -0.09 5.02 1.01 -1.26 -0.52 120.40 121.79 1k2y s VAL 150 Ca 0.07 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.57 1k2y s VAL 150 Cb 0.02 -0.96 0.00 0.00 0.00 0.00 0.00 36.38 35.45 1k2y s VAL 150 CO -0.09 0.33 -0.21 -0.70 0.00 0.00 0.00 175.10 174.43 1k2y s GLU 151 N 0.22 2.73 -0.02 2.72 2.12 0.37 -4.97 118.70 121.87 1k2y s GLU 151 Ca -0.05 -0.77 -0.28 0.00 0.36 0.00 0.00 54.97 54.22 1k2y s GLU 151 Cb -0.11 -2.09 -0.03 0.00 0.26 0.00 0.00 34.13 32.16 1k2y s GLU 151 CO 0.02 0.14 0.91 -1.14 -0.54 0.00 0.00 175.26 174.65 1k2y s GLN 152 N 0.42 4.52 -0.09 4.30 0.74 -1.26 -0.54 119.66 127.74 1k2y s GLN 152 Ca -0.18 1.28 0.03 0.00 0.05 0.00 0.00 55.36 56.54 1k2y s GLN 152 Cb -0.17 -3.46 0.01 0.00 1.10 0.00 0.00 33.01 30.48 1k2y s GLN 152 CO 0.08 -0.03 -0.19 0.08 -0.55 0.00 0.00 175.29 174.67 1k2y s VAL 153 N 1.00 1.70 -0.67 1.34 1.01 -0.30 -4.90 120.40 119.58 1k2y s VAL 153 Ca 0.48 -0.81 -0.13 0.00 0.00 0.00 0.00 61.98 61.53 1k2y s VAL 153 Cb -0.20 -1.50 0.17 0.00 0.00 0.00 0.00 36.38 34.85 1k2y s VAL 153 CO 0.25 0.48 0.59 -0.62 0.00 0.00 0.00 175.10 175.80 1k2y s ASP 154 N 0.50 6.28 0.06 3.32 3.68 -1.26 -4.21 116.67 125.03 1k2y s ASP 154 Ca -0.16 -2.32 0.22 0.00 2.13 0.00 0.00 52.55 52.42 1k2y s ASP 154 Cb -0.17 -2.14 -0.07 0.00 -1.45 0.00 0.00 42.92 39.08 1k2y s ASP 154 CO 0.06 -0.66 0.89 0.00 0.13 0.00 0.00 175.17 175.59 1k2y n ILE 155 N 4.45 0.20 -0.25 4.11 0.13 -1.26 -4.52 119.36 122.22 1k2y n ILE 155 Ca 0.02 -0.35 -0.06 0.00 -1.10 0.00 0.00 62.75 61.26 1k2y n ILE 155 Cb 0.43 0.10 0.05 0.00 -0.84 0.00 0.00 39.64 39.38 1k2y n ILE 155 CO 0.00 0.00 0.00 -0.07 2.80 0.00 0.00 176.55 179.28 1k2y h LEU 156 N 0.00 0.87 -1.18 9.51 4.07 -1.93 -1.97 115.31 124.68 1k2y h LEU 156 Ca 0.00 -0.11 -0.02 0.00 0.08 0.00 0.00 57.88 57.83 1k2y h LEU 156 Cb 0.83 -0.22 -0.03 0.00 1.08 0.00 0.00 40.66 42.32 1k2y h LEU 156 CO 0.00 0.74 0.33 -0.65 -1.08 0.00 0.00 178.44 177.78 1k2y h PRO 157 N 0.94 0.89 -0.28 1.13 0.11 -1.99 -0.64 132.00 132.16 1k2y h PRO 157 Ca 0.24 -0.10 -0.02 0.00 0.11 0.00 0.00 66.00 66.22 1k2y h PRO 157 Cb 0.08 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.00 1k2y h PRO 157 CO -0.03 0.68 0.10 -0.09 -0.21 0.00 0.00 178.00 178.44 1k2y h ARG 158 N 0.90 0.43 -0.17 1.05 2.43 -1.67 -0.17 114.38 117.18 1k2y h ARG 158 Ca 0.23 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 1k2y h ARG 158 Cb 0.06 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1k2y h ARG 158 CO -0.03 0.47 0.11 -0.92 -1.51 0.00 0.00 179.97 178.08 1k2y h TYR 159 N 0.30 0.20 -0.28 2.20 5.03 -1.13 0.19 116.97 123.48 1k2y h TYR 159 Ca 0.09 0.01 0.04 0.00 2.58 0.00 0.00 58.73 61.45 1k2y h TYR 159 Cb 0.21 -0.07 -0.04 0.00 1.55 0.00 0.00 36.73 38.38 1k2y h TYR 159 CO -0.00 0.12 0.05 0.35 -1.32 0.00 0.00 178.16 177.36 1k2y h PHE 160 N 0.22 0.08 -0.43 -3.82 3.57 -1.00 -2.31 116.94 113.25 1k2y h PHE 160 Ca 0.06 0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.44 1k2y h PHE 160 Cb -0.02 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 1k2y h PHE 160 CO -0.07 0.01 -0.27 -0.22 -2.23 0.00 0.00 178.31 175.53 1k2y h LYS 161 N 0.15 0.94 -0.66 1.11 3.64 -0.82 -1.00 116.57 119.93 1k2y h LYS 161 Ca 0.13 -0.44 0.08 0.00 -1.27 0.00 0.00 60.65 59.15 1k2y h LYS 161 Cb 0.14 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 31.88 1k2y h LYS 161 CO -0.18 1.10 0.31 0.37 -2.27 0.00 0.00 179.45 178.79 1k2y h GLN 162 N 0.77 0.54 -0.06 1.90 5.75 -0.68 0.97 115.11 124.30 1k2y h GLN 162 Ca 0.09 -0.03 -0.08 0.00 -0.15 0.00 0.00 58.65 58.47 1k2y h GLN 162 Cb 0.86 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 29.29 1k2y h GLN 162 CO 0.08 0.36 -0.27 0.82 -2.65 0.00 0.00 178.83 177.16 1k2y h ILE 163 N 0.55 1.44 -0.91 2.39 2.04 -1.29 -3.15 117.51 118.59 1k2y h ILE 163 Ca 0.32 -1.71 -0.01 0.00 1.00 0.00 0.00 64.86 64.45 1k2y h ILE 163 Cb 0.32 2.38 -0.04 0.00 -0.74 0.00 0.00 36.82 38.74 1k2y h ILE 163 CO -0.25 0.49 0.53 -0.09 0.00 0.00 0.00 178.15 178.82 1k2y h ARG 164 N -0.24 1.25 0.00 2.37 2.43 -0.84 -1.71 114.38 117.64 1k2y h ARG 164 Ca -0.02 -0.13 -0.06 0.00 -0.81 0.00 0.00 59.98 58.96 1k2y h ARG 164 Cb 0.93 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 30.22 1k2y h ARG 164 CO 0.06 0.89 -0.29 -0.44 -1.51 0.00 0.00 179.97 178.67 1k2y h ASP 165 N 1.26 0.00 0.00 -3.80 3.45 -0.86 -3.06 116.42 113.42 1k2y h ASP 165 Ca 0.32 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.78 1k2y h ASP 165 Cb -0.02 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.75 1k2y h ASP 165 CO -0.06 0.29 -0.67 -0.67 -1.57 0.00 0.00 179.24 176.57 1k2y n ASP 166 N -3.82 1.60 -4.80 6.45 4.64 -0.70 -4.91 116.55 115.02 1k2y n ASP 166 Ca -0.01 -1.29 -0.37 0.00 -1.38 0.00 0.00 54.79 51.74 1k2y n ASP 166 Cb 0.38 0.66 -0.07 0.00 -1.04 0.00 0.00 41.12 41.06 1k2y n ASP 166 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1k2y s ILE 167 N -2.68 5.30 -0.63 5.18 -1.09 -0.88 -5.03 121.20 121.36 1k2y s ILE 167 Ca 0.15 0.51 0.05 0.00 -2.23 0.00 0.00 60.65 59.12 1k2y s ILE 167 Cb 0.17 -3.58 0.17 0.00 -1.58 0.00 0.00 42.46 37.64 1k2y s ILE 167 CO 0.69 0.50 0.44 0.00 -1.23 0.00 0.00 174.94 175.34 1k2y s ALA 168 N -0.35 3.32 0.43 9.38 0.00 -1.26 -4.95 121.76 128.33 1k2y s ALA 168 Ca 0.17 -3.53 -0.23 0.00 0.00 0.00 0.00 51.96 48.37 1k2y s ALA 168 Cb -0.14 -2.06 -0.08 0.00 0.00 0.00 0.00 23.12 20.84 1k2y s ALA 168 CO 0.06 -2.07 1.09 -1.64 0.00 0.00 0.00 175.76 173.20 1k2y s MET 169 N -1.06 3.99 0.00 0.00 -1.94 -1.26 -4.93 119.30 114.09 1k2y s MET 169 Ca 0.25 1.60 0.00 0.00 -1.71 0.00 0.00 55.69 55.83 1k2y s MET 169 Cb -0.05 -2.46 0.00 0.00 2.01 0.00 0.00 34.83 34.33 1k2y s MET 169 CO -0.15 -0.31 0.00 0.00 -0.01 0.00 0.00 175.02 174.54 1k2y n ALA 170 N -0.29 0.49 -2.05 3.03 0.00 -1.26 -5.04 120.51 115.38 1k2y n ALA 170 Ca 0.06 -0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.18 1k2y n ALA 170 Cb 0.49 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.89 1k2y n ALA 170 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1k2y s LYS 171 N -0.00 3.98 0.47 0.00 -2.85 -0.94 -5.02 119.74 115.38 1k2y s LYS 171 Ca 0.00 0.74 -0.21 0.00 -1.00 0.00 0.00 55.97 55.50 1k2y s LYS 171 Cb 0.00 -2.34 -0.08 0.00 -2.06 0.00 0.00 37.83 33.35 1k2y s LYS 171 CO 0.00 0.02 1.07 -1.25 0.10 0.00 0.00 175.35 175.29 1k2y s PRO 172 N -3.37 3.80 0.01 1.78 0.04 -1.26 -4.83 135.00 131.17 1k2y s PRO 172 Ca 0.56 1.48 0.02 0.00 0.04 0.00 0.00 61.00 63.09 1k2y s PRO 172 Cb -0.10 -2.21 -0.01 0.00 0.04 0.00 0.00 34.50 32.22 1k2y s PRO 172 CO 0.22 -0.45 -0.05 -1.64 0.04 0.00 0.00 177.00 175.11 1k2y s MET 173 N -3.02 0.41 -0.27 4.56 -1.94 -1.26 -5.05 119.30 112.72 1k2y s MET 173 Ca 0.66 -0.37 -0.10 0.00 -1.71 0.00 0.00 55.69 54.17 1k2y s MET 173 Cb -0.20 -0.30 -0.05 0.00 2.01 0.00 0.00 34.83 36.29 1k2y s MET 173 CO 0.24 0.07 0.17 0.21 -0.01 0.00 0.00 175.02 175.70 1k2y s LYS 174 N -0.63 3.90 -0.10 2.03 2.20 -1.26 -0.51 119.74 125.36 1k2y s LYS 174 Ca -0.03 -0.35 0.02 0.00 -0.36 0.00 0.00 55.97 55.25 1k2y s LYS 174 Cb -0.05 -3.59 0.02 0.00 -1.51 0.00 0.00 37.83 32.70 1k2y s LYS 174 CO -0.00 -0.17 -0.14 0.08 -0.36 0.00 0.00 175.35 174.76 1k2y s VAL 175 N 1.71 1.37 -0.09 4.02 1.01 0.33 -0.35 120.40 128.40 1k2y s VAL 175 Ca 0.07 -0.57 -0.29 0.00 0.00 0.00 0.00 61.98 61.19 1k2y s VAL 175 Cb -0.16 -1.26 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 1k2y s VAL 175 CO 0.09 0.41 0.99 -0.69 0.00 0.00 0.00 175.10 175.91 1k2y s VAL 176 N 0.99 4.81 -0.27 2.92 1.01 -0.63 -1.05 120.40 128.18 1k2y s VAL 176 Ca -0.07 2.03 0.03 0.00 0.00 0.00 0.00 61.98 63.97 1k2y s VAL 176 Cb -0.15 -4.31 0.06 0.00 0.00 0.00 0.00 36.38 31.99 1k2y s VAL 176 CO -0.01 0.04 -0.08 -0.69 0.00 0.00 0.00 175.10 174.36 1k2y s VAL 177 N 1.80 2.25 -0.35 2.92 1.01 -0.37 -0.39 120.40 127.27 1k2y s VAL 177 Ca 0.49 -1.71 -0.10 0.00 0.00 0.00 0.00 61.98 60.66 1k2y s VAL 177 Cb -0.19 -2.36 0.02 0.00 0.00 0.00 0.00 36.38 33.85 1k2y s VAL 177 CO 0.20 -0.11 0.17 -0.62 0.00 0.00 0.00 175.10 174.74 1k2y s ASP 178 N 1.09 5.58 0.00 3.32 -1.08 0.40 -0.65 116.67 125.33 1k2y s ASP 178 Ca -0.06 -0.90 0.24 0.00 -0.52 0.00 0.00 52.55 51.31 1k2y s ASP 178 Cb -0.20 -1.98 0.44 0.00 -1.46 0.00 0.00 42.92 39.71 1k2y s ASP 178 CO -0.05 -0.32 1.40 0.00 0.52 0.00 0.00 175.17 176.72 1k2y n GLY 180 N 1.35 -0.03 2.62 0.00 0.00 -1.16 -0.99 105.19 106.98 1k2y n GLY 180 Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 1k2y n GLY 180 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1k2y n ASN 181 N -1.63 -5.27 -3.09 1.61 3.02 0.26 -3.97 115.26 106.18 1k2y n ASN 181 Ca -0.18 0.32 -0.12 0.00 -0.03 0.00 0.00 54.58 54.56 1k2y n ASN 181 Cb 0.61 -3.89 0.07 0.00 -0.61 0.00 0.00 39.78 35.96 1k2y n ASN 181 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k2y n GLY 182 N -0.44 -0.07 0.20 7.41 0.00 -0.16 -1.24 105.19 110.90 1k2y n GLY 182 Ca -0.13 -1.87 0.15 0.00 0.00 0.00 0.00 46.02 44.16 1k2y n GLY 182 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1k2y h VAL 183 N -0.83 0.00 0.00 1.61 3.04 -1.58 -2.72 116.25 115.77 1k2y h VAL 183 Ca -0.18 -0.38 0.00 0.00 -1.01 0.00 0.00 66.70 65.14 1k2y h VAL 183 Cb 0.57 1.25 0.00 0.00 -2.01 0.00 0.00 31.29 31.10 1k2y h VAL 183 CO 0.16 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.72 1k2y h ALA 184 N 2.14 1.00 -0.02 3.17 0.00 -1.83 -1.87 119.26 121.84 1k2y h ALA 184 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1k2y h ALA 184 Cb 0.45 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1k2y h ALA 184 CO 0.00 0.00 0.08 0.78 0.00 0.00 0.00 179.25 180.11 1k2y h GLY 185 N 0.33 0.00 2.00 0.00 0.00 -1.69 0.41 103.07 104.13 1k2y h GLY 185 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1k2y h GLY 185 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 176.54 176.15 1k2y h VAL 186 N 0.00 0.00 0.00 4.60 -1.51 -1.60 -3.42 116.25 114.32 1k2y h VAL 186 Ca 0.01 -0.49 0.00 0.00 -1.23 0.00 0.00 66.70 64.99 1k2y h VAL 186 Cb 0.18 1.42 0.00 0.00 -2.13 0.00 0.00 31.29 30.76 1k2y h VAL 186 CO -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.34 1k2y n ILE 187 N -2.83 0.00 0.03 7.19 3.06 -0.71 -4.91 119.36 121.19 1k2y n ILE 187 Ca 0.02 0.00 -0.11 0.00 -2.50 0.00 0.00 62.75 60.16 1k2y n ILE 187 Cb 0.32 0.00 -0.04 0.00 0.54 0.00 0.00 39.64 40.46 1k2y n ILE 187 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1k2y h ALA 188 N 0.00 -0.29 -0.85 1.51 0.00 -1.20 0.17 119.26 118.59 1k2y h ALA 188 Ca 0.00 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1k2y h ALA 188 Cb 0.00 0.47 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1k2y h ALA 188 CO 0.00 -0.74 0.55 -1.35 0.00 0.00 0.00 179.25 177.72 1k2y h PRO 189 N -0.36 1.13 -0.08 0.00 0.11 -1.84 0.09 132.00 131.05 1k2y h PRO 189 Ca 0.08 -0.08 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 1k2y h PRO 189 Cb 0.47 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 31.33 1k2y h PRO 189 CO -0.27 0.76 -0.04 1.96 -0.21 0.00 0.00 178.00 180.21 1k2y h GLN 190 N 1.16 0.16 -0.22 1.05 7.50 -1.74 -1.19 115.11 121.83 1k2y h GLN 190 Ca 0.31 -0.07 0.00 0.00 0.50 0.00 0.00 58.65 59.39 1k2y h GLN 190 Cb -0.11 -0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.40 1k2y h GLN 190 CO -0.07 0.53 0.14 1.25 -1.50 0.00 0.00 178.83 179.18 1k2y h LEU 191 N -0.21 0.26 -0.96 1.46 5.85 -0.64 -0.12 115.31 120.95 1k2y h LEU 191 Ca 0.02 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1k2y h LEU 191 Cb 0.48 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 1k2y h LEU 191 CO 0.01 0.21 0.60 0.40 -0.34 0.00 0.00 178.44 179.32 1k2y h ILE 192 N 0.29 1.26 -0.57 4.05 2.04 -0.91 -0.63 117.51 123.04 1k2y h ILE 192 Ca 0.08 -0.54 -0.00 0.00 1.00 0.00 0.00 64.86 65.40 1k2y h ILE 192 Cb -0.01 -0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 35.93 1k2y h ILE 192 CO -0.02 0.27 0.34 -0.08 0.00 0.00 0.00 178.15 178.66 1k2y h GLU 193 N 1.32 0.77 0.00 2.37 4.81 -1.03 -2.88 114.58 119.95 1k2y h GLU 193 Ca 0.35 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.49 1k2y h GLU 193 Cb -0.08 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.13 1k2y h GLU 193 CO -0.07 0.56 -0.09 0.00 -0.73 0.00 0.00 179.01 178.68 1k2y h ALA 194 N 1.17 1.69 0.00 2.92 0.00 0.28 -0.58 119.26 124.74 1k2y h ALA 194 Ca 0.20 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1k2y h ALA 194 Cb -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1k2y h ALA 194 CO -0.04 0.11 0.00 -0.07 0.00 0.00 0.00 179.25 179.25 1k2y h LEU 195 N 0.00 0.00 0.00 0.00 3.38 -0.96 -3.46 115.31 114.27 1k2y h LEU 195 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1k2y h LEU 195 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1k2y h LEU 195 CO 0.01 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.15 1k2y n GLY 196 N 0.19 0.30 3.90 0.83 0.00 -0.23 -4.64 105.19 105.54 1k2y n GLY 196 Ca 0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 1k2y n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k2y s SER 198 N -4.13 6.36 -0.07 0.00 0.15 0.33 -4.35 113.70 111.98 1k2y s SER 198 Ca 0.49 0.41 0.01 0.00 0.70 0.00 0.00 55.95 57.57 1k2y s SER 198 Cb -0.10 -2.17 -0.03 0.00 -1.71 0.00 0.00 66.02 62.01 1k2y s SER 198 CO 0.47 0.06 -0.09 -0.69 1.20 0.00 0.00 173.24 174.18 1k2y s VAL 199 N 0.78 3.47 -0.36 4.45 1.01 -1.26 -0.52 120.40 127.96 1k2y s VAL 199 Ca 0.15 -0.56 -0.03 0.00 0.00 0.00 0.00 61.98 61.54 1k2y s VAL 199 Cb -0.13 -2.41 0.08 0.00 0.00 0.00 0.00 36.38 33.92 1k2y s VAL 199 CO 0.04 0.59 0.12 -0.63 0.00 0.00 0.00 175.10 175.22 1k2y s ILE 200 N -0.65 3.23 0.16 2.22 1.01 -0.21 -4.95 121.20 122.01 1k2y s ILE 200 Ca 0.10 -1.71 -0.30 0.00 0.00 0.00 0.00 60.65 58.74 1k2y s ILE 200 Cb -0.11 -3.05 -0.07 0.00 0.01 0.00 0.00 42.46 39.24 1k2y s ILE 200 CO 0.01 -0.42 0.98 -2.16 0.00 0.00 0.00 174.94 173.35 1k2y s PRO 201 N 1.21 4.72 -0.11 2.79 0.04 -1.26 -1.23 135.00 141.17 1k2y s PRO 201 Ca 0.02 1.50 0.01 0.00 0.04 0.00 0.00 61.00 62.58 1k2y s PRO 201 Cb -0.21 -3.34 0.02 0.00 0.04 0.00 0.00 34.50 31.01 1k2y s PRO 201 CO -0.02 0.27 -0.12 -0.51 0.04 0.00 0.00 177.00 176.66 1k2y s LEU 202 N -0.38 1.54 -1.46 -3.56 1.43 0.18 -4.82 118.68 111.60 1k2y s LEU 202 Ca 0.46 -0.37 -0.08 0.00 -1.03 0.00 0.00 54.13 53.10 1k2y s LEU 202 Cb -0.25 -0.97 0.05 0.00 0.03 0.00 0.00 46.19 45.06 1k2y s LEU 202 CO 0.31 -0.03 0.82 -1.22 0.23 0.00 0.00 176.35 176.46 1k2y n TYR 203 N 4.42 -2.07 0.97 0.29 0.53 -1.26 -2.02 117.16 118.01 1k2y n TYR 203 Ca -0.18 0.86 0.13 0.00 -1.02 0.00 0.00 57.90 57.69 1k2y n TYR 203 Cb 0.51 -4.01 0.36 0.00 -1.03 0.00 0.00 39.34 35.16 1k2y n TYR 203 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1k2y s GLU 205 N -3.01 4.32 -0.14 0.00 1.03 -1.26 -4.39 118.70 115.24 1k2y s GLU 205 Ca 0.12 1.88 -0.29 0.00 0.03 0.00 0.00 54.97 56.70 1k2y s GLU 205 Cb 0.18 -3.50 -0.04 0.00 -0.80 0.00 0.00 34.13 29.97 1k2y s GLU 205 CO 0.65 -0.49 1.57 0.08 -1.33 0.00 0.00 175.26 175.74 1k2y s VAL 206 N 2.03 3.75 -0.27 1.83 1.01 -1.26 -4.21 120.40 123.29 1k2y s VAL 206 Ca 0.61 0.89 -0.01 0.00 0.00 0.00 0.00 61.98 63.48 1k2y s VAL 206 Cb -0.30 -3.66 0.14 0.00 0.00 0.00 0.00 36.38 32.56 1k2y s VAL 206 CO 0.26 -0.17 0.36 -0.62 0.00 0.00 0.00 175.10 174.93 1k2y s ASP 207 N 3.47 0.72 0.00 3.32 -1.08 -0.37 -5.02 116.67 117.71 1k2y s ASP 207 Ca 0.69 -0.26 0.03 0.00 -0.52 0.00 0.00 52.55 52.49 1k2y s ASP 207 Cb -0.28 0.91 0.13 0.00 -1.46 0.00 0.00 42.92 42.23 1k2y s ASP 207 CO 0.27 -0.34 1.01 0.61 0.52 0.00 0.00 175.17 177.23 1k2y n GLY 208 N 5.34 -0.50 0.04 2.66 0.00 -1.22 -1.12 105.19 110.39 1k2y n GLY 208 Ca -0.02 -0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.12 1k2y n GLY 208 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1k2y n ASN 209 N -1.40 0.26 -3.97 1.61 3.02 -1.26 -4.55 115.26 108.97 1k2y n ASN 209 Ca 0.01 0.53 -0.38 0.00 -0.03 0.00 0.00 54.58 54.71 1k2y n ASN 209 Cb 0.03 -0.60 0.01 0.00 -0.61 0.00 0.00 39.78 38.61 1k2y n ASN 209 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1k2y n PHE 210 N -1.75 -1.36 0.78 3.10 3.72 -0.28 -4.83 117.46 116.83 1k2y n PHE 210 Ca 0.06 0.21 0.11 0.00 -0.05 0.00 0.00 57.45 57.78 1k2y n PHE 210 Cb 0.34 -2.47 0.49 0.00 -0.94 0.00 0.00 39.48 36.90 1k2y n PHE 210 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1k2y n PRO 211 N -4.15 0.00 0.00 -1.08 -0.04 -1.26 -4.62 135.00 123.85 1k2y n PRO 211 Ca -0.15 0.11 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 1k2y n PRO 211 Cb 0.53 -1.51 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 1k2y n PRO 211 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1k2y n ASN 212 N -1.51 0.01 -4.76 3.54 4.13 -1.26 -5.06 115.26 110.33 1k2y n ASN 212 Ca 0.06 0.00 -0.36 0.00 1.68 0.00 0.00 54.58 55.96 1k2y n ASN 212 Cb 0.27 0.00 0.02 0.00 -1.54 0.00 0.00 39.78 38.53 1k2y n ASN 212 CO 0.00 0.00 0.00 -1.38 0.28 0.00 0.00 177.26 176.16 1k2y s HIS 213 N 2.63 2.56 0.62 3.10 -3.43 -1.26 -4.97 115.29 114.54 1k2y s HIS 213 Ca 0.00 1.52 -0.18 0.00 -0.80 0.00 0.00 55.06 55.60 1k2y s HIS 213 Cb 0.00 -3.42 -0.02 0.00 -1.43 0.00 0.00 32.58 27.71 1k2y s HIS 213 CO 0.00 -1.91 1.20 -1.01 -2.00 0.00 0.00 174.74 171.02 1k2y s HIS 214 N -1.63 2.35 -1.41 0.38 3.76 -1.26 -4.78 115.29 112.70 1k2y s HIS 214 Ca 0.73 1.53 -0.15 0.00 -0.15 0.00 0.00 55.06 57.02 1k2y s HIS 214 Cb -0.28 -3.47 0.05 0.00 1.11 0.00 0.00 32.58 29.99 1k2y s HIS 214 CO 0.32 -2.25 2.09 -0.35 -0.85 0.00 0.00 174.74 173.69 1k2y n PRO 215 N -1.80 2.94 -3.47 8.40 -0.04 -1.25 -4.79 135.00 134.99 1k2y n PRO 215 Ca 0.13 -2.79 -0.29 0.00 -0.04 0.00 0.00 63.50 60.51 1k2y n PRO 215 Cb 0.50 -3.35 -0.12 0.00 -0.04 0.00 0.00 33.50 30.49 1k2y n PRO 215 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1k2y s ASP 216 N 3.51 2.89 0.00 3.54 2.15 -1.26 -1.27 116.67 126.23 1k2y s ASP 216 Ca 0.49 -2.28 0.12 0.00 0.43 0.00 0.00 52.55 51.31 1k2y s ASP 216 Cb 0.11 -0.44 0.70 0.00 -0.30 0.00 0.00 42.92 42.99 1k2y s ASP 216 CO -0.04 -0.30 1.12 -0.81 -0.17 0.00 0.00 175.17 174.97 1k2y n PRO 217 N 3.92 0.42 0.12 4.34 -0.04 -1.26 -2.45 135.00 140.06 1k2y n PRO 217 Ca 0.13 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.72 1k2y n PRO 217 Cb 0.38 -1.43 0.42 0.00 -0.04 0.00 0.00 33.50 32.82 1k2y n PRO 217 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1k2y h GLY 218 N 2.17 0.00 -7.48 0.55 0.00 -1.93 -3.41 103.07 92.97 1k2y h GLY 218 Ca 0.00 0.00 -0.68 0.00 0.00 0.00 0.00 47.33 46.65 1k2y h GLY 218 CO 0.00 0.00 -0.62 -1.59 0.00 0.00 0.00 176.54 174.33 1k2y s LYS 219 N -3.17 2.93 0.33 4.80 -2.85 -1.03 -5.01 119.74 115.74 1k2y s LYS 219 Ca 0.09 -0.97 0.12 0.00 -1.00 0.00 0.00 55.97 54.21 1k2y s LYS 219 Cb 0.11 -3.39 0.98 0.00 -2.06 0.00 0.00 37.83 33.47 1k2y s LYS 219 CO 0.55 -0.52 1.69 -1.00 0.10 0.00 0.00 175.35 176.18 1k2y h PRO 220 N 8.22 0.41 -0.48 1.78 0.13 -1.87 0.25 132.00 140.45 1k2y h PRO 220 Ca -0.29 -0.02 0.14 0.00 -0.87 0.00 0.00 66.00 64.96 1k2y h PRO 220 Cb 1.11 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 32.13 1k2y h PRO 220 CO 0.60 0.27 0.42 0.93 -0.23 0.00 0.00 178.00 180.00 1k2y h GLU 221 N 0.42 0.00 -0.05 0.86 3.07 -1.95 1.48 114.58 118.41 1k2y h GLU 221 Ca 0.69 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.55 1k2y h GLU 221 Cb 1.46 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.37 1k2y h GLU 221 CO -0.56 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.14 1k2y n ASN 222 N -3.99 0.53 -0.47 1.42 3.02 0.89 -3.02 115.26 113.64 1k2y n ASN 222 Ca 0.09 -1.50 0.06 0.00 -0.03 0.00 0.00 54.58 53.20 1k2y n ASN 222 Cb 0.62 -0.03 0.05 0.00 -0.61 0.00 0.00 39.78 39.81 1k2y n ASN 222 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1k2y n LEU 223 N -0.44 1.95 -0.09 3.41 4.77 0.50 -4.73 117.00 122.37 1k2y n LEU 223 Ca 0.15 -0.97 -0.09 0.00 -0.03 0.00 0.00 56.01 55.07 1k2y n LEU 223 Cb 0.15 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.23 1k2y n LEU 223 CO 0.11 0.37 1.00 0.11 -1.33 0.00 0.00 177.39 177.65 1k2y h LYS 224 N 2.31 0.43 -0.58 3.23 1.79 -1.47 -0.18 116.57 122.10 1k2y h LYS 224 Ca 0.00 -0.03 -0.04 0.00 -2.18 0.00 0.00 60.65 58.40 1k2y h LYS 224 Cb 0.51 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 31.04 1k2y h LYS 224 CO 0.00 0.30 0.20 -0.44 -1.08 0.00 0.00 179.45 178.43 1k2y h ASP 225 N 0.43 0.82 -0.21 0.86 3.32 -1.85 -1.40 116.42 118.39 1k2y h ASP 225 Ca 0.12 -0.19 0.03 0.00 0.02 0.00 0.00 57.03 57.00 1k2y h ASP 225 Cb -0.03 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.28 1k2y h ASP 225 CO -0.02 0.79 0.05 0.25 -1.72 0.00 0.00 179.24 178.58 1k2y h LEU 226 N 0.81 0.02 -0.48 1.55 5.85 -1.77 -0.69 115.31 120.60 1k2y h LEU 226 Ca 0.19 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.95 1k2y h LEU 226 Cb 0.25 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1k2y h LEU 226 CO -0.01 0.04 0.31 0.40 -0.34 0.00 0.00 178.44 178.85 1k2y h ILE 227 N 0.13 1.11 -0.65 4.05 2.04 -0.76 0.11 117.51 123.55 1k2y h ILE 227 Ca 0.10 -0.22 -0.03 0.00 1.00 0.00 0.00 64.86 65.71 1k2y h ILE 227 Cb 0.09 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.56 1k2y h ILE 227 CO -0.12 0.12 0.30 0.00 0.00 0.00 0.00 178.15 178.45 1k2y h ALA 228 N 1.18 0.84 -0.44 1.87 0.00 -1.10 -2.11 119.26 119.50 1k2y h ALA 228 Ca 0.18 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 1k2y h ALA 228 Cb -0.06 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1k2y h ALA 228 CO -0.04 0.41 -0.29 -0.22 0.00 0.00 0.00 179.25 179.10 1k2y h LYS 229 N 0.90 0.97 -0.59 0.00 1.63 -0.67 0.93 116.57 119.75 1k2y h LYS 229 Ca 0.22 -0.46 0.02 0.00 -0.85 0.00 0.00 60.65 59.58 1k2y h LYS 229 Cb 0.13 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.72 1k2y h LYS 229 CO -0.03 1.12 0.37 0.28 -3.45 0.00 0.00 179.45 177.75 1k2y h VAL 230 N 0.82 1.10 -0.33 2.00 2.07 -0.75 -1.40 116.25 119.77 1k2y h VAL 230 Ca 0.09 -0.25 -0.07 0.00 0.82 0.00 0.00 66.70 67.28 1k2y h VAL 230 Cb 0.88 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 1k2y h VAL 230 CO 0.08 0.14 -0.08 0.11 0.02 0.00 0.00 177.57 177.84 1k2y h LYS 231 N 0.74 0.64 -0.30 1.57 1.57 -1.07 -1.60 116.57 118.12 1k2y h LYS 231 Ca 0.23 -0.24 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 1k2y h LYS 231 Cb -0.02 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 1k2y h LYS 231 CO -0.08 0.81 -0.10 0.00 -0.57 0.00 0.00 179.45 179.51 1k2y h ALA 232 N 0.81 1.27 -0.29 3.86 0.00 -0.60 -3.00 119.26 121.32 1k2y h ALA 232 Ca 0.09 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1k2y h ALA 232 Cb 0.57 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1k2y h ALA 232 CO 0.03 0.48 0.00 0.39 0.00 0.00 0.00 179.25 180.15 1k2y n GLU 233 N -4.22 2.46 -3.86 0.00 -0.58 -0.54 -4.96 120.64 108.93 1k2y n GLU 233 Ca 0.01 -2.18 -0.26 0.00 -0.42 0.00 0.00 57.16 54.31 1k2y n GLU 233 Cb 0.31 -1.50 0.02 0.00 -0.57 0.00 0.00 31.44 29.69 1k2y n GLU 233 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1k2y n ASN 234 N 1.45 -2.36 -4.86 1.62 3.02 -0.68 -4.95 115.26 108.49 1k2y n ASN 234 Ca 0.18 -0.86 -0.31 0.00 -0.03 0.00 0.00 54.58 53.56 1k2y n ASN 234 Cb 0.60 -3.71 -0.01 0.00 -0.61 0.00 0.00 39.78 36.05 1k2y n ASN 234 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1k2y s ALA 235 N -3.58 3.11 -0.09 5.41 0.00 -0.72 -4.99 121.76 120.90 1k2y s ALA 235 Ca 0.28 0.00 0.16 0.00 0.00 0.00 0.00 51.96 52.40 1k2y s ALA 235 Cb -0.14 -3.06 0.21 0.00 0.00 0.00 0.00 23.12 20.13 1k2y s ALA 235 CO 0.84 -0.45 1.51 -0.44 0.00 0.00 0.00 175.76 177.22 1k2y h ASP 236 N 0.30 0.00 -4.69 0.00 3.45 -1.03 -3.41 116.42 111.04 1k2y h ASP 236 Ca -0.45 0.00 0.04 0.00 0.43 0.00 0.00 57.03 57.04 1k2y h ASP 236 Cb 1.19 0.00 -0.17 0.00 -0.56 0.00 0.00 39.33 39.79 1k2y h ASP 236 CO 0.62 0.46 0.38 -0.22 -1.57 0.00 0.00 179.24 178.91 1k2y s LEU 237 N -6.56 -0.47 -0.02 1.55 2.96 -1.19 -3.41 118.68 111.53 1k2y s LEU 237 Ca 0.03 0.24 0.06 0.00 -0.22 0.00 0.00 54.13 54.23 1k2y s LEU 237 Cb 0.08 2.23 -0.01 0.00 0.50 0.00 0.00 46.19 48.99 1k2y s LEU 237 CO 0.73 -0.64 -0.19 -0.83 -1.32 0.00 0.00 176.35 174.10 1k2y s GLY 238 N -1.98 0.93 -0.02 7.98 0.00 -0.22 -1.60 107.32 112.41 1k2y s GLY 238 Ca -0.01 -0.80 0.04 0.00 0.00 0.00 0.00 44.72 43.96 1k2y s GLY 238 CO -0.04 -0.62 -0.15 1.08 0.00 0.00 0.00 173.10 173.37 1k2y s LEU 239 N -0.36 2.00 -0.18 0.66 1.43 0.48 -1.51 118.68 121.19 1k2y s LEU 239 Ca 0.05 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 52.88 1k2y s LEU 239 Cb -0.08 -0.79 0.04 0.00 0.03 0.00 0.00 46.19 45.39 1k2y s LEU 239 CO -0.00 0.17 -0.08 0.00 0.23 0.00 0.00 176.35 176.67 1k2y s ALA 240 N -0.26 1.74 0.26 4.21 0.00 -0.34 -0.45 121.76 126.92 1k2y s ALA 240 Ca 0.04 -1.02 -0.15 0.00 0.00 0.00 0.00 51.96 50.84 1k2y s ALA 240 Cb -0.07 -1.20 -0.08 0.00 0.00 0.00 0.00 23.12 21.77 1k2y s ALA 240 CO -0.00 -0.80 0.67 -0.06 0.00 0.00 0.00 175.76 175.57 1k2y s PHE 241 N 1.52 3.47 0.98 0.00 0.08 0.09 -0.07 117.98 124.04 1k2y s PHE 241 Ca -0.00 1.16 -0.15 0.00 0.12 0.00 0.00 56.93 58.06 1k2y s PHE 241 Cb -0.16 -2.48 0.18 0.00 -0.57 0.00 0.00 43.02 40.00 1k2y s PHE 241 CO -0.08 0.22 1.20 0.16 -0.10 0.00 0.00 175.22 176.62 1k2y s ASP 242 N -2.09 2.94 0.38 1.36 -4.77 -0.76 -4.50 116.67 109.23 1k2y s ASP 242 Ca 0.48 0.64 0.04 0.00 -3.30 0.00 0.00 52.55 50.42 1k2y s ASP 242 Cb -0.12 -0.96 0.73 0.00 -1.09 0.00 0.00 42.92 41.48 1k2y s ASP 242 CO 0.19 -2.87 2.03 1.23 0.70 0.00 0.00 175.17 176.45 1k2y h GLY 243 N -1.73 0.76 -0.92 2.12 0.00 -1.26 -2.44 103.07 99.60 1k2y h GLY 243 Ca -0.47 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 46.58 1k2y h GLY 243 CO 0.49 0.28 -0.40 2.09 0.00 0.00 0.00 176.54 178.99 1k2y n ASP 244 N -4.45 1.90 0.00 0.19 3.85 -1.24 -1.63 116.55 115.17 1k2y n ASP 244 Ca 0.05 -1.45 0.00 0.00 -0.71 0.00 0.00 54.79 52.68 1k2y n ASP 244 Cb 0.05 0.46 0.00 0.00 -1.35 0.00 0.00 41.12 40.28 1k2y n ASP 244 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1k2y n GLY 245 N 1.30 0.64 0.61 6.12 0.00 -0.92 -0.57 105.19 112.38 1k2y n GLY 245 Ca 0.08 -0.12 0.12 0.00 0.00 0.00 0.00 46.02 46.10 1k2y n GLY 245 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1k2y n ASP 246 N 0.22 1.85 -3.97 1.61 5.68 -1.26 -0.74 116.55 119.94 1k2y n ASP 246 Ca 0.00 -1.68 -0.09 0.00 -0.50 0.00 0.00 54.79 52.52 1k2y n ASP 246 Cb 0.00 -0.07 -0.11 0.00 -1.14 0.00 0.00 41.12 39.79 1k2y n ASP 246 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1k2y s ARG 247 N -1.85 0.29 -0.01 0.11 0.52 -1.26 -3.75 118.95 113.00 1k2y s ARG 247 Ca 0.35 -0.56 -0.00 0.00 -0.52 0.00 0.00 55.73 54.99 1k2y s ARG 247 Cb 0.19 0.10 0.01 0.00 0.52 0.00 0.00 34.95 35.78 1k2y s ARG 247 CO 0.29 -0.05 0.02 0.54 0.02 0.00 0.00 175.30 176.13 1k2y s VAL 248 N -1.35 -0.03 0.25 3.52 0.11 -1.26 -1.83 120.40 119.80 1k2y s VAL 248 Ca -0.15 0.10 -0.13 0.00 -2.93 0.00 0.00 61.98 58.87 1k2y s VAL 248 Cb -0.09 -0.05 -0.08 0.00 -1.53 0.00 0.00 36.38 34.63 1k2y s VAL 248 CO -0.01 0.04 0.63 -0.83 -3.33 0.00 0.00 175.10 171.60 1k2y s GLY 249 N 0.49 2.37 -0.06 6.54 0.00 0.90 -4.90 107.32 112.67 1k2y s GLY 249 Ca -0.04 -0.09 0.03 0.00 0.00 0.00 0.00 44.72 44.61 1k2y s GLY 249 CO -0.01 0.12 -0.14 0.14 0.00 0.00 0.00 173.10 173.20 1k2y s VAL 250 N -1.78 1.22 -0.05 1.40 1.01 -1.26 -1.20 120.40 119.74 1k2y s VAL 250 Ca 0.47 -0.55 0.03 0.00 0.00 0.00 0.00 61.98 61.93 1k2y s VAL 250 Cb -0.12 -1.08 0.00 0.00 0.00 0.00 0.00 36.38 35.18 1k2y s VAL 250 CO 0.19 0.37 -0.14 -0.69 0.00 0.00 0.00 175.10 174.84 1k2y s VAL 251 N 0.43 1.18 0.97 2.92 1.01 -0.57 -0.87 120.40 125.47 1k2y s VAL 251 Ca -0.11 -0.56 -0.16 0.00 0.00 0.00 0.00 61.98 61.16 1k2y s VAL 251 Cb -0.14 -1.04 0.21 0.00 0.00 0.00 0.00 36.38 35.41 1k2y s VAL 251 CO 0.03 0.35 1.33 0.42 0.00 0.00 0.00 175.10 177.24 1k2y s THR 252 N 0.28 2.00 -0.01 3.92 -4.23 -0.06 -1.05 115.64 116.49 1k2y s THR 252 Ca -0.07 -0.01 0.30 0.00 -1.18 0.00 0.00 61.69 60.73 1k2y s THR 252 Cb -0.12 -2.99 0.32 0.00 1.34 0.00 0.00 72.50 71.05 1k2y s THR 252 CO 0.02 0.00 1.92 -0.55 -0.54 0.00 0.00 174.62 175.47 1k2y h ASN 253 N -1.67 0.00 -0.30 3.99 -1.07 -1.78 -0.55 115.58 114.20 1k2y h ASN 253 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.93 1k2y h ASN 253 Cb 1.23 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.48 1k2y h ASN 253 CO 0.36 0.00 0.00 0.35 0.07 0.00 0.00 177.43 178.21 1k2y n THR 254 N -2.65 0.44 -0.13 6.14 -2.24 -1.26 -4.65 114.28 109.93 1k2y n THR 254 Ca -0.00 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 61.06 1k2y n THR 254 Cb 0.17 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 1k2y n THR 254 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k2y n GLY 255 N 1.26 0.56 3.73 3.38 0.00 -0.21 -5.02 105.19 108.89 1k2y n GLY 255 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1k2y n GLY 255 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1k2y s THR 256 N -2.28 3.03 -0.09 2.61 2.01 -1.26 -4.62 115.64 115.03 1k2y s THR 256 Ca 0.00 0.80 -0.28 0.00 0.31 0.00 0.00 61.69 62.52 1k2y s THR 256 Cb 0.00 -3.51 -0.02 0.00 0.01 0.00 0.00 72.50 68.98 1k2y s THR 256 CO 0.00 0.10 0.93 -0.63 -0.69 0.00 0.00 174.62 174.33 1k2y s ILE 257 N 0.47 4.85 -0.34 1.82 1.01 -1.26 -0.88 121.20 126.87 1k2y s ILE 257 Ca 0.61 1.90 -0.10 0.00 0.00 0.00 0.00 60.65 63.06 1k2y s ILE 257 Cb -0.39 -4.25 0.01 0.00 0.01 0.00 0.00 42.46 37.84 1k2y s ILE 257 CO 0.36 0.06 0.18 -0.63 0.00 0.00 0.00 174.94 174.92 1k2y s ILE 258 N 1.72 4.63 0.67 2.92 -1.09 -0.05 -4.99 121.20 125.01 1k2y s ILE 258 Ca 0.46 -0.57 -0.11 0.00 -2.23 0.00 0.00 60.65 58.20 1k2y s ILE 258 Cb -0.18 -3.44 -0.01 0.00 -1.58 0.00 0.00 42.46 37.25 1k2y s ILE 258 CO 0.19 -0.05 1.07 -0.31 -1.23 0.00 0.00 174.94 174.61 1k2y s TYR 259 N 1.60 3.42 0.48 3.97 1.51 -1.26 -4.31 117.35 122.75 1k2y s TYR 259 Ca 0.04 1.17 0.15 0.00 -1.01 0.00 0.00 57.07 57.42 1k2y s TYR 259 Cb -0.18 -2.92 1.14 0.00 -0.11 0.00 0.00 41.96 39.89 1k2y s TYR 259 CO 0.07 -1.01 2.06 -1.35 -1.11 0.00 0.00 175.55 174.21 1k2y h PRO 260 N -0.54 0.22 -0.07 -1.71 0.11 -1.86 -1.79 132.00 126.37 1k2y h PRO 260 Ca -0.45 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.55 1k2y h PRO 260 Cb 1.23 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1k2y h PRO 260 CO 0.62 0.15 -0.41 0.38 -0.21 0.00 0.00 178.00 178.53 1k2y h ASP 261 N 0.23 0.15 0.32 -2.05 -0.00 -1.93 -0.19 116.42 112.94 1k2y h ASP 261 Ca 0.15 -0.06 -0.28 0.00 -0.00 0.00 0.00 57.03 56.84 1k2y h ASP 261 Cb 0.30 -0.04 0.02 0.00 -0.00 0.00 0.00 39.33 39.61 1k2y h ASP 261 CO -0.03 0.54 -1.18 -0.09 -0.00 0.00 0.00 179.24 178.49 1k2y h ARG 262 N 0.12 0.48 -0.75 4.15 2.43 -1.74 -2.08 114.38 116.98 1k2y h ARG 262 Ca 0.01 -0.65 0.03 0.00 -0.81 0.00 0.00 59.98 58.56 1k2y h ARG 262 Cb 0.77 0.22 -0.05 0.00 -0.42 0.00 0.00 29.97 30.49 1k2y h ARG 262 CO 0.06 1.27 0.48 1.25 -1.51 0.00 0.00 179.97 181.52 1k2y h LEU 263 N 0.21 0.79 -1.67 3.80 6.46 -1.11 -2.19 115.31 121.60 1k2y h LEU 263 Ca -0.15 -0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.57 1k2y h LEU 263 Cb 1.86 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 41.61 1k2y h LEU 263 CO 0.21 0.55 -0.18 -0.07 -0.62 0.00 0.00 178.44 178.32 1k2y h LEU 264 N 0.93 0.00 -0.39 2.25 3.38 -0.84 -0.53 115.31 120.11 1k2y h LEU 264 Ca 0.30 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.28 1k2y h LEU 264 Cb 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1k2y h LEU 264 CO -0.11 0.18 0.25 0.24 0.09 0.00 0.00 178.44 179.09 1k2y h MET 265 N 0.00 0.49 -0.21 1.13 2.86 -0.72 0.24 114.93 118.71 1k2y h MET 265 Ca -0.00 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 1k2y h MET 265 Cb 0.35 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 1k2y h MET 265 CO 0.02 0.32 0.01 1.25 1.06 0.00 0.00 176.91 179.57 1k2y h LEU 266 N 0.50 0.36 -0.49 1.22 5.85 -1.28 -1.90 115.31 119.58 1k2y h LEU 266 Ca 0.15 -0.30 -0.08 0.00 0.84 0.00 0.00 57.88 58.49 1k2y h LEU 266 Cb -0.02 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 1k2y h LEU 266 CO -0.05 0.57 -0.02 -0.26 -0.34 0.00 0.00 178.44 178.34 1k2y h PHE 267 N 0.14 0.95 -0.37 1.25 0.05 -0.97 -2.67 116.94 115.32 1k2y h PHE 267 Ca 0.06 -0.17 -0.00 0.00 3.82 0.00 0.00 57.97 61.68 1k2y h PHE 267 Cb 0.38 -0.25 -0.02 0.00 2.00 0.00 0.00 35.95 38.06 1k2y h PHE 267 CO 0.03 0.91 0.23 0.00 -0.18 0.00 0.00 178.31 179.30 1k2y h ALA 268 N 0.92 0.47 -0.50 2.45 0.00 -0.51 0.27 119.26 122.35 1k2y h ALA 268 Ca 0.14 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.08 1k2y h ALA 268 Cb 0.54 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 1k2y h ALA 268 CO 0.03 -0.05 0.14 -0.22 0.00 0.00 0.00 179.25 179.15 1k2y h LYS 269 N 0.49 0.28 0.01 0.00 3.64 -1.24 0.26 116.57 120.02 1k2y h LYS 269 Ca 0.13 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1k2y h LYS 269 Cb -0.01 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1k2y h LYS 269 CO -0.03 0.19 -0.01 0.22 -2.27 0.00 0.00 179.45 177.56 1k2y h ASP 270 N 0.29 -0.01 -0.24 4.20 1.82 -1.12 -1.76 116.42 119.60 1k2y h ASP 270 Ca 0.25 -0.29 -0.00 0.00 -0.39 0.00 0.00 57.03 56.59 1k2y h ASP 270 Cb 0.30 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.31 1k2y h ASP 270 CO -0.29 0.28 0.13 0.58 -1.61 0.00 0.00 179.24 178.34 1k2y h VAL 271 N -0.31 1.12 -0.11 2.25 2.07 -0.80 -2.74 116.25 117.72 1k2y h VAL 271 Ca -0.00 -0.31 -0.06 0.00 0.82 0.00 0.00 66.70 67.14 1k2y h VAL 271 Cb 0.30 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1k2y h VAL 271 CO 0.00 0.12 -0.23 0.58 0.02 0.00 0.00 177.57 178.06 1k2y h VAL 272 N 0.28 1.21 -0.56 2.57 2.07 -0.95 -2.58 116.25 118.29 1k2y h VAL 272 Ca 0.08 -0.99 0.15 0.00 0.82 0.00 0.00 66.70 66.76 1k2y h VAL 272 Cb 0.07 1.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 1k2y h VAL 272 CO -0.01 0.30 0.40 0.77 0.02 0.00 0.00 177.57 179.04 1k2y h SER 273 N 0.17 0.06 -0.09 0.57 4.64 -0.99 -0.64 113.55 117.27 1k2y h SER 273 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1k2y h SER 273 Cb 0.50 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1k2y h SER 273 CO 0.03 0.03 0.00 0.54 -0.87 0.00 0.00 176.83 176.57 1k2y n ARG 274 N -4.39 1.32 -3.14 4.77 1.74 -1.05 -4.78 116.66 111.12 1k2y n ARG 274 Ca 0.10 -1.51 -0.19 0.00 -0.77 0.00 0.00 57.85 55.48 1k2y n ARG 274 Cb 0.59 -1.29 -0.05 0.00 -1.02 0.00 0.00 32.46 30.69 1k2y n ARG 274 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1k2y n ASN 275 N 0.81 -1.23 -4.63 0.55 3.02 -0.25 -5.12 115.26 108.41 1k2y n ASN 275 Ca 0.10 -2.67 -0.46 0.00 -0.03 0.00 0.00 54.58 51.51 1k2y n ASN 275 Cb 0.38 0.18 -0.03 0.00 -0.61 0.00 0.00 39.78 39.70 1k2y n ASN 275 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1k2y n PRO 276 N 2.37 1.66 -0.94 3.52 -0.01 -1.21 -1.61 135.00 138.78 1k2y n PRO 276 Ca 0.23 0.59 0.00 0.00 -0.01 0.00 0.00 63.50 64.31 1k2y n PRO 276 Cb 0.53 -2.16 0.00 0.00 -0.01 0.00 0.00 33.50 31.86 1k2y n PRO 276 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1k2y n GLY 277 N 1.93 0.72 3.65 -1.23 0.00 0.41 -4.99 105.19 105.66 1k2y n GLY 277 Ca 0.12 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.68 1k2y n GLY 277 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k2y n ALA 278 N 1.00 0.63 -2.00 4.61 0.00 -0.63 -4.06 120.51 120.05 1k2y n ALA 278 Ca 0.00 0.44 -0.41 0.00 0.00 0.00 0.00 53.44 53.47 1k2y n ALA 278 Cb 0.02 -2.23 -0.04 0.00 0.00 0.00 0.00 19.45 17.20 1k2y n ALA 278 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1k2y s ASP 279 N 0.44 7.19 -0.11 0.00 1.11 -1.26 -0.83 116.67 123.21 1k2y s ASP 279 Ca 0.74 2.18 -0.01 0.00 0.18 0.00 0.00 52.55 55.64 1k2y s ASP 279 Cb -0.73 -2.61 0.03 0.00 1.07 0.00 0.00 42.92 40.68 1k2y s ASP 279 CO 0.46 -0.27 -0.04 -0.63 1.18 0.00 0.00 175.17 175.87 1k2y s ILE 280 N -0.34 0.81 -0.07 0.77 -1.09 -0.44 -1.68 121.20 119.16 1k2y s ILE 280 Ca 0.50 -0.23 -0.02 0.00 -2.23 0.00 0.00 60.65 58.66 1k2y s ILE 280 Cb -0.31 -0.93 -0.04 0.00 -1.58 0.00 0.00 42.46 39.61 1k2y s ILE 280 CO 0.37 0.26 0.05 -0.63 -1.23 0.00 0.00 174.94 173.76 1k2y s ILE 281 N 1.79 4.64 0.28 2.92 -1.09 -0.62 -0.86 121.20 128.26 1k2y s ILE 281 Ca 0.04 -0.22 -0.04 0.00 -2.23 0.00 0.00 60.65 58.20 1k2y s ILE 281 Cb -0.13 -3.02 0.02 0.00 -1.58 0.00 0.00 42.46 37.75 1k2y s ILE 281 CO -0.07 0.53 0.44 2.22 -1.23 0.00 0.00 174.94 176.83 1k2y n PHE 282 N 1.81 -1.45 -4.14 3.97 1.16 -0.50 -1.33 117.46 116.99 1k2y n PHE 282 Ca -0.17 -1.70 -0.25 0.00 -1.87 0.00 0.00 57.45 53.45 1k2y n PHE 282 Cb 0.54 0.51 -0.07 0.00 -1.61 0.00 0.00 39.48 38.84 1k2y n PHE 282 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 1k2y s ASP 283 N -2.65 4.43 0.00 5.98 3.84 -1.25 -0.55 116.67 126.47 1k2y s ASP 283 Ca 0.20 -1.13 0.17 0.00 -0.00 0.00 0.00 52.55 51.79 1k2y s ASP 283 Cb -0.02 -0.33 0.92 0.00 -1.38 0.00 0.00 42.92 42.12 1k2y s ASP 283 CO 0.14 -0.62 1.45 1.33 -0.00 0.00 0.00 175.17 177.47 1k2y n VAL 284 N -1.29 0.27 1.27 2.11 0.24 -0.54 -1.77 118.33 118.61 1k2y n VAL 284 Ca -0.02 0.07 0.13 0.00 -2.04 0.00 0.00 64.34 62.48 1k2y n VAL 284 Cb 0.65 -0.80 0.33 0.00 -1.47 0.00 0.00 33.84 32.55 1k2y n VAL 284 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1k2y n LYS 285 N -1.14 1.78 -3.14 7.34 5.02 -1.26 -4.92 118.16 121.84 1k2y n LYS 285 Ca 0.10 -1.25 -0.33 0.00 -2.02 0.00 0.00 58.31 54.81 1k2y n LYS 285 Cb 0.10 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.57 1k2y n LYS 285 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1k2y n THR 287 N -0.20 2.02 0.33 0.00 5.66 -1.26 -4.84 114.28 115.98 1k2y n THR 287 Ca 0.03 -0.50 0.21 0.00 -3.05 0.00 0.00 64.05 60.74 1k2y n THR 287 Cb 0.53 -1.30 1.12 0.00 -1.55 0.00 0.00 70.33 69.13 1k2y n THR 287 CO 0.00 0.00 0.00 0.08 -3.05 0.00 0.00 175.07 172.10 1k2y h ARG 288 N 2.25 0.00 0.00 1.09 0.11 -1.98 -1.54 114.38 114.31 1k2y h ARG 288 Ca -0.43 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.64 1k2y h ARG 288 Cb 1.31 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.39 1k2y h ARG 288 CO 0.61 0.00 -0.05 0.00 0.10 0.00 0.00 179.97 180.64 1k2y h ARG 289 N 0.00 0.00 -0.37 0.08 2.47 -1.95 -2.51 114.38 112.10 1k2y h ARG 289 Ca -0.00 0.00 -0.15 0.00 -1.26 0.00 0.00 59.98 58.57 1k2y h ARG 289 Cb 0.06 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.38 1k2y h ARG 289 CO 0.00 0.05 -0.34 1.25 0.56 0.00 0.00 179.97 181.49 1k2y h LEU 290 N 0.00 0.95 0.05 3.04 5.85 -1.63 -0.12 115.31 123.45 1k2y h LEU 290 Ca -0.00 -0.46 0.02 0.00 0.84 0.00 0.00 57.88 58.28 1k2y h LEU 290 Cb 0.12 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 1k2y h LEU 290 CO 0.01 1.21 -0.20 0.40 -0.34 0.00 0.00 178.44 179.52 1k2y h ILE 291 N 0.70 0.54 -0.45 4.05 2.04 -1.61 -1.47 117.51 121.32 1k2y h ILE 291 Ca 0.06 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.88 1k2y h ILE 291 Cb 0.93 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 1k2y h ILE 291 CO 0.09 0.00 0.12 0.00 0.00 0.00 0.00 178.15 178.35 1k2y h ALA 292 N 0.51 0.59 -0.52 1.87 0.00 -1.50 -2.07 119.26 118.14 1k2y h ALA 292 Ca 0.04 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1k2y h ALA 292 Cb 0.39 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1k2y h ALA 292 CO -0.15 0.26 0.27 1.25 0.00 0.00 0.00 179.25 180.88 1k2y h LEU 293 N 0.59 0.67 -0.28 0.00 7.12 -0.81 0.84 115.31 123.44 1k2y h LEU 293 Ca 0.14 -0.11 -0.02 0.00 0.13 0.00 0.00 57.88 58.02 1k2y h LEU 293 Cb 0.31 -0.17 -0.01 0.00 -0.53 0.00 0.00 40.66 40.25 1k2y h LEU 293 CO -0.00 0.59 0.11 0.40 -0.13 0.00 0.00 178.44 179.40 1k2y h ILE 294 N 0.70 1.18 -0.64 4.05 2.04 -1.16 -2.66 117.51 121.03 1k2y h ILE 294 Ca 0.18 -0.56 0.01 0.00 1.00 0.00 0.00 64.86 65.49 1k2y h ILE 294 Cb 0.08 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 1k2y h ILE 294 CO -0.03 0.19 0.42 -1.28 0.00 0.00 0.00 178.15 177.45 1k2y h SER 295 N 0.29 0.73 -0.66 1.72 0.87 -1.09 -0.74 113.55 114.68 1k2y h SER 295 Ca 0.09 -0.02 0.06 0.00 -1.23 0.00 0.00 61.79 60.69 1k2y h SER 295 Cb 0.19 -0.18 -0.04 0.00 -0.44 0.00 0.00 62.40 61.93 1k2y h SER 295 CO -0.01 0.54 0.44 1.23 -0.53 0.00 0.00 176.83 178.50 1k2y h GLY 296 N 0.86 0.85 0.42 5.77 0.00 -0.64 -0.82 103.07 109.51 1k2y h GLY 296 Ca 0.23 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.29 1k2y h GLY 296 CO -0.05 0.21 -0.02 -1.72 0.00 0.00 0.00 176.54 174.96 1k2y n TYR 297 N -4.47 0.00 -0.21 5.60 4.01 -1.02 -4.90 117.16 116.16 1k2y n TYR 297 Ca 0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.83 1k2y n TYR 297 Cb 0.22 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.21 1k2y n TYR 297 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1k2y n GLY 298 N 1.12 0.89 3.96 2.72 0.00 -0.31 -4.83 105.19 108.74 1k2y n GLY 298 Ca 0.20 -0.06 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 1k2y n GLY 298 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1k2y s GLY 299 N -2.05 1.75 -0.40 -0.02 0.00 -0.31 -0.45 107.32 105.85 1k2y s GLY 299 Ca 0.00 -1.38 0.02 0.00 0.00 0.00 0.00 44.72 43.36 1k2y s GLY 299 CO 0.00 -0.82 0.14 -1.60 0.00 0.00 0.00 173.10 170.82 1k2y s ARG 300 N -5.34 1.73 0.33 2.90 3.52 -0.01 -4.19 118.95 117.89 1k2y s ARG 300 Ca 0.66 -2.02 -0.27 0.00 -0.13 0.00 0.00 55.73 53.97 1k2y s ARG 300 Cb -0.06 -3.34 -0.09 0.00 -1.56 0.00 0.00 34.95 29.90 1k2y s ARG 300 CO 0.46 -1.01 1.11 -1.25 -0.81 0.00 0.00 175.30 173.81 1k2y s PRO 301 N 0.72 4.40 -0.20 5.12 0.04 -1.26 -1.33 135.00 142.49 1k2y s PRO 301 Ca 0.12 1.76 -0.01 0.00 0.04 0.00 0.00 61.00 62.91 1k2y s PRO 301 Cb -0.21 -2.93 0.06 0.00 0.04 0.00 0.00 34.50 31.45 1k2y s PRO 301 CO -0.06 0.01 -0.02 0.08 0.04 0.00 0.00 177.00 177.05 1k2y s VAL 302 N -1.33 1.07 -0.24 -0.36 1.01 -0.04 -4.91 120.40 115.61 1k2y s VAL 302 Ca 0.50 -0.85 -0.20 0.00 0.00 0.00 0.00 61.98 61.43 1k2y s VAL 302 Cb -0.30 -1.40 -0.02 0.00 0.00 0.00 0.00 36.38 34.66 1k2y s VAL 302 CO 0.38 -0.09 0.59 -0.32 0.00 0.00 0.00 175.10 175.66 1k2y s MET 303 N 1.62 4.12 0.25 2.72 1.75 -1.26 -1.41 119.30 127.09 1k2y s MET 303 Ca -0.03 0.50 0.03 0.00 -1.25 0.00 0.00 55.69 54.94 1k2y s MET 303 Cb -0.17 -3.63 -0.01 0.00 2.84 0.00 0.00 34.83 33.85 1k2y s MET 303 CO -0.07 -0.35 0.10 1.87 -0.65 0.00 0.00 175.02 175.92 1k2y n TRP 304 N 5.48 0.03 -1.86 4.11 -0.00 0.29 -4.90 117.44 120.60 1k2y n TRP 304 Ca -0.02 -1.65 -0.34 0.00 -0.00 0.00 0.00 57.50 55.49 1k2y n TRP 304 Cb 0.49 0.01 0.04 0.00 -0.00 0.00 0.00 31.31 31.86 1k2y n TRP 304 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 1k2y s LYS 305 N -2.96 2.83 0.73 5.87 1.02 -1.26 -1.47 119.74 124.51 1k2y s LYS 305 Ca 0.14 1.59 -0.12 0.00 0.02 0.00 0.00 55.97 57.60 1k2y s LYS 305 Cb 0.01 -1.94 0.03 0.00 -0.52 0.00 0.00 37.83 35.41 1k2y s LYS 305 CO 0.10 -1.26 1.09 0.95 -0.92 0.00 0.00 175.35 175.31 1k2y s THR 306 N -2.00 3.35 0.00 2.17 -4.23 -1.26 -4.50 115.64 109.16 1k2y s THR 306 Ca 0.72 0.50 0.00 0.00 -1.18 0.00 0.00 61.69 61.72 1k2y s THR 306 Cb -0.25 -3.01 0.00 0.00 1.34 0.00 0.00 72.50 70.59 1k2y s THR 306 CO 0.37 -0.51 0.00 0.61 -0.54 0.00 0.00 174.62 174.55 1k2y n GLY 307 N -1.03 2.26 0.34 3.99 0.00 -1.26 -4.68 105.19 104.81 1k2y n GLY 307 Ca 0.09 -1.16 0.10 0.00 0.00 0.00 0.00 46.02 45.05 1k2y n GLY 307 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1k2y h HIS 308 N 0.00 0.45 -0.45 1.61 2.07 -1.97 -1.07 115.15 115.78 1k2y h HIS 308 Ca 0.00 0.01 -0.03 0.00 -2.85 0.00 0.00 60.37 57.50 1k2y h HIS 308 Cb 0.00 -0.15 -0.02 0.00 2.57 0.00 0.00 27.41 29.81 1k2y h HIS 308 CO 0.00 0.24 0.15 0.77 -3.07 0.00 0.00 177.93 176.02 1k2y h SER 309 N 0.44 0.65 -0.29 3.10 0.02 -1.98 0.06 113.55 115.54 1k2y h SER 309 Ca 0.23 -0.20 -0.14 0.00 -0.84 0.00 0.00 61.79 60.85 1k2y h SER 309 Cb 0.35 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 1k2y h SER 309 CO -0.06 0.68 -0.33 -0.07 -1.14 0.00 0.00 176.83 175.91 1k2y h LEU 310 N 0.59 0.86 -0.38 5.07 3.38 -1.64 -1.99 115.31 121.20 1k2y h LEU 310 Ca 0.15 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 1k2y h LEU 310 Cb 0.25 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1k2y h LEU 310 CO -0.01 1.11 0.16 0.40 0.09 0.00 0.00 178.44 180.19 1k2y h ILE 311 N 0.69 1.19 -0.67 1.22 1.08 -1.07 -1.69 117.51 118.25 1k2y h ILE 311 Ca 0.07 -0.57 -0.02 0.00 -0.39 0.00 0.00 64.86 63.95 1k2y h ILE 311 Cb 0.88 0.86 -0.03 0.00 -3.07 0.00 0.00 36.82 35.46 1k2y h ILE 311 CO 0.08 0.21 0.35 0.50 -0.69 0.00 0.00 178.15 178.59 1k2y h LYS 312 N 0.46 0.95 -0.75 2.37 3.64 -0.85 -0.47 116.57 121.93 1k2y h LYS 312 Ca 0.13 -0.13 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1k2y h LYS 312 Cb 0.18 -0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 1k2y h LYS 312 CO -0.01 0.73 0.49 -0.22 -2.27 0.00 0.00 179.45 178.17 1k2y h LYS 313 N 0.92 0.99 -0.56 1.90 3.64 -1.18 -1.27 116.57 121.00 1k2y h LYS 313 Ca 0.23 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.45 1k2y h LYS 313 Cb 0.08 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.66 1k2y h LYS 313 CO -0.03 0.66 -0.04 -0.22 -2.27 0.00 0.00 179.45 177.55 1k2y h LYS 314 N 1.01 1.00 -0.47 1.90 1.63 -0.99 -1.34 116.57 119.32 1k2y h LYS 314 Ca 0.27 -0.33 0.04 0.00 -0.85 0.00 0.00 60.65 59.79 1k2y h LYS 314 Cb -0.10 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 31.40 1k2y h LYS 314 CO -0.06 1.00 0.23 1.98 -3.45 0.00 0.00 179.45 179.16 1k2y h MET 315 N 0.91 0.45 -0.60 1.90 4.05 -0.59 -1.47 114.93 119.57 1k2y h MET 315 Ca 0.16 -0.03 -0.07 0.00 -0.28 0.00 0.00 59.70 59.48 1k2y h MET 315 Cb 0.58 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 31.25 1k2y h MET 315 CO 0.03 0.30 0.12 0.87 0.23 0.00 0.00 176.91 178.46 1k2y h LYS 316 N 0.46 0.99 0.00 0.39 1.57 -0.97 -1.69 116.57 117.32 1k2y h LYS 316 Ca 0.20 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1k2y h LYS 316 Cb 0.11 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1k2y h LYS 316 CO -0.14 0.92 0.00 0.93 -0.57 0.00 0.00 179.45 180.58 1k2y h GLU 317 N 0.89 0.00 -0.01 3.15 5.08 -0.86 -3.15 114.58 119.68 1k2y h GLU 317 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1k2y h GLU 317 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1k2y h GLU 317 CO 0.01 0.00 -0.33 0.25 -1.00 0.00 0.00 179.01 177.94 1k2y n THR 318 N -2.96 0.00 -1.87 1.13 -2.24 -0.59 -4.98 114.28 102.77 1k2y n THR 318 Ca 0.01 -0.34 -0.15 0.00 -2.27 0.00 0.00 64.05 61.30 1k2y n THR 318 Cb 0.29 1.14 -0.04 0.00 -2.10 0.00 0.00 70.33 69.62 1k2y n THR 318 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k2y n GLY 319 N 1.08 0.63 3.75 3.38 0.00 -0.68 -4.91 105.19 108.44 1k2y n GLY 319 Ca 0.05 -0.28 -0.38 0.00 0.00 0.00 0.00 46.02 45.41 1k2y n GLY 319 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k2y s ALA 320 N -2.66 2.71 -0.49 4.61 0.00 -0.93 -4.75 121.76 120.25 1k2y s ALA 320 Ca 0.00 1.29 0.23 0.00 0.00 0.00 0.00 51.96 53.48 1k2y s ALA 320 Cb 0.00 -3.56 0.13 0.00 0.00 0.00 0.00 23.12 19.69 1k2y s ALA 320 CO 0.00 -1.40 1.12 1.28 0.00 0.00 0.00 175.76 176.75 1k2y n LEU 321 N -1.24 0.69 -3.63 0.00 4.77 -0.68 -4.65 117.00 112.26 1k2y n LEU 321 Ca 0.12 0.17 -0.15 0.00 -0.03 0.00 0.00 56.01 56.12 1k2y n LEU 321 Cb 0.46 -0.11 -0.07 0.00 -2.33 0.00 0.00 43.42 41.36 1k2y n LEU 321 CO 0.51 -0.06 0.34 -0.22 -1.33 0.00 0.00 177.39 176.63 1k2y s LEU 322 N -4.48 -0.44 0.02 2.23 2.96 -1.24 -0.36 118.68 117.37 1k2y s LEU 322 Ca 0.03 1.13 -0.11 0.00 -0.22 0.00 0.00 54.13 54.96 1k2y s LEU 322 Cb 0.13 2.23 0.01 0.00 0.50 0.00 0.00 46.19 49.06 1k2y s LEU 322 CO 0.77 -0.31 0.22 0.00 -1.32 0.00 0.00 176.35 175.72 1k2y s ALA 323 N -0.03 -0.49 0.28 5.97 0.00 -0.18 -1.59 121.76 125.72 1k2y s ALA 323 Ca -0.03 -0.08 -0.21 0.00 0.00 0.00 0.00 51.96 51.64 1k2y s ALA 323 Cb -0.04 0.20 0.02 0.00 0.00 0.00 0.00 23.12 23.31 1k2y s ALA 323 CO 0.03 -0.31 0.73 0.20 0.00 0.00 0.00 175.76 176.41 1k2y s GLY 324 N -1.76 -0.07 0.14 0.00 0.00 -0.44 -0.09 107.32 105.10 1k2y s GLY 324 Ca -0.09 -0.31 -0.18 0.00 0.00 0.00 0.00 44.72 44.14 1k2y s GLY 324 CO -0.01 -0.09 0.46 -1.83 0.00 0.00 0.00 173.10 171.63 1k2y s GLU 325 N -3.82 1.15 0.33 2.90 4.04 -0.79 -3.89 118.70 118.62 1k2y s GLU 325 Ca 0.11 -0.66 0.26 0.00 0.04 0.00 0.00 54.97 54.72 1k2y s GLU 325 Cb -0.06 0.51 1.15 0.00 0.02 0.00 0.00 34.13 35.75 1k2y s GLU 325 CO 0.07 -0.47 1.77 0.52 -1.84 0.00 0.00 175.26 175.31 1k2y h MET 326 N 2.25 0.00 0.00 -4.83 2.86 -1.94 -1.48 114.93 111.79 1k2y h MET 326 Ca -0.34 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.30 1k2y h MET 326 Cb 1.27 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.93 1k2y h MET 326 CO 0.44 0.00 0.00 -1.13 1.06 0.00 0.00 176.91 177.28 1k2y n SER 327 N -2.41 0.33 0.00 1.22 3.41 -1.26 -4.71 113.62 110.20 1k2y n SER 327 Ca 0.01 0.54 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 1k2y n SER 327 Cb 0.19 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.51 1k2y n SER 327 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1k2y n GLY 328 N 1.00 1.08 3.72 5.00 0.00 -0.56 -4.89 105.19 110.53 1k2y n GLY 328 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1k2y n GLY 328 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1k2y s HIS 329 N -2.00 3.66 -0.06 1.61 3.76 -1.25 -4.41 115.29 116.60 1k2y s HIS 329 Ca 0.00 1.67 0.03 0.00 -0.15 0.00 0.00 55.06 56.61 1k2y s HIS 329 Cb 0.00 -3.15 0.01 0.00 1.11 0.00 0.00 32.58 30.55 1k2y s HIS 329 CO 0.00 -0.15 -0.14 0.08 -0.85 0.00 0.00 174.74 173.68 1k2y s VAL 330 N 0.74 1.26 -0.20 -0.90 1.01 -1.26 -1.89 120.40 119.16 1k2y s VAL 330 Ca 0.52 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.93 1k2y s VAL 330 Cb -0.23 -1.13 0.03 0.00 0.00 0.00 0.00 36.38 35.05 1k2y s VAL 330 CO 0.29 0.38 -0.17 -0.36 0.00 0.00 0.00 175.10 175.24 1k2y s PHE 331 N 0.46 2.92 -0.20 5.22 0.40 0.88 -3.24 117.98 124.42 1k2y s PHE 331 Ca -0.12 -1.78 -0.09 0.00 -0.60 0.00 0.00 56.93 54.34 1k2y s PHE 331 Cb -0.15 -1.94 -0.05 0.00 0.51 0.00 0.00 43.02 41.40 1k2y s PHE 331 CO 0.04 -0.81 0.10 -0.06 0.70 0.00 0.00 175.22 175.18 1k2y s PHE 332 N 1.25 3.33 -0.21 0.36 0.40 -1.26 -1.01 117.98 120.84 1k2y s PHE 332 Ca 0.01 0.20 0.06 0.00 -0.60 0.00 0.00 56.93 56.61 1k2y s PHE 332 Cb -0.15 -2.13 -0.17 0.00 0.51 0.00 0.00 43.02 41.07 1k2y s PHE 332 CO -0.10 0.20 -0.12 1.17 0.70 0.00 0.00 175.22 177.08 1k2y n LYS 333 N 3.61 0.74 -1.69 0.44 3.00 0.52 -1.24 118.16 123.54 1k2y n LYS 333 Ca -0.16 0.09 -0.43 0.00 -0.00 0.00 0.00 58.31 57.80 1k2y n LYS 333 Cb 0.52 -1.46 -0.03 0.00 0.00 0.00 0.00 35.03 34.06 1k2y n LYS 333 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1k2y n GLU 334 N -3.00 2.69 -1.14 1.64 2.13 -0.87 -1.36 120.64 120.72 1k2y n GLU 334 Ca -0.37 0.98 -0.05 0.00 0.66 0.00 0.00 57.16 58.38 1k2y n GLU 334 Cb 0.98 -2.86 -0.02 0.00 0.27 0.00 0.00 31.44 29.81 1k2y n GLU 334 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1k2y n ARG 335 N 5.64 -1.24 0.00 5.31 1.74 -1.26 -4.88 116.66 121.97 1k2y n ARG 335 Ca 0.18 0.57 0.00 0.00 -0.77 0.00 0.00 57.85 57.83 1k2y n ARG 335 Cb 0.36 -4.62 0.00 0.00 -1.02 0.00 0.00 32.46 27.18 1k2y n ARG 335 CO 0.00 0.00 0.00 1.87 -1.52 0.00 0.00 177.63 177.98 1k2y n TRP 336 N -2.41 0.00 0.08 -1.55 -0.00 -0.47 -5.09 117.44 108.01 1k2y n TRP 336 Ca -0.05 0.00 0.02 0.00 -0.00 0.00 0.00 57.50 57.47 1k2y n TRP 336 Cb 0.39 0.00 -0.03 0.00 -0.00 0.00 0.00 31.31 31.66 1k2y n TRP 336 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 1k2y n PHE 337 N 0.00 0.00 0.00 5.87 3.01 -1.23 -4.80 117.46 120.31 1k2y n PHE 337 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1k2y n PHE 337 Cb 0.00 -0.06 0.00 0.00 -0.01 0.00 0.00 39.48 39.41 1k2y n PHE 337 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1k2y n GLY 338 N 1.79 0.27 3.93 1.37 0.00 -0.38 -4.92 105.19 107.25 1k2y n GLY 338 Ca -0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1k2y n GLY 338 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1k2y s PHE 339 N -2.00 3.52 0.32 1.61 -0.12 -1.26 -4.61 117.98 115.44 1k2y s PHE 339 Ca 0.00 0.49 -0.28 0.00 -0.05 0.00 0.00 56.93 57.09 1k2y s PHE 339 Cb 0.00 -2.02 -0.09 0.00 -0.63 0.00 0.00 43.02 40.28 1k2y s PHE 339 CO 0.00 0.02 1.08 0.16 -0.05 0.00 0.00 175.22 176.42 1k2y s ASP 340 N -4.01 7.09 -0.30 1.98 3.84 -1.26 -4.18 116.67 119.84 1k2y s ASP 340 Ca 0.42 2.18 -0.04 0.00 -0.00 0.00 0.00 52.55 55.12 1k2y s ASP 340 Cb -0.10 -2.61 0.19 0.00 -1.38 0.00 0.00 42.92 39.02 1k2y s ASP 340 CO 0.38 -0.26 0.70 -0.62 -0.00 0.00 0.00 175.17 175.37 1k2y s ASP 341 N -1.13 -1.19 0.30 2.11 -1.08 -1.20 -4.57 116.67 109.92 1k2y s ASP 341 Ca 0.49 0.74 0.03 0.00 -0.52 0.00 0.00 52.55 53.29 1k2y s ASP 341 Cb -0.28 1.99 0.48 0.00 -1.46 0.00 0.00 42.92 43.65 1k2y s ASP 341 CO 0.36 -0.22 1.77 1.23 0.52 0.00 0.00 175.17 178.83 1k2y h GLY 342 N 8.00 0.52 0.91 2.66 0.00 -1.02 -1.47 103.07 112.66 1k2y h GLY 342 Ca -0.21 -0.38 -0.08 0.00 0.00 0.00 0.00 47.33 46.66 1k2y h GLY 342 CO 0.18 0.35 -0.12 -2.22 0.00 0.00 0.00 176.54 174.73 1k2y h ILE 343 N 0.44 1.29 -0.52 2.60 2.04 -1.90 -1.02 117.51 120.43 1k2y h ILE 343 Ca 0.08 -1.19 -0.06 0.00 1.00 0.00 0.00 64.86 64.68 1k2y h ILE 343 Cb 0.56 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 1k2y h ILE 343 CO 0.04 0.38 0.07 0.22 0.00 0.00 0.00 178.15 178.86 1k2y h TYR 344 N 0.37 0.92 -0.65 1.37 3.20 -1.90 -1.25 116.97 119.03 1k2y h TYR 344 Ca 0.07 -0.13 0.06 0.00 3.14 0.00 0.00 58.73 61.87 1k2y h TYR 344 Cb 0.63 -0.25 -0.06 0.00 1.54 0.00 0.00 36.73 38.59 1k2y h TYR 344 CO 0.06 0.84 0.36 0.77 -1.64 0.00 0.00 178.16 178.54 1k2y h SER 345 N 0.75 0.52 -0.48 -2.11 0.02 -1.16 0.11 113.55 111.19 1k2y h SER 345 Ca 0.16 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 61.15 1k2y h SER 345 Cb 0.42 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.87 1k2y h SER 345 CO 0.01 0.33 0.31 0.00 -1.14 0.00 0.00 176.83 176.35 1k2y h ALA 346 N 1.35 0.60 -0.47 3.77 0.00 -0.76 0.30 119.26 124.05 1k2y h ALA 346 Ca 0.30 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1k2y h ALA 346 Cb 0.20 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1k2y h ALA 346 CO -0.19 0.04 0.22 0.00 0.00 0.00 0.00 179.25 179.32 1k2y h ALA 347 N 1.18 0.61 -0.79 0.00 0.00 -0.42 -0.55 119.26 119.30 1k2y h ALA 347 Ca 0.18 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1k2y h ALA 347 Cb -0.06 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1k2y h ALA 347 CO -0.05 0.18 0.30 0.00 0.00 0.00 0.00 179.25 179.68 1k2y h ARG 348 N 0.62 1.19 -0.45 0.00 2.47 -0.43 -1.00 114.38 116.78 1k2y h ARG 348 Ca 0.16 -0.22 -0.02 0.00 -1.26 0.00 0.00 59.98 58.64 1k2y h ARG 348 Cb 0.13 -0.19 -0.02 0.00 -1.65 0.00 0.00 29.97 28.24 1k2y h ARG 348 CO -0.02 0.97 0.21 1.25 0.56 0.00 0.00 179.97 182.94 1k2y h LEU 349 N 1.15 0.59 -0.85 3.04 5.85 -0.57 -2.53 115.31 121.99 1k2y h LEU 349 Ca 0.26 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 1k2y h LEU 349 Cb 0.24 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1k2y h LEU 349 CO -0.02 0.55 0.31 -0.07 -0.34 0.00 0.00 178.44 178.88 1k2y h LEU 350 N 0.58 1.06 0.04 2.25 3.38 -0.86 0.00 115.31 121.77 1k2y h LEU 350 Ca 0.15 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1k2y h LEU 350 Cb 0.12 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1k2y h LEU 350 CO -0.02 0.94 -0.10 -0.08 0.09 0.00 0.00 178.44 179.27 1k2y h GLU 351 N 1.12 -0.18 0.00 1.13 4.81 -1.01 0.87 114.58 121.33 1k2y h GLU 351 Ca 0.26 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1k2y h GLU 351 Cb 0.21 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.63 1k2y h GLU 351 CO -0.02 -0.12 -0.00 0.82 -0.73 0.00 0.00 179.01 178.96 1k2y h ILE 352 N -0.19 1.16 -0.37 2.32 2.04 -1.08 -2.88 117.51 118.51 1k2y h ILE 352 Ca 0.02 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.39 1k2y h ILE 352 Cb 0.21 1.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 1k2y h ILE 352 CO -0.06 0.13 0.24 -0.07 0.00 0.00 0.00 178.15 178.39 1k2y h LEU 353 N -0.21 0.43 -1.63 1.44 3.38 -0.87 -1.52 115.31 116.32 1k2y h LEU 353 Ca -0.00 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1k2y h LEU 353 Cb 0.21 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1k2y h LEU 353 CO 0.00 0.32 -0.02 0.77 0.09 0.00 0.00 178.44 179.60 1k2y h SER 354 N 0.51 0.00 -0.49 -0.43 4.64 -0.61 -2.25 113.55 114.91 1k2y h SER 354 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1k2y h SER 354 Cb -0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1k2y h SER 354 CO -0.03 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 175.95 1k2y n GLN 355 N -3.13 2.25 -5.16 4.77 6.02 -0.57 -2.22 117.38 119.35 1k2y n GLN 355 Ca 0.00 -1.93 -0.31 0.00 -0.01 0.00 0.00 57.00 54.75 1k2y n GLN 355 Cb 0.28 -1.44 -0.17 0.00 1.02 0.00 0.00 30.24 29.94 1k2y n GLN 355 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1k2y s ASP 356 N -1.12 2.92 0.37 1.08 -1.08 -0.85 -5.02 116.67 112.98 1k2y s ASP 356 Ca 0.37 -0.52 0.27 0.00 -0.52 0.00 0.00 52.55 52.15 1k2y s ASP 356 Cb 0.19 -1.19 0.97 0.00 -1.46 0.00 0.00 42.92 41.43 1k2y s ASP 356 CO 0.26 0.17 1.79 0.06 0.52 0.00 0.00 175.17 177.97 1k2y h GLN 357 N 6.56 0.00 -7.30 4.34 -0.00 -1.88 -3.44 115.11 113.40 1k2y h GLN 357 Ca -0.24 0.00 -0.51 0.00 -0.00 0.00 0.00 58.65 57.91 1k2y h GLN 357 Cb 1.22 0.00 0.08 0.00 -0.00 0.00 0.00 27.48 28.78 1k2y h GLN 357 CO 0.47 0.00 0.37 1.03 -0.00 0.00 0.00 178.83 180.70 1k2y s ARG 358 N -3.37 3.06 0.78 0.06 0.52 -1.26 -5.04 118.95 113.70 1k2y s ARG 358 Ca 0.05 1.02 -0.11 0.00 -0.52 0.00 0.00 55.73 56.17 1k2y s ARG 358 Cb 0.09 -2.00 0.06 0.00 0.52 0.00 0.00 34.95 33.61 1k2y s ARG 358 CO 0.52 -1.00 1.09 0.16 0.02 0.00 0.00 175.30 176.09 1k2y s ASP 359 N -3.51 4.69 0.37 0.23 1.47 -1.26 -4.83 116.67 113.82 1k2y s ASP 359 Ca 0.60 1.32 0.07 0.00 1.18 0.00 0.00 52.55 55.71 1k2y s ASP 359 Cb -0.14 -2.07 0.71 0.00 -0.34 0.00 0.00 42.92 41.07 1k2y s ASP 359 CO 0.50 -1.85 1.92 0.77 0.68 0.00 0.00 175.17 177.19 1k2y h SER 360 N -1.00 0.40 -0.17 2.11 4.64 -1.95 -1.14 113.55 116.43 1k2y h SER 360 Ca -0.46 -0.06 0.03 0.00 -0.47 0.00 0.00 61.79 60.82 1k2y h SER 360 Cb 1.26 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 63.22 1k2y h SER 360 CO 0.60 0.46 -0.03 -0.08 -0.87 0.00 0.00 176.83 176.90 1k2y h GLU 361 N 0.42 0.01 -0.01 4.77 4.57 -1.92 -1.91 114.58 120.51 1k2y h GLU 361 Ca 0.09 -0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 58.13 1k2y h GLU 361 Cb 0.28 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.85 1k2y h GLU 361 CO 0.01 0.01 -0.68 0.45 -1.18 0.00 0.00 179.01 177.62 1k2y h HIS 362 N 0.01 0.08 -0.27 0.92 3.86 -1.75 0.36 115.15 118.36 1k2y h HIS 362 Ca 0.08 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.26 1k2y h HIS 362 Cb 0.12 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.56 1k2y h HIS 362 CO -0.19 0.72 0.17 0.28 0.86 0.00 0.00 177.93 179.77 1k2y h VAL 363 N 0.04 1.06 -0.02 2.45 2.07 -1.04 -1.97 116.25 118.83 1k2y h VAL 363 Ca -0.01 -0.12 -0.22 0.00 0.82 0.00 0.00 66.70 67.16 1k2y h VAL 363 Cb 1.20 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 1k2y h VAL 363 CO 0.09 0.06 -0.91 -0.26 0.02 0.00 0.00 177.57 176.58 1k2y h PHE 364 N 0.36 0.69 0.00 1.57 -1.00 -1.28 -3.28 116.94 113.99 1k2y h PHE 364 Ca 0.10 -0.36 -0.02 0.00 2.81 0.00 0.00 57.97 60.50 1k2y h PHE 364 Cb -0.03 -0.08 -0.00 0.00 3.61 0.00 0.00 35.95 39.44 1k2y h PHE 364 CO -0.06 1.17 -0.09 0.66 -1.61 0.00 0.00 178.31 178.37 1k2y h SER 365 N 0.28 0.00 0.43 2.17 4.64 -0.75 -2.93 113.55 117.39 1k2y h SER 365 Ca -0.08 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.19 1k2y h SER 365 Cb 1.54 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.62 1k2y h SER 365 CO 0.16 0.09 -0.28 0.00 -0.87 0.00 0.00 176.83 175.94 1k2y h ALA 366 N 1.91 1.33 -2.64 5.18 0.00 -1.42 -3.44 119.26 120.18 1k2y h ALA 366 Ca -0.00 -0.25 -0.52 0.00 0.00 0.00 0.00 54.91 54.14 1k2y h ALA 366 Cb 0.47 -0.04 0.11 0.00 0.00 0.00 0.00 17.79 18.32 1k2y h ALA 366 CO 0.01 0.35 0.42 -0.06 0.00 0.00 0.00 179.25 179.97 1k2y s PHE 367 N -4.15 2.47 0.34 0.00 0.08 -1.11 -4.94 117.98 110.68 1k2y s PHE 367 Ca -0.02 1.55 -0.29 0.00 0.12 0.00 0.00 56.93 58.29 1k2y s PHE 367 Cb 0.14 -3.34 -0.11 0.00 -0.57 0.00 0.00 43.02 39.14 1k2y s PHE 367 CO 0.68 -1.96 1.48 -2.14 -0.10 0.00 0.00 175.22 173.18 1k2y s PRO 368 N -3.63 4.15 0.01 0.24 0.02 -1.26 -5.00 135.00 129.53 1k2y s PRO 368 Ca 0.73 2.51 0.04 0.00 0.02 0.00 0.00 61.00 64.30 1k2y s PRO 368 Cb -0.26 -3.00 -0.01 0.00 0.02 0.00 0.00 34.50 31.25 1k2y s PRO 368 CO 0.36 -0.50 -0.14 -1.54 -0.33 0.00 0.00 177.00 174.85 1k2y s SER 369 N -0.01 1.61 0.48 2.53 1.04 -1.26 -5.01 113.70 113.08 1k2y s SER 369 Ca 0.55 -0.32 0.04 0.00 0.48 0.00 0.00 55.95 56.69 1k2y s SER 369 Cb -0.46 -0.15 -0.03 0.00 0.10 0.00 0.00 66.02 65.49 1k2y s SER 369 CO 0.57 0.12 0.06 -1.81 0.98 0.00 0.00 173.24 173.16 1k2y s ASP 370 N -0.61 4.15 -0.08 7.02 -0.00 -1.26 -5.01 116.67 120.88 1k2y s ASP 370 Ca 0.04 -1.49 -0.27 0.00 -0.00 0.00 0.00 52.55 50.83 1k2y s ASP 370 Cb -0.06 0.19 -0.03 0.00 -0.00 0.00 0.00 42.92 43.03 1k2y s ASP 370 CO 0.00 -0.75 0.87 -0.63 -0.00 0.00 0.00 175.17 174.66 1k2y s ILE 371 N -2.80 4.91 0.06 0.77 1.01 0.22 -4.88 121.20 120.49 1k2y s ILE 371 Ca 0.19 1.78 0.05 0.00 0.00 0.00 0.00 60.65 62.67 1k2y s ILE 371 Cb 0.03 -4.20 -0.03 0.00 0.01 0.00 0.00 42.46 38.28 1k2y s ILE 371 CO 0.10 0.13 -0.14 -0.94 0.00 0.00 0.00 174.94 174.09 1k2y s SER 372 N 1.00 1.69 0.35 3.58 1.04 -1.26 -0.89 113.70 119.20 1k2y s SER 372 Ca 0.44 -0.56 -0.14 0.00 0.48 0.00 0.00 55.95 56.17 1k2y s SER 372 Cb -0.19 -0.07 -0.08 0.00 0.10 0.00 0.00 66.02 65.78 1k2y s SER 372 CO 0.20 -0.03 0.76 0.42 0.98 0.00 0.00 173.24 175.56 1k2y s THR 373 N -1.12 4.69 0.73 2.02 -4.23 -0.86 -5.02 115.64 111.85 1k2y s THR 373 Ca -0.01 0.91 -0.15 0.00 -1.18 0.00 0.00 61.69 61.26 1k2y s THR 373 Cb -0.09 -3.64 0.04 0.00 1.34 0.00 0.00 72.50 70.15 1k2y s THR 373 CO 0.02 -0.28 1.25 -2.84 -0.54 0.00 0.00 174.62 172.24 1k2y s PRO 374 N -3.20 2.04 0.31 3.99 0.02 -1.26 -4.65 135.00 132.24 1k2y s PRO 374 Ca 0.54 1.92 -0.29 0.00 0.02 0.00 0.00 61.00 63.18 1k2y s PRO 374 Cb -0.10 -1.80 -0.12 0.00 0.02 0.00 0.00 34.50 32.50 1k2y s PRO 374 CO 0.20 -1.95 1.46 -1.91 -0.33 0.00 0.00 177.00 174.47 1k2y n GLU 375 N -2.66 2.41 -4.35 5.54 2.13 -1.26 -4.85 120.64 117.60 1k2y n GLU 375 Ca 0.15 0.85 -0.35 0.00 0.66 0.00 0.00 57.16 58.47 1k2y n GLU 375 Cb 0.49 -2.55 -0.10 0.00 0.27 0.00 0.00 31.44 29.55 1k2y n GLU 375 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 1k2y s ILE 376 N -0.47 4.24 -0.09 6.31 1.01 0.14 -4.96 121.20 127.38 1k2y s ILE 376 Ca 0.61 -0.26 0.04 0.00 0.00 0.00 0.00 60.65 61.04 1k2y s ILE 376 Cb -0.55 -2.82 0.00 0.00 0.01 0.00 0.00 42.46 39.11 1k2y s ILE 376 CO 0.55 0.56 -0.22 0.20 0.00 0.00 0.00 174.94 176.03 1k2y s ASN 377 N -0.44 2.84 -0.24 3.58 -0.87 -1.26 -0.49 114.94 118.06 1k2y s ASN 377 Ca 0.08 -0.51 -0.00 0.00 -1.57 0.00 0.00 52.86 50.85 1k2y s ASN 377 Cb -0.12 -1.30 0.03 0.00 -0.02 0.00 0.00 41.25 39.84 1k2y s ASN 377 CO 0.02 0.13 -0.09 -0.63 -2.57 0.00 0.00 177.10 173.97 1k2y s ILE 378 N 0.42 2.63 0.02 0.60 1.01 0.21 -4.96 121.20 121.14 1k2y s ILE 378 Ca -0.18 -1.15 -0.30 0.00 0.00 0.00 0.00 60.65 59.02 1k2y s ILE 378 Cb -0.17 -2.36 -0.06 0.00 0.01 0.00 0.00 42.46 39.88 1k2y s ILE 378 CO 0.08 0.18 1.41 -0.89 0.00 0.00 0.00 174.94 175.72 1k2y s THR 379 N 1.27 3.65 0.00 2.92 2.01 -1.26 -1.10 115.64 123.13 1k2y s THR 379 Ca -0.01 1.06 0.00 0.00 0.31 0.00 0.00 61.69 63.05 1k2y s THR 379 Cb -0.17 -3.68 0.00 0.00 0.01 0.00 0.00 72.50 68.66 1k2y s THR 379 CO -0.06 0.01 0.00 1.33 -0.69 0.00 0.00 174.62 175.21 1k2y n VAL 380 N 4.58 0.00 -4.01 3.82 0.24 -0.64 -4.94 118.33 117.38 1k2y n VAL 380 Ca 0.13 0.00 -0.08 0.00 -2.04 0.00 0.00 64.34 62.35 1k2y n VAL 380 Cb 0.43 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.71 1k2y n VAL 380 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1k2y s THR 381 N 4.00 0.18 0.47 3.34 -4.23 -1.26 -4.89 115.64 113.25 1k2y s THR 381 Ca 0.00 -1.52 0.15 0.00 -1.18 0.00 0.00 61.69 59.14 1k2y s THR 381 Cb 0.00 -1.31 0.21 0.00 1.34 0.00 0.00 72.50 72.74 1k2y s THR 381 CO 0.00 -0.84 2.03 -0.08 -0.54 0.00 0.00 174.62 175.19 1k2y h GLU 382 N 3.25 0.00 -0.06 3.99 4.57 -1.95 -2.25 114.58 122.12 1k2y h GLU 382 Ca -0.34 0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 57.70 1k2y h GLU 382 Cb 1.16 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.74 1k2y h GLU 382 CO 0.60 0.13 -0.59 -0.44 -1.18 0.00 0.00 179.01 177.53 1k2y h ASP 383 N 0.00 0.22 0.33 1.04 3.32 -2.00 -3.34 116.42 115.99 1k2y h ASP 383 Ca -0.00 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.93 1k2y h ASP 383 Cb 0.24 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1k2y h ASP 383 CO 0.02 0.76 -1.59 -1.54 -1.72 0.00 0.00 179.24 175.17 1k2y n SER 384 N -3.87 0.34 0.13 6.45 3.41 -0.99 -4.63 113.62 114.46 1k2y n SER 384 Ca -0.02 0.04 -0.13 0.00 -0.26 0.00 0.00 58.87 58.50 1k2y n SER 384 Cb 0.61 1.40 -0.06 0.00 -0.26 0.00 0.00 64.21 65.90 1k2y n SER 384 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1k2y h LYS 385 N 0.00 -0.46 -0.44 4.33 2.10 -1.54 -0.55 116.57 120.01 1k2y h LYS 385 Ca 0.00 0.03 -0.12 0.00 -2.00 0.00 0.00 60.65 58.56 1k2y h LYS 385 Cb 0.96 0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 32.38 1k2y h LYS 385 CO 0.00 -0.30 -0.22 0.74 -2.00 0.00 0.00 179.45 177.66 1k2y h PHE 386 N -0.47 1.02 -0.63 0.07 0.05 -1.85 -3.16 116.94 111.97 1k2y h PHE 386 Ca 0.02 -0.24 -0.01 0.00 3.82 0.00 0.00 57.97 61.56 1k2y h PHE 386 Cb 0.48 -0.24 -0.03 0.00 2.00 0.00 0.00 35.95 38.16 1k2y h PHE 386 CO -0.21 1.02 0.35 0.00 -0.18 0.00 0.00 178.31 179.29 1k2y h ALA 387 N 0.97 1.44 -0.16 2.45 0.00 -1.74 0.25 119.26 122.47 1k2y h ALA 387 Ca 0.10 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1k2y h ALA 387 Cb 0.77 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1k2y h ALA 387 CO 0.06 0.47 0.08 0.82 0.00 0.00 0.00 179.25 180.69 1k2y h ILE 388 N 0.87 1.01 -0.60 0.00 2.04 -1.07 -0.14 117.51 119.62 1k2y h ILE 388 Ca 0.22 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 66.03 1k2y h ILE 388 Cb 0.01 0.81 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 1k2y h ILE 388 CO -0.04 0.03 0.39 0.40 0.00 0.00 0.00 178.15 178.94 1k2y h ILE 389 N 0.18 1.16 -0.74 -0.67 1.08 -1.42 -1.62 117.51 115.47 1k2y h ILE 389 Ca 0.06 -0.29 -0.03 0.00 -0.39 0.00 0.00 64.86 64.22 1k2y h ILE 389 Cb 0.01 0.28 -0.03 0.00 -3.07 0.00 0.00 36.82 34.00 1k2y h ILE 389 CO -0.04 0.15 0.36 -0.33 -0.69 0.00 0.00 178.15 177.60 1k2y h GLU 390 N 0.81 1.06 -0.54 2.37 5.08 -0.68 -0.28 114.58 122.40 1k2y h GLU 390 Ca 0.22 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 58.37 1k2y h GLU 390 Cb -0.09 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 28.94 1k2y h GLU 390 CO -0.05 0.81 0.08 0.00 -1.00 0.00 0.00 179.01 178.86 1k2y h ALA 391 N 1.34 0.72 -0.41 3.43 0.00 -0.74 0.17 119.26 123.77 1k2y h ALA 391 Ca 0.26 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1k2y h ALA 391 Cb 0.10 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1k2y h ALA 391 CO -0.03 0.46 0.24 -0.07 0.00 0.00 0.00 179.25 179.85 1k2y h LEU 392 N 0.78 0.50 -1.46 0.00 3.38 -0.86 -0.80 115.31 116.85 1k2y h LEU 392 Ca 0.16 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1k2y h LEU 392 Cb 0.41 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1k2y h LEU 392 CO 0.01 0.43 0.02 1.56 0.09 0.00 0.00 178.44 180.54 1k2y h GLN 393 N 0.54 0.36 0.06 1.13 4.20 -0.58 0.00 115.11 120.82 1k2y h GLN 393 Ca 0.15 -0.06 -0.08 0.00 0.06 0.00 0.00 58.65 58.72 1k2y h GLN 393 Cb 0.02 -0.06 0.01 0.00 0.30 0.00 0.00 27.48 27.75 1k2y h GLN 393 CO -0.03 0.38 -0.33 0.00 -0.67 0.00 0.00 178.83 178.18 1k2y h ARG 394 N 0.36 0.13 0.00 1.46 3.08 -0.71 -3.43 114.38 115.27 1k2y h ARG 394 Ca 0.08 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 59.92 1k2y h ARG 394 Cb 0.22 0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.34 1k2y h ARG 394 CO 0.00 1.09 0.00 -0.25 -1.07 0.00 0.00 179.97 179.75 1k2y n ASP 395 N -4.41 0.42 -4.75 7.04 8.00 -0.33 -5.06 116.55 117.46 1k2y n ASP 395 Ca -0.12 -0.71 -0.33 0.00 0.71 0.00 0.00 54.79 54.35 1k2y n ASP 395 Cb 0.62 0.48 0.07 0.00 -0.02 0.00 0.00 41.12 42.26 1k2y n ASP 395 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1k2y s ALA 396 N -0.48 2.32 -0.18 2.24 0.00 -0.02 -5.02 121.76 120.63 1k2y s ALA 396 Ca 0.00 0.62 0.01 0.00 0.00 0.00 0.00 51.96 52.59 1k2y s ALA 396 Cb 0.00 -3.36 0.02 0.00 0.00 0.00 0.00 23.12 19.78 1k2y s ALA 396 CO 0.00 -1.52 -0.20 -0.65 0.00 0.00 0.00 175.76 173.39 1k2y s GLN 397 N -4.11 2.95 0.00 0.00 -1.52 -1.26 -5.01 119.66 110.72 1k2y s GLN 397 Ca 0.69 -0.82 0.11 0.00 -1.95 0.00 0.00 55.36 53.39 1k2y s GLN 397 Cb -0.23 -2.55 -0.04 0.00 -0.22 0.00 0.00 33.01 29.97 1k2y s GLN 397 CO 0.44 -0.21 0.60 0.91 -0.25 0.00 0.00 175.29 176.78 1k2y n TRP 398 N 4.62 0.00 -2.91 0.91 7.02 -1.26 -4.95 117.44 120.87 1k2y n TRP 398 Ca -0.21 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.27 1k2y n TRP 398 Cb 0.50 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.39 1k2y n TRP 398 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1k2y n GLY 399 N 1.06 -1.44 3.54 6.99 0.00 -1.26 -4.66 105.19 109.42 1k2y n GLY 399 Ca 0.04 -1.47 -0.43 0.00 0.00 0.00 0.00 46.02 44.15 1k2y n GLY 399 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1k2y s GLU 400 N 0.00 3.39 -0.13 1.61 0.41 -1.26 -4.92 118.70 117.80 1k2y s GLU 400 Ca 0.00 -0.14 -0.33 0.00 -0.41 0.00 0.00 54.97 54.09 1k2y s GLU 400 Cb 0.00 -3.98 0.13 0.00 -1.78 0.00 0.00 34.13 28.50 1k2y s GLU 400 CO 0.00 -1.26 1.16 0.20 -0.49 0.00 0.00 175.26 174.86 1k2y s GLY 401 N 2.41 -0.33 -0.28 -1.39 0.00 -1.26 -4.80 107.32 101.67 1k2y s GLY 401 Ca 0.31 1.38 -0.17 0.00 0.00 0.00 0.00 44.72 46.24 1k2y s GLY 401 CO 0.22 0.45 0.48 -1.31 0.00 0.00 0.00 173.10 172.94 1k2y s ASN 402 N -2.33 6.37 -0.16 1.64 0.01 -0.05 -4.89 114.94 115.53 1k2y s ASN 402 Ca 0.09 0.35 -0.12 0.00 -0.71 0.00 0.00 52.86 52.47 1k2y s ASN 402 Cb -0.00 -2.26 -0.05 0.00 0.41 0.00 0.00 41.25 39.35 1k2y s ASN 402 CO -0.05 -0.31 0.24 -0.63 -1.51 0.00 0.00 177.10 174.84 1k2y s ILE 403 N 2.27 5.34 -0.16 0.60 1.01 -1.26 -0.71 121.20 128.29 1k2y s ILE 403 Ca 0.19 0.44 0.01 0.00 0.00 0.00 0.00 60.65 61.28 1k2y s ILE 403 Cb -0.16 -3.57 0.02 0.00 0.01 0.00 0.00 42.46 38.76 1k2y s ILE 403 CO 0.10 0.43 -0.16 -0.89 0.00 0.00 0.00 174.94 174.42 1k2y s THR 404 N 0.27 1.69 -0.19 2.92 2.01 0.15 -5.01 115.64 117.48 1k2y s THR 404 Ca 0.14 -0.71 0.15 0.00 0.31 0.00 0.00 61.69 61.59 1k2y s THR 404 Cb -0.12 -1.57 0.44 0.00 0.01 0.00 0.00 72.50 71.26 1k2y s THR 404 CO 0.03 0.48 1.33 0.35 -0.69 0.00 0.00 174.62 176.11 1k2y n THR 405 N 4.72 2.21 0.13 -0.82 -2.24 -1.26 -1.03 114.28 115.99 1k2y n THR 405 Ca -0.18 -2.29 0.03 0.00 -2.27 0.00 0.00 64.05 59.35 1k2y n THR 405 Cb 0.50 -0.26 0.43 0.00 -2.10 0.00 0.00 70.33 68.90 1k2y n THR 405 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1k2y h LEU 406 N 1.02 0.20 -6.16 3.22 3.38 -1.97 -3.38 115.31 111.61 1k2y h LEU 406 Ca 0.04 -0.03 -0.19 0.00 0.09 0.00 0.00 57.88 57.79 1k2y h LEU 406 Cb 1.31 -0.05 -0.25 0.00 0.09 0.00 0.00 40.66 41.76 1k2y h LEU 406 CO 0.17 0.31 -0.55 -0.62 0.09 0.00 0.00 178.44 177.84 1k2y s ASP 407 N -6.89 -0.30 0.04 -0.43 -1.08 -1.26 -4.87 116.67 101.88 1k2y s ASP 407 Ca -0.06 -1.05 0.00 0.00 -0.52 0.00 0.00 52.55 50.92 1k2y s ASP 407 Cb 0.16 1.33 0.00 0.00 -1.46 0.00 0.00 42.92 42.95 1k2y s ASP 407 CO 0.72 -0.22 0.00 0.61 0.52 0.00 0.00 175.17 176.80 1k2y n GLY 408 N 4.44 -0.00 2.86 2.66 0.00 -1.26 -4.68 105.19 109.20 1k2y n GLY 408 Ca 0.10 -1.02 -0.25 0.00 0.00 0.00 0.00 46.02 44.85 1k2y n GLY 408 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k2y s VAL 409 N 0.00 0.79 -0.06 1.61 1.01 0.24 -4.29 120.40 119.70 1k2y s VAL 409 Ca 0.00 -0.14 0.04 0.00 0.00 0.00 0.00 61.98 61.88 1k2y s VAL 409 Cb 0.00 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.50 1k2y s VAL 409 CO 0.00 0.33 -0.18 -0.60 0.00 0.00 0.00 175.10 174.65 1k2y s ARG 410 N 1.81 2.60 -0.12 2.72 3.52 -0.20 -1.23 118.95 128.04 1k2y s ARG 410 Ca 0.05 -0.77 0.02 0.00 -0.13 0.00 0.00 55.73 54.90 1k2y s ARG 410 Cb -0.12 -2.33 0.02 0.00 -1.56 0.00 0.00 34.95 30.95 1k2y s ARG 410 CO -0.07 0.50 -0.16 0.08 -0.81 0.00 0.00 175.30 174.84 1k2y s VAL 411 N -0.43 1.63 -0.31 7.11 1.01 -0.09 -0.68 120.40 128.65 1k2y s VAL 411 Ca 0.05 -0.71 -0.10 0.00 0.00 0.00 0.00 61.98 61.21 1k2y s VAL 411 Cb -0.12 -1.49 -0.02 0.00 0.00 0.00 0.00 36.38 34.75 1k2y s VAL 411 CO 0.02 0.47 0.17 -1.81 0.00 0.00 0.00 175.10 173.94 1k2y s ASP 412 N 1.06 5.68 0.46 3.32 1.01 0.11 -1.75 116.67 126.55 1k2y s ASP 412 Ca -0.04 -0.40 0.05 0.00 0.71 0.00 0.00 52.55 52.86 1k2y s ASP 412 Cb -0.15 -2.04 0.01 0.00 1.01 0.00 0.00 42.92 41.76 1k2y s ASP 412 CO -0.04 -0.17 0.64 -0.31 0.21 0.00 0.00 175.17 175.50 1k2y s TYR 413 N 1.66 2.92 0.41 4.23 1.51 0.67 -0.87 117.35 127.87 1k2y s TYR 413 Ca 0.05 -0.17 0.10 0.00 -1.01 0.00 0.00 57.07 56.05 1k2y s TYR 413 Cb -0.17 -2.44 0.92 0.00 -0.11 0.00 0.00 41.96 40.16 1k2y s TYR 413 CO 0.07 -0.51 2.00 -1.35 -1.11 0.00 0.00 175.55 174.65 1k2y h PRO 414 N 0.46 0.51 -0.32 -1.71 0.11 -1.99 -3.11 132.00 125.95 1k2y h PRO 414 Ca -0.42 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1k2y h PRO 414 Cb 1.28 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1k2y h PRO 414 CO 0.50 0.34 0.00 1.63 -0.21 0.00 0.00 178.00 180.26 1k2y n LYS 415 N -4.48 2.88 -3.42 1.05 5.02 -1.26 -5.05 118.16 112.90 1k2y n LYS 415 Ca 0.08 -2.08 0.00 0.00 -2.02 0.00 0.00 58.31 54.29 1k2y n LYS 415 Cb 0.26 -1.30 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 1k2y n LYS 415 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1k2y n GLY 416 N 0.36 -1.38 3.49 0.72 0.00 -1.18 -0.93 105.19 106.28 1k2y n GLY 416 Ca 0.12 -1.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.04 1k2y n GLY 416 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1k2y s TRP 417 N -2.87 -0.18 0.02 1.61 1.48 0.05 -0.24 118.94 118.82 1k2y s TRP 417 Ca 0.00 -0.15 -0.01 0.00 -1.06 0.00 0.00 56.10 54.88 1k2y s TRP 417 Cb 0.00 0.40 -0.02 0.00 -1.16 0.00 0.00 33.47 32.69 1k2y s TRP 417 CO 0.00 -0.89 -0.00 0.20 -4.06 0.00 0.00 176.95 172.20 1k2y s GLY 418 N -2.85 0.25 -0.01 3.67 0.00 -0.72 -1.77 107.32 105.90 1k2y s GLY 418 Ca 0.07 -0.64 0.01 0.00 0.00 0.00 0.00 44.72 44.17 1k2y s GLY 418 CO -0.05 -0.72 -0.04 -2.27 0.00 0.00 0.00 173.10 170.02 1k2y s LEU 419 N -1.73 1.90 -0.05 0.66 2.96 -0.18 -0.91 118.68 121.32 1k2y s LEU 419 Ca -0.12 -0.08 0.01 0.00 -0.22 0.00 0.00 54.13 53.73 1k2y s LEU 419 Cb -0.06 -0.24 0.02 0.00 0.50 0.00 0.00 46.19 46.40 1k2y s LEU 419 CO -0.02 0.04 -0.05 0.54 -1.32 0.00 0.00 176.35 175.53 1k2y s VAL 420 N 0.05 0.61 0.11 1.68 0.11 -0.37 -1.83 120.40 120.77 1k2y s VAL 420 Ca -0.00 -0.15 -0.06 0.00 -2.93 0.00 0.00 61.98 58.83 1k2y s VAL 420 Cb -0.04 -0.63 -0.02 0.00 -1.53 0.00 0.00 36.38 34.17 1k2y s VAL 420 CO -0.00 0.25 0.15 0.00 -3.33 0.00 0.00 175.10 172.17 1k2y s ARG 421 N 0.98 0.90 0.03 1.54 1.70 -0.29 -0.59 118.95 123.22 1k2y s ARG 421 Ca -0.10 -1.15 -0.22 0.00 -0.47 0.00 0.00 55.73 53.80 1k2y s ARG 421 Cb -0.14 0.31 -0.06 0.00 -0.57 0.00 0.00 34.95 34.49 1k2y s ARG 421 CO -0.00 -0.28 0.65 0.00 -1.08 0.00 0.00 175.30 174.59 1k2y s ALA 422 N -3.93 3.47 0.41 7.88 0.00 -1.26 -0.30 121.76 128.02 1k2y s ALA 422 Ca 0.12 0.12 -0.27 0.00 0.00 0.00 0.00 51.96 51.93 1k2y s ALA 422 Cb 0.05 -2.81 -0.09 0.00 0.00 0.00 0.00 23.12 20.27 1k2y s ALA 422 CO -0.06 0.18 1.43 0.45 0.00 0.00 0.00 175.76 177.76 1k2y s SER 423 N -0.32 6.17 0.22 0.00 0.15 0.12 -4.90 113.70 115.13 1k2y s SER 423 Ca 0.33 2.93 0.25 0.00 0.70 0.00 0.00 55.95 60.16 1k2y s SER 423 Cb -0.19 -2.66 0.65 0.00 -1.71 0.00 0.00 66.02 62.11 1k2y s SER 423 CO 0.19 -0.98 1.65 0.78 1.20 0.00 0.00 173.24 176.09 1k2y h ASN 424 N 2.70 0.00 0.00 5.45 2.35 -1.97 -3.38 115.58 120.73 1k2y h ASN 424 Ca -0.51 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.20 1k2y h ASN 424 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.62 1k2y h ASN 424 CO 0.63 0.02 0.00 0.35 -1.65 0.00 0.00 177.43 176.78 1k2y n THR 425 N -2.33 0.02 -4.10 2.81 -2.24 -1.26 -5.04 114.28 102.14 1k2y n THR 425 Ca 0.05 -0.37 -0.07 0.00 -2.27 0.00 0.00 64.05 61.38 1k2y n THR 425 Cb 0.45 1.25 -0.10 0.00 -2.10 0.00 0.00 70.33 69.83 1k2y n THR 425 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1k2y s THR 426 N -0.02 0.26 -1.44 4.28 -4.23 -1.26 -5.06 115.64 108.16 1k2y s THR 426 Ca 0.00 -1.80 -0.12 0.00 -1.18 0.00 0.00 61.69 58.58 1k2y s THR 426 Cb 0.00 -1.51 0.05 0.00 1.34 0.00 0.00 72.50 72.38 1k2y s THR 426 CO 0.00 -0.98 2.26 -0.81 -0.54 0.00 0.00 174.62 174.55 1k2y n PRO 427 N 0.12 3.15 -3.85 3.99 -0.04 -1.26 -4.36 135.00 132.75 1k2y n PRO 427 Ca -0.14 -2.75 -0.12 0.00 -0.04 0.00 0.00 63.50 60.45 1k2y n PRO 427 Cb 0.61 -3.14 -0.12 0.00 -0.04 0.00 0.00 33.50 30.80 1k2y n PRO 427 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1k2y s VAL 428 N 2.42 0.02 -0.06 0.52 1.01 -1.26 -1.62 120.40 121.43 1k2y s VAL 428 Ca 0.49 -0.19 -0.12 0.00 0.00 0.00 0.00 61.98 62.16 1k2y s VAL 428 Cb 0.14 -0.21 -0.05 0.00 0.00 0.00 0.00 36.38 36.26 1k2y s VAL 428 CO -0.07 -0.10 0.30 -0.76 0.00 0.00 0.00 175.10 174.47 1k2y s LEU 429 N -0.30 4.42 -0.14 3.92 1.43 -0.25 -0.71 118.68 127.05 1k2y s LEU 429 Ca -0.04 0.74 0.01 0.00 -1.03 0.00 0.00 54.13 53.82 1k2y s LEU 429 Cb -0.03 -2.38 0.00 0.00 0.03 0.00 0.00 46.19 43.82 1k2y s LEU 429 CO 0.00 0.33 -0.18 -0.69 0.23 0.00 0.00 176.35 176.05 1k2y s VAL 430 N -0.91 2.46 0.09 -1.59 1.01 0.59 -0.62 120.40 121.43 1k2y s VAL 430 Ca 0.20 -0.85 0.07 0.00 0.00 0.00 0.00 61.98 61.40 1k2y s VAL 430 Cb -0.15 -2.01 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 1k2y s VAL 430 CO 0.09 0.53 -0.18 -0.76 0.00 0.00 0.00 175.10 174.78 1k2y s LEU 431 N 0.70 2.30 -0.00 3.92 1.02 0.36 -1.14 118.68 125.83 1k2y s LEU 431 Ca -0.08 -0.67 -0.02 0.00 0.02 0.00 0.00 54.13 53.37 1k2y s LEU 431 Cb -0.16 -0.72 -0.00 0.00 0.02 0.00 0.00 46.19 45.33 1k2y s LEU 431 CO 0.01 -0.01 0.04 -0.13 0.02 0.00 0.00 176.35 176.29 1k2y s ARG 432 N -1.91 0.24 0.01 1.70 0.52 -0.76 -0.68 118.95 118.07 1k2y s ARG 432 Ca 0.04 -0.26 0.00 0.00 -0.52 0.00 0.00 55.73 54.99 1k2y s ARG 432 Cb -0.10 0.09 -0.01 0.00 0.52 0.00 0.00 34.95 35.46 1k2y s ARG 432 CO 0.03 -0.04 -0.02 -0.06 0.02 0.00 0.00 175.30 175.23 1k2y s PHE 433 N -0.78 0.20 -0.03 -0.53 0.40 -1.26 -1.01 117.98 114.96 1k2y s PHE 433 Ca -0.09 -0.27 -0.13 0.00 -0.60 0.00 0.00 56.93 55.85 1k2y s PHE 433 Cb -0.05 -0.14 0.02 0.00 0.51 0.00 0.00 43.02 43.36 1k2y s PHE 433 CO -0.00 -0.09 0.27 -2.00 0.70 0.00 0.00 175.22 174.11 1k2y s GLU 434 N -0.75 0.58 0.21 0.44 2.12 -0.73 -2.02 118.70 118.55 1k2y s GLU 434 Ca -0.07 -0.13 -0.22 0.00 0.36 0.00 0.00 54.97 54.90 1k2y s GLU 434 Cb -0.05 0.26 0.05 0.00 0.26 0.00 0.00 34.13 34.64 1k2y s GLU 434 CO -0.00 -0.15 0.63 0.00 -0.54 0.00 0.00 175.26 175.20 1k2y s ALA 435 N -1.10 -1.39 -0.08 6.30 0.00 -0.07 -0.77 121.76 124.65 1k2y s ALA 435 Ca -0.12 0.13 0.24 0.00 0.00 0.00 0.00 51.96 52.21 1k2y s ALA 435 Cb -0.05 0.87 0.70 0.00 0.00 0.00 0.00 23.12 24.64 1k2y s ALA 435 CO 0.03 -0.87 1.73 0.38 0.00 0.00 0.00 175.76 177.03 1k2y h ASP 436 N 2.02 0.00 -4.31 0.00 3.04 -1.34 0.66 116.42 116.50 1k2y h ASP 436 Ca -0.28 0.00 -0.28 0.00 -3.24 0.00 0.00 57.03 53.23 1k2y h ASP 436 Cb 1.28 0.00 -0.15 0.00 -1.04 0.00 0.00 39.33 39.43 1k2y h ASP 436 CO 0.33 0.17 -0.69 0.42 -2.04 0.00 0.00 179.24 177.42 1k2y s THR 437 N -3.41 0.89 0.23 1.15 -4.23 -1.26 -4.62 115.64 104.40 1k2y s THR 437 Ca 0.03 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.47 1k2y s THR 437 Cb 0.08 -1.86 0.22 0.00 1.34 0.00 0.00 72.50 72.28 1k2y s THR 437 CO 0.65 -0.72 1.88 1.05 -0.54 0.00 0.00 174.62 176.93 1k2y h GLU 438 N 2.82 1.26 -0.46 3.99 9.09 -1.96 0.14 114.58 129.45 1k2y h GLU 438 Ca -0.36 -0.12 -0.01 0.00 0.05 0.00 0.00 59.36 58.92 1k2y h GLU 438 Cb 1.18 -0.26 -0.02 0.00 -1.65 0.00 0.00 28.75 28.00 1k2y h GLU 438 CO 0.64 0.88 0.23 1.49 0.05 0.00 0.00 179.01 182.31 1k2y h GLU 439 N 1.27 0.65 -0.33 1.06 4.81 -1.98 -1.01 114.58 119.04 1k2y h GLU 439 Ca 0.33 -0.09 -0.13 0.00 -0.13 0.00 0.00 59.36 59.34 1k2y h GLU 439 Cb -0.04 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 1k2y h GLU 439 CO -0.06 0.54 -0.31 1.49 -0.73 0.00 0.00 179.01 179.93 1k2y h GLU 440 N 0.60 0.71 -0.18 1.92 4.57 -1.87 -2.04 114.58 118.28 1k2y h GLU 440 Ca 0.16 -0.32 0.03 0.00 -1.18 0.00 0.00 59.36 58.04 1k2y h GLU 440 Cb 0.09 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.64 1k2y h GLU 440 CO -0.02 0.93 0.00 1.25 -1.18 0.00 0.00 179.01 179.99 1k2y h LEU 441 N 0.60 -0.07 -1.18 1.64 5.85 -0.68 -1.00 115.31 120.47 1k2y h LEU 441 Ca 0.07 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.80 1k2y h LEU 441 Cb 0.83 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.91 1k2y h LEU 441 CO 0.07 -0.01 0.19 -0.33 -0.34 0.00 0.00 178.44 178.02 1k2y h GLU 442 N 0.06 0.76 -0.31 1.25 4.39 -1.05 -1.08 114.58 118.60 1k2y h GLU 442 Ca 0.09 -0.12 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 1k2y h GLU 442 Cb 0.11 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 1k2y h GLU 442 CO -0.15 0.64 0.17 -0.09 -1.16 0.00 0.00 179.01 178.43 1k2y h ARG 443 N 0.75 0.43 -0.47 2.33 2.43 -0.87 -1.52 114.38 117.47 1k2y h ARG 443 Ca 0.18 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.20 1k2y h ARG 443 Cb 0.18 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1k2y h ARG 443 CO -0.01 0.37 -0.09 0.82 -1.51 0.00 0.00 179.97 179.54 1k2y h ILE 444 N 0.39 1.27 -0.95 1.20 2.04 -0.96 -1.69 117.51 118.81 1k2y h ILE 444 Ca 0.11 -1.20 0.05 0.00 1.00 0.00 0.00 64.86 64.81 1k2y h ILE 444 Cb 0.06 1.09 -0.06 0.00 -0.74 0.00 0.00 36.82 37.17 1k2y h ILE 444 CO -0.02 0.41 0.62 0.11 0.00 0.00 0.00 178.15 179.27 1k2y h LYS 445 N 0.73 1.12 -0.56 2.37 1.57 -1.10 -1.38 116.57 119.31 1k2y h LYS 445 Ca 0.12 -0.07 -0.10 0.00 -1.87 0.00 0.00 60.65 58.73 1k2y h LYS 445 Cb 0.63 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 1k2y h LYS 445 CO 0.04 0.74 -0.05 1.15 -0.57 0.00 0.00 179.45 180.76 1k2y h THR 446 N 1.15 1.26 -0.01 -0.16 2.02 -0.92 0.19 112.91 116.45 1k2y h THR 446 Ca 0.39 -1.18 0.00 0.00 0.77 0.00 0.00 66.41 66.39 1k2y h THR 446 Cb 0.08 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 1k2y h THR 446 CO -0.13 0.42 -0.02 0.58 0.37 0.00 0.00 175.52 176.74 1k2y h VAL 447 N 0.91 0.95 -0.55 3.16 2.07 -0.55 0.04 116.25 122.28 1k2y h VAL 447 Ca 0.16 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.61 1k2y h VAL 447 Cb 0.59 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 1k2y h VAL 447 CO 0.04 0.00 0.07 -0.26 0.02 0.00 0.00 177.57 177.44 1k2y h PHE 448 N -0.03 0.99 -0.31 1.57 -1.00 -1.08 -0.34 116.94 116.75 1k2y h PHE 448 Ca 0.01 -0.15 0.03 0.00 2.81 0.00 0.00 57.97 60.68 1k2y h PHE 448 Cb 0.04 -0.27 -0.03 0.00 3.61 0.00 0.00 35.95 39.30 1k2y h PHE 448 CO -0.10 0.88 0.11 -0.09 -1.61 0.00 0.00 178.31 177.50 1k2y h ARG 449 N 0.81 0.24 -0.41 1.51 2.43 -0.42 -0.70 114.38 117.85 1k2y h ARG 449 Ca 0.16 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.25 1k2y h ARG 449 Cb 0.44 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 1k2y h ARG 449 CO 0.01 0.16 -0.04 -0.91 -1.51 0.00 0.00 179.97 177.68 1k2y h ASN 450 N 0.25 0.65 0.11 -3.80 2.35 -0.76 -1.11 115.58 113.27 1k2y h ASN 450 Ca 0.14 -0.16 -0.16 0.00 -0.55 0.00 0.00 56.30 55.57 1k2y h ASN 450 Cb 0.10 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 1k2y h ASN 450 CO -0.13 0.74 -0.59 1.56 -1.65 0.00 0.00 177.43 177.36 1k2y h GLN 451 N 0.63 0.48 -0.32 0.81 1.08 -0.60 -1.37 115.11 115.82 1k2y h GLN 451 Ca 0.12 -0.32 -0.04 0.00 -1.45 0.00 0.00 58.65 56.96 1k2y h GLN 451 Cb 0.46 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.92 1k2y h GLN 451 CO 0.02 0.93 0.03 -0.07 -0.95 0.00 0.00 178.83 178.79 1k2y h LEU 452 N 0.36 0.53 -1.90 1.46 3.38 -0.89 -2.27 115.31 115.98 1k2y h LEU 452 Ca -0.00 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 1k2y h LEU 452 Cb 1.13 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.73 1k2y h LEU 452 CO 0.11 0.68 -0.12 0.11 0.09 0.00 0.00 178.44 179.31 1k2y h LYS 453 N 0.36 0.00 0.00 1.13 1.79 -1.13 -1.74 116.57 116.97 1k2y h LYS 453 Ca 0.09 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.51 1k2y h LYS 453 Cb 0.39 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.03 1k2y h LYS 453 CO 0.01 0.12 -0.26 0.00 -1.08 0.00 0.00 179.45 178.24 1k2y h ALA 454 N 1.88 0.93 0.01 3.86 0.00 -0.67 -1.90 119.26 123.37 1k2y h ALA 454 Ca -0.00 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 1k2y h ALA 454 Cb 0.34 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1k2y h ALA 454 CO 0.02 0.32 -0.01 0.28 0.00 0.00 0.00 179.25 179.86 1k2y h VAL 455 N 0.00 1.55 -2.53 0.00 2.07 -0.98 -3.44 116.25 112.91 1k2y h VAL 455 Ca -0.00 -1.86 -0.39 0.00 0.82 0.00 0.00 66.70 65.27 1k2y h VAL 455 Cb 0.93 2.78 -0.37 0.00 -1.52 0.00 0.00 31.29 33.12 1k2y h VAL 455 CO 0.03 0.47 -0.68 -0.62 0.02 0.00 0.00 177.57 176.79 1k2y s ASP 456 N -5.99 2.07 0.62 0.57 3.68 -0.90 -5.02 116.67 111.70 1k2y s ASP 456 Ca -0.17 -0.67 0.41 0.00 2.13 0.00 0.00 52.55 54.25 1k2y s ASP 456 Cb -0.01 0.18 2.21 0.00 -1.45 0.00 0.00 42.92 43.85 1k2y s ASP 456 CO 0.65 -0.37 2.24 0.77 0.13 0.00 0.00 175.17 178.59 1k2y h SER 457 N 8.33 0.00 -0.22 -0.34 4.64 -1.61 -1.27 113.55 123.09 1k2y h SER 457 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1k2y h SER 457 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1k2y h SER 457 CO 0.33 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 175.09 1k2y n SER 458 N -2.94 2.81 -4.76 4.97 7.64 -1.26 -4.97 113.62 115.11 1k2y n SER 458 Ca -0.03 -1.90 -0.41 0.00 1.01 0.00 0.00 58.87 57.55 1k2y n SER 458 Cb 0.08 -0.13 -0.02 0.00 -1.01 0.00 0.00 64.21 63.13 1k2y n SER 458 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1k2y s LEU 459 N -1.69 4.43 -0.51 -3.43 2.96 -0.48 -4.93 118.68 115.04 1k2y s LEU 459 Ca 0.35 2.59 -0.28 0.00 -0.22 0.00 0.00 54.13 56.57 1k2y s LEU 459 Cb 0.21 -3.64 0.01 0.00 0.50 0.00 0.00 46.19 43.27 1k2y s LEU 459 CO 0.30 -0.52 1.41 -2.16 -1.32 0.00 0.00 176.35 174.06 1k2y s PRO 460 N -1.22 3.40 -0.37 0.98 0.04 -1.26 -4.97 135.00 131.59 1k2y s PRO 460 Ca 0.52 0.63 -0.09 0.00 0.04 0.00 0.00 61.00 62.09 1k2y s PRO 460 Cb -0.39 -4.09 0.04 0.00 0.04 0.00 0.00 34.50 30.11 1k2y s PRO 460 CO 0.48 -1.80 0.18 0.08 0.04 0.00 0.00 177.00 175.98 1k2y s VAL 461 N 5.85 4.27 -0.13 -0.36 1.01 -1.26 -4.91 120.40 124.87 1k2y s VAL 461 Ca 0.56 -1.05 0.01 0.00 0.00 0.00 0.00 61.98 61.50 1k2y s VAL 461 Cb -0.12 -3.44 0.18 0.00 0.00 0.00 0.00 36.38 33.00 1k2y s VAL 461 CO 0.28 -0.27 1.23 -0.81 0.00 0.00 0.00 175.10 175.53 1k2y n PRO 462 N 4.93 1.34 0.00 2.72 -0.04 -1.26 -5.18 135.00 137.50 1k2y n PRO 462 Ca -0.12 -0.79 0.00 0.00 -0.04 0.00 0.00 63.50 62.56 1k2y n PRO 462 Cb 0.45 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 1k2y n PRO 462 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43