#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h5y s ALA 3 N 0.00 3.65 0.54 2.41 0.00 -1.26 -4.72 121.76 122.39 2h5y s ALA 3 Ca 0.00 1.31 -0.20 0.00 0.00 0.00 0.00 51.96 53.07 2h5y s ALA 3 Cb 0.00 -3.79 -0.06 0.00 0.00 0.00 0.00 23.12 19.27 2h5y s ALA 3 CO 0.00 -1.39 1.15 -1.25 0.00 0.00 0.00 175.76 174.27 2h5y s PRO 4 N 3.68 3.33 -0.02 0.00 0.04 -1.26 -4.74 135.00 136.03 2h5y s PRO 4 Ca 0.83 1.69 -0.30 0.00 0.04 0.00 0.00 61.00 63.26 2h5y s PRO 4 Cb -0.42 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.02 2h5y s PRO 4 CO 0.38 -0.89 1.38 0.08 0.04 0.00 0.00 177.00 177.99 2h5y s VAL 5 N -1.69 3.82 -0.35 -0.36 1.01 0.14 -4.79 120.40 118.17 2h5y s VAL 5 Ca 0.72 1.17 -0.18 0.00 0.00 0.00 0.00 61.98 63.70 2h5y s VAL 5 Cb -0.26 -3.75 -0.00 0.00 0.00 0.00 0.00 36.38 32.36 2h5y s VAL 5 CO 0.30 -0.02 0.50 -0.89 0.00 0.00 0.00 175.10 174.99 2h5y s THR 6 N 2.55 5.02 -0.17 3.92 2.01 -1.26 0.00 115.64 127.71 2h5y s THR 6 Ca 0.63 0.29 -0.02 0.00 0.31 0.00 0.00 61.69 62.90 2h5y s THR 6 Cb -0.30 -3.96 -0.01 0.00 0.01 0.00 0.00 72.50 68.24 2h5y s THR 6 CO 0.25 -0.22 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.18 2h5y s VAL 7 N 2.37 3.24 -0.32 3.82 1.01 0.48 0.48 120.40 131.49 2h5y s VAL 7 Ca 0.18 -0.57 -0.11 0.00 0.00 0.00 0.00 61.98 61.48 2h5y s VAL 7 Cb -0.16 -2.41 -0.02 0.00 0.00 0.00 0.00 36.38 33.80 2h5y s VAL 7 CO 0.13 0.49 0.18 -0.36 0.00 0.00 0.00 175.10 175.54 2h5y s PHE 8 N 0.77 3.20 -0.05 5.22 0.40 0.95 0.10 117.98 128.57 2h5y s PHE 8 Ca -0.04 -0.38 0.04 0.00 -0.60 0.00 0.00 56.93 55.95 2h5y s PHE 8 Cb -0.15 -2.40 0.00 0.00 0.51 0.00 0.00 43.02 40.99 2h5y s PHE 8 CO 0.01 -0.39 -0.16 0.00 0.70 0.00 0.00 175.22 175.38 2h5y s ALA 9 N 1.66 1.48 0.18 5.36 0.00 0.31 -0.05 121.76 130.70 2h5y s ALA 9 Ca 0.05 -0.62 -0.29 0.00 0.00 0.00 0.00 51.96 51.10 2h5y s ALA 9 Cb -0.17 -0.54 -0.17 0.00 0.00 0.00 0.00 23.12 22.24 2h5y s ALA 9 CO 0.08 0.23 0.59 0.00 0.00 0.00 0.00 175.76 176.66 2h5y n ALA 10 N 3.36 -2.92 -0.33 0.00 0.00 0.14 -3.00 120.51 117.76 2h5y n ALA 10 Ca -0.19 0.46 0.21 0.00 0.00 0.00 0.00 53.44 53.91 2h5y n ALA 10 Cb 0.53 -1.63 0.46 0.00 0.00 0.00 0.00 19.45 18.80 2h5y n ALA 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h5y h ALA 11 N 1.24 2.06 0.00 0.00 0.00 -0.92 0.25 119.26 121.88 2h5y h ALA 11 Ca -0.31 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2h5y h ALA 11 Cb 1.44 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.25 2h5y h ALA 11 CO 0.58 -0.49 0.00 -1.13 0.00 0.00 0.00 179.25 178.21 2h5y n SER 12 N -4.72 0.28 -0.61 0.00 3.41 -1.26 -1.66 113.62 109.05 2h5y n SER 12 Ca 0.26 0.59 0.09 0.00 -0.26 0.00 0.00 58.87 59.55 2h5y n SER 12 Cb 0.82 -0.64 0.31 0.00 -0.26 0.00 0.00 64.21 64.44 2h5y n SER 12 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2h5y n LEU 13 N -1.83 1.81 -0.15 1.04 4.77 0.86 -4.65 117.00 118.86 2h5y n LEU 13 Ca 0.02 -0.81 -0.06 0.00 -0.03 0.00 0.00 56.01 55.13 2h5y n LEU 13 Cb 0.14 -0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 41.02 2h5y n LEU 13 CO 0.12 0.40 0.49 0.50 -1.33 0.00 0.00 177.39 177.58 2h5y h LYS 14 N 2.26 -0.08 -0.07 3.23 1.63 -1.46 0.39 116.57 122.48 2h5y h LYS 14 Ca 0.00 0.01 -0.23 0.00 -0.85 0.00 0.00 60.65 59.58 2h5y h LYS 14 Cb 0.50 0.02 0.01 0.00 -0.60 0.00 0.00 32.23 32.16 2h5y h LYS 14 CO 0.00 -0.05 -0.87 0.93 -3.45 0.00 0.00 179.45 176.01 2h5y h GLU 15 N -0.08 0.62 -0.14 1.90 3.07 -1.87 -1.60 114.58 116.48 2h5y h GLU 15 Ca 0.06 -0.58 -0.02 0.00 -0.50 0.00 0.00 59.36 58.33 2h5y h GLU 15 Cb 0.24 0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.29 2h5y h GLU 15 CO -0.40 1.19 0.01 0.66 -1.40 0.00 0.00 179.01 179.07 2h5y h SER 16 N 0.40 0.23 0.28 1.42 4.64 -1.80 0.19 113.55 118.91 2h5y h SER 16 Ca -0.07 -0.29 -0.13 0.00 -0.47 0.00 0.00 61.79 60.83 2h5y h SER 16 Cb 1.49 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 63.51 2h5y h SER 16 CO 0.17 0.46 -0.51 0.24 -0.87 0.00 0.00 176.83 176.31 2h5y h MET 17 N -0.00 0.26 -0.31 4.77 2.86 -0.25 0.29 114.93 122.55 2h5y h MET 17 Ca 0.04 -0.15 0.02 0.00 -2.06 0.00 0.00 59.70 57.55 2h5y h MET 17 Cb 0.33 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 2h5y h MET 17 CO 0.00 0.71 0.16 -0.44 1.06 0.00 0.00 176.91 178.41 2h5y h ASP 18 N 0.21 0.24 -0.45 1.22 3.45 -1.13 0.44 116.42 120.40 2h5y h ASP 18 Ca 0.01 0.01 -0.00 0.00 0.43 0.00 0.00 57.03 57.47 2h5y h ASP 18 Cb 0.98 -0.04 -0.02 0.00 -0.56 0.00 0.00 39.33 39.69 2h5y h ASP 18 CO 0.08 0.18 0.27 -0.08 -1.57 0.00 0.00 179.24 178.12 2h5y h GLU 19 N 0.33 0.62 -0.56 3.56 4.81 -0.45 -1.68 114.58 121.21 2h5y h GLU 19 Ca 0.12 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 2h5y h GLU 19 Cb 0.03 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.26 2h5y h GLU 19 CO -0.08 0.47 0.27 0.00 -0.73 0.00 0.00 179.01 178.94 2h5y h ALA 20 N 1.12 0.72 -0.50 2.92 0.00 -0.08 0.77 119.26 124.21 2h5y h ALA 20 Ca 0.16 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.98 2h5y h ALA 20 Cb 0.01 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 2h5y h ALA 20 CO -0.03 0.28 0.28 0.00 0.00 0.00 0.00 179.25 179.79 2h5y h ALA 21 N 1.11 0.64 -0.35 0.00 0.00 0.07 0.38 119.26 121.11 2h5y h ALA 21 Ca 0.19 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 2h5y h ALA 21 Cb 0.12 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2h5y h ALA 21 CO -0.02 -0.04 0.07 1.15 0.00 0.00 0.00 179.25 180.41 2h5y h THR 22 N 0.56 1.23 -0.64 0.00 2.02 -0.90 -1.98 112.91 113.19 2h5y h THR 22 Ca 0.21 -0.79 -0.08 0.00 0.77 0.00 0.00 66.41 66.52 2h5y h THR 22 Cb 0.06 1.08 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 2h5y h THR 22 CO -0.12 0.27 0.08 0.00 0.37 0.00 0.00 175.52 176.12 2h5y h ALA 23 N 0.92 0.93 -0.19 6.16 0.00 -0.36 0.01 119.26 126.72 2h5y h ALA 23 Ca 0.11 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 2h5y h ALA 23 Cb 0.33 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2h5y h ALA 23 CO 0.00 0.66 0.10 -0.92 0.00 0.00 0.00 179.25 179.10 2h5y h TYR 24 N 1.00 0.27 -0.54 0.00 3.20 -0.10 -1.12 116.97 119.68 2h5y h TYR 24 Ca 0.19 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.02 2h5y h TYR 24 Cb 0.46 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.62 2h5y h TYR 24 CO 0.03 0.26 0.18 1.49 -1.64 0.00 0.00 178.16 178.48 2h5y h GLU 25 N 0.20 0.80 -0.59 1.82 4.81 -1.04 0.17 114.58 120.75 2h5y h GLU 25 Ca 0.07 -0.14 0.02 0.00 -0.13 0.00 0.00 59.36 59.18 2h5y h GLU 25 Cb 0.08 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.29 2h5y h GLU 25 CO -0.01 0.68 0.37 -0.22 -0.73 0.00 0.00 179.01 179.10 2h5y h LYS 26 N 0.78 0.72 -0.14 1.92 3.64 -0.48 0.71 116.57 123.72 2h5y h LYS 26 Ca 0.18 -0.04 -0.19 0.00 -1.27 0.00 0.00 60.65 59.33 2h5y h LYS 26 Cb 0.21 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 2h5y h LYS 26 CO -0.01 0.47 -0.68 0.00 -2.27 0.00 0.00 179.45 176.96 2h5y h ALA 27 N 1.25 0.56 0.00 5.00 0.00 -0.26 -3.38 119.26 122.43 2h5y h ALA 27 Ca 0.23 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2h5y h ALA 27 Cb -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2h5y h ALA 27 CO -0.09 0.72 -0.74 0.25 0.00 0.00 0.00 179.25 179.39 2h5y n THR 28 N -3.90 0.00 -0.99 0.00 -2.24 -0.04 -4.99 114.28 102.12 2h5y n THR 28 Ca -0.05 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 2h5y n THR 28 Cb 0.68 0.64 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 2h5y n THR 28 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2h5y n GLY 29 N 1.95 0.99 3.61 3.38 0.00 0.24 -5.00 105.19 110.37 2h5y n GLY 29 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2h5y n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2h5y s THR 30 N -3.94 4.90 0.59 2.61 2.01 -1.26 -4.98 115.64 115.58 2h5y s THR 30 Ca 0.00 1.02 -0.18 0.00 0.31 0.00 0.00 61.69 62.83 2h5y s THR 30 Cb 0.00 -4.04 -0.03 0.00 0.01 0.00 0.00 72.50 68.44 2h5y s THR 30 CO 0.00 -0.15 1.16 -2.16 -0.69 0.00 0.00 174.62 172.78 2h5y s PRO 31 N 2.70 3.04 -0.08 4.92 0.04 -1.26 -3.43 135.00 140.92 2h5y s PRO 31 Ca 0.28 1.66 0.02 0.00 0.04 0.00 0.00 61.00 63.00 2h5y s PRO 31 Cb -0.15 -1.96 0.01 0.00 0.04 0.00 0.00 34.50 32.45 2h5y s PRO 31 CO 0.11 -1.12 -0.14 0.08 0.04 0.00 0.00 177.00 175.98 2h5y s VAL 32 N -1.82 1.29 -0.24 -0.36 1.01 -1.26 -0.69 120.40 118.33 2h5y s VAL 32 Ca 0.74 -0.55 -0.03 0.00 0.00 0.00 0.00 61.98 62.14 2h5y s VAL 32 Cb -0.26 -1.17 0.01 0.00 0.00 0.00 0.00 36.38 34.96 2h5y s VAL 32 CO 0.33 0.39 -0.05 -0.13 0.00 0.00 0.00 175.10 175.64 2h5y s ARG 33 N 0.74 3.04 -0.12 2.72 1.81 0.10 -4.86 118.95 122.38 2h5y s ARG 33 Ca -0.13 -0.85 -0.03 0.00 -1.72 0.00 0.00 55.73 53.00 2h5y s ARG 33 Cb -0.16 -3.00 -0.03 0.00 -0.45 0.00 0.00 34.95 31.30 2h5y s ARG 33 CO 0.03 -0.33 0.01 0.08 -0.68 0.00 0.00 175.30 174.41 2h5y s VAL 34 N 1.39 4.37 -0.08 3.52 1.01 -1.26 -0.38 120.40 128.96 2h5y s VAL 34 Ca 0.02 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 61.83 2h5y s VAL 34 Cb -0.16 -2.88 -0.01 0.00 0.00 0.00 0.00 36.38 33.33 2h5y s VAL 34 CO -0.04 0.56 -0.19 -0.44 0.00 0.00 0.00 175.10 175.00 2h5y s SER 35 N -0.46 3.59 0.04 3.32 0.01 0.11 -4.95 113.70 115.37 2h5y s SER 35 Ca 0.08 -0.38 0.08 0.00 1.31 0.00 0.00 55.95 57.04 2h5y s SER 35 Cb -0.12 -1.15 -0.03 0.00 0.21 0.00 0.00 66.02 64.93 2h5y s SER 35 CO 0.02 0.23 -0.20 -0.31 0.41 0.00 0.00 173.24 173.39 2h5y s TYR 36 N -0.08 2.50 0.16 2.43 2.02 -1.26 -0.53 117.35 122.59 2h5y s TYR 36 Ca -0.04 -0.30 -0.23 0.00 -0.37 0.00 0.00 57.07 56.13 2h5y s TYR 36 Cb -0.14 -1.44 0.08 0.00 -0.40 0.00 0.00 41.96 40.05 2h5y s TYR 36 CO 0.04 0.22 1.05 0.00 -1.57 0.00 0.00 175.55 175.30 2h5y s ALA 37 N -0.90 -1.68 0.42 3.71 0.00 -1.16 -4.90 121.76 117.25 2h5y s ALA 37 Ca 0.14 -0.18 -0.25 0.00 0.00 0.00 0.00 51.96 51.68 2h5y s ALA 37 Cb -0.10 0.72 -0.10 0.00 0.00 0.00 0.00 23.12 23.64 2h5y s ALA 37 CO 0.04 -1.06 1.09 0.00 0.00 0.00 0.00 175.76 175.83 2h5y n ALA 38 N -0.66 0.52 -0.22 0.00 0.00 -1.26 -0.23 120.51 118.67 2h5y n ALA 38 Ca -0.03 0.24 0.12 0.00 0.00 0.00 0.00 53.44 53.77 2h5y n ALA 38 Cb 0.60 -2.14 0.42 0.00 0.00 0.00 0.00 19.45 18.32 2h5y n ALA 38 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2h5y h SER 39 N 1.71 0.57 0.05 0.00 0.02 -1.90 -0.76 113.55 113.25 2h5y h SER 39 Ca -0.45 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 60.54 2h5y h SER 39 Cb 1.32 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.75 2h5y h SER 39 CO 0.58 0.30 -0.16 0.77 -1.14 0.00 0.00 176.83 177.18 2h5y h SER 40 N 0.61 -0.46 -0.43 3.07 4.64 -1.89 0.18 113.55 119.28 2h5y h SER 40 Ca 0.40 0.06 0.01 0.00 -0.47 0.00 0.00 61.79 61.79 2h5y h SER 40 Cb 0.68 0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.93 2h5y h SER 40 CO -0.16 -0.23 0.26 0.00 -0.87 0.00 0.00 176.83 175.84 2h5y h ALA 41 N 0.59 0.54 -0.17 5.18 0.00 -1.53 0.01 119.26 123.88 2h5y h ALA 41 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2h5y h ALA 41 Cb 0.33 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2h5y h ALA 41 CO -0.12 -0.05 0.11 -0.07 0.00 0.00 0.00 179.25 179.13 2h5y h LEU 42 N 0.54 0.20 -0.58 0.00 3.38 -1.08 0.26 115.31 118.03 2h5y h LEU 42 Ca 0.16 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 2h5y h LEU 42 Cb -0.02 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 2h5y h LEU 42 CO -0.06 0.15 0.35 0.00 0.09 0.00 0.00 178.44 178.97 2h5y h ALA 43 N 1.06 0.74 -0.75 1.53 0.00 -0.28 0.45 119.26 122.01 2h5y h ALA 43 Ca 0.06 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2h5y h ALA 43 Cb -0.02 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 2h5y h ALA 43 CO -0.01 0.23 0.31 0.00 0.00 0.00 0.00 179.25 179.77 2h5y h ARG 44 N 0.79 1.12 -0.62 0.00 3.08 -0.53 0.25 114.38 118.47 2h5y h ARG 44 Ca 0.21 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 2h5y h ARG 44 Cb -0.01 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 29.82 2h5y h ARG 44 CO -0.04 0.91 0.36 1.96 -1.07 0.00 0.00 179.97 182.09 2h5y h GLN 45 N 1.08 0.86 -0.12 0.04 4.20 0.03 0.48 115.11 121.68 2h5y h GLN 45 Ca 0.25 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.87 2h5y h GLN 45 Cb 0.20 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 2h5y h GLN 45 CO -0.02 0.63 0.05 0.82 -0.67 0.00 0.00 178.83 179.64 2h5y h ILE 46 N 0.85 1.15 -0.96 2.54 2.04 -0.26 0.92 117.51 123.77 2h5y h ILE 46 Ca 0.22 -0.45 0.18 0.00 1.00 0.00 0.00 64.86 65.81 2h5y h ILE 46 Cb 0.01 1.22 -0.09 0.00 -0.74 0.00 0.00 36.82 37.22 2h5y h ILE 46 CO -0.04 0.14 0.61 -0.08 0.00 0.00 0.00 178.15 178.78 2h5y h GLU 47 N 0.04 0.67 -0.04 2.37 4.22 -0.16 0.48 114.58 122.15 2h5y h GLU 47 Ca 0.04 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.44 2h5y h GLU 47 Cb 0.17 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2h5y h GLU 47 CO -0.00 0.44 0.00 1.04 -2.18 0.00 0.00 179.01 178.31 2h5y n GLN 48 N -4.64 1.38 0.00 1.92 6.02 0.13 -4.87 117.38 117.31 2h5y n GLN 48 Ca 0.21 -0.56 0.00 0.00 -0.01 0.00 0.00 57.00 56.64 2h5y n GLN 48 Cb 0.57 -1.43 0.00 0.00 1.02 0.00 0.00 30.24 30.40 2h5y n GLN 48 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2h5y n GLY 49 N 1.05 1.28 3.73 1.08 0.00 0.16 -5.06 105.19 107.42 2h5y n GLY 49 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2h5y n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h5y s ALA 50 N -2.00 3.87 -1.04 4.61 0.00 0.26 -4.82 121.76 122.64 2h5y s ALA 50 Ca 0.00 1.56 -0.08 0.00 0.00 0.00 0.00 51.96 53.44 2h5y s ALA 50 Cb 0.00 -3.68 -0.09 0.00 0.00 0.00 0.00 23.12 19.35 2h5y s ALA 50 CO 0.00 -0.92 3.04 -0.35 0.00 0.00 0.00 175.76 177.53 2h5y n PRO 51 N 3.50 3.27 -2.23 0.00 -0.04 -1.26 -4.58 135.00 133.67 2h5y n PRO 51 Ca 0.14 -2.08 -0.38 0.00 -0.04 0.00 0.00 63.50 61.13 2h5y n PRO 51 Cb 0.36 -2.50 -0.01 0.00 -0.04 0.00 0.00 33.50 31.31 2h5y n PRO 51 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2h5y s ALA 52 N 1.01 3.12 -0.15 0.55 0.00 -1.26 -4.83 121.76 120.20 2h5y s ALA 52 Ca 0.66 1.02 0.04 0.00 0.00 0.00 0.00 51.96 53.68 2h5y s ALA 52 Cb 0.24 -3.41 -0.23 0.00 0.00 0.00 0.00 23.12 19.72 2h5y s ALA 52 CO -0.06 -0.64 0.24 -0.25 0.00 0.00 0.00 175.76 175.04 2h5y n ASP 53 N -0.07 1.41 -4.02 0.00 8.00 0.18 -4.55 116.55 117.50 2h5y n ASP 53 Ca 0.05 0.13 -0.16 0.00 0.71 0.00 0.00 54.79 55.52 2h5y n ASP 53 Cb 0.46 -0.23 -0.14 0.00 -0.02 0.00 0.00 41.12 41.20 2h5y n ASP 53 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2h5y s VAL 54 N -2.55 0.57 -0.06 2.53 1.01 -0.31 -0.13 120.40 121.46 2h5y s VAL 54 Ca -0.19 -0.56 0.03 0.00 0.00 0.00 0.00 61.98 61.26 2h5y s VAL 54 Cb 0.07 -0.53 0.00 0.00 0.00 0.00 0.00 36.38 35.93 2h5y s VAL 54 CO 0.75 -0.01 -0.16 0.12 0.00 0.00 0.00 175.10 175.80 2h5y s PHE 55 N -0.55 1.73 -0.18 5.22 5.36 -0.31 -0.03 117.98 129.22 2h5y s PHE 55 Ca -0.01 -0.60 0.01 0.00 -0.96 0.00 0.00 56.93 55.37 2h5y s PHE 55 Cb -0.05 -1.20 0.02 0.00 -0.34 0.00 0.00 43.02 41.45 2h5y s PHE 55 CO 0.00 -0.25 -0.18 -0.51 -1.46 0.00 0.00 175.22 172.82 2h5y s LEU 56 N 0.36 2.09 0.14 6.12 1.02 0.93 -0.95 118.68 128.38 2h5y s LEU 56 Ca -0.11 -0.65 0.04 0.00 0.02 0.00 0.00 54.13 53.42 2h5y s LEU 56 Cb -0.14 -1.40 -0.04 0.00 0.02 0.00 0.00 46.19 44.63 2h5y s LEU 56 CO 0.04 -0.03 0.18 -0.55 0.02 0.00 0.00 176.35 176.01 2h5y s SER 57 N 1.34 5.84 0.00 2.29 0.15 -0.76 -0.68 113.70 121.88 2h5y s SER 57 Ca 0.04 0.01 0.29 0.00 0.70 0.00 0.00 55.95 56.99 2h5y s SER 57 Cb -0.13 -1.63 1.38 0.00 -1.71 0.00 0.00 66.02 63.92 2h5y s SER 57 CO -0.12 0.08 1.93 0.00 1.20 0.00 0.00 173.24 176.33 2h5y n ALA 58 N -0.30 2.62 -2.52 5.45 0.00 -1.26 -3.26 120.51 121.23 2h5y n ALA 58 Ca -0.08 -0.35 -0.09 0.00 0.00 0.00 0.00 53.44 52.93 2h5y n ALA 58 Cb 0.54 -1.30 -0.08 0.00 0.00 0.00 0.00 19.45 18.61 2h5y n ALA 58 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2h5y s ASP 59 N -1.98 0.14 0.26 0.00 1.47 -1.17 -4.10 116.67 111.29 2h5y s ASP 59 Ca 0.42 -0.91 0.05 0.00 1.18 0.00 0.00 52.55 53.28 2h5y s ASP 59 Cb 0.21 0.37 0.33 0.00 -0.34 0.00 0.00 42.92 43.49 2h5y s ASP 59 CO 0.34 -0.81 1.62 -0.07 0.68 0.00 0.00 175.17 176.94 2h5y h LEU 60 N 2.69 0.28 -0.93 2.11 3.38 -1.90 -3.30 115.31 117.65 2h5y h LEU 60 Ca -0.33 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 57.51 2h5y h LEU 60 Cb 1.21 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.83 2h5y h LEU 60 CO 0.53 0.75 0.61 -0.33 0.09 0.00 0.00 178.44 180.09 2h5y h GLU 61 N 0.21 1.20 0.00 1.13 5.08 -1.95 0.34 114.58 120.58 2h5y h GLU 61 Ca 0.01 -0.07 -0.11 0.00 -1.00 0.00 0.00 59.36 58.18 2h5y h GLU 61 Cb 0.98 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 2h5y h GLU 61 CO 0.08 0.79 -0.53 -1.49 -1.00 0.00 0.00 179.01 176.86 2h5y h TRP 62 N 1.23 0.00 -0.27 4.33 4.06 -1.95 0.80 115.95 124.15 2h5y h TRP 62 Ca 0.35 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 61.17 2h5y h TRP 62 Cb -0.10 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.05 2h5y h TRP 62 CO -0.01 0.53 -0.33 1.98 -3.56 0.00 0.00 178.44 177.06 2h5y h MET 63 N 0.00 0.71 -0.90 0.49 4.05 -1.27 -2.73 114.93 115.27 2h5y h MET 63 Ca -0.01 -0.39 0.10 0.00 -0.28 0.00 0.00 59.70 59.12 2h5y h MET 63 Cb 1.05 0.02 -0.08 0.00 -0.80 0.00 0.00 31.60 31.80 2h5y h MET 63 CO 0.07 1.01 0.54 -0.44 0.23 0.00 0.00 176.91 178.32 2h5y h ASP 64 N 0.44 0.79 -0.11 1.39 3.45 0.04 0.11 116.42 122.53 2h5y h ASP 64 Ca 0.04 0.04 0.04 0.00 0.43 0.00 0.00 57.03 57.58 2h5y h ASP 64 Cb 0.91 -0.12 -0.04 0.00 -0.56 0.00 0.00 39.33 39.52 2h5y h ASP 64 CO 0.08 0.45 -0.13 0.22 -1.57 0.00 0.00 179.24 178.29 2h5y h TYR 65 N 0.90 -0.34 -0.63 4.55 3.20 -0.72 0.57 116.97 124.50 2h5y h TYR 65 Ca 0.43 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 62.25 2h5y h TYR 65 Cb 0.37 0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.78 2h5y h TYR 65 CO -0.04 -0.20 0.14 -0.07 -1.64 0.00 0.00 178.16 176.36 2h5y h LEU 66 N -0.17 0.94 -0.52 2.82 3.38 -1.05 -0.53 115.31 120.17 2h5y h LEU 66 Ca 0.08 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2h5y h LEU 66 Cb 0.29 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 2h5y h LEU 66 CO -0.21 0.91 0.34 -0.61 0.09 0.00 0.00 178.44 178.96 2h5y h GLN 67 N 0.95 0.69 -0.24 1.13 4.15 0.04 0.63 115.11 122.46 2h5y h GLN 67 Ca 0.20 -0.05 -0.04 0.00 0.77 0.00 0.00 58.65 59.53 2h5y h GLN 67 Cb 0.35 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.88 2h5y h GLN 67 CO 0.00 0.47 -0.04 1.96 -1.93 0.00 0.00 178.83 179.29 2h5y h GLN 68 N 0.70 0.37 -0.00 1.69 4.20 0.71 0.40 115.11 123.17 2h5y h GLN 68 Ca 0.19 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.83 2h5y h GLN 68 Cb -0.06 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.66 2h5y h GLN 68 CO -0.04 0.43 0.00 0.72 -0.67 0.00 0.00 178.83 179.27 2h5y n HIS 69 N -4.30 0.00 -1.01 2.96 8.25 -0.26 -4.89 115.22 115.96 2h5y n HIS 69 Ca 0.00 -0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2h5y n HIS 69 Cb 0.23 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.34 2h5y n HIS 69 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2h5y n GLY 70 N 1.03 0.46 0.02 -1.41 0.00 0.13 -4.90 105.19 100.52 2h5y n GLY 70 Ca 0.23 -0.46 0.11 0.00 0.00 0.00 0.00 46.02 45.90 2h5y n GLY 70 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2h5y n LEU 71 N -0.04 0.63 -3.96 0.99 4.77 0.11 -4.80 117.00 114.70 2h5y n LEU 71 Ca -0.00 -0.08 -0.20 0.00 -0.03 0.00 0.00 56.01 55.69 2h5y n LEU 71 Cb 0.02 -0.09 -0.16 0.00 -2.33 0.00 0.00 43.42 40.86 2h5y n LEU 71 CO 0.01 0.08 -0.43 -0.69 -1.33 0.00 0.00 177.39 175.02 2h5y s VAL 72 N -3.17 0.72 0.01 4.08 1.01 -1.16 -0.59 120.40 121.29 2h5y s VAL 72 Ca 0.04 -0.29 -0.16 0.00 0.00 0.00 0.00 61.98 61.58 2h5y s VAL 72 Cb 0.15 -0.67 -0.06 0.00 0.00 0.00 0.00 36.38 35.80 2h5y s VAL 72 CO 0.81 0.24 0.45 -0.76 0.00 0.00 0.00 175.10 175.84 2h5y s LEU 73 N 0.48 4.47 0.49 3.92 1.43 -1.26 -4.18 118.68 124.03 2h5y s LEU 73 Ca -0.07 1.02 0.21 0.00 -1.03 0.00 0.00 54.13 54.25 2h5y s LEU 73 Cb -0.11 -2.67 1.25 0.00 0.03 0.00 0.00 46.19 44.69 2h5y s LEU 73 CO 0.01 0.28 1.98 1.55 0.23 0.00 0.00 176.35 180.41 2h5y h PRO 74 N 4.87 0.16 0.00 1.29 0.13 -1.95 0.15 132.00 136.65 2h5y h PRO 74 Ca -0.50 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 64.60 2h5y h PRO 74 Cb 1.21 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 2h5y h PRO 74 CO 0.63 0.10 -0.08 0.00 -0.23 0.00 0.00 178.00 178.42 2h5y h ALA 75 N 1.72 1.16 -0.54 -0.56 0.00 -2.00 -2.67 119.26 116.36 2h5y h ALA 75 Ca 0.27 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2h5y h ALA 75 Cb 0.84 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2h5y h ALA 75 CO -0.04 0.11 0.00 1.04 0.00 0.00 0.00 179.25 180.36 2h5y n GLN 76 N -3.42 2.91 -4.67 0.00 6.02 0.52 -4.90 117.38 113.84 2h5y n GLN 76 Ca -0.01 -2.44 -0.29 0.00 -0.01 0.00 0.00 57.00 54.25 2h5y n GLN 76 Cb 0.24 -1.49 -0.14 0.00 1.02 0.00 0.00 30.24 29.87 2h5y n GLN 76 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 2h5y s ARG 77 N -1.17 1.59 0.12 -1.09 1.70 -1.01 -1.93 118.95 117.16 2h5y s ARG 77 Ca 0.38 -1.19 -0.24 0.00 -0.47 0.00 0.00 55.73 54.22 2h5y s ARG 77 Cb 0.21 -1.88 0.07 0.00 -0.57 0.00 0.00 34.95 32.78 2h5y s ARG 77 CO 0.24 0.47 0.59 -3.38 -1.08 0.00 0.00 175.30 172.14 2h5y s HIS 78 N -0.91 -0.53 -0.01 5.89 -3.43 -0.22 -4.97 115.29 111.11 2h5y s HIS 78 Ca 0.12 0.43 -0.30 0.00 -0.80 0.00 0.00 55.06 54.51 2h5y s HIS 78 Cb -0.10 0.50 -0.04 0.00 -1.43 0.00 0.00 32.58 31.52 2h5y s HIS 78 CO 0.04 -0.79 1.11 -0.80 -2.00 0.00 0.00 174.74 172.30 2h5y s ASN 79 N -2.47 7.18 -0.12 7.38 0.01 -1.26 -0.47 114.94 125.18 2h5y s ASN 79 Ca -0.01 1.80 -0.02 0.00 -0.71 0.00 0.00 52.86 53.92 2h5y s ASN 79 Cb -0.01 -2.57 -0.07 0.00 0.41 0.00 0.00 41.25 39.02 2h5y s ASN 79 CO -0.09 -0.43 -0.13 -0.11 -1.51 0.00 0.00 177.10 174.83 2h5y n LEU 80 N 4.36 2.19 -4.11 0.60 7.94 0.11 -4.60 117.00 123.50 2h5y n LEU 80 Ca 0.09 0.02 -0.09 0.00 -1.11 0.00 0.00 56.01 54.92 2h5y n LEU 80 Cb 0.48 -0.40 -0.10 0.00 0.53 0.00 0.00 43.42 43.92 2h5y n LEU 80 CO 0.54 0.54 -0.37 -0.76 -1.11 0.00 0.00 177.39 176.23 2h5y s LEU 81 N -6.08 2.47 0.30 -1.96 1.43 -0.98 -0.79 118.68 113.07 2h5y s LEU 81 Ca -0.17 -0.95 0.03 0.00 -1.03 0.00 0.00 54.13 52.01 2h5y s LEU 81 Cb 0.05 0.09 -0.05 0.00 0.03 0.00 0.00 46.19 46.31 2h5y s LEU 81 CO 0.26 -0.52 0.10 -0.83 0.23 0.00 0.00 176.35 175.59 2h5y s GLY 82 N -2.80 1.98 0.34 -3.19 0.00 0.77 -0.09 107.32 104.34 2h5y s GLY 82 Ca 0.06 -1.84 -0.08 0.00 0.00 0.00 0.00 44.72 42.86 2h5y s GLY 82 CO -0.07 -1.68 0.57 0.21 0.00 0.00 0.00 173.10 172.12 2h5y s ASN 83 N -3.41 0.48 0.38 1.64 3.84 -1.04 -1.19 114.94 115.64 2h5y s ASN 83 Ca 0.36 -1.29 0.08 0.00 0.21 0.00 0.00 52.86 52.22 2h5y s ASN 83 Cb 0.07 0.71 -0.06 0.00 -0.55 0.00 0.00 41.25 41.41 2h5y s ASN 83 CO 0.15 -1.39 0.03 0.42 -2.79 0.00 0.00 177.10 173.52 2h5y s THR 84 N -3.01 2.29 -0.14 -5.21 -4.23 -1.26 -4.42 115.64 99.66 2h5y s THR 84 Ca 0.25 -1.97 -0.02 0.00 -1.18 0.00 0.00 61.69 58.76 2h5y s THR 84 Cb -0.02 -2.87 -0.02 0.00 1.34 0.00 0.00 72.50 70.92 2h5y s THR 84 CO 0.16 -0.10 -0.06 -0.22 -0.54 0.00 0.00 174.62 173.86 2h5y s LEU 85 N -3.73 3.11 0.09 4.79 2.96 -1.26 -0.58 118.68 124.06 2h5y s LEU 85 Ca 0.36 -0.17 0.07 0.00 -0.22 0.00 0.00 54.13 54.16 2h5y s LEU 85 Cb 0.04 -1.73 -0.03 0.00 0.50 0.00 0.00 46.19 44.97 2h5y s LEU 85 CO 0.19 0.18 -0.17 0.68 -1.32 0.00 0.00 176.35 175.91 2h5y s VAL 86 N 0.27 1.43 -0.20 1.68 -7.23 0.81 -0.24 120.40 116.91 2h5y s VAL 86 Ca -0.05 -1.47 -0.16 0.00 -1.81 0.00 0.00 61.98 58.49 2h5y s VAL 86 Cb -0.14 -1.36 -0.04 0.00 0.56 0.00 0.00 36.38 35.40 2h5y s VAL 86 CO 0.04 -0.17 0.40 -0.22 -0.31 0.00 0.00 175.10 174.84 2h5y s LEU 87 N -1.91 4.16 0.22 1.32 2.96 0.12 -0.93 118.68 124.61 2h5y s LEU 87 Ca 0.03 0.52 0.10 0.00 -0.22 0.00 0.00 54.13 54.57 2h5y s LEU 87 Cb -0.09 -2.52 -0.05 0.00 0.50 0.00 0.00 46.19 44.03 2h5y s LEU 87 CO 0.03 -0.08 -0.19 0.68 -1.32 0.00 0.00 176.35 175.47 2h5y s VAL 88 N 1.31 2.12 0.15 1.68 -7.23 0.70 0.41 120.40 119.54 2h5y s VAL 88 Ca 0.19 -2.16 0.01 0.00 -1.81 0.00 0.00 61.98 58.21 2h5y s VAL 88 Cb -0.15 -2.09 -0.04 0.00 0.56 0.00 0.00 36.38 34.66 2h5y s VAL 88 CO 0.08 -0.36 0.01 0.00 -0.31 0.00 0.00 175.10 174.52 2h5y s ALA 89 N -2.31 1.15 0.66 1.32 0.00 -0.25 -0.71 121.76 121.61 2h5y s ALA 89 Ca 0.23 -1.52 -0.17 0.00 0.00 0.00 0.00 51.96 50.49 2h5y s ALA 89 Cb -0.05 0.59 -0.03 0.00 0.00 0.00 0.00 23.12 23.63 2h5y s ALA 89 CO 0.10 -0.36 0.89 -2.30 0.00 0.00 0.00 175.76 174.09 2h5y n PRO 90 N -0.17 0.67 -0.19 0.00 -0.02 -1.26 0.12 135.00 134.15 2h5y n PRO 90 Ca -0.07 0.27 0.15 0.00 -2.02 0.00 0.00 63.50 61.84 2h5y n PRO 90 Cb 0.63 -2.12 0.49 0.00 -0.02 0.00 0.00 33.50 32.47 2h5y n PRO 90 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2h5y h ALA 91 N 0.11 2.08 0.00 3.55 0.00 -0.93 0.29 119.26 124.36 2h5y h ALA 91 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2h5y h ALA 91 Cb 1.36 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2h5y h ALA 91 CO 0.48 -0.30 -0.15 -1.13 0.00 0.00 0.00 179.25 178.16 2h5y n SER 92 N -4.49 0.15 -4.77 0.00 3.41 -1.26 -4.81 113.62 101.84 2h5y n SER 92 Ca 0.15 0.28 -0.41 0.00 -0.26 0.00 0.00 58.87 58.64 2h5y n SER 92 Cb 0.54 -0.28 -0.01 0.00 -0.26 0.00 0.00 64.21 64.20 2h5y n SER 92 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2h5y s SER 93 N -3.01 6.54 0.00 4.04 0.15 0.09 -4.90 113.70 116.61 2h5y s SER 93 Ca 0.13 2.89 0.23 0.00 0.70 0.00 0.00 55.95 59.90 2h5y s SER 93 Cb 0.19 -2.66 0.47 0.00 -1.71 0.00 0.00 66.02 62.30 2h5y s SER 93 CO 0.58 -0.72 1.43 0.29 1.20 0.00 0.00 173.24 176.02 2h5y n LYS 94 N 0.61 2.56 -1.68 5.44 4.76 -1.26 -4.96 118.16 123.64 2h5y n LYS 94 Ca 0.00 -2.37 -0.44 0.00 -2.87 0.00 0.00 58.31 52.63 2h5y n LYS 94 Cb 0.40 -1.53 -0.02 0.00 -1.84 0.00 0.00 35.03 32.04 2h5y n LYS 94 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2h5y n LEU 95 N 1.54 3.18 -4.12 -0.35 4.77 -1.26 -4.97 117.00 115.78 2h5y n LEU 95 Ca 0.20 1.16 -0.31 0.00 -0.03 0.00 0.00 56.01 57.03 2h5y n LEU 95 Cb 0.62 -1.44 -0.16 0.00 -2.33 0.00 0.00 43.42 40.10 2h5y n LEU 95 CO 0.16 -0.51 -0.52 -0.60 -1.33 0.00 0.00 177.39 174.59 2h5y s ARG 96 N -0.77 2.72 -0.06 3.23 3.52 -1.26 -4.95 118.95 121.39 2h5y s ARG 96 Ca 0.65 -0.74 -0.02 0.00 -0.13 0.00 0.00 55.73 55.48 2h5y s ARG 96 Cb -0.63 -2.26 0.04 0.00 -1.56 0.00 0.00 34.95 30.54 2h5y s ARG 96 CO 0.53 -0.07 0.12 0.08 -0.81 0.00 0.00 175.30 175.15 2h5y s VAL 97 N 0.97 -0.13 -0.43 7.11 1.01 -1.26 -5.03 120.40 122.64 2h5y s VAL 97 Ca -0.05 0.28 -0.18 0.00 0.00 0.00 0.00 61.98 62.04 2h5y s VAL 97 Cb -0.15 -0.22 0.03 0.00 0.00 0.00 0.00 36.38 36.04 2h5y s VAL 97 CO -0.04 0.12 0.46 -0.62 0.00 0.00 0.00 175.10 175.02 2h5y s ASP 98 N 1.65 6.20 0.60 3.32 3.68 -1.26 -4.56 116.67 126.30 2h5y s ASP 98 Ca -0.03 -0.69 0.29 0.00 2.13 0.00 0.00 52.55 54.25 2h5y s ASP 98 Cb -0.12 -2.23 1.62 0.00 -1.45 0.00 0.00 42.92 40.74 2h5y s ASP 98 CO -0.05 -0.61 2.03 -0.65 0.13 0.00 0.00 175.17 176.02 2h5y h PRO 99 N 8.75 0.00 0.00 4.34 0.11 -1.96 0.31 132.00 143.56 2h5y h PRO 99 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2h5y h PRO 99 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2h5y h PRO 99 CO 0.81 0.00 -0.23 0.00 -0.21 0.00 0.00 178.00 178.37 2h5y h ARG 100 N 0.00 0.00 -6.21 1.05 3.08 -1.92 -3.45 114.38 106.93 2h5y h ARG 100 Ca 0.11 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.59 2h5y h ARG 100 Cb 0.70 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.69 2h5y h ARG 100 CO -0.00 0.00 0.84 0.00 -1.07 0.00 0.00 179.97 179.74 2h5y s ALA 101 N -3.17 3.57 -0.18 0.04 0.00 0.10 -4.92 121.76 117.20 2h5y s ALA 101 Ca 0.08 0.09 -0.39 0.00 0.00 0.00 0.00 51.96 51.73 2h5y s ALA 101 Cb 0.10 -3.63 -0.16 0.00 0.00 0.00 0.00 23.12 19.43 2h5y s ALA 101 CO 0.66 -1.32 1.62 -2.30 0.00 0.00 0.00 175.76 174.43 2h5y n PRO 102 N 6.68 1.11 -0.27 0.00 -0.02 -1.26 -0.71 135.00 140.53 2h5y n PRO 102 Ca 0.12 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 2h5y n PRO 102 Cb 0.46 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 2h5y n PRO 102 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2h5y n GLY 103 N 3.70 1.73 0.23 -1.23 0.00 -1.26 -4.91 105.19 103.45 2h5y n GLY 103 Ca 0.24 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.16 2h5y n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h5y h ALA 104 N 0.00 0.60 -0.07 4.61 0.00 -1.19 0.12 119.26 123.32 2h5y h ALA 104 Ca 0.00 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2h5y h ALA 104 Cb 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2h5y h ALA 104 CO 0.00 0.36 0.03 0.82 0.00 0.00 0.00 179.25 180.46 2h5y h ILE 105 N 0.63 1.15 -0.91 0.00 2.04 -1.83 -1.42 117.51 117.18 2h5y h ILE 105 Ca 0.13 -0.46 0.01 0.00 1.00 0.00 0.00 64.86 65.55 2h5y h ILE 105 Cb 0.44 1.32 -0.04 0.00 -0.74 0.00 0.00 36.82 37.79 2h5y h ILE 105 CO 0.02 0.13 0.59 0.00 0.00 0.00 0.00 178.15 178.89 2h5y h ALA 106 N 0.86 1.15 -0.69 1.87 0.00 -1.80 -1.87 119.26 118.78 2h5y h ALA 106 Ca 0.02 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2h5y h ALA 106 Cb 0.18 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2h5y h ALA 106 CO -0.00 0.56 0.32 -0.22 0.00 0.00 0.00 179.25 179.91 2h5y h LYS 107 N 1.23 1.00 0.00 0.00 1.63 -0.77 -1.59 116.57 118.07 2h5y h LYS 107 Ca 0.33 -0.16 0.00 0.00 -0.85 0.00 0.00 60.65 59.98 2h5y h LYS 107 Cb -0.13 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 31.32 2h5y h LYS 107 CO -0.07 0.80 0.00 0.00 -3.45 0.00 0.00 179.45 176.73 2h5y n ALA 108 N -2.37 1.46 0.65 5.00 0.00 -0.55 -0.81 120.51 123.89 2h5y n ALA 108 Ca 0.05 -0.01 0.13 0.00 0.00 0.00 0.00 53.44 53.61 2h5y n ALA 108 Cb 0.14 -1.19 0.46 0.00 0.00 0.00 0.00 19.45 18.86 2h5y n ALA 108 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2h5y n LEU 109 N -1.61 0.54 0.00 0.00 4.77 -0.60 -4.83 117.00 115.28 2h5y n LEU 109 Ca 0.02 0.57 0.00 0.00 -0.03 0.00 0.00 56.01 56.57 2h5y n LEU 109 Cb 0.12 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 2h5y n LEU 109 CO 0.10 -0.22 0.00 0.61 -1.33 0.00 0.00 177.39 176.55 2h5y n GLY 110 N 0.97 -0.09 0.18 -0.72 0.00 0.01 -0.82 105.19 104.73 2h5y n GLY 110 Ca 0.05 -1.03 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 2h5y n GLY 110 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2h5y h GLU 111 N 0.00 0.56 0.00 1.61 4.39 -1.93 -3.36 114.58 115.85 2h5y h GLU 111 Ca 0.00 -0.26 0.00 0.00 0.34 0.00 0.00 59.36 59.44 2h5y h GLU 111 Cb 0.00 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 2h5y h GLU 111 CO 0.00 0.83 0.00 0.09 -1.16 0.00 0.00 179.01 178.77 2h5y n ASN 112 N -4.43 0.56 -4.67 1.42 4.13 -1.26 -5.07 115.26 105.94 2h5y n ASN 112 Ca -0.04 -0.89 -0.36 0.00 1.68 0.00 0.00 54.58 54.97 2h5y n ASN 112 Cb 0.38 0.11 0.08 0.00 -1.54 0.00 0.00 39.78 38.81 2h5y n ASN 112 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2h5y n GLY 113 N 0.11 0.08 3.42 7.41 0.00 -0.00 -5.03 105.19 111.19 2h5y n GLY 113 Ca 0.00 -0.23 -0.28 0.00 0.00 0.00 0.00 46.02 45.51 2h5y n GLY 113 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2h5y s ARG 114 N -3.32 1.51 -0.42 1.61 0.52 -1.26 -4.82 118.95 112.77 2h5y s ARG 114 Ca 0.78 -1.39 -0.21 0.00 -0.52 0.00 0.00 55.73 54.39 2h5y s ARG 114 Cb -0.37 -1.91 0.02 0.00 0.52 0.00 0.00 34.95 33.20 2h5y s ARG 114 CO 0.45 0.44 0.68 -1.17 0.02 0.00 0.00 175.30 175.71 2h5y s LEU 115 N -2.31 4.37 -0.01 2.53 2.96 0.11 -3.79 118.68 122.53 2h5y s LEU 115 Ca 0.17 -0.14 -0.30 0.00 -0.22 0.00 0.00 54.13 53.64 2h5y s LEU 115 Cb -0.09 -2.81 -0.05 0.00 0.50 0.00 0.00 46.19 43.73 2h5y s LEU 115 CO 0.08 -0.77 1.41 0.00 -1.32 0.00 0.00 176.35 175.75 2h5y s ALA 116 N 2.92 3.59 0.06 5.97 0.00 0.27 -0.34 121.76 134.23 2h5y s ALA 116 Ca 0.25 0.87 -0.06 0.00 0.00 0.00 0.00 51.96 53.02 2h5y s ALA 116 Cb -0.14 -3.60 -0.01 0.00 0.00 0.00 0.00 23.12 19.37 2h5y s ALA 116 CO 0.19 -0.95 0.11 0.14 0.00 0.00 0.00 175.76 175.25 2h5y s VAL 117 N 2.53 0.16 0.58 0.00 -7.23 -0.80 -0.22 120.40 115.41 2h5y s VAL 117 Ca 0.64 -1.32 -0.20 0.00 -1.81 0.00 0.00 61.98 59.29 2h5y s VAL 117 Cb -0.31 -1.27 -0.04 0.00 0.56 0.00 0.00 36.38 35.33 2h5y s VAL 117 CO 0.26 -0.73 1.33 -0.83 -0.31 0.00 0.00 175.10 174.82 2h5y s GLY 118 N -2.67 2.87 -0.08 2.32 0.00 -1.26 0.28 107.32 108.78 2h5y s GLY 118 Ca 0.03 1.27 -0.39 0.00 0.00 0.00 0.00 44.72 45.63 2h5y s GLY 118 CO -0.09 1.76 1.47 -0.18 0.00 0.00 0.00 173.10 176.06 2h5y n GLN 119 N -1.31 0.99 0.18 2.90 0.00 0.15 -3.75 117.38 116.54 2h5y n GLN 119 Ca 0.12 0.36 0.12 0.00 -0.00 0.00 0.00 57.00 57.60 2h5y n GLN 119 Cb 0.46 -2.00 0.20 0.00 0.00 0.00 0.00 30.24 28.90 2h5y n GLN 119 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.06 178.85 2h5y h THR 120 N 4.05 0.00 -0.04 1.69 1.35 -1.86 -0.76 112.91 117.34 2h5y h THR 120 Ca -0.47 -0.88 -0.21 0.00 -0.55 0.00 0.00 66.41 64.29 2h5y h THR 120 Cb 1.34 1.82 0.00 0.00 -1.73 0.00 0.00 68.15 69.59 2h5y h THR 120 CO 0.84 0.00 -0.87 0.00 -0.25 0.00 0.00 175.52 175.24 2h5y h ALA 121 N 2.12 0.42 0.00 6.62 0.00 -1.86 -3.18 119.26 123.37 2h5y h ALA 121 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.24 2h5y h ALA 121 Cb 0.94 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2h5y h ALA 121 CO 0.00 0.78 -0.63 0.43 0.00 0.00 0.00 179.25 179.83 2h5y n SER 122 N -3.79 2.76 -4.69 0.00 7.64 -1.17 -4.89 113.62 109.48 2h5y n SER 122 Ca -0.06 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.39 2h5y n SER 122 Cb 0.79 0.12 -0.03 0.00 -1.01 0.00 0.00 64.21 64.09 2h5y n SER 122 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2h5y s VAL 123 N -1.63 4.18 0.25 0.44 1.01 -0.30 -4.33 120.40 120.03 2h5y s VAL 123 Ca 0.00 1.52 -0.04 0.00 0.00 0.00 0.00 61.98 63.45 2h5y s VAL 123 Cb 0.00 -3.97 0.25 0.00 0.00 0.00 0.00 36.38 32.65 2h5y s VAL 123 CO 0.00 -0.00 1.67 -0.65 0.00 0.00 0.00 175.10 176.12 2h5y h PRO 124 N 7.51 0.24 -0.23 2.72 0.11 -1.92 0.38 132.00 140.80 2h5y h PRO 124 Ca -0.35 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.72 2h5y h PRO 124 Cb 1.16 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 2h5y h PRO 124 CO 0.88 0.16 0.01 0.00 -0.21 0.00 0.00 178.00 178.84 2h5y h ALA 125 N 1.64 1.58 -0.33 -0.75 0.00 -1.90 0.27 119.26 119.77 2h5y h ALA 125 Ca 0.43 -0.14 -0.18 0.00 0.00 0.00 0.00 54.91 55.03 2h5y h ALA 125 Cb 0.76 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 2h5y h ALA 125 CO -0.55 0.31 -0.48 0.78 0.00 0.00 0.00 179.25 179.32 2h5y h GLY 126 N 0.63 1.00 0.99 0.00 0.00 -0.53 0.35 103.07 105.50 2h5y h GLY 126 Ca 0.08 -1.10 -0.11 0.00 0.00 0.00 0.00 47.33 46.20 2h5y h GLY 126 CO 0.00 0.99 -0.21 0.50 0.00 0.00 0.00 176.54 177.82 2h5y h LYS 127 N 0.72 0.76 -0.54 4.80 1.57 0.66 0.25 116.57 124.78 2h5y h LYS 127 Ca 0.03 -0.35 -0.02 0.00 -1.87 0.00 0.00 60.65 58.45 2h5y h LYS 127 Cb 1.08 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.36 2h5y h LYS 127 CO 0.11 0.97 0.26 1.88 -0.57 0.00 0.00 179.45 182.10 2h5y h TYR 128 N 0.54 0.78 0.08 -1.35 0.05 -0.49 0.83 116.97 117.41 2h5y h TYR 128 Ca 0.07 -0.04 -0.00 0.00 0.05 0.00 0.00 58.73 58.81 2h5y h TYR 128 Cb 0.76 -0.24 -0.00 0.00 1.01 0.00 0.00 36.73 38.26 2h5y h TYR 128 CO 0.06 0.61 -0.05 0.00 -1.05 0.00 0.00 178.16 177.73 2h5y h ALA 129 N 1.10 -0.12 -0.84 3.88 0.00 -0.69 0.87 119.26 123.45 2h5y h ALA 129 Ca 0.19 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2h5y h ALA 129 Cb 0.12 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 2h5y h ALA 129 CO -0.02 -0.57 0.50 0.00 0.00 0.00 0.00 179.25 179.16 2h5y h ALA 130 N 0.80 1.08 -0.22 0.00 0.00 -0.27 0.34 119.26 120.99 2h5y h ALA 130 Ca -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2h5y h ALA 130 Cb 0.10 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2h5y h ALA 130 CO 0.01 0.55 0.12 0.00 0.00 0.00 0.00 179.25 179.93 2h5y h ALA 131 N 1.27 0.29 -0.20 0.00 0.00 -0.44 0.14 119.26 120.31 2h5y h ALA 131 Ca 0.30 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 2h5y h ALA 131 Cb -0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2h5y h ALA 131 CO -0.05 -0.17 0.11 0.00 0.00 0.00 0.00 179.25 179.13 2h5y h ALA 132 N 0.99 0.26 -0.63 0.00 0.00 -0.32 0.14 119.26 119.70 2h5y h ALA 132 Ca 0.08 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2h5y h ALA 132 Cb 0.08 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 2h5y h ALA 132 CO -0.01 -0.20 0.41 -0.07 0.00 0.00 0.00 179.25 179.37 2h5y h LEU 133 N 0.21 0.69 -0.20 0.00 3.38 -0.11 0.69 115.31 119.97 2h5y h LEU 133 Ca 0.07 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 2h5y h LEU 133 Cb 0.08 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2h5y h LEU 133 CO -0.01 0.49 -0.00 0.03 0.09 0.00 0.00 178.44 179.04 2h5y h ARG 134 N 0.82 0.36 -0.95 1.13 3.08 -0.42 0.38 114.38 118.78 2h5y h ARG 134 Ca 0.24 -0.12 0.01 0.00 0.07 0.00 0.00 59.98 60.18 2h5y h ARG 134 Cb -0.05 -0.03 -0.05 0.00 0.08 0.00 0.00 29.97 29.92 2h5y h ARG 134 CO -0.07 0.56 0.62 -0.22 -1.07 0.00 0.00 179.97 179.79 2h5y h LYS 135 N 0.12 1.25 -0.02 0.04 1.63 -0.42 -0.06 116.57 119.11 2h5y h LYS 135 Ca 0.06 -0.08 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 2h5y h LYS 135 Cb 0.40 -0.28 0.00 0.00 -0.60 0.00 0.00 32.23 31.75 2h5y h LYS 135 CO 0.01 0.83 0.00 1.28 -3.45 0.00 0.00 179.45 178.13 2h5y n LEU 136 N -4.42 0.42 -0.37 5.20 4.77 0.21 -4.89 117.00 117.92 2h5y n LEU 136 Ca 0.11 -0.16 -0.05 0.00 -0.03 0.00 0.00 56.01 55.88 2h5y n LEU 136 Cb 0.02 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 2h5y n LEU 136 CO 0.37 0.08 -0.05 0.61 -1.33 0.00 0.00 177.39 177.07 2h5y n GLY 137 N 0.97 0.75 0.00 -0.72 0.00 -0.04 -4.86 105.19 101.29 2h5y n GLY 137 Ca 0.19 -0.66 0.09 0.00 0.00 0.00 0.00 46.02 45.65 2h5y n GLY 137 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2h5y n GLN 138 N -2.67 0.65 0.06 1.61 1.13 0.12 -4.59 117.38 113.70 2h5y n GLN 138 Ca -0.05 -0.02 -0.11 0.00 -1.94 0.00 0.00 57.00 54.88 2h5y n GLN 138 Cb 0.18 -1.41 -0.05 0.00 0.11 0.00 0.00 30.24 29.07 2h5y n GLN 138 CO 0.00 0.00 0.00 2.35 -1.44 0.00 0.00 177.06 177.97 2h5y h TRP 139 N 0.00 -0.25 -0.47 1.08 2.91 -1.71 -1.70 115.95 115.81 2h5y h TRP 139 Ca 0.00 0.01 0.04 0.00 1.13 0.00 0.00 58.89 60.07 2h5y h TRP 139 Cb 0.51 0.11 -0.03 0.00 -0.51 0.00 0.00 29.16 29.24 2h5y h TRP 139 CO 0.00 -0.15 0.31 -0.44 -1.03 0.00 0.00 178.44 177.13 2h5y h ASP 140 N -0.18 0.41 0.94 2.65 3.32 -1.89 0.51 116.42 122.18 2h5y h ASP 140 Ca 0.03 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2h5y h ASP 140 Cb 0.22 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.68 2h5y h ASP 140 CO -0.09 0.28 0.00 0.77 -1.72 0.00 0.00 179.24 178.48 2h5y h SER 141 N 0.47 0.00 0.00 6.45 4.64 -1.61 -3.26 113.55 120.25 2h5y h SER 141 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 2h5y h SER 141 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2h5y h SER 141 CO -0.05 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.24 2h5y n VAL 142 N -2.33 0.00 0.28 0.95 0.24 -0.11 -4.72 118.33 112.64 2h5y n VAL 142 Ca 0.03 -0.29 0.13 0.00 -2.04 0.00 0.00 64.34 62.17 2h5y n VAL 142 Cb 0.29 1.16 0.82 0.00 -1.47 0.00 0.00 33.84 34.63 2h5y n VAL 142 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2h5y h SER 143 N 0.00 0.00 -0.47 -1.34 4.64 -0.12 0.55 113.55 116.81 2h5y h SER 143 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2h5y h SER 143 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 2h5y h SER 143 CO 0.00 0.05 0.00 -3.20 -0.87 0.00 0.00 176.83 172.81 2h5y n ASN 144 N -3.83 3.08 -0.72 4.97 4.05 -1.26 -4.23 115.26 117.32 2h5y n ASN 144 Ca -0.03 -1.96 0.06 0.00 0.45 0.00 0.00 54.58 53.11 2h5y n ASN 144 Cb 0.15 -0.31 0.14 0.00 1.23 0.00 0.00 39.78 40.99 2h5y n ASN 144 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 2h5y n ARG 145 N 1.20 1.08 -3.40 1.20 5.12 0.19 -5.05 116.66 117.00 2h5y n ARG 145 Ca 0.19 -2.76 -0.32 0.00 -1.93 0.00 0.00 57.85 53.03 2h5y n ARG 145 Cb 0.51 -1.16 -0.05 0.00 -1.16 0.00 0.00 32.46 30.60 2h5y n ARG 145 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2h5y s LEU 146 N -2.24 4.20 -0.87 0.55 1.43 -1.11 0.04 118.68 120.68 2h5y s LEU 146 Ca 0.34 0.95 -0.03 0.00 -1.03 0.00 0.00 54.13 54.36 2h5y s LEU 146 Cb 0.34 -3.61 0.21 0.00 0.03 0.00 0.00 46.19 43.16 2h5y s LEU 146 CO -0.07 -0.04 0.75 0.00 0.23 0.00 0.00 176.35 177.21 2h5y s ALA 147 N -1.76 4.18 0.20 4.21 0.00 0.54 -4.71 121.76 124.42 2h5y s ALA 147 Ca 0.46 -3.75 -0.30 0.00 0.00 0.00 0.00 51.96 48.37 2h5y s ALA 147 Cb -0.12 -2.86 -0.08 0.00 0.00 0.00 0.00 23.12 20.05 2h5y s ALA 147 CO 0.21 -2.15 1.23 -1.21 0.00 0.00 0.00 175.76 173.84 2h5y s GLU 148 N -1.12 4.46 0.19 0.00 2.02 -1.26 -1.90 118.70 121.09 2h5y s GLU 148 Ca 0.26 1.94 0.07 0.00 0.02 0.00 0.00 54.97 57.26 2h5y s GLU 148 Cb -0.09 -3.22 -0.05 0.00 0.10 0.00 0.00 34.13 30.88 2h5y s GLU 148 CO -0.11 -0.13 -0.14 -1.12 0.02 0.00 0.00 175.26 173.79 2h5y s SER 149 N 0.11 2.43 0.54 -0.19 0.01 0.14 -4.78 113.70 111.96 2h5y s SER 149 Ca 0.53 -1.02 0.32 0.00 1.31 0.00 0.00 55.95 57.09 2h5y s SER 149 Cb -0.34 -0.11 1.31 0.00 0.21 0.00 0.00 66.02 67.09 2h5y s SER 149 CO 0.38 -0.20 1.97 1.05 0.41 0.00 0.00 173.24 176.85 2h5y h GLU 150 N 2.60 0.00 -3.31 12.44 4.11 -1.92 0.43 114.58 128.93 2h5y h GLU 150 Ca -0.38 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.03 2h5y h GLU 150 Cb 1.22 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.41 2h5y h GLU 150 CO 0.62 0.04 0.10 -1.54 0.07 0.00 0.00 179.01 178.30 2h5y s SER 151 N -5.78 -0.02 0.48 3.06 1.04 -1.26 -4.17 113.70 107.05 2h5y s SER 151 Ca 0.01 -0.93 0.13 0.00 0.48 0.00 0.00 55.95 55.65 2h5y s SER 151 Cb 0.09 0.71 1.11 0.00 0.10 0.00 0.00 66.02 68.04 2h5y s SER 151 CO 0.56 -1.37 2.09 1.62 0.98 0.00 0.00 173.24 177.12 2h5y h VAL 152 N 2.08 1.05 -0.01 5.02 3.04 -1.92 -1.71 116.25 123.80 2h5y h VAL 152 Ca -0.25 -0.18 -0.17 0.00 -1.01 0.00 0.00 66.70 65.09 2h5y h VAL 152 Cb 1.25 0.95 -0.01 0.00 -2.01 0.00 0.00 31.29 31.47 2h5y h VAL 152 CO 0.32 0.06 -0.77 0.03 -1.01 0.00 0.00 177.57 176.20 2h5y h ARG 153 N 0.14 0.15 -0.63 4.17 2.47 -1.95 0.11 114.38 118.84 2h5y h ARG 153 Ca 0.04 -0.14 -0.08 0.00 -1.26 0.00 0.00 59.98 58.53 2h5y h ARG 153 Cb 0.06 0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.39 2h5y h ARG 153 CO -0.00 0.85 0.07 0.00 0.56 0.00 0.00 179.97 181.44 2h5y h ALA 154 N 1.11 0.92 -0.25 0.04 0.00 -1.75 0.10 119.26 119.43 2h5y h ALA 154 Ca -0.02 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 2h5y h ALA 154 Cb 1.36 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2h5y h ALA 154 CO 0.11 0.66 0.10 0.00 0.00 0.00 0.00 179.25 180.12 2h5y h ALA 155 N 1.08 0.33 -0.57 0.00 0.00 -1.04 -2.21 119.26 116.84 2h5y h ALA 155 Ca 0.19 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.05 2h5y h ALA 155 Cb 0.47 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.10 2h5y h ALA 155 CO 0.02 -0.07 0.24 1.25 0.00 0.00 0.00 179.25 180.69 2h5y h LEU 156 N 0.25 0.28 -1.07 0.00 5.85 -0.45 -1.46 115.31 118.71 2h5y h LEU 156 Ca 0.08 0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.92 2h5y h LEU 156 Cb 0.19 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 2h5y h LEU 156 CO -0.01 0.18 0.62 0.24 -0.34 0.00 0.00 178.44 179.14 2h5y h MET 157 N 0.45 1.10 -0.67 1.25 2.86 -0.36 0.40 114.93 119.97 2h5y h MET 157 Ca 0.27 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.85 2h5y h MET 157 Cb 0.27 -0.25 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 2h5y h MET 157 CO -0.24 0.73 0.41 -0.07 1.06 0.00 0.00 176.91 178.80 2h5y h LEU 158 N 1.14 0.79 -0.13 1.22 3.38 -0.68 0.29 115.31 121.31 2h5y h LEU 158 Ca 0.40 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.26 2h5y h LEU 158 Cb 0.13 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 2h5y h LEU 158 CO -0.15 0.60 -0.19 0.58 0.09 0.00 0.00 178.44 179.38 2h5y h VAL 159 N 0.90 1.37 -0.87 1.22 2.07 -0.90 0.25 116.25 120.29 2h5y h VAL 159 Ca 0.24 -1.42 0.11 0.00 0.82 0.00 0.00 66.70 66.45 2h5y h VAL 159 Cb -0.05 1.99 -0.08 0.00 -1.52 0.00 0.00 31.29 31.63 2h5y h VAL 159 CO -0.05 0.41 0.51 -1.28 0.02 0.00 0.00 177.57 177.18 2h5y h SER 160 N -0.05 0.72 0.15 0.57 0.87 0.15 0.64 113.55 116.60 2h5y h SER 160 Ca 0.01 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2h5y h SER 160 Cb 0.75 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.63 2h5y h SER 160 CO 0.04 0.39 0.00 0.54 -0.53 0.00 0.00 176.83 177.27 2h5y n ARG 161 N -4.73 0.78 -1.07 2.24 1.74 0.98 -4.87 116.66 111.73 2h5y n ARG 161 Ca 0.15 0.01 -0.02 0.00 -0.77 0.00 0.00 57.85 57.22 2h5y n ARG 161 Cb 0.32 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.25 2h5y n ARG 161 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2h5y n GLY 162 N 0.94 0.53 0.05 -0.13 0.00 0.22 -4.90 105.19 101.89 2h5y n GLY 162 Ca 0.20 -0.25 0.13 0.00 0.00 0.00 0.00 46.02 46.10 2h5y n GLY 162 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2h5y n GLU 163 N -2.07 0.21 -3.99 1.61 1.02 0.83 -4.66 120.64 113.59 2h5y n GLU 163 Ca -0.02 -0.09 -0.17 0.00 -0.02 0.00 0.00 57.16 56.86 2h5y n GLU 163 Cb 0.18 -1.50 -0.16 0.00 -0.02 0.00 0.00 31.44 29.95 2h5y n GLU 163 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2h5y s ALA 164 N -2.86 0.35 0.02 0.62 0.00 -0.89 -4.74 121.76 114.25 2h5y s ALA 164 Ca 0.16 0.06 0.28 0.00 0.00 0.00 0.00 51.96 52.46 2h5y s ALA 164 Cb 0.18 -0.26 1.02 0.00 0.00 0.00 0.00 23.12 24.06 2h5y s ALA 164 CO 0.60 -0.02 1.86 -1.00 0.00 0.00 0.00 175.76 177.20 2h5y h PRO 165 N 6.90 0.00 -3.54 0.00 0.13 -1.83 -3.38 132.00 130.28 2h5y h PRO 165 Ca -0.38 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.64 2h5y h PRO 165 Cb 1.15 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.11 2h5y h PRO 165 CO 0.49 0.09 -0.37 -0.51 -0.23 0.00 0.00 178.00 177.47 2h5y s LEU 166 N -6.39 1.29 0.23 1.56 1.43 -1.26 -4.21 118.68 111.34 2h5y s LEU 166 Ca 0.02 -0.36 -0.13 0.00 -1.03 0.00 0.00 54.13 52.62 2h5y s LEU 166 Cb 0.09 1.03 0.00 0.00 0.03 0.00 0.00 46.19 47.34 2h5y s LEU 166 CO 0.60 -0.58 0.48 -0.83 0.23 0.00 0.00 176.35 176.25 2h5y s GLY 167 N -2.15 0.42 -0.17 -3.19 0.00 0.11 -0.57 107.32 101.77 2h5y s GLY 167 Ca -0.04 -0.77 0.00 0.00 0.00 0.00 0.00 44.72 43.92 2h5y s GLY 167 CO -0.04 -0.57 -0.13 -0.42 0.00 0.00 0.00 173.10 171.94 2h5y s ILE 168 N -3.99 1.59 0.07 0.90 1.01 0.69 -0.21 121.20 121.27 2h5y s ILE 168 Ca 0.20 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 60.10 2h5y s ILE 168 Cb -0.01 -1.56 -0.01 0.00 0.01 0.00 0.00 42.46 40.90 2h5y s ILE 168 CO 0.07 0.36 0.05 1.33 0.00 0.00 0.00 174.94 176.74 2h5y n VAL 169 N 4.74 0.00 -2.93 2.92 0.24 -0.10 -4.40 118.33 118.80 2h5y n VAL 169 Ca -0.16 -0.50 -0.27 0.00 -2.04 0.00 0.00 64.34 61.36 2h5y n VAL 169 Cb 0.49 0.23 -0.01 0.00 -1.47 0.00 0.00 33.84 33.08 2h5y n VAL 169 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 2h5y s TYR 170 N -2.16 3.53 0.27 6.34 2.02 -1.26 -0.13 117.35 125.96 2h5y s TYR 170 Ca 0.07 0.70 0.00 0.00 -0.37 0.00 0.00 57.07 57.48 2h5y s TYR 170 Cb 0.00 -2.19 0.53 0.00 -0.40 0.00 0.00 41.96 39.90 2h5y s TYR 170 CO 0.05 -0.10 1.81 0.78 -1.57 0.00 0.00 175.55 176.52 2h5y h GLY 171 N 0.65 1.53 1.48 0.71 0.00 -1.16 0.92 103.07 107.21 2h5y h GLY 171 Ca -0.48 -0.36 -0.07 0.00 0.00 0.00 0.00 47.33 46.42 2h5y h GLY 171 CO 0.62 0.09 -0.04 1.48 0.00 0.00 0.00 176.54 178.70 2h5y h SER 172 N 0.86 0.60 -0.69 0.19 4.64 -1.82 -1.02 113.55 116.32 2h5y h SER 172 Ca 0.48 -0.14 -0.02 0.00 -0.47 0.00 0.00 61.79 61.63 2h5y h SER 172 Cb 0.53 -0.16 -0.03 0.00 -0.31 0.00 0.00 62.40 62.43 2h5y h SER 172 CO -0.29 0.70 0.34 0.44 -0.87 0.00 0.00 176.83 177.15 2h5y h ASP 173 N 0.59 0.89 -0.52 4.97 3.32 -1.18 0.14 116.42 124.63 2h5y h ASP 173 Ca 0.12 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 2h5y h ASP 173 Cb 0.44 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 2h5y h ASP 173 CO 0.02 0.76 0.28 0.00 -1.72 0.00 0.00 179.24 178.58 2h5y h ALA 174 N 1.16 0.66 -0.37 3.45 0.00 -0.44 -1.10 119.26 122.62 2h5y h ALA 174 Ca 0.24 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2h5y h ALA 174 Cb 0.10 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2h5y h ALA 174 CO -0.03 0.19 0.19 -0.09 0.00 0.00 0.00 179.25 179.51 2h5y h ARG 175 N 0.69 0.51 0.00 0.00 2.43 -0.62 -1.91 114.38 115.48 2h5y h ARG 175 Ca 0.18 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 2h5y h ARG 175 Cb 0.06 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 2h5y h ARG 175 CO -0.03 0.39 0.00 0.00 -1.51 0.00 0.00 179.97 178.82 2h5y n ALA 176 N -2.48 2.08 -3.46 2.80 0.00 0.42 -4.46 120.51 115.42 2h5y n ALA 176 Ca 0.02 -0.08 -0.22 0.00 0.00 0.00 0.00 53.44 53.16 2h5y n ALA 176 Cb 0.10 -1.38 -0.12 0.00 0.00 0.00 0.00 19.45 18.05 2h5y n ALA 176 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2h5y s ASP 177 N -2.99 2.47 0.00 0.00 -1.08 -0.72 -4.97 116.67 109.38 2h5y s ASP 177 Ca 0.12 -0.97 0.08 0.00 -0.52 0.00 0.00 52.55 51.26 2h5y s ASP 177 Cb 0.15 0.13 0.38 0.00 -1.46 0.00 0.00 42.92 42.12 2h5y s ASP 177 CO 0.43 -0.41 1.24 0.00 0.52 0.00 0.00 175.17 176.95 2h5y n ALA 178 N 5.29 1.43 1.55 3.66 0.00 -1.26 -1.77 120.51 129.41 2h5y n ALA 178 Ca -0.04 -0.03 0.15 0.00 0.00 0.00 0.00 53.44 53.52 2h5y n ALA 178 Cb 0.45 -1.14 0.80 0.00 0.00 0.00 0.00 19.45 19.56 2h5y n ALA 178 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2h5y n LYS 179 N -1.45 0.56 -4.36 0.00 5.02 -1.26 -4.68 118.16 111.98 2h5y n LYS 179 Ca 0.02 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.07 2h5y n LYS 179 Cb 0.09 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.52 2h5y n LYS 179 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2h5y s VAL 180 N -2.44 2.69 0.12 -0.18 -7.23 -0.73 -0.35 120.40 112.28 2h5y s VAL 180 Ca 0.33 -2.03 0.06 0.00 -1.81 0.00 0.00 61.98 58.53 2h5y s VAL 180 Cb 0.21 -2.74 -0.04 0.00 0.56 0.00 0.00 36.38 34.37 2h5y s VAL 180 CO 0.44 -0.25 -0.14 0.00 -0.31 0.00 0.00 175.10 174.84 2h5y s ARG 181 N -3.68 1.01 -0.27 4.82 1.70 0.12 -4.53 118.95 118.12 2h5y s ARG 181 Ca 0.34 -1.23 -0.24 0.00 -0.47 0.00 0.00 55.73 54.13 2h5y s ARG 181 Cb -0.01 -0.89 -0.00 0.00 -0.57 0.00 0.00 34.95 33.47 2h5y s ARG 181 CO 0.19 0.17 0.81 0.08 -1.08 0.00 0.00 175.30 175.47 2h5y s VAL 182 N -2.12 4.82 -0.02 4.99 1.01 -1.26 -1.09 120.40 126.73 2h5y s VAL 182 Ca 0.08 1.42 -0.08 0.00 0.00 0.00 0.00 61.98 63.40 2h5y s VAL 182 Cb -0.05 -4.12 -0.30 0.00 0.00 0.00 0.00 36.38 31.91 2h5y s VAL 182 CO 0.03 -0.14 0.79 0.58 0.00 0.00 0.00 175.10 176.36 2h5y h VAL 183 N 5.50 1.07 -2.30 2.92 2.07 -0.37 -3.48 116.25 121.66 2h5y h VAL 183 Ca -0.24 -2.66 0.02 0.00 0.82 0.00 0.00 66.70 64.64 2h5y h VAL 183 Cb 1.09 2.79 -0.17 0.00 -1.52 0.00 0.00 31.29 33.49 2h5y h VAL 183 CO 0.88 0.83 0.34 0.00 0.02 0.00 0.00 177.57 179.64 2h5y s ALA 184 N -2.60 -1.76 -0.16 1.67 0.00 -0.99 -4.57 121.76 113.35 2h5y s ALA 184 Ca -0.12 1.04 -0.06 0.00 0.00 0.00 0.00 51.96 52.82 2h5y s ALA 184 Cb 0.06 0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.40 2h5y s ALA 184 CO 0.86 -0.56 0.02 0.99 0.00 0.00 0.00 175.76 177.07 2h5y s THR 185 N -2.45 4.45 0.47 0.00 2.01 -1.26 0.11 115.64 118.96 2h5y s THR 185 Ca -0.02 -0.16 -0.24 0.00 0.31 0.00 0.00 61.69 61.59 2h5y s THR 185 Cb -0.01 -2.97 -0.07 0.00 0.01 0.00 0.00 72.50 69.46 2h5y s THR 185 CO -0.03 0.49 1.26 -0.36 -0.69 0.00 0.00 174.62 175.29 2h5y s PHE 186 N 0.23 2.70 0.44 4.92 0.40 0.66 -4.94 117.98 122.39 2h5y s PHE 186 Ca 0.01 1.45 -0.26 0.00 -0.60 0.00 0.00 56.93 57.54 2h5y s PHE 186 Cb -0.13 -3.58 -0.09 0.00 0.51 0.00 0.00 43.02 39.73 2h5y s PHE 186 CO 0.01 -2.06 1.43 -2.14 0.70 0.00 0.00 175.22 173.16 2h5y s PRO 187 N -2.61 3.77 0.60 0.24 0.02 -1.26 -4.66 135.00 131.10 2h5y s PRO 187 Ca 0.64 2.44 0.37 0.00 0.02 0.00 0.00 61.00 64.46 2h5y s PRO 187 Cb -0.35 -2.72 1.85 0.00 0.02 0.00 0.00 34.50 33.31 2h5y s PRO 187 CO 0.43 -0.75 2.17 0.38 -0.33 0.00 0.00 177.00 178.90 2h5y h ASP 188 N 2.46 0.00 0.50 2.53 3.04 -1.92 -1.03 116.42 122.01 2h5y h ASP 188 Ca -0.51 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.28 2h5y h ASP 188 Cb 1.26 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.55 2h5y h ASP 188 CO 0.62 0.02 0.00 -0.90 -2.04 0.00 0.00 179.24 176.94 2h5y n ASP 189 N -3.21 0.00 0.06 4.15 5.75 -1.26 -3.53 116.55 118.51 2h5y n ASP 189 Ca -0.01 -0.24 0.12 0.00 -0.01 0.00 0.00 54.79 54.64 2h5y n ASP 189 Cb 0.19 -0.25 0.11 0.00 -1.03 0.00 0.00 41.12 40.14 2h5y n ASP 189 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 2h5y h SER 190 N 0.00 0.00 -5.30 -1.12 4.64 -1.54 -3.47 113.55 106.76 2h5y h SER 190 Ca 0.00 -0.21 -0.13 0.00 -0.47 0.00 0.00 61.79 60.98 2h5y h SER 190 Cb 0.25 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.20 2h5y h SER 190 CO 0.00 0.10 -0.47 -1.38 -0.87 0.00 0.00 176.83 174.21 2h5y s HIS 191 N -3.21 0.54 0.54 4.77 -3.43 -1.23 -2.53 115.29 110.74 2h5y s HIS 191 Ca 0.05 -0.93 -0.22 0.00 -0.80 0.00 0.00 55.06 53.16 2h5y s HIS 191 Cb 0.13 -0.23 -0.05 0.00 -1.43 0.00 0.00 32.58 31.00 2h5y s HIS 191 CO 0.75 -0.60 1.34 -0.51 -2.00 0.00 0.00 174.74 173.72 2h5y s ASP 192 N -2.98 5.32 0.19 7.38 1.11 -1.26 -4.87 116.67 121.56 2h5y s ASP 192 Ca 0.17 2.73 -0.32 0.00 0.18 0.00 0.00 52.55 55.31 2h5y s ASP 192 Cb 0.05 -2.63 -0.16 0.00 1.07 0.00 0.00 42.92 41.26 2h5y s ASP 192 CO -0.02 -1.53 1.13 0.00 1.18 0.00 0.00 175.17 175.94 2h5y n ALA 193 N -1.01 -0.76 -2.60 5.23 0.00 -1.26 -4.85 120.51 115.27 2h5y n ALA 193 Ca 0.10 0.45 -0.43 0.00 0.00 0.00 0.00 53.44 53.57 2h5y n ALA 193 Cb 0.45 -2.02 -0.02 0.00 0.00 0.00 0.00 19.45 17.86 2h5y n ALA 193 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2h5y s ILE 194 N -0.31 4.27 -0.05 0.00 1.01 -1.26 -4.92 121.20 119.94 2h5y s ILE 194 Ca 0.71 1.22 0.02 0.00 0.00 0.00 0.00 60.65 62.61 2h5y s ILE 194 Cb -0.84 -4.56 0.01 0.00 0.01 0.00 0.00 42.46 37.08 2h5y s ILE 194 CO 0.53 -0.93 -0.11 -0.69 0.00 0.00 0.00 174.94 173.74 2h5y s VAL 195 N 4.29 0.97 -0.40 2.92 1.01 -1.26 -2.51 120.40 125.42 2h5y s VAL 195 Ca 0.46 -0.41 -0.09 0.00 0.00 0.00 0.00 61.98 61.94 2h5y s VAL 195 Cb -0.08 -0.88 0.06 0.00 0.00 0.00 0.00 36.38 35.48 2h5y s VAL 195 CO 0.29 0.31 0.23 -0.31 0.00 0.00 0.00 175.10 175.62 2h5y s TYR 196 N 0.49 3.31 0.36 5.22 1.51 0.88 -3.03 117.35 126.08 2h5y s TYR 196 Ca -0.10 -1.39 -0.19 0.00 -1.01 0.00 0.00 57.07 54.39 2h5y s TYR 196 Cb -0.13 -2.74 -0.10 0.00 -0.11 0.00 0.00 41.96 38.88 2h5y s TYR 196 CO 0.02 -0.79 0.84 -1.25 -1.11 0.00 0.00 175.55 173.27 2h5y s PRO 197 N 1.45 4.17 0.05 -1.71 0.04 -1.20 0.06 135.00 137.86 2h5y s PRO 197 Ca 0.02 0.93 0.09 0.00 0.04 0.00 0.00 61.00 62.08 2h5y s PRO 197 Cb -0.22 -2.39 -0.03 0.00 0.04 0.00 0.00 34.50 31.90 2h5y s PRO 197 CO 0.03 0.11 -0.24 0.54 0.04 0.00 0.00 177.00 177.48 2h5y s VAL 198 N -2.00 2.35 -0.04 -0.36 0.11 0.38 -1.82 120.40 119.02 2h5y s VAL 198 Ca 0.56 -1.38 -0.07 0.00 -2.93 0.00 0.00 61.98 58.17 2h5y s VAL 198 Cb -0.11 -1.95 0.01 0.00 -1.53 0.00 0.00 36.38 32.80 2h5y s VAL 198 CO 0.16 0.32 0.16 0.00 -3.33 0.00 0.00 175.10 172.42 2h5y s ALA 199 N -0.87 -0.39 0.19 1.54 0.00 -0.13 -1.06 121.76 121.04 2h5y s ALA 199 Ca 0.13 0.23 -0.30 0.00 0.00 0.00 0.00 51.96 52.02 2h5y s ALA 199 Cb -0.10 -0.12 -0.08 0.00 0.00 0.00 0.00 23.12 22.82 2h5y s ALA 199 CO 0.04 -0.14 1.17 0.00 0.00 0.00 0.00 175.76 176.83 2h5y s ALA 200 N -0.53 3.42 0.24 0.00 0.00 -0.81 -1.16 121.76 122.91 2h5y s ALA 200 Ca -0.06 0.92 -0.30 0.00 0.00 0.00 0.00 51.96 52.52 2h5y s ALA 200 Cb -0.04 -3.39 -0.09 0.00 0.00 0.00 0.00 23.12 19.60 2h5y s ALA 200 CO 0.01 -0.32 1.18 -0.51 0.00 0.00 0.00 175.76 176.11 2h5y s LEU 201 N -0.36 4.48 0.28 0.00 2.01 0.82 -4.61 118.68 121.30 2h5y s LEU 201 Ca 0.51 2.31 0.00 0.00 0.01 0.00 0.00 54.13 56.96 2h5y s LEU 201 Cb -0.32 -3.62 0.51 0.00 0.01 0.00 0.00 46.19 42.77 2h5y s LEU 201 CO 0.37 -0.31 1.85 0.50 1.01 0.00 0.00 176.35 179.76 2h5y h LYS 202 N 4.48 1.01 -0.03 1.70 3.64 -1.18 -1.08 116.57 125.10 2h5y h LYS 202 Ca -0.46 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 2h5y h LYS 202 Cb 1.21 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 2h5y h LYS 202 CO 0.71 0.67 0.00 0.09 -2.27 0.00 0.00 179.45 178.64 2h5y n ASN 203 N -4.59 0.93 -4.71 4.20 5.03 -1.26 -4.91 115.26 109.95 2h5y n ASN 203 Ca 0.18 -1.37 -0.43 0.00 0.87 0.00 0.00 54.58 53.82 2h5y n ASN 203 Cb 0.31 -0.02 -0.03 0.00 -1.02 0.00 0.00 39.78 39.03 2h5y n ASN 203 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 2h5y n SER 204 N -0.25 3.47 -0.78 6.41 2.88 -0.41 -4.86 113.62 120.08 2h5y n SER 204 Ca 0.20 1.12 0.07 0.00 -1.33 0.00 0.00 58.87 58.92 2h5y n SER 204 Cb 0.25 -1.52 0.19 0.00 -0.75 0.00 0.00 64.21 62.38 2h5y n SER 204 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2h5y n ASN 205 N 2.74 3.22 -4.68 -3.46 3.02 -1.26 -4.96 115.26 109.88 2h5y n ASN 205 Ca 0.12 -2.14 -0.43 0.00 -0.03 0.00 0.00 54.58 52.10 2h5y n ASN 205 Cb 0.34 -0.31 -0.02 0.00 -0.61 0.00 0.00 39.78 39.17 2h5y n ASN 205 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2h5y s ASN 206 N -1.11 7.06 0.31 6.41 3.04 -1.26 -4.90 114.94 124.50 2h5y s ASN 206 Ca 0.29 1.67 0.24 0.00 0.04 0.00 0.00 52.86 55.10 2h5y s ASN 206 Cb 0.17 -2.55 1.12 0.00 -1.54 0.00 0.00 41.25 38.45 2h5y s ASN 206 CO 0.17 -0.63 1.74 1.55 -3.04 0.00 0.00 177.10 176.89 2h5y h PRO 207 N 7.61 0.00 -0.02 0.43 0.13 -1.94 -2.23 132.00 135.99 2h5y h PRO 207 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2h5y h PRO 207 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2h5y h PRO 207 CO 0.92 0.00 -0.15 0.00 -0.23 0.00 0.00 178.00 178.54 2h5y n ALA 208 N -1.81 2.83 0.08 -0.56 0.00 -1.26 -4.55 120.51 115.25 2h5y n ALA 208 Ca 0.01 -0.57 -0.12 0.00 0.00 0.00 0.00 53.44 52.76 2h5y n ALA 208 Cb 0.16 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 18.60 2h5y n ALA 208 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2h5y h THR 209 N 3.02 0.74 -0.53 0.00 2.02 -1.79 0.15 112.91 116.53 2h5y h THR 209 Ca 0.00 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.09 2h5y h THR 209 Cb 0.73 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 2h5y h THR 209 CO 0.00 0.00 -0.02 0.00 0.37 0.00 0.00 175.52 175.87 2h5y h ALA 210 N 0.68 0.96 -0.61 6.16 0.00 -1.81 -1.25 119.26 123.39 2h5y h ALA 210 Ca 0.02 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.66 2h5y h ALA 210 Cb 0.24 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 2h5y h ALA 210 CO -0.06 0.63 0.38 0.00 0.00 0.00 0.00 179.25 180.19 2h5y h ALA 211 N 1.13 0.79 -0.11 0.00 0.00 -1.68 0.26 119.26 119.65 2h5y h ALA 211 Ca 0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2h5y h ALA 211 Cb 0.53 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2h5y h ALA 211 CO 0.03 0.12 0.03 0.35 0.00 0.00 0.00 179.25 179.77 2h5y h PHE 212 N 0.74 0.18 -0.64 0.00 3.57 -0.13 0.16 116.94 120.83 2h5y h PHE 212 Ca 0.25 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.72 2h5y h PHE 212 Cb 0.02 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 2h5y h PHE 212 CO -0.05 0.34 0.36 0.28 -2.23 0.00 0.00 178.31 177.00 2h5y h VAL 213 N -0.03 1.20 -0.92 1.41 2.07 -0.90 -1.84 116.25 117.23 2h5y h VAL 213 Ca 0.03 -0.48 0.02 0.00 0.82 0.00 0.00 66.70 67.10 2h5y h VAL 213 Cb 0.25 0.36 -0.05 0.00 -1.52 0.00 0.00 31.29 30.32 2h5y h VAL 213 CO 0.00 0.21 0.60 -1.28 0.02 0.00 0.00 177.57 177.12 2h5y h SER 214 N 0.86 1.02 0.15 0.57 0.87 -0.21 -2.10 113.55 114.71 2h5y h SER 214 Ca 0.23 -0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.74 2h5y h SER 214 Cb 0.02 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 61.73 2h5y h SER 214 CO -0.04 0.72 -0.11 -0.25 -0.53 0.00 0.00 176.83 176.62 2h5y h TRP 215 N 1.20 0.00 0.00 2.24 7.01 0.14 -0.93 115.95 125.62 2h5y h TRP 215 Ca 0.35 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.35 2h5y h TRP 215 Cb -0.07 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 26.99 2h5y h TRP 215 CO -0.01 0.11 0.00 -0.07 -2.79 0.00 0.00 178.44 175.68 2h5y h LEU 216 N 0.00 0.00 0.00 0.65 3.38 -0.91 0.17 115.31 118.60 2h5y h LEU 216 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2h5y h LEU 216 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2h5y h LEU 216 CO 0.01 0.00 -0.08 0.61 0.09 0.00 0.00 178.44 179.07 2h5y n GLY 217 N -0.79 -1.48 3.84 0.83 0.00 -0.35 -3.91 105.19 103.32 2h5y n GLY 217 Ca -0.01 -0.13 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 2h5y n GLY 217 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2h5y s SER 218 N -3.15 6.87 0.20 1.61 0.15 0.59 -4.81 113.70 115.15 2h5y s SER 218 Ca 0.13 1.34 -0.19 0.00 0.70 0.00 0.00 55.95 57.93 2h5y s SER 218 Cb 0.18 -2.39 0.16 0.00 -1.71 0.00 0.00 66.02 62.26 2h5y s SER 218 CO 0.56 -0.13 1.59 0.50 1.20 0.00 0.00 173.24 176.96 2h5y h LYS 219 N 2.63 -0.12 0.00 5.44 3.64 -1.90 0.88 116.57 127.14 2h5y h LYS 219 Ca -0.48 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 58.88 2h5y h LYS 219 Cb 1.18 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 33.02 2h5y h LYS 219 CO 0.65 -0.08 -0.15 -1.00 -2.27 0.00 0.00 179.45 176.61 2h5y h PRO 220 N -0.13 0.00 -0.00 1.90 0.13 -1.93 0.15 132.00 132.13 2h5y h PRO 220 Ca 0.26 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.39 2h5y h PRO 220 Cb 0.55 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.68 2h5y h PRO 220 CO -0.70 0.15 -0.00 0.00 -0.23 0.00 0.00 178.00 177.22 2h5y h ALA 221 N 1.85 0.00 -0.98 -0.56 0.00 -1.14 -3.10 119.26 115.34 2h5y h ALA 221 Ca -0.00 -0.32 0.06 0.00 0.00 0.00 0.00 54.91 54.65 2h5y h ALA 221 Cb 0.31 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 2h5y h ALA 221 CO 0.02 -0.18 0.63 0.87 0.00 0.00 0.00 179.25 180.59 2h5y h LYS 222 N -0.63 1.11 0.00 0.00 1.57 -0.68 -1.65 116.57 116.29 2h5y h LYS 222 Ca -0.00 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 2h5y h LYS 222 Cb 0.63 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.69 2h5y h LYS 222 CO 0.00 0.74 -0.08 0.00 -0.57 0.00 0.00 179.45 179.54 2h5y h ALA 223 N 1.47 1.85 -0.12 3.86 0.00 -0.71 0.16 119.26 125.77 2h5y h ALA 223 Ca 0.42 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 2h5y h ALA 223 Cb 0.16 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2h5y h ALA 223 CO -0.16 0.10 0.06 0.82 0.00 0.00 0.00 179.25 180.07 2h5y h ILE 224 N 0.00 1.11 -0.40 0.00 2.04 -1.22 0.19 117.51 119.23 2h5y h ILE 224 Ca -0.00 -0.32 -0.16 0.00 1.00 0.00 0.00 64.86 65.38 2h5y h ILE 224 Cb 0.15 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 2h5y h ILE 224 CO 0.01 0.10 -0.36 -0.26 0.00 0.00 0.00 178.15 177.64 2h5y h PHE 225 N 0.08 1.13 -0.55 1.37 -1.00 -1.09 -2.74 116.94 114.13 2h5y h PHE 225 Ca 0.04 -0.33 -0.01 0.00 2.81 0.00 0.00 57.97 60.48 2h5y h PHE 225 Cb 0.11 -0.24 -0.03 0.00 3.61 0.00 0.00 35.95 39.40 2h5y h PHE 225 CO -0.03 1.16 0.31 0.00 -1.61 0.00 0.00 178.31 178.14 2h5y h ALA 226 N 0.78 0.71 0.00 2.45 0.00 -0.57 -0.95 119.26 121.68 2h5y h ALA 226 Ca 0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2h5y h ALA 226 Cb 0.95 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 2h5y h ALA 226 CO 0.09 0.23 -0.07 0.00 0.00 0.00 0.00 179.25 179.50 2h5y h ARG 227 N 0.74 0.00 -0.57 0.00 3.08 -0.49 -2.15 114.38 114.99 2h5y h ARG 227 Ca 0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.25 2h5y h ARG 227 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2h5y h ARG 227 CO -0.03 0.07 0.00 0.54 -1.07 0.00 0.00 179.97 179.47 2h5y n ARG 228 N -4.22 2.41 -0.61 0.04 1.74 -0.47 -4.92 116.66 110.63 2h5y n ARG 228 Ca -0.03 -2.19 0.00 0.00 -0.77 0.00 0.00 57.85 54.87 2h5y n ARG 228 Cb 0.15 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 2h5y n ARG 228 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2h5y n GLY 229 N 1.47 0.63 3.84 -0.13 0.00 -0.81 -4.64 105.19 105.55 2h5y n GLY 229 Ca 0.20 -0.61 -0.37 0.00 0.00 0.00 0.00 46.02 45.25 2h5y n GLY 229 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2h5y s PHE 230 N -2.00 3.67 0.47 1.61 0.08 -0.56 -4.40 117.98 116.87 2h5y s PHE 230 Ca 0.00 1.05 -0.14 0.00 0.12 0.00 0.00 56.93 57.97 2h5y s PHE 230 Cb 0.00 -2.35 -0.07 0.00 -0.57 0.00 0.00 43.02 40.03 2h5y s PHE 230 CO 0.00 0.53 0.90 -1.54 -0.10 0.00 0.00 175.22 175.00 2h5y s SER 231 N -1.45 6.56 -0.18 1.36 1.04 -0.33 -4.01 113.70 116.69 2h5y s SER 231 Ca 0.32 1.38 -0.06 0.00 0.48 0.00 0.00 55.95 58.06 2h5y s SER 231 Cb -0.16 -2.43 -0.04 0.00 0.10 0.00 0.00 66.02 63.49 2h5y s SER 231 CO 0.18 -0.52 0.03 -0.76 0.98 0.00 0.00 173.24 173.15 2h5y s LEU 232 N -4.04 3.65 0.00 2.42 1.43 -1.26 -0.16 118.68 120.71 2h5y s LEU 232 Ca 0.55 0.02 0.28 0.00 -1.03 0.00 0.00 54.13 53.95 2h5y s LEU 232 Cb -0.10 -1.91 1.01 0.00 0.03 0.00 0.00 46.19 45.21 2h5y s LEU 232 CO 0.33 0.17 1.72 0.29 0.23 0.00 0.00 176.35 179.08