#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yrz n SER 2 N 0.00 7.60 -0.38 1.61 2.88 -1.26 -4.76 113.62 119.31 2yrz n SER 2 Ca 0.00 -3.75 -0.02 0.00 -1.33 0.00 0.00 58.87 53.77 2yrz n SER 2 Cb 0.00 -1.01 0.03 0.00 -0.75 0.00 0.00 64.21 62.48 2yrz n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2yrz n SER 3 N -0.75 -0.67 -2.71 -3.46 2.88 -1.26 -4.07 113.62 103.59 2yrz n SER 3 Ca 0.59 1.72 -0.07 0.00 -1.33 0.00 0.00 58.87 59.78 2yrz n SER 3 Cb 0.57 -0.38 0.09 0.00 -0.75 0.00 0.00 64.21 63.74 2yrz n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yrz n GLY 4 N -1.45 0.51 3.08 0.46 0.00 -1.26 -5.15 105.19 101.37 2yrz n GLY 4 Ca 0.10 0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 2yrz n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2yrz n SER 5 N -0.04 -5.30 -4.02 1.61 7.64 -1.26 -4.94 113.62 107.30 2yrz n SER 5 Ca -0.01 0.24 -0.31 0.00 1.01 0.00 0.00 58.87 59.79 2yrz n SER 5 Cb 0.75 -0.83 -0.15 0.00 -1.01 0.00 0.00 64.21 62.98 2yrz n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2yrz s SER 6 N -1.13 4.78 0.00 6.43 1.04 -1.26 -5.02 113.70 118.54 2yrz s SER 6 Ca 0.44 -2.22 0.00 0.00 0.48 0.00 0.00 55.95 54.64 2yrz s SER 6 Cb -0.21 -1.65 0.00 0.00 0.10 0.00 0.00 66.02 64.26 2yrz s SER 6 CO 0.79 -0.38 0.00 0.61 0.98 0.00 0.00 173.24 175.24 2yrz n GLY 7 N 4.18 1.12 3.57 7.32 0.00 -1.26 -4.96 105.19 115.16 2yrz n GLY 7 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2yrz n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yrz s SER 8 N 0.57 6.73 0.30 1.61 1.04 -1.26 -4.89 113.70 117.80 2yrz s SER 8 Ca 0.00 -2.13 -0.11 0.00 0.48 0.00 0.00 55.95 54.19 2yrz s SER 8 Cb 0.00 -2.57 0.01 0.00 0.10 0.00 0.00 66.02 63.56 2yrz s SER 8 CO 0.00 -1.27 0.54 -1.00 0.98 0.00 0.00 173.24 172.50 2yrz s HIS 9 N 4.36 0.48 0.13 5.02 4.02 -1.26 -5.17 115.29 122.86 2yrz s HIS 9 Ca 0.51 -0.86 0.01 0.00 1.02 0.00 0.00 55.06 55.74 2yrz s HIS 9 Cb 0.02 0.25 -0.04 0.00 -1.02 0.00 0.00 32.58 31.80 2yrz s HIS 9 CO 0.01 -1.14 0.28 -0.51 1.02 0.00 0.00 174.74 174.40 2yrz s ASP 10 N -3.08 6.36 0.86 1.40 1.01 -1.26 -5.08 116.67 116.88 2yrz s ASP 10 Ca 0.23 0.24 -0.13 0.00 0.71 0.00 0.00 52.55 53.59 2yrz s ASP 10 Cb -0.02 -1.94 0.05 0.00 1.01 0.00 0.00 42.92 42.02 2yrz s ASP 10 CO 0.12 0.08 0.72 -1.20 0.21 0.00 0.00 175.17 175.10 2yrz n SER 11 N -0.30 -0.83 -4.55 0.27 7.64 -1.26 -4.77 113.62 109.82 2yrz n SER 11 Ca -0.06 0.46 -0.32 0.00 1.01 0.00 0.00 58.87 59.96 2yrz n SER 11 Cb 0.53 -1.32 -0.04 0.00 -1.01 0.00 0.00 64.21 62.38 2yrz n SER 11 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2yrz s ARG 12 N -3.70 2.11 -0.15 1.43 0.52 -1.26 -4.71 118.95 113.19 2yrz s ARG 12 Ca 0.64 1.04 0.19 0.00 -0.52 0.00 0.00 55.73 57.08 2yrz s ARG 12 Cb -0.26 -4.61 0.45 0.00 0.52 0.00 0.00 34.95 31.05 2yrz s ARG 12 CO 0.60 -3.41 1.17 1.28 0.02 0.00 0.00 175.30 174.96 2yrz n LEU 13 N 15.83 2.12 -4.68 2.53 4.77 -1.26 -5.07 117.00 131.23 2yrz n LEU 13 Ca 0.36 -3.10 -0.43 0.00 -0.03 0.00 0.00 56.01 52.82 2yrz n LEU 13 Cb 0.52 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.52 2yrz n LEU 13 CO 0.68 1.08 0.89 0.42 -1.33 0.00 0.00 177.39 179.12 2yrz s THR 14 N -2.34 4.57 0.00 -5.08 -4.23 -1.26 -4.85 115.64 102.45 2yrz s THR 14 Ca 0.36 1.86 0.00 0.00 -1.18 0.00 0.00 61.69 62.73 2yrz s THR 14 Cb 0.37 -4.20 0.00 0.00 1.34 0.00 0.00 72.50 70.01 2yrz s THR 14 CO -0.08 -0.04 0.00 0.00 -0.54 0.00 0.00 174.62 173.95 2yrz n ALA 15 N 5.44 2.05 0.67 3.99 0.00 -1.26 -4.77 120.51 126.63 2yrz n ALA 15 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.53 2yrz n ALA 15 Cb 0.47 0.25 0.05 0.00 0.00 0.00 0.00 19.45 20.22 2yrz n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2yrz n GLY 16 N 2.50 2.08 3.85 0.00 0.00 -1.26 -4.85 105.19 107.51 2yrz n GLY 16 Ca 0.00 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 2yrz n GLY 16 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2yrz s VAL 17 N -0.88 4.75 0.47 1.61 -7.23 -1.26 -4.09 120.40 113.77 2yrz s VAL 17 Ca 0.09 0.88 -0.22 0.00 -1.81 0.00 0.00 61.98 60.92 2yrz s VAL 17 Cb 0.07 -3.69 -0.07 0.00 0.56 0.00 0.00 36.38 33.25 2yrz s VAL 17 CO 0.02 0.01 1.16 -2.16 -0.31 0.00 0.00 175.10 173.82 2yrz s PRO 18 N -2.53 3.69 0.63 4.82 0.04 -1.26 -4.69 135.00 135.70 2yrz s PRO 18 Ca 0.47 1.74 -0.09 0.00 0.04 0.00 0.00 61.00 63.15 2yrz s PRO 18 Cb -0.13 -2.33 -0.01 0.00 0.04 0.00 0.00 34.50 32.07 2yrz s PRO 18 CO 0.19 -0.60 1.00 0.34 0.04 0.00 0.00 177.00 177.97 2yrz s ASP 19 N -1.44 5.82 0.10 6.66 2.15 -0.09 -3.88 116.67 125.99 2yrz s ASP 19 Ca 0.65 1.11 -0.36 0.00 0.43 0.00 0.00 52.55 54.39 2yrz s ASP 19 Cb -0.28 -2.10 -0.17 0.00 -0.30 0.00 0.00 42.92 40.08 2yrz s ASP 19 CO 0.33 -1.04 1.26 0.41 -0.17 0.00 0.00 175.17 175.96 2yrz n THR 20 N -2.75 0.23 -2.26 1.71 -1.04 -1.26 -4.59 114.28 104.32 2yrz n THR 20 Ca 0.05 -0.06 -0.38 0.00 -2.04 0.00 0.00 64.05 61.63 2yrz n THR 20 Cb 0.56 -0.74 -0.01 0.00 -1.82 0.00 0.00 70.33 68.32 2yrz n THR 20 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2yrz s PRO 21 N 0.23 3.87 1.33 -2.82 0.04 -1.26 -4.85 135.00 131.52 2yrz s PRO 21 Ca 0.82 1.82 -0.18 0.00 0.04 0.00 0.00 61.00 63.50 2yrz s PRO 21 Cb -0.96 -2.51 0.34 0.00 0.04 0.00 0.00 34.50 31.41 2yrz s PRO 21 CO 0.49 -0.47 0.96 0.99 0.04 0.00 0.00 177.00 179.01 2yrz s THR 22 N -1.49 1.57 0.63 1.26 2.01 -1.26 -4.59 115.64 113.78 2yrz s THR 22 Ca 0.61 0.00 -0.17 0.00 0.31 0.00 0.00 61.69 62.44 2yrz s THR 22 Cb -0.30 -2.02 -0.05 0.00 0.01 0.00 0.00 72.50 70.15 2yrz s THR 22 CO 0.37 0.00 0.76 -2.11 -0.69 0.00 0.00 174.62 172.95 2yrz n ARG 23 N -5.41 0.62 -2.60 4.92 1.85 -1.26 -4.59 116.66 110.18 2yrz n ARG 23 Ca 0.07 0.25 -0.23 0.00 -1.00 0.00 0.00 57.85 56.94 2yrz n ARG 23 Cb 0.57 -1.98 0.11 0.00 -1.05 0.00 0.00 32.46 30.11 2yrz n ARG 23 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2yrz s LEU 24 N -1.06 2.98 -0.13 2.89 1.43 -1.26 -4.49 118.68 119.03 2yrz s LEU 24 Ca 0.72 -0.38 -0.04 0.00 -1.03 0.00 0.00 54.13 53.40 2yrz s LEU 24 Cb -0.40 -1.96 0.06 0.00 0.03 0.00 0.00 46.19 43.91 2yrz s LEU 24 CO 0.51 -1.85 0.15 -0.69 0.23 0.00 0.00 176.35 174.70 2yrz s VAL 25 N -3.13 -0.23 -0.19 -1.59 1.01 -0.63 -4.89 120.40 110.75 2yrz s VAL 25 Ca 0.66 0.14 -0.09 0.00 0.00 0.00 0.00 61.98 62.68 2yrz s VAL 25 Cb -0.05 -0.44 -0.05 0.00 0.00 0.00 0.00 36.38 35.84 2yrz s VAL 25 CO 0.44 -0.03 0.13 -0.36 0.00 0.00 0.00 175.10 175.28 2yrz s PHE 26 N 2.26 3.43 -0.16 5.22 0.08 -1.24 -1.66 117.98 125.91 2yrz s PHE 26 Ca 0.04 0.34 0.05 0.00 0.12 0.00 0.00 56.93 57.48 2yrz s PHE 26 Cb -0.14 -2.12 -0.23 0.00 -0.57 0.00 0.00 43.02 39.96 2yrz s PHE 26 CO -0.08 0.35 0.21 0.45 -0.10 0.00 0.00 175.22 176.05 2yrz n SER 27 N 3.30 1.40 -3.16 1.36 2.88 -0.92 -4.91 113.62 113.58 2yrz n SER 27 Ca -0.17 0.12 -0.15 0.00 -1.33 0.00 0.00 58.87 57.34 2yrz n SER 27 Cb 0.52 -0.20 0.08 0.00 -0.75 0.00 0.00 64.21 63.86 2yrz n SER 27 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2yrz n ALA 28 N -2.92 -1.90 -0.51 -1.46 0.00 -1.26 -4.82 120.51 107.64 2yrz n ALA 28 Ca -0.33 -0.02 0.44 0.00 0.00 0.00 0.00 53.44 53.53 2yrz n ALA 28 Cb 1.05 -2.78 0.74 0.00 0.00 0.00 0.00 19.45 18.47 2yrz n ALA 28 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2yrz h LEU 29 N -1.57 0.00 0.00 0.00 -0.00 -1.83 -3.44 115.31 108.47 2yrz h LEU 29 Ca -0.53 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.35 2yrz h LEU 29 Cb 1.30 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.96 2yrz h LEU 29 CO 0.44 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.49 2yrz n GLY 30 N -1.84 1.42 0.17 0.83 0.00 -1.11 -4.94 105.19 99.73 2yrz n GLY 30 Ca 0.35 -0.84 0.01 0.00 0.00 0.00 0.00 46.02 45.54 2yrz n GLY 30 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yrz h PRO 31 N 0.00 0.00 0.00 1.61 0.13 -1.91 -3.16 132.00 128.67 2yrz h PRO 31 Ca 0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2yrz h PRO 31 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 2yrz h PRO 31 CO 0.00 0.47 -0.12 0.25 -0.23 0.00 0.00 178.00 178.36 2yrz n THR 32 N -3.92 1.84 -3.98 1.56 -2.24 -1.26 -4.41 114.28 101.87 2yrz n THR 32 Ca -0.01 -2.33 -0.10 0.00 -2.27 0.00 0.00 64.05 59.33 2yrz n THR 32 Cb 0.49 -0.19 -0.12 0.00 -2.10 0.00 0.00 70.33 68.42 2yrz n THR 32 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2yrz s SER 33 N -2.85 0.28 0.25 3.42 1.04 -1.20 -2.23 113.70 112.42 2yrz s SER 33 Ca 0.32 -0.43 -0.15 0.00 0.48 0.00 0.00 55.95 56.16 2yrz s SER 33 Cb 0.29 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.49 2yrz s SER 33 CO 0.01 -0.24 0.55 -0.76 0.98 0.00 0.00 173.24 173.77 2yrz s LEU 34 N -1.25 0.15 -0.25 2.42 1.43 0.44 -2.74 118.68 118.88 2yrz s LEU 34 Ca -0.13 -0.82 -0.02 0.00 -1.03 0.00 0.00 54.13 52.13 2yrz s LEU 34 Cb -0.09 2.05 0.11 0.00 0.03 0.00 0.00 46.19 48.30 2yrz s LEU 34 CO -0.01 -1.19 0.26 -0.60 0.23 0.00 0.00 176.35 175.04 2yrz s ARG 35 N -3.98 0.26 -0.20 1.70 3.52 -1.26 0.49 118.95 119.47 2yrz s ARG 35 Ca 0.19 0.02 -0.14 0.00 -0.13 0.00 0.00 55.73 55.67 2yrz s ARG 35 Cb -0.02 -0.92 -0.04 0.00 -1.56 0.00 0.00 34.95 32.41 2yrz s ARG 35 CO 0.08 -0.84 0.33 0.08 -0.81 0.00 0.00 175.30 174.13 2yrz s VAL 36 N 2.34 5.25 -0.09 7.11 1.01 -0.44 -2.16 120.40 133.43 2yrz s VAL 36 Ca 0.09 0.56 0.01 0.00 0.00 0.00 0.00 61.98 62.63 2yrz s VAL 36 Cb -0.15 -3.66 0.02 0.00 0.00 0.00 0.00 36.38 32.59 2yrz s VAL 36 CO -0.23 0.30 -0.10 -0.94 0.00 0.00 0.00 175.10 174.12 2yrz s SER 37 N 0.96 1.98 0.30 3.32 1.04 -0.66 -0.80 113.70 119.82 2yrz s SER 37 Ca 0.16 -0.30 0.02 0.00 0.48 0.00 0.00 55.95 56.31 2yrz s SER 37 Cb -0.14 -0.84 0.02 0.00 0.10 0.00 0.00 66.02 65.16 2yrz s SER 37 CO 0.06 -0.04 0.17 -2.67 0.98 0.00 0.00 173.24 171.74 2yrz n TRP 38 N 4.38 -0.57 -4.06 5.02 2.14 0.49 -1.61 117.44 123.22 2yrz n TRP 38 Ca -0.18 -1.31 -0.31 0.00 2.07 0.00 0.00 57.50 57.77 2yrz n TRP 38 Cb 0.51 -0.23 -0.16 0.00 -0.81 0.00 0.00 31.31 30.62 2yrz n TRP 38 CO 0.00 0.00 0.00 -0.65 2.07 0.00 0.00 177.69 179.11 2yrz s GLN 39 N -3.18 2.59 -0.55 -2.67 -0.21 -1.26 -4.80 119.66 109.58 2yrz s GLN 39 Ca 0.13 -0.70 -0.40 0.00 0.02 0.00 0.00 55.36 54.41 2yrz s GLN 39 Cb -0.01 -2.33 -0.18 0.00 1.00 0.00 0.00 33.01 31.49 2yrz s GLN 39 CO 0.08 -0.24 2.24 -1.91 -2.12 0.00 0.00 175.29 173.34 2yrz n GLU 40 N 4.70 0.22 -0.23 2.91 0.00 -1.26 -4.04 120.64 122.94 2yrz n GLU 40 Ca -0.19 0.05 -0.07 0.00 0.00 0.00 0.00 57.16 56.96 2yrz n GLU 40 Cb 0.50 -1.72 0.06 0.00 0.00 0.00 0.00 31.44 30.27 2yrz n GLU 40 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 2yrz n PRO 41 N 7.82 -1.50 -3.43 5.31 -0.04 -1.26 -5.00 135.00 136.90 2yrz n PRO 41 Ca 0.54 -0.39 -0.34 0.00 -0.04 0.00 0.00 63.50 63.27 2yrz n PRO 41 Cb 0.03 -0.36 -0.06 0.00 -0.04 0.00 0.00 33.50 33.07 2yrz n PRO 41 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2yrz s ARG 42 N -3.55 3.86 -0.30 0.54 1.70 -1.26 -4.91 118.95 115.03 2yrz s ARG 42 Ca 0.16 0.33 -0.15 0.00 -0.47 0.00 0.00 55.73 55.60 2yrz s ARG 42 Cb -0.02 -2.84 0.16 0.00 -0.57 0.00 0.00 34.95 31.68 2yrz s ARG 42 CO 0.12 0.44 0.98 0.00 -1.08 0.00 0.00 175.30 175.76 2yrz h GLU 44 N 6.93 0.00 -6.32 0.00 3.07 -1.84 -3.41 114.58 113.02 2yrz h GLU 44 Ca -0.20 0.00 -0.62 0.00 -0.50 0.00 0.00 59.36 58.04 2yrz h GLU 44 Cb 1.14 0.00 -0.11 0.00 -0.84 0.00 0.00 28.75 28.95 2yrz h GLU 44 CO 0.13 0.00 -0.64 1.03 -1.40 0.00 0.00 179.01 178.12 2yrz s ARG 45 N -4.73 2.54 0.12 2.33 1.81 -1.26 -5.09 118.95 114.67 2yrz s ARG 45 Ca -0.05 -0.97 -0.31 0.00 -1.72 0.00 0.00 55.73 52.68 2yrz s ARG 45 Cb 0.16 -2.47 -0.08 0.00 -0.45 0.00 0.00 34.95 32.11 2yrz s ARG 45 CO 0.59 0.49 1.36 -1.25 -0.68 0.00 0.00 175.30 175.81 2yrz s PRO 46 N -2.74 4.34 0.40 3.54 0.04 -1.26 -4.88 135.00 134.44 2yrz s PRO 46 Ca 0.27 2.04 -0.25 0.00 0.04 0.00 0.00 61.00 63.10 2yrz s PRO 46 Cb -0.10 -3.25 -0.08 0.00 0.04 0.00 0.00 34.50 31.10 2yrz s PRO 46 CO 0.19 -0.40 1.19 -0.51 0.04 0.00 0.00 177.00 177.51 2yrz s LEU 47 N 0.97 4.20 0.01 -3.56 1.43 -1.26 -4.07 118.68 116.41 2yrz s LEU 47 Ca 0.63 2.38 0.22 0.00 -1.03 0.00 0.00 54.13 56.34 2yrz s LEU 47 Cb -0.36 -4.00 -0.27 0.00 0.03 0.00 0.00 46.19 41.59 2yrz s LEU 47 CO 0.31 -0.69 0.61 0.00 0.23 0.00 0.00 176.35 176.81 2yrz n GLN 48 N 0.10 0.61 -0.01 1.70 6.02 -0.29 -4.68 117.38 120.83 2yrz n GLN 48 Ca 0.04 -0.13 0.00 0.00 -0.01 0.00 0.00 57.00 56.90 2yrz n GLN 48 Cb 0.46 -1.57 0.00 0.00 1.02 0.00 0.00 30.24 30.15 2yrz n GLN 48 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2yrz n GLY 49 N 1.26 -0.80 3.34 1.08 0.00 -1.25 -3.53 105.19 105.29 2yrz n GLY 49 Ca -0.03 -0.29 -0.10 0.00 0.00 0.00 0.00 46.02 45.61 2yrz n GLY 49 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2yrz s TYR 50 N -4.00 -0.06 -0.02 1.61 2.02 -1.00 -3.41 117.35 112.48 2yrz s TYR 50 Ca 0.00 -0.28 0.01 0.00 -0.37 0.00 0.00 57.07 56.42 2yrz s TYR 50 Cb 0.00 0.20 0.02 0.00 -0.40 0.00 0.00 41.96 41.78 2yrz s TYR 50 CO 0.00 -0.72 -0.01 0.45 -1.57 0.00 0.00 175.55 173.70 2yrz s SER 51 N -2.85 0.40 -0.41 2.29 0.15 -0.17 -0.28 113.70 112.83 2yrz s SER 51 Ca 0.06 -0.03 0.02 0.00 0.70 0.00 0.00 55.95 56.70 2yrz s SER 51 Cb 0.02 -0.18 0.12 0.00 -1.71 0.00 0.00 66.02 64.27 2yrz s SER 51 CO -0.09 -0.07 0.19 -0.69 1.20 0.00 0.00 173.24 173.78 2yrz s VAL 52 N 0.75 1.49 -0.21 4.45 1.01 0.09 -0.91 120.40 127.07 2yrz s VAL 52 Ca -0.07 -2.34 -0.17 0.00 0.00 0.00 0.00 61.98 59.40 2yrz s VAL 52 Cb -0.11 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 2yrz s VAL 52 CO -0.01 -0.80 0.47 -1.61 0.00 0.00 0.00 175.10 173.14 2yrz s GLU 53 N 0.65 4.17 0.01 2.72 2.02 -0.06 -1.74 118.70 126.46 2yrz s GLU 53 Ca 0.15 0.31 0.03 0.00 0.02 0.00 0.00 54.97 55.48 2yrz s GLU 53 Cb -0.22 -3.56 -0.01 0.00 0.10 0.00 0.00 34.13 30.43 2yrz s GLU 53 CO -0.06 -0.12 -0.11 1.52 0.02 0.00 0.00 175.26 176.51 2yrz s TYR 54 N 1.57 0.93 0.14 1.61 -0.85 0.06 0.37 117.35 121.18 2yrz s TYR 54 Ca 0.22 -0.24 -0.08 0.00 -0.52 0.00 0.00 57.07 56.44 2yrz s TYR 54 Cb -0.15 -0.58 -0.01 0.00 0.38 0.00 0.00 41.96 41.60 2yrz s TYR 54 CO 0.09 -0.01 0.24 1.14 -1.52 0.00 0.00 175.55 175.49 2yrz s GLN 55 N -0.59 1.06 -0.07 -3.49 -2.07 -1.11 -0.56 119.66 112.84 2yrz s GLN 55 Ca 0.02 -1.17 -0.35 0.00 -1.82 0.00 0.00 55.36 52.05 2yrz s GLN 55 Cb -0.05 0.35 -0.12 0.00 -1.09 0.00 0.00 33.01 32.10 2yrz s GLN 55 CO 0.00 -0.37 1.82 1.28 -1.32 0.00 0.00 175.29 176.70 2yrz n LEU 56 N -0.17 3.30 -0.26 2.60 4.77 -1.25 -0.55 117.00 125.44 2yrz n LEU 56 Ca -0.09 1.00 0.12 0.00 -0.03 0.00 0.00 56.01 57.01 2yrz n LEU 56 Cb 0.63 -1.36 0.38 0.00 -2.33 0.00 0.00 43.42 40.74 2yrz n LEU 56 CO 0.25 -0.13 1.22 0.25 -1.33 0.00 0.00 177.39 177.65 2yrz h LEU 57 N 8.56 0.64 -0.50 2.23 7.12 -1.18 -0.25 115.31 131.93 2yrz h LEU 57 Ca -0.48 0.04 -0.17 0.00 0.13 0.00 0.00 57.88 57.40 2yrz h LEU 57 Cb 1.27 -0.09 -0.01 0.00 -0.53 0.00 0.00 40.66 41.31 2yrz h LEU 57 CO 0.94 0.33 -0.59 -1.13 -0.13 0.00 0.00 178.44 177.86 2yrz h ASN 58 N 0.68 0.59 0.00 1.25 -1.24 -1.89 -3.48 115.58 111.50 2yrz h ASN 58 Ca 0.44 -0.33 0.00 0.00 0.71 0.00 0.00 56.30 57.12 2yrz h ASN 58 Cb 0.70 -0.17 0.00 0.00 0.73 0.00 0.00 38.32 39.58 2yrz h ASN 58 CO -0.19 1.04 0.00 0.61 -1.29 0.00 0.00 177.43 177.60 2yrz n GLY 59 N 0.31 3.39 0.00 1.57 0.00 -0.10 -5.19 105.19 105.17 2yrz n GLY 59 Ca -0.03 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.39 2yrz n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yrz n GLY 60 N 0.00 -0.68 3.18 -0.02 0.00 -1.26 -4.89 105.19 101.52 2yrz n GLY 60 Ca 0.00 -0.70 -0.35 0.00 0.00 0.00 0.00 46.02 44.97 2yrz n GLY 60 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2yrz n GLU 61 N 0.00 -0.96 -3.85 1.61 4.71 -1.26 -4.61 120.64 116.28 2yrz n GLU 61 Ca 0.00 -0.27 -0.25 0.00 -0.01 0.00 0.00 57.16 56.63 2yrz n GLU 61 Cb 0.00 -1.44 -0.17 0.00 -1.01 0.00 0.00 31.44 28.81 2yrz n GLU 61 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 2yrz s LEU 62 N 2.19 0.91 -0.27 -4.62 1.98 -1.26 -3.80 118.68 113.81 2yrz s LEU 62 Ca 0.49 -0.20 -0.13 0.00 -2.89 0.00 0.00 54.13 51.40 2yrz s LEU 62 Cb -0.05 -0.65 -0.04 0.00 0.66 0.00 0.00 46.19 46.11 2yrz s LEU 62 CO 0.67 -0.15 0.29 -1.00 -1.89 0.00 0.00 176.35 174.26 2yrz s HIS 63 N 1.82 3.24 -0.21 5.38 3.76 0.28 -4.97 115.29 124.60 2yrz s HIS 63 Ca 0.05 0.29 -0.08 0.00 -0.15 0.00 0.00 55.06 55.17 2yrz s HIS 63 Cb -0.12 -2.48 -0.04 0.00 1.11 0.00 0.00 32.58 31.05 2yrz s HIS 63 CO -0.07 -0.18 0.07 0.50 -0.85 0.00 0.00 174.74 174.22 2yrz s ARG 64 N 1.86 3.89 -0.17 1.40 3.52 -1.26 -0.76 118.95 127.43 2yrz s ARG 64 Ca 0.12 -0.38 -0.04 0.00 -0.13 0.00 0.00 55.73 55.30 2yrz s ARG 64 Cb -0.16 -3.28 -0.02 0.00 -1.56 0.00 0.00 34.95 29.93 2yrz s ARG 64 CO 0.10 0.12 -0.04 -0.51 -0.81 0.00 0.00 175.30 174.16 2yrz s LEU 65 N 0.80 3.15 0.01 -0.88 1.43 -0.71 -4.97 118.68 117.50 2yrz s LEU 65 Ca 0.04 -0.20 0.00 0.00 -1.03 0.00 0.00 54.13 52.94 2yrz s LEU 65 Cb -0.13 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 2yrz s LEU 65 CO 0.02 0.12 0.07 0.20 0.23 0.00 0.00 176.35 177.00 2yrz s ASN 66 N 0.63 5.60 -0.30 2.29 0.01 -1.26 -0.73 114.94 121.17 2yrz s ASN 66 Ca -0.03 0.11 0.03 0.00 -0.71 0.00 0.00 52.86 52.26 2yrz s ASN 66 Cb -0.14 -1.58 0.09 0.00 0.41 0.00 0.00 41.25 40.02 2yrz s ASN 66 CO 0.02 0.26 0.01 -0.63 -1.51 0.00 0.00 177.10 175.25 2yrz s ILE 67 N -1.21 1.92 -2.00 0.60 -1.09 0.61 -4.96 121.20 115.06 2yrz s ILE 67 Ca 0.23 -1.89 0.12 0.00 -2.23 0.00 0.00 60.65 56.88 2yrz s ILE 67 Cb -0.12 -2.31 0.33 0.00 -1.58 0.00 0.00 42.46 38.78 2yrz s ILE 67 CO 0.15 -0.43 1.13 -0.81 -1.23 0.00 0.00 174.94 173.75 2yrz n PRO 68 N 4.44 0.49 -3.97 2.79 -0.04 -1.26 -2.38 135.00 135.08 2yrz n PRO 68 Ca -0.03 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.13 2yrz n PRO 68 Cb 0.42 -1.37 -0.16 0.00 -0.04 0.00 0.00 33.50 32.35 2yrz n PRO 68 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 2yrz s ASN 69 N -1.87 3.42 0.00 3.54 2.47 -1.26 -4.87 114.94 116.36 2yrz s ASN 69 Ca 0.18 -0.92 0.15 0.00 0.42 0.00 0.00 52.86 52.68 2yrz s ASN 69 Cb 0.08 -1.17 0.71 0.00 -1.45 0.00 0.00 41.25 39.42 2yrz s ASN 69 CO 0.13 -0.17 1.42 -0.81 -3.72 0.00 0.00 177.10 173.95 2yrz n PRO 70 N 4.71 0.16 0.01 0.43 -0.04 -1.23 -2.09 135.00 136.94 2yrz n PRO 70 Ca -0.14 0.17 0.11 0.00 -0.04 0.00 0.00 63.50 63.61 2yrz n PRO 70 Cb 0.46 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.28 2yrz n PRO 70 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2yrz n ALA 71 N -1.34 2.93 -2.57 0.55 0.00 -1.26 -4.81 120.51 114.02 2yrz n ALA 71 Ca 0.06 -0.49 -0.42 0.00 0.00 0.00 0.00 53.44 52.60 2yrz n ALA 71 Cb 0.13 -0.80 -0.03 0.00 0.00 0.00 0.00 19.45 18.75 2yrz n ALA 71 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2yrz s GLN 72 N -3.45 3.37 -0.41 0.00 0.74 -0.89 -4.86 119.66 114.16 2yrz s GLN 72 Ca -0.05 0.03 0.05 0.00 0.05 0.00 0.00 55.36 55.43 2yrz s GLN 72 Cb 0.14 -4.09 0.61 0.00 1.10 0.00 0.00 33.01 30.77 2yrz s GLN 72 CO 0.89 -1.87 1.79 0.25 -0.55 0.00 0.00 175.29 175.79 2yrz n THR 73 N 6.53 3.03 -3.66 -0.34 -2.24 -1.26 -4.85 114.28 111.50 2yrz n THR 73 Ca 0.06 -2.25 -0.07 0.00 -2.27 0.00 0.00 64.05 59.52 2yrz n THR 73 Cb 0.49 -0.47 -0.08 0.00 -2.10 0.00 0.00 70.33 68.17 2yrz n THR 73 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2yrz s SER 74 N -1.72 -0.77 -0.02 3.42 1.04 -1.26 -0.38 113.70 114.00 2yrz s SER 74 Ca 0.54 1.29 0.02 0.00 0.48 0.00 0.00 55.95 58.28 2yrz s SER 74 Cb 0.46 1.42 0.00 0.00 0.10 0.00 0.00 66.02 68.01 2yrz s SER 74 CO 0.07 -0.22 -0.08 0.54 0.98 0.00 0.00 173.24 174.52 2yrz s VAL 75 N 2.00 0.70 -0.11 5.02 0.11 0.02 -4.98 120.40 123.16 2yrz s VAL 75 Ca -0.08 -0.33 -0.24 0.00 -2.93 0.00 0.00 61.98 58.40 2yrz s VAL 75 Cb -0.08 -0.62 -0.03 0.00 -1.53 0.00 0.00 36.38 34.12 2yrz s VAL 75 CO -0.17 0.22 0.76 -0.69 -3.33 0.00 0.00 175.10 171.89 2yrz s VAL 76 N 0.13 4.97 -0.22 2.04 1.01 -1.26 -1.32 120.40 125.75 2yrz s VAL 76 Ca -0.02 1.53 -0.07 0.00 0.00 0.00 0.00 61.98 63.43 2yrz s VAL 76 Cb -0.07 -4.09 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 2yrz s VAL 76 CO 0.00 0.14 0.04 -0.69 0.00 0.00 0.00 175.10 174.60 2yrz s VAL 77 N 1.45 4.29 0.30 2.92 1.01 0.18 -4.93 120.40 125.62 2yrz s VAL 77 Ca 0.38 -0.19 0.03 0.00 0.00 0.00 0.00 61.98 62.20 2yrz s VAL 77 Cb -0.17 -2.97 -0.01 0.00 0.00 0.00 0.00 36.38 33.23 2yrz s VAL 77 CO 0.16 0.39 0.12 -0.62 0.00 0.00 0.00 175.10 175.16 2yrz n GLU 78 N 4.40 0.61 -3.29 2.72 1.02 -1.26 0.17 120.64 125.01 2yrz n GLU 78 Ca -0.17 -2.59 -0.17 0.00 -0.02 0.00 0.00 57.16 54.21 2yrz n GLU 78 Cb 0.52 1.51 0.06 0.00 -0.02 0.00 0.00 31.44 33.50 2yrz n GLU 78 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2yrz n ASP 79 N -1.71 -4.93 -5.00 1.62 -0.08 -0.95 -4.96 116.55 100.55 2yrz n ASP 79 Ca -0.03 -0.40 -0.21 0.00 -1.51 0.00 0.00 54.79 52.63 2yrz n ASP 79 Cb 0.46 -3.86 0.04 0.00 2.34 0.00 0.00 41.12 40.10 2yrz n ASP 79 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 2yrz s LEU 80 N -5.62 3.03 -0.10 -2.67 1.43 -1.24 -5.11 118.68 108.40 2yrz s LEU 80 Ca 0.39 -0.93 -0.04 0.00 -1.03 0.00 0.00 54.13 52.52 2yrz s LEU 80 Cb -0.17 -1.57 -0.04 0.00 0.03 0.00 0.00 46.19 44.44 2yrz s LEU 80 CO 0.54 -1.24 0.06 -0.76 0.23 0.00 0.00 176.35 175.18 2yrz s LEU 81 N -4.54 3.90 0.47 1.79 1.43 -1.26 -4.77 118.68 115.70 2yrz s LEU 81 Ca 0.54 0.27 -0.22 0.00 -1.03 0.00 0.00 54.13 53.69 2yrz s LEU 81 Cb -0.05 -1.92 -0.07 0.00 0.03 0.00 0.00 46.19 44.18 2yrz s LEU 81 CO 0.34 0.39 1.16 -2.16 0.23 0.00 0.00 176.35 176.31 2yrz s PRO 82 N -0.96 3.69 -1.35 1.29 0.04 -1.26 -3.62 135.00 132.83 2yrz s PRO 82 Ca 0.14 1.75 -0.04 0.00 0.04 0.00 0.00 61.00 62.89 2yrz s PRO 82 Cb -0.12 -2.34 -0.00 0.00 0.04 0.00 0.00 34.50 32.09 2yrz s PRO 82 CO 0.03 -0.60 0.50 0.09 0.04 0.00 0.00 177.00 177.05 2yrz n ASN 83 N -0.63 -1.15 -3.72 6.66 5.03 -1.16 -4.97 115.26 115.31 2yrz n ASN 83 Ca 0.08 -1.00 -0.13 0.00 0.87 0.00 0.00 54.58 54.40 2yrz n ASN 83 Cb 0.49 -3.16 -0.13 0.00 -1.02 0.00 0.00 39.78 35.95 2yrz n ASN 83 CO 0.00 0.00 0.00 -1.00 -1.83 0.00 0.00 177.26 174.43 2yrz s HIS 84 N -3.86 -0.32 0.59 3.10 3.76 -1.24 -4.92 115.29 112.40 2yrz s HIS 84 Ca 0.08 0.77 -0.16 0.00 -0.15 0.00 0.00 55.06 55.60 2yrz s HIS 84 Cb -0.03 0.02 -0.04 0.00 1.11 0.00 0.00 32.58 33.64 2yrz s HIS 84 CO 0.88 -0.24 1.05 -1.12 -0.85 0.00 0.00 174.74 174.46 2yrz s SER 85 N 1.39 5.87 -0.12 1.40 0.01 -1.26 -3.32 113.70 117.68 2yrz s SER 85 Ca -0.08 1.77 -0.06 0.00 1.31 0.00 0.00 55.95 58.89 2yrz s SER 85 Cb -0.11 -2.53 0.05 0.00 0.21 0.00 0.00 66.02 63.64 2yrz s SER 85 CO -0.08 -1.10 0.28 -0.31 0.41 0.00 0.00 173.24 172.43 2yrz s TYR 86 N -2.51 -0.38 -0.56 2.43 2.02 0.71 -0.65 117.35 118.40 2yrz s TYR 86 Ca 0.63 0.88 -0.21 0.00 -0.37 0.00 0.00 57.07 58.00 2yrz s TYR 86 Cb -0.15 0.09 0.06 0.00 -0.40 0.00 0.00 41.96 41.56 2yrz s TYR 86 CO 0.37 -0.25 0.81 0.54 -1.57 0.00 0.00 175.55 175.45 2yrz s VAL 87 N 1.23 4.59 -0.09 0.71 0.11 0.29 -0.36 120.40 126.88 2yrz s VAL 87 Ca -0.09 -0.27 -0.22 0.00 -2.93 0.00 0.00 61.98 58.48 2yrz s VAL 87 Cb -0.10 -4.48 -0.04 0.00 -1.53 0.00 0.00 36.38 30.23 2yrz s VAL 87 CO -0.09 -1.08 0.63 -0.36 -3.33 0.00 0.00 175.10 170.86 2yrz s PHE 88 N 3.38 3.54 -0.27 1.54 0.40 -0.85 -2.74 117.98 122.97 2yrz s PHE 88 Ca 0.21 1.11 0.01 0.00 -0.60 0.00 0.00 56.93 57.66 2yrz s PHE 88 Cb -0.17 -2.73 0.08 0.00 0.51 0.00 0.00 43.02 40.71 2yrz s PHE 88 CO 0.13 0.09 0.01 1.03 0.70 0.00 0.00 175.22 177.18 2yrz s ARG 89 N 0.86 1.26 0.28 0.44 0.52 0.16 0.19 118.95 122.65 2yrz s ARG 89 Ca 0.33 -1.10 0.01 0.00 -0.52 0.00 0.00 55.73 54.46 2yrz s ARG 89 Cb -0.17 -2.49 -0.03 0.00 0.52 0.00 0.00 34.95 32.78 2yrz s ARG 89 CO 0.15 -0.76 0.46 0.08 0.02 0.00 0.00 175.30 175.25 2yrz s VAL 90 N 1.42 5.17 -0.04 3.52 1.01 -1.03 -0.88 120.40 129.57 2yrz s VAL 90 Ca 0.02 -0.59 -0.30 0.00 0.00 0.00 0.00 61.98 61.11 2yrz s VAL 90 Cb -0.18 -3.83 0.11 0.00 0.00 0.00 0.00 36.38 32.48 2yrz s VAL 90 CO -0.12 -0.40 0.94 0.00 0.00 0.00 0.00 175.10 175.52 2yrz s ARG 91 N -3.99 0.73 0.20 2.72 1.70 -0.08 -0.42 118.95 119.81 2yrz s ARG 91 Ca 0.38 -0.24 0.07 0.00 -0.47 0.00 0.00 55.73 55.46 2yrz s ARG 91 Cb -0.10 0.34 -0.04 0.00 -0.57 0.00 0.00 34.95 34.58 2yrz s ARG 91 CO 0.32 -0.31 0.07 0.00 -1.08 0.00 0.00 175.30 174.30 2yrz s ALA 92 N -2.89 3.37 -0.05 7.88 0.00 -1.26 -1.00 121.76 127.81 2yrz s ALA 92 Ca 0.05 -1.38 0.06 0.00 0.00 0.00 0.00 51.96 50.69 2yrz s ALA 92 Cb -0.01 -1.12 -0.01 0.00 0.00 0.00 0.00 23.12 21.98 2yrz s ALA 92 CO -0.08 0.41 -0.23 -1.14 0.00 0.00 0.00 175.76 174.72 2yrz s GLN 93 N -3.28 2.25 0.26 0.00 0.74 -1.22 -3.45 119.66 114.96 2yrz s GLN 93 Ca 0.30 -0.84 0.04 0.00 0.05 0.00 0.00 55.36 54.91 2yrz s GLN 93 Cb -0.09 -1.97 -0.05 0.00 1.10 0.00 0.00 33.01 32.00 2yrz s GLN 93 CO 0.21 0.39 0.00 -1.54 -0.55 0.00 0.00 175.29 173.80 2yrz s SER 94 N -0.22 2.04 0.40 6.67 1.04 -1.08 -1.14 113.70 121.42 2yrz s SER 94 Ca -0.01 -1.25 0.30 0.00 0.48 0.00 0.00 55.95 55.47 2yrz s SER 94 Cb -0.12 -0.03 1.35 0.00 0.10 0.00 0.00 66.02 67.32 2yrz s SER 94 CO 0.02 -0.51 1.41 1.67 0.98 0.00 0.00 173.24 176.81 2yrz n GLN 95 N -0.50 -0.03 0.04 4.02 7.27 -1.26 -0.99 117.38 125.93 2yrz n GLN 95 Ca -0.04 1.13 -0.02 0.00 0.07 0.00 0.00 57.00 58.14 2yrz n GLN 95 Cb 0.64 -2.23 -0.01 0.00 2.41 0.00 0.00 30.24 31.05 2yrz n GLN 95 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 2yrz h GLU 96 N 0.00 -0.12 0.00 3.69 4.39 -1.95 -3.51 114.58 117.09 2yrz h GLU 96 Ca 0.80 0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.50 2yrz h GLU 96 Cb 2.58 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 31.26 2yrz h GLU 96 CO -0.41 -0.08 0.00 0.41 -1.16 0.00 0.00 179.01 177.77 2yrz n GLY 97 N 0.69 -1.07 3.61 -3.84 0.00 -0.17 -5.08 105.19 99.33 2yrz n GLY 97 Ca -0.02 -0.83 -0.43 0.00 0.00 0.00 0.00 46.02 44.75 2yrz n GLY 97 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2yrz s TRP 98 N -3.00 3.04 0.00 1.61 0.52 -1.26 -2.62 118.94 117.23 2yrz s TRP 98 Ca 0.00 0.83 0.00 0.00 0.02 0.00 0.00 56.10 56.95 2yrz s TRP 98 Cb 0.00 -3.80 0.00 0.00 -1.15 0.00 0.00 33.47 28.52 2yrz s TRP 98 CO 0.00 -0.90 0.00 0.41 0.02 0.00 0.00 176.95 176.48 2yrz n GLY 99 N 4.37 -0.20 3.97 0.98 0.00 -1.22 -5.03 105.19 108.06 2yrz n GLY 99 Ca 0.09 -0.16 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 2yrz n GLY 99 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2yrz s ARG 100 N 0.00 1.88 0.29 1.61 1.81 -1.25 -4.98 118.95 118.31 2yrz s ARG 100 Ca 0.00 -0.80 0.02 0.00 -1.72 0.00 0.00 55.73 53.23 2yrz s ARG 100 Cb 0.00 -2.29 -0.06 0.00 -0.45 0.00 0.00 34.95 32.15 2yrz s ARG 100 CO 0.00 -1.33 0.08 -1.83 -0.68 0.00 0.00 175.30 171.54 2yrz s GLU 101 N -5.15 1.53 -0.21 3.54 4.04 -1.26 -4.33 118.70 116.87 2yrz s GLU 101 Ca 0.64 -1.84 0.01 0.00 0.04 0.00 0.00 54.97 53.82 2yrz s GLU 101 Cb -0.07 -0.55 0.04 0.00 0.02 0.00 0.00 34.13 33.57 2yrz s GLU 101 CO 0.44 -0.25 -0.14 0.50 -1.84 0.00 0.00 175.26 173.97 2yrz s ARG 102 N -3.96 2.46 0.29 -4.83 6.06 0.44 -4.66 118.95 114.75 2yrz s ARG 102 Ca 0.37 -0.97 -0.29 0.00 -2.50 0.00 0.00 55.73 52.34 2yrz s ARG 102 Cb 0.08 -2.59 -0.10 0.00 0.06 0.00 0.00 34.95 32.40 2yrz s ARG 102 CO 0.15 -0.38 1.24 -2.00 -2.50 0.00 0.00 175.30 171.81 2yrz s GLU 103 N 1.28 4.46 -0.46 5.12 2.12 -1.26 -2.46 118.70 127.49 2yrz s GLU 103 Ca -0.01 2.05 0.06 0.00 0.36 0.00 0.00 54.97 57.43 2yrz s GLU 103 Cb -0.16 -3.14 0.19 0.00 0.26 0.00 0.00 34.13 31.29 2yrz s GLU 103 CO -0.09 -0.07 0.58 0.41 -0.54 0.00 0.00 175.26 175.55 2yrz n GLY 104 N 1.24 0.84 3.76 -1.50 0.00 0.49 -4.87 105.19 105.16 2yrz n GLY 104 Ca 0.01 -0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 2yrz n GLY 104 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2yrz s VAL 105 N 0.35 2.77 0.03 1.61 1.01 -1.26 -2.02 120.40 122.89 2yrz s VAL 105 Ca 0.32 0.74 0.02 0.00 0.00 0.00 0.00 61.98 63.06 2yrz s VAL 105 Cb 0.06 -3.47 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 2yrz s VAL 105 CO -0.13 0.16 -0.07 -0.51 0.00 0.00 0.00 175.10 174.55 2yrz s ILE 106 N -0.85 0.50 -0.13 2.22 1.10 0.52 -4.92 121.20 119.63 2yrz s ILE 106 Ca 0.51 -0.83 0.02 0.00 -0.51 0.00 0.00 60.65 59.85 2yrz s ILE 106 Cb -0.40 -0.53 0.00 0.00 0.15 0.00 0.00 42.46 41.68 2yrz s ILE 106 CO 0.50 -0.23 -0.20 -0.89 -2.11 0.00 0.00 174.94 172.01 2yrz s THR 107 N -1.01 2.36 -0.43 4.00 2.01 -1.26 -0.20 115.64 121.10 2yrz s THR 107 Ca -0.06 -0.89 -0.29 0.00 0.31 0.00 0.00 61.69 60.76 2yrz s THR 107 Cb -0.08 -1.95 0.01 0.00 0.01 0.00 0.00 72.50 70.49 2yrz s THR 107 CO 0.00 0.54 1.45 -0.63 -0.69 0.00 0.00 174.62 175.29 2yrz s ILE 108 N 0.62 3.84 -0.38 1.82 -1.09 -1.21 -4.97 121.20 119.83 2yrz s ILE 108 Ca -0.10 0.84 -0.06 0.00 -2.23 0.00 0.00 60.65 59.10 2yrz s ILE 108 Cb -0.16 -4.19 0.08 0.00 -1.58 0.00 0.00 42.46 36.61 2yrz s ILE 108 CO 0.03 -0.79 0.18 -1.61 -1.23 0.00 0.00 174.94 171.51 2yrz s GLU 109 N 5.12 2.39 -0.01 2.79 2.02 -1.26 -3.00 118.70 126.74 2yrz s GLU 109 Ca 0.62 -1.50 0.16 0.00 0.02 0.00 0.00 54.97 54.27 2yrz s GLU 109 Cb -0.14 -3.57 -0.22 0.00 0.10 0.00 0.00 34.13 30.30 2yrz s GLU 109 CO 0.32 -0.89 0.50 -1.13 0.02 0.00 0.00 175.26 174.07 2yrz n SER 110 N 4.75 1.02 -2.72 -0.19 3.41 -1.26 -4.57 113.62 114.06 2yrz n SER 110 Ca -0.09 -0.37 -0.28 0.00 -0.26 0.00 0.00 58.87 57.87 2yrz n SER 110 Cb 0.43 1.44 -0.02 0.00 -0.26 0.00 0.00 64.21 65.80 2yrz n SER 110 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2yrz n GLN 111 N -1.78 3.38 -1.82 4.33 7.27 -1.26 -5.05 117.38 122.45 2yrz n GLN 111 Ca -0.00 -4.64 -0.42 0.00 0.07 0.00 0.00 57.00 52.00 2yrz n GLN 111 Cb 0.35 -2.25 -0.03 0.00 2.41 0.00 0.00 30.24 30.73 2yrz n GLN 111 CO 0.00 0.00 0.00 0.14 0.07 0.00 0.00 177.06 177.27 2yrz s VAL 112 N -5.04 3.28 0.17 1.69 -7.23 -1.26 -4.95 120.40 107.05 2yrz s VAL 112 Ca 0.48 0.32 -0.12 0.00 -1.81 0.00 0.00 61.98 60.85 2yrz s VAL 112 Cb 0.34 -3.26 0.01 0.00 0.56 0.00 0.00 36.38 34.03 2yrz s VAL 112 CO -0.17 -0.09 0.36 -0.55 -0.31 0.00 0.00 175.10 174.34 2yrz s SER 113 N 5.16 -0.07 0.00 4.85 0.15 -1.26 -5.14 113.70 117.39 2yrz s SER 113 Ca 0.85 -0.70 0.00 0.00 0.70 0.00 0.00 55.95 56.80 2yrz s SER 113 Cb -0.34 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 64.45 2yrz s SER 113 CO 0.35 -0.93 0.00 0.61 1.20 0.00 0.00 173.24 174.47 2yrz n GLY 114 N -0.25 -2.14 3.59 9.45 0.00 -1.26 -4.79 105.19 109.79 2yrz n GLY 114 Ca -0.09 -1.60 -0.42 0.00 0.00 0.00 0.00 46.02 43.92 2yrz n GLY 114 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yrz s PRO 115 N -0.17 3.19 -1.08 1.61 0.04 -1.26 -4.93 135.00 132.40 2yrz s PRO 115 Ca 0.00 1.12 -0.19 0.00 0.04 0.00 0.00 61.00 61.97 2yrz s PRO 115 Cb 0.00 -4.22 0.10 0.00 0.04 0.00 0.00 34.50 30.43 2yrz s PRO 115 CO 0.00 -2.04 1.40 0.45 0.04 0.00 0.00 177.00 176.85 2yrz s SER 116 N 6.23 6.72 0.26 6.66 0.15 -1.26 -4.99 113.70 127.47 2yrz s SER 116 Ca 0.73 -2.14 -0.30 0.00 0.70 0.00 0.00 55.95 54.95 2yrz s SER 116 Cb -0.18 -2.49 -0.14 0.00 -1.71 0.00 0.00 66.02 61.50 2yrz s SER 116 CO 0.30 -1.15 1.12 -0.24 1.20 0.00 0.00 173.24 174.47 2yrz n SER 117 N 7.42 1.62 0.00 5.45 2.88 -1.26 -5.24 113.62 124.49 2yrz n SER 117 Ca 0.34 1.17 0.00 0.00 -1.33 0.00 0.00 58.87 59.05 2yrz n SER 117 Cb 0.48 -1.30 0.00 0.00 -0.75 0.00 0.00 64.21 62.63 2yrz n SER 117 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42