#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 1.34 -4.73 1.61 7.64 -1.26 -4.90 113.62 113.33 2yrz n SER 2 Ca 0.00 -0.32 -0.36 0.00 1.01 0.00 0.00 58.87 59.20 2yrz n SER 2 Cb 0.00 -1.29 -0.08 0.00 -1.01 0.00 0.00 64.21 61.83 2yrz n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2yrz s SER 3 N 10.38 6.31 0.00 6.43 1.04 -1.26 -4.94 113.70 131.66 2yrz s SER 3 Ca 1.14 0.36 0.00 0.00 0.48 0.00 0.00 55.95 57.92 2yrz s SER 3 Cb -0.61 -2.13 0.00 0.00 0.10 0.00 0.00 66.02 63.37 2yrz s SER 3 CO 0.35 0.14 0.00 0.61 0.98 0.00 0.00 173.24 175.32 2yrz n GLY 4 N 3.48 2.61 2.54 7.32 0.00 -1.26 -5.02 105.19 114.87 2yrz n GLY 4 Ca -0.14 -0.46 -0.37 0.00 0.00 0.00 0.00 46.02 45.05 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 0.00 7.56 -3.76 1.61 7.64 -1.26 -4.79 113.62 120.62 2yrz n SER 5 Ca 0.00 -3.81 -0.14 0.00 1.01 0.00 0.00 58.87 55.93 2yrz n SER 5 Cb 0.00 -0.99 -0.15 0.00 -1.01 0.00 0.00 64.21 62.05 2yrz n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yrz s SER 6 N -1.61 -0.00 0.00 6.43 0.01 -1.26 -4.91 113.70 112.36 2yrz s SER 6 Ca 0.60 0.14 0.00 0.00 1.31 0.00 0.00 55.95 58.00 2yrz s SER 6 Cb 0.48 0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.75 2yrz s SER 6 CO -0.16 -0.13 0.00 0.61 0.41 0.00 0.00 173.24 173.96 2yrz n GLY 7 N 4.15 2.18 4.08 3.44 0.00 -1.26 -4.72 105.19 113.07 2yrz n GLY 7 Ca -0.27 -0.37 -0.30 0.00 0.00 0.00 0.00 46.02 45.09 2yrz n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2yrz n SER 8 N 2.98 -1.18 -4.44 1.61 7.64 -1.26 -4.77 113.62 114.19 2yrz n SER 8 Ca 0.00 -1.04 -0.51 0.00 1.01 0.00 0.00 58.87 58.34 2yrz n SER 8 Cb 0.00 -2.80 -0.04 0.00 -1.01 0.00 0.00 64.21 60.36 2yrz n SER 8 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2yrz n HIS 9 N -4.42 -0.02 -1.57 1.43 -0.00 -1.26 -4.65 115.22 104.73 2yrz n HIS 9 Ca -0.18 0.96 -0.57 0.00 -0.00 0.00 0.00 57.72 57.93 2yrz n HIS 9 Cb 0.62 -2.02 -0.08 0.00 -0.00 0.00 0.00 29.99 28.51 2yrz n HIS 9 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.34 176.09 2yrz n ASP 10 N 1.84 2.00 -3.96 0.41 8.00 -1.26 -4.81 116.55 118.77 2yrz n ASP 10 Ca 0.18 0.84 -0.36 0.00 0.71 0.00 0.00 54.79 56.16 2yrz n ASP 10 Cb 0.21 -1.12 0.01 0.00 -0.02 0.00 0.00 41.12 40.20 2yrz n ASP 10 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2yrz n SER 11 N 6.83 -3.37 -3.64 -2.24 7.64 -1.26 -4.72 113.62 112.86 2yrz n SER 11 Ca 0.35 0.62 -0.34 0.00 1.01 0.00 0.00 58.87 60.51 2yrz n SER 11 Cb 0.12 -0.79 0.01 0.00 -1.01 0.00 0.00 64.21 62.53 2yrz n SER 11 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2yrz n ARG 12 N 1.39 0.00 -0.61 1.43 5.12 -1.26 -4.76 116.66 117.97 2yrz n ARG 12 Ca 0.08 0.00 -0.10 0.00 -1.93 0.00 0.00 57.85 55.90 2yrz n ARG 12 Cb 0.44 -0.85 0.04 0.00 -1.16 0.00 0.00 32.46 30.92 2yrz n ARG 12 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2yrz n LEU 13 N 2.10 5.25 -4.39 0.55 4.32 -1.26 -4.85 117.00 118.72 2yrz n LEU 13 Ca 0.08 -2.65 -0.33 0.00 -0.02 0.00 0.00 56.01 53.09 2yrz n LEU 13 Cb 0.38 -0.86 -0.14 0.00 -1.62 0.00 0.00 43.42 41.18 2yrz n LEU 13 CO 0.46 0.94 -0.46 0.42 -1.22 0.00 0.00 177.39 177.53 2yrz s THR 14 N -1.39 2.96 0.00 -5.08 -4.23 -1.26 -4.98 115.64 101.66 2yrz s THR 14 Ca 0.21 -0.71 0.00 0.00 -1.18 0.00 0.00 61.69 60.00 2yrz s THR 14 Cb 0.17 -2.21 0.00 0.00 1.34 0.00 0.00 72.50 71.80 2yrz s THR 14 CO 0.02 0.55 0.00 0.00 -0.54 0.00 0.00 174.62 174.64 2yrz n ALA 15 N 3.16 2.48 -0.14 3.99 0.00 -1.26 -4.78 120.51 123.97 2yrz n ALA 15 Ca -0.18 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.22 2yrz n ALA 15 Cb 0.53 0.33 0.02 0.00 0.00 0.00 0.00 19.45 20.33 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 2.68 2.73 3.81 0.00 0.00 -1.26 -4.82 105.19 108.33 2yrz n GLY 16 Ca 0.00 -0.25 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.57 4.86 -0.07 1.61 -7.23 -1.26 -4.15 120.40 113.58 2yrz s VAL 17 Ca 0.08 -0.40 -0.30 0.00 -1.81 0.00 0.00 61.98 59.56 2yrz s VAL 17 Cb 0.07 -3.25 -0.05 0.00 0.56 0.00 0.00 36.38 33.72 2yrz s VAL 17 CO 0.00 0.32 1.51 -2.16 -0.31 0.00 0.00 175.10 174.46 2yrz s PRO 18 N -1.86 4.21 1.19 4.82 0.04 -1.26 -4.70 135.00 137.44 2yrz s PRO 18 Ca 0.25 2.02 -0.15 0.00 0.04 0.00 0.00 61.00 63.16 2yrz s PRO 18 Cb -0.12 -3.84 0.26 0.00 0.04 0.00 0.00 34.50 30.84 2yrz s PRO 18 CO 0.16 -0.76 0.74 -3.47 0.04 0.00 0.00 177.00 173.72 2yrz n ASP 19 N 6.62 -2.13 -4.68 6.66 2.03 -0.49 -3.52 116.55 121.05 2yrz n ASP 19 Ca 0.16 -0.22 -0.45 0.00 0.52 0.00 0.00 54.79 54.79 2yrz n ASP 19 Cb 0.43 -1.16 -0.04 0.00 -0.72 0.00 0.00 41.12 39.64 2yrz n ASP 19 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2yrz n THR 20 N -4.94 0.28 -2.26 5.18 -1.04 -1.26 -4.62 114.28 105.61 2yrz n THR 20 Ca 0.02 -0.07 -0.38 0.00 -2.04 0.00 0.00 64.05 61.58 2yrz n THR 20 Cb 0.56 -1.56 -0.02 0.00 -1.82 0.00 0.00 70.33 67.49 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 0.53 4.00 1.05 -2.82 0.04 -1.26 -4.88 135.00 131.66 2yrz s PRO 21 Ca 0.75 1.87 -0.12 0.00 0.04 0.00 0.00 61.00 63.54 2yrz s PRO 21 Cb -0.66 -2.65 0.22 0.00 0.04 0.00 0.00 34.50 31.46 2yrz s PRO 21 CO 0.41 -0.37 1.08 0.99 0.04 0.00 0.00 177.00 179.15 2yrz s THR 22 N -1.41 2.10 0.79 1.26 2.01 -1.26 -4.49 115.64 114.63 2yrz s THR 22 Ca 0.58 0.03 -0.17 0.00 0.31 0.00 0.00 61.69 62.44 2yrz s THR 22 Cb -0.31 -2.11 -0.13 0.00 0.01 0.00 0.00 72.50 69.95 2yrz s THR 22 CO 0.39 -0.04 -0.40 -2.11 -0.69 0.00 0.00 174.62 171.77 2yrz n ARG 23 N -4.59 0.01 -3.61 4.92 1.85 -1.26 -4.48 116.66 109.51 2yrz n ARG 23 Ca 0.07 0.01 -0.20 0.00 -1.00 0.00 0.00 57.85 56.73 2yrz n ARG 23 Cb 0.53 -1.10 -0.01 0.00 -1.05 0.00 0.00 32.46 30.83 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 5.89 3.98 -0.14 2.89 1.43 -1.26 -4.53 118.68 126.95 2yrz s LEU 24 Ca 0.49 -0.18 -0.00 0.00 -1.03 0.00 0.00 54.13 53.41 2yrz s LEU 24 Cb -0.31 -2.70 0.03 0.00 0.03 0.00 0.00 46.19 43.24 2yrz s LEU 24 CO 0.74 -0.35 -0.10 -0.69 0.23 0.00 0.00 176.35 176.18 2yrz s VAL 25 N -2.16 1.29 -0.18 -1.59 1.01 0.07 -4.88 120.40 113.96 2yrz s VAL 25 Ca 0.42 -0.52 -0.08 0.00 0.00 0.00 0.00 61.98 61.80 2yrz s VAL 25 Cb -0.09 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 2yrz s VAL 25 CO 0.30 0.35 0.10 -0.36 0.00 0.00 0.00 175.10 175.49 2yrz s PHE 26 N 1.59 3.38 -0.17 5.22 0.40 -1.23 -1.25 117.98 125.91 2yrz s PHE 26 Ca 0.04 0.27 -0.01 0.00 -0.60 0.00 0.00 56.93 56.63 2yrz s PHE 26 Cb -0.13 -2.08 -0.22 0.00 0.51 0.00 0.00 43.02 41.09 2yrz s PHE 26 CO -0.09 0.33 0.14 0.45 0.70 0.00 0.00 175.22 176.75 2yrz n SER 27 N 3.22 1.90 -3.22 1.36 2.88 -0.81 -4.89 113.62 114.05 2yrz n SER 27 Ca -0.17 0.08 -0.15 0.00 -1.33 0.00 0.00 58.87 57.30 2yrz n SER 27 Cb 0.53 -0.56 0.08 0.00 -0.75 0.00 0.00 64.21 63.51 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 -3.06 -2.06 -0.30 -1.46 0.00 -1.26 -4.83 120.51 107.54 2yrz n ALA 28 Ca -0.36 0.01 0.35 0.00 0.00 0.00 0.00 53.44 53.43 2yrz n ALA 28 Cb 1.03 -3.44 0.69 0.00 0.00 0.00 0.00 19.45 17.73 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 -1.50 0.00 0.00 0.00 -0.00 -1.84 -3.44 115.31 108.53 2yrz h LEU 29 Ca -0.56 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.32 2yrz h LEU 29 Cb 1.31 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.97 2yrz h LEU 29 CO 0.45 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.50 2yrz n GLY 30 N -1.74 1.58 0.19 0.83 0.00 -1.13 -4.94 105.19 99.97 2yrz n GLY 30 Ca 0.26 -0.86 0.04 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.93 -3.14 132.00 128.67 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 0.39 -0.05 0.25 -0.23 0.00 0.00 178.00 178.36 2yrz n THR 32 N -3.78 1.70 -4.08 1.56 -2.24 -1.26 -4.33 114.28 101.86 2yrz n THR 32 Ca -0.01 -2.04 -0.13 0.00 -2.27 0.00 0.00 64.05 59.59 2yrz n THR 32 Cb 0.46 -0.16 -0.12 0.00 -2.10 0.00 0.00 70.33 68.41 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 -2.69 0.76 0.19 3.42 1.04 -1.19 -1.89 113.70 113.35 2yrz s SER 33 Ca 0.29 -0.44 -0.17 0.00 0.48 0.00 0.00 55.95 56.11 2yrz s SER 33 Cb 0.25 0.02 0.03 0.00 0.10 0.00 0.00 66.02 66.41 2yrz s SER 33 CO 0.03 -0.15 0.51 -0.76 0.98 0.00 0.00 173.24 173.85 2yrz s LEU 34 N -1.23 0.13 -0.23 2.42 1.43 0.32 -2.86 118.68 118.66 2yrz s LEU 34 Ca -0.07 -0.50 -0.04 0.00 -1.03 0.00 0.00 54.13 52.48 2yrz s LEU 34 Cb -0.08 2.08 0.08 0.00 0.03 0.00 0.00 46.19 48.30 2yrz s LEU 34 CO 0.00 -1.04 0.11 -0.60 0.23 0.00 0.00 176.35 175.06 2yrz s ARG 35 N -3.88 0.13 -0.15 1.70 3.52 -1.26 0.97 118.95 119.98 2yrz s ARG 35 Ca 0.10 -0.29 -0.16 0.00 -0.13 0.00 0.00 55.73 55.24 2yrz s ARG 35 Cb -0.01 -1.48 -0.04 0.00 -1.56 0.00 0.00 34.95 31.86 2yrz s ARG 35 CO -0.03 -0.84 0.41 0.08 -0.81 0.00 0.00 175.30 174.11 2yrz s VAL 36 N 2.13 5.22 -0.06 7.11 1.01 0.17 -1.93 120.40 134.05 2yrz s VAL 36 Ca 0.06 0.78 0.03 0.00 0.00 0.00 0.00 61.98 62.85 2yrz s VAL 36 Cb -0.16 -3.75 0.01 0.00 0.00 0.00 0.00 36.38 32.48 2yrz s VAL 36 CO -0.23 0.32 -0.13 -0.55 0.00 0.00 0.00 175.10 174.51 2yrz s SER 37 N 0.72 1.79 0.35 3.32 0.15 -0.38 -0.36 113.70 119.29 2yrz s SER 37 Ca 0.22 -0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.57 2yrz s SER 37 Cb -0.14 -0.75 -0.00 0.00 -1.71 0.00 0.00 66.02 63.41 2yrz s SER 37 CO 0.08 0.05 0.02 -2.67 1.20 0.00 0.00 173.24 171.92 2yrz n TRP 38 N 3.67 0.72 -5.14 3.44 2.14 0.09 -0.75 117.44 121.60 2yrz n TRP 38 Ca -0.22 -1.77 -0.32 0.00 2.07 0.00 0.00 57.50 57.26 2yrz n TRP 38 Cb 0.52 -0.20 -0.16 0.00 -0.81 0.00 0.00 31.31 30.66 2yrz n TRP 38 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2yrz s GLN 39 N -3.26 3.01 -0.51 -2.67 -0.44 -1.26 -4.79 119.66 109.74 2yrz s GLN 39 Ca 0.02 -0.85 -0.34 0.00 -2.50 0.00 0.00 55.36 51.70 2yrz s GLN 39 Cb 0.00 -2.34 -0.13 0.00 -1.64 0.00 0.00 33.01 28.90 2yrz s GLN 39 CO 0.02 0.23 2.32 -1.91 0.50 0.00 0.00 175.29 176.45 2yrz n GLU 40 N 3.39 0.78 -1.23 1.67 2.13 -1.26 -4.18 120.64 121.94 2yrz n GLU 40 Ca -0.19 0.16 -0.30 0.00 0.66 0.00 0.00 57.16 57.49 2yrz n GLU 40 Cb 0.53 -2.37 0.12 0.00 0.27 0.00 0.00 31.44 29.99 2yrz n GLU 40 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 2yrz s PRO 41 N 7.08 1.65 0.26 5.31 0.04 -1.26 -4.99 135.00 143.09 2yrz s PRO 41 Ca 1.13 0.96 -0.29 0.00 0.04 0.00 0.00 61.00 62.83 2yrz s PRO 41 Cb -0.87 -1.84 -0.09 0.00 0.04 0.00 0.00 34.50 31.74 2yrz s PRO 41 CO 0.46 -2.01 1.21 -0.98 0.04 0.00 0.00 177.00 175.73 2yrz s ARG 42 N -4.92 4.49 -0.30 4.56 1.70 -1.26 -4.82 118.95 118.39 2yrz s ARG 42 Ca 0.63 1.98 -0.04 0.00 -0.47 0.00 0.00 55.73 57.82 2yrz s ARG 42 Cb -0.18 -3.17 0.18 0.00 -0.57 0.00 0.00 34.95 31.22 2yrz s ARG 42 CO 0.57 -0.04 0.69 0.00 -1.08 0.00 0.00 175.30 175.43 2yrz h GLU 44 N 7.98 0.00 -6.19 0.00 4.39 -1.85 -3.41 114.58 115.51 2yrz h GLU 44 Ca -0.21 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 58.94 2yrz h GLU 44 Cb 1.15 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.74 2yrz h GLU 44 CO 0.18 0.00 -0.55 1.03 -1.16 0.00 0.00 179.01 178.52 2yrz s ARG 45 N -4.64 2.96 0.27 2.33 1.81 -1.26 -5.09 118.95 115.33 2yrz s ARG 45 Ca -0.04 -0.89 -0.29 0.00 -1.72 0.00 0.00 55.73 52.78 2yrz s ARG 45 Cb 0.16 -2.65 -0.10 0.00 -0.45 0.00 0.00 34.95 31.91 2yrz s ARG 45 CO 0.56 0.46 1.25 -1.25 -0.68 0.00 0.00 175.30 175.65 2yrz s PRO 46 N -3.32 4.44 0.42 3.54 0.04 -1.26 -4.84 135.00 134.02 2yrz s PRO 46 Ca 0.32 2.05 -0.14 0.00 0.04 0.00 0.00 61.00 63.27 2yrz s PRO 46 Cb -0.10 -3.14 -0.08 0.00 0.04 0.00 0.00 34.50 31.22 2yrz s PRO 46 CO 0.24 -0.11 0.84 -0.51 0.04 0.00 0.00 177.00 177.51 2yrz s LEU 47 N -1.13 3.84 -0.08 -3.56 1.43 -1.26 -3.55 118.68 114.36 2yrz s LEU 47 Ca 0.50 1.35 0.15 0.00 -1.03 0.00 0.00 54.13 55.11 2yrz s LEU 47 Cb -0.37 -4.23 -0.22 0.00 0.03 0.00 0.00 46.19 41.40 2yrz s LEU 47 CO 0.45 -0.40 0.21 0.00 0.23 0.00 0.00 176.35 176.84 2yrz n GLN 48 N -1.08 0.99 0.00 1.70 6.02 -0.45 -4.78 117.38 119.79 2yrz n GLN 48 Ca 0.04 -0.08 0.00 0.00 -0.01 0.00 0.00 57.00 56.95 2yrz n GLN 48 Cb 0.54 -1.39 0.00 0.00 1.02 0.00 0.00 30.24 30.41 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 1.81 -0.94 3.46 1.08 0.00 -1.25 -3.67 105.19 105.67 2yrz n GLY 49 Ca -0.13 -0.09 -0.11 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.36 -0.01 1.61 2.02 -1.03 -3.69 117.35 111.90 2yrz s TYR 50 Ca 0.00 0.08 0.02 0.00 -0.37 0.00 0.00 57.07 56.80 2yrz s TYR 50 Cb 0.00 0.48 -0.00 0.00 -0.40 0.00 0.00 41.96 42.04 2yrz s TYR 50 CO 0.00 -0.87 -0.07 0.45 -1.57 0.00 0.00 175.55 173.49 2yrz s SER 51 N -2.80 0.89 -0.45 2.29 0.15 -0.41 0.60 113.70 113.98 2yrz s SER 51 Ca 0.04 -0.14 0.02 0.00 0.70 0.00 0.00 55.95 56.57 2yrz s SER 51 Cb -0.01 -0.12 0.14 0.00 -1.71 0.00 0.00 66.02 64.32 2yrz s SER 51 CO -0.09 0.08 0.26 -0.69 1.20 0.00 0.00 173.24 174.01 2yrz s VAL 52 N -0.12 1.36 -0.25 4.45 1.01 0.66 -1.19 120.40 126.33 2yrz s VAL 52 Ca 0.02 -2.64 -0.23 0.00 0.00 0.00 0.00 61.98 59.14 2yrz s VAL 52 Cb -0.04 -1.94 -0.01 0.00 0.00 0.00 0.00 36.38 34.39 2yrz s VAL 52 CO -0.00 -0.94 0.74 -1.61 0.00 0.00 0.00 175.10 173.29 2yrz s GLU 53 N 0.24 4.15 0.01 2.72 2.02 -1.00 -2.57 118.70 124.27 2yrz s GLU 53 Ca 0.19 0.75 0.04 0.00 0.02 0.00 0.00 54.97 55.97 2yrz s GLU 53 Cb -0.21 -3.65 -0.01 0.00 0.10 0.00 0.00 34.13 30.36 2yrz s GLU 53 CO -0.03 -0.47 -0.11 1.52 0.02 0.00 0.00 175.26 176.19 2yrz s TYR 54 N 2.69 0.99 0.32 1.61 1.13 -0.63 -0.11 117.35 123.35 2yrz s TYR 54 Ca 0.31 -0.23 -0.09 0.00 -1.41 0.00 0.00 57.07 55.64 2yrz s TYR 54 Cb -0.15 -0.62 0.01 0.00 -1.10 0.00 0.00 41.96 40.10 2yrz s TYR 54 CO 0.08 -0.01 0.55 1.14 -2.51 0.00 0.00 175.55 174.80 2yrz s GLN 55 N -0.52 1.86 -0.24 -3.49 -2.07 -1.20 -0.79 119.66 113.21 2yrz s GLN 55 Ca 0.03 -1.51 -0.29 0.00 -1.82 0.00 0.00 55.36 51.76 2yrz s GLN 55 Cb -0.05 0.49 -0.02 0.00 -1.09 0.00 0.00 33.01 32.34 2yrz s GLN 55 CO 0.00 -0.80 1.61 -0.51 -1.32 0.00 0.00 175.29 174.27 2yrz s LEU 56 N -3.13 3.84 0.31 2.60 1.43 -1.26 -1.21 118.68 121.27 2yrz s LEU 56 Ca 0.24 1.54 0.04 0.00 -1.03 0.00 0.00 54.13 54.93 2yrz s LEU 56 Cb -0.02 -3.53 0.83 0.00 0.03 0.00 0.00 46.19 43.50 2yrz s LEU 56 CO 0.15 -1.30 1.55 -0.11 0.23 0.00 0.00 176.35 176.86 2yrz n LEU 57 N 8.61 -0.06 -0.15 1.79 7.94 -0.63 0.10 117.00 134.62 2yrz n LEU 57 Ca 0.19 1.68 -0.05 0.00 -1.11 0.00 0.00 56.01 56.72 2yrz n LEU 57 Cb 0.46 -0.64 0.04 0.00 0.53 0.00 0.00 43.42 43.81 2yrz n LEU 57 CO 0.65 -1.72 1.00 -0.55 -1.11 0.00 0.00 177.39 175.66 2yrz h ASN 58 N 0.00 0.31 0.00 1.96 7.08 -1.90 -3.47 115.58 119.56 2yrz h ASN 58 Ca 0.63 0.03 0.00 0.00 -3.08 0.00 0.00 56.30 53.88 2yrz h ASN 58 Cb 1.36 -0.03 0.00 0.00 -2.08 0.00 0.00 38.32 37.57 2yrz h ASN 58 CO -0.91 0.22 0.00 0.61 -2.08 0.00 0.00 177.43 175.27 2yrz n GLY 59 N -1.24 2.72 0.00 9.14 0.00 0.29 -5.19 105.19 110.91 2yrz n GLY 59 Ca 0.03 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 2.00 3.61 -0.02 0.00 -1.25 -4.94 105.19 104.59 2yrz n GLY 60 Ca 0.00 -0.78 -0.45 0.00 0.00 0.00 0.00 46.02 44.79 2yrz n GLY 60 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2yrz n GLU 61 N 0.00 1.53 -4.42 1.61 2.13 -1.26 -4.61 120.64 115.62 2yrz n GLU 61 Ca 0.00 0.54 -0.34 0.00 0.66 0.00 0.00 57.16 58.02 2yrz n GLU 61 Cb 0.00 -2.01 -0.11 0.00 0.27 0.00 0.00 31.44 29.59 2yrz n GLU 61 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 2yrz s LEU 62 N 0.25 3.40 -0.25 4.31 0.20 -1.26 -4.14 118.68 121.20 2yrz s LEU 62 Ca 0.63 0.02 -0.06 0.00 0.69 0.00 0.00 54.13 55.41 2yrz s LEU 62 Cb -0.71 -1.79 -0.01 0.00 -0.43 0.00 0.00 46.19 43.25 2yrz s LEU 62 CO 0.57 0.30 0.04 -1.00 -0.29 0.00 0.00 176.35 175.96 2yrz s HIS 63 N -0.43 3.06 -0.26 5.38 3.76 0.03 -4.98 115.29 121.85 2yrz s HIS 63 Ca 0.07 -0.71 -0.11 0.00 -0.15 0.00 0.00 55.06 54.16 2yrz s HIS 63 Cb -0.12 -2.20 -0.05 0.00 1.11 0.00 0.00 32.58 31.32 2yrz s HIS 63 CO 0.02 -0.47 0.19 0.50 -0.85 0.00 0.00 174.74 174.13 2yrz s ARG 64 N 1.55 4.01 -0.22 1.40 3.52 -1.26 -1.61 118.95 126.34 2yrz s ARG 64 Ca 0.05 -0.27 -0.04 0.00 -0.13 0.00 0.00 55.73 55.34 2yrz s ARG 64 Cb -0.15 -3.61 -0.01 0.00 -1.56 0.00 0.00 34.95 29.62 2yrz s ARG 64 CO 0.01 -0.08 -0.04 -0.51 -0.81 0.00 0.00 175.30 173.87 2yrz s LEU 65 N 1.46 2.90 0.01 -0.88 1.43 -1.06 -4.97 118.68 117.58 2yrz s LEU 65 Ca 0.08 -0.39 -0.03 0.00 -1.03 0.00 0.00 54.13 52.76 2yrz s LEU 65 Cb -0.15 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.29 2yrz s LEU 65 CO 0.08 -0.02 0.21 0.20 0.23 0.00 0.00 176.35 177.05 2yrz s ASN 66 N 1.46 6.39 -0.31 2.29 -0.87 -1.26 -0.24 114.94 122.39 2yrz s ASN 66 Ca 0.06 0.37 0.02 0.00 -1.57 0.00 0.00 52.86 51.73 2yrz s ASN 66 Cb -0.14 -2.01 0.08 0.00 -0.02 0.00 0.00 41.25 39.15 2yrz s ASN 66 CO -0.03 0.24 -0.00 -0.63 -2.57 0.00 0.00 177.10 174.10 2yrz s ILE 67 N -1.37 2.51 -2.00 0.60 -1.09 0.20 -4.95 121.20 115.10 2yrz s ILE 67 Ca 0.29 -1.85 0.11 0.00 -2.23 0.00 0.00 60.65 56.97 2yrz s ILE 67 Cb -0.13 -2.61 0.30 0.00 -1.58 0.00 0.00 42.46 38.44 2yrz s ILE 67 CO 0.20 -0.30 1.07 -0.81 -1.23 0.00 0.00 174.94 173.88 2yrz n PRO 68 N 4.43 0.49 -3.93 2.79 -0.04 -1.26 -2.46 135.00 135.01 2yrz n PRO 68 Ca -0.07 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.09 2yrz n PRO 68 Cb 0.42 -1.34 -0.16 0.00 -0.04 0.00 0.00 33.50 32.38 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 -1.85 3.61 0.00 3.54 2.47 -1.26 -4.88 114.94 116.57 2yrz s ASN 69 Ca 0.16 -1.05 0.15 0.00 0.42 0.00 0.00 52.86 52.54 2yrz s ASN 69 Cb 0.07 -1.13 0.85 0.00 -1.45 0.00 0.00 41.25 39.59 2yrz s ASN 69 CO 0.12 -0.22 1.37 -0.81 -3.72 0.00 0.00 177.10 173.85 2yrz n PRO 70 N 4.71 0.36 -0.07 0.43 -0.04 -1.24 -2.24 135.00 136.92 2yrz n PRO 70 Ca -0.12 0.07 -0.03 0.00 -0.04 0.00 0.00 63.50 63.38 2yrz n PRO 70 Cb 0.45 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.25 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 -1.13 1.97 -2.33 0.55 0.00 -1.26 -4.84 120.51 113.47 2yrz n ALA 71 Ca 0.10 -1.05 -0.40 0.00 0.00 0.00 0.00 53.44 52.09 2yrz n ALA 71 Cb 0.08 -0.38 -0.03 0.00 0.00 0.00 0.00 19.45 19.12 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 -2.86 2.97 -0.45 0.00 0.74 -0.95 -4.84 119.66 114.27 2yrz s GLN 72 Ca -0.09 0.17 0.02 0.00 0.05 0.00 0.00 55.36 55.51 2yrz s GLN 72 Cb 0.09 -4.26 0.53 0.00 1.10 0.00 0.00 33.01 30.47 2yrz s GLN 72 CO 0.86 -2.37 1.87 0.25 -0.55 0.00 0.00 175.29 175.35 2yrz n THR 73 N 6.76 3.07 -3.65 -0.34 -2.24 -1.26 -4.85 114.28 111.76 2yrz n THR 73 Ca 0.11 -1.94 -0.07 0.00 -2.27 0.00 0.00 64.05 59.87 2yrz n THR 73 Cb 0.50 -0.72 -0.08 0.00 -2.10 0.00 0.00 70.33 67.93 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 -1.10 -0.84 -0.02 3.42 1.04 -1.26 -0.73 113.70 114.21 2yrz s SER 74 Ca 0.52 1.36 0.03 0.00 0.48 0.00 0.00 55.95 58.34 2yrz s SER 74 Cb 0.43 1.30 -0.00 0.00 0.10 0.00 0.00 66.02 67.84 2yrz s SER 74 CO 0.07 -0.23 -0.10 0.54 0.98 0.00 0.00 173.24 174.50 2yrz s VAL 75 N 1.69 0.86 -0.27 5.02 0.11 0.52 -4.98 120.40 123.35 2yrz s VAL 75 Ca -0.09 -0.43 -0.19 0.00 -2.93 0.00 0.00 61.98 58.34 2yrz s VAL 75 Cb -0.06 -0.74 -0.02 0.00 -1.53 0.00 0.00 36.38 34.02 2yrz s VAL 75 CO -0.18 0.26 0.57 -0.69 -3.33 0.00 0.00 175.10 171.73 2yrz s VAL 76 N -0.00 5.02 -0.26 2.04 1.01 -1.26 -0.66 120.40 126.28 2yrz s VAL 76 Ca -0.00 0.95 -0.11 0.00 0.00 0.00 0.00 61.98 62.82 2yrz s VAL 76 Cb -0.07 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 2yrz s VAL 76 CO 0.00 0.02 0.18 -0.69 0.00 0.00 0.00 175.10 174.61 2yrz s VAL 77 N 2.42 5.33 0.34 2.92 1.01 0.27 -4.91 120.40 127.78 2yrz s VAL 77 Ca 0.23 0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.41 2yrz s VAL 77 Cb -0.15 -3.52 -0.01 0.00 0.00 0.00 0.00 36.38 32.70 2yrz s VAL 77 CO 0.09 0.29 0.08 -0.62 0.00 0.00 0.00 175.10 174.94 2yrz n GLU 78 N 4.74 0.77 -3.28 2.72 1.02 -1.26 0.12 120.64 125.47 2yrz n GLU 78 Ca -0.14 -2.72 -0.16 0.00 -0.02 0.00 0.00 57.16 54.12 2yrz n GLU 78 Cb 0.52 1.26 0.08 0.00 -0.02 0.00 0.00 31.44 33.27 2yrz n GLU 78 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2yrz n ASP 79 N -1.53 -2.93 -4.35 1.62 9.92 -0.79 -4.96 116.55 113.54 2yrz n ASP 79 Ca -0.08 -0.52 -0.21 0.00 -0.53 0.00 0.00 54.79 53.46 2yrz n ASP 79 Cb 0.48 -4.45 0.01 0.00 -0.64 0.00 0.00 41.12 36.51 2yrz n ASP 79 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2yrz n LEU 80 N -3.85 0.00 -4.68 0.64 4.77 -1.23 -5.10 117.00 107.56 2yrz n LEU 80 Ca -0.19 -2.32 -0.35 0.00 -0.03 0.00 0.00 56.01 53.13 2yrz n LEU 80 Cb 0.62 -0.08 -0.09 0.00 -2.33 0.00 0.00 43.42 41.54 2yrz n LEU 80 CO 0.53 -0.55 -0.31 -0.76 -1.33 0.00 0.00 177.39 174.97 2yrz s LEU 81 N 0.00 3.57 0.44 2.23 1.43 -1.26 -4.76 118.68 120.33 2yrz s LEU 81 Ca 0.29 0.14 -0.24 0.00 -1.03 0.00 0.00 54.13 53.30 2yrz s LEU 81 Cb -0.02 -1.82 -0.08 0.00 0.03 0.00 0.00 46.19 44.30 2yrz s LEU 81 CO 0.19 0.38 1.17 -2.16 0.23 0.00 0.00 176.35 176.15 2yrz s PRO 82 N -0.90 3.84 -1.40 1.29 0.04 -1.26 -3.54 135.00 133.06 2yrz s PRO 82 Ca 0.13 1.80 -0.01 0.00 0.04 0.00 0.00 61.00 62.97 2yrz s PRO 82 Cb -0.11 -2.48 0.01 0.00 0.04 0.00 0.00 34.50 31.95 2yrz s PRO 82 CO 0.02 -0.49 0.48 0.09 0.04 0.00 0.00 177.00 177.14 2yrz n ASN 83 N -0.33 -0.59 -3.77 6.66 5.03 -1.20 -4.97 115.26 116.08 2yrz n ASN 83 Ca 0.06 -0.97 -0.16 0.00 0.87 0.00 0.00 54.58 54.38 2yrz n ASN 83 Cb 0.48 -3.23 -0.16 0.00 -1.02 0.00 0.00 39.78 35.85 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 -3.88 0.10 0.30 3.10 3.76 -1.23 -4.93 115.29 112.50 2yrz s HIS 84 Ca 0.03 0.11 -0.28 0.00 -0.15 0.00 0.00 55.06 54.77 2yrz s HIS 84 Cb -0.02 -0.30 -0.09 0.00 1.11 0.00 0.00 32.58 33.28 2yrz s HIS 84 CO 0.88 -0.11 1.05 -1.12 -0.85 0.00 0.00 174.74 174.59 2yrz s SER 85 N 1.16 7.23 -0.04 1.40 0.01 -1.26 -3.67 113.70 118.53 2yrz s SER 85 Ca -0.08 2.14 -0.01 0.00 1.31 0.00 0.00 55.95 59.31 2yrz s SER 85 Cb -0.13 -2.61 0.03 0.00 0.21 0.00 0.00 66.02 63.52 2yrz s SER 85 CO -0.03 -0.16 0.02 -0.31 0.41 0.00 0.00 173.24 173.18 2yrz s TYR 86 N -1.30 0.28 -0.57 2.43 2.02 -0.37 -1.60 117.35 118.24 2yrz s TYR 86 Ca 0.47 0.06 -0.23 0.00 -0.37 0.00 0.00 57.07 57.00 2yrz s TYR 86 Cb -0.28 -0.50 0.05 0.00 -0.40 0.00 0.00 41.96 40.83 2yrz s TYR 86 CO 0.36 -0.19 0.91 0.54 -1.57 0.00 0.00 175.55 175.59 2yrz s VAL 87 N 1.61 4.43 -0.17 0.71 0.11 -0.35 -1.16 120.40 125.58 2yrz s VAL 87 Ca -0.02 0.04 -0.21 0.00 -2.93 0.00 0.00 61.98 58.86 2yrz s VAL 87 Cb -0.13 -4.54 -0.03 0.00 -1.53 0.00 0.00 36.38 30.15 2yrz s VAL 87 CO -0.03 -1.15 0.65 -0.36 -3.33 0.00 0.00 175.10 170.88 2yrz s PHE 88 N 3.82 3.41 -0.43 1.54 0.40 -0.46 -3.27 117.98 122.99 2yrz s PHE 88 Ca 0.27 1.00 0.03 0.00 -0.60 0.00 0.00 56.93 57.63 2yrz s PHE 88 Cb -0.14 -2.81 0.12 0.00 0.51 0.00 0.00 43.02 40.70 2yrz s PHE 88 CO 0.16 -0.13 0.16 1.03 0.70 0.00 0.00 175.22 177.15 2yrz s ARG 89 N 1.72 1.62 0.46 0.44 0.52 0.85 0.58 118.95 125.14 2yrz s ARG 89 Ca 0.31 -2.16 -0.11 0.00 -0.52 0.00 0.00 55.73 53.25 2yrz s ARG 89 Cb -0.16 -3.08 -0.06 0.00 0.52 0.00 0.00 34.95 32.17 2yrz s ARG 89 CO 0.11 -1.04 0.84 0.08 0.02 0.00 0.00 175.30 175.31 2yrz s VAL 90 N 0.38 4.75 0.13 3.52 1.01 -0.97 -2.37 120.40 126.84 2yrz s VAL 90 Ca 0.14 0.70 -0.25 0.00 0.00 0.00 0.00 61.98 62.57 2yrz s VAL 90 Cb -0.22 -3.76 0.07 0.00 0.00 0.00 0.00 36.38 32.46 2yrz s VAL 90 CO -0.05 -0.65 0.78 0.00 0.00 0.00 0.00 175.10 175.18 2yrz s ARG 91 N -4.13 1.21 0.23 2.72 1.70 -0.33 -1.39 118.95 118.95 2yrz s ARG 91 Ca 0.52 -0.54 0.09 0.00 -0.47 0.00 0.00 55.73 55.34 2yrz s ARG 91 Cb -0.10 0.49 -0.04 0.00 -0.57 0.00 0.00 34.95 34.73 2yrz s ARG 91 CO 0.35 -0.54 -0.06 0.00 -1.08 0.00 0.00 175.30 173.97 2yrz s ALA 92 N -3.49 3.04 -0.08 7.88 0.00 -1.26 -1.28 121.76 126.55 2yrz s ALA 92 Ca 0.06 -1.59 0.03 0.00 0.00 0.00 0.00 51.96 50.46 2yrz s ALA 92 Cb -0.02 -0.72 0.01 0.00 0.00 0.00 0.00 23.12 22.39 2yrz s ALA 92 CO -0.06 0.36 -0.16 -1.14 0.00 0.00 0.00 175.76 174.76 2yrz s GLN 93 N -3.29 2.20 0.38 0.00 0.74 -1.24 -3.19 119.66 115.26 2yrz s GLN 93 Ca 0.28 -0.58 0.04 0.00 0.05 0.00 0.00 55.36 55.15 2yrz s GLN 93 Cb -0.07 -1.76 -0.04 0.00 1.10 0.00 0.00 33.01 32.23 2yrz s GLN 93 CO 0.17 0.06 0.08 -1.54 -0.55 0.00 0.00 175.29 173.52 2yrz s SER 94 N 0.63 2.72 0.33 6.67 1.04 -1.14 -1.34 113.70 122.61 2yrz s SER 94 Ca -0.14 -1.54 0.09 0.00 0.48 0.00 0.00 55.95 54.84 2yrz s SER 94 Cb -0.16 0.23 0.98 0.00 0.10 0.00 0.00 66.02 67.17 2yrz s SER 94 CO 0.04 -0.78 1.55 1.67 0.98 0.00 0.00 173.24 176.71 2yrz n GLN 95 N -0.84 -0.07 0.37 4.02 7.27 -1.23 -0.63 117.38 126.27 2yrz n GLN 95 Ca -0.05 1.43 -0.16 0.00 0.07 0.00 0.00 57.00 58.29 2yrz n GLN 95 Cb 0.66 -2.39 -0.08 0.00 2.41 0.00 0.00 30.24 30.85 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 -0.94 0.00 3.69 4.39 -1.93 -3.50 114.58 116.29 2yrz h GLU 96 Ca 0.69 0.06 0.00 0.00 0.34 0.00 0.00 59.36 60.45 2yrz h GLU 96 Cb 1.61 0.21 0.00 0.00 -0.10 0.00 0.00 28.75 30.48 2yrz h GLU 96 CO -0.86 -0.61 0.00 0.41 -1.16 0.00 0.00 179.01 176.79 2yrz n GLY 97 N -0.84 -1.36 3.61 -3.84 0.00 0.20 -5.07 105.19 97.89 2yrz n GLY 97 Ca -0.13 -1.22 -0.43 0.00 0.00 0.00 0.00 46.02 44.24 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 2.35 0.00 1.61 0.52 -1.26 -2.89 118.94 116.26 2yrz s TRP 98 Ca 0.00 0.68 0.00 0.00 0.02 0.00 0.00 56.10 56.80 2yrz s TRP 98 Cb 0.00 -4.21 0.00 0.00 -1.15 0.00 0.00 33.47 28.11 2yrz s TRP 98 CO 0.00 -2.13 0.00 0.41 0.02 0.00 0.00 176.95 175.25 2yrz n GLY 99 N 4.98 -0.24 3.96 0.98 0.00 -1.19 -5.03 105.19 108.65 2yrz n GLY 99 Ca 0.17 -0.15 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 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 1.81 -0.07 1.61 1.81 -1.23 -4.97 118.95 117.91 2yrz s ARG 100 Ca 0.00 -0.70 -0.03 0.00 -1.72 0.00 0.00 55.73 53.28 2yrz s ARG 100 Cb 0.00 -2.23 0.04 0.00 -0.45 0.00 0.00 34.95 32.31 2yrz s ARG 100 CO 0.00 -1.42 0.14 -1.83 -0.68 0.00 0.00 175.30 171.52 2yrz s GLU 101 N -5.23 0.07 0.27 3.54 1.03 -1.26 -4.24 118.70 112.89 2yrz s GLU 101 Ca 0.64 0.41 -0.29 0.00 0.03 0.00 0.00 54.97 55.77 2yrz s GLU 101 Cb -0.07 -0.21 -0.09 0.00 -0.80 0.00 0.00 34.13 32.95 2yrz s GLU 101 CO 0.45 -0.20 0.97 0.50 -1.33 0.00 0.00 175.26 175.65 2yrz s ARG 102 N 1.45 4.72 -0.07 -4.83 6.06 -0.49 -4.84 118.95 120.96 2yrz s ARG 102 Ca -0.06 1.51 -0.14 0.00 -2.50 0.00 0.00 55.73 54.54 2yrz s ARG 102 Cb -0.12 -3.12 -0.05 0.00 0.06 0.00 0.00 34.95 31.72 2yrz s ARG 102 CO -0.06 0.38 0.35 -2.00 -2.50 0.00 0.00 175.30 171.47 2yrz s GLU 103 N -1.49 3.99 -0.37 5.12 2.12 -1.26 -2.30 118.70 124.52 2yrz s GLU 103 Ca 0.44 0.26 0.04 0.00 0.36 0.00 0.00 54.97 56.08 2yrz s GLU 103 Cb -0.25 -3.29 0.16 0.00 0.26 0.00 0.00 34.13 31.00 2yrz s GLU 103 CO 0.32 0.52 0.42 0.20 -0.54 0.00 0.00 175.26 176.18 2yrz s GLY 104 N -0.47 -0.26 0.36 -1.50 0.00 0.20 -4.88 107.32 100.77 2yrz s GLY 104 Ca 0.21 -0.72 -0.25 0.00 0.00 0.00 0.00 44.72 43.97 2yrz s GLY 104 CO 0.09 2.90 0.97 0.14 0.00 0.00 0.00 173.10 177.20 2yrz s VAL 105 N 1.57 4.14 0.03 1.40 1.01 -1.26 -1.36 120.40 125.93 2yrz s VAL 105 Ca 0.16 1.66 0.02 0.00 0.00 0.00 0.00 61.98 63.82 2yrz s VAL 105 Cb -0.13 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.36 2yrz s VAL 105 CO -0.06 0.02 -0.07 -0.51 0.00 0.00 0.00 175.10 174.48 2yrz s ILE 106 N -1.73 0.52 -0.26 2.22 1.10 -0.31 -4.93 121.20 117.81 2yrz s ILE 106 Ca 0.54 -0.92 0.03 0.00 -0.51 0.00 0.00 60.65 59.79 2yrz s ILE 106 Cb -0.17 -0.56 0.06 0.00 0.15 0.00 0.00 42.46 41.93 2yrz s ILE 106 CO 0.22 -0.29 -0.10 -0.89 -2.11 0.00 0.00 174.94 171.78 2yrz s THR 107 N -1.14 2.11 -0.06 4.00 2.01 -1.26 -1.24 115.64 120.06 2yrz s THR 107 Ca -0.08 -1.62 -0.30 0.00 0.31 0.00 0.00 61.69 60.01 2yrz s THR 107 Cb -0.08 -2.24 -0.08 0.00 0.01 0.00 0.00 72.50 70.10 2yrz s THR 107 CO 0.00 -0.05 2.06 -0.38 -0.69 0.00 0.00 174.62 175.57 2yrz n ILE 108 N 4.45 0.62 -3.92 1.82 2.08 -1.24 -4.95 119.36 118.21 2yrz n ILE 108 Ca -0.14 -0.25 -0.31 0.00 0.56 0.00 0.00 62.75 62.62 2yrz n ILE 108 Cb 0.42 -2.37 -0.15 0.00 -0.75 0.00 0.00 39.64 36.79 2yrz n ILE 108 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 2yrz s GLU 109 N 5.11 1.28 -0.24 0.38 2.02 -1.26 -3.24 118.70 122.75 2yrz s GLU 109 Ca 0.93 -1.49 -0.18 0.00 0.02 0.00 0.00 54.97 54.26 2yrz s GLU 109 Cb -0.42 -2.73 -0.03 0.00 0.10 0.00 0.00 34.13 31.05 2yrz s GLU 109 CO 0.40 -0.90 0.51 0.45 0.02 0.00 0.00 175.26 175.75 2yrz s SER 110 N 1.20 6.48 -0.32 -0.19 0.15 -1.26 -4.96 113.70 114.80 2yrz s SER 110 Ca 0.08 0.57 0.06 0.00 0.70 0.00 0.00 55.95 57.36 2yrz s SER 110 Cb -0.18 -2.28 0.46 0.00 -1.71 0.00 0.00 66.02 62.30 2yrz s SER 110 CO -0.13 -0.24 1.26 0.00 1.20 0.00 0.00 173.24 175.32 2yrz n GLN 111 N 5.24 3.54 -0.06 5.44 6.02 -1.26 -4.66 117.38 131.64 2yrz n GLN 111 Ca -0.04 -4.11 -0.09 0.00 -0.01 0.00 0.00 57.00 52.75 2yrz n GLN 111 Cb 0.50 -2.28 -0.06 0.00 1.02 0.00 0.00 30.24 29.42 2yrz n GLN 111 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 2yrz n VAL 112 N -0.72 0.72 -1.24 5.09 0.24 -1.26 -4.62 118.33 116.53 2yrz n VAL 112 Ca 0.45 -0.29 -0.27 0.00 -2.04 0.00 0.00 64.34 62.19 2yrz n VAL 112 Cb 0.94 -0.94 0.04 0.00 -1.47 0.00 0.00 33.84 32.41 2yrz n VAL 112 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2yrz n SER 113 N -2.84 7.06 -3.64 -1.34 2.88 -1.26 -4.87 113.62 109.61 2yrz n SER 113 Ca -0.22 -3.44 -0.09 0.00 -1.33 0.00 0.00 58.87 53.79 2yrz n SER 113 Cb 0.74 -1.05 -0.07 0.00 -0.75 0.00 0.00 64.21 63.08 2yrz n SER 113 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2yrz s GLY 114 N -0.69 -0.27 -0.96 0.46 0.00 -1.26 -5.09 107.32 99.51 2yrz s GLY 114 Ca 0.50 2.56 -0.24 0.00 0.00 0.00 0.00 44.72 47.54 2yrz s GLY 114 CO -0.08 1.97 1.95 2.56 0.00 0.00 0.00 173.10 179.50 2yrz s PRO 115 N 0.54 2.54 0.06 2.90 0.04 -1.26 -4.95 135.00 134.87 2yrz s PRO 115 Ca -0.00 -0.46 0.03 0.00 0.04 0.00 0.00 61.00 60.61 2yrz s PRO 115 Cb -0.05 -5.10 -0.04 0.00 0.04 0.00 0.00 34.50 29.36 2yrz s PRO 115 CO -0.07 -3.50 0.03 -1.54 0.04 0.00 0.00 177.00 171.95 2yrz s SER 116 N 7.75 5.24 0.66 6.66 1.04 -1.26 -5.12 113.70 128.67 2yrz s SER 116 Ca 0.70 -0.06 -0.05 0.00 0.48 0.00 0.00 55.95 57.02 2yrz s SER 116 Cb -0.06 -1.35 0.05 0.00 0.10 0.00 0.00 66.02 64.77 2yrz s SER 116 CO 0.02 0.21 0.96 -0.94 0.98 0.00 0.00 173.24 174.47 2yrz s SER 117 N -2.09 4.98 0.00 7.02 1.04 -1.26 -5.17 113.70 118.22 2yrz s SER 117 Ca 0.25 0.39 0.03 0.00 0.48 0.00 0.00 55.95 57.10 2yrz s SER 117 Cb -0.12 -1.12 0.17 0.00 0.10 0.00 0.00 66.02 65.06 2yrz s SER 117 CO 0.17 -1.46 0.66 0.61 0.98 0.00 0.00 173.24 174.20