#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yrz s SER 2 N 0.00 0.24 0.28 1.61 0.01 -1.26 -5.04 113.70 109.55 2yrz s SER 2 Ca 0.00 0.37 0.00 0.00 1.31 0.00 0.00 55.95 57.64 2yrz s SER 2 Cb 0.00 0.31 0.67 0.00 0.21 0.00 0.00 66.02 67.20 2yrz s SER 2 CO 0.00 -0.20 1.63 0.77 0.41 0.00 0.00 173.24 175.86 2yrz h SER 3 N 7.77 -0.14 0.00 2.44 4.64 -2.09 -3.44 113.55 122.73 2yrz h SER 3 Ca -0.29 0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 2yrz h SER 3 Cb 1.13 0.31 0.00 0.00 -0.31 0.00 0.00 62.40 63.53 2yrz h SER 3 CO 0.28 -0.19 0.00 0.61 -0.87 0.00 0.00 176.83 176.66 2yrz n GLY 4 N -1.40 0.09 2.99 -0.77 0.00 -1.26 -5.11 105.19 99.72 2yrz n GLY 4 Ca 0.20 -0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 2yrz n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yrz s SER 5 N 0.00 4.76 -0.30 1.61 0.15 -1.26 -5.03 113.70 113.63 2yrz s SER 5 Ca 0.00 -3.21 0.00 0.00 0.70 0.00 0.00 55.95 53.45 2yrz s SER 5 Cb 0.00 -1.71 0.09 0.00 -1.71 0.00 0.00 66.02 62.69 2yrz s SER 5 CO 0.00 -0.23 0.06 -0.44 1.20 0.00 0.00 173.24 173.83 2yrz s SER 6 N -0.30 4.13 -0.21 5.45 0.01 -1.26 -4.92 113.70 116.60 2yrz s SER 6 Ca 0.19 -1.66 0.04 0.00 1.31 0.00 0.00 55.95 55.83 2yrz s SER 6 Cb -0.19 -1.08 0.13 0.00 0.21 0.00 0.00 66.02 65.10 2yrz s SER 6 CO -0.05 -0.38 0.96 0.61 0.41 0.00 0.00 173.24 174.80 2yrz n GLY 7 N 4.69 -0.12 3.22 3.44 0.00 -1.26 -5.11 105.19 110.04 2yrz n GLY 7 Ca -0.02 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 2yrz n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yrz s SER 8 N -0.38 5.31 0.48 1.61 0.01 -1.26 -5.09 113.70 114.38 2yrz s SER 8 Ca 0.05 -1.48 0.04 0.00 1.31 0.00 0.00 55.95 55.87 2yrz s SER 8 Cb 0.14 -1.86 0.02 0.00 0.21 0.00 0.00 66.02 64.53 2yrz s SER 8 CO -0.04 -0.43 0.67 -1.00 0.41 0.00 0.00 173.24 172.86 2yrz s HIS 9 N 1.32 2.91 0.15 2.43 0.09 -1.26 -5.12 115.29 115.81 2yrz s HIS 9 Ca 0.01 -0.12 -0.25 0.00 -0.00 0.00 0.00 55.06 54.70 2yrz s HIS 9 Cb -0.21 -2.52 0.06 0.00 -0.00 0.00 0.00 32.58 29.91 2yrz s HIS 9 CO 0.00 -0.60 0.94 -0.51 -0.00 0.00 0.00 174.74 174.58 2yrz s ASP 10 N -4.36 -0.19 0.01 1.40 1.01 -1.26 -5.10 116.67 108.18 2yrz s ASP 10 Ca 0.54 -0.40 -0.05 0.00 0.71 0.00 0.00 52.55 53.36 2yrz s ASP 10 Cb -0.10 0.50 -0.02 0.00 1.01 0.00 0.00 42.92 44.31 2yrz s ASP 10 CO 0.36 -0.91 -0.09 -0.24 0.21 0.00 0.00 175.17 174.49 2yrz n SER 11 N -0.46 1.20 -4.56 0.27 2.88 -1.26 -4.90 113.62 106.79 2yrz n SER 11 Ca -0.06 0.17 -0.31 0.00 -1.33 0.00 0.00 58.87 57.34 2yrz n SER 11 Cb 0.61 -0.41 -0.04 0.00 -0.75 0.00 0.00 64.21 63.62 2yrz n SER 11 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2yrz s ARG 12 N -2.22 2.77 0.26 -1.46 0.52 -1.26 -4.90 118.95 112.65 2yrz s ARG 12 Ca -0.08 -0.31 0.02 0.00 -0.52 0.00 0.00 55.73 54.84 2yrz s ARG 12 Cb 0.02 -4.99 -0.04 0.00 0.52 0.00 0.00 34.95 30.46 2yrz s ARG 12 CO 0.12 -3.04 0.16 -0.51 0.02 0.00 0.00 175.30 172.05 2yrz s LEU 13 N 8.89 1.44 0.13 2.53 1.43 -1.26 -5.11 118.68 126.73 2yrz s LEU 13 Ca 0.64 -1.49 -0.20 0.00 -1.03 0.00 0.00 54.13 52.05 2yrz s LEU 13 Cb -0.06 0.32 -0.12 0.00 0.03 0.00 0.00 46.19 46.36 2yrz s LEU 13 CO 0.01 -0.88 0.39 0.41 0.23 0.00 0.00 176.35 176.52 2yrz n THR 14 N -0.43 1.30 -3.76 5.49 -1.04 -1.26 -4.90 114.28 109.68 2yrz n THR 14 Ca 0.02 -0.32 -0.36 0.00 -2.04 0.00 0.00 64.05 61.35 2yrz n THR 14 Cb 0.65 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 69.05 2yrz n THR 14 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2yrz s ALA 15 N -0.65 3.37 0.00 2.41 0.00 -1.26 -4.54 121.76 121.08 2yrz s ALA 15 Ca 0.46 -2.92 0.00 0.00 0.00 0.00 0.00 51.96 49.50 2yrz s ALA 15 Cb -0.67 -2.52 0.00 0.00 0.00 0.00 0.00 23.12 19.93 2yrz s ALA 15 CO 0.39 -1.96 0.00 0.41 0.00 0.00 0.00 175.76 174.61 2yrz n GLY 16 N 3.99 1.22 3.91 0.00 0.00 -1.26 -4.99 105.19 108.07 2yrz n GLY 16 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.22 5.25 -0.17 1.61 -7.23 -1.26 -4.37 120.40 113.00 2yrz s VAL 17 Ca 0.00 -0.14 -0.29 0.00 -1.81 0.00 0.00 61.98 59.73 2yrz s VAL 17 Cb 0.00 -3.63 -0.03 0.00 0.56 0.00 0.00 36.38 33.28 2yrz s VAL 17 CO 0.00 0.06 1.58 -2.16 -0.31 0.00 0.00 175.10 174.27 2yrz s PRO 18 N -2.64 3.95 0.78 4.82 0.04 -1.26 -4.70 135.00 135.99 2yrz s PRO 18 Ca 0.39 1.79 -0.14 0.00 0.04 0.00 0.00 61.00 63.07 2yrz s PRO 18 Cb -0.12 -3.99 0.04 0.00 0.04 0.00 0.00 34.50 30.47 2yrz s PRO 18 CO 0.26 -1.11 0.98 -3.47 0.04 0.00 0.00 177.00 173.70 2yrz n ASP 19 N 7.88 0.31 -4.54 6.66 2.03 -0.67 -3.73 116.55 124.49 2yrz n ASP 19 Ca 0.18 0.59 -0.60 0.00 0.52 0.00 0.00 54.79 55.47 2yrz n ASP 19 Cb 0.45 -1.41 -0.08 0.00 -0.72 0.00 0.00 41.12 39.35 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 -2.97 0.00 -2.25 5.18 -1.04 -1.26 -4.60 114.28 107.35 2yrz n THR 20 Ca 0.12 -0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 61.73 2yrz n THR 20 Cb 0.50 -0.09 -0.03 0.00 -1.82 0.00 0.00 70.33 68.90 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 0.50 4.45 1.17 -2.82 0.04 -1.26 -4.90 135.00 132.18 2yrz s PRO 21 Ca 0.93 2.06 -0.17 0.00 0.04 0.00 0.00 61.00 63.86 2yrz s PRO 21 Cb -1.31 -3.12 0.20 0.00 0.04 0.00 0.00 34.50 30.31 2yrz s PRO 21 CO 0.61 -0.06 0.40 2.41 0.04 0.00 0.00 177.00 180.40 2yrz n THR 22 N 1.12 0.00 -0.65 1.26 -1.04 -1.26 -4.48 114.28 109.23 2yrz n THR 22 Ca 0.00 -0.27 -0.21 0.00 -2.04 0.00 0.00 64.05 61.53 2yrz n THR 22 Cb 0.43 -0.73 0.11 0.00 -1.82 0.00 0.00 70.33 68.32 2yrz n THR 22 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2yrz n ARG 23 N -3.23 -1.50 -4.38 -2.82 5.12 -1.26 -4.61 116.66 103.99 2yrz n ARG 23 Ca 0.03 -0.44 -0.28 0.00 -1.93 0.00 0.00 57.85 55.23 2yrz n ARG 23 Cb 0.56 -1.38 -0.13 0.00 -1.16 0.00 0.00 32.46 30.35 2yrz n ARG 23 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2yrz s LEU 24 N 2.13 2.33 -0.21 0.55 1.43 -1.26 -4.43 118.68 119.22 2yrz s LEU 24 Ca 0.35 -0.75 -0.03 0.00 -1.03 0.00 0.00 54.13 52.66 2yrz s LEU 24 Cb -0.04 -1.17 -0.01 0.00 0.03 0.00 0.00 46.19 45.01 2yrz s LEU 24 CO 0.40 0.16 -0.05 -0.69 0.23 0.00 0.00 176.35 176.39 2yrz s VAL 25 N -1.12 3.36 -0.14 -1.59 1.01 0.85 -4.87 120.40 117.90 2yrz s VAL 25 Ca 0.13 -0.50 -0.05 0.00 0.00 0.00 0.00 61.98 61.56 2yrz s VAL 25 Cb -0.10 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 2yrz s VAL 25 CO 0.06 0.44 0.06 -0.36 0.00 0.00 0.00 175.10 175.29 2yrz s PHE 26 N 1.32 3.30 -0.23 5.22 0.40 -1.23 -1.15 117.98 125.60 2yrz s PHE 26 Ca 0.04 0.21 -0.01 0.00 -0.60 0.00 0.00 56.93 56.57 2yrz s PHE 26 Cb -0.14 -1.95 -0.19 0.00 0.51 0.00 0.00 43.02 41.25 2yrz s PHE 26 CO -0.02 0.39 -0.12 0.45 0.70 0.00 0.00 175.22 176.61 2yrz n SER 27 N 2.72 2.01 -3.09 1.36 2.88 -0.75 -4.89 113.62 113.86 2yrz n SER 27 Ca -0.18 -0.05 -0.14 0.00 -1.33 0.00 0.00 58.87 57.17 2yrz n SER 27 Cb 0.53 -0.52 0.07 0.00 -0.75 0.00 0.00 64.21 63.55 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 -3.26 -1.89 -0.48 -1.46 0.00 -1.26 -4.83 120.51 107.33 2yrz n ALA 28 Ca -0.44 -0.00 0.43 0.00 0.00 0.00 0.00 53.44 53.43 2yrz n ALA 28 Cb 0.99 -2.99 0.73 0.00 0.00 0.00 0.00 19.45 18.19 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 -1.45 0.00 0.00 0.00 -0.00 -1.84 -3.44 115.31 108.58 2yrz h LEU 29 Ca -0.52 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.36 2yrz h LEU 29 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.95 2yrz h LEU 29 CO 0.42 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.47 2yrz n GLY 30 N -1.83 1.49 0.19 0.83 0.00 -1.13 -4.94 105.19 99.80 2yrz n GLY 30 Ca 0.34 -0.86 0.05 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.90 -3.12 132.00 128.72 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 0.36 -0.08 0.25 -0.23 0.00 0.00 178.00 178.30 2yrz n THR 32 N -3.73 1.80 -3.98 1.56 -2.24 -1.26 -4.29 114.28 102.14 2yrz n THR 32 Ca -0.01 -2.22 -0.10 0.00 -2.27 0.00 0.00 64.05 59.45 2yrz n THR 32 Cb 0.45 -0.19 -0.11 0.00 -2.10 0.00 0.00 70.33 68.38 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 -2.80 0.27 0.19 3.42 1.04 -1.18 -2.03 113.70 112.61 2yrz s SER 33 Ca 0.31 -0.45 -0.17 0.00 0.48 0.00 0.00 55.95 56.12 2yrz s SER 33 Cb 0.27 0.08 0.03 0.00 0.10 0.00 0.00 66.02 66.50 2yrz s SER 33 CO 0.02 -0.25 0.51 -0.76 0.98 0.00 0.00 173.24 173.73 2yrz s LEU 34 N -1.30 0.11 -0.23 2.42 1.43 0.15 -2.83 118.68 118.43 2yrz s LEU 34 Ca -0.14 -0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 52.45 2yrz s LEU 34 Cb -0.09 2.10 0.08 0.00 0.03 0.00 0.00 46.19 48.31 2yrz s LEU 34 CO -0.01 -1.03 0.10 -0.60 0.23 0.00 0.00 176.35 175.04 2yrz s ARG 35 N -3.87 0.20 -0.11 1.70 3.52 -1.26 -0.02 118.95 119.12 2yrz s ARG 35 Ca 0.09 -0.36 -0.15 0.00 -0.13 0.00 0.00 55.73 55.18 2yrz s ARG 35 Cb -0.01 -1.57 -0.05 0.00 -1.56 0.00 0.00 34.95 31.77 2yrz s ARG 35 CO -0.04 -0.84 0.36 0.08 -0.81 0.00 0.00 175.30 174.06 2yrz s VAL 36 N 2.07 5.22 -0.02 7.11 1.01 0.08 -1.81 120.40 134.06 2yrz s VAL 36 Ca 0.05 0.71 0.01 0.00 0.00 0.00 0.00 61.98 62.76 2yrz s VAL 36 Cb -0.16 -3.69 0.01 0.00 0.00 0.00 0.00 36.38 32.54 2yrz s VAL 36 CO -0.22 0.43 -0.05 -0.55 0.00 0.00 0.00 175.10 174.71 2yrz s SER 37 N 0.06 0.68 0.24 3.32 0.15 -0.30 -0.49 113.70 117.35 2yrz s SER 37 Ca 0.21 -0.10 0.01 0.00 0.70 0.00 0.00 55.95 56.77 2yrz s SER 37 Cb -0.14 -0.18 -0.00 0.00 -1.71 0.00 0.00 66.02 63.99 2yrz s SER 37 CO 0.08 0.02 0.02 -2.67 1.20 0.00 0.00 173.24 171.89 2yrz n TRP 38 N 3.34 0.42 -4.93 3.44 2.14 -0.56 -0.10 117.44 121.20 2yrz n TRP 38 Ca -0.18 -1.27 -0.31 0.00 2.07 0.00 0.00 57.50 57.81 2yrz n TRP 38 Cb 0.55 -0.12 -0.17 0.00 -0.81 0.00 0.00 31.31 30.77 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 -2.87 2.86 -0.53 -2.67 0.74 -1.26 -4.84 119.66 111.08 2yrz s GLN 39 Ca 0.03 -0.81 -0.34 0.00 0.05 0.00 0.00 55.36 54.30 2yrz s GLN 39 Cb 0.00 -2.24 -0.14 0.00 1.10 0.00 0.00 33.01 31.74 2yrz s GLN 39 CO 0.02 0.08 2.34 -1.91 -0.55 0.00 0.00 175.29 175.27 2yrz n GLU 40 N 3.78 0.71 -1.11 1.67 0.00 -1.26 -4.21 120.64 120.23 2yrz n GLU 40 Ca -0.20 0.14 -0.29 0.00 0.00 0.00 0.00 57.16 56.81 2yrz n GLU 40 Cb 0.52 -2.32 0.22 0.00 0.00 0.00 0.00 31.44 29.86 2yrz n GLU 40 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.13 175.88 2yrz s PRO 41 N 7.17 -0.67 0.23 5.31 0.04 -1.26 -5.00 135.00 140.82 2yrz s PRO 41 Ca 1.15 0.14 -0.30 0.00 0.04 0.00 0.00 61.00 62.02 2yrz s PRO 41 Cb -0.90 -1.64 -0.09 0.00 0.04 0.00 0.00 34.50 31.91 2yrz s PRO 41 CO 0.47 -3.38 1.00 -0.98 0.04 0.00 0.00 177.00 174.15 2yrz s ARG 42 N -5.24 4.76 -0.30 4.56 1.70 -1.26 -4.88 118.95 118.29 2yrz s ARG 42 Ca 0.69 1.60 -0.06 0.00 -0.47 0.00 0.00 55.73 57.49 2yrz s ARG 42 Cb -0.13 -3.26 0.19 0.00 -0.57 0.00 0.00 34.95 31.17 2yrz s ARG 42 CO 0.57 0.36 0.82 0.00 -1.08 0.00 0.00 175.30 175.96 2yrz h GLU 44 N 7.94 0.11 -6.01 0.00 4.81 -1.87 -3.39 114.58 116.18 2yrz h GLU 44 Ca -0.16 -0.01 -0.58 0.00 -0.13 0.00 0.00 59.36 58.48 2yrz h GLU 44 Cb 1.17 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.49 2yrz h GLU 44 CO 0.08 0.07 -0.50 1.03 -0.73 0.00 0.00 179.01 178.96 2yrz s ARG 45 N -5.13 3.37 0.22 1.92 1.81 -1.26 -5.08 118.95 114.80 2yrz s ARG 45 Ca -0.06 -0.55 -0.30 0.00 -1.72 0.00 0.00 55.73 53.10 2yrz s ARG 45 Cb 0.25 -2.96 -0.09 0.00 -0.45 0.00 0.00 34.95 31.70 2yrz s ARG 45 CO 0.82 0.56 1.29 -1.25 -0.68 0.00 0.00 175.30 176.04 2yrz s PRO 46 N -2.85 4.40 0.45 3.54 0.04 -1.26 -4.87 135.00 134.46 2yrz s PRO 46 Ca 0.34 2.05 -0.22 0.00 0.04 0.00 0.00 61.00 63.21 2yrz s PRO 46 Cb -0.12 -3.18 -0.09 0.00 0.04 0.00 0.00 34.50 31.15 2yrz s PRO 46 CO 0.28 -0.21 1.05 -0.51 0.04 0.00 0.00 177.00 177.64 2yrz s LEU 47 N -0.37 3.97 -0.07 -3.56 1.43 -1.26 -4.07 118.68 114.74 2yrz s LEU 47 Ca 0.55 1.99 0.21 0.00 -1.03 0.00 0.00 54.13 55.85 2yrz s LEU 47 Cb -0.36 -4.40 -0.30 0.00 0.03 0.00 0.00 46.19 41.16 2yrz s LEU 47 CO 0.40 -0.68 0.39 0.00 0.23 0.00 0.00 176.35 176.68 2yrz n GLN 48 N -0.60 0.67 0.00 1.70 6.02 -1.02 -4.73 117.38 119.41 2yrz n GLN 48 Ca 0.08 -0.12 0.00 0.00 -0.01 0.00 0.00 57.00 56.95 2yrz n GLN 48 Cb 0.51 -1.54 0.00 0.00 1.02 0.00 0.00 30.24 30.23 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 1.41 1.03 3.53 1.08 0.00 -1.26 -3.69 105.19 107.29 2yrz n GLY 49 Ca -0.13 -0.10 -0.10 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 -0.08 -0.27 -0.01 1.61 2.02 -1.06 -4.05 117.35 115.51 2yrz s TYR 50 Ca 0.00 -0.05 0.01 0.00 -0.37 0.00 0.00 57.07 56.66 2yrz s TYR 50 Cb 0.00 0.49 0.00 0.00 -0.40 0.00 0.00 41.96 42.05 2yrz s TYR 50 CO 0.00 -0.94 -0.05 0.45 -1.57 0.00 0.00 175.55 173.45 2yrz s SER 51 N -2.84 0.65 -0.21 2.29 0.15 -0.39 0.17 113.70 113.53 2yrz s SER 51 Ca 0.06 -0.10 -0.02 0.00 0.70 0.00 0.00 55.95 56.60 2yrz s SER 51 Cb -0.02 -0.14 0.06 0.00 -1.71 0.00 0.00 66.02 64.22 2yrz s SER 51 CO -0.05 0.03 0.02 -0.69 1.20 0.00 0.00 173.24 173.76 2yrz s VAL 52 N 0.13 0.70 -0.05 4.45 1.01 0.43 -1.53 120.40 125.53 2yrz s VAL 52 Ca -0.01 -0.70 -0.01 0.00 0.00 0.00 0.00 61.98 61.25 2yrz s VAL 52 Cb -0.05 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 2yrz s VAL 52 CO -0.00 -0.22 0.04 -1.61 0.00 0.00 0.00 175.10 173.31 2yrz s GLU 53 N 1.77 3.00 -0.12 2.72 8.01 -0.83 -0.32 118.70 132.93 2yrz s GLU 53 Ca -0.01 -0.45 -0.12 0.00 0.01 0.00 0.00 54.97 54.39 2yrz s GLU 53 Cb -0.17 -2.82 0.03 0.00 -4.31 0.00 0.00 34.13 26.86 2yrz s GLU 53 CO -0.09 0.68 0.34 1.52 0.01 0.00 0.00 175.26 177.72 2yrz s TYR 54 N -1.03 -0.36 -0.05 1.61 -0.85 -0.80 -0.03 117.35 115.84 2yrz s TYR 54 Ca 0.18 0.87 -0.30 0.00 -0.52 0.00 0.00 57.07 57.30 2yrz s TYR 54 Cb -0.12 0.12 0.09 0.00 0.38 0.00 0.00 41.96 42.44 2yrz s TYR 54 CO 0.08 -0.19 0.76 1.14 -1.52 0.00 0.00 175.55 175.82 2yrz s GLN 55 N 0.08 0.96 -0.35 -3.49 -2.07 -1.21 -1.40 119.66 112.18 2yrz s GLN 55 Ca -0.01 0.09 -0.38 0.00 -1.82 0.00 0.00 55.36 53.24 2yrz s GLN 55 Cb -0.03 0.45 -0.14 0.00 -1.09 0.00 0.00 33.01 32.20 2yrz s GLN 55 CO 0.01 -0.33 2.02 1.28 -1.32 0.00 0.00 175.29 176.95 2yrz n LEU 56 N 0.60 2.01 -0.35 2.60 4.77 -1.26 -1.05 117.00 124.32 2yrz n LEU 56 Ca -0.16 0.70 0.12 0.00 -0.03 0.00 0.00 56.01 56.64 2yrz n LEU 56 Cb 0.59 -1.16 0.24 0.00 -2.33 0.00 0.00 43.42 40.76 2yrz n LEU 56 CO 0.19 -0.62 0.75 -0.11 -1.33 0.00 0.00 177.39 176.27 2yrz n LEU 57 N 7.86 -0.20 -0.10 2.23 7.94 -0.87 0.75 117.00 134.62 2yrz n LEU 57 Ca 0.38 1.70 -0.07 0.00 -1.11 0.00 0.00 56.01 56.91 2yrz n LEU 57 Cb 0.15 -0.58 0.01 0.00 0.53 0.00 0.00 43.42 43.52 2yrz n LEU 57 CO 0.80 -1.69 0.95 -0.55 -1.11 0.00 0.00 177.39 175.79 2yrz h ASN 58 N 0.00 0.19 0.00 1.96 7.08 -1.87 -3.47 115.58 119.47 2yrz h ASN 58 Ca 0.56 0.03 0.00 0.00 -3.08 0.00 0.00 56.30 53.81 2yrz h ASN 58 Cb 1.07 -0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.31 2yrz h ASN 58 CO -0.97 0.15 0.00 0.61 -2.08 0.00 0.00 177.43 175.14 2yrz n GLY 59 N -1.21 1.69 0.00 9.14 0.00 0.23 -5.18 105.19 109.87 2yrz n GLY 59 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 4.34 3.74 -0.02 0.00 -1.24 -4.96 105.19 107.05 2yrz n GLY 60 Ca 0.00 -0.56 -0.37 0.00 0.00 0.00 0.00 46.02 45.09 2yrz n GLY 60 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2yrz s GLU 61 N 3.01 4.23 -0.25 1.61 2.12 -1.26 -4.89 118.70 123.27 2yrz s GLU 61 Ca 0.00 0.26 -0.10 0.00 0.36 0.00 0.00 54.97 55.49 2yrz s GLU 61 Cb 0.00 -3.40 -0.05 0.00 0.26 0.00 0.00 34.13 30.94 2yrz s GLU 61 CO 0.00 0.27 0.16 -1.17 -0.54 0.00 0.00 175.26 173.98 2yrz s LEU 62 N 0.32 4.00 -0.20 2.70 1.98 -1.26 -4.07 118.68 122.15 2yrz s LEU 62 Ca 0.21 0.04 -0.03 0.00 -2.89 0.00 0.00 54.13 51.46 2yrz s LEU 62 Cb -0.14 -2.08 -0.00 0.00 0.66 0.00 0.00 46.19 44.62 2yrz s LEU 62 CO 0.07 0.02 -0.08 -1.00 -1.89 0.00 0.00 176.35 173.48 2yrz s HIS 63 N 1.30 2.91 -0.26 5.38 3.76 -0.49 -5.00 115.29 122.89 2yrz s HIS 63 Ca 0.07 -1.05 -0.10 0.00 -0.15 0.00 0.00 55.06 53.83 2yrz s HIS 63 Cb -0.14 -2.05 -0.05 0.00 1.11 0.00 0.00 32.58 31.45 2yrz s HIS 63 CO 0.06 -0.57 0.15 0.50 -0.85 0.00 0.00 174.74 174.04 2yrz s ARG 64 N 1.35 3.92 -0.07 1.40 3.52 -1.26 -1.91 118.95 125.89 2yrz s ARG 64 Ca 0.04 -0.34 -0.02 0.00 -0.13 0.00 0.00 55.73 55.28 2yrz s ARG 64 Cb -0.14 -3.54 -0.03 0.00 -1.56 0.00 0.00 34.95 29.67 2yrz s ARG 64 CO -0.05 -0.10 0.01 -0.51 -0.81 0.00 0.00 175.30 173.84 2yrz s LEU 65 N 1.50 3.63 0.07 -0.88 1.43 0.57 -4.97 118.68 120.02 2yrz s LEU 65 Ca 0.07 0.14 0.09 0.00 -1.03 0.00 0.00 54.13 53.40 2yrz s LEU 65 Cb -0.15 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.16 2yrz s LEU 65 CO 0.08 0.36 -0.22 0.20 0.23 0.00 0.00 176.35 177.00 2yrz s ASN 66 N -1.01 3.55 -0.33 2.29 -0.87 -1.26 -0.43 114.94 116.89 2yrz s ASN 66 Ca 0.14 -0.55 -0.01 0.00 -1.57 0.00 0.00 52.86 50.88 2yrz s ASN 66 Cb -0.11 -0.44 0.07 0.00 -0.02 0.00 0.00 41.25 40.74 2yrz s ASN 66 CO 0.04 0.23 0.05 -0.63 -2.57 0.00 0.00 177.10 174.22 2yrz s ILE 67 N -0.95 2.91 -2.00 0.60 -1.09 0.13 -4.95 121.20 115.84 2yrz s ILE 67 Ca 0.14 -1.69 0.10 0.00 -2.23 0.00 0.00 60.65 56.96 2yrz s ILE 67 Cb -0.10 -2.82 0.27 0.00 -1.58 0.00 0.00 42.46 38.24 2yrz s ILE 67 CO 0.05 -0.31 1.02 -0.81 -1.23 0.00 0.00 174.94 173.66 2yrz n PRO 68 N 4.55 0.49 -3.85 2.79 -0.04 -1.26 -2.57 135.00 135.12 2yrz n PRO 68 Ca -0.08 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.10 2yrz n PRO 68 Cb 0.43 -1.31 -0.17 0.00 -0.04 0.00 0.00 33.50 32.41 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 -1.81 2.71 0.00 3.54 2.47 -1.26 -4.91 114.94 115.68 2yrz s ASN 69 Ca 0.14 -0.63 0.15 0.00 0.42 0.00 0.00 52.86 52.94 2yrz s ASN 69 Cb 0.07 -0.80 0.83 0.00 -1.45 0.00 0.00 41.25 39.90 2yrz s ASN 69 CO 0.11 -0.21 1.38 -0.81 -3.72 0.00 0.00 177.10 173.85 2yrz n PRO 70 N 4.94 0.34 -0.06 0.43 -0.04 -1.24 -2.30 135.00 137.06 2yrz n PRO 70 Ca -0.11 0.08 -0.06 0.00 -0.04 0.00 0.00 63.50 63.37 2yrz n PRO 70 Cb 0.48 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.29 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 -1.15 1.71 -2.31 0.55 0.00 -1.26 -4.82 120.51 113.23 2yrz n ALA 71 Ca 0.09 -1.08 -0.39 0.00 0.00 0.00 0.00 53.44 52.06 2yrz n ALA 71 Cb 0.09 -0.43 -0.03 0.00 0.00 0.00 0.00 19.45 19.08 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 -2.68 2.94 -0.47 0.00 0.74 -0.97 -4.84 119.66 114.38 2yrz s GLN 72 Ca -0.08 0.07 0.01 0.00 0.05 0.00 0.00 55.36 55.41 2yrz s GLN 72 Cb 0.08 -4.38 0.47 0.00 1.10 0.00 0.00 33.01 30.28 2yrz s GLN 72 CO 0.84 -2.46 1.90 0.25 -0.55 0.00 0.00 175.29 175.27 2yrz n THR 73 N 6.84 3.12 -3.64 -0.34 -2.24 -1.26 -4.86 114.28 111.89 2yrz n THR 73 Ca 0.14 -2.08 -0.09 0.00 -2.27 0.00 0.00 64.05 59.75 2yrz n THR 73 Cb 0.50 -0.89 -0.07 0.00 -2.10 0.00 0.00 70.33 67.78 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 -1.07 -0.84 0.04 3.42 1.04 -1.26 -1.49 113.70 113.53 2yrz s SER 74 Ca 0.51 1.44 0.02 0.00 0.48 0.00 0.00 55.95 58.40 2yrz s SER 74 Cb 0.42 1.39 -0.02 0.00 0.10 0.00 0.00 66.02 67.91 2yrz s SER 74 CO 0.04 -0.24 -0.08 0.54 0.98 0.00 0.00 173.24 174.49 2yrz s VAL 75 N 1.12 0.59 -0.21 5.02 0.11 0.35 -4.99 120.40 122.39 2yrz s VAL 75 Ca -0.06 -0.95 -0.13 0.00 -2.93 0.00 0.00 61.98 57.91 2yrz s VAL 75 Cb -0.05 -0.62 -0.05 0.00 -1.53 0.00 0.00 36.38 34.14 2yrz s VAL 75 CO -0.12 -0.27 0.26 -0.69 -3.33 0.00 0.00 175.10 170.95 2yrz s VAL 76 N -1.14 5.30 -0.25 2.04 1.01 -1.26 -0.74 120.40 125.36 2yrz s VAL 76 Ca -0.07 0.42 -0.05 0.00 0.00 0.00 0.00 61.98 62.28 2yrz s VAL 76 Cb -0.09 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.69 2yrz s VAL 76 CO 0.00 0.33 0.02 -0.69 0.00 0.00 0.00 175.10 174.77 2yrz s VAL 77 N 0.98 3.75 0.34 2.92 1.01 0.98 -4.94 120.40 125.45 2yrz s VAL 77 Ca 0.13 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.61 2yrz s VAL 77 Cb -0.14 -2.80 -0.01 0.00 0.00 0.00 0.00 36.38 33.43 2yrz s VAL 77 CO 0.05 0.28 0.05 -0.62 0.00 0.00 0.00 175.10 174.86 2yrz n GLU 78 N 4.84 0.91 -3.22 2.72 1.02 -1.26 0.32 120.64 125.97 2yrz n GLU 78 Ca -0.16 -2.65 -0.16 0.00 -0.02 0.00 0.00 57.16 54.16 2yrz n GLU 78 Cb 0.50 1.03 0.06 0.00 -0.02 0.00 0.00 31.44 33.00 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 -1.42 -4.56 -4.94 1.62 9.92 -0.86 -4.96 116.55 111.35 2yrz n ASP 79 Ca -0.10 -0.38 -0.22 0.00 -0.53 0.00 0.00 54.79 53.55 2yrz n ASP 79 Cb 0.46 -3.65 0.01 0.00 -0.64 0.00 0.00 41.12 37.31 2yrz n ASP 79 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2yrz s LEU 80 N -5.31 3.05 -0.09 0.64 1.43 -1.25 -5.11 118.68 112.04 2yrz s LEU 80 Ca 0.34 -0.96 -0.05 0.00 -1.03 0.00 0.00 54.13 52.44 2yrz s LEU 80 Cb -0.15 -1.62 -0.04 0.00 0.03 0.00 0.00 46.19 44.41 2yrz s LEU 80 CO 0.50 -1.04 0.10 -0.76 0.23 0.00 0.00 176.35 175.38 2yrz s LEU 81 N -4.36 4.14 0.46 1.79 1.43 -1.26 -4.71 118.68 116.17 2yrz s LEU 81 Ca 0.47 0.35 -0.23 0.00 -1.03 0.00 0.00 54.13 53.70 2yrz s LEU 81 Cb -0.04 -2.06 -0.07 0.00 0.03 0.00 0.00 46.19 44.05 2yrz s LEU 81 CO 0.29 0.38 1.16 -2.16 0.23 0.00 0.00 176.35 176.25 2yrz s PRO 82 N -1.11 3.74 -1.33 1.29 0.04 -1.26 -3.63 135.00 132.74 2yrz s PRO 82 Ca 0.16 1.76 -0.06 0.00 0.04 0.00 0.00 61.00 62.90 2yrz s PRO 82 Cb -0.12 -2.38 -0.00 0.00 0.04 0.00 0.00 34.50 32.04 2yrz s PRO 82 CO 0.05 -0.56 0.52 0.09 0.04 0.00 0.00 177.00 177.14 2yrz n ASN 83 N -0.53 -1.61 -3.76 6.66 5.03 -1.21 -4.98 115.26 114.87 2yrz n ASN 83 Ca 0.07 -1.02 -0.13 0.00 0.87 0.00 0.00 54.58 54.38 2yrz n ASN 83 Cb 0.48 -3.10 -0.14 0.00 -1.02 0.00 0.00 39.78 36.00 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 -3.82 -0.21 0.58 3.10 3.76 -1.24 -4.93 115.29 112.53 2yrz s HIS 84 Ca 0.13 0.55 -0.17 0.00 -0.15 0.00 0.00 55.06 55.42 2yrz s HIS 84 Cb -0.05 -0.02 -0.04 0.00 1.11 0.00 0.00 32.58 33.58 2yrz s HIS 84 CO 0.88 -0.17 1.07 -1.54 -0.85 0.00 0.00 174.74 174.14 2yrz s SER 85 N 0.94 5.76 -0.16 1.40 1.04 -1.26 -3.64 113.70 117.79 2yrz s SER 85 Ca -0.07 1.90 -0.06 0.00 0.48 0.00 0.00 55.95 58.20 2yrz s SER 85 Cb -0.09 -2.55 0.08 0.00 0.10 0.00 0.00 66.02 63.56 2yrz s SER 85 CO -0.05 -1.18 0.33 -0.31 0.98 0.00 0.00 173.24 173.01 2yrz s TYR 86 N -2.29 -0.58 -0.56 5.02 2.02 -0.81 -2.04 117.35 118.11 2yrz s TYR 86 Ca 0.66 1.18 -0.26 0.00 -0.37 0.00 0.00 57.07 58.27 2yrz s TYR 86 Cb -0.18 0.10 0.03 0.00 -0.40 0.00 0.00 41.96 41.51 2yrz s TYR 86 CO 0.34 -0.42 1.07 0.54 -1.57 0.00 0.00 175.55 175.51 2yrz s VAL 87 N 2.50 4.21 -0.23 0.71 0.11 -0.22 -1.81 120.40 125.67 2yrz s VAL 87 Ca 0.00 0.65 -0.18 0.00 -2.93 0.00 0.00 61.98 59.52 2yrz s VAL 87 Cb -0.12 -4.63 -0.03 0.00 -1.53 0.00 0.00 36.38 30.07 2yrz s VAL 87 CO -0.10 -1.20 0.52 -0.36 -3.33 0.00 0.00 175.10 170.62 2yrz s PHE 88 N 4.44 3.33 -0.32 1.54 0.40 -1.01 -3.30 117.98 123.06 2yrz s PHE 88 Ca 0.37 0.71 0.03 0.00 -0.60 0.00 0.00 56.93 57.45 2yrz s PHE 88 Cb -0.10 -2.69 0.09 0.00 0.51 0.00 0.00 43.02 40.84 2yrz s PHE 88 CO 0.23 -0.18 0.03 1.03 0.70 0.00 0.00 175.22 177.04 2yrz s ARG 89 N 1.92 1.50 0.26 0.44 0.52 0.96 0.13 118.95 124.68 2yrz s ARG 89 Ca 0.23 -1.72 -0.01 0.00 -0.52 0.00 0.00 55.73 53.71 2yrz s ARG 89 Cb -0.15 -3.04 -0.04 0.00 0.52 0.00 0.00 34.95 32.23 2yrz s ARG 89 CO 0.09 -0.89 0.46 0.08 0.02 0.00 0.00 175.30 175.06 2yrz s VAL 90 N 1.00 5.14 0.10 3.52 1.01 -1.11 -1.97 120.40 128.11 2yrz s VAL 90 Ca 0.08 -0.35 -0.25 0.00 0.00 0.00 0.00 61.98 61.46 2yrz s VAL 90 Cb -0.19 -3.78 0.08 0.00 0.00 0.00 0.00 36.38 32.49 2yrz s VAL 90 CO -0.09 -0.32 0.69 0.00 0.00 0.00 0.00 175.10 175.37 2yrz s ARG 91 N -3.69 1.14 0.25 2.72 1.70 -0.58 -1.44 118.95 119.06 2yrz s ARG 91 Ca 0.40 -0.39 0.09 0.00 -0.47 0.00 0.00 55.73 55.36 2yrz s ARG 91 Cb -0.10 0.53 -0.04 0.00 -0.57 0.00 0.00 34.95 34.76 2yrz s ARG 91 CO 0.31 -0.49 -0.02 0.00 -1.08 0.00 0.00 175.30 174.02 2yrz s ALA 92 N -3.47 3.14 0.01 7.88 0.00 -1.26 -1.26 121.76 126.80 2yrz s ALA 92 Ca 0.02 -1.63 0.06 0.00 0.00 0.00 0.00 51.96 50.41 2yrz s ALA 92 Cb -0.01 -0.77 -0.02 0.00 0.00 0.00 0.00 23.12 22.32 2yrz s ALA 92 CO -0.11 0.29 -0.20 -1.14 0.00 0.00 0.00 175.76 174.61 2yrz s GLN 93 N -3.56 1.45 0.10 0.00 0.74 -1.26 -2.79 119.66 114.34 2yrz s GLN 93 Ca 0.31 -0.81 0.00 0.00 0.05 0.00 0.00 55.36 54.91 2yrz s GLN 93 Cb -0.07 -1.48 -0.04 0.00 1.10 0.00 0.00 33.01 32.52 2yrz s GLN 93 CO 0.19 0.39 -0.01 -1.54 -0.55 0.00 0.00 175.29 173.77 2yrz s SER 94 N -0.82 0.69 0.31 6.67 1.04 -1.12 -2.45 113.70 118.02 2yrz s SER 94 Ca 0.07 -1.08 0.22 0.00 0.48 0.00 0.00 55.95 55.64 2yrz s SER 94 Cb -0.08 0.19 1.05 0.00 0.10 0.00 0.00 66.02 67.27 2yrz s SER 94 CO 0.01 -0.60 1.11 1.67 0.98 0.00 0.00 173.24 176.40 2yrz n GLN 95 N -0.03 -0.03 0.22 4.02 -0.06 -1.26 0.68 117.38 120.92 2yrz n GLN 95 Ca -0.10 0.90 -0.10 0.00 -2.00 0.00 0.00 57.00 55.70 2yrz n GLN 95 Cb 0.62 -1.75 -0.05 0.00 -4.06 0.00 0.00 30.24 25.00 2yrz n GLN 95 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 2yrz h GLU 96 N 0.00 -0.59 0.00 3.69 4.39 -1.94 -3.50 114.58 116.62 2yrz h GLU 96 Ca 0.62 0.04 0.00 0.00 0.34 0.00 0.00 59.36 60.36 2yrz h GLU 96 Cb 1.96 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 30.75 2yrz h GLU 96 CO -0.36 -0.36 0.00 0.41 -1.16 0.00 0.00 179.01 177.54 2yrz n GLY 97 N 0.13 -2.04 3.68 -3.84 0.00 0.21 -5.07 105.19 98.26 2yrz n GLY 97 Ca -0.08 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.31 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 -2.43 2.80 0.00 1.61 0.52 -1.26 -2.80 118.94 117.39 2yrz s TRP 98 Ca 0.00 0.87 0.00 0.00 0.02 0.00 0.00 56.10 56.99 2yrz s TRP 98 Cb 0.00 -3.60 0.00 0.00 -1.15 0.00 0.00 33.47 28.72 2yrz s TRP 98 CO 0.00 -2.18 0.00 0.41 0.02 0.00 0.00 176.95 175.20 2yrz n GLY 99 N 3.64 1.08 2.56 0.98 0.00 -1.12 -5.00 105.19 107.33 2yrz n GLY 99 Ca 0.13 -1.41 -0.18 0.00 0.00 0.00 0.00 46.02 44.57 2yrz n GLY 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yrz n ARG 100 N 0.00 -0.47 -4.22 1.61 1.74 -1.24 -4.92 116.66 109.15 2yrz n ARG 100 Ca 0.00 -1.53 -0.13 0.00 -0.77 0.00 0.00 57.85 55.42 2yrz n ARG 100 Cb 0.00 -0.73 -0.10 0.00 -1.02 0.00 0.00 32.46 30.61 2yrz n ARG 100 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 2yrz s GLU 101 N -4.64 1.21 -0.12 5.56 4.04 -1.26 -4.28 118.70 119.21 2yrz s GLU 101 Ca 0.48 -1.63 0.01 0.00 0.04 0.00 0.00 54.97 53.86 2yrz s GLU 101 Cb -0.02 0.16 0.02 0.00 0.02 0.00 0.00 34.13 34.31 2yrz s GLU 101 CO 0.33 -0.36 -0.14 0.50 -1.84 0.00 0.00 175.26 173.75 2yrz s ARG 102 N -4.12 2.16 0.20 -4.83 6.06 -0.52 -4.67 118.95 113.22 2yrz s ARG 102 Ca 0.37 -0.53 -0.30 0.00 -2.50 0.00 0.00 55.73 52.78 2yrz s ARG 102 Cb 0.07 -1.90 -0.08 0.00 0.06 0.00 0.00 34.95 33.11 2yrz s ARG 102 CO 0.11 -0.12 1.10 -2.00 -2.50 0.00 0.00 175.30 171.89 2yrz s GLU 103 N 1.16 4.60 -0.43 5.12 2.12 -1.26 -2.75 118.70 127.27 2yrz s GLU 103 Ca -0.03 1.74 0.05 0.00 0.36 0.00 0.00 54.97 57.09 2yrz s GLU 103 Cb -0.14 -3.26 0.19 0.00 0.26 0.00 0.00 34.13 31.18 2yrz s GLU 103 CO -0.04 0.10 0.49 0.41 -0.54 0.00 0.00 175.26 175.67 2yrz n GLY 104 N 1.90 1.60 3.77 -1.50 0.00 0.34 -4.84 105.19 106.46 2yrz n GLY 104 Ca 0.02 -0.92 -0.40 0.00 0.00 0.00 0.00 46.02 44.72 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 0.02 2.95 0.05 1.61 1.01 -1.26 -2.39 120.40 122.39 2yrz s VAL 105 Ca 0.33 0.94 0.04 0.00 0.00 0.00 0.00 61.98 63.28 2yrz s VAL 105 Cb 0.07 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.84 2yrz s VAL 105 CO -0.16 0.21 -0.11 -0.51 0.00 0.00 0.00 175.10 174.53 2yrz s ILE 106 N -1.18 0.82 -0.29 2.22 1.10 -0.75 -4.95 121.20 118.17 2yrz s ILE 106 Ca 0.49 -1.05 0.01 0.00 -0.51 0.00 0.00 60.65 59.59 2yrz s ILE 106 Cb -0.37 -0.81 0.06 0.00 0.15 0.00 0.00 42.46 41.50 2yrz s ILE 106 CO 0.48 -0.21 -0.04 -0.89 -2.11 0.00 0.00 174.94 172.18 2yrz s THR 107 N -1.12 2.54 -0.02 4.00 2.01 -1.26 -1.93 115.64 119.85 2yrz s THR 107 Ca -0.04 -1.65 -0.32 0.00 0.31 0.00 0.00 61.69 59.99 2yrz s THR 107 Cb -0.09 -2.53 -0.10 0.00 0.01 0.00 0.00 72.50 69.78 2yrz s THR 107 CO 0.01 -0.15 1.92 -0.38 -0.69 0.00 0.00 174.62 175.33 2yrz n ILE 108 N 4.49 0.66 -3.85 1.82 2.08 -1.24 -4.96 119.36 118.36 2yrz n ILE 108 Ca -0.11 -0.12 -0.29 0.00 0.56 0.00 0.00 62.75 62.79 2yrz n ILE 108 Cb 0.42 -2.09 -0.16 0.00 -0.75 0.00 0.00 39.64 37.06 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 4.21 1.22 -0.13 0.38 2.02 -1.26 -3.34 118.70 121.80 2yrz s GLU 109 Ca 0.91 -0.77 -0.11 0.00 0.02 0.00 0.00 54.97 55.02 2yrz s GLU 109 Cb -0.56 -2.39 -0.04 0.00 0.10 0.00 0.00 34.13 31.24 2yrz s GLU 109 CO 0.47 -0.62 -0.21 0.45 0.02 0.00 0.00 175.26 175.37 2yrz n SER 110 N 4.82 1.50 -4.41 -0.19 2.88 -1.26 -4.76 113.62 112.20 2yrz n SER 110 Ca -0.11 0.43 -0.45 0.00 -1.33 0.00 0.00 58.87 57.41 2yrz n SER 110 Cb 0.45 -0.75 -0.02 0.00 -0.75 0.00 0.00 64.21 63.14 2yrz n SER 110 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 2yrz s GLN 111 N -2.24 3.65 0.29 -1.46 0.74 -1.26 -5.02 119.66 114.36 2yrz s GLN 111 Ca -0.17 -2.06 -0.29 0.00 0.05 0.00 0.00 55.36 52.89 2yrz s GLN 111 Cb 0.02 -4.77 -0.13 0.00 1.10 0.00 0.00 33.01 29.23 2yrz s GLN 111 CO 0.25 -1.61 1.18 1.55 -0.55 0.00 0.00 175.29 176.11 2yrz n VAL 112 N 4.91 1.75 -3.74 1.34 3.14 -1.26 -5.00 118.33 119.46 2yrz n VAL 112 Ca 0.22 -0.44 -0.13 0.00 -2.96 0.00 0.00 64.34 61.03 2yrz n VAL 112 Cb 0.48 -1.25 -0.09 0.00 -1.06 0.00 0.00 33.84 31.91 2yrz n VAL 112 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 2yrz s SER 113 N -0.30 -0.30 -0.26 6.55 0.15 -1.26 -5.17 113.70 113.11 2yrz s SER 113 Ca 0.60 0.43 -0.26 0.00 0.70 0.00 0.00 55.95 57.42 2yrz s SER 113 Cb -0.66 0.54 0.12 0.00 -1.71 0.00 0.00 66.02 64.31 2yrz s SER 113 CO 0.59 -0.30 1.04 -0.83 1.20 0.00 0.00 173.24 174.93 2yrz s GLY 114 N -0.60 -0.16 1.00 9.45 0.00 -1.26 -5.17 107.32 110.57 2yrz s GLY 114 Ca -0.07 2.59 -0.12 0.00 0.00 0.00 0.00 44.72 47.11 2yrz s GLY 114 CO 0.03 1.70 1.09 2.56 0.00 0.00 0.00 173.10 178.48 2yrz s PRO 115 N -0.01 0.46 0.17 2.90 0.04 -1.26 -5.08 135.00 132.22 2yrz s PRO 115 Ca 0.02 0.54 0.10 0.00 0.04 0.00 0.00 61.00 61.70 2yrz s PRO 115 Cb -0.04 -1.74 -0.04 0.00 0.04 0.00 0.00 34.50 32.72 2yrz s PRO 115 CO -0.05 -2.72 -0.22 -1.12 0.04 0.00 0.00 177.00 172.93 2yrz s SER 116 N -3.45 3.13 -0.17 6.66 0.01 -1.26 -5.06 113.70 113.56 2yrz s SER 116 Ca 0.65 -0.83 -0.31 0.00 1.31 0.00 0.00 55.95 56.77 2yrz s SER 116 Cb -0.19 -0.21 -0.14 0.00 0.21 0.00 0.00 66.02 65.69 2yrz s SER 116 CO 0.58 0.08 0.95 -0.24 0.41 0.00 0.00 173.24 175.02 2yrz n SER 117 N 0.43 0.40 0.00 2.44 2.88 -1.26 -5.39 113.62 113.12 2yrz n SER 117 Ca -0.14 0.85 0.00 0.00 -1.33 0.00 0.00 58.87 58.25 2yrz n SER 117 Cb 0.56 -0.65 0.00 0.00 -0.75 0.00 0.00 64.21 63.36 2yrz n SER 117 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42