#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 4.65 0.07 1.61 0.15 -1.26 -4.95 113.70 113.97 2yrz s SER 2 Ca 0.00 2.43 -0.36 0.00 0.70 0.00 0.00 55.95 58.72 2yrz s SER 2 Cb 0.00 -2.60 -0.20 0.00 -1.71 0.00 0.00 66.02 61.51 2yrz s SER 2 CO 0.00 -1.96 1.58 0.28 1.20 0.00 0.00 173.24 174.35 2yrz h SER 3 N 0.33 -1.09 0.00 5.45 0.02 -2.14 -3.48 113.55 112.64 2yrz h SER 3 Ca -0.49 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 2yrz h SER 3 Cb 1.31 0.30 0.00 0.00 0.14 0.00 0.00 62.40 64.14 2yrz h SER 3 CO 0.52 -0.74 0.00 0.61 -1.14 0.00 0.00 176.83 176.09 2yrz n GLY 4 N -1.62 1.45 2.48 -3.77 0.00 -1.26 -5.04 105.19 97.43 2yrz n GLY 4 Ca -0.15 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 44.81 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 3.11 -4.74 1.61 7.64 -1.26 -5.08 113.62 114.90 2yrz n SER 5 Ca 0.00 -2.91 -0.41 0.00 1.01 0.00 0.00 58.87 56.57 2yrz n SER 5 Cb 0.00 -0.43 -0.05 0.00 -1.01 0.00 0.00 64.21 62.72 2yrz n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2yrz s SER 6 N -3.63 7.46 0.00 6.43 0.15 -1.26 -4.35 113.70 118.51 2yrz s SER 6 Ca 0.38 1.75 0.00 0.00 0.70 0.00 0.00 55.95 58.77 2yrz s SER 6 Cb 0.38 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 62.12 2yrz s SER 6 CO -0.02 -0.00 0.00 0.61 1.20 0.00 0.00 173.24 175.03 2yrz n GLY 7 N 2.13 1.00 3.09 9.45 0.00 -1.26 -5.14 105.19 114.46 2yrz n GLY 7 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.98 1.37 -0.28 1.61 0.01 -1.26 -5.13 113.70 108.03 2yrz s SER 8 Ca 0.00 -0.37 -0.02 0.00 1.31 0.00 0.00 55.95 56.87 2yrz s SER 8 Cb 0.00 -0.09 0.04 0.00 0.21 0.00 0.00 66.02 66.18 2yrz s SER 8 CO 0.00 0.03 -0.02 -1.00 0.41 0.00 0.00 173.24 172.66 2yrz s HIS 9 N -0.71 3.20 0.27 2.43 0.09 -1.26 -5.08 115.29 114.22 2yrz s HIS 9 Ca 0.01 -1.74 0.06 0.00 -0.00 0.00 0.00 55.06 53.39 2yrz s HIS 9 Cb -0.07 -2.10 -0.02 0.00 -0.00 0.00 0.00 32.58 30.39 2yrz s HIS 9 CO 0.01 -0.77 0.23 -0.25 -0.00 0.00 0.00 174.74 173.95 2yrz n ASP 10 N 4.65 -0.51 -0.12 1.40 8.00 -1.26 -5.09 116.55 123.62 2yrz n ASP 10 Ca -0.14 -2.79 -0.25 0.00 0.71 0.00 0.00 54.79 52.32 2yrz n ASP 10 Cb 0.45 1.35 -0.11 0.00 -0.02 0.00 0.00 41.12 42.78 2yrz n ASP 10 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2yrz n SER 11 N -1.92 1.96 -4.56 -2.24 3.41 -1.26 -4.79 113.62 104.23 2yrz n SER 11 Ca 0.06 0.23 -0.28 0.00 -0.26 0.00 0.00 58.87 58.62 2yrz n SER 11 Cb 0.49 -0.75 -0.05 0.00 -0.26 0.00 0.00 64.21 63.64 2yrz n SER 11 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2yrz s ARG 12 N -2.49 2.48 -0.06 4.33 1.81 -1.26 -4.90 118.95 118.86 2yrz s ARG 12 Ca -0.35 0.00 -0.04 0.00 -1.72 0.00 0.00 55.73 53.63 2yrz s ARG 12 Cb 0.11 -4.89 0.03 0.00 -0.45 0.00 0.00 34.95 29.75 2yrz s ARG 12 CO 0.56 -3.34 0.14 -0.51 -0.68 0.00 0.00 175.30 171.47 2yrz s LEU 13 N 10.34 1.01 -0.36 2.53 1.43 -1.26 -5.09 118.68 127.28 2yrz s LEU 13 Ca 0.72 0.29 -0.32 0.00 -1.03 0.00 0.00 54.13 53.79 2yrz s LEU 13 Cb -0.09 0.41 -0.14 0.00 0.03 0.00 0.00 46.19 46.40 2yrz s LEU 13 CO 0.05 -0.11 1.42 0.35 0.23 0.00 0.00 176.35 178.29 2yrz n THR 14 N 3.74 0.00 -3.55 5.49 -2.24 -1.26 -4.85 114.28 111.62 2yrz n THR 14 Ca -0.21 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.16 2yrz n THR 14 Cb 0.55 -0.36 -0.06 0.00 -2.10 0.00 0.00 70.33 68.35 2yrz n THR 14 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2yrz s ALA 15 N 3.65 3.83 0.00 6.98 0.00 -1.26 -4.43 121.76 130.52 2yrz s ALA 15 Ca 0.83 -3.33 0.00 0.00 0.00 0.00 0.00 51.96 49.46 2yrz s ALA 15 Cb -1.08 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 19.00 2yrz s ALA 15 CO 0.51 -2.19 0.00 0.41 0.00 0.00 0.00 175.76 174.50 2yrz n GLY 16 N 3.62 0.64 3.89 0.00 0.00 -1.26 -4.95 105.19 107.13 2yrz n GLY 16 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.64 5.22 -0.06 1.61 -7.23 -1.26 -4.35 120.40 113.68 2yrz s VAL 17 Ca 0.00 0.05 -0.30 0.00 -1.81 0.00 0.00 61.98 59.92 2yrz s VAL 17 Cb 0.00 -3.61 -0.05 0.00 0.56 0.00 0.00 36.38 33.28 2yrz s VAL 17 CO 0.00 0.15 1.50 -2.16 -0.31 0.00 0.00 175.10 174.28 2yrz s PRO 18 N -2.36 4.22 0.76 4.82 0.04 -1.26 -4.72 135.00 136.49 2yrz s PRO 18 Ca 0.36 2.01 -0.14 0.00 0.04 0.00 0.00 61.00 63.27 2yrz s PRO 18 Cb -0.13 -3.81 0.05 0.00 0.04 0.00 0.00 34.50 30.65 2yrz s PRO 18 CO 0.23 -0.74 1.20 0.34 0.04 0.00 0.00 177.00 178.06 2yrz s ASP 19 N 2.61 4.03 -0.01 6.66 2.15 -0.55 -3.91 116.67 127.65 2yrz s ASP 19 Ca 0.66 2.32 -0.39 0.00 0.43 0.00 0.00 52.55 55.57 2yrz s ASP 19 Cb -0.30 -2.58 -0.19 0.00 -0.30 0.00 0.00 42.92 39.55 2yrz s ASP 19 CO 0.25 -2.37 1.23 0.41 -0.17 0.00 0.00 175.17 174.52 2yrz n THR 20 N -2.95 0.01 -2.25 1.71 -1.04 -1.26 -4.56 114.28 103.94 2yrz n THR 20 Ca 0.13 -0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.74 2yrz n THR 20 Cb 0.50 -0.38 -0.03 0.00 -1.82 0.00 0.00 70.33 68.61 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 0.51 4.43 1.29 -2.82 0.04 -1.26 -4.88 135.00 132.31 2yrz s PRO 21 Ca 0.90 2.04 -0.19 0.00 0.04 0.00 0.00 61.00 63.79 2yrz s PRO 21 Cb -1.16 -3.08 0.30 0.00 0.04 0.00 0.00 34.50 30.60 2yrz s PRO 21 CO 0.55 -0.06 0.73 2.41 0.04 0.00 0.00 177.00 180.68 2yrz n THR 22 N 0.88 0.00 -1.17 1.26 -1.04 -1.26 -4.53 114.28 108.42 2yrz n THR 22 Ca -0.00 -0.19 -0.36 0.00 -2.04 0.00 0.00 64.05 61.46 2yrz n THR 22 Cb 0.43 -0.87 0.07 0.00 -1.82 0.00 0.00 70.33 68.14 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 -4.57 0.16 -3.71 -2.82 1.74 -1.26 -4.61 116.66 101.60 2yrz n ARG 23 Ca 0.08 0.09 -0.26 0.00 -0.77 0.00 0.00 57.85 56.99 2yrz n ARG 23 Cb 0.55 -1.72 -0.03 0.00 -1.02 0.00 0.00 32.46 30.24 2yrz n ARG 23 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2yrz s LEU 24 N 0.56 4.22 -0.24 0.55 1.43 -1.26 -4.49 118.68 119.44 2yrz s LEU 24 Ca 0.62 0.36 -0.01 0.00 -1.03 0.00 0.00 54.13 54.06 2yrz s LEU 24 Cb -0.32 -3.14 0.03 0.00 0.03 0.00 0.00 46.19 42.78 2yrz s LEU 24 CO 0.62 -0.06 -0.07 -0.69 0.23 0.00 0.00 176.35 176.38 2yrz s VAL 25 N -1.91 2.82 -0.17 -1.59 1.01 0.13 -4.89 120.40 115.80 2yrz s VAL 25 Ca 0.38 -1.03 -0.09 0.00 0.00 0.00 0.00 61.98 61.23 2yrz s VAL 25 Cb -0.11 -2.43 -0.05 0.00 0.00 0.00 0.00 36.38 33.80 2yrz s VAL 25 CO 0.30 0.21 0.15 -0.36 0.00 0.00 0.00 175.10 175.40 2yrz s PHE 26 N 1.32 3.49 -0.21 5.22 0.08 -1.24 -1.13 117.98 125.50 2yrz s PHE 26 Ca 0.00 0.43 0.01 0.00 0.12 0.00 0.00 56.93 57.49 2yrz s PHE 26 Cb -0.17 -2.10 -0.20 0.00 -0.57 0.00 0.00 43.02 39.99 2yrz s PHE 26 CO -0.05 0.45 -0.01 0.45 -0.10 0.00 0.00 175.22 175.96 2yrz n SER 27 N 2.95 1.87 -3.26 1.36 2.88 -0.92 -4.91 113.62 113.58 2yrz n SER 27 Ca -0.17 -0.01 -0.17 0.00 -1.33 0.00 0.00 58.87 57.19 2yrz n SER 27 Cb 0.53 -0.45 0.08 0.00 -0.75 0.00 0.00 64.21 63.63 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 -3.13 -1.79 -0.58 -1.46 0.00 -1.26 -4.80 120.51 107.48 2yrz n ALA 28 Ca -0.40 0.00 0.45 0.00 0.00 0.00 0.00 53.44 53.49 2yrz n ALA 28 Cb 1.02 -2.65 0.70 0.00 0.00 0.00 0.00 19.45 18.52 2yrz n ALA 28 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2yrz n LEU 29 N -4.00 0.00 0.00 0.00 7.99 -1.15 -4.68 117.00 115.16 2yrz n LEU 29 Ca -0.23 0.87 0.00 0.00 -0.01 0.00 0.00 56.01 56.64 2yrz n LEU 29 Cb 0.64 -0.42 0.00 0.00 -0.11 0.00 0.00 43.42 43.53 2yrz n LEU 29 CO 0.57 -0.87 0.00 0.61 -1.51 0.00 0.00 177.39 176.19 2yrz n GLY 30 N -1.81 1.33 0.19 -0.72 0.00 -1.11 -4.94 105.19 98.13 2yrz n GLY 30 Ca 0.38 -0.84 0.04 0.00 0.00 0.00 0.00 46.02 45.60 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 -3.13 132.00 128.68 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 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 2yrz h PRO 31 CO 0.00 0.38 -0.18 0.25 -0.23 0.00 0.00 178.00 178.22 2yrz n THR 32 N -3.76 1.84 -3.91 1.56 -2.24 -1.26 -4.35 114.28 102.15 2yrz n THR 32 Ca -0.01 -2.38 -0.10 0.00 -2.27 0.00 0.00 64.05 59.28 2yrz n THR 32 Cb 0.46 -0.18 -0.11 0.00 -2.10 0.00 0.00 70.33 68.40 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 -2.86 0.09 0.21 3.42 1.04 -1.18 -2.74 113.70 111.68 2yrz s SER 33 Ca 0.32 -0.25 -0.17 0.00 0.48 0.00 0.00 55.95 56.33 2yrz s SER 33 Cb 0.29 0.15 0.02 0.00 0.10 0.00 0.00 66.02 66.58 2yrz s SER 33 CO -0.00 -0.27 0.54 -0.76 0.98 0.00 0.00 173.24 173.73 2yrz s LEU 34 N -1.11 0.08 -0.24 2.42 1.43 0.26 -2.74 118.68 118.78 2yrz s LEU 34 Ca -0.12 -0.56 -0.03 0.00 -1.03 0.00 0.00 54.13 52.39 2yrz s LEU 34 Cb -0.07 2.15 0.10 0.00 0.03 0.00 0.00 46.19 48.39 2yrz s LEU 34 CO 0.00 -1.09 0.19 -0.60 0.23 0.00 0.00 176.35 175.08 2yrz s ARG 35 N -3.90 0.19 -0.20 1.70 3.52 -1.26 0.13 118.95 119.13 2yrz s ARG 35 Ca 0.11 -0.12 -0.17 0.00 -0.13 0.00 0.00 55.73 55.42 2yrz s ARG 35 Cb -0.01 -1.20 -0.03 0.00 -1.56 0.00 0.00 34.95 32.15 2yrz s ARG 35 CO -0.00 -0.84 0.47 0.08 -0.81 0.00 0.00 175.30 174.20 2yrz s VAL 36 N 2.24 5.14 -0.06 7.11 1.01 0.31 -2.17 120.40 133.98 2yrz s VAL 36 Ca 0.07 0.86 0.02 0.00 0.00 0.00 0.00 61.98 62.93 2yrz s VAL 36 Cb -0.15 -3.80 0.01 0.00 0.00 0.00 0.00 36.38 32.44 2yrz s VAL 36 CO -0.23 0.21 -0.12 -0.44 0.00 0.00 0.00 175.10 174.52 2yrz s SER 37 N 1.11 1.73 0.38 3.32 0.01 -0.28 -0.77 113.70 119.21 2yrz s SER 37 Ca 0.22 -0.29 0.02 0.00 1.31 0.00 0.00 55.95 57.21 2yrz s SER 37 Cb -0.15 -0.80 0.02 0.00 0.21 0.00 0.00 66.02 65.30 2yrz s SER 37 CO 0.09 0.03 0.18 -2.67 0.41 0.00 0.00 173.24 171.28 2yrz n TRP 38 N 3.84 -0.20 -4.05 2.43 2.14 -0.77 0.19 117.44 121.02 2yrz n TRP 38 Ca -0.23 -1.71 -0.33 0.00 2.07 0.00 0.00 57.50 57.30 2yrz n TRP 38 Cb 0.52 -0.29 -0.15 0.00 -0.81 0.00 0.00 31.31 30.58 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 -3.50 2.58 -0.44 -2.67 0.74 -1.26 -4.84 119.66 110.26 2yrz s GLN 39 Ca 0.14 -1.13 -0.28 0.00 0.05 0.00 0.00 55.36 54.14 2yrz s GLN 39 Cb -0.01 -2.83 -0.14 0.00 1.10 0.00 0.00 33.01 31.13 2yrz s GLN 39 CO 0.09 -0.44 1.60 -1.91 -0.55 0.00 0.00 175.29 174.07 2yrz n GLU 40 N 4.54 0.00 -1.17 1.67 2.13 -1.26 -4.23 120.64 122.31 2yrz n GLU 40 Ca -0.16 0.00 -0.29 0.00 0.66 0.00 0.00 57.16 57.37 2yrz n GLU 40 Cb 0.45 -1.05 0.17 0.00 0.27 0.00 0.00 31.44 31.29 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 4.74 0.61 0.27 5.31 0.04 -1.26 -4.99 135.00 139.72 2yrz s PRO 41 Ca 0.87 0.59 -0.29 0.00 0.04 0.00 0.00 61.00 62.20 2yrz s PRO 41 Cb -1.00 -1.75 -0.09 0.00 0.04 0.00 0.00 34.50 31.69 2yrz s PRO 41 CO 0.43 -2.62 1.12 -0.98 0.04 0.00 0.00 177.00 174.99 2yrz s ARG 42 N -4.95 4.60 -0.29 4.56 1.70 -1.26 -4.84 118.95 118.47 2yrz s ARG 42 Ca 0.65 1.84 -0.14 0.00 -0.47 0.00 0.00 55.73 57.60 2yrz s ARG 42 Cb -0.18 -3.19 0.12 0.00 -0.57 0.00 0.00 34.95 31.13 2yrz s ARG 42 CO 0.57 0.15 0.79 0.00 -1.08 0.00 0.00 175.30 175.73 2yrz h GLU 44 N 7.13 0.00 -6.47 0.00 4.81 -1.85 -3.43 114.58 114.77 2yrz h GLU 44 Ca -0.24 0.00 -0.63 0.00 -0.13 0.00 0.00 59.36 58.36 2yrz h GLU 44 Cb 1.17 0.00 -0.14 0.00 0.63 0.00 0.00 28.75 30.41 2yrz h GLU 44 CO 0.14 0.06 -0.73 1.03 -0.73 0.00 0.00 179.01 178.79 2yrz s ARG 45 N -4.11 2.06 0.22 1.92 1.81 -1.26 -5.11 118.95 114.48 2yrz s ARG 45 Ca -0.03 -1.24 -0.30 0.00 -1.72 0.00 0.00 55.73 52.45 2yrz s ARG 45 Cb 0.12 -2.18 -0.09 0.00 -0.45 0.00 0.00 34.95 32.36 2yrz s ARG 45 CO 0.53 0.44 1.29 -1.25 -0.68 0.00 0.00 175.30 175.64 2yrz s PRO 46 N -2.73 4.41 0.40 3.54 0.04 -1.26 -4.87 135.00 134.53 2yrz s PRO 46 Ca 0.24 2.05 -0.23 0.00 0.04 0.00 0.00 61.00 63.10 2yrz s PRO 46 Cb -0.09 -3.18 -0.10 0.00 0.04 0.00 0.00 34.50 31.17 2yrz s PRO 46 CO 0.15 -0.20 1.00 -0.51 0.04 0.00 0.00 177.00 177.48 2yrz s LEU 47 N -0.44 4.09 0.05 -3.56 1.43 -1.26 -4.08 118.68 114.92 2yrz s LEU 47 Ca 0.55 1.90 0.22 0.00 -1.03 0.00 0.00 54.13 55.77 2yrz s LEU 47 Cb -0.36 -4.29 -0.18 0.00 0.03 0.00 0.00 46.19 41.38 2yrz s LEU 47 CO 0.40 -0.42 0.74 0.00 0.23 0.00 0.00 176.35 177.30 2yrz n GLN 48 N -0.21 0.57 -0.10 1.70 6.02 -1.07 -4.67 117.38 119.62 2yrz n GLN 48 Ca 0.05 -0.07 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 2yrz n GLN 48 Cb 0.51 -1.63 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 -0.79 3.54 1.08 0.00 -1.26 -3.97 105.19 105.05 2yrz n GLY 49 Ca -0.02 -0.30 -0.09 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 -3.97 0.37 -0.04 1.61 2.02 -1.10 -3.95 117.35 112.30 2yrz s TYR 50 Ca 0.00 -0.72 -0.03 0.00 -0.37 0.00 0.00 57.07 55.95 2yrz s TYR 50 Cb 0.00 0.14 0.02 0.00 -0.40 0.00 0.00 41.96 41.72 2yrz s TYR 50 CO 0.00 -0.94 0.10 0.45 -1.57 0.00 0.00 175.55 173.59 2yrz s SER 51 N -3.01 -0.08 -0.24 2.29 0.15 -0.89 -1.10 113.70 110.81 2yrz s SER 51 Ca 0.22 0.21 -0.02 0.00 0.70 0.00 0.00 55.95 57.06 2yrz s SER 51 Cb 0.00 0.15 0.08 0.00 -1.71 0.00 0.00 66.02 64.54 2yrz s SER 51 CO 0.07 -0.09 0.05 -0.69 1.20 0.00 0.00 173.24 173.79 2yrz s VAL 52 N 0.58 0.71 -0.12 4.45 1.01 0.69 -1.61 120.40 126.11 2yrz s VAL 52 Ca -0.04 -0.92 -0.04 0.00 0.00 0.00 0.00 61.98 60.97 2yrz s VAL 52 Cb -0.06 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 2yrz s VAL 52 CO -0.02 -0.39 0.04 -1.61 0.00 0.00 0.00 175.10 173.12 2yrz s GLU 53 N 1.74 3.33 -0.03 2.72 8.01 -0.93 -0.86 118.70 132.68 2yrz s GLU 53 Ca 0.03 -0.35 -0.05 0.00 0.01 0.00 0.00 54.97 54.61 2yrz s GLU 53 Cb -0.17 -2.97 0.01 0.00 -4.31 0.00 0.00 34.13 26.68 2yrz s GLU 53 CO -0.15 0.60 0.12 1.52 0.01 0.00 0.00 175.26 177.35 2yrz s TYR 54 N -0.56 -0.06 -0.11 1.61 -0.85 -0.81 -0.19 117.35 116.38 2yrz s TYR 54 Ca 0.10 0.14 -0.30 0.00 -0.52 0.00 0.00 57.07 56.49 2yrz s TYR 54 Cb -0.12 0.00 0.09 0.00 0.38 0.00 0.00 41.96 42.32 2yrz s TYR 54 CO 0.02 -0.14 0.81 1.14 -1.52 0.00 0.00 175.55 175.86 2yrz s GLN 55 N -0.47 0.86 -0.39 -3.49 -2.07 -1.20 -1.05 119.66 111.85 2yrz s GLN 55 Ca -0.05 0.28 -0.36 0.00 -1.82 0.00 0.00 55.36 53.41 2yrz s GLN 55 Cb -0.04 0.41 -0.15 0.00 -1.09 0.00 0.00 33.01 32.14 2yrz s GLN 55 CO 0.00 -0.25 1.34 1.28 -1.32 0.00 0.00 175.29 176.34 2yrz n LEU 56 N 1.01 0.85 -0.29 2.60 4.77 -1.25 -1.50 117.00 123.20 2yrz n LEU 56 Ca -0.15 0.82 -0.05 0.00 -0.03 0.00 0.00 56.01 56.60 2yrz n LEU 56 Cb 0.57 -0.68 -0.02 0.00 -2.33 0.00 0.00 43.42 40.95 2yrz n LEU 56 CO 0.19 -0.64 0.38 -0.11 -1.33 0.00 0.00 177.39 175.88 2yrz n LEU 57 N 3.77 -0.62 0.03 2.23 0.00 -0.49 0.77 117.00 122.69 2yrz n LEU 57 Ca 0.29 1.25 -0.11 0.00 0.00 0.00 0.00 56.01 57.44 2yrz n LEU 57 Cb -0.04 -0.22 -0.05 0.00 0.00 0.00 0.00 43.42 43.11 2yrz n LEU 57 CO 0.69 -1.07 0.79 -0.55 0.00 0.00 0.00 177.39 177.26 2yrz h ASN 58 N 0.00 -0.31 0.00 1.96 7.08 -1.85 -3.45 115.58 119.01 2yrz h ASN 58 Ca 0.18 0.05 0.00 0.00 -3.08 0.00 0.00 56.30 53.45 2yrz h ASN 58 Cb 0.35 0.14 0.00 0.00 -2.08 0.00 0.00 38.32 36.74 2yrz h ASN 58 CO -0.69 -0.15 0.00 0.61 -2.08 0.00 0.00 177.43 175.13 2yrz n GLY 59 N -1.24 3.41 0.00 9.14 0.00 0.23 -5.18 105.19 111.56 2yrz n GLY 59 Ca -0.05 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 0.93 3.68 -0.02 0.00 -1.26 -4.90 105.19 103.63 2yrz n GLY 60 Ca 0.00 0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.98 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 3.32 4.28 -0.23 1.61 2.12 -1.26 -4.85 118.70 123.68 2yrz s GLU 61 Ca 0.00 1.91 -0.07 0.00 0.36 0.00 0.00 54.97 57.17 2yrz s GLU 61 Cb 0.00 -3.62 -0.03 0.00 0.26 0.00 0.00 34.13 30.74 2yrz s GLU 61 CO 0.00 -0.59 0.06 -1.17 -0.54 0.00 0.00 175.26 173.02 2yrz s LEU 62 N 2.58 3.48 -0.22 2.70 1.98 -1.26 -3.88 118.68 124.06 2yrz s LEU 62 Ca 0.63 -0.16 -0.05 0.00 -2.89 0.00 0.00 54.13 51.66 2yrz s LEU 62 Cb -0.30 -1.92 -0.02 0.00 0.66 0.00 0.00 46.19 44.62 2yrz s LEU 62 CO 0.25 0.01 -0.01 -1.00 -1.89 0.00 0.00 176.35 173.71 2yrz s HIS 63 N 1.34 3.00 -0.25 5.38 3.76 -0.21 -4.99 115.29 123.31 2yrz s HIS 63 Ca 0.05 -0.70 -0.10 0.00 -0.15 0.00 0.00 55.06 54.16 2yrz s HIS 63 Cb -0.15 -2.12 -0.05 0.00 1.11 0.00 0.00 32.58 31.38 2yrz s HIS 63 CO 0.03 -0.42 0.15 0.50 -0.85 0.00 0.00 174.74 174.15 2yrz s ARG 64 N 1.35 3.96 -0.08 1.40 3.52 -1.26 -1.92 118.95 125.92 2yrz s ARG 64 Ca 0.04 -0.32 0.01 0.00 -0.13 0.00 0.00 55.73 55.33 2yrz s ARG 64 Cb -0.14 -3.53 -0.02 0.00 -1.56 0.00 0.00 34.95 29.69 2yrz s ARG 64 CO -0.00 -0.05 -0.11 -0.51 -0.81 0.00 0.00 175.30 173.82 2yrz s LEU 65 N 1.35 2.91 0.08 -0.88 1.43 -0.04 -4.99 118.68 118.54 2yrz s LEU 65 Ca 0.07 -0.17 0.09 0.00 -1.03 0.00 0.00 54.13 53.09 2yrz s LEU 65 Cb -0.15 -1.63 -0.03 0.00 0.03 0.00 0.00 46.19 44.41 2yrz s LEU 65 CO 0.07 0.30 -0.23 0.20 0.23 0.00 0.00 176.35 176.91 2yrz s ASN 66 N -0.43 3.48 -0.29 2.29 -0.87 -1.26 -0.22 114.94 117.63 2yrz s ASN 66 Ca 0.06 -0.59 -0.02 0.00 -1.57 0.00 0.00 52.86 50.74 2yrz s ASN 66 Cb -0.12 -0.39 0.04 0.00 -0.02 0.00 0.00 41.25 40.76 2yrz s ASN 66 CO 0.02 0.22 -0.00 -0.63 -2.57 0.00 0.00 177.10 174.14 2yrz s ILE 67 N -0.96 3.06 -2.00 0.60 -1.09 -0.26 -4.96 121.20 115.59 2yrz s ILE 67 Ca 0.14 -1.28 0.09 0.00 -2.23 0.00 0.00 60.65 57.37 2yrz s ILE 67 Cb -0.10 -2.72 0.26 0.00 -1.58 0.00 0.00 42.46 38.32 2yrz s ILE 67 CO 0.05 -0.06 0.99 -0.81 -1.23 0.00 0.00 174.94 173.88 2yrz n PRO 68 N 4.65 0.49 -3.81 2.79 -0.04 -1.26 -2.70 135.00 135.13 2yrz n PRO 68 Ca -0.14 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.06 2yrz n PRO 68 Cb 0.44 -1.29 -0.17 0.00 -0.04 0.00 0.00 33.50 32.44 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 -1.80 2.31 0.00 3.54 2.47 -1.26 -4.92 114.94 115.28 2yrz s ASN 69 Ca 0.14 -0.45 0.15 0.00 0.42 0.00 0.00 52.86 53.12 2yrz s ASN 69 Cb 0.06 -0.64 0.80 0.00 -1.45 0.00 0.00 41.25 40.02 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 5.03 0.29 -0.07 0.43 -0.04 -1.25 -2.30 135.00 137.09 2yrz n PRO 70 Ca -0.09 0.10 -0.05 0.00 -0.04 0.00 0.00 63.50 63.42 2yrz n PRO 70 Cb 0.49 -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 -1.20 1.79 -2.24 0.55 0.00 -1.26 -4.84 120.51 113.31 2yrz n ALA 71 Ca 0.08 -1.07 -0.40 0.00 0.00 0.00 0.00 53.44 52.05 2yrz n ALA 71 Cb 0.10 -0.40 -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 -2.73 2.91 -0.58 0.00 0.74 -0.98 -4.84 119.66 114.18 2yrz s GLN 72 Ca -0.09 0.34 0.00 0.00 0.05 0.00 0.00 55.36 55.67 2yrz s GLN 72 Cb 0.08 -4.28 0.51 0.00 1.10 0.00 0.00 33.01 30.42 2yrz s GLN 72 CO 0.84 -2.42 1.94 0.25 -0.55 0.00 0.00 175.29 175.35 2yrz n THR 73 N 6.91 3.42 -3.65 -0.34 -2.24 -1.26 -4.87 114.28 112.25 2yrz n THR 73 Ca 0.14 -2.73 -0.05 0.00 -2.27 0.00 0.00 64.05 59.14 2yrz n THR 73 Cb 0.51 -0.95 -0.07 0.00 -2.10 0.00 0.00 70.33 67.72 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 -1.82 -0.83 -0.04 3.42 1.04 -1.26 -1.85 113.70 112.36 2yrz s SER 74 Ca 0.61 1.36 0.04 0.00 0.48 0.00 0.00 55.95 58.44 2yrz s SER 74 Cb 0.49 1.75 0.00 0.00 0.10 0.00 0.00 66.02 68.37 2yrz s SER 74 CO 0.02 -0.22 -0.15 0.54 0.98 0.00 0.00 173.24 174.41 2yrz s VAL 75 N 2.45 1.26 -0.30 5.02 0.11 0.05 -4.98 120.40 124.01 2yrz s VAL 75 Ca -0.06 -0.62 -0.19 0.00 -2.93 0.00 0.00 61.98 58.18 2yrz s VAL 75 Cb -0.10 -1.10 -0.01 0.00 -1.53 0.00 0.00 36.38 33.63 2yrz s VAL 75 CO -0.17 0.37 0.57 -0.69 -3.33 0.00 0.00 175.10 171.85 2yrz s VAL 76 N 0.15 5.00 -0.11 2.04 1.01 -1.26 -0.53 120.40 126.71 2yrz s VAL 76 Ca -0.05 0.76 -0.12 0.00 0.00 0.00 0.00 61.98 62.57 2yrz s VAL 76 Cb -0.11 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.29 2yrz s VAL 76 CO 0.02 -0.08 0.27 -0.69 0.00 0.00 0.00 175.10 174.62 2yrz s VAL 77 N 2.46 5.30 0.35 2.92 1.01 0.34 -4.92 120.40 127.86 2yrz s VAL 77 Ca 0.22 0.51 0.07 0.00 0.00 0.00 0.00 61.98 62.78 2yrz s VAL 77 Cb -0.15 -3.57 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 2yrz s VAL 77 CO 0.11 0.52 0.26 -0.62 0.00 0.00 0.00 175.10 175.37 2yrz n GLU 78 N 2.59 0.44 -3.21 2.72 1.02 -1.26 0.90 120.64 123.84 2yrz n GLU 78 Ca -0.15 -3.42 -0.15 0.00 -0.02 0.00 0.00 57.16 53.42 2yrz n GLU 78 Cb 0.53 2.62 0.07 0.00 -0.02 0.00 0.00 31.44 34.64 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 -1.63 -2.80 -4.89 1.62 9.92 -1.11 -4.98 116.55 112.68 2yrz n ASP 79 Ca 0.05 -0.49 -0.24 0.00 -0.53 0.00 0.00 54.79 53.58 2yrz n ASP 79 Cb 0.62 -4.25 -0.01 0.00 -0.64 0.00 0.00 41.12 36.83 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 -5.68 2.96 -0.13 0.64 1.43 -1.25 -5.11 118.68 111.53 2yrz s LEU 80 Ca 0.10 -1.07 -0.06 0.00 -1.03 0.00 0.00 54.13 52.08 2yrz s LEU 80 Cb -0.05 -1.48 -0.04 0.00 0.03 0.00 0.00 46.19 44.66 2yrz s LEU 80 CO 0.59 -0.94 0.07 -0.76 0.23 0.00 0.00 176.35 175.54 2yrz s LEU 81 N -4.23 3.92 0.48 1.79 1.43 -1.26 -4.78 118.68 116.04 2yrz s LEU 81 Ca 0.40 0.22 -0.22 0.00 -1.03 0.00 0.00 54.13 53.51 2yrz s LEU 81 Cb -0.02 -1.95 -0.07 0.00 0.03 0.00 0.00 46.19 44.18 2yrz s LEU 81 CO 0.24 0.31 1.15 -2.16 0.23 0.00 0.00 176.35 176.13 2yrz s PRO 82 N -0.45 3.65 -1.43 1.29 0.04 -1.26 -3.49 135.00 133.35 2yrz s PRO 82 Ca 0.10 1.73 -0.07 0.00 0.04 0.00 0.00 61.00 62.80 2yrz s PRO 82 Cb -0.12 -2.30 0.04 0.00 0.04 0.00 0.00 34.50 32.16 2yrz s PRO 82 CO 0.02 -0.63 0.81 0.09 0.04 0.00 0.00 177.00 177.33 2yrz n ASN 83 N -0.70 -2.79 -3.73 6.66 5.03 -1.14 -4.98 115.26 113.62 2yrz n ASN 83 Ca 0.08 -0.82 -0.15 0.00 0.87 0.00 0.00 54.58 54.56 2yrz n ASN 83 Cb 0.49 -3.85 -0.15 0.00 -1.02 0.00 0.00 39.78 35.24 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 -3.52 -0.10 0.63 3.10 3.76 -1.23 -4.95 115.29 112.98 2yrz s HIS 84 Ca 0.32 0.40 -0.16 0.00 -0.15 0.00 0.00 55.06 55.48 2yrz s HIS 84 Cb -0.16 -0.18 -0.02 0.00 1.11 0.00 0.00 32.58 33.33 2yrz s HIS 84 CO 0.83 -0.17 1.10 -1.12 -0.85 0.00 0.00 174.74 174.53 2yrz s SER 85 N 1.42 5.35 -0.13 1.40 0.01 -1.26 -4.00 113.70 116.48 2yrz s SER 85 Ca -0.06 1.98 -0.05 0.00 1.31 0.00 0.00 55.95 59.13 2yrz s SER 85 Cb -0.12 -2.55 0.06 0.00 0.21 0.00 0.00 66.02 63.62 2yrz s SER 85 CO -0.05 -1.47 0.28 -0.31 0.41 0.00 0.00 173.24 172.10 2yrz s TYR 86 N -2.28 -0.44 -0.57 2.43 2.02 -0.74 -1.39 117.35 116.37 2yrz s TYR 86 Ca 0.67 0.98 -0.24 0.00 -0.37 0.00 0.00 57.07 58.11 2yrz s TYR 86 Cb -0.20 0.04 0.05 0.00 -0.40 0.00 0.00 41.96 41.45 2yrz s TYR 86 CO 0.38 -0.33 0.96 0.54 -1.57 0.00 0.00 175.55 175.54 2yrz s VAL 87 N 1.99 4.36 -0.23 0.71 0.11 -0.56 -1.52 120.40 125.25 2yrz s VAL 87 Ca -0.03 0.19 -0.17 0.00 -2.93 0.00 0.00 61.98 59.04 2yrz s VAL 87 Cb -0.11 -4.57 -0.03 0.00 -1.53 0.00 0.00 36.38 30.13 2yrz s VAL 87 CO -0.09 -1.19 0.48 -0.36 -3.33 0.00 0.00 175.10 170.61 2yrz s PHE 88 N 4.03 3.32 -0.30 1.54 0.40 -0.82 -3.27 117.98 122.88 2yrz s PHE 88 Ca 0.29 0.65 0.03 0.00 -0.60 0.00 0.00 56.93 57.31 2yrz s PHE 88 Cb -0.13 -2.65 0.08 0.00 0.51 0.00 0.00 43.02 40.83 2yrz s PHE 88 CO 0.18 -0.17 -0.00 1.03 0.70 0.00 0.00 175.22 176.96 2yrz s ARG 89 N 1.87 1.61 0.34 0.44 0.52 0.73 0.15 118.95 124.61 2yrz s ARG 89 Ca 0.21 -1.53 -0.01 0.00 -0.52 0.00 0.00 55.73 53.88 2yrz s ARG 89 Cb -0.15 -2.91 -0.04 0.00 0.52 0.00 0.00 34.95 32.37 2yrz s ARG 89 CO 0.09 -0.80 0.56 0.08 0.02 0.00 0.00 175.30 175.24 2yrz s VAL 90 N 1.10 5.09 0.22 3.52 1.01 -1.04 -2.19 120.40 128.11 2yrz s VAL 90 Ca 0.03 -0.36 -0.23 0.00 0.00 0.00 0.00 61.98 61.43 2yrz s VAL 90 Cb -0.19 -3.84 0.04 0.00 0.00 0.00 0.00 36.38 32.39 2yrz s VAL 90 CO -0.09 -0.53 0.85 0.00 0.00 0.00 0.00 175.10 175.33 2yrz s ARG 91 N -4.20 1.51 0.12 2.72 1.70 -0.64 -0.70 118.95 119.47 2yrz s ARG 91 Ca 0.41 -0.85 0.06 0.00 -0.47 0.00 0.00 55.73 54.88 2yrz s ARG 91 Cb -0.10 0.51 -0.04 0.00 -0.57 0.00 0.00 34.95 34.75 2yrz s ARG 91 CO 0.36 -0.69 -0.15 0.00 -1.08 0.00 0.00 175.30 173.74 2yrz s ALA 92 N -3.51 1.55 0.05 7.88 0.00 -1.26 -2.10 121.76 124.37 2yrz s ALA 92 Ca 0.12 -1.31 0.09 0.00 0.00 0.00 0.00 51.96 50.87 2yrz s ALA 92 Cb -0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 23.12 22.96 2yrz s ALA 92 CO 0.05 0.13 -0.25 -1.14 0.00 0.00 0.00 175.76 174.54 2yrz s GLN 93 N -2.64 1.69 0.17 0.00 0.74 -1.25 -2.90 119.66 115.48 2yrz s GLN 93 Ca 0.09 -1.09 -0.01 0.00 0.05 0.00 0.00 55.36 54.40 2yrz s GLN 93 Cb -0.05 -1.88 -0.04 0.00 1.10 0.00 0.00 33.01 32.14 2yrz s GLN 93 CO 0.03 0.48 0.08 -1.54 -0.55 0.00 0.00 175.29 173.80 2yrz s SER 94 N -1.28 0.41 0.27 6.67 1.04 -1.11 -2.59 113.70 117.11 2yrz s SER 94 Ca 0.11 -1.28 0.15 0.00 0.48 0.00 0.00 55.95 55.41 2yrz s SER 94 Cb -0.10 0.30 0.97 0.00 0.10 0.00 0.00 66.02 67.29 2yrz s SER 94 CO 0.02 -0.75 1.15 1.67 0.98 0.00 0.00 173.24 176.31 2yrz n GLN 95 N -0.20 -0.04 0.24 4.02 -0.06 -1.26 0.06 117.38 120.13 2yrz n GLN 95 Ca -0.02 1.01 -0.10 0.00 -2.00 0.00 0.00 57.00 55.89 2yrz n GLN 95 Cb 0.65 -1.81 -0.05 0.00 -4.06 0.00 0.00 30.24 24.97 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 -0.61 0.00 3.69 4.39 -1.93 -3.50 114.58 116.62 2yrz h GLU 96 Ca 0.61 0.04 0.00 0.00 0.34 0.00 0.00 59.36 60.36 2yrz h GLU 96 Cb 1.62 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 30.41 2yrz h GLU 96 CO -0.57 -0.41 0.00 0.41 -1.16 0.00 0.00 179.01 177.29 2yrz n GLY 97 N -0.22 -1.57 3.67 -3.84 0.00 0.11 -5.08 105.19 98.27 2yrz n GLY 97 Ca -0.08 -1.12 -0.43 0.00 0.00 0.00 0.00 46.02 44.39 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 -2.78 2.94 0.00 1.61 0.52 -1.26 -2.74 118.94 117.24 2yrz s TRP 98 Ca 0.00 1.03 0.00 0.00 0.02 0.00 0.00 56.10 57.15 2yrz s TRP 98 Cb 0.00 -3.51 0.00 0.00 -1.15 0.00 0.00 33.47 28.81 2yrz s TRP 98 CO 0.00 -1.73 0.00 0.41 0.02 0.00 0.00 176.95 175.65 2yrz n GLY 99 N 3.54 1.19 3.95 0.98 0.00 -1.14 -5.01 105.19 108.70 2yrz n GLY 99 Ca 0.13 -1.43 -0.26 0.00 0.00 0.00 0.00 46.02 44.47 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 1.55 1.70 0.33 1.61 1.81 -1.25 -4.92 118.95 119.78 2yrz s ARG 100 Ca 0.00 -0.61 0.03 0.00 -1.72 0.00 0.00 55.73 53.43 2yrz s ARG 100 Cb 0.00 -2.17 -0.06 0.00 -0.45 0.00 0.00 34.95 32.27 2yrz s ARG 100 CO 0.00 -1.53 0.07 -1.83 -0.68 0.00 0.00 175.30 171.33 2yrz s GLU 101 N -5.32 1.67 -0.17 3.54 4.04 -1.26 -4.30 118.70 116.90 2yrz s GLU 101 Ca 0.65 -1.94 0.01 0.00 0.04 0.00 0.00 54.97 53.73 2yrz s GLU 101 Cb -0.07 -0.76 0.02 0.00 0.02 0.00 0.00 34.13 33.34 2yrz s GLU 101 CO 0.46 -0.25 -0.16 0.50 -1.84 0.00 0.00 175.26 173.97 2yrz s ARG 102 N -3.88 2.56 0.17 -4.83 6.06 0.12 -4.69 118.95 114.46 2yrz s ARG 102 Ca 0.34 -0.73 -0.30 0.00 -2.50 0.00 0.00 55.73 52.54 2yrz s ARG 102 Cb 0.08 -2.36 -0.08 0.00 0.06 0.00 0.00 34.95 32.65 2yrz s ARG 102 CO 0.15 -0.26 1.15 -2.00 -2.50 0.00 0.00 175.30 171.84 2yrz s GLU 103 N 1.38 4.53 -0.41 5.12 2.12 -1.26 -2.49 118.70 127.70 2yrz s GLU 103 Ca 0.04 1.79 0.04 0.00 0.36 0.00 0.00 54.97 57.20 2yrz s GLU 103 Cb -0.14 -3.27 0.17 0.00 0.26 0.00 0.00 34.13 31.15 2yrz s GLU 103 CO -0.11 -0.03 0.43 0.20 -0.54 0.00 0.00 175.26 175.21 2yrz s GLY 104 N 0.11 0.10 0.47 -1.50 0.00 0.39 -4.86 107.32 102.04 2yrz s GLY 104 Ca 0.52 -1.31 -0.22 0.00 0.00 0.00 0.00 44.72 43.71 2yrz s GLY 104 CO 0.35 2.72 1.13 0.54 0.00 0.00 0.00 173.10 177.85 2yrz s VAL 105 N 0.94 3.27 0.03 1.40 0.11 -1.26 -1.95 120.40 122.93 2yrz s VAL 105 Ca 0.24 0.90 0.01 0.00 -2.93 0.00 0.00 61.98 60.20 2yrz s VAL 105 Cb -0.08 -3.43 -0.02 0.00 -1.53 0.00 0.00 36.38 31.32 2yrz s VAL 105 CO -0.07 -0.06 -0.05 -0.51 -3.33 0.00 0.00 175.10 171.08 2yrz s ILE 106 N -1.65 0.30 -0.20 7.04 1.10 -0.58 -4.93 121.20 122.29 2yrz s ILE 106 Ca 0.65 -0.87 0.01 0.00 -0.51 0.00 0.00 60.65 59.93 2yrz s ILE 106 Cb -0.26 -0.40 0.04 0.00 0.15 0.00 0.00 42.46 42.00 2yrz s ILE 106 CO 0.31 -0.38 -0.14 -0.89 -2.11 0.00 0.00 174.94 171.73 2yrz s THR 107 N -1.24 1.90 -0.46 4.00 2.01 -1.26 -1.79 115.64 118.80 2yrz s THR 107 Ca -0.11 -1.12 -0.28 0.00 0.31 0.00 0.00 61.69 60.49 2yrz s THR 107 Cb -0.09 -1.89 -0.01 0.00 0.01 0.00 0.00 72.50 70.52 2yrz s THR 107 CO -0.00 0.25 1.72 -0.63 -0.69 0.00 0.00 174.62 175.27 2yrz s ILE 108 N 1.30 3.54 -0.39 1.82 -1.09 -1.26 -4.96 121.20 120.16 2yrz s ILE 108 Ca -0.01 0.48 -0.05 0.00 -2.23 0.00 0.00 60.65 58.85 2yrz s ILE 108 Cb -0.16 -3.91 0.09 0.00 -1.58 0.00 0.00 42.46 36.90 2yrz s ILE 108 CO -0.09 -0.70 0.18 -1.61 -1.23 0.00 0.00 174.94 171.49 2yrz s GLU 109 N 5.97 2.31 -1.01 2.79 2.02 -1.26 -2.88 118.70 126.65 2yrz s GLU 109 Ca 0.70 -1.57 -0.14 0.00 0.02 0.00 0.00 54.97 53.98 2yrz s GLU 109 Cb -0.17 -3.56 0.19 0.00 0.10 0.00 0.00 34.13 30.69 2yrz s GLU 109 CO 0.29 -0.93 1.11 -1.54 0.02 0.00 0.00 175.26 174.20 2yrz s SER 110 N 1.80 6.91 -0.75 -0.19 1.04 -1.26 -4.93 113.70 116.31 2yrz s SER 110 Ca 0.03 -2.74 -0.04 0.00 0.48 0.00 0.00 55.95 53.68 2yrz s SER 110 Cb -0.22 -2.31 0.19 0.00 0.10 0.00 0.00 66.02 63.78 2yrz s SER 110 CO -0.01 -0.71 0.61 -1.10 0.98 0.00 0.00 173.24 173.01 2yrz s GLN 111 N 1.01 2.99 -1.66 4.02 -0.21 -1.26 -4.74 119.66 119.81 2yrz s GLN 111 Ca 0.31 -2.78 -0.16 0.00 0.02 0.00 0.00 55.36 52.75 2yrz s GLN 111 Cb -0.07 -3.93 0.14 0.00 1.00 0.00 0.00 33.01 30.15 2yrz s GLN 111 CO -0.07 -1.22 0.76 0.28 -2.12 0.00 0.00 175.29 172.92 2yrz n VAL 112 N 3.16 -1.33 -3.88 1.09 0.31 -1.26 -0.02 118.33 116.40 2yrz n VAL 112 Ca 0.13 -0.06 -0.31 0.00 -0.01 0.00 0.00 64.34 64.09 2yrz n VAL 112 Cb 0.39 -1.88 -0.02 0.00 -0.91 0.00 0.00 33.84 31.42 2yrz n VAL 112 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2yrz n SER 113 N -2.71 -3.24 -3.64 4.52 3.41 -1.26 -4.89 113.62 105.81 2yrz n SER 113 Ca 0.03 -0.75 -0.06 0.00 -0.26 0.00 0.00 58.87 57.83 2yrz n SER 113 Cb 0.52 -2.68 -0.07 0.00 -0.26 0.00 0.00 64.21 61.72 2yrz n SER 113 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2yrz s GLY 114 N -3.03 0.04 0.06 5.00 0.00 0.97 -5.01 107.32 105.35 2yrz s GLY 114 Ca 0.61 3.02 0.16 0.00 0.00 0.00 0.00 44.72 48.51 2yrz s GLY 114 CO 0.75 1.98 1.52 -1.55 0.00 0.00 0.00 173.10 175.79 2yrz n PRO 115 N 2.22 0.05 -3.65 2.90 -0.04 -1.26 -4.52 135.00 130.69 2yrz n PRO 115 Ca -0.13 0.30 -0.38 0.00 -0.04 0.00 0.00 63.50 63.25 2yrz n PRO 115 Cb 0.56 -1.59 -0.06 0.00 -0.04 0.00 0.00 33.50 32.37 2yrz n PRO 115 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2yrz s SER 116 N -3.30 6.64 0.02 3.54 0.15 -1.26 -5.01 113.70 114.48 2yrz s SER 116 Ca 0.06 0.76 -0.25 0.00 0.70 0.00 0.00 55.95 57.22 2yrz s SER 116 Cb 0.09 -2.18 -0.18 0.00 -1.71 0.00 0.00 66.02 62.05 2yrz s SER 116 CO 0.29 0.36 1.42 -1.28 1.20 0.00 0.00 173.24 175.22 2yrz h SER 117 N 4.79 -0.13 0.00 5.45 0.87 -1.94 -3.48 113.55 119.11 2yrz h SER 117 Ca -0.53 -0.23 0.00 0.00 -1.23 0.00 0.00 61.79 59.80 2yrz h SER 117 Cb 1.22 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 2yrz h SER 117 CO 0.60 0.16 0.00 0.61 -0.53 0.00 0.00 176.83 177.67