#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 -0.57 0.32 1.61 0.01 -1.26 -5.19 113.70 108.63 2yrz s SER 2 Ca 0.00 0.20 0.03 0.00 1.31 0.00 0.00 55.95 57.50 2yrz s SER 2 Cb 0.00 0.57 -0.04 0.00 0.21 0.00 0.00 66.02 66.76 2yrz s SER 2 CO 0.00 -0.84 0.14 -0.94 0.41 0.00 0.00 173.24 172.01 2yrz s SER 3 N -2.24 1.79 0.00 2.44 1.04 -1.26 -5.14 113.70 110.32 2yrz s SER 3 Ca -0.03 -1.55 0.00 0.00 0.48 0.00 0.00 55.95 54.85 2yrz s SER 3 Cb -0.01 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.47 2yrz s SER 3 CO -0.05 -0.86 0.00 0.61 0.98 0.00 0.00 173.24 173.91 2yrz n GLY 4 N -0.64 0.87 3.61 7.32 0.00 -1.26 -5.17 105.19 109.91 2yrz n GLY 4 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 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 0.96 -0.27 0.02 1.61 0.15 -1.26 -5.17 113.70 109.73 2yrz s SER 5 Ca 0.00 -0.52 -0.27 0.00 0.70 0.00 0.00 55.95 55.87 2yrz s SER 5 Cb 0.00 0.62 0.06 0.00 -1.71 0.00 0.00 66.02 64.99 2yrz s SER 5 CO 0.00 -1.13 0.61 -0.94 1.20 0.00 0.00 173.24 172.98 2yrz s SER 6 N -2.89 -0.57 0.00 5.45 1.04 -1.26 -4.96 113.70 110.51 2yrz s SER 6 Ca 0.10 0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.94 2yrz s SER 6 Cb -0.02 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.63 2yrz s SER 6 CO 0.00 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 174.13 2yrz n GLY 7 N 0.54 1.32 3.04 7.32 0.00 -1.26 -4.78 105.19 111.38 2yrz n GLY 7 Ca -0.19 -0.01 -0.32 0.00 0.00 0.00 0.00 46.02 45.51 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 0.00 4.42 -0.79 1.61 0.01 -1.26 -5.05 113.70 112.64 2yrz s SER 8 Ca 0.00 -1.48 -0.02 0.00 1.31 0.00 0.00 55.95 55.76 2yrz s SER 8 Cb 0.00 -1.51 0.20 0.00 0.21 0.00 0.00 66.02 64.92 2yrz s SER 8 CO 0.00 -0.22 0.64 -1.38 0.41 0.00 0.00 173.24 172.69 2yrz s HIS 9 N 1.11 3.69 -0.09 2.43 -3.43 -1.26 -4.98 115.29 112.76 2yrz s HIS 9 Ca -0.06 -2.89 -0.04 0.00 -0.80 0.00 0.00 55.06 51.28 2yrz s HIS 9 Cb -0.20 -3.23 0.05 0.00 -1.43 0.00 0.00 32.58 27.77 2yrz s HIS 9 CO -0.06 -0.78 0.18 -0.51 -2.00 0.00 0.00 174.74 171.57 2yrz s ASP 10 N 0.20 0.65 -0.12 7.38 1.01 -1.26 -5.01 116.67 119.52 2yrz s ASP 10 Ca 0.23 0.39 0.03 0.00 0.71 0.00 0.00 52.55 53.90 2yrz s ASP 10 Cb -0.12 0.36 0.25 0.00 1.01 0.00 0.00 42.92 44.41 2yrz s ASP 10 CO -0.09 -0.24 1.12 -0.24 0.21 0.00 0.00 175.17 175.93 2yrz n SER 11 N 5.30 2.94 -3.72 0.27 2.88 -1.26 -4.69 113.62 115.34 2yrz n SER 11 Ca -0.05 -2.43 -0.27 0.00 -1.33 0.00 0.00 58.87 54.78 2yrz n SER 11 Cb 0.50 -0.59 -0.17 0.00 -0.75 0.00 0.00 64.21 63.20 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 -1.33 0.56 0.14 -1.46 1.81 -1.26 -5.13 118.95 112.29 2yrz s ARG 12 Ca 0.19 -0.37 -0.10 0.00 -1.72 0.00 0.00 55.73 53.72 2yrz s ARG 12 Cb 0.15 -2.07 -0.00 0.00 -0.45 0.00 0.00 34.95 32.58 2yrz s ARG 12 CO 0.04 -0.65 0.28 -0.51 -0.68 0.00 0.00 175.30 173.79 2yrz s LEU 13 N 1.90 0.98 0.14 2.53 1.43 -1.26 -5.13 118.68 119.27 2yrz s LEU 13 Ca -0.01 -0.74 -0.26 0.00 -1.03 0.00 0.00 54.13 52.09 2yrz s LEU 13 Cb -0.17 1.27 -0.15 0.00 0.03 0.00 0.00 46.19 47.17 2yrz s LEU 13 CO -0.08 -0.86 0.53 0.41 0.23 0.00 0.00 176.35 176.58 2yrz n THR 14 N -0.18 1.40 0.43 5.49 -1.04 -1.26 -4.76 114.28 114.36 2yrz n THR 14 Ca -0.10 -0.35 -0.05 0.00 -2.04 0.00 0.00 64.05 61.51 2yrz n THR 14 Cb 0.63 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 69.17 2yrz n THR 14 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2yrz n ALA 15 N 0.23 3.25 -2.15 2.41 0.00 -1.26 -3.54 120.51 119.46 2yrz n ALA 15 Ca 0.16 -0.56 -0.05 0.00 0.00 0.00 0.00 53.44 52.99 2yrz n ALA 15 Cb 0.19 -1.09 -0.03 0.00 0.00 0.00 0.00 19.45 18.51 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 0.29 0.78 3.92 0.00 0.00 -1.26 -4.84 105.19 104.08 2yrz n GLY 16 Ca 0.11 -0.11 -0.29 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 -0.04 5.27 -0.02 1.61 -7.23 -1.23 -4.25 120.40 114.51 2yrz s VAL 17 Ca 0.05 -0.38 -0.30 0.00 -1.81 0.00 0.00 61.98 59.54 2yrz s VAL 17 Cb 0.10 -3.70 -0.05 0.00 0.56 0.00 0.00 36.38 33.29 2yrz s VAL 17 CO -0.03 -0.05 1.46 -2.16 -0.31 0.00 0.00 175.10 174.01 2yrz s PRO 18 N -3.02 4.25 0.72 4.82 0.04 -1.26 -4.65 135.00 135.90 2yrz s PRO 18 Ca 0.37 2.02 -0.14 0.00 0.04 0.00 0.00 61.00 63.29 2yrz s PRO 18 Cb -0.12 -3.67 0.04 0.00 0.04 0.00 0.00 34.50 30.79 2yrz s PRO 18 CO 0.28 -0.66 1.16 0.34 0.04 0.00 0.00 177.00 178.16 2yrz s ASP 19 N 2.22 4.43 -0.05 6.66 2.15 -0.58 -2.85 116.67 128.66 2yrz s ASP 19 Ca 0.66 2.18 -0.40 0.00 0.43 0.00 0.00 52.55 55.42 2yrz s ASP 19 Cb -0.32 -2.57 -0.19 0.00 -0.30 0.00 0.00 42.92 39.55 2yrz s ASP 19 CO 0.27 -2.09 1.26 0.41 -0.17 0.00 0.00 175.17 174.84 2yrz n THR 20 N -2.79 0.02 -2.26 1.71 -1.04 -1.26 -4.62 114.28 104.03 2yrz n THR 20 Ca 0.12 -0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.76 2yrz n THR 20 Cb 0.51 -0.39 -0.00 0.00 -1.82 0.00 0.00 70.33 68.63 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 0.72 3.59 1.06 -2.82 0.04 -1.26 -4.90 135.00 131.42 2yrz s PRO 21 Ca 0.91 1.70 -0.13 0.00 0.04 0.00 0.00 61.00 63.53 2yrz s PRO 21 Cb -1.18 -2.24 0.22 0.00 0.04 0.00 0.00 34.50 31.34 2yrz s PRO 21 CO 0.57 -0.68 1.07 0.99 0.04 0.00 0.00 177.00 179.00 2yrz s THR 22 N -1.64 2.04 1.00 1.26 2.01 -1.26 -4.43 115.64 114.62 2yrz s THR 22 Ca 0.67 0.01 -0.20 0.00 0.31 0.00 0.00 61.69 62.49 2yrz s THR 22 Cb -0.27 -2.37 -0.13 0.00 0.01 0.00 0.00 72.50 69.74 2yrz s THR 22 CO 0.31 -0.02 -0.89 0.54 -0.69 0.00 0.00 174.62 173.87 2yrz n ARG 23 N -4.43 -0.12 -4.33 4.92 1.74 -1.26 -4.49 116.66 108.70 2yrz n ARG 23 Ca 0.04 -0.03 -0.32 0.00 -0.77 0.00 0.00 57.85 56.77 2yrz n ARG 23 Cb 0.56 -1.12 -0.09 0.00 -1.02 0.00 0.00 32.46 30.79 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 6.64 3.38 -0.28 0.55 1.43 -1.26 -4.44 118.68 124.70 2yrz s LEU 24 Ca 0.41 -0.08 -0.08 0.00 -1.03 0.00 0.00 54.13 53.35 2yrz s LEU 24 Cb -0.09 -1.96 -0.01 0.00 0.03 0.00 0.00 46.19 44.16 2yrz s LEU 24 CO 0.75 0.27 0.10 -0.69 0.23 0.00 0.00 176.35 177.02 2yrz s VAL 25 N -1.08 4.35 -0.15 -1.59 1.01 0.77 -4.87 120.40 118.84 2yrz s VAL 25 Ca 0.19 -0.37 -0.08 0.00 0.00 0.00 0.00 61.98 61.72 2yrz s VAL 25 Cb -0.11 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 2yrz s VAL 25 CO 0.10 0.18 0.11 -0.36 0.00 0.00 0.00 175.10 175.13 2yrz s PHE 26 N 1.59 3.45 -0.26 5.22 0.40 -1.24 -1.32 117.98 125.82 2yrz s PHE 26 Ca 0.05 0.37 -0.00 0.00 -0.60 0.00 0.00 56.93 56.75 2yrz s PHE 26 Cb -0.16 -2.02 -0.17 0.00 0.51 0.00 0.00 43.02 41.19 2yrz s PHE 26 CO 0.04 0.49 -0.24 0.45 0.70 0.00 0.00 175.22 176.67 2yrz n SER 27 N 2.71 1.98 -3.02 1.36 2.88 -0.79 -4.90 113.62 113.84 2yrz n SER 27 Ca -0.18 -0.07 -0.14 0.00 -1.33 0.00 0.00 58.87 57.15 2yrz n SER 27 Cb 0.54 -0.47 0.07 0.00 -0.75 0.00 0.00 64.21 63.59 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 -3.38 -1.88 -0.49 -1.46 0.00 -1.26 -4.83 120.51 107.22 2yrz n ALA 28 Ca -0.47 0.01 0.43 0.00 0.00 0.00 0.00 53.44 53.41 2yrz n ALA 28 Cb 0.98 -3.18 0.74 0.00 0.00 0.00 0.00 19.45 17.98 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 -1.34 0.00 0.00 0.00 -0.00 -1.84 -3.44 115.31 108.69 2yrz h LEU 29 Ca -0.50 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.38 2yrz h LEU 29 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.94 2yrz h LEU 29 CO 0.40 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.45 2yrz n GLY 30 N -1.83 1.56 0.19 0.83 0.00 -1.14 -4.94 105.19 99.85 2yrz n GLY 30 Ca 0.34 -0.86 0.04 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 -1.94 -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 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2yrz h PRO 31 CO 0.00 0.39 -0.01 0.25 -0.23 0.00 0.00 178.00 178.40 2yrz n THR 32 N -3.79 1.72 -4.06 1.56 -2.24 -1.26 -4.17 114.28 102.04 2yrz n THR 32 Ca -0.01 -2.04 -0.13 0.00 -2.27 0.00 0.00 64.05 59.60 2yrz n THR 32 Cb 0.46 -0.12 -0.11 0.00 -2.10 0.00 0.00 70.33 68.46 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 -2.58 0.81 0.16 3.42 1.04 -1.18 -1.84 113.70 113.52 2yrz s SER 33 Ca 0.27 -0.56 -0.18 0.00 0.48 0.00 0.00 55.95 55.95 2yrz s SER 33 Cb 0.24 0.04 0.04 0.00 0.10 0.00 0.00 66.02 66.44 2yrz s SER 33 CO 0.03 -0.22 0.49 -0.76 0.98 0.00 0.00 173.24 173.76 2yrz s LEU 34 N -1.62 0.04 -0.28 2.42 1.43 0.18 -2.89 118.68 117.96 2yrz s LEU 34 Ca -0.10 -0.29 -0.03 0.00 -1.03 0.00 0.00 54.13 52.68 2yrz s LEU 34 Cb -0.09 2.14 0.09 0.00 0.03 0.00 0.00 46.19 48.36 2yrz s LEU 34 CO 0.00 -0.95 0.11 -0.60 0.23 0.00 0.00 176.35 175.14 2yrz s ARG 35 N -3.81 0.40 -0.06 1.70 3.52 -1.26 0.38 118.95 119.82 2yrz s ARG 35 Ca 0.04 -0.68 -0.17 0.00 -0.13 0.00 0.00 55.73 54.80 2yrz s ARG 35 Cb 0.00 -1.57 -0.05 0.00 -1.56 0.00 0.00 34.95 31.77 2yrz s ARG 35 CO -0.09 -0.95 0.45 0.08 -0.81 0.00 0.00 175.30 173.97 2yrz s VAL 36 N 1.92 5.09 -0.02 7.11 1.01 0.40 -1.89 120.40 134.02 2yrz s VAL 36 Ca 0.08 0.92 0.00 0.00 0.00 0.00 0.00 61.98 62.98 2yrz s VAL 36 Cb -0.17 -3.78 0.02 0.00 0.00 0.00 0.00 36.38 32.46 2yrz s VAL 36 CO -0.29 0.45 0.00 -0.55 0.00 0.00 0.00 175.10 174.71 2yrz s SER 37 N -0.19 0.30 0.28 3.32 0.15 -0.43 -0.07 113.70 117.07 2yrz s SER 37 Ca 0.25 -0.01 0.01 0.00 0.70 0.00 0.00 55.95 56.90 2yrz s SER 37 Cb -0.16 -0.16 0.01 0.00 -1.71 0.00 0.00 66.02 64.00 2yrz s SER 37 CO 0.12 -0.09 0.12 -2.67 1.20 0.00 0.00 173.24 171.92 2yrz n TRP 38 N 4.00 -0.27 -4.05 3.44 2.14 0.25 -0.16 117.44 122.78 2yrz n TRP 38 Ca -0.25 -1.27 -0.33 0.00 2.07 0.00 0.00 57.50 57.71 2yrz n TRP 38 Cb 0.51 -0.21 -0.15 0.00 -0.81 0.00 0.00 31.31 30.65 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 -3.09 2.66 -0.85 -2.67 0.74 -1.26 -4.82 119.66 110.37 2yrz s GLN 39 Ca 0.09 -1.07 -0.34 0.00 0.05 0.00 0.00 55.36 54.09 2yrz s GLN 39 Cb -0.01 -2.82 -0.21 0.00 1.10 0.00 0.00 33.01 31.08 2yrz s GLN 39 CO 0.06 -0.40 2.54 -1.91 -0.55 0.00 0.00 175.29 175.03 2yrz n GLU 40 N 4.57 0.04 -1.15 1.67 2.13 -1.26 -4.18 120.64 122.45 2yrz n GLU 40 Ca -0.17 0.00 -0.29 0.00 0.66 0.00 0.00 57.16 57.37 2yrz n GLU 40 Cb 0.46 -1.56 0.19 0.00 0.27 0.00 0.00 31.44 30.80 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 8.18 0.20 0.42 5.31 0.04 -1.26 -5.01 135.00 142.88 2yrz s PRO 41 Ca 1.31 0.45 -0.23 0.00 0.04 0.00 0.00 61.00 62.57 2yrz s PRO 41 Cb -1.29 -1.72 -0.09 0.00 0.04 0.00 0.00 34.50 31.44 2yrz s PRO 41 CO 0.53 -2.87 1.01 -0.98 0.04 0.00 0.00 177.00 174.72 2yrz s ARG 42 N -4.99 4.15 -0.30 4.56 1.70 -1.26 -4.84 118.95 117.97 2yrz s ARG 42 Ca 0.66 1.35 -0.10 0.00 -0.47 0.00 0.00 55.73 57.17 2yrz s ARG 42 Cb -0.18 -2.37 0.18 0.00 -0.57 0.00 0.00 34.95 32.00 2yrz s ARG 42 CO 0.58 -0.13 0.88 0.00 -1.08 0.00 0.00 175.30 175.55 2yrz h GLU 44 N 7.92 0.00 -6.39 0.00 4.57 -1.83 -3.38 114.58 115.47 2yrz h GLU 44 Ca -0.17 0.00 -0.62 0.00 -1.18 0.00 0.00 59.36 57.39 2yrz h GLU 44 Cb 1.16 0.00 -0.12 0.00 -0.16 0.00 0.00 28.75 29.62 2yrz h GLU 44 CO 0.05 0.00 -0.68 1.03 -1.18 0.00 0.00 179.01 178.23 2yrz s ARG 45 N -4.77 2.33 -0.01 1.92 1.81 -1.26 -5.09 118.95 113.89 2yrz s ARG 45 Ca -0.04 -1.08 -0.30 0.00 -1.72 0.00 0.00 55.73 52.58 2yrz s ARG 45 Cb 0.23 -2.34 -0.06 0.00 -0.45 0.00 0.00 34.95 32.33 2yrz s ARG 45 CO 0.77 0.47 1.45 -1.25 -0.68 0.00 0.00 175.30 176.06 2yrz s PRO 46 N -2.74 4.26 0.53 3.54 0.04 -1.26 -4.88 135.00 134.49 2yrz s PRO 46 Ca 0.26 2.02 -0.22 0.00 0.04 0.00 0.00 61.00 63.10 2yrz s PRO 46 Cb -0.10 -3.63 -0.05 0.00 0.04 0.00 0.00 34.50 30.76 2yrz s PRO 46 CO 0.17 -0.63 1.34 -0.51 0.04 0.00 0.00 177.00 177.41 2yrz s LEU 47 N 2.66 3.87 -0.05 -3.56 1.43 -1.26 -4.15 118.68 117.62 2yrz s LEU 47 Ca 0.66 2.71 0.18 0.00 -1.03 0.00 0.00 54.13 56.65 2yrz s LEU 47 Cb -0.32 -4.27 -0.22 0.00 0.03 0.00 0.00 46.19 41.41 2yrz s LEU 47 CO 0.27 -1.49 0.48 0.00 0.23 0.00 0.00 176.35 175.84 2yrz n GLN 48 N -0.95 0.65 0.00 1.70 6.02 -0.92 -4.65 117.38 119.24 2yrz n GLN 48 Ca 0.10 0.05 0.00 0.00 -0.01 0.00 0.00 57.00 57.13 2yrz n GLN 48 Cb 0.45 -1.64 0.00 0.00 1.02 0.00 0.00 30.24 30.07 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 1.49 1.51 3.74 1.08 0.00 -1.25 -3.25 105.19 108.51 2yrz n GLY 49 Ca -0.17 -0.10 -0.08 0.00 0.00 0.00 0.00 46.02 45.67 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 0.05 -0.08 0.00 1.61 2.02 -1.11 -3.93 117.35 115.91 2yrz s TYR 50 Ca 0.00 -0.33 0.00 0.00 -0.37 0.00 0.00 57.07 56.37 2yrz s TYR 50 Cb 0.00 0.55 -0.00 0.00 -0.40 0.00 0.00 41.96 42.11 2yrz s TYR 50 CO 0.00 -1.13 -0.00 0.45 -1.57 0.00 0.00 175.55 173.30 2yrz s SER 51 N -2.93 0.03 -0.29 2.29 0.15 0.56 -0.45 113.70 113.07 2yrz s SER 51 Ca 0.13 -0.01 -0.02 0.00 0.70 0.00 0.00 55.95 56.75 2yrz s SER 51 Cb -0.04 -0.00 0.09 0.00 -1.71 0.00 0.00 66.02 64.36 2yrz s SER 51 CO 0.05 -0.00 0.09 -0.69 1.20 0.00 0.00 173.24 173.89 2yrz s VAL 52 N -0.03 0.61 -0.12 4.45 1.01 0.92 -0.29 120.40 126.94 2yrz s VAL 52 Ca -0.00 -1.12 -0.12 0.00 0.00 0.00 0.00 61.98 60.74 2yrz s VAL 52 Cb -0.00 -1.41 -0.05 0.00 0.00 0.00 0.00 36.38 34.92 2yrz s VAL 52 CO -0.00 -0.61 0.27 -1.61 0.00 0.00 0.00 175.10 173.15 2yrz s GLU 53 N 1.77 4.01 -0.02 2.72 2.02 -0.80 -1.20 118.70 127.21 2yrz s GLU 53 Ca 0.08 0.09 -0.04 0.00 0.02 0.00 0.00 54.97 55.11 2yrz s GLU 53 Cb -0.17 -3.34 0.00 0.00 0.10 0.00 0.00 34.13 30.73 2yrz s GLU 53 CO -0.25 0.45 0.10 1.52 0.02 0.00 0.00 175.26 177.09 2yrz s TYR 54 N -0.16 -0.01 0.13 1.61 -0.85 -0.72 0.31 117.35 117.66 2yrz s TYR 54 Ca 0.17 0.02 -0.26 0.00 -0.52 0.00 0.00 57.07 56.49 2yrz s TYR 54 Cb -0.13 -0.02 0.07 0.00 0.38 0.00 0.00 41.96 42.25 2yrz s TYR 54 CO 0.05 -0.16 0.96 1.14 -1.52 0.00 0.00 175.55 176.02 2yrz s GLN 55 N -0.67 1.12 -0.18 -3.49 -2.07 -1.20 -0.86 119.66 112.32 2yrz s GLN 55 Ca -0.07 -0.60 -0.29 0.00 -1.82 0.00 0.00 55.36 52.58 2yrz s GLN 55 Cb -0.05 0.40 -0.04 0.00 -1.09 0.00 0.00 33.01 32.23 2yrz s GLN 55 CO 0.00 -0.51 1.74 -0.51 -1.32 0.00 0.00 175.29 174.69 2yrz s LEU 56 N -2.88 3.93 0.16 2.60 1.43 -1.26 -0.82 118.68 121.85 2yrz s LEU 56 Ca 0.11 1.83 -0.27 0.00 -1.03 0.00 0.00 54.13 54.77 2yrz s LEU 56 Cb -0.01 -3.53 -0.01 0.00 0.03 0.00 0.00 46.19 42.67 2yrz s LEU 56 CO 0.00 -1.30 1.44 -0.11 0.23 0.00 0.00 176.35 176.61 2yrz n LEU 57 N 8.65 -0.92 -0.26 1.79 7.94 -0.45 0.59 117.00 134.35 2yrz n LEU 57 Ca 0.20 1.65 0.06 0.00 -1.11 0.00 0.00 56.01 56.81 2yrz n LEU 57 Cb 0.45 -0.24 0.18 0.00 0.53 0.00 0.00 43.42 44.33 2yrz n LEU 57 CO 0.65 -1.37 0.88 -0.55 -1.11 0.00 0.00 177.39 175.89 2yrz h ASN 58 N 0.00 -0.17 0.00 1.96 7.08 -1.90 -3.45 115.58 119.09 2yrz h ASN 58 Ca 0.18 0.18 0.00 0.00 -3.08 0.00 0.00 56.30 53.58 2yrz h ASN 58 Cb 0.41 0.28 0.00 0.00 -2.08 0.00 0.00 38.32 36.93 2yrz h ASN 58 CO -0.88 -0.13 0.00 0.61 -2.08 0.00 0.00 177.43 174.95 2yrz n GLY 59 N -1.39 0.71 0.00 9.14 0.00 0.20 -5.18 105.19 108.67 2yrz n GLY 59 Ca 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 2.74 3.70 -0.02 0.00 -1.17 -4.96 105.19 105.49 2yrz n GLY 60 Ca 0.00 -0.18 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 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 3.78 4.23 -0.15 1.61 2.12 -1.26 -4.83 118.70 124.20 2yrz s GLU 61 Ca 0.00 0.15 -0.17 0.00 0.36 0.00 0.00 54.97 55.31 2yrz s GLU 61 Cb 0.00 -3.47 -0.04 0.00 0.26 0.00 0.00 34.13 30.88 2yrz s GLU 61 CO 0.00 0.12 0.42 -1.17 -0.54 0.00 0.00 175.26 174.09 2yrz s LEU 62 N 0.82 4.23 -0.19 2.70 1.98 -1.26 -4.15 118.68 122.81 2yrz s LEU 62 Ca 0.18 0.67 0.01 0.00 -2.89 0.00 0.00 54.13 52.09 2yrz s LEU 62 Cb -0.14 -2.58 0.02 0.00 0.66 0.00 0.00 46.19 44.15 2yrz s LEU 62 CO 0.06 -0.01 -0.18 -1.00 -1.89 0.00 0.00 176.35 173.33 2yrz s HIS 63 N 0.82 2.83 -0.26 5.38 3.76 -0.04 -4.99 115.29 122.78 2yrz s HIS 63 Ca 0.22 -1.66 -0.11 0.00 -0.15 0.00 0.00 55.06 53.36 2yrz s HIS 63 Cb -0.15 -1.93 -0.05 0.00 1.11 0.00 0.00 32.58 31.56 2yrz s HIS 63 CO 0.08 -0.80 0.19 0.50 -0.85 0.00 0.00 174.74 173.86 2yrz s ARG 64 N 1.29 4.01 -0.14 1.40 3.52 -1.26 -1.75 118.95 126.01 2yrz s ARG 64 Ca 0.04 -0.27 -0.04 0.00 -0.13 0.00 0.00 55.73 55.33 2yrz s ARG 64 Cb -0.14 -3.60 -0.03 0.00 -1.56 0.00 0.00 34.95 29.62 2yrz s ARG 64 CO -0.12 -0.07 -0.02 -0.51 -0.81 0.00 0.00 175.30 173.77 2yrz s LEU 65 N 1.44 3.37 0.00 -0.88 1.43 -0.34 -4.96 118.68 118.74 2yrz s LEU 65 Ca 0.08 -0.06 0.03 0.00 -1.03 0.00 0.00 54.13 53.15 2yrz s LEU 65 Cb -0.15 -1.81 -0.03 0.00 0.03 0.00 0.00 46.19 44.23 2yrz s LEU 65 CO 0.08 0.21 -0.05 0.20 0.23 0.00 0.00 176.35 177.01 2yrz s ASN 66 N 0.13 4.72 -0.31 2.29 0.01 -1.26 -0.05 114.94 120.46 2yrz s ASN 66 Ca 0.00 -0.12 -0.04 0.00 -0.71 0.00 0.00 52.86 52.00 2yrz s ASN 66 Cb -0.13 -1.13 0.04 0.00 0.41 0.00 0.00 41.25 40.44 2yrz s ASN 66 CO 0.02 0.28 0.04 -0.63 -1.51 0.00 0.00 177.10 175.30 2yrz s ILE 67 N -1.01 3.30 -2.00 0.60 -1.09 0.41 -4.96 121.20 116.44 2yrz s ILE 67 Ca 0.18 -1.25 0.09 0.00 -2.23 0.00 0.00 60.65 57.43 2yrz s ILE 67 Cb -0.11 -2.86 0.24 0.00 -1.58 0.00 0.00 42.46 38.15 2yrz s ILE 67 CO 0.08 -0.11 0.96 -0.81 -1.23 0.00 0.00 174.94 173.83 2yrz n PRO 68 N 4.70 0.49 -3.83 2.79 -0.04 -1.26 -2.76 135.00 135.09 2yrz n PRO 68 Ca -0.13 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.06 2yrz n PRO 68 Cb 0.44 -1.27 -0.17 0.00 -0.04 0.00 0.00 33.50 32.46 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 -1.78 2.46 0.00 3.54 2.47 -1.26 -4.90 114.94 115.46 2yrz s ASN 69 Ca 0.13 -0.51 0.15 0.00 0.42 0.00 0.00 52.86 53.05 2yrz s ASN 69 Cb 0.06 -0.72 0.69 0.00 -1.45 0.00 0.00 41.25 39.82 2yrz s ASN 69 CO 0.10 -0.20 1.43 -0.81 -3.72 0.00 0.00 177.10 173.89 2yrz n PRO 70 N 4.99 0.12 -0.04 0.43 -0.04 -1.20 -2.38 135.00 136.88 2yrz n PRO 70 Ca -0.10 0.19 -0.07 0.00 -0.04 0.00 0.00 63.50 63.48 2yrz n PRO 70 Cb 0.48 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.31 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 -1.37 1.58 -2.30 0.55 0.00 -1.26 -4.78 120.51 112.92 2yrz n ALA 71 Ca 0.06 -0.89 -0.39 0.00 0.00 0.00 0.00 53.44 52.21 2yrz n ALA 71 Cb 0.14 -0.68 -0.03 0.00 0.00 0.00 0.00 19.45 18.88 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 -2.63 2.92 -0.46 0.00 0.74 -1.00 -4.84 119.66 114.40 2yrz s GLN 72 Ca -0.06 0.12 0.02 0.00 0.05 0.00 0.00 55.36 55.50 2yrz s GLN 72 Cb 0.08 -4.33 0.55 0.00 1.10 0.00 0.00 33.01 30.41 2yrz s GLN 72 CO 0.83 -2.45 1.88 0.25 -0.55 0.00 0.00 175.29 175.25 2yrz n THR 73 N 6.81 3.12 -3.66 -0.34 -2.24 -1.26 -4.87 114.28 111.85 2yrz n THR 73 Ca 0.13 -1.98 -0.11 0.00 -2.27 0.00 0.00 64.05 59.82 2yrz n THR 73 Cb 0.50 -0.70 -0.08 0.00 -2.10 0.00 0.00 70.33 67.96 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 -1.18 -0.75 0.03 3.42 1.04 -1.26 -0.59 113.70 114.42 2yrz s SER 74 Ca 0.53 1.32 0.01 0.00 0.48 0.00 0.00 55.95 58.29 2yrz s SER 74 Cb 0.44 1.26 -0.02 0.00 0.10 0.00 0.00 66.02 67.80 2yrz s SER 74 CO 0.07 -0.22 -0.05 0.54 0.98 0.00 0.00 173.24 174.56 2yrz s VAL 75 N 0.99 0.26 -0.20 5.02 0.11 0.90 -4.98 120.40 122.50 2yrz s VAL 75 Ca -0.05 -1.05 -0.10 0.00 -2.93 0.00 0.00 61.98 57.84 2yrz s VAL 75 Cb -0.05 -0.49 -0.05 0.00 -1.53 0.00 0.00 36.38 34.26 2yrz s VAL 75 CO -0.09 -0.51 0.14 -0.69 -3.33 0.00 0.00 175.10 170.62 2yrz s VAL 76 N -1.67 5.40 -0.21 2.04 1.01 -1.26 -0.45 120.40 125.26 2yrz s VAL 76 Ca -0.12 0.21 -0.03 0.00 0.00 0.00 0.00 61.98 62.04 2yrz s VAL 76 Cb -0.08 -3.48 -0.01 0.00 0.00 0.00 0.00 36.38 32.80 2yrz s VAL 76 CO -0.01 0.42 -0.05 -0.69 0.00 0.00 0.00 175.10 174.76 2yrz s VAL 77 N 0.49 3.35 0.23 2.92 1.01 0.16 -4.93 120.40 123.62 2yrz s VAL 77 Ca 0.08 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.56 2yrz s VAL 77 Cb -0.12 -2.51 -0.00 0.00 0.00 0.00 0.00 36.38 33.76 2yrz s VAL 77 CO -0.01 0.44 0.03 -0.62 0.00 0.00 0.00 175.10 174.95 2yrz n GLU 78 N 4.59 1.11 -3.28 2.72 1.02 -1.26 0.51 120.64 126.05 2yrz n GLU 78 Ca -0.18 -1.80 -0.17 0.00 -0.02 0.00 0.00 57.16 54.99 2yrz n GLU 78 Cb 0.51 0.69 0.07 0.00 -0.02 0.00 0.00 31.44 32.69 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 -1.44 -4.10 -4.88 1.62 9.92 -0.77 -4.95 116.55 111.96 2yrz n ASP 79 Ca -0.07 -0.46 -0.25 0.00 -0.53 0.00 0.00 54.79 53.49 2yrz n ASP 79 Cb 0.32 -4.14 -0.02 0.00 -0.64 0.00 0.00 41.12 36.63 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 -5.80 2.92 -0.12 0.64 1.43 -1.24 -5.10 118.68 111.40 2yrz s LEU 80 Ca 0.28 -1.10 -0.07 0.00 -1.03 0.00 0.00 54.13 52.20 2yrz s LEU 80 Cb -0.12 -1.43 -0.04 0.00 0.03 0.00 0.00 46.19 44.63 2yrz s LEU 80 CO 0.58 -0.94 0.15 -0.76 0.23 0.00 0.00 176.35 175.61 2yrz s LEU 81 N -4.21 4.38 0.37 1.79 1.43 -1.26 -4.67 118.68 116.51 2yrz s LEU 81 Ca 0.39 0.46 -0.27 0.00 -1.03 0.00 0.00 54.13 53.69 2yrz s LEU 81 Cb -0.02 -2.08 -0.09 0.00 0.03 0.00 0.00 46.19 44.03 2yrz s LEU 81 CO 0.23 0.39 1.20 -2.16 0.23 0.00 0.00 176.35 176.25 2yrz s PRO 82 N -0.92 4.18 -1.37 1.29 0.04 -1.26 -3.46 135.00 133.50 2yrz s PRO 82 Ca 0.15 1.95 -0.04 0.00 0.04 0.00 0.00 61.00 63.10 2yrz s PRO 82 Cb -0.12 -2.84 0.02 0.00 0.04 0.00 0.00 34.50 31.61 2yrz s PRO 82 CO 0.04 -0.24 0.75 0.09 0.04 0.00 0.00 177.00 177.68 2yrz n ASN 83 N 0.38 -2.01 -3.83 6.66 5.03 -1.13 -4.99 115.26 115.37 2yrz n ASN 83 Ca 0.03 -0.82 -0.16 0.00 0.87 0.00 0.00 54.58 54.49 2yrz n ASN 83 Cb 0.45 -3.93 -0.16 0.00 -1.02 0.00 0.00 39.78 35.12 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 -3.60 0.29 0.04 3.10 3.76 -1.22 -4.90 115.29 112.76 2yrz s HIS 84 Ca 0.17 -0.00 -0.30 0.00 -0.15 0.00 0.00 55.06 54.78 2yrz s HIS 84 Cb -0.09 -0.36 -0.05 0.00 1.11 0.00 0.00 32.58 33.19 2yrz s HIS 84 CO 0.82 -0.11 1.09 -1.12 -0.85 0.00 0.00 174.74 174.57 2yrz s SER 85 N 0.86 7.23 -0.12 1.40 0.01 -1.26 -3.67 113.70 118.16 2yrz s SER 85 Ca -0.09 1.86 0.00 0.00 1.31 0.00 0.00 55.95 59.04 2yrz s SER 85 Cb -0.12 -2.58 0.02 0.00 0.21 0.00 0.00 66.02 63.55 2yrz s SER 85 CO -0.02 -0.35 -0.12 -0.31 0.41 0.00 0.00 173.24 172.85 2yrz s TYR 86 N 0.92 1.87 -0.60 2.43 2.02 -0.70 -1.34 117.35 121.94 2yrz s TYR 86 Ca 0.55 -0.96 -0.28 0.00 -0.37 0.00 0.00 57.07 56.01 2yrz s TYR 86 Cb -0.26 -1.41 0.02 0.00 -0.40 0.00 0.00 41.96 39.91 2yrz s TYR 86 CO 0.29 -0.56 1.32 0.54 -1.57 0.00 0.00 175.55 175.58 2yrz s VAL 87 N 1.40 3.85 -0.50 0.71 0.11 0.00 -2.26 120.40 123.71 2yrz s VAL 87 Ca 0.01 0.70 -0.19 0.00 -2.93 0.00 0.00 61.98 59.58 2yrz s VAL 87 Cb -0.13 -4.61 0.06 0.00 -1.53 0.00 0.00 36.38 30.16 2yrz s VAL 87 CO -0.07 -1.34 0.59 -0.36 -3.33 0.00 0.00 175.10 170.59 2yrz s PHE 88 N 5.67 3.08 -0.45 1.54 0.40 0.42 -3.20 117.98 125.44 2yrz s PHE 88 Ca 0.46 -0.57 -0.10 0.00 -0.60 0.00 0.00 56.93 56.13 2yrz s PHE 88 Cb -0.09 -3.47 0.10 0.00 0.51 0.00 0.00 43.02 40.07 2yrz s PHE 88 CO 0.23 -0.99 0.32 1.03 0.70 0.00 0.00 175.22 176.51 2yrz s ARG 89 N 2.50 2.56 0.22 0.44 0.52 0.15 -0.75 118.95 124.58 2yrz s ARG 89 Ca 0.14 -1.62 -0.22 0.00 -0.52 0.00 0.00 55.73 53.51 2yrz s ARG 89 Cb -0.20 -3.89 -0.08 0.00 0.52 0.00 0.00 34.95 31.30 2yrz s ARG 89 CO 0.11 -1.09 0.76 0.08 0.02 0.00 0.00 175.30 175.18 2yrz s VAL 90 N 1.41 4.47 0.06 3.52 1.01 -0.68 -1.90 120.40 128.30 2yrz s VAL 90 Ca 0.04 1.46 -0.03 0.00 0.00 0.00 0.00 61.98 63.46 2yrz s VAL 90 Cb -0.25 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 2yrz s VAL 90 CO 0.01 0.29 0.03 -0.60 0.00 0.00 0.00 175.10 174.83 2yrz s ARG 91 N -1.74 0.68 0.27 2.72 3.52 0.60 -0.58 118.95 124.42 2yrz s ARG 91 Ca 0.42 -1.16 0.12 0.00 -0.13 0.00 0.00 55.73 54.97 2yrz s ARG 91 Cb -0.19 0.25 -0.05 0.00 -1.56 0.00 0.00 34.95 33.40 2yrz s ARG 91 CO 0.23 -0.16 -0.19 0.00 -0.81 0.00 0.00 175.30 174.37 2yrz s ALA 92 N -3.91 2.76 0.03 6.12 0.00 -1.25 -0.32 121.76 125.19 2yrz s ALA 92 Ca 0.07 -1.85 0.03 0.00 0.00 0.00 0.00 51.96 50.21 2yrz s ALA 92 Cb 0.07 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 2yrz s ALA 92 CO -0.10 0.29 -0.09 -1.14 0.00 0.00 0.00 175.76 174.73 2yrz s GLN 93 N -3.46 0.60 0.18 0.00 0.74 -1.25 -2.73 119.66 113.74 2yrz s GLN 93 Ca 0.29 -0.64 -0.08 0.00 0.05 0.00 0.00 55.36 54.98 2yrz s GLN 93 Cb -0.05 -0.47 -0.01 0.00 1.10 0.00 0.00 33.01 33.57 2yrz s GLN 93 CO 0.15 0.11 0.28 -1.54 -0.55 0.00 0.00 175.29 173.73 2yrz s SER 94 N -1.19 0.05 0.31 6.67 1.04 -1.19 -2.16 113.70 117.24 2yrz s SER 94 Ca -0.05 -0.98 0.09 0.00 0.48 0.00 0.00 55.95 55.49 2yrz s SER 94 Cb -0.08 0.44 0.92 0.00 0.10 0.00 0.00 66.02 67.40 2yrz s SER 94 CO 0.01 -0.92 1.46 1.67 0.98 0.00 0.00 173.24 176.44 2yrz n GLN 95 N -0.24 -0.07 0.38 4.02 7.27 -1.26 -0.34 117.38 127.15 2yrz n GLN 95 Ca -0.05 1.35 -0.16 0.00 0.07 0.00 0.00 57.00 58.21 2yrz n GLN 95 Cb 0.63 -2.25 -0.08 0.00 2.41 0.00 0.00 30.24 30.95 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 -0.95 0.00 3.69 4.39 -1.95 -3.49 114.58 116.27 2yrz h GLU 96 Ca 0.65 0.06 0.00 0.00 0.34 0.00 0.00 59.36 60.42 2yrz h GLU 96 Cb 1.52 0.22 0.00 0.00 -0.10 0.00 0.00 28.75 30.39 2yrz h GLU 96 CO -0.81 -0.61 0.00 0.41 -1.16 0.00 0.00 179.01 176.83 2yrz n GLY 97 N -0.96 -0.77 3.66 -3.84 0.00 0.54 -5.05 105.19 98.78 2yrz n GLY 97 Ca -0.13 -1.24 -0.42 0.00 0.00 0.00 0.00 46.02 44.23 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 -2.00 2.03 0.00 1.61 0.52 -1.26 -3.14 118.94 116.70 2yrz s TRP 98 Ca 0.00 0.21 0.00 0.00 0.02 0.00 0.00 56.10 56.33 2yrz s TRP 98 Cb 0.00 -3.92 0.00 0.00 -1.15 0.00 0.00 33.47 28.40 2yrz s TRP 98 CO 0.00 -3.83 0.00 0.41 0.02 0.00 0.00 176.95 173.55 2yrz n GLY 99 N 4.11 0.87 3.93 0.98 0.00 -1.10 -4.94 105.19 109.04 2yrz n GLY 99 Ca 0.17 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.99 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 0.05 2.79 0.00 1.61 1.81 -1.13 -4.94 118.95 119.14 2yrz s ARG 100 Ca 0.00 -1.28 0.03 0.00 -1.72 0.00 0.00 55.73 52.77 2yrz s ARG 100 Cb 0.00 -2.60 -0.01 0.00 -0.45 0.00 0.00 34.95 31.89 2yrz s ARG 100 CO 0.00 -0.07 -0.10 -1.83 -0.68 0.00 0.00 175.30 172.61 2yrz s GLU 101 N -4.16 0.81 0.01 3.54 1.03 -1.26 -3.84 118.70 114.83 2yrz s GLU 101 Ca 0.47 -0.44 -0.12 0.00 0.03 0.00 0.00 54.97 54.91 2yrz s GLU 101 Cb -0.07 -0.78 -0.05 0.00 -0.80 0.00 0.00 34.13 32.42 2yrz s GLU 101 CO 0.29 0.21 0.37 0.50 -1.33 0.00 0.00 175.26 175.30 2yrz s ARG 102 N -0.44 3.81 -0.10 -4.83 6.06 0.26 -4.86 118.95 118.85 2yrz s ARG 102 Ca 0.03 0.27 -0.14 0.00 -2.50 0.00 0.00 55.73 53.39 2yrz s ARG 102 Cb -0.05 -3.16 -0.05 0.00 0.06 0.00 0.00 34.95 31.76 2yrz s ARG 102 CO -0.00 0.67 0.34 -2.00 -2.50 0.00 0.00 175.30 171.81 2yrz s GLU 103 N -1.30 4.08 -0.28 5.12 2.12 -1.26 -1.68 118.70 125.49 2yrz s GLU 103 Ca 0.25 0.23 0.00 0.00 0.36 0.00 0.00 54.97 55.82 2yrz s GLU 103 Cb -0.15 -3.34 0.15 0.00 0.26 0.00 0.00 34.13 31.05 2yrz s GLU 103 CO 0.13 0.42 0.38 0.20 -0.54 0.00 0.00 175.26 175.86 2yrz s GLY 104 N -0.15 -0.46 0.12 -1.50 0.00 0.07 -4.88 107.32 100.52 2yrz s GLY 104 Ca 0.20 0.28 -0.17 0.00 0.00 0.00 0.00 44.72 45.03 2yrz s GLY 104 CO 0.08 2.88 0.57 0.14 0.00 0.00 0.00 173.10 176.77 2yrz s VAL 105 N 2.51 4.79 0.05 1.40 1.01 -1.26 -0.43 120.40 128.46 2yrz s VAL 105 Ca 0.10 1.02 0.05 0.00 0.00 0.00 0.00 61.98 63.15 2yrz s VAL 105 Cb -0.13 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.41 2yrz s VAL 105 CO -0.27 0.37 -0.13 -0.51 0.00 0.00 0.00 175.10 174.56 2yrz s ILE 106 N -1.32 1.05 -0.27 2.22 1.10 -0.96 -4.95 121.20 118.08 2yrz s ILE 106 Ca 0.34 -1.10 0.00 0.00 -0.51 0.00 0.00 60.65 59.39 2yrz s ILE 106 Cb -0.17 -0.98 0.05 0.00 0.15 0.00 0.00 42.46 41.50 2yrz s ILE 106 CO 0.19 -0.11 -0.06 -0.89 -2.11 0.00 0.00 174.94 171.96 2yrz s THR 107 N -1.03 2.63 -0.23 4.00 2.01 -1.26 -1.72 115.64 120.04 2yrz s THR 107 Ca -0.01 -1.36 -0.28 0.00 0.31 0.00 0.00 61.69 60.35 2yrz s THR 107 Cb -0.09 -2.46 -0.05 0.00 0.01 0.00 0.00 72.50 69.92 2yrz s THR 107 CO 0.02 0.03 2.17 -0.63 -0.69 0.00 0.00 174.62 175.51 2yrz s ILE 108 N 1.22 3.07 -0.31 1.82 -1.09 -1.24 -4.94 121.20 119.73 2yrz s ILE 108 Ca -0.05 0.07 -0.01 0.00 -2.23 0.00 0.00 60.65 58.44 2yrz s ILE 108 Cb -0.19 -3.09 0.06 0.00 -1.58 0.00 0.00 42.46 37.66 2yrz s ILE 108 CO -0.04 -0.06 0.01 -1.61 -1.23 0.00 0.00 174.94 172.01 2yrz s GLU 109 N 6.26 2.28 -0.07 2.79 2.02 -1.26 -2.83 118.70 127.88 2yrz s GLU 109 Ca 0.98 -1.39 0.17 0.00 0.02 0.00 0.00 54.97 54.75 2yrz s GLU 109 Cb -0.32 -3.18 -0.23 0.00 0.10 0.00 0.00 34.13 30.51 2yrz s GLU 109 CO 0.35 -0.69 0.45 -1.13 0.02 0.00 0.00 175.26 174.26 2yrz n SER 110 N 4.56 0.40 -2.55 -0.19 3.41 -1.26 -4.44 113.62 113.54 2yrz n SER 110 Ca -0.11 0.18 -0.27 0.00 -0.26 0.00 0.00 58.87 58.42 2yrz n SER 110 Cb 0.43 0.73 -0.01 0.00 -0.26 0.00 0.00 64.21 65.10 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 -2.76 3.34 0.23 4.33 7.27 -1.26 -4.83 117.38 123.70 2yrz n GLN 111 Ca -0.19 -4.53 0.09 0.00 0.07 0.00 0.00 57.00 52.44 2yrz n GLN 111 Cb 0.96 -2.22 0.63 0.00 2.41 0.00 0.00 30.24 32.02 2yrz n GLN 111 CO 0.00 0.00 0.00 -0.24 0.07 0.00 0.00 177.06 176.89 2yrz h VAL 112 N 2.64 0.98 -3.65 1.69 3.04 -1.99 -3.41 116.25 115.55 2yrz h VAL 112 Ca 0.26 -0.01 -0.68 0.00 -1.01 0.00 0.00 66.70 65.27 2yrz h VAL 112 Cb 0.86 0.96 -0.18 0.00 -2.01 0.00 0.00 31.29 30.93 2yrz h VAL 112 CO 0.84 0.00 -0.71 -0.94 -1.01 0.00 0.00 177.57 175.75 2yrz s SER 113 N -6.99 4.54 0.00 3.17 1.04 -1.26 -5.04 113.70 109.16 2yrz s SER 113 Ca -0.05 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.22 2yrz s SER 113 Cb 0.17 -1.04 0.00 0.00 0.10 0.00 0.00 66.02 65.26 2yrz s SER 113 CO 0.68 0.29 0.00 0.61 0.98 0.00 0.00 173.24 175.79 2yrz n GLY 114 N 1.61 0.81 3.56 7.32 0.00 -1.26 -5.00 105.19 112.23 2yrz n GLY 114 Ca -0.16 -2.03 -0.32 0.00 0.00 0.00 0.00 46.02 43.52 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 -1.32 2.58 0.01 1.61 0.04 -1.26 -4.96 135.00 131.70 2yrz s PRO 115 Ca 0.00 0.11 -0.26 0.00 0.04 0.00 0.00 61.00 60.89 2yrz s PRO 115 Cb 0.00 -4.76 -0.04 0.00 0.04 0.00 0.00 34.50 29.73 2yrz s PRO 115 CO 0.00 -3.09 0.81 0.45 0.04 0.00 0.00 177.00 175.20 2yrz s SER 116 N 8.08 7.21 0.02 6.66 0.15 -1.26 -4.98 113.70 129.59 2yrz s SER 116 Ca 0.69 1.45 -0.23 0.00 0.70 0.00 0.00 55.95 58.56 2yrz s SER 116 Cb -0.09 -2.48 -0.17 0.00 -1.71 0.00 0.00 66.02 61.57 2yrz s SER 116 CO 0.09 -0.08 1.38 -1.28 1.20 0.00 0.00 173.24 174.54 2yrz h SER 117 N 6.19 0.15 0.00 5.45 0.87 -2.02 -3.56 113.55 120.63 2yrz h SER 117 Ca -0.42 -0.40 0.00 0.00 -1.23 0.00 0.00 61.79 59.73 2yrz h SER 117 Cb 1.21 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 2yrz h SER 117 CO 0.73 0.52 0.00 0.61 -0.53 0.00 0.00 176.83 178.16