#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dmz s SER 2 N 0.00 7.17 -0.20 1.61 0.15 -1.26 -4.99 113.70 116.18 2dmz s SER 2 Ca 0.00 2.10 -0.15 0.00 0.70 0.00 0.00 55.95 58.60 2dmz s SER 2 Cb 0.00 -2.61 -0.08 0.00 -1.71 0.00 0.00 66.02 61.62 2dmz s SER 2 CO 0.00 -0.20 -0.23 -1.20 1.20 0.00 0.00 173.24 172.80 2dmz n SER 3 N 0.75 1.90 0.00 5.45 7.64 -1.26 -5.04 113.62 123.07 2dmz n SER 3 Ca 0.01 0.42 0.00 0.00 1.01 0.00 0.00 58.87 60.31 2dmz n SER 3 Cb 0.47 -0.82 0.00 0.00 -1.01 0.00 0.00 64.21 62.85 2dmz n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dmz n GLY 4 N 1.45 -1.27 3.41 0.23 0.00 -1.26 -5.17 105.19 102.58 2dmz n GLY 4 Ca -0.24 0.35 0.02 0.00 0.00 0.00 0.00 46.02 46.15 2dmz n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dmz s SER 5 N 0.00 -0.36 -0.09 1.61 1.04 -1.26 -5.16 113.70 109.48 2dmz s SER 5 Ca 0.00 0.51 -0.01 0.00 0.48 0.00 0.00 55.95 56.93 2dmz s SER 5 Cb 0.00 1.35 -0.03 0.00 0.10 0.00 0.00 66.02 67.43 2dmz s SER 5 CO 0.00 -0.07 -0.02 -0.94 0.98 0.00 0.00 173.24 173.19 2dmz s SER 6 N 1.99 5.08 0.00 7.02 1.04 -1.26 -3.77 113.70 123.80 2dmz s SER 6 Ca -0.03 0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.49 2dmz s SER 6 Cb -0.04 -1.43 0.00 0.00 0.10 0.00 0.00 66.02 64.65 2dmz s SER 6 CO -0.16 0.36 0.00 0.61 0.98 0.00 0.00 173.24 175.03 2dmz n GLY 7 N 2.27 -0.16 0.00 7.32 0.00 -1.10 -5.01 105.19 108.51 2dmz n GLY 7 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2dmz n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dmz n GLY 8 N 2.35 -2.56 2.82 -0.02 0.00 -1.26 -5.02 105.19 101.50 2dmz n GLY 8 Ca 0.00 -0.84 -0.17 0.00 0.00 0.00 0.00 46.02 45.01 2dmz n GLY 8 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dmz s SER 9 N -1.69 1.02 -1.82 1.61 0.15 -1.26 -4.89 113.70 106.81 2dmz s SER 9 Ca 0.00 0.05 -0.21 0.00 0.70 0.00 0.00 55.95 56.49 2dmz s SER 9 Cb 0.00 0.46 0.20 0.00 -1.71 0.00 0.00 66.02 64.98 2dmz s SER 9 CO 0.00 -0.29 0.60 -0.90 1.20 0.00 0.00 173.24 173.84 2dmz n ASP 10 N 5.33 -1.93 0.04 5.45 5.75 -1.26 -4.84 116.55 125.08 2dmz n ASP 10 Ca -0.05 -1.20 -0.02 0.00 -0.01 0.00 0.00 54.79 53.50 2dmz n ASP 10 Cb 0.50 -1.85 -0.01 0.00 -1.03 0.00 0.00 41.12 38.72 2dmz n ASP 10 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 2dmz h SER 11 N -1.07 -0.13 -3.73 -1.12 0.02 -1.90 -3.41 113.55 102.22 2dmz h SER 11 Ca -0.60 0.00 -0.77 0.00 -0.84 0.00 0.00 61.79 59.58 2dmz h SER 11 Cb 1.39 0.03 -0.29 0.00 0.14 0.00 0.00 62.40 63.67 2dmz h SER 11 CO 0.86 0.14 0.14 -0.44 -1.14 0.00 0.00 176.83 176.39 2dmz s SER 12 N -4.20 6.68 0.33 3.07 0.01 -1.26 -4.87 113.70 113.46 2dmz s SER 12 Ca -0.02 -3.14 0.05 0.00 1.31 0.00 0.00 55.95 54.14 2dmz s SER 12 Cb 0.00 -2.13 0.58 0.00 0.21 0.00 0.00 66.02 64.68 2dmz s SER 12 CO 0.07 -0.41 1.84 -0.07 0.41 0.00 0.00 173.24 175.09 2dmz h LEU 13 N 7.10 0.45-10.12 2.44 -0.00 -1.99 -3.44 115.31 109.75 2dmz h LEU 13 Ca 0.12 -0.10 -0.50 0.00 -0.00 0.00 0.00 57.88 57.40 2dmz h LEU 13 Cb 0.95 -0.12 -0.04 0.00 -0.00 0.00 0.00 40.66 41.45 2dmz h LEU 13 CO 0.85 0.57 -0.40 -0.36 -0.00 0.00 0.00 178.44 179.10 2dmz s PHE 14 N -4.82 2.72 -0.03 1.13 0.40 -1.26 -0.71 117.98 115.42 2dmz s PHE 14 Ca -0.07 -0.47 0.02 0.00 -0.60 0.00 0.00 56.93 55.81 2dmz s PHE 14 Cb 0.15 -2.10 0.01 0.00 0.51 0.00 0.00 43.02 41.59 2dmz s PHE 14 CO 0.77 -0.05 -0.09 -1.83 0.70 0.00 0.00 175.22 174.72 2dmz s GLU 15 N -4.09 1.03 0.09 0.44 -1.05 0.22 -4.79 118.70 110.55 2dmz s GLU 15 Ca 0.46 -0.30 -0.06 0.00 -0.15 0.00 0.00 54.97 54.92 2dmz s GLU 15 Cb -0.03 -0.95 -0.05 0.00 -0.44 0.00 0.00 34.13 32.66 2dmz s GLU 15 CO 0.27 0.09 0.35 0.99 0.95 0.00 0.00 175.26 177.91 2dmz s THR 16 N 0.29 5.19 -0.03 1.83 2.01 -1.26 -1.64 115.64 122.03 2dmz s THR 16 Ca -0.05 0.15 -0.21 0.00 0.31 0.00 0.00 61.69 61.90 2dmz s THR 16 Cb -0.10 -3.62 0.04 0.00 0.01 0.00 0.00 72.50 68.84 2dmz s THR 16 CO 0.01 0.19 0.44 -0.72 -0.69 0.00 0.00 174.62 173.85 2dmz s TYR 17 N -1.50 -0.35 -0.19 4.92 1.13 -0.21 -4.99 117.35 116.16 2dmz s TYR 17 Ca 0.35 0.59 -0.09 0.00 -1.41 0.00 0.00 57.07 56.51 2dmz s TYR 17 Cb -0.13 0.21 -0.05 0.00 -1.10 0.00 0.00 41.96 40.89 2dmz s TYR 17 CO 0.21 -0.46 0.11 0.54 -2.51 0.00 0.00 175.55 173.43 2dmz s ASN 18 N -1.25 6.00 -0.23 -0.18 2.20 -1.26 -2.23 114.94 117.99 2dmz s ASN 18 Ca -0.12 0.18 -0.03 0.00 -0.94 0.00 0.00 52.86 51.95 2dmz s ASN 18 Cb -0.03 -2.04 0.01 0.00 -2.00 0.00 0.00 41.25 37.18 2dmz s ASN 18 CO 0.06 0.19 -0.04 -0.69 -2.94 0.00 0.00 177.10 173.67 2dmz s VAL 19 N 0.31 3.22 -0.78 3.54 1.01 0.92 -4.88 120.40 123.74 2dmz s VAL 19 Ca 0.06 -0.70 -0.17 0.00 0.00 0.00 0.00 61.98 61.18 2dmz s VAL 19 Cb -0.11 -2.53 0.15 0.00 0.00 0.00 0.00 36.38 33.88 2dmz s VAL 19 CO -0.01 0.32 0.86 -0.70 0.00 0.00 0.00 175.10 175.58 2dmz s GLU 20 N 1.43 3.41 0.94 2.72 2.12 -1.25 0.01 118.70 128.07 2dmz s GLU 20 Ca 0.04 -1.85 -0.12 0.00 0.36 0.00 0.00 54.97 53.40 2dmz s GLU 20 Cb -0.15 -4.53 0.15 0.00 0.26 0.00 0.00 34.13 29.86 2dmz s GLU 20 CO -0.04 -1.53 1.13 -0.51 -0.54 0.00 0.00 175.26 173.77 2dmz s LEU 21 N 1.84 1.88 -0.03 2.70 1.43 -0.62 -4.84 118.68 121.05 2dmz s LEU 21 Ca 0.20 1.01 0.02 0.00 -1.03 0.00 0.00 54.13 54.33 2dmz s LEU 21 Cb -0.13 -3.29 0.01 0.00 0.03 0.00 0.00 46.19 42.81 2dmz s LEU 21 CO -0.04 -2.72 -0.08 0.54 0.23 0.00 0.00 176.35 174.28 2dmz s VAL 22 N -3.20 0.72 -0.34 -1.59 0.11 -1.26 -3.45 120.40 111.39 2dmz s VAL 22 Ca 0.64 -0.31 -0.03 0.00 -2.93 0.00 0.00 61.98 59.36 2dmz s VAL 22 Cb -0.16 -0.66 0.07 0.00 -1.53 0.00 0.00 36.38 34.10 2dmz s VAL 22 CO 0.54 0.24 0.09 -0.13 -3.33 0.00 0.00 175.10 172.51 2dmz s ARG 23 N 0.34 2.32 0.55 1.54 0.52 -1.22 -4.52 118.95 118.48 2dmz s ARG 23 Ca -0.05 -1.43 -0.07 0.00 -0.52 0.00 0.00 55.73 53.65 2dmz s ARG 23 Cb -0.10 -3.37 0.12 0.00 0.52 0.00 0.00 34.95 32.12 2dmz s ARG 23 CO 0.01 -0.78 0.26 1.63 0.02 0.00 0.00 175.30 176.44 2dmz n LYS 24 N 4.65 -1.25 -0.90 3.54 4.76 -1.26 -4.72 118.16 122.99 2dmz n LYS 24 Ca -0.09 -0.44 -0.10 0.00 -2.87 0.00 0.00 58.31 54.80 2dmz n LYS 24 Cb 0.43 -0.78 -0.10 0.00 -1.84 0.00 0.00 35.03 32.74 2dmz n LYS 24 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2dmz n ASP 25 N -2.01 5.47 0.00 4.39 5.68 -1.26 -3.59 116.55 125.22 2dmz n ASP 25 Ca 0.04 -2.57 0.00 0.00 -0.50 0.00 0.00 54.79 51.77 2dmz n ASP 25 Cb 0.18 -1.30 0.00 0.00 -1.14 0.00 0.00 41.12 38.87 2dmz n ASP 25 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2dmz n GLY 26 N 1.92 0.00 3.22 6.12 0.00 -1.26 -5.17 105.19 110.02 2dmz n GLY 26 Ca 0.30 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.16 2dmz n GLY 26 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2dmz s GLN 27 N 0.00 0.97 0.55 1.61 0.74 -1.24 -5.17 119.66 117.13 2dmz s GLN 27 Ca 0.00 -1.24 0.05 0.00 0.05 0.00 0.00 55.36 54.22 2dmz s GLN 27 Cb 0.00 -0.76 0.04 0.00 1.10 0.00 0.00 33.01 33.39 2dmz s GLN 27 CO 0.00 0.13 0.39 0.45 -0.55 0.00 0.00 175.29 175.71 2dmz s SER 28 N -2.54 4.60 -0.00 6.67 0.15 -1.26 -4.58 113.70 116.74 2dmz s SER 28 Ca 0.09 -1.28 -0.24 0.00 0.70 0.00 0.00 55.95 55.21 2dmz s SER 28 Cb -0.03 0.47 -0.17 0.00 -1.71 0.00 0.00 66.02 64.58 2dmz s SER 28 CO 0.02 -1.12 1.19 0.25 1.20 0.00 0.00 173.24 174.78 2dmz h LEU 29 N 0.76 -0.28 -1.88 3.45 5.85 -1.97 -3.06 115.31 118.18 2dmz h LEU 29 Ca -0.37 -0.23 -0.15 0.00 0.84 0.00 0.00 57.88 57.97 2dmz h LEU 29 Cb 1.31 0.07 0.08 0.00 0.37 0.00 0.00 40.66 42.49 2dmz h LEU 29 CO 0.58 0.12 -0.36 0.61 -0.34 0.00 0.00 178.44 179.05 2dmz n GLY 30 N -0.13 0.06 2.68 3.75 0.00 -1.26 -2.53 105.19 107.77 2dmz n GLY 30 Ca -0.09 -0.20 -0.29 0.00 0.00 0.00 0.00 46.02 45.44 2dmz n GLY 30 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dmz s ILE 31 N -3.17 0.51 0.19 -0.61 1.01 -1.26 -2.36 121.20 115.52 2dmz s ILE 31 Ca 0.01 -0.99 -0.30 0.00 0.00 0.00 0.00 60.65 59.37 2dmz s ILE 31 Cb -0.00 -1.30 -0.08 0.00 0.01 0.00 0.00 42.46 41.09 2dmz s ILE 31 CO 0.34 -0.57 0.99 -0.13 0.00 0.00 0.00 174.94 175.57 2dmz s ARG 32 N 1.82 4.74 0.40 2.79 1.81 -0.50 -4.96 118.95 125.04 2dmz s ARG 32 Ca 0.07 1.55 0.08 0.00 -1.72 0.00 0.00 55.73 55.70 2dmz s ARG 32 Cb -0.17 -3.30 -0.04 0.00 -0.45 0.00 0.00 34.95 30.99 2dmz s ARG 32 CO -0.24 0.32 0.22 0.96 -0.68 0.00 0.00 175.30 175.88 2dmz s ILE 33 N -0.64 2.56 -0.04 1.52 -4.36 -1.26 0.45 121.20 119.42 2dmz s ILE 33 Ca 0.45 -1.60 -0.09 0.00 -0.26 0.00 0.00 60.65 59.15 2dmz s ILE 33 Cb -0.26 -3.00 0.01 0.00 1.25 0.00 0.00 42.46 40.47 2dmz s ILE 33 CO 0.33 -0.04 0.20 0.54 0.24 0.00 0.00 174.94 176.21 2dmz s VAL 34 N -2.53 0.04 -0.37 8.37 0.11 0.92 -4.45 120.40 122.49 2dmz s VAL 34 Ca 0.42 -0.30 -0.11 0.00 -2.93 0.00 0.00 61.98 59.06 2dmz s VAL 34 Cb 0.01 -0.40 0.03 0.00 -1.53 0.00 0.00 36.38 34.49 2dmz s VAL 34 CO 0.24 -0.17 0.20 -0.83 -3.33 0.00 0.00 175.10 171.22 2dmz s GLY 35 N -0.60 1.93 0.21 6.54 0.00 -1.26 -1.95 107.32 112.18 2dmz s GLY 35 Ca -0.07 -1.72 -0.11 0.00 0.00 0.00 0.00 44.72 42.83 2dmz s GLY 35 CO 0.01 0.84 0.55 -0.19 0.00 0.00 0.00 173.10 174.31 2dmz s TYR 36 N 1.55 3.47 0.00 1.90 1.51 -0.27 -4.96 117.35 120.55 2dmz s TYR 36 Ca 0.02 0.92 0.00 0.00 -1.01 0.00 0.00 57.07 57.00 2dmz s TYR 36 Cb -0.19 -2.28 0.00 0.00 -0.11 0.00 0.00 41.96 39.37 2dmz s TYR 36 CO 0.06 0.31 0.00 0.28 -1.11 0.00 0.00 175.55 175.10 2dmz n VAL 37 N 0.12 0.00 -1.54 0.71 0.31 -1.25 -2.99 118.33 113.69 2dmz n VAL 37 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 2dmz n VAL 37 Cb 0.52 0.03 0.00 0.00 -0.91 0.00 0.00 33.84 33.48 2dmz n VAL 37 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dmz n GLY 38 N 2.18 -4.62 3.38 2.92 0.00 -1.01 -4.75 105.19 103.28 2dmz n GLY 38 Ca 0.00 -0.67 -0.20 0.00 0.00 0.00 0.00 46.02 45.15 2dmz n GLY 38 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2dmz s THR 39 N -3.04 0.46 0.19 2.61 -1.32 -1.26 -4.93 115.64 108.34 2dmz s THR 39 Ca 0.00 -2.00 -0.18 0.00 -1.21 0.00 0.00 61.69 58.30 2dmz s THR 39 Cb 0.00 -2.51 0.16 0.00 -1.51 0.00 0.00 72.50 68.63 2dmz s THR 39 CO 0.00 0.00 1.62 -1.28 -2.21 0.00 0.00 174.62 172.75 2dmz h SER 40 N 2.13 -0.79 -2.04 8.08 0.87 -1.97 -3.43 113.55 116.40 2dmz h SER 40 Ca -0.35 0.19 -0.58 0.00 -1.23 0.00 0.00 61.79 59.83 2dmz h SER 40 Cb 1.25 0.44 0.21 0.00 -0.44 0.00 0.00 62.40 63.86 2dmz h SER 40 CO 0.54 -0.25 -1.44 1.41 -0.53 0.00 0.00 176.83 176.57 2dmz n HIS 41 N -5.42 -3.83 -0.81 2.24 -0.00 -1.26 -4.85 115.22 101.29 2dmz n HIS 41 Ca 0.05 0.24 -0.35 0.00 -0.00 0.00 0.00 57.72 57.66 2dmz n HIS 41 Cb 0.33 -1.59 0.11 0.00 -0.00 0.00 0.00 29.99 28.84 2dmz n HIS 41 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 2dmz n THR 42 N -1.96 0.00 -2.77 1.59 -2.24 -1.26 -4.40 114.28 103.24 2dmz n THR 42 Ca 0.04 -0.17 -0.03 0.00 -2.27 0.00 0.00 64.05 61.62 2dmz n THR 42 Cb 0.51 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 2dmz n THR 42 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dmz n GLY 43 N 2.68 -1.17 3.66 3.38 0.00 -1.26 -4.89 105.19 107.59 2dmz n GLY 43 Ca -0.01 0.70 -0.38 0.00 0.00 0.00 0.00 46.02 46.33 2dmz n GLY 43 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2dmz s GLU 44 N -2.73 4.15 -0.27 1.61 -1.05 -1.26 -4.68 118.70 114.47 2dmz s GLU 44 Ca 0.10 0.16 -0.25 0.00 -0.15 0.00 0.00 54.97 54.83 2dmz s GLU 44 Cb -0.03 -3.55 0.10 0.00 -0.44 0.00 0.00 34.13 30.21 2dmz s GLU 44 CO 0.66 -0.06 0.87 0.00 0.95 0.00 0.00 175.26 177.68 2dmz s ALA 45 N 1.40 -1.87 0.01 -0.84 0.00 -1.26 -5.06 121.76 114.14 2dmz s ALA 45 Ca 0.18 1.93 0.00 0.00 0.00 0.00 0.00 51.96 54.08 2dmz s ALA 45 Cb -0.15 -1.26 -0.01 0.00 0.00 0.00 0.00 23.12 21.70 2dmz s ALA 45 CO 0.08 -0.29 -0.03 -1.12 0.00 0.00 0.00 175.76 174.40 2dmz s SER 46 N 0.24 0.27 0.00 0.00 0.01 -1.26 -2.39 113.70 110.56 2dmz s SER 46 Ca 0.01 -0.32 0.00 0.00 1.31 0.00 0.00 55.95 56.96 2dmz s SER 46 Cb -0.05 0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.23 2dmz s SER 46 CO -0.02 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.07 2dmz n GLY 47 N 2.16 0.76 3.41 3.44 0.00 -1.16 -4.95 105.19 108.85 2dmz n GLY 47 Ca -0.19 -1.82 -0.33 0.00 0.00 0.00 0.00 46.02 43.67 2dmz n GLY 47 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dmz s ILE 48 N -2.81 3.34 0.09 -0.61 -1.09 -1.26 -1.11 121.20 117.75 2dmz s ILE 48 Ca 0.00 -0.55 0.03 0.00 -2.23 0.00 0.00 60.65 57.90 2dmz s ILE 48 Cb 0.00 -2.43 -0.03 0.00 -1.58 0.00 0.00 42.46 38.42 2dmz s ILE 48 CO 0.00 0.51 -0.09 -0.31 -1.23 0.00 0.00 174.94 173.82 2dmz s TYR 49 N 0.37 0.97 -0.19 3.97 1.51 -0.82 -2.06 117.35 121.10 2dmz s TYR 49 Ca -0.08 -0.66 -0.29 0.00 -1.01 0.00 0.00 57.07 55.03 2dmz s TYR 49 Cb -0.15 -0.54 -0.02 0.00 -0.11 0.00 0.00 41.96 41.13 2dmz s TYR 49 CO 0.05 -0.04 1.43 0.08 -1.11 0.00 0.00 175.55 175.96 2dmz s VAL 50 N -2.39 3.98 -0.10 0.71 1.01 -0.65 -0.05 120.40 122.90 2dmz s VAL 50 Ca 0.03 1.15 -0.26 0.00 0.00 0.00 0.00 61.98 62.91 2dmz s VAL 50 Cb -0.03 -3.86 -0.28 0.00 0.00 0.00 0.00 36.38 32.20 2dmz s VAL 50 CO -0.01 -0.24 0.79 0.50 0.00 0.00 0.00 175.10 176.15 2dmz h LYS 51 N 9.31 0.13 -3.84 2.72 1.63 -0.22 -3.26 116.57 123.04 2dmz h LYS 51 Ca -0.30 -0.22 -0.10 0.00 -0.85 0.00 0.00 60.65 59.19 2dmz h LYS 51 Cb 1.13 0.08 -0.11 0.00 -0.60 0.00 0.00 32.23 32.73 2dmz h LYS 51 CO 0.99 1.10 -0.24 -1.54 -3.45 0.00 0.00 179.45 176.32 2dmz s SER 52 N -6.56 -0.03 -0.48 4.20 1.04 -1.19 -4.87 113.70 105.80 2dmz s SER 52 Ca -0.17 -0.97 0.05 0.00 0.48 0.00 0.00 55.95 55.33 2dmz s SER 52 Cb -0.01 0.52 0.18 0.00 0.10 0.00 0.00 66.02 66.82 2dmz s SER 52 CO 0.74 -1.04 0.42 0.52 0.98 0.00 0.00 173.24 174.87 2dmz n VAL 53 N -0.33 -0.36 -1.31 5.02 0.31 -1.26 -1.41 118.33 119.00 2dmz n VAL 53 Ca -0.03 -3.90 -0.51 0.00 -0.01 0.00 0.00 64.34 59.89 2dmz n VAL 53 Cb 0.63 -1.83 -0.07 0.00 -0.91 0.00 0.00 33.84 31.66 2dmz n VAL 53 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2dmz n ILE 54 N 2.35 0.03 -1.22 2.52 -0.00 -0.99 -4.70 119.36 117.34 2dmz n ILE 54 Ca 0.27 -0.01 -0.30 0.00 -0.00 0.00 0.00 62.75 62.71 2dmz n ILE 54 Cb 0.46 0.00 0.13 0.00 -0.00 0.00 0.00 39.64 40.22 2dmz n ILE 54 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 2dmz s PRO 55 N -0.01 1.48 -2.03 0.38 0.04 -1.26 -3.59 135.00 130.00 2dmz s PRO 55 Ca 0.79 0.89 0.00 0.00 0.04 0.00 0.00 61.00 62.73 2dmz s PRO 55 Cb -1.11 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 31.61 2dmz s PRO 55 CO 0.50 -2.11 0.00 0.41 0.04 0.00 0.00 177.00 175.84 2dmz n GLY 56 N -1.15 1.38 3.63 0.56 0.00 -1.26 -4.97 105.19 103.38 2dmz n GLY 56 Ca 0.07 -0.05 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 2dmz n GLY 56 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dmz s SER 57 N -2.63 4.10 0.26 1.61 1.04 -1.24 -4.92 113.70 111.92 2dmz s SER 57 Ca 0.00 -1.10 -0.01 0.00 0.48 0.00 0.00 55.95 55.32 2dmz s SER 57 Cb 0.00 -0.47 0.55 0.00 0.10 0.00 0.00 66.02 66.19 2dmz s SER 57 CO 0.00 -0.31 1.73 0.00 0.98 0.00 0.00 173.24 175.64 2dmz h ALA 58 N 1.78 1.22 0.71 5.32 0.00 -1.53 0.18 119.26 126.93 2dmz h ALA 58 Ca -0.43 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 2dmz h ALA 58 Cb 1.25 0.07 0.01 0.00 0.00 0.00 0.00 17.79 19.12 2dmz h ALA 58 CO 0.70 -0.20 -0.34 0.00 0.00 0.00 0.00 179.25 179.41 2dmz h ALA 59 N 1.59 -0.96 -0.66 0.00 0.00 -1.77 0.29 119.26 117.75 2dmz h ALA 59 Ca 0.46 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 55.22 2dmz h ALA 59 Cb 0.74 0.37 -0.05 0.00 0.00 0.00 0.00 17.79 18.85 2dmz h ALA 59 CO -0.42 -1.04 0.37 -0.92 0.00 0.00 0.00 179.25 177.24 2dmz h TYR 60 N -0.97 0.67 -0.34 0.00 3.20 -1.59 -0.85 116.97 117.09 2dmz h TYR 60 Ca -0.10 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.78 2dmz h TYR 60 Cb 0.74 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.79 2dmz h TYR 60 CO -0.02 0.32 0.13 0.45 -1.64 0.00 0.00 178.16 177.40 2dmz h HIS 61 N 0.68 0.52 0.60 -3.82 3.86 -0.54 -3.20 115.15 113.25 2dmz h HIS 61 Ca 0.30 -0.04 -0.02 0.00 -1.16 0.00 0.00 60.37 59.44 2dmz h HIS 61 Cb 0.18 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.49 2dmz h HIS 61 CO -0.08 0.50 -0.39 -0.97 0.86 0.00 0.00 177.93 177.84 2dmz h ASN 62 N 0.40 -1.00 0.00 2.45 -1.24 0.11 -3.47 115.58 112.83 2dmz h ASN 62 Ca 0.11 0.06 0.00 0.00 0.71 0.00 0.00 56.30 57.18 2dmz h ASN 62 Cb 0.20 0.30 0.00 0.00 0.73 0.00 0.00 38.32 39.55 2dmz h ASN 62 CO -0.01 -0.60 0.00 0.61 -1.29 0.00 0.00 177.43 176.14 2dmz n GLY 63 N -1.52 0.69 0.00 1.57 0.00 -0.37 -4.94 105.19 100.61 2dmz n GLY 63 Ca -0.13 -0.73 -0.00 0.00 0.00 0.00 0.00 46.02 45.17 2dmz n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dmz n HIS 64 N -3.09 0.00 -3.83 1.61 8.25 -1.26 -4.94 115.22 111.96 2dmz n HIS 64 Ca 0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.11 2dmz n HIS 64 Cb 0.25 -0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.23 2dmz n HIS 64 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2dmz s ILE 65 N -2.00 3.08 0.39 1.59 1.01 -1.26 -5.08 121.20 118.93 2dmz s ILE 65 Ca -0.00 -2.10 0.04 0.00 0.00 0.00 0.00 60.65 58.58 2dmz s ILE 65 Cb 0.00 -3.13 -0.03 0.00 0.01 0.00 0.00 42.46 39.31 2dmz s ILE 65 CO 0.00 -0.66 0.11 0.00 0.00 0.00 0.00 174.94 174.40 2dmz s GLN 66 N 1.09 1.88 1.04 2.79 0.00 -1.26 -4.72 119.66 120.49 2dmz s GLN 66 Ca 0.08 -2.13 -0.14 0.00 -0.00 0.00 0.00 55.36 53.17 2dmz s GLN 66 Cb -0.22 -0.68 0.19 0.00 0.00 0.00 0.00 33.01 32.30 2dmz s GLN 66 CO -0.05 -0.42 0.36 1.33 0.00 0.00 0.00 175.29 176.51 2dmz n VAL 67 N -0.87 0.00 -3.31 3.63 0.24 -1.26 -3.36 118.33 113.39 2dmz n VAL 67 Ca -0.06 -0.04 -0.22 0.00 -2.04 0.00 0.00 64.34 61.98 2dmz n VAL 67 Cb 0.65 -0.53 -0.01 0.00 -1.47 0.00 0.00 33.84 32.49 2dmz n VAL 67 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 2dmz n ASN 68 N -1.59 -3.59 -4.22 -1.34 0.23 -1.23 -4.89 115.26 98.63 2dmz n ASN 68 Ca 0.06 -0.35 -0.27 0.00 -0.53 0.00 0.00 54.58 53.49 2dmz n ASN 68 Cb 0.37 -2.98 -0.16 0.00 -2.08 0.00 0.00 39.78 34.93 2dmz n ASN 68 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 2dmz s ASP 69 N -2.67 2.43 -0.13 0.53 1.01 -1.21 -4.99 116.67 111.63 2dmz s ASP 69 Ca 0.38 -0.38 -0.06 0.00 0.71 0.00 0.00 52.55 53.20 2dmz s ASP 69 Cb -0.20 -0.29 -0.04 0.00 1.01 0.00 0.00 42.92 43.40 2dmz s ASP 69 CO 0.46 0.25 0.07 -0.75 0.21 0.00 0.00 175.17 175.41 2dmz s LYS 70 N -0.46 3.52 -0.09 8.23 2.20 -1.26 -1.64 119.74 130.24 2dmz s LYS 70 Ca 0.07 -0.29 -0.02 0.00 -0.36 0.00 0.00 55.97 55.37 2dmz s LYS 70 Cb -0.08 -3.09 -0.03 0.00 -1.51 0.00 0.00 37.83 33.12 2dmz s LYS 70 CO -0.01 0.56 0.00 0.42 -0.36 0.00 0.00 175.35 175.97 2dmz s ILE 71 N -0.44 4.33 0.00 5.43 1.01 -0.88 -2.10 121.20 128.55 2dmz s ILE 71 Ca 0.10 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.51 2dmz s ILE 71 Cb -0.12 -2.82 0.00 0.00 0.01 0.00 0.00 42.46 39.53 2dmz s ILE 71 CO 0.02 0.60 0.00 1.33 0.00 0.00 0.00 174.94 176.89 2dmz n VAL 72 N 2.18 0.00 -3.54 2.92 0.24 0.12 -4.57 118.33 115.67 2dmz n VAL 72 Ca -0.19 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 61.95 2dmz n VAL 72 Cb 0.54 0.41 -0.06 0.00 -1.47 0.00 0.00 33.84 33.25 2dmz n VAL 72 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dmz s ALA 73 N -1.93 -1.79 -0.09 2.33 0.00 -1.09 -2.51 121.76 116.69 2dmz s ALA 73 Ca 0.00 1.46 0.00 0.00 0.00 0.00 0.00 51.96 53.42 2dmz s ALA 73 Cb 0.00 -0.26 0.02 0.00 0.00 0.00 0.00 23.12 22.88 2dmz s ALA 73 CO 0.00 -0.36 -0.07 0.08 0.00 0.00 0.00 175.76 175.41 2dmz s VAL 74 N -0.91 0.88 -1.80 0.00 1.01 -0.32 0.51 120.40 119.78 2dmz s VAL 74 Ca -0.08 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 61.65 2dmz s VAL 74 Cb -0.01 -0.90 0.00 0.00 0.00 0.00 0.00 36.38 35.47 2dmz s VAL 74 CO 0.08 0.33 0.00 -0.67 0.00 0.00 0.00 175.10 174.84 2dmz n ASP 75 N 4.57 -5.90 0.00 3.32 -0.08 0.14 -1.22 116.55 117.38 2dmz n ASP 75 Ca -0.16 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.12 2dmz n ASP 75 Cb 0.51 -4.92 0.00 0.00 2.34 0.00 0.00 41.12 39.05 2dmz n ASP 75 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2dmz n GLY 76 N -0.99 0.43 3.10 0.27 0.00 -1.24 -4.89 105.19 101.86 2dmz n GLY 76 Ca -0.25 -0.99 -0.33 0.00 0.00 0.00 0.00 46.02 44.46 2dmz n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dmz s VAL 77 N -2.00 2.15 -0.60 1.61 1.01 -0.36 -5.05 120.40 117.15 2dmz s VAL 77 Ca 0.00 -1.25 -0.26 0.00 0.00 0.00 0.00 61.98 60.47 2dmz s VAL 77 Cb 0.00 -2.08 -0.10 0.00 0.00 0.00 0.00 36.38 34.21 2dmz s VAL 77 CO 0.00 0.27 2.42 -3.20 0.00 0.00 0.00 175.10 174.59 2dmz n ASN 78 N 4.54 2.13 -1.21 3.32 2.85 -1.26 -1.17 115.26 124.45 2dmz n ASN 78 Ca -0.18 -0.88 0.05 0.00 -0.11 0.00 0.00 54.58 53.47 2dmz n ASN 78 Cb 0.46 -1.62 0.23 0.00 1.24 0.00 0.00 39.78 40.10 2dmz n ASN 78 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 2dmz n ILE 79 N 8.30 1.40 -1.56 -1.44 -5.35 -1.04 -4.88 119.36 114.79 2dmz n ILE 79 Ca 0.41 -0.77 -0.20 0.00 -0.27 0.00 0.00 62.75 61.91 2dmz n ILE 79 Cb 0.50 -0.21 -0.06 0.00 -1.74 0.00 0.00 39.64 38.13 2dmz n ILE 79 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2dmz n GLN 80 N 0.47 0.70 0.00 6.28 6.02 -1.20 -0.43 117.38 129.22 2dmz n GLN 80 Ca 0.16 -0.59 0.00 0.00 -0.01 0.00 0.00 57.00 56.56 2dmz n GLN 80 Cb 0.71 -3.60 0.00 0.00 1.02 0.00 0.00 30.24 28.37 2dmz n GLN 80 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2dmz n GLY 81 N 6.56 2.16 3.62 1.08 0.00 -1.26 -5.08 105.19 112.26 2dmz n GLY 81 Ca 0.44 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.97 2dmz n GLY 81 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2dmz n PHE 82 N -0.41 1.74 -1.29 1.61 3.01 0.43 -4.92 117.46 117.62 2dmz n PHE 82 Ca 0.00 0.53 -0.32 0.00 1.01 0.00 0.00 57.45 58.66 2dmz n PHE 82 Cb 0.00 -2.39 0.10 0.00 -0.01 0.00 0.00 39.48 37.18 2dmz n PHE 82 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2dmz s ALA 83 N 0.37 2.09 0.06 4.37 0.00 -1.26 -4.63 121.76 122.76 2dmz s ALA 83 Ca 0.78 0.57 -0.12 0.00 0.00 0.00 0.00 51.96 53.19 2dmz s ALA 83 Cb -0.82 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 18.90 2dmz s ALA 83 CO 0.46 -1.91 1.05 -1.71 0.00 0.00 0.00 175.76 173.65 2dmz n ASN 84 N -3.22 -0.41 -0.22 0.00 2.85 -1.26 -0.03 115.26 112.97 2dmz n ASN 84 Ca 0.11 1.14 -0.05 0.00 -0.11 0.00 0.00 54.58 55.68 2dmz n ASN 84 Cb 0.52 -0.32 0.05 0.00 1.24 0.00 0.00 39.78 41.28 2dmz n ASN 84 CO 0.00 0.00 0.00 1.12 -2.11 0.00 0.00 177.26 176.27 2dmz h HIS 85 N 0.00 0.75 -0.97 1.20 2.07 -1.99 -1.41 115.15 114.80 2dmz h HIS 85 Ca 0.06 0.02 0.26 0.00 -2.85 0.00 0.00 60.37 57.87 2dmz h HIS 85 Cb 0.16 -0.25 -0.05 0.00 2.57 0.00 0.00 27.41 29.84 2dmz h HIS 85 CO -0.83 0.44 0.68 -0.44 -3.07 0.00 0.00 177.93 174.71 2dmz h ASP 86 N 0.79 0.16 0.15 3.10 3.32 -0.78 -0.22 116.42 122.96 2dmz h ASP 86 Ca 0.24 0.02 -0.29 0.00 0.02 0.00 0.00 57.03 57.03 2dmz h ASP 86 Cb -0.02 -0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.53 2dmz h ASP 86 CO -0.08 0.05 -1.42 0.58 -1.72 0.00 0.00 179.24 176.65 2dmz h VAL 87 N 0.15 1.10 -0.75 -1.35 2.07 0.21 -3.27 116.25 114.42 2dmz h VAL 87 Ca 0.49 -2.48 0.10 0.00 0.82 0.00 0.00 66.70 65.62 2dmz h VAL 87 Cb 1.66 2.84 -0.07 0.00 -1.52 0.00 0.00 31.29 34.19 2dmz h VAL 87 CO -0.09 0.76 0.39 0.58 0.02 0.00 0.00 177.57 179.23 2dmz h VAL 88 N -0.16 0.86 -0.42 2.57 2.07 -0.09 -0.64 116.25 120.43 2dmz h VAL 88 Ca -0.29 -0.22 -0.05 0.00 0.82 0.00 0.00 66.70 66.96 2dmz h VAL 88 Cb 1.88 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 2dmz h VAL 88 CO 0.13 0.12 0.06 1.05 0.02 0.00 0.00 177.57 178.95 2dmz h GLU 89 N 0.66 0.65 -0.52 1.57 4.11 -1.32 -2.41 114.58 117.31 2dmz h GLU 89 Ca 0.37 -0.13 -0.03 0.00 0.07 0.00 0.00 59.36 59.64 2dmz h GLU 89 Cb 0.38 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 2dmz h GLU 89 CO -0.27 0.63 0.21 0.28 0.07 0.00 0.00 179.01 179.93 2dmz h VAL 90 N 0.63 1.21 -0.45 -1.06 2.07 -1.19 -1.73 116.25 115.72 2dmz h VAL 90 Ca 0.14 -0.65 -0.03 0.00 0.82 0.00 0.00 66.70 66.97 2dmz h VAL 90 Cb 0.30 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 2dmz h VAL 90 CO 0.00 0.25 0.16 -0.07 0.02 0.00 0.00 177.57 177.93 2dmz h LEU 91 N 0.70 0.64 -1.00 2.57 3.38 -1.11 -2.34 115.31 118.15 2dmz h LEU 91 Ca 0.17 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2dmz h LEU 91 Cb 0.19 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.72 2dmz h LEU 91 CO -0.02 0.66 0.57 0.03 0.09 0.00 0.00 178.44 179.78 2dmz h ARG 92 N 0.59 1.26 -0.79 1.13 3.08 -1.27 -2.40 114.38 115.98 2dmz h ARG 92 Ca 0.15 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 2dmz h ARG 92 Cb 0.23 -0.27 -0.03 0.00 0.08 0.00 0.00 29.97 29.98 2dmz h ARG 92 CO -0.01 0.87 0.30 -0.91 -1.07 0.00 0.00 179.97 179.16 2dmz h ASN 93 N 1.28 1.10 -3.17 7.04 2.35 -1.06 -3.44 115.58 119.68 2dmz h ASN 93 Ca 0.34 -0.18 -0.53 0.00 -0.55 0.00 0.00 56.30 55.37 2dmz h ASN 93 Cb -0.07 -0.29 0.22 0.00 0.05 0.00 0.00 38.32 38.23 2dmz h ASN 93 CO -0.07 0.98 -0.79 0.00 -1.65 0.00 0.00 177.43 175.91 2dmz n ALA 94 N -2.43 -3.09 -2.72 -0.83 0.00 -0.90 -5.03 120.51 105.50 2dmz n ALA 94 Ca 0.07 -0.63 0.00 0.00 0.00 0.00 0.00 53.44 52.88 2dmz n ALA 94 Cb 0.19 -1.69 0.00 0.00 0.00 0.00 0.00 19.45 17.96 2dmz n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dmz n GLY 95 N 1.83 5.95 0.36 0.00 0.00 -1.26 -5.01 105.19 107.05 2dmz n GLY 95 Ca 0.05 -2.01 -0.03 0.00 0.00 0.00 0.00 46.02 44.03 2dmz n GLY 95 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2dmz h GLN 96 N 0.00 -0.09 -5.93 1.61 4.15 -1.94 -3.30 115.11 109.61 2dmz h GLN 96 Ca 0.00 0.01 -0.60 0.00 0.77 0.00 0.00 58.65 58.83 2dmz h GLN 96 Cb 0.00 0.02 -0.11 0.00 0.21 0.00 0.00 27.48 27.60 2dmz h GLN 96 CO 0.00 -0.06 0.69 0.08 -1.93 0.00 0.00 178.83 177.62 2dmz s VAL 97 N -5.99 4.22 -0.38 2.39 1.01 -1.26 -3.43 120.40 116.95 2dmz s VAL 97 Ca -0.14 0.22 -0.05 0.00 0.00 0.00 0.00 61.98 62.02 2dmz s VAL 97 Cb 0.18 -4.66 0.08 0.00 0.00 0.00 0.00 36.38 31.98 2dmz s VAL 97 CO 0.70 -1.35 0.16 -0.69 0.00 0.00 0.00 175.10 173.93 2dmz s VAL 98 N 4.40 3.51 -0.80 2.92 1.01 -1.22 -4.95 120.40 125.27 2dmz s VAL 98 Ca 0.31 -1.65 -0.22 0.00 0.00 0.00 0.00 61.98 60.42 2dmz s VAL 98 Cb -0.12 -3.22 0.08 0.00 0.00 0.00 0.00 36.38 33.12 2dmz s VAL 98 CO 0.17 -0.47 1.11 -1.00 0.00 0.00 0.00 175.10 174.91 2dmz s HIS 99 N 1.26 2.75 -0.04 5.22 3.76 -1.24 -1.58 115.29 125.41 2dmz s HIS 99 Ca 0.03 -0.79 -0.25 0.00 -0.15 0.00 0.00 55.06 53.90 2dmz s HIS 99 Cb -0.22 -4.38 -0.04 0.00 1.11 0.00 0.00 32.58 29.06 2dmz s HIS 99 CO -0.01 -1.69 0.78 -1.17 -0.85 0.00 0.00 174.74 171.80 2dmz s LEU 100 N 3.95 4.34 -0.35 0.89 1.98 0.10 0.24 118.68 129.83 2dmz s LEU 100 Ca 0.30 1.33 -0.10 0.00 -2.89 0.00 0.00 54.13 52.76 2dmz s LEU 100 Cb -0.10 -3.22 0.02 0.00 0.66 0.00 0.00 46.19 43.55 2dmz s LEU 100 CO 0.02 -0.15 0.18 -0.89 -1.89 0.00 0.00 176.35 173.63 2dmz s THR 101 N 0.80 4.49 0.20 3.68 2.01 0.18 -0.05 115.64 126.96 2dmz s THR 101 Ca 0.41 -0.78 0.06 0.00 0.31 0.00 0.00 61.69 61.70 2dmz s THR 101 Cb -0.19 -3.45 -0.05 0.00 0.01 0.00 0.00 72.50 68.82 2dmz s THR 101 CO 0.21 -0.15 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.12 2dmz s LEU 102 N 1.55 2.51 -0.19 4.42 1.02 -0.95 -0.70 118.68 126.35 2dmz s LEU 102 Ca 0.02 -1.06 -0.03 0.00 0.02 0.00 0.00 54.13 53.09 2dmz s LEU 102 Cb -0.19 -0.56 0.06 0.00 0.02 0.00 0.00 46.19 45.53 2dmz s LEU 102 CO 0.06 -0.26 0.03 0.54 0.02 0.00 0.00 176.35 176.74 2dmz s VAL 103 N -3.10 0.57 0.04 -1.59 0.11 -0.89 -1.05 120.40 114.49 2dmz s VAL 103 Ca 0.22 -0.55 0.01 0.00 -2.93 0.00 0.00 61.98 58.74 2dmz s VAL 103 Cb 0.01 -1.04 -0.04 0.00 -1.53 0.00 0.00 36.38 33.78 2dmz s VAL 103 CO 0.06 -0.17 0.09 0.00 -3.33 0.00 0.00 175.10 171.75 2dmz s ARG 104 N 1.84 3.02 0.33 1.54 1.70 -0.65 -4.41 118.95 122.32 2dmz s ARG 104 Ca -0.01 -0.57 -0.29 0.00 -0.47 0.00 0.00 55.73 54.39 2dmz s ARG 104 Cb -0.17 -2.82 -0.11 0.00 -0.57 0.00 0.00 34.95 31.29 2dmz s ARG 104 CO -0.08 0.61 1.46 0.50 -1.08 0.00 0.00 175.30 176.71 2dmz s ARG 105 N -2.09 4.19 0.52 3.89 3.00 -1.26 -0.61 118.95 126.59 2dmz s ARG 105 Ca 0.27 2.46 -0.09 0.00 -1.00 0.00 0.00 55.73 57.37 2dmz s ARG 105 Cb -0.12 -3.02 0.13 0.00 0.00 0.00 0.00 34.95 31.93 2dmz s ARG 105 CO 0.19 -0.46 0.59 1.63 0.00 0.00 0.00 175.30 177.25 2dmz n LYS 106 N 1.12 -1.23 -4.21 5.12 5.02 0.11 -4.83 118.16 119.26 2dmz n LYS 106 Ca 0.03 -0.93 -0.18 0.00 -2.02 0.00 0.00 58.31 55.21 2dmz n LYS 106 Cb 0.40 -0.72 -0.07 0.00 -0.02 0.00 0.00 35.03 34.62 2dmz n LYS 106 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2dmz s THR 107 N -2.22 0.00 0.26 -0.18 -4.23 -1.26 -5.00 115.64 103.02 2dmz s THR 107 Ca 0.36 -1.86 -0.11 0.00 -1.18 0.00 0.00 61.69 58.90 2dmz s THR 107 Cb -0.02 -2.56 0.38 0.00 1.34 0.00 0.00 72.50 71.65 2dmz s THR 107 CO 0.26 0.00 1.57 0.77 -0.54 0.00 0.00 174.62 176.68 2dmz h SER 108 N 2.13 -0.98 -4.19 3.99 4.64 -2.01 -3.40 113.55 113.72 2dmz h SER 108 Ca -0.26 0.29 -0.48 0.00 -0.47 0.00 0.00 61.79 60.87 2dmz h SER 108 Cb 1.23 0.61 0.13 0.00 -0.31 0.00 0.00 62.40 64.07 2dmz h SER 108 CO 0.37 -0.31 0.29 -0.94 -0.87 0.00 0.00 176.83 175.38 2dmz s SER 109 N -5.27 3.82 -1.03 4.97 1.04 -1.26 -4.17 113.70 111.81 2dmz s SER 109 Ca -0.15 1.24 -0.03 0.00 0.48 0.00 0.00 55.95 57.50 2dmz s SER 109 Cb 0.24 -1.92 0.00 0.00 0.10 0.00 0.00 66.02 64.45 2dmz s SER 109 CO 0.76 -2.39 0.87 -0.24 0.98 0.00 0.00 173.24 173.23 2dmz n SER 110 N -3.69 -3.35 -4.60 7.02 2.88 -1.26 -4.94 113.62 105.68 2dmz n SER 110 Ca 0.07 -0.48 -0.38 0.00 -1.33 0.00 0.00 58.87 56.74 2dmz n SER 110 Cb 0.57 -4.25 0.04 0.00 -0.75 0.00 0.00 64.21 59.82 2dmz n SER 110 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 2dmz n THR 111 N -3.93 3.30 -1.06 2.46 5.66 -1.26 -4.88 114.28 114.57 2dmz n THR 111 Ca -0.15 -0.50 -0.36 0.00 -3.05 0.00 0.00 64.05 59.99 2dmz n THR 111 Cb 0.61 -1.09 0.06 0.00 -1.55 0.00 0.00 70.33 68.35 2dmz n THR 111 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 2dmz n SER 112 N -0.40 -3.84 -2.94 1.09 7.64 -1.26 -4.96 113.62 108.94 2dmz n SER 112 Ca 0.13 0.38 -0.12 0.00 1.01 0.00 0.00 58.87 60.27 2dmz n SER 112 Cb 0.46 -0.96 0.10 0.00 -1.01 0.00 0.00 64.21 62.81 2dmz n SER 112 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2dmz n PRO 113 N 0.85 -1.91 0.11 1.43 -0.04 -1.26 -4.80 135.00 129.38 2dmz n PRO 113 Ca 0.04 -0.72 -0.02 0.00 -0.04 0.00 0.00 63.50 62.75 2dmz n PRO 113 Cb 0.53 -0.68 0.05 0.00 -0.04 0.00 0.00 33.50 33.36 2dmz n PRO 113 CO 0.00 0.00 0.00 1.37 -0.04 0.00 0.00 175.50 176.83 2dmz h LEU 114 N 0.00 0.00 -6.03 1.53 8.10 -1.94 -3.30 115.31 113.67 2dmz h LEU 114 Ca -0.17 0.00 -0.57 0.00 0.11 0.00 0.00 57.88 57.25 2dmz h LEU 114 Cb 0.52 0.00 -0.40 0.00 -0.44 0.00 0.00 40.66 40.34 2dmz h LEU 114 CO 0.11 0.73 -0.96 -1.84 -4.11 0.00 0.00 178.44 172.36 2dmz n GLU 115 N -3.50 1.28 -1.56 0.17 0.28 -1.26 -2.69 120.64 113.36 2dmz n GLU 115 Ca -0.00 -3.66 -0.32 0.00 -0.16 0.00 0.00 57.16 53.01 2dmz n GLU 115 Cb 0.75 -1.55 0.06 0.00 1.43 0.00 0.00 31.44 32.13 2dmz n GLU 115 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 2dmz s PRO 116 N -1.67 2.58 -0.87 3.44 0.04 -1.26 -4.91 135.00 132.35 2dmz s PRO 116 Ca 0.37 1.30 -0.25 0.00 0.04 0.00 0.00 61.00 62.47 2dmz s PRO 116 Cb 0.18 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.75 2dmz s PRO 116 CO -0.08 -1.41 1.94 -1.25 0.04 0.00 0.00 177.00 176.24 2dmz s PRO 117 N -4.41 2.56 0.53 0.56 0.04 -1.26 -4.66 135.00 128.36 2dmz s PRO 117 Ca 0.65 -0.20 -0.19 0.00 0.04 0.00 0.00 61.00 61.30 2dmz s PRO 117 Cb -0.19 -5.00 -0.10 0.00 0.04 0.00 0.00 34.50 29.25 2dmz s PRO 117 CO 0.47 -3.32 0.43 -1.13 0.04 0.00 0.00 177.00 173.50 2dmz n SER 118 N 13.86 -1.40 -3.61 6.66 3.41 -1.26 -4.65 113.62 126.64 2dmz n SER 118 Ca 0.38 0.76 -0.09 0.00 -0.26 0.00 0.00 58.87 59.66 2dmz n SER 118 Cb 0.47 -1.11 -0.06 0.00 -0.26 0.00 0.00 64.21 63.25 2dmz n SER 118 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 2dmz s ASP 119 N -1.10 -0.33 0.07 4.04 -4.77 -1.26 -5.07 116.67 108.24 2dmz s ASP 119 Ca 0.66 0.47 0.05 0.00 -3.30 0.00 0.00 52.55 50.42 2dmz s ASP 119 Cb -0.48 0.41 -0.03 0.00 -1.09 0.00 0.00 42.92 41.73 2dmz s ASP 119 CO 0.57 -0.23 -0.14 0.00 0.70 0.00 0.00 175.17 176.07 2dmz s ARG 120 N -0.64 0.81 0.00 2.11 1.70 -1.26 -4.81 118.95 116.86 2dmz s ARG 120 Ca 0.01 -0.93 0.00 0.00 -0.47 0.00 0.00 55.73 54.34 2dmz s ARG 120 Cb -0.02 -0.81 0.00 0.00 -0.57 0.00 0.00 34.95 33.55 2dmz s ARG 120 CO -0.03 0.18 0.00 0.41 -1.08 0.00 0.00 175.30 174.78 2dmz n GLY 121 N 1.33 -0.43 2.96 3.88 0.00 -1.26 -5.17 105.19 106.51 2dmz n GLY 121 Ca -0.21 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.56 2dmz n GLY 121 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2dmz s THR 122 N 0.00 0.88 -0.12 2.61 -1.32 -1.26 -5.12 115.64 111.31 2dmz s THR 122 Ca 0.00 -0.32 -0.05 0.00 -1.21 0.00 0.00 61.69 60.11 2dmz s THR 122 Cb 0.00 -0.84 0.06 0.00 -1.51 0.00 0.00 72.50 70.21 2dmz s THR 122 CO 0.00 0.30 0.24 -0.69 -2.21 0.00 0.00 174.62 172.26 2dmz s VAL 123 N 0.82 -0.34 0.03 5.08 1.01 -1.26 -5.15 120.40 120.59 2dmz s VAL 123 Ca -0.12 0.28 -0.13 0.00 0.00 0.00 0.00 61.98 62.01 2dmz s VAL 123 Cb -0.15 -0.41 0.02 0.00 0.00 0.00 0.00 36.38 35.84 2dmz s VAL 123 CO 0.02 0.12 0.27 -0.55 0.00 0.00 0.00 175.10 174.95 2dmz s SER 124 N 2.24 -0.09 0.22 3.32 0.15 -1.26 -5.18 113.70 113.10 2dmz s SER 124 Ca 0.00 -0.18 0.01 0.00 0.70 0.00 0.00 55.95 56.49 2dmz s SER 124 Cb -0.12 0.32 -0.05 0.00 -1.71 0.00 0.00 66.02 64.47 2dmz s SER 124 CO -0.08 -0.55 0.06 -0.83 1.20 0.00 0.00 173.24 173.03 2dmz s GLY 125 N -1.88 1.49 0.45 9.45 0.00 -1.26 -5.14 107.32 110.42 2dmz s GLY 125 Ca -0.07 -1.73 -0.23 0.00 0.00 0.00 0.00 44.72 42.68 2dmz s GLY 125 CO -0.02 -1.55 1.17 2.56 0.00 0.00 0.00 173.10 175.26 2dmz s PRO 126 N -3.99 3.81 -1.11 2.90 0.04 -1.26 -4.89 135.00 130.51 2dmz s PRO 126 Ca 0.32 1.80 -0.24 0.00 0.04 0.00 0.00 61.00 62.91 2dmz s PRO 126 Cb 0.07 -2.46 -0.13 0.00 0.04 0.00 0.00 34.50 32.02 2dmz s PRO 126 CO 0.09 -0.52 2.02 0.45 0.04 0.00 0.00 177.00 179.09 2dmz s SER 127 N -1.30 4.46 1.14 6.66 0.15 -1.26 -4.92 113.70 118.63 2dmz s SER 127 Ca 0.62 -1.26 -0.16 0.00 0.70 0.00 0.00 55.95 55.86 2dmz s SER 127 Cb -0.29 -2.59 0.26 0.00 -1.71 0.00 0.00 66.02 61.69 2dmz s SER 127 CO 0.36 -3.64 1.07 -0.55 1.20 0.00 0.00 173.24 171.68 2dmz s SER 128 N 7.53 1.35 0.00 5.45 0.15 -1.26 -5.28 113.70 121.64 2dmz s SER 128 Ca 0.74 1.00 0.00 0.00 0.70 0.00 0.00 55.95 58.39 2dmz s SER 128 Cb -0.03 -1.52 0.00 0.00 -1.71 0.00 0.00 66.02 62.76 2dmz s SER 128 CO 0.13 -3.90 0.00 0.61 1.20 0.00 0.00 173.24 171.28