#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 5.33 0.35 1.61 1.04 -1.26 -5.12 113.70 115.65 2dmz s SER 2 Ca 0.00 0.35 0.08 0.00 0.48 0.00 0.00 55.95 56.86 2dmz s SER 2 Cb 0.00 -1.26 -0.07 0.00 0.10 0.00 0.00 66.02 64.79 2dmz s SER 2 CO 0.00 -1.17 -0.05 -0.44 0.98 0.00 0.00 173.24 172.56 2dmz s SER 3 N -4.38 3.50 -0.31 7.02 0.01 -1.26 -5.13 113.70 113.15 2dmz s SER 3 Ca 0.56 -1.26 -0.09 0.00 1.31 0.00 0.00 55.95 56.47 2dmz s SER 3 Cb -0.10 -0.31 0.19 0.00 0.21 0.00 0.00 66.02 66.00 2dmz s SER 3 CO 0.42 -0.32 1.00 -0.83 0.41 0.00 0.00 173.24 173.91 2dmz s GLY 4 N -3.60 -1.12 -0.23 3.44 0.00 -1.26 -5.16 107.32 99.39 2dmz s GLY 4 Ca 0.33 1.76 -0.23 0.00 0.00 0.00 0.00 44.72 46.58 2dmz s GLY 4 CO 0.16 4.11 0.65 -0.45 0.00 0.00 0.00 173.10 177.57 2dmz s SER 5 N 2.67 -0.67 -0.11 1.64 0.15 -1.26 -5.16 113.70 110.96 2dmz s SER 5 Ca 0.23 1.26 0.02 0.00 0.70 0.00 0.00 55.95 58.16 2dmz s SER 5 Cb -0.01 1.27 -0.01 0.00 -1.71 0.00 0.00 66.02 65.55 2dmz s SER 5 CO -0.21 -0.26 -0.17 -0.55 1.20 0.00 0.00 173.24 173.26 2dmz s SER 6 N 0.21 3.73 0.00 5.45 0.15 -1.26 -5.05 113.70 116.93 2dmz s SER 6 Ca -0.01 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.26 2dmz s SER 6 Cb -0.04 -1.39 0.00 0.00 -1.71 0.00 0.00 66.02 62.88 2dmz s SER 6 CO 0.02 0.20 0.00 0.61 1.20 0.00 0.00 173.24 175.26 2dmz n GLY 7 N 3.30 0.89 0.00 9.45 0.00 -1.26 -5.18 105.19 112.39 2dmz n GLY 7 Ca -0.18 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.00 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 0.00 0.20 3.64 -0.02 0.00 -1.26 -5.10 105.19 102.64 2dmz n GLY 8 Ca 0.00 -2.30 -0.28 0.00 0.00 0.00 0.00 46.02 43.44 2dmz n GLY 8 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dmz n SER 9 N 0.00 2.99 -1.93 1.61 7.64 -1.26 -5.01 113.62 117.65 2dmz n SER 9 Ca 0.00 -2.98 -0.13 0.00 1.01 0.00 0.00 58.87 56.77 2dmz n SER 9 Cb 0.00 0.12 -0.04 0.00 -1.01 0.00 0.00 64.21 63.28 2dmz n SER 9 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2dmz n ASP 10 N -1.61 5.87 -0.08 6.43 2.03 -1.26 -4.31 116.55 123.63 2dmz n ASP 10 Ca -0.10 -2.78 -0.07 0.00 0.52 0.00 0.00 54.79 52.37 2dmz n ASP 10 Cb 0.62 -1.20 -0.03 0.00 -0.72 0.00 0.00 41.12 39.79 2dmz n ASP 10 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 2dmz h SER 11 N 2.01 0.00 -3.50 1.67 0.87 -2.03 -3.43 113.55 109.15 2dmz h SER 11 Ca 0.21 -0.08 -0.68 0.00 -1.23 0.00 0.00 61.79 60.01 2dmz h SER 11 Cb 1.04 0.00 -0.37 0.00 -0.44 0.00 0.00 62.40 62.63 2dmz h SER 11 CO 0.45 0.86 -0.29 -0.94 -0.53 0.00 0.00 176.83 176.38 2dmz s SER 12 N -5.90 5.49 0.30 6.23 1.04 -1.26 -4.87 113.70 114.74 2dmz s SER 12 Ca -0.17 -3.56 0.16 0.00 0.48 0.00 0.00 55.95 52.87 2dmz s SER 12 Cb 0.03 -1.82 0.17 0.00 0.10 0.00 0.00 66.02 64.49 2dmz s SER 12 CO 0.27 -0.20 1.49 -0.07 0.98 0.00 0.00 173.24 175.72 2dmz h LEU 13 N 6.08 0.00-10.29 2.42 -0.00 -1.87 -3.46 115.31 108.19 2dmz h LEU 13 Ca 0.11 0.00 -0.51 0.00 -0.00 0.00 0.00 57.88 57.48 2dmz h LEU 13 Cb 0.83 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.47 2dmz h LEU 13 CO 0.79 0.45 -0.32 -0.36 -0.00 0.00 0.00 178.44 179.00 2dmz s PHE 14 N -3.05 2.33 -0.05 1.13 0.40 -1.26 0.06 117.98 117.54 2dmz s PHE 14 Ca 0.04 -0.59 0.00 0.00 -0.60 0.00 0.00 56.93 55.78 2dmz s PHE 14 Cb 0.08 -2.14 0.03 0.00 0.51 0.00 0.00 43.02 41.49 2dmz s PHE 14 CO 0.73 -0.35 -0.01 -1.83 0.70 0.00 0.00 175.22 174.46 2dmz s GLU 15 N -4.24 0.53 -0.09 0.44 -1.05 0.15 -4.71 118.70 109.73 2dmz s GLU 15 Ca 0.47 0.04 -0.12 0.00 -0.15 0.00 0.00 54.97 55.21 2dmz s GLU 15 Cb -0.04 -0.73 -0.05 0.00 -0.44 0.00 0.00 34.13 32.88 2dmz s GLU 15 CO 0.28 -0.17 0.29 0.99 0.95 0.00 0.00 175.26 177.60 2dmz s THR 16 N 1.30 5.26 0.01 1.83 2.01 -1.26 -2.38 115.64 122.40 2dmz s THR 16 Ca -0.06 0.56 0.00 0.00 0.31 0.00 0.00 61.69 62.51 2dmz s THR 16 Cb -0.13 -3.60 -0.01 0.00 0.01 0.00 0.00 72.50 68.77 2dmz s THR 16 CO -0.02 0.53 -0.02 -0.72 -0.69 0.00 0.00 174.62 173.70 2dmz s TYR 17 N -0.54 0.14 -0.15 4.92 1.13 -0.72 -5.01 117.35 117.12 2dmz s TYR 17 Ca 0.19 -0.18 -0.14 0.00 -1.41 0.00 0.00 57.07 55.53 2dmz s TYR 17 Cb -0.14 -0.10 -0.05 0.00 -1.10 0.00 0.00 41.96 40.57 2dmz s TYR 17 CO 0.08 -0.06 0.30 -0.80 -2.51 0.00 0.00 175.55 172.56 2dmz s ASN 18 N -0.50 6.46 -0.23 -0.18 0.01 -1.26 -2.89 114.94 116.35 2dmz s ASN 18 Ca -0.05 0.54 0.01 0.00 -0.71 0.00 0.00 52.86 52.66 2dmz s ASN 18 Cb -0.03 -2.18 0.04 0.00 0.41 0.00 0.00 41.25 39.48 2dmz s ASN 18 CO -0.00 0.12 -0.13 -0.69 -1.51 0.00 0.00 177.10 174.89 2dmz s VAL 19 N 0.31 2.31 -0.69 1.60 1.01 -0.17 -4.92 120.40 119.86 2dmz s VAL 19 Ca 0.17 -1.22 -0.20 0.00 0.00 0.00 0.00 61.98 60.73 2dmz s VAL 19 Cb -0.13 -2.17 0.10 0.00 0.00 0.00 0.00 36.38 34.17 2dmz s VAL 19 CO 0.05 0.24 0.90 -0.70 0.00 0.00 0.00 175.10 175.59 2dmz s GLU 20 N 1.23 3.18 0.10 2.72 2.12 -1.26 -0.11 118.70 126.69 2dmz s GLU 20 Ca -0.01 -1.20 -0.20 0.00 0.36 0.00 0.00 54.97 53.92 2dmz s GLU 20 Cb -0.16 -4.36 -0.07 0.00 0.26 0.00 0.00 34.13 29.79 2dmz s GLU 20 CO -0.08 -1.70 0.61 -0.51 -0.54 0.00 0.00 175.26 173.04 2dmz s LEU 21 N 3.26 4.52 -0.00 2.70 1.43 0.64 -4.85 118.68 126.39 2dmz s LEU 21 Ca 0.20 1.33 0.00 0.00 -1.03 0.00 0.00 54.13 54.63 2dmz s LEU 21 Cb -0.17 -3.01 -0.04 0.00 0.03 0.00 0.00 46.19 43.00 2dmz s LEU 21 CO 0.05 0.25 0.05 0.54 0.23 0.00 0.00 176.35 177.47 2dmz s VAL 22 N -1.15 4.52 -0.41 -1.59 0.11 -1.25 -1.24 120.40 119.38 2dmz s VAL 22 Ca 0.31 -0.48 -0.04 0.00 -2.93 0.00 0.00 61.98 58.84 2dmz s VAL 22 Cb -0.20 -3.05 0.11 0.00 -1.53 0.00 0.00 36.38 31.71 2dmz s VAL 22 CO 0.20 0.36 0.22 -0.13 -3.33 0.00 0.00 175.10 172.42 2dmz s ARG 23 N -1.68 2.13 0.98 1.54 0.52 -1.18 -4.52 118.95 116.74 2dmz s ARG 23 Ca 0.22 -1.76 -0.15 0.00 -0.52 0.00 0.00 55.73 53.51 2dmz s ARG 23 Cb -0.12 -3.62 0.08 0.00 0.52 0.00 0.00 34.95 31.81 2dmz s ARG 23 CO 0.13 -1.06 -0.06 1.63 0.02 0.00 0.00 175.30 175.96 2dmz n LYS 24 N 4.66 -1.56 -1.55 3.54 5.02 -1.26 -4.57 118.16 122.45 2dmz n LYS 24 Ca -0.04 -0.46 -0.28 0.00 -2.02 0.00 0.00 58.31 55.52 2dmz n LYS 24 Cb 0.41 -1.40 -0.07 0.00 -0.02 0.00 0.00 35.03 33.95 2dmz n LYS 24 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2dmz n ASP 25 N -0.22 1.71 -1.04 4.39 2.03 -1.26 -1.27 116.55 120.90 2dmz n ASP 25 Ca 0.03 -0.80 -0.04 0.00 0.52 0.00 0.00 54.79 54.50 2dmz n ASP 25 Cb 0.44 -1.49 0.01 0.00 -0.72 0.00 0.00 41.12 39.36 2dmz n ASP 25 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dmz n GLY 26 N 6.30 0.69 3.59 0.27 0.00 -1.26 -5.06 105.19 109.73 2dmz n GLY 26 Ca 0.45 -0.52 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 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 -5.22 2.45 0.69 1.61 0.74 -0.39 -5.13 119.66 114.39 2dmz s GLN 27 Ca 0.10 -0.80 0.00 0.00 0.05 0.00 0.00 55.36 54.72 2dmz s GLN 27 Cb -0.05 -2.45 0.13 0.00 1.10 0.00 0.00 33.01 31.75 2dmz s GLN 27 CO 0.13 0.58 0.94 0.43 -0.55 0.00 0.00 175.29 176.82 2dmz n SER 28 N 1.35 1.33 0.00 6.67 7.64 -1.26 -4.58 113.62 124.77 2dmz n SER 28 Ca -0.15 -2.11 -0.00 0.00 1.01 0.00 0.00 58.87 57.62 2dmz n SER 28 Cb 0.52 -0.60 -0.00 0.00 -1.01 0.00 0.00 64.21 63.12 2dmz n SER 28 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2dmz h LEU 29 N 0.00 -0.01 -0.59 -3.43 5.85 -1.95 -3.31 115.31 111.87 2dmz h LEU 29 Ca -0.31 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.41 2dmz h LEU 29 Cb 1.16 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.20 2dmz h LEU 29 CO 0.34 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 179.05 2dmz n GLY 30 N 1.17 0.63 2.93 3.75 0.00 -1.26 -2.34 105.19 110.06 2dmz n GLY 30 Ca -0.00 -0.19 -0.28 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.88 1.17 -0.15 -0.61 1.01 -1.26 -1.90 121.20 117.57 2dmz s ILE 31 Ca 0.00 -0.45 -0.19 0.00 0.00 0.00 0.00 60.65 60.01 2dmz s ILE 31 Cb 0.00 -1.20 -0.04 0.00 0.01 0.00 0.00 42.46 41.23 2dmz s ILE 31 CO 0.00 0.33 0.53 -0.13 0.00 0.00 0.00 174.94 175.67 2dmz s ARG 32 N 1.64 4.28 0.41 2.79 1.81 -0.58 -5.00 118.95 124.30 2dmz s ARG 32 Ca 0.04 0.50 0.07 0.00 -1.72 0.00 0.00 55.73 54.62 2dmz s ARG 32 Cb -0.13 -3.50 -0.04 0.00 -0.45 0.00 0.00 34.95 30.83 2dmz s ARG 32 CO -0.09 -0.02 0.27 0.96 -0.68 0.00 0.00 175.30 175.75 2dmz s ILE 33 N 1.18 2.47 -0.15 1.52 -4.36 -1.26 0.08 121.20 120.68 2dmz s ILE 33 Ca 0.27 -1.54 -0.15 0.00 -0.26 0.00 0.00 60.65 58.97 2dmz s ILE 33 Cb -0.16 -3.00 0.04 0.00 1.25 0.00 0.00 42.46 40.60 2dmz s ILE 33 CO 0.11 -0.00 0.43 0.54 0.24 0.00 0.00 174.94 176.25 2dmz s VAL 34 N -2.54 0.00 -0.49 8.37 0.11 -0.40 -4.54 120.40 120.91 2dmz s VAL 34 Ca 0.44 -0.03 -0.10 0.00 -2.93 0.00 0.00 61.98 59.37 2dmz s VAL 34 Cb 0.01 -0.61 0.12 0.00 -1.53 0.00 0.00 36.38 34.37 2dmz s VAL 34 CO 0.25 -0.02 0.38 -0.83 -3.33 0.00 0.00 175.10 171.55 2dmz s GLY 35 N 0.11 2.07 0.38 6.54 0.00 -1.26 -2.16 107.32 113.00 2dmz s GLY 35 Ca -0.01 -2.58 -0.16 0.00 0.00 0.00 0.00 44.72 41.97 2dmz s GLY 35 CO 0.01 1.13 0.81 -0.19 0.00 0.00 0.00 173.10 174.86 2dmz s TYR 36 N 1.32 3.38 0.00 1.90 1.51 -0.94 -4.92 117.35 119.60 2dmz s TYR 36 Ca 0.06 1.31 0.00 0.00 -1.01 0.00 0.00 57.07 57.43 2dmz s TYR 36 Cb -0.26 -2.62 0.00 0.00 -0.11 0.00 0.00 41.96 38.97 2dmz s TYR 36 CO -0.01 -0.02 0.00 1.33 -1.11 0.00 0.00 175.55 175.74 2dmz n VAL 37 N -0.66 0.00 -1.15 0.71 0.24 -1.19 -2.93 118.33 113.34 2dmz n VAL 37 Ca 0.04 0.00 -0.49 0.00 -2.04 0.00 0.00 64.34 61.85 2dmz n VAL 37 Cb 0.54 -0.46 -0.08 0.00 -1.47 0.00 0.00 33.84 32.36 2dmz n VAL 37 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dmz n GLY 38 N 1.75 0.02 0.17 7.63 0.00 -1.12 -4.75 105.19 108.89 2dmz n GLY 38 Ca 0.00 0.81 -0.01 0.00 0.00 0.00 0.00 46.02 46.82 2dmz n GLY 38 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2dmz n THR 39 N 3.97 0.09 0.12 2.61 5.66 -1.26 -0.70 114.28 124.77 2dmz n THR 39 Ca 0.32 -0.03 -0.10 0.00 -3.05 0.00 0.00 64.05 61.19 2dmz n THR 39 Cb -0.04 -0.72 -0.06 0.00 -1.55 0.00 0.00 70.33 67.96 2dmz n THR 39 CO 0.00 0.00 0.00 -1.28 -3.05 0.00 0.00 175.07 170.74 2dmz h SER 40 N -0.01 -0.32 -1.13 1.09 0.87 -1.97 -3.39 113.55 108.69 2dmz h SER 40 Ca -0.04 -0.17 -0.66 0.00 -1.23 0.00 0.00 61.79 59.69 2dmz h SER 40 Cb 1.05 0.08 0.11 0.00 -0.44 0.00 0.00 62.40 63.21 2dmz h SER 40 CO -0.01 0.16 -0.50 0.00 -0.53 0.00 0.00 176.83 175.95 2dmz n HIS 41 N -5.04 -0.44 -1.38 2.24 -0.00 -1.26 -4.73 115.22 104.62 2dmz n HIS 41 Ca -0.07 0.94 -0.46 0.00 -0.00 0.00 0.00 57.72 58.12 2dmz n HIS 41 Cb 0.24 -1.97 -0.02 0.00 -0.00 0.00 0.00 29.99 28.24 2dmz n HIS 41 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.34 173.97 2dmz n THR 42 N -0.03 1.62 -2.71 0.61 5.66 -1.26 -3.61 114.28 114.55 2dmz n THR 42 Ca 0.17 -0.50 -0.02 0.00 -3.05 0.00 0.00 64.05 60.65 2dmz n THR 42 Cb 0.26 -0.03 0.00 0.00 -1.55 0.00 0.00 70.33 69.02 2dmz n THR 42 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2dmz n GLY 43 N 2.08 -1.11 3.68 1.09 0.00 -1.26 -4.81 105.19 104.86 2dmz n GLY 43 Ca 0.16 0.56 -0.63 0.00 0.00 0.00 0.00 46.02 46.10 2dmz n GLY 43 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2dmz n GLU 44 N -1.21 0.27 -3.89 1.61 2.13 -1.24 -4.93 120.64 113.38 2dmz n GLU 44 Ca 0.03 0.10 -0.30 0.00 0.66 0.00 0.00 57.16 57.65 2dmz n GLU 44 Cb 0.46 -1.64 -0.15 0.00 0.27 0.00 0.00 31.44 30.37 2dmz n GLU 44 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2dmz s ALA 45 N 2.30 1.92 -0.11 4.31 0.00 0.12 -5.01 121.76 125.29 2dmz s ALA 45 Ca 1.00 -1.50 -0.07 0.00 0.00 0.00 0.00 51.96 51.39 2dmz s ALA 45 Cb -1.34 -1.51 0.04 0.00 0.00 0.00 0.00 23.12 20.31 2dmz s ALA 45 CO 0.72 -1.34 0.28 -1.54 0.00 0.00 0.00 175.76 173.88 2dmz s SER 46 N 1.41 -0.30 0.00 0.00 1.04 -1.26 -2.79 113.70 111.80 2dmz s SER 46 Ca -0.01 0.58 0.00 0.00 0.48 0.00 0.00 55.95 57.01 2dmz s SER 46 Cb -0.18 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.43 2dmz s SER 46 CO -0.10 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 174.58 2dmz n GLY 47 N 3.91 0.85 3.66 7.32 0.00 -1.15 -4.93 105.19 114.86 2dmz n GLY 47 Ca -0.22 -2.02 -0.38 0.00 0.00 0.00 0.00 46.02 43.40 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 -1.35 5.20 0.06 -0.61 -1.09 -1.26 -2.20 121.20 119.95 2dmz s ILE 48 Ca 0.00 0.69 0.05 0.00 -2.23 0.00 0.00 60.65 59.16 2dmz s ILE 48 Cb 0.00 -3.72 -0.03 0.00 -1.58 0.00 0.00 42.46 37.13 2dmz s ILE 48 CO 0.00 0.24 -0.15 -0.31 -1.23 0.00 0.00 174.94 173.49 2dmz s TYR 49 N 1.39 1.29 -0.79 3.97 1.51 -0.92 -1.88 117.35 121.93 2dmz s TYR 49 Ca 0.19 -0.40 -0.25 0.00 -1.01 0.00 0.00 57.07 55.59 2dmz s TYR 49 Cb -0.15 -0.75 -0.03 0.00 -0.11 0.00 0.00 41.96 40.93 2dmz s TYR 49 CO 0.08 0.06 1.85 0.08 -1.11 0.00 0.00 175.55 176.51 2dmz s VAL 50 N -1.03 3.45 0.22 0.71 1.01 -1.00 -1.27 120.40 122.49 2dmz s VAL 50 Ca 0.01 -0.13 -0.08 0.00 0.00 0.00 0.00 61.98 61.78 2dmz s VAL 50 Cb -0.09 -4.09 0.18 0.00 0.00 0.00 0.00 36.38 32.38 2dmz s VAL 50 CO 0.02 -1.03 1.86 0.50 0.00 0.00 0.00 175.10 176.44 2dmz h LYS 51 N 12.61 0.93 -2.89 2.72 1.63 -0.59 -3.31 116.57 127.66 2dmz h LYS 51 Ca -0.06 -0.06 0.07 0.00 -0.85 0.00 0.00 60.65 59.75 2dmz h LYS 51 Cb 1.07 -0.21 -0.04 0.00 -0.60 0.00 0.00 32.23 32.45 2dmz h LYS 51 CO 1.23 0.61 0.29 -1.12 -3.45 0.00 0.00 179.45 177.02 2dmz s SER 52 N -5.80 -0.17 -0.26 4.20 0.01 -1.19 -4.91 113.70 105.59 2dmz s SER 52 Ca -0.13 -0.73 -0.01 0.00 1.31 0.00 0.00 55.95 56.40 2dmz s SER 52 Cb 0.16 0.72 0.08 0.00 0.21 0.00 0.00 66.02 67.19 2dmz s SER 52 CO 0.78 -1.36 0.03 -0.69 0.41 0.00 0.00 173.24 172.41 2dmz s VAL 53 N -3.33 1.06 0.19 3.43 1.01 -1.26 -1.53 120.40 119.97 2dmz s VAL 53 Ca 0.13 -1.17 -0.33 0.00 0.00 0.00 0.00 61.98 60.61 2dmz s VAL 53 Cb -0.05 -1.59 -0.13 0.00 0.00 0.00 0.00 36.38 34.61 2dmz s VAL 53 CO 0.07 -0.37 1.64 -0.38 0.00 0.00 0.00 175.10 176.06 2dmz n ILE 54 N 4.81 0.04 -1.25 2.22 -0.00 -0.80 -4.93 119.36 119.46 2dmz n ILE 54 Ca -0.06 -0.01 -0.31 0.00 -0.00 0.00 0.00 62.75 62.36 2dmz n ILE 54 Cb 0.44 -1.76 0.09 0.00 -0.00 0.00 0.00 39.64 38.42 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 0.97 2.23 -1.72 0.38 0.04 -1.26 -3.54 135.00 132.11 2dmz s PRO 55 Ca 0.76 1.17 0.00 0.00 0.04 0.00 0.00 61.00 62.97 2dmz s PRO 55 Cb -0.59 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.05 2dmz s PRO 55 CO 0.36 -1.66 0.00 0.41 0.04 0.00 0.00 177.00 176.14 2dmz n GLY 56 N -1.19 0.00 3.47 0.56 0.00 -1.26 -4.97 105.19 101.80 2dmz n GLY 56 Ca 0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.17 3.35 0.19 1.61 1.04 -1.23 -4.99 113.70 111.50 2dmz s SER 57 Ca 0.00 -1.10 -0.23 0.00 0.48 0.00 0.00 55.95 55.10 2dmz s SER 57 Cb 0.00 -0.27 0.10 0.00 0.10 0.00 0.00 66.02 65.95 2dmz s SER 57 CO 0.00 -0.12 1.57 0.00 0.98 0.00 0.00 173.24 175.66 2dmz h ALA 58 N 2.24 -0.16 -0.44 5.32 0.00 -1.56 0.23 119.26 124.89 2dmz h ALA 58 Ca -0.40 0.16 0.09 0.00 0.00 0.00 0.00 54.91 54.76 2dmz h ALA 58 Cb 1.25 0.96 -0.10 0.00 0.00 0.00 0.00 17.79 19.90 2dmz h ALA 58 CO 0.65 -0.76 -0.29 0.00 0.00 0.00 0.00 179.25 178.85 2dmz h ALA 59 N 0.87 -0.06 -0.41 0.00 0.00 -1.82 -0.94 119.26 116.91 2dmz h ALA 59 Ca 0.23 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.28 2dmz h ALA 59 Cb 0.56 0.65 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 2dmz h ALA 59 CO -0.77 -0.66 0.26 -0.92 0.00 0.00 0.00 179.25 177.16 2dmz h TYR 60 N -0.20 0.49 0.04 0.00 3.20 -1.26 -0.82 116.97 118.42 2dmz h TYR 60 Ca 0.20 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.09 2dmz h TYR 60 Cb 0.51 -0.16 -0.05 0.00 1.54 0.00 0.00 36.73 38.57 2dmz h TYR 60 CO -0.52 0.30 -0.52 0.45 -1.64 0.00 0.00 178.16 176.23 2dmz h HIS 61 N 0.53 -1.52 -0.49 -3.82 3.86 0.59 -1.15 115.15 113.15 2dmz h HIS 61 Ca 0.15 0.05 0.03 0.00 -1.16 0.00 0.00 60.37 59.43 2dmz h HIS 61 Cb -0.04 0.66 -0.03 0.00 1.06 0.00 0.00 27.41 29.06 2dmz h HIS 61 CO -0.05 -0.57 0.32 -0.97 0.86 0.00 0.00 177.93 177.52 2dmz h ASN 62 N -0.69 0.49 -3.80 2.45 -0.73 -1.13 -3.46 115.58 108.70 2dmz h ASN 62 Ca 0.00 -0.01 -0.37 0.00 1.87 0.00 0.00 56.30 57.80 2dmz h ASN 62 Cb 0.72 -0.12 0.04 0.00 0.27 0.00 0.00 38.32 39.23 2dmz h ASN 62 CO -0.32 0.34 -0.54 0.61 -0.37 0.00 0.00 177.43 177.15 2dmz n GLY 63 N -1.48 -0.41 0.06 1.57 0.00 -0.32 -4.89 105.19 99.73 2dmz n GLY 63 Ca 0.05 0.02 -0.08 0.00 0.00 0.00 0.00 46.02 46.01 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 -4.33 0.00 -3.14 1.61 8.25 -1.26 -4.92 115.22 111.43 2dmz n HIS 64 Ca -0.13 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 56.90 2dmz n HIS 64 Cb 0.62 -0.45 -0.07 0.00 1.12 0.00 0.00 29.99 31.22 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 -2.23 4.85 0.34 1.59 1.01 -1.26 -5.04 121.20 120.46 2dmz s ILE 65 Ca -0.15 -0.25 0.04 0.00 0.00 0.00 0.00 60.65 60.30 2dmz s ILE 65 Cb 0.04 -4.26 -0.06 0.00 0.01 0.00 0.00 42.46 38.19 2dmz s ILE 65 CO 0.28 -0.72 0.05 -1.10 0.00 0.00 0.00 174.94 173.45 2dmz s GLN 66 N 2.72 1.72 1.21 2.79 1.11 -1.26 -4.78 119.66 123.17 2dmz s GLN 66 Ca 0.18 -1.96 -0.18 0.00 0.01 0.00 0.00 55.36 53.41 2dmz s GLN 66 Cb -0.17 -1.00 0.24 0.00 -1.01 0.00 0.00 33.01 31.07 2dmz s GLN 66 CO 0.15 -0.18 0.52 1.33 0.01 0.00 0.00 175.29 177.12 2dmz n VAL 67 N -0.75 0.00 -2.91 1.09 0.24 -1.26 -3.75 118.33 110.99 2dmz n VAL 67 Ca -0.03 -0.21 -0.21 0.00 -2.04 0.00 0.00 64.34 61.85 2dmz n VAL 67 Cb 0.67 -0.76 0.03 0.00 -1.47 0.00 0.00 33.84 32.30 2dmz n VAL 67 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2dmz n ASN 68 N -3.39 -5.91 -4.19 -1.34 3.02 -1.24 -4.94 115.26 97.27 2dmz n ASN 68 Ca 0.05 -0.25 -0.22 0.00 -0.03 0.00 0.00 54.58 54.14 2dmz n ASN 68 Cb 0.54 -4.75 -0.13 0.00 -0.61 0.00 0.00 39.78 34.83 2dmz n ASN 68 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2dmz s ASP 69 N -2.66 1.98 -0.30 6.41 1.01 -1.25 -4.98 116.67 116.89 2dmz s ASP 69 Ca 0.26 -0.52 -0.07 0.00 0.71 0.00 0.00 52.55 52.92 2dmz s ASP 69 Cb -0.11 -0.13 0.00 0.00 1.01 0.00 0.00 42.92 43.69 2dmz s ASP 69 CO 0.32 0.06 0.09 -0.75 0.21 0.00 0.00 175.17 175.10 2dmz s LYS 70 N -1.31 3.16 -0.15 8.23 2.20 -1.26 -2.38 119.74 128.23 2dmz s LYS 70 Ca 0.03 -0.81 -0.27 0.00 -0.36 0.00 0.00 55.97 54.56 2dmz s LYS 70 Cb -0.09 -3.41 -0.01 0.00 -1.51 0.00 0.00 37.83 32.81 2dmz s LYS 70 CO 0.02 -0.43 0.89 0.42 -0.36 0.00 0.00 175.35 175.89 2dmz s ILE 71 N 1.53 4.84 -0.06 5.43 1.01 -0.79 -2.57 121.20 130.60 2dmz s ILE 71 Ca 0.03 1.77 0.11 0.00 0.00 0.00 0.00 60.65 62.57 2dmz s ILE 71 Cb -0.17 -4.20 -0.16 0.00 0.01 0.00 0.00 42.46 37.94 2dmz s ILE 71 CO 0.03 0.01 0.15 1.33 0.00 0.00 0.00 174.94 176.47 2dmz n VAL 72 N 4.69 0.38 -3.68 2.92 0.24 -0.76 -4.58 118.33 117.54 2dmz n VAL 72 Ca 0.06 -0.37 -0.14 0.00 -2.04 0.00 0.00 64.34 61.84 2dmz n VAL 72 Cb 0.49 -0.23 -0.08 0.00 -1.47 0.00 0.00 33.84 32.54 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 -2.56 -1.27 -0.14 2.33 0.00 -1.15 -2.15 121.76 116.83 2dmz s ALA 73 Ca -0.05 1.18 -0.00 0.00 0.00 0.00 0.00 51.96 53.09 2dmz s ALA 73 Cb 0.06 -0.48 0.03 0.00 0.00 0.00 0.00 23.12 22.73 2dmz s ALA 73 CO 0.48 -0.27 -0.09 0.08 0.00 0.00 0.00 175.76 175.95 2dmz s VAL 74 N -0.37 1.26 -1.52 0.00 1.01 -0.17 -0.16 120.40 120.44 2dmz s VAL 74 Ca -0.05 -0.51 -0.03 0.00 0.00 0.00 0.00 61.98 61.38 2dmz s VAL 74 Cb -0.03 -1.27 0.00 0.00 0.00 0.00 0.00 36.38 35.08 2dmz s VAL 74 CO 0.03 0.34 0.44 -0.67 0.00 0.00 0.00 175.10 175.24 2dmz n ASP 75 N 4.86 -5.84 -0.06 3.32 -0.08 0.29 -1.70 116.55 117.33 2dmz n ASP 75 Ca -0.14 -0.21 -0.01 0.00 -1.51 0.00 0.00 54.79 52.92 2dmz n ASP 75 Cb 0.49 -4.71 -0.00 0.00 2.34 0.00 0.00 41.12 39.24 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 -1.38 0.40 3.08 0.27 0.00 -1.22 -4.84 105.19 101.51 2dmz n GLY 76 Ca -0.14 -1.00 -0.32 0.00 0.00 0.00 0.00 46.02 44.56 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 -2.03 2.09 -0.85 1.61 1.01 -0.69 -5.05 120.40 116.50 2dmz s VAL 77 Ca 0.00 -1.34 -0.26 0.00 0.00 0.00 0.00 61.98 60.38 2dmz s VAL 77 Cb 0.00 -2.09 -0.13 0.00 0.00 0.00 0.00 36.38 34.16 2dmz s VAL 77 CO 0.00 0.19 2.29 0.21 0.00 0.00 0.00 175.10 177.78 2dmz s ASN 78 N 1.19 4.10 -0.04 3.32 3.84 -1.26 -1.00 114.94 125.09 2dmz s ASN 78 Ca -0.03 -0.22 0.04 0.00 0.21 0.00 0.00 52.86 52.85 2dmz s ASN 78 Cb -0.17 -2.56 0.17 0.00 -0.55 0.00 0.00 41.25 38.14 2dmz s ASN 78 CO -0.08 -3.74 0.88 2.30 -2.79 0.00 0.00 177.10 173.66 2dmz n ILE 79 N 8.63 0.49 -1.55 -5.21 -5.35 -0.91 -4.85 119.36 110.61 2dmz n ILE 79 Ca 0.45 -0.28 -0.29 0.00 -0.27 0.00 0.00 62.75 62.36 2dmz n ILE 79 Cb 0.44 -0.29 -0.06 0.00 -1.74 0.00 0.00 39.64 38.00 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 0.09 0.80 0.00 6.28 6.02 -1.14 -0.18 117.38 129.24 2dmz n GLN 80 Ca 0.06 -0.26 0.00 0.00 -0.01 0.00 0.00 57.00 56.78 2dmz n GLN 80 Cb 0.36 -3.34 0.00 0.00 1.02 0.00 0.00 30.24 28.28 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 6.27 2.35 3.63 1.08 0.00 -1.26 -5.07 105.19 112.19 2dmz n GLY 81 Ca 0.43 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.66 1.91 -1.56 1.61 3.01 0.74 -4.92 117.46 117.60 2dmz n PHE 82 Ca 0.00 0.44 -0.34 0.00 1.01 0.00 0.00 57.45 58.57 2dmz n PHE 82 Cb 0.00 -2.44 0.07 0.00 -0.01 0.00 0.00 39.48 37.10 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 0.77 2.25 0.01 4.37 0.00 -1.26 -4.61 121.76 123.28 2dmz s ALA 83 Ca 0.82 0.72 -0.01 0.00 0.00 0.00 0.00 51.96 53.49 2dmz s ALA 83 Cb -0.81 -3.40 -0.00 0.00 0.00 0.00 0.00 23.12 18.90 2dmz s ALA 83 CO 0.42 -1.63 0.75 -1.71 0.00 0.00 0.00 175.76 173.59 2dmz n ASN 84 N -2.63 -0.04 -0.29 0.00 2.85 -1.26 0.93 115.26 114.83 2dmz n ASN 84 Ca 0.12 0.76 0.06 0.00 -0.11 0.00 0.00 54.58 55.40 2dmz n ASN 84 Cb 0.51 -0.35 0.27 0.00 1.24 0.00 0.00 39.78 41.45 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 1.00 -0.27 1.20 2.07 -2.00 0.11 115.15 117.26 2dmz h HIS 85 Ca 0.01 0.03 0.08 0.00 -2.85 0.00 0.00 60.37 57.63 2dmz h HIS 85 Cb 0.01 -0.32 -0.01 0.00 2.57 0.00 0.00 27.41 29.66 2dmz h HIS 85 CO -0.69 0.49 0.21 0.22 -3.07 0.00 0.00 177.93 175.09 2dmz h ASP 86 N 0.95 0.00 0.34 3.10 1.82 0.24 -1.51 116.42 121.36 2dmz h ASP 86 Ca 0.40 0.00 -0.33 0.00 -0.39 0.00 0.00 57.03 56.72 2dmz h ASP 86 Cb 0.32 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.33 2dmz h ASP 86 CO -0.17 0.00 -1.62 0.58 -1.61 0.00 0.00 179.24 176.43 2dmz h VAL 87 N 0.00 1.07 0.01 2.25 2.07 0.14 -3.31 116.25 118.49 2dmz h VAL 87 Ca 0.13 -2.68 0.02 0.00 0.82 0.00 0.00 66.70 64.99 2dmz h VAL 87 Cb 0.55 2.78 -0.03 0.00 -1.52 0.00 0.00 31.29 33.07 2dmz h VAL 87 CO -0.00 0.83 -0.13 0.58 0.02 0.00 0.00 177.57 178.87 2dmz h VAL 88 N 0.09 0.68 -0.88 2.57 2.07 -0.57 -2.20 116.25 118.00 2dmz h VAL 88 Ca -0.28 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.36 2dmz h VAL 88 Cb 2.06 0.68 -0.09 0.00 -1.52 0.00 0.00 31.29 32.42 2dmz h VAL 88 CO 0.17 0.00 0.50 1.05 0.02 0.00 0.00 177.57 179.32 2dmz h GLU 89 N -0.23 0.75 -0.70 1.57 4.11 -1.56 -0.94 114.58 117.57 2dmz h GLU 89 Ca 0.04 -0.04 0.03 0.00 0.07 0.00 0.00 59.36 59.46 2dmz h GLU 89 Cb 0.28 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.32 2dmz h GLU 89 CO -0.12 0.49 0.44 0.28 0.07 0.00 0.00 179.01 180.18 2dmz h VAL 90 N 0.77 1.10 -0.16 -1.06 2.07 -1.50 -0.89 116.25 116.58 2dmz h VAL 90 Ca 0.45 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.67 2dmz h VAL 90 Cb 0.53 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 2dmz h VAL 90 CO -0.30 0.16 0.06 -0.07 0.02 0.00 0.00 177.57 177.44 2dmz h LEU 91 N 0.87 0.22 -0.70 2.57 3.38 -0.63 -2.00 115.31 119.02 2dmz h LEU 91 Ca 0.28 -0.17 0.04 0.00 0.09 0.00 0.00 57.88 58.12 2dmz h LEU 91 Cb 0.01 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 2dmz h LEU 91 CO -0.10 0.33 0.43 0.03 0.09 0.00 0.00 178.44 179.22 2dmz h ARG 92 N 0.10 0.80 -0.89 1.13 3.08 -1.01 -2.10 114.38 115.50 2dmz h ARG 92 Ca 0.05 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2dmz h ARG 92 Cb 0.18 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 2dmz h ARG 92 CO -0.00 0.53 0.51 -0.91 -1.07 0.00 0.00 179.97 179.03 2dmz h ASN 93 N 0.83 1.09 -2.65 7.04 2.35 -1.00 -3.44 115.58 119.79 2dmz h ASN 93 Ca 0.29 -0.08 -0.59 0.00 -0.55 0.00 0.00 56.30 55.37 2dmz h ASN 93 Cb 0.06 -0.28 0.17 0.00 0.05 0.00 0.00 38.32 38.32 2dmz h ASN 93 CO -0.12 0.85 -0.62 0.00 -1.65 0.00 0.00 177.43 175.89 2dmz n ALA 94 N -2.41 -1.73 -2.06 -0.83 0.00 -0.77 -5.00 120.51 107.71 2dmz n ALA 94 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2dmz n ALA 94 Cb 0.08 -1.70 0.00 0.00 0.00 0.00 0.00 19.45 17.83 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 2.00 2.09 0.44 0.00 0.00 -1.26 -5.02 105.19 103.44 2dmz n GLY 95 Ca 0.11 -1.87 -0.19 0.00 0.00 0.00 0.00 46.02 44.06 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 -1.04 -6.26 1.61 4.15 -1.90 -3.38 115.11 108.31 2dmz h GLN 96 Ca 0.00 0.07 -0.53 0.00 0.77 0.00 0.00 58.65 58.96 2dmz h GLN 96 Cb 0.00 0.24 -0.07 0.00 0.21 0.00 0.00 27.48 27.85 2dmz h GLN 96 CO 0.00 -0.69 1.15 0.08 -1.93 0.00 0.00 178.83 177.44 2dmz s VAL 97 N -6.01 3.68 -0.42 2.39 1.01 -1.26 -3.13 120.40 116.65 2dmz s VAL 97 Ca -0.18 0.23 -0.07 0.00 0.00 0.00 0.00 61.98 61.96 2dmz s VAL 97 Cb 0.03 -4.76 0.10 0.00 0.00 0.00 0.00 36.38 31.75 2dmz s VAL 97 CO 0.61 -1.70 0.25 -0.69 0.00 0.00 0.00 175.10 173.58 2dmz s VAL 98 N 6.30 3.85 -0.60 2.92 1.01 -0.38 -4.93 120.40 128.58 2dmz s VAL 98 Ca 0.42 -1.70 -0.22 0.00 0.00 0.00 0.00 61.98 60.48 2dmz s VAL 98 Cb -0.08 -3.48 0.06 0.00 0.00 0.00 0.00 36.38 32.89 2dmz s VAL 98 CO 0.13 -0.61 0.88 -1.00 0.00 0.00 0.00 175.10 174.51 2dmz s HIS 99 N 1.31 2.79 0.01 5.22 3.76 -1.25 -0.26 115.29 126.87 2dmz s HIS 99 Ca 0.05 -0.42 -0.21 0.00 -0.15 0.00 0.00 55.06 54.33 2dmz s HIS 99 Cb -0.24 -4.09 -0.05 0.00 1.11 0.00 0.00 32.58 29.31 2dmz s HIS 99 CO -0.01 -1.44 0.61 -1.17 -0.85 0.00 0.00 174.74 171.88 2dmz s LEU 100 N 3.70 4.43 -0.38 0.89 1.98 0.85 0.10 118.68 130.25 2dmz s LEU 100 Ca 0.23 1.19 -0.06 0.00 -2.89 0.00 0.00 54.13 52.60 2dmz s LEU 100 Cb -0.17 -2.95 0.07 0.00 0.66 0.00 0.00 46.19 43.81 2dmz s LEU 100 CO 0.13 0.11 0.17 -0.89 -1.89 0.00 0.00 176.35 173.98 2dmz s THR 101 N -0.26 3.76 0.25 3.68 2.01 0.77 -1.00 115.64 124.86 2dmz s THR 101 Ca 0.31 -1.43 0.11 0.00 0.31 0.00 0.00 61.69 60.99 2dmz s THR 101 Cb -0.18 -3.28 -0.05 0.00 0.01 0.00 0.00 72.50 69.00 2dmz s THR 101 CO 0.18 -0.39 -0.14 -0.76 -0.69 0.00 0.00 174.62 172.82 2dmz s LEU 102 N 1.34 2.78 -0.19 4.42 1.02 -1.14 -1.83 118.68 125.08 2dmz s LEU 102 Ca 0.01 -0.85 -0.05 0.00 0.02 0.00 0.00 54.13 53.27 2dmz s LEU 102 Cb -0.21 -1.34 0.07 0.00 0.02 0.00 0.00 46.19 44.72 2dmz s LEU 102 CO 0.01 0.05 0.13 0.54 0.02 0.00 0.00 176.35 177.10 2dmz s VAL 103 N -2.24 -0.16 0.13 -1.59 0.11 -1.06 -1.76 120.40 113.83 2dmz s VAL 103 Ca 0.28 -0.18 0.05 0.00 -2.93 0.00 0.00 61.98 59.21 2dmz s VAL 103 Cb -0.06 -0.62 -0.04 0.00 -1.53 0.00 0.00 36.38 34.12 2dmz s VAL 103 CO 0.16 -0.28 0.07 0.00 -3.33 0.00 0.00 175.10 171.71 2dmz s ARG 104 N 2.19 2.72 0.07 1.54 1.70 -1.00 -4.16 118.95 122.01 2dmz s ARG 104 Ca 0.04 -0.87 -0.31 0.00 -0.47 0.00 0.00 55.73 54.12 2dmz s ARG 104 Cb -0.16 -2.58 -0.08 0.00 -0.57 0.00 0.00 34.95 31.56 2dmz s ARG 104 CO -0.11 0.51 1.62 0.50 -1.08 0.00 0.00 175.30 176.74 2dmz s ARG 105 N -2.73 4.21 1.22 3.89 3.52 -1.26 -0.67 118.95 127.13 2dmz s ARG 105 Ca 0.29 2.29 -0.20 0.00 -0.13 0.00 0.00 55.73 57.98 2dmz s ARG 105 Cb -0.11 -3.58 0.32 0.00 -1.56 0.00 0.00 34.95 30.02 2dmz s ARG 105 CO 0.21 -0.71 0.76 1.63 -0.81 0.00 0.00 175.30 176.37 2dmz n LYS 106 N 5.50 -4.28 -3.09 5.12 5.02 0.11 -4.88 118.16 121.65 2dmz n LYS 106 Ca 0.15 -1.26 -0.41 0.00 -2.02 0.00 0.00 58.31 54.78 2dmz n LYS 106 Cb 0.41 -1.58 -0.06 0.00 -0.02 0.00 0.00 35.03 33.78 2dmz n LYS 106 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2dmz s THR 107 N -2.02 4.98 1.02 -0.18 2.01 -1.26 -4.98 115.64 115.21 2dmz s THR 107 Ca 0.57 1.19 -0.12 0.00 0.31 0.00 0.00 61.69 63.65 2dmz s THR 107 Cb -0.09 -3.96 0.18 0.00 0.01 0.00 0.00 72.50 68.64 2dmz s THR 107 CO 0.47 0.04 0.97 -1.54 -0.69 0.00 0.00 174.62 173.88 2dmz n SER 108 N 5.53 -0.71 -4.35 3.53 3.41 -1.26 -4.96 113.62 114.82 2dmz n SER 108 Ca -0.00 0.20 -0.45 0.00 -0.26 0.00 0.00 58.87 58.36 2dmz n SER 108 Cb 0.49 -1.36 -0.07 0.00 -0.26 0.00 0.00 64.21 63.02 2dmz n SER 108 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dmz s SER 109 N -2.46 6.12 -0.18 4.04 1.04 -1.26 -5.05 113.70 115.95 2dmz s SER 109 Ca 0.66 -1.53 -0.12 0.00 0.48 0.00 0.00 55.95 55.43 2dmz s SER 109 Cb -0.23 -2.18 -0.05 0.00 0.10 0.00 0.00 66.02 63.66 2dmz s SER 109 CO 0.62 -0.72 0.23 -0.55 0.98 0.00 0.00 173.24 173.80 2dmz s SER 110 N 2.95 6.34 -0.85 7.02 0.15 -1.26 -5.03 113.70 123.03 2dmz s SER 110 Ca 0.04 0.39 -0.25 0.00 0.70 0.00 0.00 55.95 56.83 2dmz s SER 110 Cb -0.26 -2.15 0.03 0.00 -1.71 0.00 0.00 66.02 61.93 2dmz s SER 110 CO 0.05 0.12 1.39 -0.89 1.20 0.00 0.00 173.24 175.11 2dmz s THR 111 N 0.46 3.78 -0.30 6.45 2.01 -1.26 -4.95 115.64 121.84 2dmz s THR 111 Ca 0.13 -0.09 -0.36 0.00 0.31 0.00 0.00 61.69 61.69 2dmz s THR 111 Cb -0.12 -4.91 -0.12 0.00 0.01 0.00 0.00 72.50 67.36 2dmz s THR 111 CO 0.02 -1.83 2.09 -1.54 -0.69 0.00 0.00 174.62 172.67 2dmz n SER 112 N 9.46 2.39 -2.87 3.53 3.41 -1.26 -4.94 113.62 123.34 2dmz n SER 112 Ca 0.17 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.35 2dmz n SER 112 Cb 0.50 -1.27 0.00 0.00 -0.26 0.00 0.00 64.21 63.18 2dmz n SER 112 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2dmz n PRO 113 N 7.62 -0.29 0.11 4.33 -0.04 -1.26 -4.99 135.00 140.47 2dmz n PRO 113 Ca 0.36 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.59 2dmz n PRO 113 Cb 0.23 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.54 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 0.69 -6.07 1.53 8.10 -2.07 -3.40 115.31 114.10 2dmz h LEU 114 Ca 0.00 -0.86 -0.57 0.00 0.11 0.00 0.00 57.88 56.55 2dmz h LEU 114 Cb 0.00 -0.22 -0.40 0.00 -0.44 0.00 0.00 40.66 39.59 2dmz h LEU 114 CO 0.00 1.70 -0.90 1.21 -4.11 0.00 0.00 178.44 176.34 2dmz n GLU 115 N -3.63 1.47 -2.25 0.17 2.13 -1.26 -5.11 120.64 112.16 2dmz n GLU 115 Ca -0.20 -3.82 -0.40 0.00 0.66 0.00 0.00 57.16 53.40 2dmz n GLU 115 Cb 1.08 -1.65 -0.03 0.00 0.27 0.00 0.00 31.44 31.12 2dmz n GLU 115 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 2dmz s PRO 116 N -1.75 4.41 -0.33 5.31 0.04 -1.26 -4.95 135.00 136.46 2dmz s PRO 116 Ca 0.37 2.04 -0.29 0.00 0.04 0.00 0.00 61.00 63.16 2dmz s PRO 116 Cb 0.17 -3.06 -0.01 0.00 0.04 0.00 0.00 34.50 31.64 2dmz s PRO 116 CO -0.07 -0.08 1.68 -1.25 0.04 0.00 0.00 177.00 177.33 2dmz s PRO 117 N -1.75 3.46 0.19 0.56 0.04 -1.26 -4.99 135.00 131.25 2dmz s PRO 117 Ca 0.49 1.36 0.10 0.00 0.04 0.00 0.00 61.00 62.98 2dmz s PRO 117 Cb -0.36 -4.13 -0.04 0.00 0.04 0.00 0.00 34.50 30.00 2dmz s PRO 117 CO 0.47 -1.70 -0.21 -1.54 0.04 0.00 0.00 177.00 174.06 2dmz s SER 118 N 5.31 3.07 0.02 6.66 1.04 -1.26 -5.15 113.70 123.39 2dmz s SER 118 Ca 0.75 -0.88 -0.11 0.00 0.48 0.00 0.00 55.95 56.19 2dmz s SER 118 Cb -0.21 -0.21 0.01 0.00 0.10 0.00 0.00 66.02 65.71 2dmz s SER 118 CO 0.33 0.04 0.23 -0.62 0.98 0.00 0.00 173.24 174.19 2dmz s ASP 119 N -2.73 -0.05 0.88 7.02 2.15 -1.26 -5.16 116.67 117.52 2dmz s ASP 119 Ca 0.19 -0.20 -0.11 0.00 0.43 0.00 0.00 52.55 52.85 2dmz s ASP 119 Cb -0.07 0.29 0.12 0.00 -0.30 0.00 0.00 42.92 42.96 2dmz s ASP 119 CO 0.09 -0.51 1.11 -2.11 -0.17 0.00 0.00 175.17 173.58 2dmz n ARG 120 N 0.95 -0.21 0.00 4.34 1.85 -1.26 -5.02 116.66 117.31 2dmz n ARG 120 Ca -0.20 0.01 0.00 0.00 -1.00 0.00 0.00 57.85 56.66 2dmz n ARG 120 Cb 0.58 -2.36 0.00 0.00 -1.05 0.00 0.00 32.46 29.63 2dmz n ARG 120 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2dmz n GLY 121 N 0.47 3.37 3.57 2.89 0.00 -1.26 -5.19 105.19 109.04 2dmz n GLY 121 Ca 0.12 -0.09 -0.09 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.61 0.00 -0.03 2.61 -1.32 -1.26 -5.17 115.64 109.86 2dmz s THR 122 Ca 0.00 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.52 2dmz s THR 122 Cb 0.00 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 69.98 2dmz s THR 122 CO 0.00 0.00 -0.16 -0.69 -2.21 0.00 0.00 174.62 171.56 2dmz s VAL 123 N -1.47 1.32 0.67 5.08 1.01 -1.26 -5.15 120.40 120.61 2dmz s VAL 123 Ca 0.01 -0.68 -0.01 0.00 0.00 0.00 0.00 61.98 61.29 2dmz s VAL 123 Cb -0.01 -1.13 0.09 0.00 0.00 0.00 0.00 36.38 35.34 2dmz s VAL 123 CO -0.01 0.38 0.93 -0.94 0.00 0.00 0.00 175.10 175.47 2dmz s SER 124 N -0.11 4.67 -0.31 3.32 1.04 -1.26 -5.11 113.70 115.95 2dmz s SER 124 Ca 0.00 -0.14 -0.07 0.00 0.48 0.00 0.00 55.95 56.23 2dmz s SER 124 Cb -0.09 -0.43 0.19 0.00 0.10 0.00 0.00 66.02 65.78 2dmz s SER 124 CO 0.01 -1.62 0.95 -0.83 0.98 0.00 0.00 173.24 172.73 2dmz s GLY 125 N -4.61 -1.14 0.02 7.32 0.00 -1.26 -5.14 107.32 102.51 2dmz s GLY 125 Ca 0.63 1.63 -0.30 0.00 0.00 0.00 0.00 44.72 46.68 2dmz s GLY 125 CO 0.43 4.06 1.43 2.56 0.00 0.00 0.00 173.10 181.57 2dmz s PRO 126 N 2.64 4.28 -0.58 2.90 0.04 -1.26 -4.99 135.00 138.03 2dmz s PRO 126 Ca 0.21 2.02 0.04 0.00 0.04 0.00 0.00 61.00 63.31 2dmz s PRO 126 Cb -0.02 -3.53 0.14 0.00 0.04 0.00 0.00 34.50 31.13 2dmz s PRO 126 CO -0.20 -0.57 0.34 0.45 0.04 0.00 0.00 177.00 177.05 2dmz s SER 127 N 1.84 4.53 -0.17 6.66 0.15 -1.26 -5.08 113.70 120.37 2dmz s SER 127 Ca 0.65 -3.26 -0.24 0.00 0.70 0.00 0.00 55.95 53.81 2dmz s SER 127 Cb -0.33 -1.65 -0.02 0.00 -1.71 0.00 0.00 66.02 62.30 2dmz s SER 127 CO 0.28 -0.20 0.76 -0.94 1.20 0.00 0.00 173.24 174.34 2dmz s SER 128 N -0.57 6.88 0.00 5.45 1.04 -1.26 -5.38 113.70 119.85 2dmz s SER 128 Ca 0.19 1.07 0.00 0.00 0.48 0.00 0.00 55.95 57.69 2dmz s SER 128 Cb -0.19 -2.42 0.00 0.00 0.10 0.00 0.00 66.02 63.51 2dmz s SER 128 CO -0.05 -0.33 0.00 0.61 0.98 0.00 0.00 173.24 174.45