#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 6.05 0.11 1.61 0.15 -1.26 -4.98 113.70 115.38 2dmz s SER 2 Ca 0.00 0.15 0.05 0.00 0.70 0.00 0.00 55.95 56.85 2dmz s SER 2 Cb 0.00 -2.55 -0.04 0.00 -1.71 0.00 0.00 66.02 61.73 2dmz s SER 2 CO 0.00 -1.80 -0.12 -0.55 1.20 0.00 0.00 173.24 171.97 2dmz s SER 3 N 4.66 1.73 0.00 5.45 0.15 -1.26 -5.11 113.70 119.32 2dmz s SER 3 Ca 0.50 -0.80 0.00 0.00 0.70 0.00 0.00 55.95 56.36 2dmz s SER 3 Cb -0.10 -0.03 0.00 0.00 -1.71 0.00 0.00 66.02 64.17 2dmz s SER 3 CO 0.23 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.09 2dmz n GLY 4 N 0.60 -0.86 3.55 9.45 0.00 -1.26 -5.09 105.19 111.58 2dmz n GLY 4 Ca -0.16 0.81 -0.31 0.00 0.00 0.00 0.00 46.02 46.36 2dmz n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dmz s SER 5 N 0.00 4.36 -1.02 1.61 0.15 -1.26 -4.87 113.70 112.67 2dmz s SER 5 Ca 0.00 0.77 -0.07 0.00 0.70 0.00 0.00 55.95 57.35 2dmz s SER 5 Cb 0.00 -2.51 0.26 0.00 -1.71 0.00 0.00 66.02 62.05 2dmz s SER 5 CO 0.00 -3.09 0.98 -0.55 1.20 0.00 0.00 173.24 171.79 2dmz s SER 6 N 11.62 6.89 0.00 5.45 0.15 -1.26 -4.97 113.70 131.57 2dmz s SER 6 Ca 0.94 -3.55 0.00 0.00 0.70 0.00 0.00 55.95 54.04 2dmz s SER 6 Cb -0.16 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 62.03 2dmz s SER 6 CO 0.21 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 174.98 2dmz n GLY 7 N 2.71 0.31 3.40 9.45 0.00 -1.26 -5.06 105.19 114.74 2dmz n GLY 7 Ca 0.22 -2.24 -0.11 0.00 0.00 0.00 0.00 46.02 43.90 2dmz n GLY 7 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dmz s GLY 8 N 0.00 -0.41 0.16 -0.02 0.00 -1.26 -4.99 107.32 100.79 2dmz s GLY 8 Ca 0.00 1.68 -0.09 0.00 0.00 0.00 0.00 44.72 46.32 2dmz s GLY 8 CO 0.00 1.66 0.27 -0.45 0.00 0.00 0.00 173.10 174.58 2dmz s SER 9 N 1.01 0.06 -0.30 1.64 0.15 -1.26 -4.76 113.70 110.24 2dmz s SER 9 Ca -0.06 -0.87 -0.09 0.00 0.70 0.00 0.00 55.95 55.63 2dmz s SER 9 Cb -0.06 0.42 0.18 0.00 -1.71 0.00 0.00 66.02 64.85 2dmz s SER 9 CO -0.09 -0.88 0.90 1.51 1.20 0.00 0.00 173.24 175.88 2dmz s ASP 10 N -2.96 -0.77 0.20 5.45 -4.77 -1.26 -4.61 116.67 107.95 2dmz s ASP 10 Ca 0.17 0.53 0.11 0.00 -3.30 0.00 0.00 52.55 50.06 2dmz s ASP 10 Cb 0.04 1.67 -0.04 0.00 -1.09 0.00 0.00 42.92 43.49 2dmz s ASP 10 CO -0.01 -0.14 -0.22 -0.55 0.70 0.00 0.00 175.17 174.95 2dmz s SER 11 N 2.88 3.27 -1.00 2.11 0.15 -1.26 -4.78 113.70 115.07 2dmz s SER 11 Ca 0.06 -0.89 -0.13 0.00 0.70 0.00 0.00 55.95 55.68 2dmz s SER 11 Cb -0.11 -0.24 0.02 0.00 -1.71 0.00 0.00 66.02 63.98 2dmz s SER 11 CO -0.15 0.07 0.24 -1.20 1.20 0.00 0.00 173.24 173.40 2dmz n SER 12 N 0.12 -1.11 -0.67 5.45 7.64 -1.26 -4.66 113.62 119.14 2dmz n SER 12 Ca -0.11 -0.94 0.51 0.00 1.01 0.00 0.00 58.87 59.34 2dmz n SER 12 Cb 0.57 -1.15 0.80 0.00 -1.01 0.00 0.00 64.21 63.42 2dmz n SER 12 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2dmz h LEU 13 N -1.05 0.04 -9.73 -3.43 4.07 -1.97 -3.37 115.31 99.87 2dmz h LEU 13 Ca -0.50 0.03 -0.65 0.00 0.08 0.00 0.00 57.88 56.84 2dmz h LEU 13 Cb 1.02 0.03 -0.07 0.00 1.08 0.00 0.00 40.66 42.72 2dmz h LEU 13 CO 0.45 -0.05 -0.52 -0.36 -1.08 0.00 0.00 178.44 176.88 2dmz s PHE 14 N -4.93 3.48 -0.02 1.13 0.40 -1.26 -0.38 117.98 116.39 2dmz s PHE 14 Ca -0.05 0.32 0.07 0.00 -0.60 0.00 0.00 56.93 56.67 2dmz s PHE 14 Cb 0.28 -1.81 -0.02 0.00 0.51 0.00 0.00 43.02 41.98 2dmz s PHE 14 CO 0.88 0.62 -0.22 -1.83 0.70 0.00 0.00 175.22 175.38 2dmz s GLU 15 N -1.83 2.22 -0.13 0.44 -1.05 -0.31 -4.88 118.70 113.14 2dmz s GLU 15 Ca 0.25 -0.87 -0.06 0.00 -0.15 0.00 0.00 54.97 54.15 2dmz s GLU 15 Cb -0.12 -2.15 -0.04 0.00 -0.44 0.00 0.00 34.13 31.38 2dmz s GLU 15 CO 0.17 0.58 0.08 0.99 0.95 0.00 0.00 175.26 178.02 2dmz s THR 16 N -0.67 4.98 0.02 1.83 2.01 -1.26 -2.29 115.64 120.26 2dmz s THR 16 Ca 0.11 0.02 0.01 0.00 0.31 0.00 0.00 61.69 62.14 2dmz s THR 16 Cb -0.10 -3.17 -0.02 0.00 0.01 0.00 0.00 72.50 69.22 2dmz s THR 16 CO -0.00 0.57 -0.05 -0.72 -0.69 0.00 0.00 174.62 173.73 2dmz s TYR 17 N -0.61 0.46 -0.15 4.92 1.13 -0.73 -5.00 117.35 117.36 2dmz s TYR 17 Ca 0.12 -0.38 -0.12 0.00 -1.41 0.00 0.00 57.07 55.28 2dmz s TYR 17 Cb -0.12 -0.29 -0.05 0.00 -1.10 0.00 0.00 41.96 40.41 2dmz s TYR 17 CO 0.02 -0.09 0.23 -0.80 -2.51 0.00 0.00 175.55 172.40 2dmz s ASN 18 N -1.11 6.40 -0.23 -0.18 0.01 -1.26 -2.71 114.94 115.86 2dmz s ASN 18 Ca -0.08 0.46 0.02 0.00 -0.71 0.00 0.00 52.86 52.55 2dmz s ASN 18 Cb -0.07 -2.14 0.04 0.00 0.41 0.00 0.00 41.25 39.49 2dmz s ASN 18 CO -0.00 0.20 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.96 2dmz s VAL 19 N 0.01 2.19 -0.45 1.60 1.01 0.13 -4.90 120.40 119.99 2dmz s VAL 19 Ca 0.14 -1.35 -0.23 0.00 0.00 0.00 0.00 61.98 60.54 2dmz s VAL 19 Cb -0.13 -2.15 0.03 0.00 0.00 0.00 0.00 36.38 34.13 2dmz s VAL 19 CO 0.03 0.18 0.79 -0.70 0.00 0.00 0.00 175.10 175.40 2dmz s GLU 20 N 1.18 3.41 0.03 2.72 2.12 -1.26 0.03 118.70 126.94 2dmz s GLU 20 Ca -0.03 -0.09 -0.08 0.00 0.36 0.00 0.00 54.97 55.12 2dmz s GLU 20 Cb -0.17 -3.94 -0.05 0.00 0.26 0.00 0.00 34.13 30.23 2dmz s GLU 20 CO -0.08 -1.12 0.32 -0.51 -0.54 0.00 0.00 175.26 173.33 2dmz s LEU 21 N 3.31 4.37 -0.12 2.70 1.43 0.03 -4.91 118.68 125.49 2dmz s LEU 21 Ca 0.30 0.65 -0.04 0.00 -1.03 0.00 0.00 54.13 54.02 2dmz s LEU 21 Cb -0.12 -2.78 -0.03 0.00 0.03 0.00 0.00 46.19 43.29 2dmz s LEU 21 CO 0.23 0.23 0.01 0.54 0.23 0.00 0.00 176.35 177.59 2dmz s VAL 22 N -1.33 4.39 -0.37 -1.59 0.11 -1.26 -2.75 120.40 117.60 2dmz s VAL 22 Ca 0.29 -0.20 -0.04 0.00 -2.93 0.00 0.00 61.98 59.10 2dmz s VAL 22 Cb -0.14 -2.89 0.08 0.00 -1.53 0.00 0.00 36.38 31.90 2dmz s VAL 22 CO 0.17 0.56 0.14 -0.13 -3.33 0.00 0.00 175.10 172.50 2dmz s ARG 23 N -0.40 2.33 1.07 1.54 0.52 -1.24 -4.69 118.95 118.08 2dmz s ARG 23 Ca 0.08 -1.49 -0.15 0.00 -0.52 0.00 0.00 55.73 53.64 2dmz s ARG 23 Cb -0.12 -3.48 0.18 0.00 0.52 0.00 0.00 34.95 32.04 2dmz s ARG 23 CO 0.02 -0.86 0.30 1.63 0.02 0.00 0.00 175.30 176.42 2dmz n LYS 24 N 4.70 -2.39 -1.92 3.54 4.76 -1.26 -4.65 118.16 120.94 2dmz n LYS 24 Ca -0.08 -0.70 -0.24 0.00 -2.87 0.00 0.00 58.31 54.41 2dmz n LYS 24 Cb 0.43 -1.55 -0.08 0.00 -1.84 0.00 0.00 35.03 31.99 2dmz n LYS 24 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2dmz s ASP 25 N -2.05 4.52 0.00 4.39 2.15 -1.26 -2.42 116.67 122.00 2dmz s ASP 25 Ca 0.42 -1.44 0.00 0.00 0.43 0.00 0.00 52.55 51.96 2dmz s ASP 25 Cb -0.07 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 39.95 2dmz s ASP 25 CO 0.41 -3.61 0.00 0.61 -0.17 0.00 0.00 175.17 172.41 2dmz n GLY 26 N 5.92 0.95 3.12 2.66 0.00 -1.26 -5.12 105.19 111.46 2dmz n GLY 26 Ca 0.44 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.17 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 0.09 2.42 0.84 1.61 0.74 -1.02 -5.14 119.66 119.21 2dmz s GLN 27 Ca 0.00 -0.66 -0.10 0.00 0.05 0.00 0.00 55.36 54.66 2dmz s GLN 27 Cb 0.00 -1.91 0.14 0.00 1.10 0.00 0.00 33.01 32.35 2dmz s GLN 27 CO 0.00 0.08 1.16 -1.12 -0.55 0.00 0.00 175.29 174.87 2dmz s SER 28 N 0.56 3.88 -0.00 6.67 0.01 -1.26 -4.55 113.70 119.01 2dmz s SER 28 Ca -0.15 0.16 -0.01 0.00 1.31 0.00 0.00 55.95 57.26 2dmz s SER 28 Cb -0.17 -0.45 -0.01 0.00 0.21 0.00 0.00 66.02 65.61 2dmz s SER 28 CO 0.05 -2.22 0.62 0.25 0.41 0.00 0.00 173.24 172.35 2dmz h LEU 29 N -1.10 -0.03 -0.73 2.44 5.85 -1.98 -3.36 115.31 116.40 2dmz h LEU 29 Ca -0.42 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.30 2dmz h LEU 29 Cb 1.27 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.30 2dmz h LEU 29 CO 0.45 -0.01 0.00 0.61 -0.34 0.00 0.00 178.44 179.15 2dmz n GLY 30 N 0.17 0.79 2.93 3.75 0.00 -1.26 -3.35 105.19 108.22 2dmz n GLY 30 Ca -0.00 -0.32 -0.29 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.36 1.35 0.02 -0.61 1.01 -1.26 -1.87 121.20 117.47 2dmz s ILE 31 Ca 0.00 -0.85 -0.19 0.00 0.00 0.00 0.00 60.65 59.61 2dmz s ILE 31 Cb 0.00 -1.51 -0.06 0.00 0.01 0.00 0.00 42.46 40.90 2dmz s ILE 31 CO 0.00 0.10 0.54 -0.13 0.00 0.00 0.00 174.94 175.44 2dmz s ARG 32 N 1.52 4.20 0.36 2.79 1.81 0.94 -4.99 118.95 125.58 2dmz s ARG 32 Ca -0.01 0.65 0.08 0.00 -1.72 0.00 0.00 55.73 54.73 2dmz s ARG 32 Cb -0.16 -3.28 -0.05 0.00 -0.45 0.00 0.00 34.95 31.00 2dmz s ARG 32 CO -0.08 0.53 0.10 0.96 -0.68 0.00 0.00 175.30 176.13 2dmz s ILE 33 N -0.67 2.63 0.03 1.52 -4.36 -1.26 0.24 121.20 119.31 2dmz s ILE 33 Ca 0.28 -1.81 0.01 0.00 -0.26 0.00 0.00 60.65 58.87 2dmz s ILE 33 Cb -0.18 -2.91 -0.02 0.00 1.25 0.00 0.00 42.46 40.60 2dmz s ILE 33 CO 0.17 -0.13 -0.05 0.54 0.24 0.00 0.00 174.94 175.70 2dmz s VAL 34 N -2.52 0.34 -0.45 8.37 0.11 0.13 -4.42 120.40 121.97 2dmz s VAL 34 Ca 0.37 -0.92 -0.13 0.00 -2.93 0.00 0.00 61.98 58.37 2dmz s VAL 34 Cb 0.01 -0.43 0.07 0.00 -1.53 0.00 0.00 36.38 34.50 2dmz s VAL 34 CO 0.21 -0.39 0.34 -0.83 -3.33 0.00 0.00 175.10 171.10 2dmz s GLY 35 N -1.39 2.01 0.25 6.54 0.00 -1.26 -2.49 107.32 110.98 2dmz s GLY 35 Ca -0.11 -2.08 -0.06 0.00 0.00 0.00 0.00 44.72 42.46 2dmz s GLY 35 CO -0.00 1.01 0.53 -0.19 0.00 0.00 0.00 173.10 174.45 2dmz s TYR 36 N 1.57 3.46 0.00 1.90 2.02 -0.55 -4.98 117.35 120.76 2dmz s TYR 36 Ca 0.04 0.71 0.00 0.00 -0.37 0.00 0.00 57.07 57.45 2dmz s TYR 36 Cb -0.23 -2.15 0.00 0.00 -0.40 0.00 0.00 41.96 39.18 2dmz s TYR 36 CO 0.05 0.24 0.00 1.33 -1.57 0.00 0.00 175.55 175.60 2dmz n VAL 37 N -0.53 0.00 -1.82 0.71 0.24 -1.26 -3.33 118.33 112.34 2dmz n VAL 37 Ca -0.01 0.00 -0.02 0.00 -2.04 0.00 0.00 64.34 62.27 2dmz n VAL 37 Cb 0.53 -0.47 0.01 0.00 -1.47 0.00 0.00 33.84 32.44 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 1.77 0.58 0.22 7.63 0.00 -0.98 -4.58 105.19 109.83 2dmz n GLY 38 Ca 0.00 -0.21 -0.08 0.00 0.00 0.00 0.00 46.02 45.73 2dmz n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dmz h THR 39 N -0.16 1.20 -3.62 2.61 1.03 -1.97 -3.44 112.91 108.56 2dmz h THR 39 Ca -0.08 -0.59 -0.56 0.00 -0.01 0.00 0.00 66.41 65.16 2dmz h THR 39 Cb 1.04 0.67 0.17 0.00 -1.07 0.00 0.00 68.15 68.97 2dmz h THR 39 CO 0.06 0.23 0.07 -0.24 -0.01 0.00 0.00 175.52 175.63 2dmz n SER 40 N -4.59 0.49 -1.84 0.00 2.88 -1.26 -4.87 113.62 104.42 2dmz n SER 40 Ca 0.02 0.74 -0.17 0.00 -1.33 0.00 0.00 58.87 58.13 2dmz n SER 40 Cb 0.13 -1.38 0.08 0.00 -0.75 0.00 0.00 64.21 62.30 2dmz n SER 40 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dmz n HIS 41 N -2.05 1.90 -3.91 0.66 1.44 -1.26 -4.85 115.22 107.15 2dmz n HIS 41 Ca 0.13 -1.68 -0.15 0.00 -2.01 0.00 0.00 57.72 54.02 2dmz n HIS 41 Cb 0.48 -0.83 -0.15 0.00 0.12 0.00 0.00 29.99 29.61 2dmz n HIS 41 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 2dmz s THR 42 N -2.36 0.10 -0.42 0.61 -4.23 -1.26 -4.97 115.64 103.11 2dmz s THR 42 Ca 0.36 0.04 -0.32 0.00 -1.18 0.00 0.00 61.69 60.59 2dmz s THR 42 Cb 0.30 -0.14 0.05 0.00 1.34 0.00 0.00 72.50 74.04 2dmz s THR 42 CO 0.04 0.07 0.61 0.61 -0.54 0.00 0.00 174.62 175.42 2dmz n GLY 43 N 3.58 -0.22 3.41 3.99 0.00 -1.26 -4.60 105.19 110.08 2dmz n GLY 43 Ca -0.20 1.13 -0.50 0.00 0.00 0.00 0.00 46.02 46.45 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 -0.13 0.59 -4.00 1.61 2.13 -1.26 -4.89 120.64 114.70 2dmz n GLU 44 Ca -0.04 0.13 -0.31 0.00 0.66 0.00 0.00 57.16 57.61 2dmz n GLU 44 Cb 0.62 -2.12 -0.15 0.00 0.27 0.00 0.00 31.44 30.06 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 7.69 2.81 -0.02 4.31 0.00 -1.26 -5.07 121.76 130.23 2dmz s ALA 45 Ca 1.16 -2.49 0.01 0.00 0.00 0.00 0.00 51.96 50.64 2dmz s ALA 45 Cb -1.04 -1.95 0.01 0.00 0.00 0.00 0.00 23.12 20.14 2dmz s ALA 45 CO 0.52 -1.69 -0.02 -1.54 0.00 0.00 0.00 175.76 173.02 2dmz s SER 46 N 0.94 0.45 0.00 0.00 1.04 -1.26 -2.32 113.70 112.56 2dmz s SER 46 Ca 0.11 -0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.49 2dmz s SER 46 Cb -0.19 -0.15 0.00 0.00 0.10 0.00 0.00 66.02 65.78 2dmz s SER 46 CO -0.09 -0.02 0.00 0.61 0.98 0.00 0.00 173.24 174.72 2dmz n GLY 47 N 3.53 -0.64 3.62 7.32 0.00 -1.21 -4.97 105.19 112.83 2dmz n GLY 47 Ca -0.19 -1.54 -0.38 0.00 0.00 0.00 0.00 46.02 43.91 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 -2.30 5.26 0.16 -0.61 -1.09 -1.26 -1.49 121.20 119.88 2dmz s ILE 48 Ca 0.00 0.37 0.10 0.00 -2.23 0.00 0.00 60.65 58.88 2dmz s ILE 48 Cb 0.00 -3.60 -0.04 0.00 -1.58 0.00 0.00 42.46 37.24 2dmz s ILE 48 CO 0.00 0.24 -0.22 -0.31 -1.23 0.00 0.00 174.94 173.42 2dmz s TYR 49 N 1.67 2.04 -0.46 3.97 1.51 -1.04 -1.55 117.35 123.50 2dmz s TYR 49 Ca 0.11 -0.41 -0.28 0.00 -1.01 0.00 0.00 57.07 55.48 2dmz s TYR 49 Cb -0.15 -1.04 -0.01 0.00 -0.11 0.00 0.00 41.96 40.65 2dmz s TYR 49 CO 0.09 0.38 1.72 0.08 -1.11 0.00 0.00 175.55 176.71 2dmz s VAL 50 N -1.68 3.53 0.10 0.71 1.01 0.05 0.23 120.40 124.34 2dmz s VAL 50 Ca 0.16 0.47 -0.16 0.00 0.00 0.00 0.00 61.98 62.46 2dmz s VAL 50 Cb -0.08 -3.90 -0.08 0.00 0.00 0.00 0.00 36.38 32.33 2dmz s VAL 50 CO 0.07 -0.70 1.45 0.50 0.00 0.00 0.00 175.10 176.42 2dmz h LYS 51 N 13.07 0.66 -2.68 2.72 1.63 -0.43 -3.28 116.57 128.26 2dmz h LYS 51 Ca -0.29 -0.30 0.11 0.00 -0.85 0.00 0.00 60.65 59.31 2dmz h LYS 51 Cb 1.15 -0.01 -0.08 0.00 -0.60 0.00 0.00 32.23 32.69 2dmz h LYS 51 CO 1.12 0.90 0.35 -1.12 -3.45 0.00 0.00 179.45 177.25 2dmz s SER 52 N -6.39 -0.27 -0.13 4.20 0.01 -1.17 -4.84 113.70 105.11 2dmz s SER 52 Ca -0.13 -0.42 -0.04 0.00 1.31 0.00 0.00 55.95 56.67 2dmz s SER 52 Cb 0.09 0.59 0.05 0.00 0.21 0.00 0.00 66.02 66.96 2dmz s SER 52 CO 0.81 -1.08 0.10 -0.69 0.41 0.00 0.00 173.24 172.79 2dmz s VAL 53 N -3.59 -0.12 0.26 3.43 1.01 -1.26 -0.04 120.40 120.10 2dmz s VAL 53 Ca 0.10 0.03 -0.31 0.00 0.00 0.00 0.00 61.98 61.80 2dmz s VAL 53 Cb -0.03 -0.45 -0.13 0.00 0.00 0.00 0.00 36.38 35.77 2dmz s VAL 53 CO 0.02 -0.13 1.47 -0.38 0.00 0.00 0.00 175.10 176.08 2dmz n ILE 54 N 5.29 1.02 -1.23 2.22 -0.00 -0.78 -4.88 119.36 121.00 2dmz n ILE 54 Ca -0.06 -0.25 -0.30 0.00 -0.00 0.00 0.00 62.75 62.14 2dmz n ILE 54 Cb 0.49 -1.66 0.12 0.00 -0.00 0.00 0.00 39.64 38.59 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 -0.50 1.74 -1.21 0.38 0.04 -1.26 -3.57 135.00 130.61 2dmz s PRO 55 Ca 0.66 0.99 -0.01 0.00 0.04 0.00 0.00 61.00 62.68 2dmz s PRO 55 Cb -0.59 -1.85 0.01 0.00 0.04 0.00 0.00 34.50 32.11 2dmz s PRO 55 CO 0.50 -1.96 0.06 0.41 0.04 0.00 0.00 177.00 176.05 2dmz n GLY 56 N -1.16 -0.50 2.92 0.56 0.00 -1.26 -4.95 105.19 100.80 2dmz n GLY 56 Ca 0.08 0.01 -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 -1.14 0.00 0.00 0.00 173.32 172.18 2dmz n SER 57 N -1.91 2.76 -0.02 1.61 3.41 -1.23 -4.93 113.62 113.31 2dmz n SER 57 Ca -0.15 -2.62 -0.12 0.00 -0.26 0.00 0.00 58.87 55.72 2dmz n SER 57 Cb 0.62 0.13 -0.07 0.00 -0.26 0.00 0.00 64.21 64.63 2dmz n SER 57 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dmz h ALA 58 N 0.96 0.12 0.37 7.33 0.00 -1.71 0.58 119.26 126.91 2dmz h ALA 58 Ca -0.30 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 2dmz h ALA 58 Cb 1.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2dmz h ALA 58 CO 0.49 -0.24 -0.18 0.00 0.00 0.00 0.00 179.25 179.32 2dmz h ALA 59 N 0.79 -0.50 0.33 0.00 0.00 -1.86 -1.71 119.26 116.31 2dmz h ALA 59 Ca 0.03 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 2dmz h ALA 59 Cb 0.27 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2dmz h ALA 59 CO 0.00 -0.71 -0.29 -0.92 0.00 0.00 0.00 179.25 177.34 2dmz h TYR 60 N -0.65 -0.76 -0.48 0.00 3.20 -1.74 -2.35 116.97 114.20 2dmz h TYR 60 Ca -0.05 0.00 0.10 0.00 3.14 0.00 0.00 58.73 61.92 2dmz h TYR 60 Cb 0.47 0.29 -0.10 0.00 1.54 0.00 0.00 36.73 38.93 2dmz h TYR 60 CO -0.02 -0.42 -0.25 0.45 -1.64 0.00 0.00 178.16 176.29 2dmz h HIS 61 N -0.63 -0.65 -0.42 -3.82 3.86 -0.90 -1.33 115.15 111.26 2dmz h HIS 61 Ca -0.02 0.06 0.09 0.00 -1.16 0.00 0.00 60.37 59.33 2dmz h HIS 61 Cb 0.56 0.36 -0.09 0.00 1.06 0.00 0.00 27.41 29.30 2dmz h HIS 61 CO -0.16 -0.33 -0.20 -0.97 0.86 0.00 0.00 177.93 177.13 2dmz h ASN 62 N -0.14 -0.70 -0.33 2.45 -1.24 -1.08 -3.46 115.58 111.08 2dmz h ASN 62 Ca 0.22 0.16 0.00 0.00 0.71 0.00 0.00 56.30 57.39 2dmz h ASN 62 Cb 0.49 0.37 0.00 0.00 0.73 0.00 0.00 38.32 39.92 2dmz h ASN 62 CO -0.57 -0.23 0.00 0.61 -1.29 0.00 0.00 177.43 175.95 2dmz n GLY 63 N -1.38 0.72 0.00 1.57 0.00 -0.50 -4.95 105.19 100.65 2dmz n GLY 63 Ca 0.02 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 -3.07 0.00 -3.84 1.61 8.25 -1.26 -4.99 115.22 111.91 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 0.44 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.42 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 -1.57 3.13 0.33 1.59 1.01 -1.26 -5.07 121.20 119.36 2dmz s ILE 65 Ca 0.00 -1.73 -0.02 0.00 0.00 0.00 0.00 60.65 58.90 2dmz s ILE 65 Cb 0.00 -2.99 -0.00 0.00 0.01 0.00 0.00 42.46 39.47 2dmz s ILE 65 CO 0.00 -0.41 0.43 0.00 0.00 0.00 0.00 174.94 174.96 2dmz s GLN 66 N 1.19 1.82 1.00 2.79 0.00 -1.26 -4.50 119.66 120.70 2dmz s GLN 66 Ca 0.02 -1.75 -0.18 0.00 -0.00 0.00 0.00 55.36 53.45 2dmz s GLN 66 Cb -0.21 0.42 -0.12 0.00 0.00 0.00 0.00 33.01 33.10 2dmz s GLN 66 CO -0.03 -0.74 -0.69 1.33 0.00 0.00 0.00 175.29 175.16 2dmz n VAL 67 N -0.54 0.00 -3.23 3.63 0.24 -1.26 -3.57 118.33 113.60 2dmz n VAL 67 Ca 0.02 -0.36 -0.16 0.00 -2.04 0.00 0.00 64.34 61.80 2dmz n VAL 67 Cb 0.62 -0.13 0.07 0.00 -1.47 0.00 0.00 33.84 32.93 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 2.47 -3.32 -3.80 -1.34 3.02 -1.24 -4.95 115.26 106.11 2dmz n ASN 68 Ca -0.00 -0.47 -0.13 0.00 -0.03 0.00 0.00 54.58 53.95 2dmz n ASN 68 Cb 0.59 -4.18 -0.11 0.00 -0.61 0.00 0.00 39.78 35.47 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 -3.78 -0.20 -0.20 6.41 1.01 -1.23 -5.00 116.67 113.67 2dmz s ASP 69 Ca 0.17 0.35 -0.06 0.00 0.71 0.00 0.00 52.55 53.73 2dmz s ASP 69 Cb -0.08 0.43 -0.03 0.00 1.01 0.00 0.00 42.92 44.26 2dmz s ASP 69 CO 0.58 -0.16 0.02 -0.75 0.21 0.00 0.00 175.17 175.08 2dmz s LYS 70 N -0.21 3.69 -0.19 8.23 2.20 -1.26 -0.77 119.74 131.43 2dmz s LYS 70 Ca -0.03 -0.48 -0.13 0.00 -0.36 0.00 0.00 55.97 54.97 2dmz s LYS 70 Cb -0.03 -3.13 -0.05 0.00 -1.51 0.00 0.00 37.83 33.11 2dmz s LYS 70 CO 0.01 0.04 0.26 0.42 -0.36 0.00 0.00 175.35 175.73 2dmz s ILE 71 N 0.94 5.31 -0.14 5.43 1.01 -0.59 -2.69 121.20 130.47 2dmz s ILE 71 Ca 0.02 0.46 0.10 0.00 0.00 0.00 0.00 60.65 61.23 2dmz s ILE 71 Cb -0.14 -3.60 -0.16 0.00 0.01 0.00 0.00 42.46 38.57 2dmz s ILE 71 CO 0.02 0.37 0.00 1.33 0.00 0.00 0.00 174.94 176.66 2dmz n VAL 72 N 3.80 0.96 -3.75 2.92 0.24 -0.52 -4.55 118.33 117.43 2dmz n VAL 72 Ca -0.12 -0.54 -0.12 0.00 -2.04 0.00 0.00 64.34 61.51 2dmz n VAL 72 Cb 0.52 -0.74 -0.12 0.00 -1.47 0.00 0.00 33.84 32.03 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 -2.34 -0.69 -0.29 2.33 0.00 -1.20 -1.37 121.76 118.22 2dmz s ALA 73 Ca -0.10 0.95 -0.08 0.00 0.00 0.00 0.00 51.96 52.73 2dmz s ALA 73 Cb 0.05 -0.58 -0.01 0.00 0.00 0.00 0.00 23.12 22.58 2dmz s ALA 73 CO 0.53 -0.17 0.11 0.08 0.00 0.00 0.00 175.76 176.31 2dmz s VAL 74 N 0.69 4.32 -1.31 0.00 1.01 0.16 -0.13 120.40 125.15 2dmz s VAL 74 Ca -0.04 -0.43 -0.09 0.00 0.00 0.00 0.00 61.98 61.41 2dmz s VAL 74 Cb -0.06 -3.16 0.06 0.00 0.00 0.00 0.00 36.38 33.23 2dmz s VAL 74 CO -0.04 0.15 0.49 -0.90 0.00 0.00 0.00 175.10 174.80 2dmz n ASP 75 N 4.93 -3.94 0.00 3.32 5.68 0.42 0.45 116.55 127.40 2dmz n ASP 75 Ca -0.15 -0.37 0.00 0.00 -0.50 0.00 0.00 54.79 53.77 2dmz n ASP 75 Cb 0.49 -3.25 0.00 0.00 -1.14 0.00 0.00 41.12 37.22 2dmz n ASP 75 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2dmz n GLY 76 N -1.20 3.31 3.60 6.12 0.00 -1.21 -4.70 105.19 111.11 2dmz n GLY 76 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.90 3.75 -0.86 1.61 1.01 0.17 -4.92 120.40 118.26 2dmz s VAL 77 Ca 0.00 0.75 -0.25 0.00 0.00 0.00 0.00 61.98 62.48 2dmz s VAL 77 Cb 0.00 -4.06 -0.06 0.00 0.00 0.00 0.00 36.38 32.27 2dmz s VAL 77 CO 0.00 -0.70 2.00 0.21 0.00 0.00 0.00 175.10 176.61 2dmz s ASN 78 N 4.75 4.99 -0.03 3.32 3.84 -1.26 0.40 114.94 130.94 2dmz s ASN 78 Ca 0.66 -0.49 0.02 0.00 0.21 0.00 0.00 52.86 53.25 2dmz s ASN 78 Cb -0.16 -2.56 0.10 0.00 -0.55 0.00 0.00 41.25 38.09 2dmz s ASN 78 CO 0.32 -2.86 0.68 2.30 -2.79 0.00 0.00 177.10 174.75 2dmz n ILE 79 N 7.94 0.34 -1.55 -5.21 -5.35 -0.47 -4.83 119.36 110.23 2dmz n ILE 79 Ca 0.39 -0.17 -0.14 0.00 -0.27 0.00 0.00 62.75 62.56 2dmz n ILE 79 Cb 0.47 -0.45 -0.08 0.00 -1.74 0.00 0.00 39.64 37.84 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 0.06 0.51 0.00 6.28 6.02 -1.01 -0.62 117.38 128.62 2dmz n GLN 80 Ca 0.03 -0.76 0.00 0.00 -0.01 0.00 0.00 57.00 56.26 2dmz n GLN 80 Cb 0.36 -3.45 0.00 0.00 1.02 0.00 0.00 30.24 28.17 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 6.68 1.90 3.85 1.08 0.00 -1.26 -5.10 105.19 112.34 2dmz n GLY 81 Ca 0.49 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.16 2dmz n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dmz s PHE 82 N -2.00 3.56 0.29 1.61 0.40 0.21 -5.05 117.98 117.00 2dmz s PHE 82 Ca 0.00 1.03 -0.29 0.00 -0.60 0.00 0.00 56.93 57.07 2dmz s PHE 82 Cb 0.00 -2.36 -0.10 0.00 0.51 0.00 0.00 43.02 41.08 2dmz s PHE 82 CO 0.00 0.38 1.28 0.00 0.70 0.00 0.00 175.22 177.59 2dmz s ALA 83 N -1.56 3.50 0.23 5.36 0.00 -1.26 -4.76 121.76 123.27 2dmz s ALA 83 Ca 0.40 1.17 0.08 0.00 0.00 0.00 0.00 51.96 53.62 2dmz s ALA 83 Cb -0.14 -3.46 0.72 0.00 0.00 0.00 0.00 23.12 20.24 2dmz s ALA 83 CO 0.20 -0.55 1.07 0.09 0.00 0.00 0.00 175.76 176.57 2dmz n ASN 84 N 1.36 0.08 -0.03 0.00 5.03 -1.26 0.18 115.26 120.62 2dmz n ASN 84 Ca 0.02 1.14 -0.15 0.00 0.87 0.00 0.00 54.58 56.46 2dmz n ASN 84 Cb 0.42 -0.49 -0.10 0.00 -1.02 0.00 0.00 39.78 38.60 2dmz n ASN 84 CO 0.00 0.00 0.00 1.12 -1.83 0.00 0.00 177.26 176.55 2dmz h HIS 85 N 0.00 0.30 -1.03 3.10 2.07 -2.00 -3.04 115.15 114.56 2dmz h HIS 85 Ca 0.49 -0.14 0.26 0.00 -2.85 0.00 0.00 60.37 58.13 2dmz h HIS 85 Cb 1.19 -0.04 -0.10 0.00 2.57 0.00 0.00 27.41 31.02 2dmz h HIS 85 CO -0.18 0.88 0.64 -0.44 -3.07 0.00 0.00 177.93 175.76 2dmz h ASP 86 N -0.35 0.53 -0.24 3.10 5.19 0.15 0.22 116.42 125.03 2dmz h ASP 86 Ca -0.02 0.10 -0.17 0.00 -0.62 0.00 0.00 57.03 56.31 2dmz h ASP 86 Cb 0.91 0.01 -0.00 0.00 0.18 0.00 0.00 39.33 40.43 2dmz h ASP 86 CO 0.05 0.10 -0.51 0.58 -3.12 0.00 0.00 179.24 176.34 2dmz h VAL 87 N 0.47 1.28 0.21 -1.35 2.07 -1.17 -2.81 116.25 114.95 2dmz h VAL 87 Ca 0.61 -1.70 0.01 0.00 0.82 0.00 0.00 66.70 66.43 2dmz h VAL 87 Cb 1.39 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 32.74 2dmz h VAL 87 CO -0.35 0.55 -0.26 0.58 0.02 0.00 0.00 177.57 178.11 2dmz h VAL 88 N 0.64 0.44 -0.86 2.57 2.07 -0.46 -2.16 116.25 118.48 2dmz h VAL 88 Ca 0.02 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.59 2dmz h VAL 88 Cb 1.10 0.44 -0.05 0.00 -1.52 0.00 0.00 31.29 31.26 2dmz h VAL 88 CO 0.11 0.00 0.56 1.05 0.02 0.00 0.00 177.57 179.31 2dmz h GLU 89 N -0.52 1.00 -0.79 1.57 4.11 -1.47 -1.98 114.58 116.50 2dmz h GLU 89 Ca 0.01 -0.06 0.07 0.00 0.07 0.00 0.00 59.36 59.45 2dmz h GLU 89 Cb 0.51 -0.23 -0.06 0.00 0.50 0.00 0.00 28.75 29.47 2dmz h GLU 89 CO -0.09 0.66 0.46 0.28 0.07 0.00 0.00 179.01 180.39 2dmz h VAL 90 N 1.03 0.98 -0.16 -1.06 2.07 -1.14 -0.89 116.25 117.08 2dmz h VAL 90 Ca 0.35 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.58 2dmz h VAL 90 Cb 0.09 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.94 2dmz h VAL 90 CO -0.11 0.15 0.06 -0.07 0.02 0.00 0.00 177.57 177.62 2dmz h LEU 91 N 0.83 0.22 -0.77 2.57 3.38 -0.76 -2.38 115.31 118.41 2dmz h LEU 91 Ca 0.36 -0.18 0.05 0.00 0.09 0.00 0.00 57.88 58.20 2dmz h LEU 91 Cb 0.23 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 2dmz h LEU 91 CO -0.20 0.34 0.47 0.03 0.09 0.00 0.00 178.44 179.17 2dmz h ARG 92 N 0.09 0.86 -0.94 1.13 3.08 -1.15 -2.01 114.38 115.44 2dmz h ARG 92 Ca 0.05 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.06 2dmz h ARG 92 Cb 0.19 -0.19 -0.05 0.00 0.08 0.00 0.00 29.97 30.00 2dmz h ARG 92 CO -0.00 0.57 0.62 -0.91 -1.07 0.00 0.00 179.97 179.18 2dmz h ASN 93 N 0.89 1.07 -2.76 7.04 2.35 -1.00 -3.43 115.58 119.73 2dmz h ASN 93 Ca 0.32 -0.03 -0.58 0.00 -0.55 0.00 0.00 56.30 55.47 2dmz h ASN 93 Cb 0.10 -0.26 0.18 0.00 0.05 0.00 0.00 38.32 38.39 2dmz h ASN 93 CO -0.15 0.77 -0.64 0.00 -1.65 0.00 0.00 177.43 175.77 2dmz n ALA 94 N -2.36 -1.89 -2.48 -0.83 0.00 -0.76 -5.01 120.51 107.18 2dmz n ALA 94 Ca 0.11 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2dmz n ALA 94 Cb 0.02 -1.71 0.00 0.00 0.00 0.00 0.00 19.45 17.77 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 3.90 0.43 0.00 0.00 -1.26 -5.03 105.19 105.23 2dmz n GLY 95 Ca 0.10 -1.92 -0.15 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.69 -6.25 1.61 4.15 -1.91 -3.35 115.11 108.67 2dmz h GLN 96 Ca 0.00 0.05 -0.53 0.00 0.77 0.00 0.00 58.65 58.94 2dmz h GLN 96 Cb 0.00 0.16 -0.07 0.00 0.21 0.00 0.00 27.48 27.78 2dmz h GLN 96 CO 0.00 -0.46 1.14 0.08 -1.93 0.00 0.00 178.83 177.67 2dmz s VAL 97 N -5.45 3.62 -0.33 2.39 1.01 -1.26 -3.66 120.40 116.72 2dmz s VAL 97 Ca -0.15 0.35 -0.02 0.00 0.00 0.00 0.00 61.98 62.16 2dmz s VAL 97 Cb 0.05 -4.64 0.06 0.00 0.00 0.00 0.00 36.38 31.85 2dmz s VAL 97 CO 0.53 -1.59 0.05 -0.69 0.00 0.00 0.00 175.10 173.41 2dmz s VAL 98 N 6.70 3.13 -0.64 2.92 1.01 -1.11 -4.95 120.40 127.45 2dmz s VAL 98 Ca 0.44 -1.49 -0.20 0.00 0.00 0.00 0.00 61.98 60.73 2dmz s VAL 98 Cb -0.09 -2.87 0.09 0.00 0.00 0.00 0.00 36.38 33.51 2dmz s VAL 98 CO 0.17 -0.23 0.84 -1.00 0.00 0.00 0.00 175.10 174.88 2dmz s HIS 99 N 1.25 2.87 -0.01 5.22 3.76 -1.25 -0.79 115.29 126.34 2dmz s HIS 99 Ca -0.02 -0.82 -0.30 0.00 -0.15 0.00 0.00 55.06 53.77 2dmz s HIS 99 Cb -0.20 -4.15 -0.03 0.00 1.11 0.00 0.00 32.58 29.31 2dmz s HIS 99 CO -0.01 -1.46 0.98 -1.17 -0.85 0.00 0.00 174.74 172.22 2dmz s LEU 100 N 3.26 4.36 -0.38 0.89 1.98 0.10 0.16 118.68 129.06 2dmz s LEU 100 Ca 0.17 1.64 -0.10 0.00 -2.89 0.00 0.00 54.13 52.95 2dmz s LEU 100 Cb -0.20 -3.56 0.04 0.00 0.66 0.00 0.00 46.19 43.13 2dmz s LEU 100 CO 0.07 -0.27 0.20 -0.89 -1.89 0.00 0.00 176.35 173.57 2dmz s THR 101 N 1.07 4.41 0.30 3.68 2.01 0.82 -0.69 115.64 127.24 2dmz s THR 101 Ca 0.51 -0.98 0.11 0.00 0.31 0.00 0.00 61.69 61.64 2dmz s THR 101 Cb -0.21 -3.50 -0.06 0.00 0.01 0.00 0.00 72.50 68.75 2dmz s THR 101 CO 0.27 -0.27 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.02 2dmz s LEU 102 N 1.51 2.63 -0.19 4.42 1.02 -1.10 -1.43 118.68 125.54 2dmz s LEU 102 Ca 0.01 -1.10 -0.05 0.00 0.02 0.00 0.00 54.13 53.02 2dmz s LEU 102 Cb -0.20 -1.01 0.07 0.00 0.02 0.00 0.00 46.19 45.07 2dmz s LEU 102 CO 0.05 -0.08 0.09 0.54 0.02 0.00 0.00 176.35 176.97 2dmz s VAL 103 N -2.60 -0.02 0.33 -1.59 0.11 -1.09 -1.78 120.40 113.76 2dmz s VAL 103 Ca 0.30 -0.29 0.08 0.00 -2.93 0.00 0.00 61.98 59.14 2dmz s VAL 103 Cb -0.02 -0.68 -0.03 0.00 -1.53 0.00 0.00 36.38 34.12 2dmz s VAL 103 CO 0.15 -0.34 0.22 -0.13 -3.33 0.00 0.00 175.10 171.67 2dmz s ARG 104 N 2.10 2.58 0.12 1.54 0.52 -0.97 -4.51 118.95 120.33 2dmz s ARG 104 Ca 0.03 -1.39 -0.30 0.00 -0.52 0.00 0.00 55.73 53.55 2dmz s ARG 104 Cb -0.16 -2.35 -0.07 0.00 0.52 0.00 0.00 34.95 32.88 2dmz s ARG 104 CO -0.13 0.12 1.24 0.50 0.02 0.00 0.00 175.30 177.05 2dmz s ARG 105 N -3.92 4.43 0.90 3.54 3.52 -1.26 -1.17 118.95 124.98 2dmz s ARG 105 Ca 0.39 1.88 -0.13 0.00 -0.13 0.00 0.00 55.73 57.74 2dmz s ARG 105 Cb -0.05 -3.28 0.13 0.00 -1.56 0.00 0.00 34.95 30.19 2dmz s ARG 105 CO 0.25 -0.24 1.18 0.15 -0.81 0.00 0.00 175.30 175.83 2dmz s LYS 106 N 0.60 1.23 0.16 5.12 1.02 0.49 -4.88 119.74 123.48 2dmz s LYS 106 Ca 0.58 0.09 0.04 0.00 0.02 0.00 0.00 55.97 56.70 2dmz s LYS 106 Cb -0.32 -1.87 -0.04 0.00 -0.52 0.00 0.00 37.83 35.08 2dmz s LYS 106 CO 0.32 -2.09 0.17 0.99 -0.92 0.00 0.00 175.35 173.82 2dmz s THR 107 N -3.48 4.68 0.22 2.17 2.01 -1.26 -4.98 115.64 114.99 2dmz s THR 107 Ca 0.65 -0.98 -0.17 0.00 0.31 0.00 0.00 61.69 61.50 2dmz s THR 107 Cb -0.11 -3.39 0.22 0.00 0.01 0.00 0.00 72.50 69.23 2dmz s THR 107 CO 0.52 -0.10 1.58 0.77 -0.69 0.00 0.00 174.62 176.70 2dmz h SER 108 N 2.37 -1.11 -2.30 3.53 4.64 -1.99 -3.42 113.55 115.29 2dmz h SER 108 Ca -0.48 0.25 -0.61 0.00 -0.47 0.00 0.00 61.79 60.49 2dmz h SER 108 Cb 1.20 0.60 0.13 0.00 -0.31 0.00 0.00 62.40 64.02 2dmz h SER 108 CO 0.65 -0.29 -0.20 -0.24 -0.87 0.00 0.00 176.83 175.88 2dmz n SER 109 N -5.47 -0.06 -3.67 4.97 2.88 -1.26 -1.78 113.62 109.23 2dmz n SER 109 Ca 0.08 1.03 -0.24 0.00 -1.33 0.00 0.00 58.87 58.41 2dmz n SER 109 Cb 0.39 -1.17 0.06 0.00 -0.75 0.00 0.00 64.21 62.73 2dmz n SER 109 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dmz n SER 110 N 1.25 -4.58 -4.78 -3.46 2.88 -1.26 -4.95 113.62 98.72 2dmz n SER 110 Ca 0.12 -0.66 -0.33 0.00 -1.33 0.00 0.00 58.87 56.67 2dmz n SER 110 Cb 0.36 -4.60 0.03 0.00 -0.75 0.00 0.00 64.21 59.24 2dmz n SER 110 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2dmz s THR 111 N -3.37 3.40 0.34 2.46 -1.32 -0.73 -4.94 115.64 111.49 2dmz s THR 111 Ca 0.44 0.68 -0.24 0.00 -1.21 0.00 0.00 61.69 61.36 2dmz s THR 111 Cb -0.21 -3.21 -0.15 0.00 -1.51 0.00 0.00 72.50 67.43 2dmz s THR 111 CO 0.77 -0.38 0.49 -0.24 -2.21 0.00 0.00 174.62 173.05 2dmz n SER 112 N -2.16 -1.17 -3.15 8.08 2.88 -1.26 -4.95 113.62 111.89 2dmz n SER 112 Ca 0.10 0.98 -0.18 0.00 -1.33 0.00 0.00 58.87 58.43 2dmz n SER 112 Cb 0.52 -1.04 0.15 0.00 -0.75 0.00 0.00 64.21 63.10 2dmz n SER 112 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2dmz n PRO 113 N 0.89 -2.33 -0.09 -1.46 -0.04 -1.26 -4.66 135.00 126.04 2dmz n PRO 113 Ca 0.13 -1.07 -0.13 0.00 -0.04 0.00 0.00 63.50 62.38 2dmz n PRO 113 Cb 0.35 -1.00 -0.05 0.00 -0.04 0.00 0.00 33.50 32.76 2dmz n PRO 113 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2dmz h LEU 114 N 0.00 0.74 -6.27 1.53 3.38 -1.97 -3.38 115.31 109.34 2dmz h LEU 114 Ca -0.25 -0.49 -0.58 0.00 0.09 0.00 0.00 57.88 56.65 2dmz h LEU 114 Cb 0.77 -0.21 -0.40 0.00 0.09 0.00 0.00 40.66 40.91 2dmz h LEU 114 CO 0.16 1.08 -0.90 1.21 0.09 0.00 0.00 178.44 180.09 2dmz n GLU 115 N -4.26 1.10 -1.19 1.13 2.13 -1.26 -4.98 120.64 113.31 2dmz n GLU 115 Ca -0.04 -3.67 -0.29 0.00 0.66 0.00 0.00 57.16 53.81 2dmz n GLU 115 Cb 0.49 -1.69 0.16 0.00 0.27 0.00 0.00 31.44 30.67 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 -1.17 0.86 0.18 5.31 0.04 -1.26 -4.98 135.00 133.98 2dmz s PRO 116 Ca 0.34 0.67 -0.30 0.00 0.04 0.00 0.00 61.00 61.75 2dmz s PRO 116 Cb 0.10 -1.77 -0.09 0.00 0.04 0.00 0.00 34.50 32.79 2dmz s PRO 116 CO -0.12 -2.48 1.31 -1.25 0.04 0.00 0.00 177.00 174.50 2dmz s PRO 117 N -4.95 4.38 -1.25 0.56 0.04 -1.26 -3.34 135.00 129.19 2dmz s PRO 117 Ca 0.64 2.04 -0.02 0.00 0.04 0.00 0.00 61.00 63.71 2dmz s PRO 117 Cb -0.18 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 31.16 2dmz s PRO 117 CO 0.57 -0.27 0.98 0.43 0.04 0.00 0.00 177.00 178.75 2dmz n SER 118 N 2.84 -2.63 -4.85 6.66 7.64 -1.26 -4.98 113.62 117.05 2dmz n SER 118 Ca 0.07 -0.64 -0.32 0.00 1.01 0.00 0.00 58.87 58.99 2dmz n SER 118 Cb 0.43 -4.91 -0.05 0.00 -1.01 0.00 0.00 64.21 58.67 2dmz n SER 118 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2dmz s ASP 119 N -4.18 6.70 -0.15 6.43 2.15 -1.21 -5.08 116.67 121.33 2dmz s ASP 119 Ca 0.11 1.37 -0.30 0.00 0.43 0.00 0.00 52.55 54.15 2dmz s ASP 119 Cb -0.05 -2.42 0.13 0.00 -0.30 0.00 0.00 42.92 40.29 2dmz s ASP 119 CO 0.75 -0.37 1.04 -0.60 -0.17 0.00 0.00 175.17 175.81 2dmz s ARG 120 N -3.50 0.55 0.00 4.34 3.52 -1.26 -5.05 118.95 117.55 2dmz s ARG 120 Ca 0.56 0.01 0.00 0.00 -0.13 0.00 0.00 55.73 56.17 2dmz s ARG 120 Cb -0.10 0.26 0.00 0.00 -1.56 0.00 0.00 34.95 33.55 2dmz s ARG 120 CO 0.24 -0.20 0.00 0.41 -0.81 0.00 0.00 175.30 174.94 2dmz n GLY 121 N 0.42 2.82 2.91 8.12 0.00 -1.26 -4.98 105.19 113.22 2dmz n GLY 121 Ca -0.08 -0.38 -0.11 0.00 0.00 0.00 0.00 46.02 45.46 2dmz n GLY 121 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2dmz n THR 122 N 0.00 -0.23 -2.36 2.61 5.66 -1.26 -4.83 114.28 113.87 2dmz n THR 122 Ca 0.00 -0.11 -0.24 0.00 -3.05 0.00 0.00 64.05 60.64 2dmz n THR 122 Cb 0.00 -0.27 0.07 0.00 -1.55 0.00 0.00 70.33 68.58 2dmz n THR 122 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 2dmz s VAL 123 N -2.97 2.36 -0.36 1.08 -7.23 -1.26 -5.03 120.40 106.99 2dmz s VAL 123 Ca 0.07 -0.41 -0.26 0.00 -1.81 0.00 0.00 61.98 59.57 2dmz s VAL 123 Cb -0.04 -2.95 0.01 0.00 0.56 0.00 0.00 36.38 33.97 2dmz s VAL 123 CO 0.32 0.00 0.93 -0.94 -0.31 0.00 0.00 175.10 175.09 2dmz s SER 124 N -4.53 6.70 -0.30 4.85 1.04 -1.26 -4.96 113.70 115.23 2dmz s SER 124 Ca 0.61 0.63 -0.13 0.00 0.48 0.00 0.00 55.95 57.54 2dmz s SER 124 Cb -0.10 -2.47 0.18 0.00 0.10 0.00 0.00 66.02 63.74 2dmz s SER 124 CO 0.43 -0.84 1.05 -0.83 0.98 0.00 0.00 173.24 174.03 2dmz s GLY 125 N 1.84 -0.45 0.30 7.32 0.00 -1.26 -5.01 107.32 110.06 2dmz s GLY 125 Ca 0.38 2.65 0.25 0.00 0.00 0.00 0.00 44.72 48.00 2dmz s GLY 125 CO 0.18 3.86 1.76 -0.56 0.00 0.00 0.00 173.10 178.33 2dmz h PRO 126 N 7.88 0.00 -4.52 2.90 0.13 -2.01 -3.44 132.00 132.93 2dmz h PRO 126 Ca -0.13 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.81 2dmz h PRO 126 Cb 1.17 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.15 2dmz h PRO 126 CO -0.10 0.00 -0.69 0.45 -0.23 0.00 0.00 178.00 177.43 2dmz s SER 127 N -4.46 0.93 -0.14 1.44 0.15 -1.26 -4.98 113.70 105.39 2dmz s SER 127 Ca 0.04 -0.98 -0.11 0.00 0.70 0.00 0.00 55.95 55.59 2dmz s SER 127 Cb 0.09 0.12 -0.04 0.00 -1.71 0.00 0.00 66.02 64.49 2dmz s SER 127 CO 0.41 -0.49 -0.22 -1.54 1.20 0.00 0.00 173.24 172.60 2dmz n SER 128 N 0.07 1.60 0.00 5.45 3.41 -1.26 -5.04 113.62 117.85 2dmz n SER 128 Ca -0.13 0.45 0.00 0.00 -0.26 0.00 0.00 58.87 58.93 2dmz n SER 128 Cb 0.61 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.78 2dmz n SER 128 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49