#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dmz h SER 2 N 0.00 -1.00 -6.10 1.61 0.02 -2.12 -3.46 113.55 102.50 2dmz h SER 2 Ca 0.00 0.12 -0.44 0.00 -0.84 0.00 0.00 61.79 60.63 2dmz h SER 2 Cb 0.00 0.39 0.04 0.00 0.14 0.00 0.00 62.40 62.97 2dmz h SER 2 CO 0.00 -0.42 -0.75 -0.24 -1.14 0.00 0.00 176.83 174.29 2dmz n SER 3 N -5.43 -4.56 -3.59 3.07 2.88 -1.26 -4.97 113.62 99.77 2dmz n SER 3 Ca -0.06 -0.71 -0.02 0.00 -1.33 0.00 0.00 58.87 56.75 2dmz n SER 3 Cb 0.34 -4.32 -0.05 0.00 -0.75 0.00 0.00 64.21 59.43 2dmz n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dmz s GLY 4 N -3.54 -0.45 0.27 0.46 0.00 -1.26 -5.15 107.32 97.65 2dmz s GLY 4 Ca 0.50 2.68 -0.29 0.00 0.00 0.00 0.00 44.72 47.60 2dmz s GLY 4 CO 0.79 2.88 1.16 -1.35 0.00 0.00 0.00 173.10 176.59 2dmz s SER 5 N 2.24 7.13 0.10 1.64 1.04 -1.26 -4.95 113.70 119.64 2dmz s SER 5 Ca -0.07 2.34 -0.19 0.00 0.48 0.00 0.00 55.95 58.52 2dmz s SER 5 Cb -0.08 -2.63 -0.06 0.00 0.10 0.00 0.00 66.02 63.35 2dmz s SER 5 CO -0.18 -0.27 1.63 0.77 0.98 0.00 0.00 173.24 176.17 2dmz h SER 6 N 4.08 0.37 -3.94 7.02 4.64 -2.03 -3.49 113.55 120.20 2dmz h SER 6 Ca -0.47 -0.19 0.04 0.00 -0.47 0.00 0.00 61.79 60.71 2dmz h SER 6 Cb 1.21 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.19 2dmz h SER 6 CO 0.68 0.45 -0.11 0.61 -0.87 0.00 0.00 176.83 177.60 2dmz n GLY 7 N -0.67 -2.09 3.29 -0.77 0.00 -1.26 -4.72 105.19 98.98 2dmz n GLY 7 Ca -0.03 -1.45 -0.45 0.00 0.00 0.00 0.00 46.02 44.10 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 -5.18 2.81 0.22 -0.02 0.00 -1.26 -5.00 107.32 98.88 2dmz s GLY 8 Ca 0.00 -3.47 -0.14 0.00 0.00 0.00 0.00 44.72 41.11 2dmz s GLY 8 CO 0.00 1.25 0.47 -1.35 0.00 0.00 0.00 173.10 173.47 2dmz s SER 9 N 1.65 -0.12 -0.59 1.64 1.04 -1.26 -5.07 113.70 110.99 2dmz s SER 9 Ca 0.21 -0.78 0.03 0.00 0.48 0.00 0.00 55.95 55.90 2dmz s SER 9 Cb -0.11 0.56 0.39 0.00 0.10 0.00 0.00 66.02 66.96 2dmz s SER 9 CO -0.08 -1.08 1.38 0.47 0.98 0.00 0.00 173.24 174.90 2dmz n ASP 10 N -0.34 5.58 -3.33 7.02 8.00 -1.26 -5.06 116.55 127.15 2dmz n ASP 10 Ca -0.05 -3.75 -0.20 0.00 0.71 0.00 0.00 54.79 51.50 2dmz n ASP 10 Cb 0.62 -0.66 0.19 0.00 -0.02 0.00 0.00 41.12 41.25 2dmz n ASP 10 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2dmz n SER 11 N -0.46 -3.40 -3.59 -2.24 7.64 -1.26 -4.41 113.62 105.90 2dmz n SER 11 Ca 0.43 -0.58 -0.22 0.00 1.01 0.00 0.00 58.87 59.51 2dmz n SER 11 Cb 0.50 -0.78 -0.16 0.00 -1.01 0.00 0.00 64.21 62.76 2dmz n SER 11 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dmz n SER 12 N -3.27 -0.74 0.02 6.43 7.64 -1.26 -4.68 113.62 117.76 2dmz n SER 12 Ca 0.09 -0.26 0.12 0.00 1.01 0.00 0.00 58.87 59.84 2dmz n SER 12 Cb 0.40 -0.52 0.57 0.00 -1.01 0.00 0.00 64.21 63.65 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 9.02 0.21-10.29 -3.43 -0.00 -1.98 -3.43 115.31 105.41 2dmz h LEU 13 Ca 0.01 0.00 -0.47 0.00 -0.00 0.00 0.00 57.88 57.42 2dmz h LEU 13 Cb 0.95 -0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 41.55 2dmz h LEU 13 CO 1.24 0.13 -0.32 -0.36 -0.00 0.00 0.00 178.44 179.13 2dmz s PHE 14 N -5.24 2.61 -0.07 1.13 0.40 -1.26 -1.22 117.98 114.34 2dmz s PHE 14 Ca -0.06 -0.49 0.03 0.00 -0.60 0.00 0.00 56.93 55.80 2dmz s PHE 14 Cb 0.19 -2.23 0.01 0.00 0.51 0.00 0.00 43.02 41.50 2dmz s PHE 14 CO 0.73 -0.29 -0.15 -1.83 0.70 0.00 0.00 175.22 174.38 2dmz s GLU 15 N -4.24 1.96 -0.11 0.44 -1.05 0.87 -4.78 118.70 111.80 2dmz s GLU 15 Ca 0.50 -0.53 -0.12 0.00 -0.15 0.00 0.00 54.97 54.67 2dmz s GLU 15 Cb -0.05 -1.59 -0.05 0.00 -0.44 0.00 0.00 34.13 32.00 2dmz s GLU 15 CO 0.30 0.09 0.27 0.99 0.95 0.00 0.00 175.26 177.86 2dmz s THR 16 N 0.50 5.30 0.02 1.83 2.01 -1.26 -2.24 115.64 121.80 2dmz s THR 16 Ca -0.14 0.50 -0.03 0.00 0.31 0.00 0.00 61.69 62.34 2dmz s THR 16 Cb -0.15 -3.58 -0.01 0.00 0.01 0.00 0.00 72.50 68.76 2dmz s THR 16 CO 0.04 0.50 0.04 -0.72 -0.69 0.00 0.00 174.62 173.79 2dmz s TYR 17 N -0.34 0.21 -0.14 4.92 1.13 -0.55 -4.37 117.35 118.21 2dmz s TYR 17 Ca 0.17 -0.45 -0.05 0.00 -1.41 0.00 0.00 57.07 55.33 2dmz s TYR 17 Cb -0.13 -0.16 -0.04 0.00 -1.10 0.00 0.00 41.96 40.53 2dmz s TYR 17 CO 0.06 -0.25 0.05 -0.80 -2.51 0.00 0.00 175.55 172.09 2dmz s ASN 18 N -1.62 5.55 -0.24 -0.18 0.02 -1.26 -2.02 114.94 115.19 2dmz s ASN 18 Ca -0.13 0.14 0.01 0.00 -1.02 0.00 0.00 52.86 51.86 2dmz s ASN 18 Cb -0.07 -1.82 0.04 0.00 0.02 0.00 0.00 41.25 39.42 2dmz s ASN 18 CO -0.01 0.27 -0.12 -0.69 0.02 0.00 0.00 177.10 176.56 2dmz s VAL 19 N -0.21 2.29 -0.62 1.60 1.01 0.36 -4.84 120.40 120.00 2dmz s VAL 19 Ca 0.07 -1.33 -0.24 0.00 0.00 0.00 0.00 61.98 60.48 2dmz s VAL 19 Cb -0.12 -2.21 0.05 0.00 0.00 0.00 0.00 36.38 34.10 2dmz s VAL 19 CO 0.02 0.17 1.02 -0.70 0.00 0.00 0.00 175.10 175.60 2dmz s GLU 20 N 1.20 3.25 0.04 2.72 2.12 -1.25 -0.15 118.70 126.62 2dmz s GLU 20 Ca -0.03 -0.41 -0.12 0.00 0.36 0.00 0.00 54.97 54.77 2dmz s GLU 20 Cb -0.17 -4.13 -0.06 0.00 0.26 0.00 0.00 34.13 30.03 2dmz s GLU 20 CO -0.07 -1.71 0.39 -0.51 -0.54 0.00 0.00 175.26 172.82 2dmz s LEU 21 N 4.34 4.41 -0.12 2.70 1.43 0.45 -4.86 118.68 127.03 2dmz s LEU 21 Ca 0.29 0.86 -0.04 0.00 -1.03 0.00 0.00 54.13 54.21 2dmz s LEU 21 Cb -0.13 -2.77 -0.03 0.00 0.03 0.00 0.00 46.19 43.29 2dmz s LEU 21 CO 0.16 0.25 0.02 0.54 0.23 0.00 0.00 176.35 177.55 2dmz s VAL 22 N -1.24 4.46 -0.29 -1.59 0.11 -1.26 -2.09 120.40 118.50 2dmz s VAL 22 Ca 0.28 -0.18 -0.01 0.00 -2.93 0.00 0.00 61.98 59.14 2dmz s VAL 22 Cb -0.15 -2.92 0.05 0.00 -1.53 0.00 0.00 36.38 31.83 2dmz s VAL 22 CO 0.15 0.56 -0.02 -0.13 -3.33 0.00 0.00 175.10 172.34 2dmz s ARG 23 N -0.48 2.38 0.95 1.54 0.52 -1.23 -4.51 118.95 118.12 2dmz s ARG 23 Ca 0.09 -1.29 -0.12 0.00 -0.52 0.00 0.00 55.73 53.89 2dmz s ARG 23 Cb -0.12 -3.13 0.18 0.00 0.52 0.00 0.00 34.95 32.40 2dmz s ARG 23 CO 0.02 -0.62 0.41 1.63 0.02 0.00 0.00 175.30 176.76 2dmz n LYS 24 N 4.58 -1.33 -2.19 3.54 4.76 -1.26 -4.68 118.16 121.58 2dmz n LYS 24 Ca -0.13 -0.69 -0.31 0.00 -2.87 0.00 0.00 58.31 54.31 2dmz n LYS 24 Cb 0.43 -1.39 -0.05 0.00 -1.84 0.00 0.00 35.03 32.18 2dmz n LYS 24 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2dmz s ASP 25 N -2.00 5.47 0.00 4.39 1.01 -1.26 -2.77 116.67 121.51 2dmz s ASP 25 Ca 0.32 -1.57 0.00 0.00 0.71 0.00 0.00 52.55 52.00 2dmz s ASP 25 Cb -0.06 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.29 2dmz s ASP 25 CO 0.27 -2.56 0.00 0.61 0.21 0.00 0.00 175.17 173.69 2dmz n GLY 26 N 6.04 1.44 3.28 0.21 0.00 -1.26 -5.12 105.19 109.77 2dmz n GLY 26 Ca 0.44 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.31 2.41 0.49 1.61 0.74 -1.11 -5.13 119.66 118.36 2dmz s GLN 27 Ca 0.00 -0.91 -0.11 0.00 0.05 0.00 0.00 55.36 54.39 2dmz s GLN 27 Cb 0.00 -2.12 -0.06 0.00 1.10 0.00 0.00 33.01 31.93 2dmz s GLN 27 CO 0.00 0.43 0.87 -1.54 -0.55 0.00 0.00 175.29 174.50 2dmz s SER 28 N -0.29 6.43 0.18 6.67 1.04 -1.26 -4.60 113.70 121.87 2dmz s SER 28 Ca 0.00 1.24 -0.20 0.00 0.48 0.00 0.00 55.95 57.48 2dmz s SER 28 Cb -0.13 -2.38 0.11 0.00 0.10 0.00 0.00 66.02 63.72 2dmz s SER 28 CO 0.02 -0.57 1.61 0.25 0.98 0.00 0.00 173.24 175.54 2dmz h LEU 29 N 0.66 -0.88 -1.83 2.42 5.85 -1.96 -3.33 115.31 116.24 2dmz h LEU 29 Ca -0.46 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.44 2dmz h LEU 29 Cb 1.19 0.45 0.00 0.00 0.37 0.00 0.00 40.66 42.67 2dmz h LEU 29 CO 0.62 -0.27 0.00 0.61 -0.34 0.00 0.00 178.44 179.06 2dmz n GLY 30 N -1.41 0.52 2.71 3.75 0.00 -1.26 -2.36 105.19 107.14 2dmz n GLY 30 Ca 0.03 -0.40 -0.21 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 -2.73 -0.20 0.24 -0.61 1.01 -1.26 -2.88 121.20 114.77 2dmz s ILE 31 Ca 0.00 0.08 -0.21 0.00 0.00 0.00 0.00 60.65 60.52 2dmz s ILE 31 Cb 0.00 -0.46 -0.09 0.00 0.01 0.00 0.00 42.46 41.92 2dmz s ILE 31 CO 0.00 -0.08 0.77 -0.13 0.00 0.00 0.00 174.94 175.50 2dmz s ARG 32 N 2.23 4.30 0.41 2.79 0.52 -0.52 -4.99 118.95 123.69 2dmz s ARG 32 Ca 0.04 0.95 0.06 0.00 -0.52 0.00 0.00 55.73 56.26 2dmz s ARG 32 Cb -0.14 -2.85 -0.07 0.00 0.52 0.00 0.00 34.95 32.41 2dmz s ARG 32 CO -0.08 0.36 0.02 0.96 0.02 0.00 0.00 175.30 176.58 2dmz s ILE 33 N -1.56 1.79 -0.17 1.52 -4.36 -1.26 -1.76 121.20 115.40 2dmz s ILE 33 Ca 0.45 -2.00 -0.20 0.00 -0.26 0.00 0.00 60.65 58.64 2dmz s ILE 33 Cb -0.17 -2.88 0.05 0.00 1.25 0.00 0.00 42.46 40.71 2dmz s ILE 33 CO 0.21 0.00 0.54 0.54 0.24 0.00 0.00 174.94 176.47 2dmz s VAL 34 N -2.81 0.00 -0.16 8.37 0.11 -0.56 -4.48 120.40 120.87 2dmz s VAL 34 Ca 0.32 -0.04 -0.12 0.00 -2.93 0.00 0.00 61.98 59.21 2dmz s VAL 34 Cb 0.09 -0.78 -0.05 0.00 -1.53 0.00 0.00 36.38 34.12 2dmz s VAL 34 CO 0.16 -0.02 0.23 -0.83 -3.33 0.00 0.00 175.10 171.30 2dmz s GLY 35 N -0.00 2.15 0.10 6.54 0.00 -1.26 -2.63 107.32 112.22 2dmz s GLY 35 Ca -0.02 -0.54 0.08 0.00 0.00 0.00 0.00 44.72 44.23 2dmz s GLY 35 CO 0.02 0.25 -0.20 -0.19 0.00 0.00 0.00 173.10 172.98 2dmz s TYR 36 N 0.24 1.72 0.00 1.90 1.51 -1.18 -4.99 117.35 116.55 2dmz s TYR 36 Ca 0.14 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 55.78 2dmz s TYR 36 Cb -0.12 -0.95 0.00 0.00 -0.11 0.00 0.00 41.96 40.78 2dmz s TYR 36 CO 0.02 0.18 0.00 1.33 -1.11 0.00 0.00 175.55 175.97 2dmz n VAL 37 N 1.15 0.00 -3.16 0.71 0.24 -1.25 -2.86 118.33 113.16 2dmz n VAL 37 Ca -0.20 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 61.96 2dmz n VAL 37 Cb 0.54 -0.10 0.07 0.00 -1.47 0.00 0.00 33.84 32.87 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 2.00 -1.06 0.09 7.63 0.00 -1.22 -4.50 105.19 108.13 2dmz n GLY 38 Ca 0.00 0.55 -0.11 0.00 0.00 0.00 0.00 46.02 46.45 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 -3.14 1.04 -3.11 2.61 5.66 -1.26 -4.59 114.28 111.49 2dmz n THR 39 Ca -0.07 -0.46 -0.28 0.00 -3.05 0.00 0.00 64.05 60.19 2dmz n THR 39 Cb 0.61 -1.00 -0.05 0.00 -1.55 0.00 0.00 70.33 68.34 2dmz n THR 39 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 2dmz n SER 40 N -2.90 4.36 -3.64 1.09 7.64 -1.26 -5.03 113.62 113.88 2dmz n SER 40 Ca -0.30 -3.59 -0.00 0.00 1.01 0.00 0.00 58.87 55.98 2dmz n SER 40 Cb 0.88 -0.64 -0.01 0.00 -1.01 0.00 0.00 64.21 63.44 2dmz n SER 40 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2dmz s HIS 41 N -3.12 -0.07 0.74 1.43 5.04 -1.26 -5.17 115.29 112.87 2dmz s HIS 41 Ca 0.45 -0.06 -0.11 0.00 -1.54 0.00 0.00 55.06 53.79 2dmz s HIS 41 Cb 0.22 0.56 0.03 0.00 0.04 0.00 0.00 32.58 33.44 2dmz s HIS 41 CO -0.09 -0.38 1.10 -0.08 -2.34 0.00 0.00 174.74 172.96 2dmz s THR 42 N -2.60 3.30 -0.17 0.89 -1.32 -1.26 -4.55 115.64 109.93 2dmz s THR 42 Ca 0.13 0.42 -0.15 0.00 -1.21 0.00 0.00 61.69 60.88 2dmz s THR 42 Cb 0.03 -3.35 0.02 0.00 -1.51 0.00 0.00 72.50 67.69 2dmz s THR 42 CO -0.03 -0.55 0.26 0.61 -2.21 0.00 0.00 174.62 172.70 2dmz n GLY 43 N -2.78 0.08 2.78 6.08 0.00 -1.26 -4.49 105.19 105.60 2dmz n GLY 43 Ca 0.07 0.45 -0.51 0.00 0.00 0.00 0.00 46.02 46.03 2dmz n GLY 43 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dmz n GLU 44 N 0.67 0.00 -3.88 1.61 1.02 -1.26 -4.89 120.64 113.91 2dmz n GLU 44 Ca -0.03 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.80 2dmz n GLU 44 Cb 0.54 -1.17 -0.14 0.00 -0.02 0.00 0.00 31.44 30.65 2dmz n GLU 44 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dmz s ALA 45 N 3.18 2.64 -0.04 0.62 0.00 -1.26 -5.00 121.76 121.91 2dmz s ALA 45 Ca 0.86 -2.67 0.07 0.00 0.00 0.00 0.00 51.96 50.21 2dmz s ALA 45 Cb -1.17 -1.96 -0.02 0.00 0.00 0.00 0.00 23.12 19.97 2dmz s ALA 45 CO 0.59 -1.89 -0.23 -1.54 0.00 0.00 0.00 175.76 172.69 2dmz s SER 46 N 0.47 3.27 0.00 0.00 1.04 -1.26 -3.38 113.70 113.84 2dmz s SER 46 Ca 0.15 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.16 2dmz s SER 46 Cb -0.23 -0.57 0.00 0.00 0.10 0.00 0.00 66.02 65.32 2dmz s SER 46 CO -0.06 0.31 0.00 0.61 0.98 0.00 0.00 173.24 175.08 2dmz n GLY 47 N 2.54 1.93 3.70 7.32 0.00 -1.13 -4.97 105.19 114.58 2dmz n GLY 47 Ca -0.17 -1.69 -0.40 0.00 0.00 0.00 0.00 46.02 43.76 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 -1.65 4.99 0.17 -0.61 -1.09 -1.26 -3.08 121.20 118.67 2dmz s ILE 48 Ca 0.00 1.55 0.06 0.00 -2.23 0.00 0.00 60.65 60.03 2dmz s ILE 48 Cb 0.00 -4.09 -0.04 0.00 -1.58 0.00 0.00 42.46 36.74 2dmz s ILE 48 CO 0.00 0.19 -0.12 -0.31 -1.23 0.00 0.00 174.94 173.47 2dmz s TYR 49 N 1.12 1.47 -0.68 3.97 1.51 -1.08 -1.80 117.35 121.86 2dmz s TYR 49 Ca 0.39 -0.67 -0.26 0.00 -1.01 0.00 0.00 57.07 55.52 2dmz s TYR 49 Cb -0.18 -0.71 0.04 0.00 -0.11 0.00 0.00 41.96 41.00 2dmz s TYR 49 CO 0.18 0.21 1.17 0.08 -1.11 0.00 0.00 175.55 176.08 2dmz s VAL 50 N -3.12 3.95 0.26 0.71 1.01 -0.97 -1.49 120.40 120.77 2dmz s VAL 50 Ca 0.19 0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.52 2dmz s VAL 50 Cb 0.01 -4.80 0.07 0.00 0.00 0.00 0.00 36.38 31.65 2dmz s VAL 50 CO 0.03 -1.62 1.71 0.50 0.00 0.00 0.00 175.10 175.73 2dmz h LYS 51 N 9.78 0.58 -2.65 2.72 1.63 -1.57 -3.29 116.57 123.78 2dmz h LYS 51 Ca -0.27 -0.21 0.11 0.00 -0.85 0.00 0.00 60.65 59.43 2dmz h LYS 51 Cb 1.06 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.61 2dmz h LYS 51 CO 1.23 0.76 0.43 -1.12 -3.45 0.00 0.00 179.45 177.29 2dmz s SER 52 N -6.78 -0.09 -0.35 4.20 0.01 -1.25 -4.95 113.70 104.49 2dmz s SER 52 Ca -0.08 -0.69 -0.00 0.00 1.31 0.00 0.00 55.95 56.49 2dmz s SER 52 Cb 0.14 0.61 0.12 0.00 0.21 0.00 0.00 66.02 67.10 2dmz s SER 52 CO 0.80 -1.18 0.16 -0.69 0.41 0.00 0.00 173.24 172.74 2dmz s VAL 53 N -2.82 0.72 0.06 3.43 1.01 -1.26 -1.44 120.40 120.10 2dmz s VAL 53 Ca 0.16 -1.65 -0.37 0.00 0.00 0.00 0.00 61.98 60.12 2dmz s VAL 53 Cb -0.03 -1.53 -0.19 0.00 0.00 0.00 0.00 36.38 34.62 2dmz s VAL 53 CO 0.06 -0.80 0.96 -0.38 0.00 0.00 0.00 175.10 174.94 2dmz n ILE 54 N 4.42 0.49 -1.25 2.22 -0.00 -1.14 -4.88 119.36 119.23 2dmz n ILE 54 Ca 0.03 -0.12 -0.31 0.00 -0.00 0.00 0.00 62.75 62.35 2dmz n ILE 54 Cb 0.39 -0.07 0.10 0.00 -0.00 0.00 0.00 39.64 40.06 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 -0.22 2.07 -1.25 0.38 0.04 -1.26 -3.56 135.00 131.21 2dmz s PRO 55 Ca 0.84 1.11 -0.10 0.00 0.04 0.00 0.00 61.00 62.89 2dmz s PRO 55 Cb -1.16 -1.88 0.08 0.00 0.04 0.00 0.00 34.50 31.58 2dmz s PRO 55 CO 0.56 -1.76 0.46 0.41 0.04 0.00 0.00 177.00 176.72 2dmz n GLY 56 N -1.19 -0.48 3.74 0.56 0.00 -1.26 -4.93 105.19 101.63 2dmz n GLY 56 Ca 0.09 0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.71 4.17 0.09 1.61 1.04 -1.23 -4.97 113.70 111.70 2dmz s SER 57 Ca 0.41 -1.47 -0.31 0.00 0.48 0.00 0.00 55.95 55.05 2dmz s SER 57 Cb -0.22 0.18 -0.13 0.00 0.10 0.00 0.00 66.02 65.94 2dmz s SER 57 CO 0.50 -0.75 1.61 0.00 0.98 0.00 0.00 173.24 175.58 2dmz h ALA 58 N 1.38 -0.78 -0.79 5.32 0.00 -1.63 0.23 119.26 123.00 2dmz h ALA 58 Ca -0.43 -0.12 0.15 0.00 0.00 0.00 0.00 54.91 54.51 2dmz h ALA 58 Cb 1.29 0.51 -0.10 0.00 0.00 0.00 0.00 17.79 19.49 2dmz h ALA 58 CO 0.73 -0.97 0.35 0.00 0.00 0.00 0.00 179.25 179.35 2dmz h ALA 59 N -0.29 1.15 -0.16 0.00 0.00 -1.70 0.45 119.26 118.72 2dmz h ALA 59 Ca -0.03 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2dmz h ALA 59 Cb 0.67 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2dmz h ALA 59 CO -0.06 -0.19 0.00 -0.92 0.00 0.00 0.00 179.25 178.09 2dmz h TYR 60 N 0.49 0.30 -0.29 0.00 5.03 -1.67 -1.91 116.97 118.91 2dmz h TYR 60 Ca 0.44 -0.05 0.04 0.00 2.58 0.00 0.00 58.73 61.74 2dmz h TYR 60 Cb 0.66 -0.08 -0.04 0.00 1.55 0.00 0.00 36.73 38.83 2dmz h TYR 60 CO -0.14 0.49 0.05 0.45 -1.32 0.00 0.00 178.16 177.69 2dmz h HIS 61 N 0.02 0.08 -0.33 -3.82 3.86 0.43 -2.56 115.15 112.84 2dmz h HIS 61 Ca 0.04 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.29 2dmz h HIS 61 Cb 0.37 0.01 -0.02 0.00 1.06 0.00 0.00 27.41 28.82 2dmz h HIS 61 CO 0.03 0.01 0.19 -0.97 0.86 0.00 0.00 177.93 178.05 2dmz h ASN 62 N 0.16 0.30 -1.52 2.45 -1.24 -0.91 -3.47 115.58 111.34 2dmz h ASN 62 Ca 0.14 0.00 -0.12 0.00 0.71 0.00 0.00 56.30 57.03 2dmz h ASN 62 Cb 0.15 -0.06 0.01 0.00 0.73 0.00 0.00 38.32 39.16 2dmz h ASN 62 CO -0.19 0.22 -0.17 0.61 -1.29 0.00 0.00 177.43 176.61 2dmz n GLY 63 N -1.19 0.30 0.02 1.57 0.00 -0.72 -4.94 105.19 100.23 2dmz n GLY 63 Ca -0.00 -0.54 -0.03 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.66 0.00 -3.51 1.61 8.25 -1.26 -5.01 115.22 111.65 2dmz n HIS 64 Ca -0.04 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.05 2dmz n HIS 64 Cb 0.54 -0.15 -0.07 0.00 1.12 0.00 0.00 29.99 31.43 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 -2.08 5.29 0.25 1.59 1.01 -1.26 -5.07 121.20 120.93 2dmz s ILE 65 Ca -0.05 0.56 -0.03 0.00 0.00 0.00 0.00 60.65 61.13 2dmz s ILE 65 Cb 0.01 -3.65 -0.02 0.00 0.01 0.00 0.00 42.46 38.81 2dmz s ILE 65 CO 0.09 0.35 0.28 -1.10 0.00 0.00 0.00 174.94 174.57 2dmz s GLN 66 N 0.70 1.46 1.28 2.79 1.11 -1.26 -4.78 119.66 120.96 2dmz s GLN 66 Ca 0.17 -1.61 -0.17 0.00 0.01 0.00 0.00 55.36 53.75 2dmz s GLN 66 Cb -0.13 0.35 0.32 0.00 -1.01 0.00 0.00 33.01 32.54 2dmz s GLN 66 CO 0.05 -0.55 0.90 1.33 0.01 0.00 0.00 175.29 177.04 2dmz n VAL 67 N -0.39 0.00 -2.92 1.09 0.24 -1.26 -3.83 118.33 111.26 2dmz n VAL 67 Ca 0.02 -0.34 -0.19 0.00 -2.04 0.00 0.00 64.34 61.79 2dmz n VAL 67 Cb 0.64 -0.97 0.03 0.00 -1.47 0.00 0.00 33.84 32.07 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 -5.05 -5.54 -4.18 -1.34 3.02 -1.24 -4.94 115.26 95.99 2dmz n ASN 68 Ca 0.05 -0.25 -0.17 0.00 -0.03 0.00 0.00 54.58 54.19 2dmz n ASN 68 Cb 0.56 -4.37 -0.11 0.00 -0.61 0.00 0.00 39.78 35.24 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 -2.75 1.61 -0.15 6.41 1.11 -1.25 -5.01 116.67 116.64 2dmz s ASP 69 Ca 0.27 -0.70 -0.01 0.00 0.18 0.00 0.00 52.55 52.28 2dmz s ASP 69 Cb -0.12 -0.03 -0.01 0.00 1.07 0.00 0.00 42.92 43.83 2dmz s ASP 69 CO 0.33 -0.15 -0.11 -0.75 1.18 0.00 0.00 175.17 175.67 2dmz s LYS 70 N -2.20 3.41 -0.18 8.23 2.20 -1.26 -2.28 119.74 127.66 2dmz s LYS 70 Ca 0.02 -0.66 -0.13 0.00 -0.36 0.00 0.00 55.97 54.83 2dmz s LYS 70 Cb -0.07 -2.71 -0.05 0.00 -1.51 0.00 0.00 37.83 33.49 2dmz s LYS 70 CO 0.02 0.15 0.27 0.42 -0.36 0.00 0.00 175.35 175.85 2dmz s ILE 71 N 0.53 5.31 -0.04 5.43 1.09 -0.75 -2.15 121.20 130.62 2dmz s ILE 71 Ca -0.07 0.49 0.13 0.00 -1.10 0.00 0.00 60.65 60.09 2dmz s ILE 71 Cb -0.15 -3.61 -0.19 0.00 -1.06 0.00 0.00 42.46 37.44 2dmz s ILE 71 CO 0.04 0.37 0.24 1.33 -0.10 0.00 0.00 174.94 176.81 2dmz n VAL 72 N 3.75 0.19 -3.61 2.92 0.24 -0.71 -4.54 118.33 116.56 2dmz n VAL 72 Ca -0.12 -0.35 -0.16 0.00 -2.04 0.00 0.00 64.34 61.67 2dmz n VAL 72 Cb 0.52 0.01 -0.07 0.00 -1.47 0.00 0.00 33.84 32.82 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 -2.78 -1.56 -0.27 2.33 0.00 -1.20 -2.64 121.76 115.64 2dmz s ALA 73 Ca -0.05 1.39 0.03 0.00 0.00 0.00 0.00 51.96 53.33 2dmz s ALA 73 Cb 0.07 -0.44 0.07 0.00 0.00 0.00 0.00 23.12 22.82 2dmz s ALA 73 CO 0.54 -0.33 -0.06 0.08 0.00 0.00 0.00 175.76 175.99 2dmz s VAL 74 N -0.55 2.04 -1.42 0.00 1.01 0.76 0.03 120.40 122.27 2dmz s VAL 74 Ca -0.07 -1.70 -0.01 0.00 0.00 0.00 0.00 61.98 60.21 2dmz s VAL 74 Cb -0.03 -2.26 0.00 0.00 0.00 0.00 0.00 36.38 34.10 2dmz s VAL 74 CO 0.05 -0.17 0.10 -0.67 0.00 0.00 0.00 175.10 174.41 2dmz n ASP 75 N 4.45 -5.07 0.00 3.32 2.03 0.24 -1.71 116.55 119.82 2dmz n ASP 75 Ca -0.10 -0.06 0.00 0.00 0.52 0.00 0.00 54.79 55.15 2dmz n ASP 75 Cb 0.42 -4.11 0.00 0.00 -0.72 0.00 0.00 41.12 36.71 2dmz n ASP 75 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dmz n GLY 76 N -1.09 2.11 3.61 0.27 0.00 -1.25 -4.81 105.19 104.03 2dmz n GLY 76 Ca -0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.45 4.52 -0.85 1.61 1.01 -0.69 -4.96 120.40 118.58 2dmz s VAL 77 Ca 0.00 1.34 -0.25 0.00 0.00 0.00 0.00 61.98 63.07 2dmz s VAL 77 Cb 0.00 -4.39 -0.05 0.00 0.00 0.00 0.00 36.38 31.94 2dmz s VAL 77 CO 0.00 -0.58 1.98 0.21 0.00 0.00 0.00 175.10 176.71 2dmz s ASN 78 N 1.89 5.04 -0.04 3.32 3.84 -1.26 -0.17 114.94 127.55 2dmz s ASN 78 Ca 0.41 -0.47 0.04 0.00 0.21 0.00 0.00 52.86 53.05 2dmz s ASN 78 Cb -0.11 -2.55 0.20 0.00 -0.55 0.00 0.00 41.25 38.23 2dmz s ASN 78 CO 0.19 -2.80 0.92 2.30 -2.79 0.00 0.00 177.10 174.92 2dmz n ILE 79 N 7.88 0.57 -1.55 -5.21 -5.35 -1.08 -4.85 119.36 109.77 2dmz n ILE 79 Ca 0.38 -0.33 -0.28 0.00 -0.27 0.00 0.00 62.75 62.25 2dmz n ILE 79 Cb 0.47 -0.27 -0.05 0.00 -1.74 0.00 0.00 39.64 38.05 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 0.13 0.81 0.00 6.28 6.02 -1.17 -0.22 117.38 129.23 2dmz n GLN 80 Ca 0.07 -0.28 0.00 0.00 -0.01 0.00 0.00 57.00 56.78 2dmz n GLN 80 Cb 0.39 -3.38 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 6.28 2.06 3.63 1.08 0.00 -1.26 -5.06 105.19 111.91 2dmz n GLY 81 Ca 0.42 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.09 1.89 -1.06 1.61 3.01 0.70 -4.92 117.46 117.59 2dmz n PHE 82 Ca 0.00 0.46 -0.32 0.00 1.01 0.00 0.00 57.45 58.59 2dmz n PHE 82 Cb 0.00 -2.44 0.13 0.00 -0.01 0.00 0.00 39.48 37.16 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 0.71 1.85 0.24 4.37 0.00 -1.26 -4.59 121.76 123.09 2dmz s ALA 83 Ca 0.82 0.63 -0.14 0.00 0.00 0.00 0.00 51.96 53.27 2dmz s ALA 83 Cb -0.82 -3.42 0.31 0.00 0.00 0.00 0.00 23.12 19.19 2dmz s ALA 83 CO 0.42 -2.26 1.51 -1.71 0.00 0.00 0.00 175.76 173.73 2dmz n ASN 84 N -3.57 -0.53 -0.02 0.00 2.85 -1.26 -0.48 115.26 112.25 2dmz n ASN 84 Ca 0.12 1.69 -0.13 0.00 -0.11 0.00 0.00 54.58 56.15 2dmz n ASN 84 Cb 0.52 -0.43 -0.09 0.00 1.24 0.00 0.00 39.78 41.02 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 0.13 -1.13 1.20 2.07 -2.00 -2.68 115.15 112.75 2dmz h HIS 85 Ca 0.39 -0.04 0.33 0.00 -2.85 0.00 0.00 60.37 58.20 2dmz h HIS 85 Cb 0.63 -0.03 -0.11 0.00 2.57 0.00 0.00 27.41 30.47 2dmz h HIS 85 CO -0.82 0.52 0.71 -0.44 -3.07 0.00 0.00 177.93 174.83 2dmz h ASP 86 N -0.29 0.39 0.22 3.10 3.32 -1.10 0.50 116.42 122.57 2dmz h ASP 86 Ca 0.01 0.12 -0.24 0.00 0.02 0.00 0.00 57.03 56.94 2dmz h ASP 86 Cb 0.48 0.07 0.01 0.00 0.22 0.00 0.00 39.33 40.11 2dmz h ASP 86 CO 0.01 -0.04 -1.00 0.58 -1.72 0.00 0.00 179.24 177.07 2dmz h VAL 87 N 0.28 1.36 0.30 -1.35 2.07 -0.82 -3.21 116.25 114.87 2dmz h VAL 87 Ca 0.69 -2.39 0.00 0.00 0.82 0.00 0.00 66.70 65.82 2dmz h VAL 87 Cb 1.88 2.43 -0.03 0.00 -1.52 0.00 0.00 31.29 34.05 2dmz h VAL 87 CO -0.39 0.72 -0.37 0.58 0.02 0.00 0.00 177.57 178.14 2dmz h VAL 88 N 0.29 0.25 -0.92 2.57 2.07 0.33 -1.91 116.25 118.93 2dmz h VAL 88 Ca -0.10 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.58 2dmz h VAL 88 Cb 1.64 0.25 -0.08 0.00 -1.52 0.00 0.00 31.29 31.59 2dmz h VAL 88 CO 0.18 0.00 0.59 1.05 0.02 0.00 0.00 177.57 179.41 2dmz h GLU 89 N -0.71 0.63 -0.39 1.57 4.11 -1.51 -1.04 114.58 117.24 2dmz h GLU 89 Ca -0.01 -0.04 0.03 0.00 0.07 0.00 0.00 59.36 59.42 2dmz h GLU 89 Cb 0.66 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 2dmz h GLU 89 CO -0.11 0.42 0.18 0.28 0.07 0.00 0.00 179.01 179.84 2dmz h VAL 90 N 0.65 0.95 -0.38 -1.06 2.07 -1.36 -0.66 116.25 116.45 2dmz h VAL 90 Ca 0.48 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.87 2dmz h VAL 90 Cb 0.85 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 2dmz h VAL 90 CO -0.23 0.07 0.24 -0.07 0.02 0.00 0.00 177.57 177.60 2dmz h LEU 91 N 0.36 0.45 -0.99 2.57 3.38 -0.74 -1.81 115.31 118.54 2dmz h LEU 91 Ca 0.17 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.12 2dmz h LEU 91 Cb 0.10 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 2dmz h LEU 91 CO -0.14 0.34 0.65 0.03 0.09 0.00 0.00 178.44 179.42 2dmz h ARG 92 N 0.51 1.29 -0.69 1.13 3.08 -1.07 -2.22 114.38 116.40 2dmz h ARG 92 Ca 0.14 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 2dmz h ARG 92 Cb -0.03 -0.29 -0.03 0.00 0.08 0.00 0.00 29.97 29.70 2dmz h ARG 92 CO -0.03 0.85 0.23 -0.91 -1.07 0.00 0.00 179.97 179.05 2dmz h ASN 93 N 1.33 0.97 -3.64 7.04 2.35 -0.70 -3.44 115.58 119.48 2dmz h ASN 93 Ca 0.36 -0.16 -0.51 0.00 -0.55 0.00 0.00 56.30 55.44 2dmz h ASN 93 Cb -0.14 -0.25 0.21 0.00 0.05 0.00 0.00 38.32 38.18 2dmz h ASN 93 CO -0.08 0.89 -0.26 0.00 -1.65 0.00 0.00 177.43 176.33 2dmz n ALA 94 N -2.45 -2.06 -2.74 -0.83 0.00 -0.72 -5.04 120.51 106.67 2dmz n ALA 94 Ca 0.06 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.81 2dmz n ALA 94 Cb 0.21 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 17.71 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 1.02 4.24 0.45 0.00 0.00 -1.26 -5.01 105.19 104.63 2dmz n GLY 95 Ca 0.08 -1.82 -0.18 0.00 0.00 0.00 0.00 46.02 44.10 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 -0.99 -6.10 1.61 4.15 -1.89 -3.37 115.11 108.52 2dmz h GLN 96 Ca 0.00 0.07 -0.50 0.00 0.77 0.00 0.00 58.65 58.99 2dmz h GLN 96 Cb 0.00 0.23 -0.07 0.00 0.21 0.00 0.00 27.48 27.85 2dmz h GLN 96 CO 0.00 -0.66 1.18 0.08 -1.93 0.00 0.00 178.83 177.50 2dmz s VAL 97 N -5.99 3.61 -0.37 2.39 1.01 -1.26 -3.56 120.40 116.23 2dmz s VAL 97 Ca -0.18 0.00 -0.06 0.00 0.00 0.00 0.00 61.98 61.75 2dmz s VAL 97 Cb 0.04 -4.52 0.07 0.00 0.00 0.00 0.00 36.38 31.96 2dmz s VAL 97 CO 0.61 -1.46 0.16 -0.69 0.00 0.00 0.00 175.10 173.72 2dmz s VAL 98 N 7.23 3.66 -0.86 2.92 1.01 -0.89 -4.92 120.40 128.54 2dmz s VAL 98 Ca 0.52 -1.47 -0.19 0.00 0.00 0.00 0.00 61.98 60.83 2dmz s VAL 98 Cb -0.08 -3.23 0.12 0.00 0.00 0.00 0.00 36.38 33.20 2dmz s VAL 98 CO 0.09 -0.38 1.06 -1.00 0.00 0.00 0.00 175.10 174.87 2dmz s HIS 99 N 1.32 3.06 -0.01 5.22 3.76 -1.24 -0.41 115.29 126.99 2dmz s HIS 99 Ca 0.01 -1.25 -0.30 0.00 -0.15 0.00 0.00 55.06 53.37 2dmz s HIS 99 Cb -0.21 -4.25 -0.04 0.00 1.11 0.00 0.00 32.58 29.19 2dmz s HIS 99 CO 0.00 -1.49 1.16 -1.17 -0.85 0.00 0.00 174.74 172.40 2dmz s LEU 100 N 2.82 4.32 -0.38 0.89 1.98 0.79 0.83 118.68 129.93 2dmz s LEU 100 Ca 0.29 1.85 -0.14 0.00 -2.89 0.00 0.00 54.13 53.24 2dmz s LEU 100 Cb -0.08 -3.57 0.01 0.00 0.66 0.00 0.00 46.19 43.21 2dmz s LEU 100 CO -0.05 -0.50 0.27 -0.89 -1.89 0.00 0.00 176.35 173.28 2dmz s THR 101 N 1.66 5.17 0.21 3.68 2.01 0.10 -0.48 115.64 127.99 2dmz s THR 101 Ca 0.56 -0.53 0.11 0.00 0.31 0.00 0.00 61.69 62.14 2dmz s THR 101 Cb -0.26 -3.80 -0.05 0.00 0.01 0.00 0.00 72.50 68.41 2dmz s THR 101 CO 0.25 -0.19 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.01 2dmz s LEU 102 N 1.68 2.51 -0.23 4.42 1.02 -0.86 -1.74 118.68 125.48 2dmz s LEU 102 Ca 0.05 -0.87 -0.02 0.00 0.02 0.00 0.00 54.13 53.31 2dmz s LEU 102 Cb -0.18 -1.20 0.07 0.00 0.02 0.00 0.00 46.19 44.90 2dmz s LEU 102 CO 0.10 0.10 0.05 0.54 0.02 0.00 0.00 176.35 177.16 2dmz s VAL 103 N -1.82 0.63 0.17 -1.59 0.11 -0.92 -1.48 120.40 115.50 2dmz s VAL 103 Ca 0.23 -0.80 0.06 0.00 -2.93 0.00 0.00 61.98 58.54 2dmz s VAL 103 Cb -0.07 -1.22 -0.04 0.00 -1.53 0.00 0.00 36.38 33.52 2dmz s VAL 103 CO 0.11 -0.34 0.09 -0.13 -3.33 0.00 0.00 175.10 171.50 2dmz s ARG 104 N 1.79 2.72 0.18 1.54 0.52 -0.95 -4.37 118.95 120.38 2dmz s ARG 104 Ca 0.02 -0.95 -0.31 0.00 -0.52 0.00 0.00 55.73 53.97 2dmz s ARG 104 Cb -0.17 -2.54 -0.09 0.00 0.52 0.00 0.00 34.95 32.67 2dmz s ARG 104 CO -0.13 0.48 1.41 0.50 0.02 0.00 0.00 175.30 177.57 2dmz s ARG 105 N -3.03 4.31 -0.01 3.54 3.52 -1.26 -0.09 118.95 125.93 2dmz s ARG 105 Ca 0.30 2.18 -0.23 0.00 -0.13 0.00 0.00 55.73 57.84 2dmz s ARG 105 Cb -0.10 -3.18 -0.19 0.00 -1.56 0.00 0.00 34.95 29.92 2dmz s ARG 105 CO 0.22 -0.41 1.19 0.87 -0.81 0.00 0.00 175.30 176.36 2dmz h LYS 106 N 5.97 0.22 -4.16 5.12 1.57 -1.47 -3.46 116.57 120.36 2dmz h LYS 106 Ca -0.44 -0.16 -0.46 0.00 -1.87 0.00 0.00 60.65 57.72 2dmz h LYS 106 Cb 1.21 0.03 0.08 0.00 0.08 0.00 0.00 32.23 33.63 2dmz h LYS 106 CO 0.83 0.79 -0.41 2.41 -0.57 0.00 0.00 179.45 182.50 2dmz n THR 107 N -4.57 1.26 -1.50 -0.16 -1.04 -1.26 -4.48 114.28 102.52 2dmz n THR 107 Ca -0.08 -0.35 -0.62 0.00 -2.04 0.00 0.00 64.05 60.96 2dmz n THR 107 Cb 0.41 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.82 2dmz n THR 107 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2dmz n SER 108 N 1.42 1.00 -3.38 8.00 7.64 -1.26 -4.86 113.62 122.17 2dmz n SER 108 Ca 0.12 0.96 -0.04 0.00 1.01 0.00 0.00 58.87 60.92 2dmz n SER 108 Cb 0.19 -0.85 0.01 0.00 -1.01 0.00 0.00 64.21 62.55 2dmz n SER 108 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dmz s SER 109 N 3.92 -0.04 -0.32 6.43 1.04 -1.26 -5.03 113.70 118.45 2dmz s SER 109 Ca 1.06 -0.69 -0.06 0.00 0.48 0.00 0.00 55.95 56.75 2dmz s SER 109 Cb -1.44 0.55 -0.18 0.00 0.10 0.00 0.00 66.02 65.05 2dmz s SER 109 CO 0.73 -1.08 2.92 -1.20 0.98 0.00 0.00 173.24 175.59 2dmz n SER 110 N -1.08 4.94 -4.06 7.02 7.64 -1.26 -4.79 113.62 122.03 2dmz n SER 110 Ca -0.04 -2.33 -0.08 0.00 1.01 0.00 0.00 58.87 57.43 2dmz n SER 110 Cb 0.60 -1.20 -0.10 0.00 -1.01 0.00 0.00 64.21 62.50 2dmz n SER 110 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2dmz s THR 111 N 1.71 0.20 0.51 0.44 -4.23 -1.26 -5.13 115.64 107.87 2dmz s THR 111 Ca 0.55 -1.72 -0.15 0.00 -1.18 0.00 0.00 61.69 59.20 2dmz s THR 111 Cb 0.23 -1.54 -0.12 0.00 1.34 0.00 0.00 72.50 72.40 2dmz s THR 111 CO -0.01 -0.89 -0.24 -1.54 -0.54 0.00 0.00 174.62 171.40 2dmz n SER 112 N 0.06 -3.47 -2.86 3.99 3.41 -1.26 -4.94 113.62 108.54 2dmz n SER 112 Ca -0.13 0.44 0.00 0.00 -0.26 0.00 0.00 58.87 58.92 2dmz n SER 112 Cb 0.61 -0.68 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 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 1.43 -0.31 0.08 4.33 -0.04 -1.26 -4.94 135.00 134.28 2dmz n PRO 113 Ca 0.05 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.38 2dmz n PRO 113 Cb 0.40 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.81 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 0.46 -6.27 1.53 -0.00 -1.92 -3.38 115.31 105.73 2dmz h LEU 114 Ca 0.00 -0.39 -0.58 0.00 -0.00 0.00 0.00 57.88 56.91 2dmz h LEU 114 Cb 0.00 -0.14 -0.40 0.00 -0.00 0.00 0.00 40.66 40.12 2dmz h LEU 114 CO 0.00 1.20 -0.91 1.21 -0.00 0.00 0.00 178.44 179.94 2dmz n GLU 115 N -3.70 1.05 -1.39 0.17 2.13 -1.26 -5.12 120.64 112.51 2dmz n GLU 115 Ca -0.06 -3.64 -0.32 0.00 0.66 0.00 0.00 57.16 53.80 2dmz n GLU 115 Cb 0.86 -1.67 0.08 0.00 0.27 0.00 0.00 31.44 30.98 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 -1.12 2.40 -1.07 5.31 0.04 -1.26 -4.90 135.00 134.39 2dmz s PRO 116 Ca 0.34 1.24 -0.23 0.00 0.04 0.00 0.00 61.00 62.39 2dmz s PRO 116 Cb 0.10 -1.91 -0.07 0.00 0.04 0.00 0.00 34.50 32.66 2dmz s PRO 116 CO -0.12 -1.54 1.94 -1.25 0.04 0.00 0.00 177.00 176.06 2dmz s PRO 117 N -4.67 2.51 0.19 0.56 0.04 -1.26 -4.81 135.00 127.57 2dmz s PRO 117 Ca 0.63 -0.83 -0.21 0.00 0.04 0.00 0.00 61.00 60.64 2dmz s PRO 117 Cb -0.18 -5.17 0.07 0.00 0.04 0.00 0.00 34.50 29.26 2dmz s PRO 117 CO 0.52 -3.75 0.99 -1.13 0.04 0.00 0.00 177.00 173.67 2dmz n SER 118 N 14.24 -1.74 -3.39 6.66 3.41 -1.26 -5.17 113.62 126.37 2dmz n SER 118 Ca 0.43 -1.94 -0.26 0.00 -0.26 0.00 0.00 58.87 56.84 2dmz n SER 118 Cb 0.47 2.83 0.22 0.00 -0.26 0.00 0.00 64.21 67.47 2dmz n SER 118 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2dmz n ASP 119 N -1.30 -2.08 -4.99 4.04 9.92 -1.26 -5.06 116.55 115.82 2dmz n ASP 119 Ca -0.03 -1.06 -0.19 0.00 -0.53 0.00 0.00 54.79 52.99 2dmz n ASP 119 Cb 0.57 -0.87 0.03 0.00 -0.64 0.00 0.00 41.12 40.22 2dmz n ASP 119 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 2dmz s ARG 120 N -5.12 2.60 0.14 -1.24 3.00 -1.26 -4.87 118.95 112.19 2dmz s ARG 120 Ca 0.61 -1.24 0.05 0.00 0.00 0.00 0.00 55.73 55.16 2dmz s ARG 120 Cb -0.06 -2.66 -0.04 0.00 0.00 0.00 0.00 34.95 32.18 2dmz s ARG 120 CO 0.47 -0.55 -0.13 0.20 0.00 0.00 0.00 175.30 175.30 2dmz s GLY 121 N -4.46 1.10 -0.34 -3.53 0.00 -1.26 -4.71 107.32 94.13 2dmz s GLY 121 Ca 0.58 -1.39 -0.25 0.00 0.00 0.00 0.00 44.72 43.66 2dmz s GLY 121 CO 0.36 -1.47 0.85 -1.08 0.00 0.00 0.00 173.10 171.76 2dmz s THR 122 N -2.64 4.70 0.04 0.90 -1.32 -1.26 -5.04 115.64 111.02 2dmz s THR 122 Ca 0.13 1.18 0.03 0.00 -1.21 0.00 0.00 61.69 61.82 2dmz s THR 122 Cb -0.02 -4.24 -0.04 0.00 -1.51 0.00 0.00 72.50 66.70 2dmz s THR 122 CO 0.02 -0.38 -0.01 -0.69 -2.21 0.00 0.00 174.62 171.35 2dmz s VAL 123 N 3.19 4.02 -0.16 5.08 1.01 -1.26 -5.02 120.40 127.26 2dmz s VAL 123 Ca 0.35 -0.80 -0.04 0.00 0.00 0.00 0.00 61.98 61.49 2dmz s VAL 123 Cb -0.13 -2.85 -0.08 0.00 0.00 0.00 0.00 36.38 33.32 2dmz s VAL 123 CO 0.15 0.26 -0.17 -1.54 0.00 0.00 0.00 175.10 173.80 2dmz n SER 124 N 1.03 1.94 0.00 3.32 3.41 -1.26 -5.10 113.62 116.96 2dmz n SER 124 Ca -0.13 0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 2dmz n SER 124 Cb 0.52 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 64.11 2dmz n SER 124 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dmz n GLY 125 N 2.37 1.34 3.66 5.00 0.00 -1.26 -5.04 105.19 111.27 2dmz n GLY 125 Ca -0.29 -0.78 -0.29 0.00 0.00 0.00 0.00 46.02 44.66 2dmz n GLY 125 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dmz s PRO 126 N 0.00 0.07 -0.35 1.61 0.04 -1.26 -4.78 135.00 130.33 2dmz s PRO 126 Ca 0.00 0.40 0.02 0.00 0.04 0.00 0.00 61.00 61.46 2dmz s PRO 126 Cb 0.00 -1.71 0.10 0.00 0.04 0.00 0.00 34.50 32.93 2dmz s PRO 126 CO 0.00 -2.95 0.07 0.45 0.04 0.00 0.00 177.00 174.61 2dmz s SER 127 N -3.52 4.86 0.00 6.66 0.15 -1.26 -4.89 113.70 115.71 2dmz s SER 127 Ca 0.66 -2.04 0.00 0.00 0.70 0.00 0.00 55.95 55.27 2dmz s SER 127 Cb -0.17 -1.67 0.00 0.00 -1.71 0.00 0.00 66.02 62.46 2dmz s SER 127 CO 0.57 -0.40 0.00 -1.54 1.20 0.00 0.00 173.24 173.08 2dmz n SER 128 N 4.36 0.66 -0.48 5.45 3.41 -1.26 -5.31 113.62 120.44 2dmz n SER 128 Ca 0.01 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.76 2dmz n SER 128 Cb 0.42 0.00 0.52 0.00 -0.26 0.00 0.00 64.21 64.89 2dmz n SER 128 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49