#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pas n ALA 2 N 0.00 2.63 -0.02 0.00 0.00 -1.24 -4.48 120.51 117.40 2pas n ALA 2 Ca 0.00 -1.81 -0.08 0.00 0.00 0.00 0.00 53.44 51.55 2pas n ALA 2 Cb 0.00 -0.58 -0.13 0.00 0.00 0.00 0.00 19.45 18.74 2pas n ALA 2 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2pas n LYS 3 N -0.11 0.63 0.15 0.00 4.81 -1.23 -3.79 118.16 118.62 2pas n LYS 3 Ca 0.17 0.29 0.13 0.00 -0.87 0.00 0.00 58.31 58.02 2pas n LYS 3 Cb 0.68 -1.79 0.50 0.00 0.02 0.00 0.00 35.03 34.44 2pas n LYS 3 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 2pas h ASP 4 N 0.00 0.00 -0.42 3.14 5.19 -1.91 -2.16 116.42 120.26 2pas h ASP 4 Ca -0.28 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.13 2pas h ASP 4 Cb 1.97 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.48 2pas h ASP 4 CO 0.08 0.00 0.00 -0.11 -3.12 0.00 0.00 179.24 176.09 2pas n LEU 5 N -2.36 2.72 0.00 1.55 0.00 -1.25 -4.92 117.00 112.75 2pas n LEU 5 Ca 0.02 -1.28 -0.04 0.00 0.00 0.00 0.00 56.01 54.72 2pas n LEU 5 Cb 0.26 -0.28 -0.01 0.00 0.00 0.00 0.00 43.42 43.40 2pas n LEU 5 CO 0.22 0.64 -0.02 0.18 0.00 0.00 0.00 177.39 178.41 2pas n LEU 6 N 0.99 0.00 -0.77 -1.96 7.99 -0.81 -5.04 117.00 117.40 2pas n LEU 6 Ca 0.18 -0.38 0.09 0.00 -0.01 0.00 0.00 56.01 55.89 2pas n LEU 6 Cb 0.46 0.03 0.09 0.00 -0.11 0.00 0.00 43.42 43.89 2pas n LEU 6 CO 0.13 -0.11 0.56 0.29 -1.51 0.00 0.00 177.39 176.74 2pas n LYS 7 N -0.28 1.67 0.00 3.23 4.01 -1.26 -4.99 118.16 120.54 2pas n LYS 7 Ca -0.02 -1.67 0.00 0.00 -0.51 0.00 0.00 58.31 56.11 2pas n LYS 7 Cb 0.08 -1.36 0.00 0.00 -0.51 0.00 0.00 35.03 33.24 2pas n LYS 7 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2pas n ALA 8 N 1.06 0.00 0.30 7.82 0.00 -1.26 -4.51 120.51 123.91 2pas n ALA 8 Ca 0.11 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.72 2pas n ALA 8 Cb 0.47 0.00 0.92 0.00 0.00 0.00 0.00 19.45 20.84 2pas n ALA 8 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2pas h ASP 9 N 0.00 0.00 0.78 0.00 3.32 -1.98 -0.20 116.42 118.33 2pas h ASP 9 Ca 0.00 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.95 2pas h ASP 9 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2pas h ASP 9 CO 0.00 0.03 -0.47 0.44 -1.72 0.00 0.00 179.24 177.52 2pas h ASP 10 N 0.00 0.00 1.06 6.45 5.19 -1.87 -2.03 116.42 125.22 2pas h ASP 10 Ca -0.00 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.22 2pas h ASP 10 Cb 0.10 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.59 2pas h ASP 10 CO 0.00 0.47 -0.90 0.40 -3.12 0.00 0.00 179.24 176.09 2pas h ILE 11 N 0.00 1.57 -0.00 0.35 2.04 -1.35 -2.99 117.51 117.13 2pas h ILE 11 Ca -0.00 -3.18 0.00 0.00 1.00 0.00 0.00 64.86 62.67 2pas h ILE 11 Cb 0.99 2.75 0.00 0.00 -0.74 0.00 0.00 36.82 39.82 2pas h ILE 11 CO 0.06 0.89 -0.27 2.29 0.00 0.00 0.00 178.15 181.12 2pas n LYS 12 N -3.35 0.19 -0.09 2.37 2.85 -1.03 -2.59 118.16 116.51 2pas n LYS 12 Ca 0.00 -0.08 -0.21 0.00 -1.05 0.00 0.00 58.31 56.97 2pas n LYS 12 Cb 0.89 -1.50 -0.12 0.00 -0.65 0.00 0.00 35.03 33.66 2pas n LYS 12 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 177.40 178.22 2pas h LYS 13 N 0.19 0.03 -0.04 -1.58 1.57 -1.33 -2.85 116.57 112.55 2pas h LYS 13 Ca 0.00 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2pas h LYS 13 Cb 0.47 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.80 2pas h LYS 13 CO 0.00 1.02 -0.01 0.00 -0.57 0.00 0.00 179.45 179.90 2pas h ALA 14 N -0.41 0.05 -0.46 3.86 0.00 -1.65 -2.08 119.26 118.57 2pas h ALA 14 Ca -0.34 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 2pas h ALA 14 Cb 1.36 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 2pas h ALA 14 CO -0.17 -0.25 0.26 -0.07 0.00 0.00 0.00 179.25 179.02 2pas h LEU 15 N -0.26 0.56 -1.32 0.00 -0.00 -1.69 -0.02 115.31 112.57 2pas h LEU 15 Ca 0.01 -0.03 -0.01 0.00 -0.00 0.00 0.00 57.88 57.85 2pas h LEU 15 Cb 0.38 -0.14 -0.00 0.00 -0.00 0.00 0.00 40.66 40.90 2pas h LEU 15 CO 0.00 0.44 -0.05 0.44 -0.00 0.00 0.00 178.44 179.27 2pas h ASP 16 N 0.64 0.00 0.80 -0.43 5.19 -1.29 0.28 116.42 121.60 2pas h ASP 16 Ca 0.17 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.51 2pas h ASP 16 Cb 0.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 2pas h ASP 16 CO -0.03 0.05 -1.24 0.00 -3.12 0.00 0.00 179.24 174.90 2pas n ALA 17 N -2.12 2.32 -0.03 3.45 0.00 -0.14 -4.30 120.51 119.68 2pas n ALA 17 Ca 0.01 -0.38 0.03 0.00 0.00 0.00 0.00 53.44 53.10 2pas n ALA 17 Cb 0.34 -1.01 -0.14 0.00 0.00 0.00 0.00 19.45 18.64 2pas n ALA 17 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2pas n VAL 18 N -2.72 0.38 -0.46 0.00 0.24 -0.53 -4.55 118.33 110.70 2pas n VAL 18 Ca -0.04 -0.51 0.35 0.00 -2.04 0.00 0.00 64.34 62.09 2pas n VAL 18 Cb 0.66 -0.13 0.54 0.00 -1.47 0.00 0.00 33.84 33.45 2pas n VAL 18 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2pas n LYS 19 N -2.29 0.00 -0.65 7.34 5.02 0.06 -4.07 118.16 123.57 2pas n LYS 19 Ca -0.11 0.74 -0.24 0.00 -2.02 0.00 0.00 58.31 56.67 2pas n LYS 19 Cb 0.66 -1.72 0.13 0.00 -0.02 0.00 0.00 35.03 34.09 2pas n LYS 19 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2pas n ALA 20 N -2.57 -2.22 -2.88 7.82 0.00 -1.26 -4.79 120.51 114.61 2pas n ALA 20 Ca 0.29 -1.11 -0.43 0.00 0.00 0.00 0.00 53.44 52.19 2pas n ALA 20 Cb 1.36 -1.01 0.01 0.00 0.00 0.00 0.00 19.45 19.80 2pas n ALA 20 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2pas n GLU 21 N -1.05 4.31 0.00 0.00 1.02 -1.26 -4.03 120.64 119.63 2pas n GLU 21 Ca 0.03 -4.36 0.00 0.00 -0.02 0.00 0.00 57.16 52.81 2pas n GLU 21 Cb 0.48 -2.59 0.00 0.00 -0.02 0.00 0.00 31.44 29.30 2pas n GLU 21 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2pas n GLY 22 N 1.62 1.40 1.47 0.62 0.00 -1.26 -5.01 105.19 104.03 2pas n GLY 22 Ca 0.29 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.40 2pas n GLY 22 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2pas n SER 23 N 0.00 4.57 -4.73 1.61 3.41 -1.26 -4.95 113.62 112.27 2pas n SER 23 Ca 0.00 -2.44 -0.41 0.00 -0.26 0.00 0.00 58.87 55.76 2pas n SER 23 Cb 0.00 -0.55 -0.05 0.00 -0.26 0.00 0.00 64.21 63.35 2pas n SER 23 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2pas s PHE 24 N -1.83 3.78 -0.31 7.33 2.19 -1.26 -4.42 117.98 123.45 2pas s PHE 24 Ca 0.49 1.69 -0.01 0.00 0.33 0.00 0.00 56.93 59.42 2pas s PHE 24 Cb 0.31 -2.98 0.10 0.00 -1.31 0.00 0.00 43.02 39.15 2pas s PHE 24 CO 0.23 0.22 0.11 1.21 1.83 0.00 0.00 175.22 178.82 2pas s ASN 25 N 0.03 3.90 0.48 6.13 2.47 -1.26 -4.95 114.94 121.74 2pas s ASN 25 Ca 0.44 -1.59 0.41 0.00 0.42 0.00 0.00 52.86 52.54 2pas s ASN 25 Cb -0.22 -0.74 1.41 0.00 -1.45 0.00 0.00 41.25 40.24 2pas s ASN 25 CO 0.27 -0.42 1.31 0.00 -3.72 0.00 0.00 177.10 174.55 2pas n HIS 26 N 4.90 0.00 0.01 0.43 1.44 -1.26 -0.27 115.22 120.46 2pas n HIS 26 Ca -0.02 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.62 2pas n HIS 26 Cb 0.42 -0.40 -0.05 0.00 0.12 0.00 0.00 29.99 30.07 2pas n HIS 26 CO 0.00 0.00 0.00 0.87 -2.81 0.00 0.00 176.34 174.40 2pas h LYS 27 N 0.00 -0.14 -0.02 -1.40 1.57 -1.87 -3.08 116.57 111.63 2pas h LYS 27 Ca 0.76 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.55 2pas h LYS 27 Cb 3.17 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 35.51 2pas h LYS 27 CO -0.01 0.19 -0.00 0.87 -0.57 0.00 0.00 179.45 179.93 2pas h LYS 28 N -0.99 0.03 -0.07 3.15 1.79 -0.87 -0.22 116.57 119.38 2pas h LYS 28 Ca -0.01 -0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.46 2pas h LYS 28 Cb 0.39 -0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.00 2pas h LYS 28 CO 0.02 0.36 -0.33 0.35 -1.08 0.00 0.00 179.45 178.77 2pas h PHE 29 N -0.30 -0.99 -0.22 -1.35 3.57 -1.21 -0.65 116.94 115.79 2pas h PHE 29 Ca 0.00 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 2pas h PHE 29 Cb 0.35 0.44 -0.01 0.00 2.79 0.00 0.00 35.95 39.52 2pas h PHE 29 CO 0.04 -0.34 -0.01 0.74 -2.23 0.00 0.00 178.31 176.51 2pas h PHE 30 N -0.36 0.33 -0.45 0.41 -1.00 -1.61 -2.23 116.94 112.03 2pas h PHE 30 Ca 0.02 -0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 2pas h PHE 30 Cb 0.42 -0.10 -0.02 0.00 3.61 0.00 0.00 35.95 39.86 2pas h PHE 30 CO -0.52 0.35 0.21 0.00 -1.61 0.00 0.00 178.31 176.74 2pas h ALA 31 N 1.68 1.52 0.00 2.45 0.00 -0.06 -2.69 119.26 122.16 2pas h ALA 31 Ca 0.07 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2pas h ALA 31 Cb 0.24 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2pas h ALA 31 CO 0.01 0.38 -0.05 -0.07 0.00 0.00 0.00 179.25 179.52 2pas h LEU 32 N 0.64 0.00 -0.90 0.00 3.38 -0.59 -3.34 115.31 114.50 2pas h LEU 32 Ca 0.16 -0.72 0.23 0.00 0.09 0.00 0.00 57.88 57.64 2pas h LEU 32 Cb 0.08 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.70 2pas h LEU 32 CO -0.02 0.89 0.39 1.62 0.09 0.00 0.00 178.44 181.40 2pas h VAL 33 N -1.00 0.44 0.00 1.22 3.04 -1.39 -3.45 116.25 115.10 2pas h VAL 33 Ca -0.01 -0.13 0.00 0.00 -1.01 0.00 0.00 66.70 65.55 2pas h VAL 33 Cb 0.75 0.04 0.00 0.00 -2.01 0.00 0.00 31.29 30.07 2pas h VAL 33 CO -0.01 0.07 0.00 0.61 -1.01 0.00 0.00 177.57 177.23 2pas n GLY 34 N -1.34 1.36 0.62 3.17 0.00 -1.02 -4.79 105.19 103.20 2pas n GLY 34 Ca 0.23 0.00 0.46 0.00 0.00 0.00 0.00 46.02 46.71 2pas n GLY 34 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2pas h LEU 35 N 0.00 0.05 -0.04 0.99 7.12 -1.86 0.25 115.31 121.81 2pas h LEU 35 Ca 0.00 0.02 0.02 0.00 0.13 0.00 0.00 57.88 58.05 2pas h LEU 35 Cb 0.00 0.02 -0.02 0.00 -0.53 0.00 0.00 40.66 40.13 2pas h LEU 35 CO 0.00 -0.03 -0.07 0.50 -0.13 0.00 0.00 178.44 178.71 2pas h LYS 36 N 0.02 -0.10 -0.75 1.25 1.63 -1.64 -2.50 116.57 114.48 2pas h LYS 36 Ca 0.82 0.01 -0.17 0.00 -0.85 0.00 0.00 60.65 60.46 2pas h LYS 36 Cb 3.18 0.02 -0.10 0.00 -0.60 0.00 0.00 32.23 34.73 2pas h LYS 36 CO -0.08 -0.06 0.22 0.00 -3.45 0.00 0.00 179.45 176.07 2pas n ALA 37 N -2.31 4.36 -1.25 5.00 0.00 0.83 -4.65 120.51 122.48 2pas n ALA 37 Ca -0.05 -2.10 -0.14 0.00 0.00 0.00 0.00 53.44 51.15 2pas n ALA 37 Cb 0.12 -1.22 0.16 0.00 0.00 0.00 0.00 19.45 18.51 2pas n ALA 37 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2pas n MET 38 N 0.01 -1.96 -3.52 0.00 2.81 -0.89 -5.00 117.12 108.57 2pas n MET 38 Ca 0.36 -1.30 -0.38 0.00 -1.81 0.00 0.00 57.70 54.57 2pas n MET 38 Cb 1.30 -1.08 -0.10 0.00 -0.71 0.00 0.00 33.22 32.63 2pas n MET 38 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 2pas s SER 39 N -3.86 6.17 0.44 7.83 1.04 -1.26 -4.93 113.70 119.13 2pas s SER 39 Ca 0.51 0.19 0.37 0.00 0.48 0.00 0.00 55.95 57.49 2pas s SER 39 Cb -0.04 -2.16 1.25 0.00 0.10 0.00 0.00 66.02 65.18 2pas s SER 39 CO 0.38 -0.06 1.18 0.00 0.98 0.00 0.00 173.24 175.72 2pas n ALA 40 N 4.84 1.38 0.10 5.32 0.00 -1.26 0.69 120.51 131.57 2pas n ALA 40 Ca -0.12 0.47 -0.09 0.00 0.00 0.00 0.00 53.44 53.70 2pas n ALA 40 Cb 0.51 -0.82 -0.06 0.00 0.00 0.00 0.00 19.45 19.08 2pas n ALA 40 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2pas h ASN 41 N 0.00 -0.28 0.00 0.00 2.35 -2.00 -2.43 115.58 113.22 2pas h ASN 41 Ca 0.68 -0.20 0.00 0.00 -0.55 0.00 0.00 56.30 56.23 2pas h ASN 41 Cb 2.85 0.07 0.00 0.00 0.05 0.00 0.00 38.32 41.29 2pas h ASN 41 CO -0.01 0.23 0.00 0.47 -1.65 0.00 0.00 177.43 176.48 2pas n ASP 42 N -4.99 0.00 -0.09 5.81 9.92 0.22 -2.05 116.55 125.36 2pas n ASP 42 Ca -0.07 -0.68 -0.23 0.00 -0.53 0.00 0.00 54.79 53.28 2pas n ASP 42 Cb 0.23 0.00 -0.12 0.00 -0.64 0.00 0.00 41.12 40.59 2pas n ASP 42 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2pas n VAL 43 N -0.96 1.58 0.29 2.53 0.31 0.48 -1.75 118.33 120.80 2pas n VAL 43 Ca 0.14 -0.25 0.17 0.00 -0.01 0.00 0.00 64.34 64.39 2pas n VAL 43 Cb 0.06 -1.91 0.85 0.00 -0.91 0.00 0.00 33.84 31.93 2pas n VAL 43 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2pas h LYS 44 N -0.72 0.00 0.04 5.55 1.57 -1.23 0.10 116.57 121.89 2pas h LYS 44 Ca -0.44 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.10 2pas h LYS 44 Cb 1.55 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.84 2pas h LYS 44 CO -0.18 0.05 -1.11 -0.22 -0.57 0.00 0.00 179.45 177.42 2pas h LYS 45 N 0.00 0.08 -0.53 3.15 3.11 -1.49 -1.79 116.57 119.09 2pas h LYS 45 Ca -0.00 -0.15 -0.09 0.00 -2.81 0.00 0.00 60.65 57.60 2pas h LYS 45 Cb 0.31 0.05 -0.02 0.00 -1.00 0.00 0.00 32.23 31.57 2pas h LYS 45 CO 0.01 1.05 -0.03 0.28 -2.81 0.00 0.00 179.45 177.95 2pas h VAL 46 N 0.02 1.26 0.12 2.00 2.07 0.01 -2.77 116.25 118.96 2pas h VAL 46 Ca -0.06 -1.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.32 2pas h VAL 46 Cb 1.84 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 2pas h VAL 46 CO 0.15 0.40 -0.06 0.15 0.02 0.00 0.00 177.57 178.23 2pas h PHE 47 N 0.85 -0.15 -1.37 1.57 3.04 -1.24 -0.78 116.94 118.86 2pas h PHE 47 Ca 0.15 -0.00 0.40 0.00 3.98 0.00 0.00 57.97 62.50 2pas h PHE 47 Cb 0.54 0.05 -0.05 0.00 2.56 0.00 0.00 35.95 39.05 2pas h PHE 47 CO 0.03 0.15 1.06 -0.22 -2.02 0.00 0.00 178.31 177.31 2pas h LYS 48 N -0.46 0.00 0.19 1.11 3.11 -1.12 1.45 116.57 120.85 2pas h LYS 48 Ca -0.02 0.00 -0.28 0.00 -2.81 0.00 0.00 60.65 57.54 2pas h LYS 48 Cb 0.37 0.00 0.02 0.00 -1.00 0.00 0.00 32.23 31.63 2pas h LYS 48 CO 0.03 0.00 -1.29 0.00 -2.81 0.00 0.00 179.45 175.38 2pas h ALA 49 N 1.17 -0.06 -0.95 5.00 0.00 -1.07 -3.19 119.26 120.16 2pas h ALA 49 Ca 0.65 -0.87 0.25 0.00 0.00 0.00 0.00 54.91 54.95 2pas h ALA 49 Cb 2.76 0.22 -0.06 0.00 0.00 0.00 0.00 17.79 20.72 2pas h ALA 49 CO -0.01 0.64 0.65 0.82 0.00 0.00 0.00 179.25 181.36 2pas h ILE 50 N -0.09 0.57 -0.40 0.00 1.08 0.34 -2.84 117.51 116.17 2pas h ILE 50 Ca -0.24 -0.07 -0.68 0.00 -0.39 0.00 0.00 64.86 63.48 2pas h ILE 50 Cb 1.94 0.35 -0.06 0.00 -3.07 0.00 0.00 36.82 35.99 2pas h ILE 50 CO 0.20 0.04 2.64 -0.67 -0.69 0.00 0.00 178.15 179.66 2pas n ASP 51 N -4.40 4.29 -2.14 1.72 2.03 -0.33 -4.80 116.55 112.92 2pas n ASP 51 Ca 0.21 -2.87 -0.12 0.00 0.52 0.00 0.00 54.79 52.53 2pas n ASP 51 Cb 0.89 -1.69 -0.14 0.00 -0.72 0.00 0.00 41.12 39.46 2pas n ASP 51 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2pas n ALA 52 N 7.41 5.78 -1.45 -1.67 0.00 -1.08 -4.37 120.51 125.13 2pas n ALA 52 Ca 0.50 -1.69 0.00 0.00 0.00 0.00 0.00 53.44 52.25 2pas n ALA 52 Cb 0.42 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.50 2pas n ALA 52 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2pas n ASP 53 N 2.63 0.00 0.00 0.00 5.75 -1.26 -5.07 116.55 118.60 2pas n ASP 53 Ca 0.40 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.18 2pas n ASP 53 Cb 0.77 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.86 2pas n ASP 53 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2pas n ALA 54 N -3.00 0.00 -2.55 2.12 0.00 -1.26 -5.04 120.51 110.78 2pas n ALA 54 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 2pas n ALA 54 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 2pas n ALA 54 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2pas n SER 55 N 0.00 0.37 -2.59 0.00 3.41 -1.26 -4.98 113.62 108.56 2pas n SER 55 Ca 0.00 -2.05 -0.14 0.00 -0.26 0.00 0.00 58.87 56.42 2pas n SER 55 Cb 0.00 -0.07 -0.03 0.00 -0.26 0.00 0.00 64.21 63.86 2pas n SER 55 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2pas n GLY 56 N -0.33 -0.26 3.20 5.00 0.00 -1.26 -4.80 105.19 106.72 2pas n GLY 56 Ca -0.04 0.02 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 2pas n GLY 56 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2pas s PHE 57 N -1.83 -0.13 -0.42 1.61 0.08 -1.26 -4.77 117.98 111.25 2pas s PHE 57 Ca 0.28 0.21 -0.22 0.00 0.12 0.00 0.00 56.93 57.32 2pas s PHE 57 Cb -0.16 0.06 0.02 0.00 -0.57 0.00 0.00 43.02 42.37 2pas s PHE 57 CO 0.34 -0.34 0.71 0.42 -0.10 0.00 0.00 175.22 176.25 2pas s ILE 58 N -1.20 4.76 0.34 0.64 -1.09 -0.98 -4.49 121.20 119.18 2pas s ILE 58 Ca -0.13 0.43 -0.09 0.00 -2.23 0.00 0.00 60.65 58.63 2pas s ILE 58 Cb -0.06 -4.22 -0.06 0.00 -1.58 0.00 0.00 42.46 36.54 2pas s ILE 58 CO 0.03 -0.56 0.67 -1.61 -1.23 0.00 0.00 174.94 172.24 2pas s GLU 59 N 3.01 3.77 0.21 2.79 2.02 -1.26 -2.61 118.70 126.63 2pas s GLU 59 Ca 0.27 0.33 -0.11 0.00 0.02 0.00 0.00 54.97 55.48 2pas s GLU 59 Cb -0.13 -2.51 0.27 0.00 0.10 0.00 0.00 34.13 31.86 2pas s GLU 59 CO 0.19 0.11 1.70 0.93 0.02 0.00 0.00 175.26 178.22 2pas h GLU 60 N 1.69 0.23 0.00 1.61 5.08 -1.97 0.17 114.58 121.40 2pas h GLU 60 Ca -0.47 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 57.87 2pas h GLU 60 Cb 1.18 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.38 2pas h GLU 60 CO 0.65 0.15 -0.01 0.93 -1.00 0.00 0.00 179.01 179.74 2pas h GLU 61 N 0.24 0.00 -0.03 2.33 4.39 -1.96 -1.27 114.58 118.28 2pas h GLU 61 Ca 0.30 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.79 2pas h GLU 61 Cb 0.45 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 2pas h GLU 61 CO -0.40 0.01 -0.88 0.93 -1.16 0.00 0.00 179.01 177.51 2pas h GLU 62 N 0.00 0.44 -0.95 2.33 4.39 -1.07 -3.08 114.58 116.64 2pas h GLU 62 Ca -0.00 -0.44 0.10 0.00 0.34 0.00 0.00 59.36 59.36 2pas h GLU 62 Cb 0.02 0.11 -0.08 0.00 -0.10 0.00 0.00 28.75 28.71 2pas h GLU 62 CO 0.00 1.09 0.59 -0.07 -1.16 0.00 0.00 179.01 179.46 2pas h LEU 63 N 0.27 0.88 -0.04 1.33 3.38 -0.08 0.47 115.31 121.51 2pas h LEU 63 Ca -0.07 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2pas h LEU 63 Cb 1.50 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 42.11 2pas h LEU 63 CO 0.15 0.50 -0.03 0.50 0.09 0.00 0.00 178.44 179.66 2pas h LYS 64 N 0.98 0.09 -0.84 1.13 3.64 -1.49 -2.99 116.57 117.09 2pas h LYS 64 Ca 0.45 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.75 2pas h LYS 64 Cb 0.37 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 2pas h LYS 64 CO -0.24 0.52 0.05 1.19 -2.27 0.00 0.00 179.45 178.71 2pas n PHE 65 N -4.80 1.06 0.94 1.91 3.72 -0.95 -4.36 117.46 114.98 2pas n PHE 65 Ca -0.08 -0.48 0.00 0.00 -0.05 0.00 0.00 57.45 56.85 2pas n PHE 65 Cb 0.26 -0.34 0.00 0.00 -0.94 0.00 0.00 39.48 38.46 2pas n PHE 65 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 176.76 178.26 2pas n VAL 66 N 0.20 0.27 -0.85 -4.37 3.14 0.16 -3.32 118.33 113.56 2pas n VAL 66 Ca 0.16 0.00 0.06 0.00 -2.96 0.00 0.00 64.34 61.60 2pas n VAL 66 Cb 0.76 -0.61 0.09 0.00 -1.06 0.00 0.00 33.84 33.01 2pas n VAL 66 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 2pas n LEU 67 N 0.18 1.99 0.01 6.55 4.77 -1.26 -4.57 117.00 124.66 2pas n LEU 67 Ca 0.00 -2.52 -0.12 0.00 -0.03 0.00 0.00 56.01 53.34 2pas n LEU 67 Cb 0.30 -0.26 -0.14 0.00 -2.33 0.00 0.00 43.42 40.99 2pas n LEU 67 CO 0.00 0.59 -0.45 0.50 -1.33 0.00 0.00 177.39 176.70 2pas h LYS 68 N 0.00 0.09 0.00 3.23 1.63 -1.64 0.19 116.57 120.06 2pas h LYS 68 Ca 0.00 -0.15 -0.08 0.00 -0.85 0.00 0.00 60.65 59.57 2pas h LYS 68 Cb 0.90 0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.57 2pas h LYS 68 CO 0.00 0.78 -0.80 0.77 -3.45 0.00 0.00 179.45 176.76 2pas h SER 69 N 0.02 0.00 0.07 4.20 0.02 -1.85 -3.30 113.55 112.72 2pas h SER 69 Ca -0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 2pas h SER 69 Cb 1.99 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.53 2pas h SER 69 CO 0.10 0.31 -1.88 0.49 -1.14 0.00 0.00 176.83 174.71 2pas n PHE 70 N -2.97 0.07 -3.65 3.45 3.72 -1.25 -3.56 117.46 113.27 2pas n PHE 70 Ca -0.01 0.02 -0.16 0.00 -0.05 0.00 0.00 57.45 57.25 2pas n PHE 70 Cb 0.68 -0.51 -0.14 0.00 -0.94 0.00 0.00 39.48 38.56 2pas n PHE 70 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2pas s ALA 71 N -3.49 -0.31 0.61 4.37 0.00 0.64 -4.92 121.76 118.67 2pas s ALA 71 Ca -0.07 0.66 0.29 0.00 0.00 0.00 0.00 51.96 52.85 2pas s ALA 71 Cb 0.14 -0.94 1.59 0.00 0.00 0.00 0.00 23.12 23.91 2pas s ALA 71 CO 0.90 -0.66 1.98 0.00 0.00 0.00 0.00 175.76 177.98 2pas h ALA 72 N 8.33 1.87 0.03 0.00 0.00 -1.75 -0.92 119.26 126.83 2pas h ALA 72 Ca -0.14 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.46 2pas h ALA 72 Cb 1.12 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 2pas h ALA 72 CO 0.15 -0.49 -1.74 0.22 0.00 0.00 0.00 179.25 177.40 2pas h ASP 73 N 0.00 0.11 -3.66 0.00 1.82 -1.88 -3.49 116.42 109.32 2pas h ASP 73 Ca 0.13 -0.24 0.00 0.00 -0.39 0.00 0.00 57.03 56.52 2pas h ASP 73 Cb 0.83 -0.04 0.00 0.00 0.68 0.00 0.00 39.33 40.80 2pas h ASP 73 CO -0.00 1.22 -0.14 0.61 -1.61 0.00 0.00 179.24 179.32 2pas n GLY 74 N 1.65 -0.86 3.55 -0.78 0.00 -0.35 -4.77 105.19 103.63 2pas n GLY 74 Ca -0.20 0.28 -0.15 0.00 0.00 0.00 0.00 46.02 45.95 2pas n GLY 74 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2pas n ARG 75 N -0.48 0.52 -1.60 1.61 0.63 -1.26 -4.85 116.66 111.23 2pas n ARG 75 Ca 0.03 -0.72 -0.53 0.00 -0.92 0.00 0.00 57.85 55.72 2pas n ARG 75 Cb 0.15 -3.40 -0.06 0.00 0.45 0.00 0.00 32.46 29.60 2pas n ARG 75 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2pas n ASP 76 N 17.25 1.71 -3.81 6.15 8.00 -1.26 -4.91 116.55 139.68 2pas n ASP 76 Ca 0.49 1.11 -0.30 0.00 0.71 0.00 0.00 54.79 56.80 2pas n ASP 76 Cb 0.40 -1.18 0.26 0.00 -0.02 0.00 0.00 41.12 40.58 2pas n ASP 76 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2pas s LEU 77 N 0.83 0.04 0.00 0.64 1.02 -1.26 -4.93 118.68 115.02 2pas s LEU 77 Ca 0.86 0.87 0.24 0.00 0.02 0.00 0.00 54.13 56.12 2pas s LEU 77 Cb -0.97 -2.53 0.29 0.00 0.02 0.00 0.00 46.19 43.00 2pas s LEU 77 CO 0.49 -4.58 1.27 0.41 0.02 0.00 0.00 176.35 173.96 2pas n THR 78 N -5.10 0.00 0.00 5.49 -1.04 -1.26 -4.97 114.28 107.40 2pas n THR 78 Ca 0.11 -0.14 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 2pas n THR 78 Cb 0.59 0.80 0.00 0.00 -1.82 0.00 0.00 70.33 69.89 2pas n THR 78 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2pas n ASP 79 N -0.65 0.00 -0.00 8.00 2.03 -1.26 -4.66 116.55 120.00 2pas n ASP 79 Ca 0.09 0.00 0.03 0.00 0.52 0.00 0.00 54.79 55.43 2pas n ASP 79 Cb 0.39 0.00 0.40 0.00 -0.72 0.00 0.00 41.12 41.19 2pas n ASP 79 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2pas h ALA 80 N 0.00 1.65 -0.12 -1.67 0.00 -1.97 0.95 119.26 118.10 2pas h ALA 80 Ca 0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2pas h ALA 80 Cb 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2pas h ALA 80 CO 0.00 0.30 -0.11 0.93 0.00 0.00 0.00 179.25 180.37 2pas h GLU 81 N 0.55 0.18 0.00 0.00 5.08 -1.93 -0.23 114.58 118.23 2pas h GLU 81 Ca 0.14 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.36 2pas h GLU 81 Cb -0.00 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2pas h GLU 81 CO -0.03 0.30 -0.51 1.15 -1.00 0.00 0.00 179.01 178.92 2pas h THR 82 N 0.17 0.92 -0.00 1.13 2.02 -1.26 -2.71 112.91 113.17 2pas h THR 82 Ca 0.04 -2.19 0.00 0.00 0.77 0.00 0.00 66.41 65.03 2pas h THR 82 Cb 0.30 2.38 0.00 0.00 -1.74 0.00 0.00 68.15 69.09 2pas h THR 82 CO 0.02 0.50 -0.16 1.17 0.37 0.00 0.00 175.52 177.42 2pas n LYS 83 N -3.27 0.39 -0.08 6.66 3.00 -0.20 -3.14 118.16 121.53 2pas n LYS 83 Ca 0.02 -0.13 -0.22 0.00 -0.00 0.00 0.00 58.31 57.97 2pas n LYS 83 Cb 0.71 -1.50 -0.12 0.00 0.00 0.00 0.00 35.03 34.13 2pas n LYS 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2pas n ALA 84 N -1.19 0.83 -0.07 3.14 0.00 -0.42 -2.77 120.51 120.03 2pas n ALA 84 Ca 0.11 -0.54 -0.07 0.00 0.00 0.00 0.00 53.44 52.94 2pas n ALA 84 Cb 0.30 -0.56 -0.01 0.00 0.00 0.00 0.00 19.45 19.18 2pas n ALA 84 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2pas h PHE 85 N -0.73 -0.04 -0.59 0.00 3.04 -1.58 0.56 116.94 117.61 2pas h PHE 85 Ca -0.38 0.02 -0.06 0.00 3.98 0.00 0.00 57.97 61.52 2pas h PHE 85 Cb 1.50 0.06 -0.02 0.00 2.56 0.00 0.00 35.95 40.04 2pas h PHE 85 CO 0.09 -0.06 0.12 1.25 -2.02 0.00 0.00 178.31 177.68 2pas h LEU 86 N 0.07 0.92 0.00 0.59 5.85 -1.72 -0.58 115.31 120.45 2pas h LEU 86 Ca 0.13 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.61 2pas h LEU 86 Cb 0.18 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.97 2pas h LEU 86 CO -0.24 0.93 0.00 1.17 -0.34 0.00 0.00 178.44 179.97 2pas n LYS 87 N -4.33 0.98 -0.01 1.25 0.00 -0.82 -1.17 118.16 114.07 2pas n LYS 87 Ca 0.03 0.00 0.01 0.00 0.00 0.00 0.00 58.31 58.35 2pas n LYS 87 Cb 0.26 -1.20 -0.03 0.00 0.00 0.00 0.00 35.03 34.06 2pas n LYS 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2pas n ALA 88 N -0.70 2.07 -0.45 3.14 0.00 0.13 -4.63 120.51 120.07 2pas n ALA 88 Ca 0.09 -0.13 0.04 0.00 0.00 0.00 0.00 53.44 53.45 2pas n ALA 88 Cb 0.04 -0.03 0.06 0.00 0.00 0.00 0.00 19.45 19.52 2pas n ALA 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pas n ALA 89 N -1.78 2.12 -3.44 0.00 0.00 -0.29 -4.85 120.51 112.26 2pas n ALA 89 Ca -0.02 -1.68 -0.28 0.00 0.00 0.00 0.00 53.44 51.47 2pas n ALA 89 Cb 0.25 -0.17 -0.11 0.00 0.00 0.00 0.00 19.45 19.43 2pas n ALA 89 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2pas s ASP 90 N -1.77 2.07 0.13 0.00 -1.08 -0.32 -4.78 116.67 110.92 2pas s ASP 90 Ca 0.14 -2.84 -0.03 0.00 -0.52 0.00 0.00 52.55 49.30 2pas s ASP 90 Cb 0.12 -0.49 -0.09 0.00 -1.46 0.00 0.00 42.92 41.00 2pas s ASP 90 CO 0.02 -0.21 1.31 0.50 0.52 0.00 0.00 175.17 177.30 2pas h LYS 91 N 6.05 0.36 0.00 4.34 1.63 -1.89 -3.04 116.57 124.03 2pas h LYS 91 Ca 0.19 -0.40 0.00 0.00 -0.85 0.00 0.00 60.65 59.60 2pas h LYS 91 Cb 0.92 0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.67 2pas h LYS 91 CO 0.36 1.08 0.00 -0.40 -3.45 0.00 0.00 179.45 177.04 2pas n ASP 92 N -3.72 0.36 -3.17 4.20 5.68 -1.26 -4.93 116.55 113.72 2pas n ASP 92 Ca -0.06 0.55 -0.14 0.00 -0.50 0.00 0.00 54.79 54.64 2pas n ASP 92 Cb 0.84 -0.64 0.07 0.00 -1.14 0.00 0.00 41.12 40.25 2pas n ASP 92 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2pas n GLY 93 N 0.92 -1.00 0.50 6.12 0.00 -1.15 -4.93 105.19 105.66 2pas n GLY 93 Ca 0.05 0.50 0.04 0.00 0.00 0.00 0.00 46.02 46.62 2pas n GLY 93 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2pas n ASP 94 N -3.13 2.74 -2.16 1.61 5.75 -1.26 -4.96 116.55 115.13 2pas n ASP 94 Ca -0.08 -2.03 -0.17 0.00 -0.01 0.00 0.00 54.79 52.49 2pas n ASP 94 Cb 0.62 -0.19 -0.03 0.00 -1.03 0.00 0.00 41.12 40.49 2pas n ASP 94 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2pas n GLY 95 N 0.25 0.10 3.05 6.12 0.00 -1.26 -4.93 105.19 108.52 2pas n GLY 95 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 2pas n GLY 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pas s LYS 96 N -4.61 0.29 -0.47 1.61 1.02 -1.26 -4.26 119.74 112.06 2pas s LYS 96 Ca 0.00 0.74 -0.16 0.00 0.02 0.00 0.00 55.97 56.57 2pas s LYS 96 Cb 0.00 -0.14 0.06 0.00 -0.52 0.00 0.00 37.83 37.23 2pas s LYS 96 CO 0.00 -0.43 0.41 0.42 -0.92 0.00 0.00 175.35 174.83 2pas s ILE 97 N 2.53 5.19 0.00 2.17 -1.09 -1.07 -4.92 121.20 124.01 2pas s ILE 97 Ca 0.05 -0.93 0.00 0.00 -2.23 0.00 0.00 60.65 57.54 2pas s ILE 97 Cb -0.14 -4.12 0.00 0.00 -1.58 0.00 0.00 42.46 36.62 2pas s ILE 97 CO -0.13 -0.57 0.00 0.61 -1.23 0.00 0.00 174.94 173.62 2pas n GLY 98 N 5.19 -1.43 0.00 6.18 0.00 -1.26 -2.32 105.19 111.55 2pas n GLY 98 Ca -0.11 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.29 2pas n GLY 98 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2pas n ILE 99 N -2.06 0.00 -0.34 -0.61 2.08 -1.26 -1.48 119.36 115.68 2pas n ILE 99 Ca 0.00 0.86 0.31 0.00 0.56 0.00 0.00 62.75 64.48 2pas n ILE 99 Cb 0.00 -1.69 0.56 0.00 -0.75 0.00 0.00 39.64 37.76 2pas n ILE 99 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 2pas n ASP 100 N -1.47 0.26 -0.06 4.38 8.00 -1.26 0.24 116.55 126.65 2pas n ASP 100 Ca 0.00 1.39 -0.12 0.00 0.71 0.00 0.00 54.79 56.77 2pas n ASP 100 Cb 0.00 -0.68 -0.06 0.00 -0.02 0.00 0.00 41.12 40.36 2pas n ASP 100 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2pas h GLU 101 N 0.00 0.32 0.35 -1.24 5.08 -1.92 -1.49 114.58 115.69 2pas h GLU 101 Ca 0.77 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.98 2pas h GLU 101 Cb 2.22 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.46 2pas h GLU 101 CO -0.58 0.63 -0.17 0.35 -1.00 0.00 0.00 179.01 178.23 2pas h PHE 102 N 0.01 -0.44 0.00 4.33 3.57 0.43 -1.74 116.94 123.09 2pas h PHE 102 Ca 0.04 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2pas h PHE 102 Cb 0.52 0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.41 2pas h PHE 102 CO 0.06 -0.10 0.00 -1.91 -2.23 0.00 0.00 178.31 174.13 2pas n GLU 103 N -5.14 0.05 -0.10 1.11 2.13 0.13 -0.49 120.64 118.33 2pas n GLU 103 Ca -0.09 0.28 -0.22 0.00 0.66 0.00 0.00 57.16 57.79 2pas n GLU 103 Cb 0.28 -1.50 -0.12 0.00 0.27 0.00 0.00 31.44 30.37 2pas n GLU 103 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 2pas n THR 104 N -1.43 1.55 0.80 6.31 -1.04 -0.56 -2.82 114.28 117.09 2pas n THR 104 Ca 0.03 -0.08 0.13 0.00 -2.04 0.00 0.00 64.05 62.09 2pas n THR 104 Cb 0.10 -2.01 0.49 0.00 -1.82 0.00 0.00 70.33 67.09 2pas n THR 104 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2pas n LEU 105 N -4.37 0.45 -0.01 -4.42 7.99 -0.67 -1.92 117.00 114.05 2pas n LEU 105 Ca -0.34 0.52 -0.16 0.00 -0.01 0.00 0.00 56.01 56.02 2pas n LEU 105 Cb 0.72 -0.39 -0.14 0.00 -0.11 0.00 0.00 43.42 43.49 2pas n LEU 105 CO 0.19 -0.09 -0.70 0.52 -1.51 0.00 0.00 177.39 175.80 2pas n VAL 106 N -1.91 1.71 0.07 4.08 0.31 0.36 -3.73 118.33 119.23 2pas n VAL 106 Ca 0.06 -0.71 -0.12 0.00 -0.01 0.00 0.00 64.34 63.56 2pas n VAL 106 Cb 0.39 -1.45 -0.13 0.00 -0.91 0.00 0.00 33.84 31.74 2pas n VAL 106 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 2pas h HIS 107 N 0.04 0.25 -0.75 3.52 3.86 -1.55 -3.28 115.15 117.24 2pas h HIS 107 Ca -0.37 -0.18 -0.48 0.00 -1.16 0.00 0.00 60.37 58.18 2pas h HIS 107 Cb 2.03 -0.01 -0.22 0.00 1.06 0.00 0.00 27.41 30.27 2pas h HIS 107 CO 0.05 1.16 0.62 0.39 0.86 0.00 0.00 177.93 181.01 2pas n GLU 108 N -3.41 2.19 0.00 2.45 -0.58 -0.81 -4.79 120.64 115.69 2pas n GLU 108 Ca -0.07 -2.41 0.04 0.00 -0.42 0.00 0.00 57.16 54.30 2pas n GLU 108 Cb 1.00 -1.94 0.25 0.00 -0.57 0.00 0.00 31.44 30.17 2pas n GLU 108 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65