#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 2.39 0.07 0.00 0.00 -1.25 -4.23 120.51 117.50 2pas n ALA 2 Ca 0.00 -1.19 -0.11 0.00 0.00 0.00 0.00 53.44 52.14 2pas n ALA 2 Cb 0.00 -0.91 -0.02 0.00 0.00 0.00 0.00 19.45 18.52 2pas n ALA 2 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2pas h LYS 3 N 4.40 0.31 -0.01 0.00 3.64 -1.87 -3.01 116.57 120.03 2pas h LYS 3 Ca 0.00 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 2pas h LYS 3 Cb 0.99 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 2pas h LYS 3 CO 0.00 1.02 -0.13 -0.25 -2.27 0.00 0.00 179.45 177.83 2pas n ASP 4 N -3.72 1.04 -1.31 4.20 8.00 -1.26 -3.62 116.55 119.88 2pas n ASP 4 Ca -0.05 -1.05 0.12 0.00 0.71 0.00 0.00 54.79 54.51 2pas n ASP 4 Cb 0.81 0.04 0.29 0.00 -0.02 0.00 0.00 41.12 42.25 2pas n ASP 4 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2pas n LEU 5 N -0.43 3.84 0.00 0.64 0.00 -1.14 -4.96 117.00 114.95 2pas n LEU 5 Ca 0.16 -1.85 0.00 0.00 0.00 0.00 0.00 56.01 54.32 2pas n LEU 5 Cb 0.33 -0.42 0.00 0.00 0.00 0.00 0.00 43.42 43.32 2pas n LEU 5 CO 0.22 0.92 0.00 0.18 0.00 0.00 0.00 177.39 178.71 2pas n LEU 6 N 1.63 0.00 0.03 -1.96 4.32 -1.23 -5.03 117.00 114.77 2pas n LEU 6 Ca 0.23 0.00 0.12 0.00 -0.02 0.00 0.00 56.01 56.35 2pas n LEU 6 Cb 0.62 0.00 0.31 0.00 -1.62 0.00 0.00 43.42 42.73 2pas n LEU 6 CO 0.17 0.00 0.56 1.17 -1.22 0.00 0.00 177.39 178.06 2pas n LYS 7 N 0.00 0.14 0.00 3.23 4.81 -1.26 -4.95 118.16 120.13 2pas n LYS 7 Ca 0.00 0.06 0.00 0.00 -0.87 0.00 0.00 58.31 57.50 2pas n LYS 7 Cb 0.00 -1.60 0.00 0.00 0.02 0.00 0.00 35.03 33.45 2pas n LYS 7 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2pas n ALA 8 N -1.65 0.00 0.11 3.14 0.00 -1.26 -4.49 120.51 116.35 2pas n ALA 8 Ca 0.05 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.52 2pas n ALA 8 Cb 0.38 0.00 0.43 0.00 0.00 0.00 0.00 19.45 20.26 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 0.25 -0.13 0.00 3.32 -1.96 -1.50 116.42 116.40 2pas h ASP 9 Ca 0.00 -0.04 -0.05 0.00 0.02 0.00 0.00 57.03 56.97 2pas h ASP 9 Cb 0.00 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 2pas h ASP 9 CO 0.00 0.33 -0.04 0.44 -1.72 0.00 0.00 179.24 178.25 2pas h ASP 10 N 0.27 0.38 0.63 6.45 3.32 -1.81 -1.43 116.42 124.22 2pas h ASP 10 Ca 0.06 -0.07 -0.16 0.00 0.02 0.00 0.00 57.03 56.88 2pas h ASP 10 Cb 0.24 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 2pas h ASP 10 CO 0.01 0.48 -0.74 0.40 -1.72 0.00 0.00 179.24 177.66 2pas h ILE 11 N 0.39 1.49 0.00 0.35 2.04 -1.46 -2.58 117.51 117.74 2pas h ILE 11 Ca 0.08 -2.43 0.00 0.00 1.00 0.00 0.00 64.86 63.51 2pas h ILE 11 Cb 0.33 2.31 0.00 0.00 -0.74 0.00 0.00 36.82 38.72 2pas h ILE 11 CO 0.01 0.70 0.00 0.29 0.00 0.00 0.00 178.15 179.15 2pas n LYS 12 N -3.71 0.10 -0.02 2.37 5.02 -0.62 -1.86 118.16 119.45 2pas n LYS 12 Ca -0.02 0.09 -0.21 0.00 -2.02 0.00 0.00 58.31 56.15 2pas n LYS 12 Cb 0.71 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 34.09 2pas n LYS 12 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2pas h LYS 13 N 0.00 0.17 -0.06 1.97 1.79 -0.94 -2.71 116.57 116.79 2pas h LYS 13 Ca 0.00 -0.28 -0.03 0.00 -2.18 0.00 0.00 60.65 58.16 2pas h LYS 13 Cb 0.35 0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 31.10 2pas h LYS 13 CO 0.00 1.14 -0.06 0.00 -1.08 0.00 0.00 179.45 179.44 2pas h ALA 14 N -0.13 0.08 -0.26 3.86 0.00 -1.47 -1.51 119.26 119.83 2pas h ALA 14 Ca -0.28 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.37 2pas h ALA 14 Cb 1.58 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.34 2pas h ALA 14 CO -0.00 -0.11 0.18 -0.07 0.00 0.00 0.00 179.25 179.25 2pas h LEU 15 N -0.32 0.23 -0.39 0.00 4.07 -1.54 0.98 115.31 118.35 2pas h LEU 15 Ca 0.01 -0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.90 2pas h LEU 15 Cb 0.58 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.26 2pas h LEU 15 CO 0.02 0.16 -0.30 0.44 -1.08 0.00 0.00 178.44 177.67 2pas h ASP 16 N 0.27 0.00 0.75 -0.43 3.32 -1.30 0.13 116.42 119.16 2pas h ASP 16 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2pas h ASP 16 Cb 0.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.64 2pas h ASP 16 CO -0.02 0.30 -1.01 0.00 -1.72 0.00 0.00 179.24 176.79 2pas n ALA 17 N -2.20 2.85 -0.01 3.45 0.00 -0.02 -4.28 120.51 120.30 2pas n ALA 17 Ca 0.02 -0.30 0.04 0.00 0.00 0.00 0.00 53.44 53.20 2pas n ALA 17 Cb 0.59 -1.06 -0.08 0.00 0.00 0.00 0.00 19.45 18.90 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 -2.35 0.06 -0.43 0.00 0.24 0.13 -4.62 118.33 111.37 2pas n VAL 18 Ca 0.01 -0.25 0.36 0.00 -2.04 0.00 0.00 64.34 62.41 2pas n VAL 18 Cb 0.50 0.17 0.55 0.00 -1.47 0.00 0.00 33.84 33.58 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 -1.91 0.00 -0.77 7.34 5.02 0.44 -4.06 118.16 124.23 2pas n LYS 19 Ca -0.03 0.84 -0.27 0.00 -2.02 0.00 0.00 58.31 56.83 2pas n LYS 19 Cb 0.32 -1.99 0.09 0.00 -0.02 0.00 0.00 35.03 33.43 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 -2.50 -2.69 -2.75 7.82 0.00 -1.26 -4.78 120.51 114.36 2pas n ALA 20 Ca 0.30 -1.09 -0.43 0.00 0.00 0.00 0.00 53.44 52.22 2pas n ALA 20 Cb 1.47 -0.90 0.01 0.00 0.00 0.00 0.00 19.45 20.03 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 0.19 4.11 0.00 0.00 1.02 -1.26 -4.00 120.64 120.70 2pas n GLU 21 Ca 0.01 -4.14 0.00 0.00 -0.02 0.00 0.00 57.16 53.01 2pas n GLU 21 Cb 0.52 -2.68 0.00 0.00 -0.02 0.00 0.00 31.44 29.26 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 1.97 1.20 1.26 0.62 0.00 -1.26 -5.01 105.19 103.97 2pas n GLY 22 Ca 0.32 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.45 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 3.67 -4.78 1.61 3.41 -1.26 -4.92 113.62 111.36 2pas n SER 23 Ca 0.00 -2.00 -0.38 0.00 -0.26 0.00 0.00 58.87 56.23 2pas n SER 23 Cb 0.00 -0.44 -0.06 0.00 -0.26 0.00 0.00 64.21 63.45 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 -1.11 3.63 0.00 7.33 2.19 -1.26 -4.58 117.98 124.18 2pas s PHE 24 Ca 0.46 0.97 0.00 0.00 0.33 0.00 0.00 56.93 58.69 2pas s PHE 24 Cb 0.24 -2.44 0.00 0.00 -1.31 0.00 0.00 43.02 39.51 2pas s PHE 24 CO 0.31 0.40 0.00 0.09 1.83 0.00 0.00 175.22 177.86 2pas n ASN 25 N 2.73 0.00 0.00 6.13 5.03 -1.26 -4.85 115.26 123.04 2pas n ASN 25 Ca -0.10 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.35 2pas n ASN 25 Cb 0.52 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.28 2pas n ASN 25 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2pas n HIS 26 N 0.00 0.00 -0.08 3.10 1.44 -1.26 -4.22 115.22 114.20 2pas n HIS 26 Ca 0.00 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.57 2pas n HIS 26 Cb 0.00 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.00 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 0.00 -0.09 -1.40 1.57 -1.99 -3.06 116.57 111.60 2pas h LYS 27 Ca 0.00 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 2pas h LYS 27 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2pas h LYS 27 CO 0.00 0.87 -0.40 1.57 -0.57 0.00 0.00 179.45 180.92 2pas h LYS 28 N -1.00 0.19 0.11 3.15 2.10 -1.94 -1.42 116.57 117.75 2pas h LYS 28 Ca -0.08 -0.09 -0.01 0.00 -2.00 0.00 0.00 60.65 58.48 2pas h LYS 28 Cb 0.96 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.29 2pas h LYS 28 CO -0.05 0.57 -0.05 0.35 -2.00 0.00 0.00 179.45 178.26 2pas h PHE 29 N 0.16 -0.13 -0.67 0.07 3.57 -1.92 -2.34 116.94 115.68 2pas h PHE 29 Ca 0.01 -0.00 0.19 0.00 3.53 0.00 0.00 57.97 61.71 2pas h PHE 29 Cb 0.79 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.54 2pas h PHE 29 CO 0.01 -0.08 0.48 0.74 -2.23 0.00 0.00 178.31 177.23 2pas h PHE 30 N -0.22 0.00 0.07 0.41 0.04 -1.62 -1.23 116.94 114.39 2pas h PHE 30 Ca -0.01 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.75 2pas h PHE 30 Cb 0.11 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.26 2pas h PHE 30 CO 0.11 0.00 -0.03 0.00 -0.60 0.00 0.00 178.31 177.78 2pas h ALA 31 N 1.66 -0.10 0.00 2.45 0.00 -1.24 -2.45 119.26 119.58 2pas h ALA 31 Ca 0.32 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2pas h ALA 31 Cb 1.28 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2pas h ALA 31 CO -0.00 -0.43 0.00 1.28 0.00 0.00 0.00 179.25 180.10 2pas n LEU 32 N -5.01 0.00 -0.05 0.00 4.77 -0.53 -3.75 117.00 112.43 2pas n LEU 32 Ca -0.08 0.09 -0.02 0.00 -0.03 0.00 0.00 56.01 55.98 2pas n LEU 32 Cb 0.17 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.16 2pas n LEU 32 CO 0.33 -0.03 -0.12 0.58 -1.33 0.00 0.00 177.39 176.82 2pas h VAL 33 N 0.00 0.00 0.00 4.08 2.07 -0.88 -3.39 116.25 118.13 2pas h VAL 33 Ca 0.00 -0.86 0.00 0.00 0.82 0.00 0.00 66.70 66.66 2pas h VAL 33 Cb 0.07 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.84 2pas h VAL 33 CO 0.00 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.20 2pas n GLY 34 N 1.74 2.35 0.00 2.17 0.00 -1.16 -4.18 105.19 106.11 2pas n GLY 34 Ca -0.02 -0.26 0.01 0.00 0.00 0.00 0.00 46.02 45.75 2pas n GLY 34 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2pas n LEU 35 N 0.00 0.00 0.25 0.99 -0.00 -1.26 -2.26 117.00 114.72 2pas n LEU 35 Ca 0.00 0.49 0.17 0.00 -0.00 0.00 0.00 56.01 56.67 2pas n LEU 35 Cb 0.00 -0.49 0.80 0.00 -0.00 0.00 0.00 43.42 43.73 2pas n LEU 35 CO 0.00 -0.45 1.15 0.50 -0.00 0.00 0.00 177.39 178.59 2pas h LYS 36 N 0.00 0.00 0.00 1.47 3.64 -1.74 -3.21 116.57 116.73 2pas h LYS 36 Ca 0.00 0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 59.15 2pas h LYS 36 Cb 0.04 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 31.71 2pas h LYS 36 CO 0.00 0.00 -0.38 0.00 -2.27 0.00 0.00 179.45 176.80 2pas n ALA 37 N -2.06 -0.78 -0.04 5.00 0.00 -0.96 -4.08 120.51 117.59 2pas n ALA 37 Ca 0.01 -1.35 -0.02 0.00 0.00 0.00 0.00 53.44 52.09 2pas n ALA 37 Cb 0.45 -1.30 -0.01 0.00 0.00 0.00 0.00 19.45 18.59 2pas n ALA 37 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 2pas h MET 38 N 2.81 0.00 0.00 0.00 4.05 -1.63 -3.50 114.93 116.66 2pas h MET 38 Ca -0.14 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.28 2pas h MET 38 Cb 1.13 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.93 2pas h MET 38 CO 0.09 0.00 0.00 -1.13 0.23 0.00 0.00 176.91 176.10 2pas n SER 39 N -3.50 0.00 -0.42 1.39 3.41 -1.26 -4.93 113.62 108.31 2pas n SER 39 Ca -0.03 0.00 0.33 0.00 -0.26 0.00 0.00 58.87 58.91 2pas n SER 39 Cb 0.11 0.00 0.53 0.00 -0.26 0.00 0.00 64.21 64.59 2pas n SER 39 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2pas n ALA 40 N 0.00 1.15 -0.02 7.33 0.00 -1.26 0.89 120.51 128.60 2pas n ALA 40 Ca 0.00 0.55 -0.12 0.00 0.00 0.00 0.00 53.44 53.87 2pas n ALA 40 Cb 0.00 -0.78 -0.10 0.00 0.00 0.00 0.00 19.45 18.57 2pas n ALA 40 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2pas h ASN 41 N 0.00 -0.05 0.06 0.00 -1.24 -1.99 -2.07 115.58 110.28 2pas h ASN 41 Ca 0.65 -0.62 0.00 0.00 0.71 0.00 0.00 56.30 57.04 2pas h ASN 41 Cb 2.34 0.01 0.00 0.00 0.73 0.00 0.00 38.32 41.41 2pas h ASN 41 CO -0.18 0.66 0.00 0.47 -1.29 0.00 0.00 177.43 177.09 2pas n ASP 42 N -4.77 0.00 -0.07 1.15 8.00 0.26 -2.26 116.55 118.86 2pas n ASP 42 Ca -0.08 -0.61 -0.22 0.00 0.71 0.00 0.00 54.79 54.58 2pas n ASP 42 Cb 0.33 -0.04 -0.12 0.00 -0.02 0.00 0.00 41.12 41.27 2pas n ASP 42 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2pas n VAL 43 N -1.04 1.62 0.30 2.53 0.31 0.95 -2.20 118.33 120.80 2pas n VAL 43 Ca 0.16 -0.35 0.18 0.00 -0.01 0.00 0.00 64.34 64.32 2pas n VAL 43 Cb 0.09 -1.86 0.92 0.00 -0.91 0.00 0.00 33.84 32.09 2pas n VAL 43 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2pas h LYS 44 N -0.52 0.00 0.00 5.55 3.64 -1.15 0.21 116.57 124.30 2pas h LYS 44 Ca -0.44 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 58.73 2pas h LYS 44 Cb 1.66 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.45 2pas h LYS 44 CO -0.12 0.04 -1.02 0.87 -2.27 0.00 0.00 179.45 176.94 2pas h LYS 45 N 0.00 0.00 -0.09 1.90 1.57 -1.52 -1.45 116.57 116.98 2pas h LYS 45 Ca -0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2pas h LYS 45 Cb 0.23 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 2pas h LYS 45 CO 0.00 0.96 -0.11 0.28 -0.57 0.00 0.00 179.45 180.01 2pas h VAL 46 N 0.00 1.38 0.08 0.50 2.07 -0.16 -2.81 116.25 117.31 2pas h VAL 46 Ca -0.02 -1.33 -0.00 0.00 0.82 0.00 0.00 66.70 66.16 2pas h VAL 46 Cb 1.77 2.06 0.00 0.00 -1.52 0.00 0.00 31.29 33.60 2pas h VAL 46 CO 0.13 0.37 -0.04 0.15 0.02 0.00 0.00 177.57 178.20 2pas h PHE 47 N -0.21 -0.11 -1.07 1.57 3.04 -1.23 0.61 116.94 119.55 2pas h PHE 47 Ca 0.01 -0.00 0.31 0.00 3.98 0.00 0.00 57.97 62.27 2pas h PHE 47 Cb 0.66 0.03 -0.04 0.00 2.56 0.00 0.00 35.95 39.16 2pas h PHE 47 CO 0.10 -0.04 0.86 -0.22 -2.02 0.00 0.00 178.31 176.98 2pas h LYS 48 N -0.14 0.00 0.22 1.11 1.63 -1.25 1.35 116.57 119.49 2pas h LYS 48 Ca -0.01 0.00 -0.32 0.00 -0.85 0.00 0.00 60.65 59.46 2pas h LYS 48 Cb 0.11 0.00 0.03 0.00 -0.60 0.00 0.00 32.23 31.77 2pas h LYS 48 CO 0.02 0.00 -1.45 0.00 -3.45 0.00 0.00 179.45 174.57 2pas h ALA 49 N 1.29 -0.08 -0.30 5.00 0.00 -0.68 -3.15 119.26 121.34 2pas h ALA 49 Ca 0.51 -0.89 0.03 0.00 0.00 0.00 0.00 54.91 54.56 2pas h ALA 49 Cb 2.21 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 20.14 2pas h ALA 49 CO -0.01 0.79 0.20 0.82 0.00 0.00 0.00 179.25 181.06 2pas h ILE 50 N 0.13 1.00 -0.14 0.00 1.08 0.33 -3.38 117.51 116.53 2pas h ILE 50 Ca -0.23 -0.09 -0.09 0.00 -0.39 0.00 0.00 64.86 64.05 2pas h ILE 50 Cb 2.12 0.70 -0.03 0.00 -3.07 0.00 0.00 36.82 36.54 2pas h ILE 50 CO 0.25 0.05 0.69 -0.67 -0.69 0.00 0.00 178.15 177.78 2pas n ASP 51 N -4.49 0.21 0.15 1.72 2.03 0.16 -4.73 116.55 111.60 2pas n ASP 51 Ca 0.03 -1.47 -0.13 0.00 0.52 0.00 0.00 54.79 53.73 2pas n ASP 51 Cb 0.18 -1.21 -0.08 0.00 -0.72 0.00 0.00 41.12 39.28 2pas n ASP 51 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2pas h ALA 52 N 11.41 -0.40 -0.39 -1.67 0.00 -1.79 -3.14 119.26 123.27 2pas h ALA 52 Ca 0.01 -0.18 -0.16 0.00 0.00 0.00 0.00 54.91 54.58 2pas h ALA 52 Cb 1.03 0.15 -0.10 0.00 0.00 0.00 0.00 17.79 18.88 2pas h ALA 52 CO 1.16 -0.55 0.20 -0.40 0.00 0.00 0.00 179.25 179.67 2pas n ASP 53 N -5.12 3.28 -3.47 0.00 5.68 -1.26 -4.86 116.55 110.80 2pas n ASP 53 Ca -0.09 -2.63 -0.24 0.00 -0.50 0.00 0.00 54.79 51.32 2pas n ASP 53 Cb 0.26 -0.63 -0.01 0.00 -1.14 0.00 0.00 41.12 39.60 2pas n ASP 53 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2pas n ALA 54 N -0.08 -1.09 -1.38 2.12 0.00 -1.19 -4.81 120.51 114.09 2pas n ALA 54 Ca 0.23 0.05 -0.12 0.00 0.00 0.00 0.00 53.44 53.59 2pas n ALA 54 Cb 0.92 -2.69 0.19 0.00 0.00 0.00 0.00 19.45 17.87 2pas n ALA 54 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2pas n SER 55 N -2.29 2.99 -4.03 0.00 7.64 -1.26 -4.91 113.62 111.76 2pas n SER 55 Ca 0.00 -3.73 -0.32 0.00 1.01 0.00 0.00 58.87 55.83 2pas n SER 55 Cb 0.53 -0.72 -0.05 0.00 -1.01 0.00 0.00 64.21 62.96 2pas n SER 55 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2pas n GLY 56 N -1.13 -0.43 3.26 0.23 0.00 -1.26 -4.88 105.19 100.98 2pas n GLY 56 Ca 0.44 0.07 -0.13 0.00 0.00 0.00 0.00 46.02 46.39 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 -2.99 -0.30 -0.64 1.61 0.08 -1.26 -4.79 117.98 109.69 2pas s PHE 57 Ca 0.63 0.62 -0.14 0.00 0.12 0.00 0.00 56.93 58.17 2pas s PHE 57 Cb -0.37 0.13 0.16 0.00 -0.57 0.00 0.00 43.02 42.38 2pas s PHE 57 CO 0.78 -0.32 0.58 0.42 -0.10 0.00 0.00 175.22 176.57 2pas s ILE 58 N -0.68 5.21 0.66 0.64 -1.09 -1.07 -4.52 121.20 120.35 2pas s ILE 58 Ca -0.08 -1.91 -0.03 0.00 -2.23 0.00 0.00 60.65 56.40 2pas s ILE 58 Cb -0.04 -4.30 0.07 0.00 -1.58 0.00 0.00 42.46 36.61 2pas s ILE 58 CO 0.03 -0.92 0.93 -1.61 -1.23 0.00 0.00 174.94 172.14 2pas s GLU 59 N 1.02 2.17 0.27 2.79 2.02 -1.26 -1.98 118.70 123.73 2pas s GLU 59 Ca 0.09 -0.63 -0.01 0.00 0.02 0.00 0.00 54.97 54.44 2pas s GLU 59 Cb -0.22 -2.31 0.50 0.00 0.10 0.00 0.00 34.13 32.19 2pas s GLU 59 CO -0.02 -1.12 1.82 0.93 0.02 0.00 0.00 175.26 176.89 2pas h GLU 60 N -0.36 0.85 0.00 1.61 3.07 -1.97 0.71 114.58 118.49 2pas h GLU 60 Ca -0.42 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 58.37 2pas h GLU 60 Cb 1.30 -0.19 -0.00 0.00 -0.84 0.00 0.00 28.75 29.01 2pas h GLU 60 CO 0.52 0.56 -0.11 1.05 -1.40 0.00 0.00 179.01 179.63 2pas h GLU 61 N 0.87 0.00 0.01 2.33 -0.00 -1.97 -2.38 114.58 113.43 2pas h GLU 61 Ca 0.46 0.00 -0.09 0.00 -0.00 0.00 0.00 59.36 59.73 2pas h GLU 61 Cb 0.47 0.00 0.01 0.00 -0.00 0.00 0.00 28.75 29.23 2pas h GLU 61 CO -0.27 0.11 -0.35 0.93 -0.00 0.00 0.00 179.01 179.43 2pas h GLU 62 N 0.00 0.22 -0.93 1.06 5.08 -1.25 -2.61 114.58 116.16 2pas h GLU 62 Ca -0.00 -0.25 0.27 0.00 -1.00 0.00 0.00 59.36 58.38 2pas h GLU 62 Cb 0.23 0.07 -0.15 0.00 0.50 0.00 0.00 28.75 29.40 2pas h GLU 62 CO 0.01 0.98 0.33 -0.07 -1.00 0.00 0.00 179.01 179.27 2pas h LEU 63 N -0.43 0.13 -0.45 1.33 3.38 -0.80 1.89 115.31 120.36 2pas h LEU 63 Ca -0.05 0.20 -0.16 0.00 0.09 0.00 0.00 57.88 57.97 2pas h LEU 63 Cb 1.11 0.25 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 2pas h LEU 63 CO 0.07 -0.18 -0.42 0.50 0.09 0.00 0.00 178.44 178.50 2pas h LYS 64 N 0.22 0.83 -0.69 1.13 3.64 -1.46 -2.76 116.57 117.47 2pas h LYS 64 Ca 0.62 -0.45 -0.01 0.00 -1.27 0.00 0.00 60.65 59.54 2pas h LYS 64 Cb 1.33 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.17 2pas h LYS 64 CO -0.67 1.09 0.01 1.19 -2.27 0.00 0.00 179.45 178.80 2pas n PHE 65 N -4.04 1.59 -1.01 1.91 3.72 0.33 -3.51 117.46 116.44 2pas n PHE 65 Ca -0.02 -0.57 -0.16 0.00 -0.05 0.00 0.00 57.45 56.65 2pas n PHE 65 Cb 0.55 -0.42 -0.04 0.00 -0.94 0.00 0.00 39.48 38.63 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 0.44 2.84 0.07 -4.37 3.14 0.56 -4.01 118.33 117.00 2pas n VAL 66 Ca 0.21 -1.80 0.00 0.00 -2.96 0.00 0.00 64.34 59.80 2pas n VAL 66 Cb 0.98 -1.57 0.00 0.00 -1.06 0.00 0.00 33.84 32.18 2pas n VAL 66 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26 2pas n LEU 67 N 1.13 0.18 -0.46 6.55 -0.00 -1.26 -4.80 117.00 118.34 2pas n LEU 67 Ca 0.33 0.24 0.36 0.00 -0.00 0.00 0.00 56.01 56.94 2pas n LEU 67 Cb 0.62 0.10 0.57 0.00 -0.00 0.00 0.00 43.42 44.71 2pas n LEU 67 CO 0.25 -0.62 1.03 0.29 -0.00 0.00 0.00 177.39 178.33 2pas n LYS 68 N -3.21 -0.01 -0.29 1.96 4.01 -1.24 -0.30 118.16 119.08 2pas n LYS 68 Ca 0.00 0.85 0.01 0.00 -0.51 0.00 0.00 58.31 58.66 2pas n LYS 68 Cb 0.06 -1.84 0.08 0.00 -0.51 0.00 0.00 35.03 32.83 2pas n LYS 68 CO 0.00 0.00 0.00 0.77 -1.11 0.00 0.00 177.40 177.06 2pas h SER 69 N 0.00 -0.92 0.55 4.39 0.02 -1.87 -0.76 113.55 114.96 2pas h SER 69 Ca 0.68 0.26 -0.28 0.00 -0.84 0.00 0.00 61.79 61.60 2pas h SER 69 Cb 2.54 0.56 -0.04 0.00 0.14 0.00 0.00 62.40 65.59 2pas h SER 69 CO -0.13 -0.28 -1.59 -0.26 -1.14 0.00 0.00 176.83 173.42 2pas h PHE 70 N -0.03 0.06 -2.36 3.45 0.04 -1.01 -3.08 116.94 114.01 2pas h PHE 70 Ca 0.37 -0.05 -0.35 0.00 2.80 0.00 0.00 57.97 60.75 2pas h PHE 70 Cb 0.60 -0.00 -0.35 0.00 2.20 0.00 0.00 35.95 38.40 2pas h PHE 70 CO -0.68 1.08 -0.65 0.00 -0.60 0.00 0.00 178.31 177.46 2pas s ALA 71 N -2.62 -0.26 0.45 2.45 0.00 -0.32 -4.80 121.76 116.66 2pas s ALA 71 Ca -0.05 -0.19 0.35 0.00 0.00 0.00 0.00 51.96 52.07 2pas s ALA 71 Cb 0.08 -1.57 1.51 0.00 0.00 0.00 0.00 23.12 23.14 2pas s ALA 71 CO 0.82 -1.51 1.54 0.00 0.00 0.00 0.00 175.76 176.61 2pas n ALA 72 N 5.31 1.43 -3.09 0.00 0.00 -1.03 -1.03 120.51 122.09 2pas n ALA 72 Ca -0.04 0.83 -0.17 0.00 0.00 0.00 0.00 53.44 54.06 2pas n ALA 72 Cb 0.47 -1.06 -0.02 0.00 0.00 0.00 0.00 19.45 18.84 2pas n ALA 72 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2pas n ASP 73 N -4.57 1.09 0.00 0.00 -0.08 -1.26 -4.70 116.55 107.02 2pas n ASP 73 Ca 0.41 -2.99 0.00 0.00 -1.51 0.00 0.00 54.79 50.70 2pas n ASP 73 Cb 1.62 -0.60 0.00 0.00 2.34 0.00 0.00 41.12 44.48 2pas n ASP 73 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2pas n GLY 74 N 0.20 0.66 0.01 0.27 0.00 -0.20 -4.98 105.19 101.15 2pas n GLY 74 Ca 0.23 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.24 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 0.00 0.07 -1.50 1.61 0.00 -1.26 -5.09 116.66 110.49 2pas n ARG 75 Ca 0.00 0.23 0.00 0.00 -0.00 0.00 0.00 57.85 58.08 2pas n ARG 75 Cb 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 32.46 31.63 2pas n ARG 75 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 2pas n ASP 76 N -2.63 -2.00 -4.74 6.15 2.03 -1.26 -5.00 116.55 109.10 2pas n ASP 76 Ca -0.01 0.00 -0.32 0.00 0.52 0.00 0.00 54.79 54.98 2pas n ASP 76 Cb 0.05 -1.00 0.09 0.00 -0.72 0.00 0.00 41.12 39.54 2pas n ASP 76 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2pas s LEU 77 N 0.00 3.17 0.47 -2.67 1.43 -1.23 -5.05 118.68 114.80 2pas s LEU 77 Ca 0.00 2.04 0.08 0.00 -1.03 0.00 0.00 54.13 55.22 2pas s LEU 77 Cb 0.00 -4.55 0.02 0.00 0.03 0.00 0.00 46.19 41.69 2pas s LEU 77 CO 0.00 -2.13 0.50 0.42 0.23 0.00 0.00 176.35 175.37 2pas s THR 78 N -2.51 2.44 0.24 5.49 -4.23 -1.26 -4.89 115.64 110.92 2pas s THR 78 Ca 0.66 -1.24 -0.06 0.00 -1.18 0.00 0.00 61.69 59.88 2pas s THR 78 Cb -0.21 -2.68 0.24 0.00 1.34 0.00 0.00 72.50 71.19 2pas s THR 78 CO 0.50 0.00 1.67 0.44 -0.54 0.00 0.00 174.62 176.69 2pas h ASP 79 N 0.74 -0.10 -0.39 3.99 3.32 -1.98 0.56 116.42 122.57 2pas h ASP 79 Ca -0.38 0.16 -0.07 0.00 0.02 0.00 0.00 57.03 56.76 2pas h ASP 79 Cb 1.28 0.24 -0.01 0.00 0.22 0.00 0.00 39.33 41.06 2pas h ASP 79 CO 0.52 -0.08 -0.01 0.00 -1.72 0.00 0.00 179.24 177.94 2pas h ALA 80 N 1.63 0.52 -0.31 3.45 0.00 -1.98 -0.47 119.26 122.11 2pas h ALA 80 Ca 0.41 -0.27 0.08 0.00 0.00 0.00 0.00 54.91 55.14 2pas h ALA 80 Cb 0.71 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2pas h ALA 80 CO -0.55 0.31 0.22 0.93 0.00 0.00 0.00 179.25 180.16 2pas h GLU 81 N 0.52 0.04 0.00 0.00 5.08 -1.37 0.74 114.58 119.58 2pas h GLU 81 Ca 0.11 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.40 2pas h GLU 81 Cb 0.49 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2pas h GLU 81 CO 0.02 0.03 -0.85 1.15 -1.00 0.00 0.00 179.01 178.36 2pas h THR 82 N 0.04 0.27 0.00 1.13 2.02 -0.51 -3.08 112.91 112.77 2pas h THR 82 Ca 0.14 -1.46 0.00 0.00 0.77 0.00 0.00 66.41 65.87 2pas h THR 82 Cb 0.52 1.88 0.00 0.00 -1.74 0.00 0.00 68.15 68.81 2pas h THR 82 CO -0.01 0.15 0.00 1.17 0.37 0.00 0.00 175.52 177.21 2pas n LYS 83 N -2.90 0.21 -0.10 6.66 3.00 0.20 -1.79 118.16 123.45 2pas n LYS 83 Ca -0.02 0.24 -0.21 0.00 -0.00 0.00 0.00 58.31 58.32 2pas n LYS 83 Cb 0.65 -1.78 -0.12 0.00 0.00 0.00 0.00 35.03 33.79 2pas n LYS 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2pas h ALA 84 N 2.52 0.26 -0.61 3.14 0.00 -1.42 -3.10 119.26 120.05 2pas h ALA 84 Ca 0.00 -1.18 0.02 0.00 0.00 0.00 0.00 54.91 53.75 2pas h ALA 84 Cb 0.62 0.70 -0.04 0.00 0.00 0.00 0.00 17.79 19.07 2pas h ALA 84 CO 0.00 0.69 0.38 0.35 0.00 0.00 0.00 179.25 180.67 2pas h PHE 85 N -0.95 0.71 -0.29 0.00 3.04 -1.55 0.66 116.94 118.56 2pas h PHE 85 Ca -0.33 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 61.61 2pas h PHE 85 Cb 1.32 -0.23 -0.01 0.00 2.56 0.00 0.00 35.95 39.59 2pas h PHE 85 CO 0.11 0.41 0.08 1.25 -2.02 0.00 0.00 178.31 178.14 2pas h LEU 86 N 0.75 0.43 -0.04 0.59 5.85 -1.52 0.61 115.31 121.98 2pas h LEU 86 Ca 0.24 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2pas h LEU 86 Cb 0.00 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 40.92 2pas h LEU 86 CO -0.09 0.54 0.00 2.29 -0.34 0.00 0.00 178.44 180.83 2pas n LYS 87 N -4.69 0.12 0.00 1.25 2.85 -1.07 -2.26 118.16 114.37 2pas n LYS 87 Ca -0.02 0.13 0.05 0.00 -1.05 0.00 0.00 58.31 57.42 2pas n LYS 87 Cb 0.17 -1.65 -0.02 0.00 -0.65 0.00 0.00 35.03 32.88 2pas n LYS 87 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2pas n ALA 88 N -1.64 3.07 -0.10 0.58 0.00 0.20 -4.51 120.51 118.12 2pas n ALA 88 Ca 0.06 -0.41 -0.10 0.00 0.00 0.00 0.00 53.44 52.99 2pas n ALA 88 Cb 0.36 -0.40 -0.15 0.00 0.00 0.00 0.00 19.45 19.27 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 -0.55 1.52 -2.58 0.00 0.00 0.21 -4.87 120.51 114.25 2pas n ALA 89 Ca 0.04 -1.24 -0.39 0.00 0.00 0.00 0.00 53.44 51.85 2pas n ALA 89 Cb 0.22 -0.15 -0.10 0.00 0.00 0.00 0.00 19.45 19.42 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 -5.46 6.09 -0.04 0.00 -1.08 -0.96 -4.96 116.67 110.26 2pas s ASP 90 Ca -0.12 -0.06 -0.22 0.00 -0.52 0.00 0.00 52.55 51.63 2pas s ASP 90 Cb 0.06 -2.15 -0.30 0.00 -1.46 0.00 0.00 42.92 39.07 2pas s ASP 90 CO 0.76 -0.14 0.94 0.11 0.52 0.00 0.00 175.17 177.35 2pas h LYS 91 N 8.37 0.32 -0.18 4.34 1.57 -1.90 -3.26 116.57 125.84 2pas h LYS 91 Ca -0.33 -0.49 0.00 0.00 -1.87 0.00 0.00 60.65 57.96 2pas h LYS 91 Cb 1.17 0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.66 2pas h LYS 91 CO 0.60 1.21 0.00 -0.40 -0.57 0.00 0.00 179.45 180.29 2pas n ASP 92 N -4.15 2.03 -3.78 0.86 5.75 -1.26 -4.94 116.55 111.05 2pas n ASP 92 Ca -0.13 -1.75 -0.29 0.00 -0.01 0.00 0.00 54.79 52.61 2pas n ASP 92 Cb 0.79 -0.11 0.02 0.00 -1.03 0.00 0.00 41.12 40.79 2pas n ASP 92 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2pas n GLY 93 N 1.21 -0.69 0.08 6.12 0.00 -1.23 -4.87 105.19 105.82 2pas n GLY 93 Ca 0.17 0.33 -0.06 0.00 0.00 0.00 0.00 46.02 46.46 2pas n GLY 93 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2pas h ASP 94 N -1.90 0.00 0.00 1.61 2.03 -1.92 -3.48 116.42 112.76 2pas h ASP 94 Ca -0.65 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.65 2pas h ASP 94 Cb 1.37 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.87 2pas h ASP 94 CO 0.53 0.88 0.00 0.61 -1.03 0.00 0.00 179.24 180.24 2pas n GLY 95 N 1.49 1.23 3.24 7.15 0.00 -1.26 -5.10 105.19 111.94 2pas n GLY 95 Ca -0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 2pas n GLY 95 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2pas s LYS 96 N -0.04 0.40 -0.51 1.61 -2.85 -1.26 -4.44 119.74 112.64 2pas s LYS 96 Ca 0.00 0.56 -0.13 0.00 -1.00 0.00 0.00 55.97 55.39 2pas s LYS 96 Cb 0.00 0.13 0.12 0.00 -2.06 0.00 0.00 37.83 36.03 2pas s LYS 96 CO 0.00 -0.08 0.44 0.42 0.10 0.00 0.00 175.35 176.22 2pas s ILE 97 N 0.51 4.81 0.00 3.79 -1.09 -0.84 -4.91 121.20 123.47 2pas s ILE 97 Ca -0.03 -1.60 0.00 0.00 -2.23 0.00 0.00 60.65 56.79 2pas s ILE 97 Cb -0.04 -4.11 0.00 0.00 -1.58 0.00 0.00 42.46 36.73 2pas s ILE 97 CO -0.03 -0.82 0.00 0.61 -1.23 0.00 0.00 174.94 173.47 2pas n GLY 98 N 5.11 -2.48 0.02 6.18 0.00 -1.26 -2.60 105.19 110.17 2pas n GLY 98 Ca -0.12 -1.42 -0.01 0.00 0.00 0.00 0.00 46.02 44.48 2pas n GLY 98 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2pas h ILE 99 N -1.35 0.00 -1.37 -0.61 1.08 -1.98 -1.06 117.51 112.23 2pas h ILE 99 Ca 0.00 -0.04 0.47 0.00 -0.39 0.00 0.00 64.86 64.90 2pas h ILE 99 Cb 0.00 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 33.62 2pas h ILE 99 CO 0.00 0.00 0.89 -0.67 -0.69 0.00 0.00 178.15 177.68 2pas n ASP 100 N -2.22 0.19 0.03 1.72 -0.08 -1.26 0.24 116.55 115.17 2pas n ASP 100 Ca -0.01 1.32 -0.19 0.00 -1.51 0.00 0.00 54.79 54.40 2pas n ASP 100 Cb 0.02 -0.65 -0.11 0.00 2.34 0.00 0.00 41.12 42.72 2pas n ASP 100 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 2pas h GLU 101 N 0.00 0.60 0.20 -0.67 4.57 -1.91 -2.39 114.58 114.98 2pas h GLU 101 Ca 0.86 -0.64 -0.01 0.00 -1.18 0.00 0.00 59.36 58.38 2pas h GLU 101 Cb 2.80 0.18 0.00 0.00 -0.16 0.00 0.00 28.75 31.57 2pas h GLU 101 CO -0.43 1.25 -0.10 0.35 -1.18 0.00 0.00 179.01 178.90 2pas h PHE 102 N 0.22 -0.25 -0.01 0.92 3.57 0.45 -0.34 116.94 121.51 2pas h PHE 102 Ca -0.11 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.39 2pas h PHE 102 Cb 1.55 0.08 -0.00 0.00 2.79 0.00 0.00 35.95 40.37 2pas h PHE 102 CO 0.12 0.15 0.01 1.49 -2.23 0.00 0.00 178.31 177.84 2pas h GLU 103 N -0.79 0.00 0.00 1.11 4.81 -0.12 0.17 114.58 119.76 2pas h GLU 103 Ca -0.03 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.11 2pas h GLU 103 Cb 0.51 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.88 2pas h GLU 103 CO 0.05 0.00 -0.46 1.15 -0.73 0.00 0.00 179.01 179.02 2pas h THR 104 N 0.00 0.79 0.00 0.32 2.02 -1.35 -3.08 112.91 111.61 2pas h THR 104 Ca 0.00 -2.08 0.00 0.00 0.77 0.00 0.00 66.41 65.10 2pas h THR 104 Cb 0.02 2.37 0.00 0.00 -1.74 0.00 0.00 68.15 68.79 2pas h THR 104 CO -0.00 0.45 -0.05 0.25 0.37 0.00 0.00 175.52 176.54 2pas h LEU 105 N 0.00 0.00 -0.99 2.58 6.46 0.11 -2.79 115.31 120.67 2pas h LEU 105 Ca -0.00 0.00 0.37 0.00 -0.12 0.00 0.00 57.88 58.13 2pas h LEU 105 Cb 1.33 0.00 -0.18 0.00 -0.73 0.00 0.00 40.66 41.08 2pas h LEU 105 CO 0.06 0.19 0.42 0.58 -0.62 0.00 0.00 178.44 179.07 2pas h VAL 106 N -0.34 0.05 0.00 1.05 2.07 -1.25 0.76 116.25 118.59 2pas h VAL 106 Ca 0.00 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2pas h VAL 106 Cb 0.05 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.81 2pas h VAL 106 CO 0.00 0.01 0.00 1.41 0.02 0.00 0.00 177.57 179.01 2pas n HIS 107 N -5.29 0.00 0.00 1.57 8.25 -1.16 -4.24 115.22 114.35 2pas n HIS 107 Ca 0.33 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.79 2pas n HIS 107 Cb 1.12 -0.45 0.00 0.00 1.12 0.00 0.00 29.99 31.78 2pas n HIS 107 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2pas n GLU 108 N -1.84 0.00 0.00 -0.41 -0.58 -0.60 -4.84 120.64 112.36 2pas n GLU 108 Ca 0.00 0.55 0.00 0.00 -0.42 0.00 0.00 57.16 57.29 2pas n GLU 108 Cb 0.00 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.40 2pas n GLU 108 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65