#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6p s ARG 2 N 0.00 1.44 0.61 2.12 3.00 -1.26 0.10 118.95 124.97 2k6p s ARG 2 Ca 0.00 -1.65 0.29 0.00 0.00 0.00 0.00 55.73 54.37 2k6p s ARG 2 Cb 0.00 -1.29 1.55 0.00 0.00 0.00 0.00 34.95 35.21 2k6p s ARG 2 CO 0.00 0.21 1.94 0.97 0.00 0.00 0.00 175.30 178.42 2k6p h ILE 3 N 2.46 0.26 -0.00 1.52 6.09 -1.79 1.12 117.51 127.17 2k6p h ILE 3 Ca -0.39 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.09 2k6p h ILE 3 Cb 1.23 0.67 0.00 0.00 0.47 0.00 0.00 36.82 39.19 2k6p h ILE 3 CO 0.62 0.00 -0.03 -2.24 -3.07 0.00 0.00 178.15 173.43 2k6p h ASP 4 N 0.00 0.03 0.20 2.19 3.04 -1.84 -3.28 116.42 116.76 2k6p h ASP 4 Ca 0.13 -0.74 0.00 0.00 -3.24 0.00 0.00 57.03 53.18 2k6p h ASP 4 Cb 0.90 -0.01 0.00 0.00 -1.04 0.00 0.00 39.33 39.18 2k6p h ASP 4 CO -0.00 0.77 -0.25 0.29 -2.04 0.00 0.00 179.24 178.01 2k6p n LYS 5 N -4.71 0.93 0.00 4.15 5.02 -0.48 -3.70 118.16 119.38 2k6p n LYS 5 Ca -0.09 -0.57 0.00 0.00 -2.02 0.00 0.00 58.31 55.63 2k6p n LYS 5 Cb 0.38 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 2k6p n LYS 5 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2k6p n PHE 6 N -0.54 0.00 0.95 2.13 7.35 0.37 -3.17 117.46 124.56 2k6p n PHE 6 Ca 0.13 0.00 0.13 0.00 -0.76 0.00 0.00 57.45 56.94 2k6p n PHE 6 Cb 0.36 -0.46 0.57 0.00 0.35 0.00 0.00 39.48 40.30 2k6p n PHE 6 CO 0.00 0.00 0.00 1.47 -0.76 0.00 0.00 176.76 177.47 2k6p n LEU 7 N -1.90 0.00 0.01 -2.13 -0.00 -1.24 -2.02 117.00 109.73 2k6p n LEU 7 Ca 0.00 0.47 -0.03 0.00 -0.00 0.00 0.00 56.01 56.45 2k6p n LEU 7 Cb 0.00 -0.47 -0.10 0.00 -0.00 0.00 0.00 43.42 42.85 2k6p n LEU 7 CO 0.00 -0.05 -0.38 0.00 -0.00 0.00 0.00 177.39 176.96 2k6p n GLN 8 N -1.47 0.62 -0.04 1.47 6.02 -1.24 -2.92 117.38 119.82 2k6p n GLN 8 Ca 0.07 0.24 -0.12 0.00 -0.01 0.00 0.00 57.00 57.18 2k6p n GLN 8 Cb 0.29 -1.80 -0.14 0.00 1.02 0.00 0.00 30.24 29.61 2k6p n GLN 8 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2k6p n SER 9 N -2.93 1.06 0.01 1.08 7.64 -1.18 -4.15 113.62 115.15 2k6p n SER 9 Ca -0.12 0.23 0.20 0.00 1.01 0.00 0.00 58.87 60.20 2k6p n SER 9 Cb 0.91 -0.04 0.70 0.00 -1.01 0.00 0.00 64.21 64.77 2k6p n SER 9 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 2k6p h VAL 10 N 0.02 0.68 0.00 0.44 -1.51 -1.58 -0.70 116.25 113.60 2k6p h VAL 10 Ca -0.40 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.07 2k6p h VAL 10 Cb 2.06 0.72 0.00 0.00 -2.13 0.00 0.00 31.29 31.94 2k6p h VAL 10 CO 0.06 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.01 2k6p n GLY 11 N -1.62 1.32 0.14 5.19 0.00 -1.24 -4.11 105.19 104.86 2k6p n GLY 11 Ca 0.09 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.01 2k6p n GLY 11 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2k6p n LEU 12 N 0.00 2.71 -3.81 0.99 0.00 -1.15 -4.74 117.00 111.00 2k6p n LEU 12 Ca 0.00 -0.04 -0.41 0.00 0.00 0.00 0.00 56.01 55.57 2k6p n LEU 12 Cb 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 43.42 42.94 2k6p n LEU 12 CO 0.00 0.68 1.11 0.52 0.00 0.00 0.00 177.39 179.69 2k6p n VAL 13 N -3.02 5.26 -1.95 1.96 0.31 -1.20 -5.00 118.33 114.69 2k6p n VAL 13 Ca -0.26 -5.89 -0.40 0.00 -0.01 0.00 0.00 64.34 57.79 2k6p n VAL 13 Cb 0.76 -1.90 -0.03 0.00 -0.91 0.00 0.00 33.84 31.76 2k6p n VAL 13 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 2k6p s LYS 14 N -3.25 2.80 0.09 5.55 -2.85 -1.26 -4.92 119.74 115.89 2k6p s LYS 14 Ca 0.35 1.01 -0.15 0.00 -1.00 0.00 0.00 55.97 56.18 2k6p s LYS 14 Cb 0.11 -4.35 0.03 0.00 -2.06 0.00 0.00 37.83 31.55 2k6p s LYS 14 CO 0.02 -2.51 0.35 1.03 0.10 0.00 0.00 175.35 174.35 2k6p s ARG 15 N 6.74 0.97 -0.53 1.78 1.81 -1.26 -5.05 118.95 123.41 2k6p s ARG 15 Ca 0.76 -0.67 -0.00 0.00 -1.72 0.00 0.00 55.73 54.10 2k6p s ARG 15 Cb -0.17 0.42 0.45 0.00 -0.45 0.00 0.00 34.95 35.20 2k6p s ARG 15 CO 0.26 -0.35 1.97 -2.13 -0.68 0.00 0.00 175.30 174.37 2k6p n ARG 16 N 0.03 2.37 -4.27 3.54 3.00 -1.26 -4.93 116.66 115.14 2k6p n ARG 16 Ca -0.17 -2.82 -0.15 0.00 -0.00 0.00 0.00 57.85 54.72 2k6p n ARG 16 Cb 0.62 -2.10 -0.10 0.00 0.00 0.00 0.00 32.46 30.88 2k6p n ARG 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 2k6p s VAL 17 N -3.86 0.67 -0.16 5.15 -7.23 -1.26 -5.06 120.40 108.64 2k6p s VAL 17 Ca 0.55 -1.99 0.15 0.00 -1.81 0.00 0.00 61.98 58.87 2k6p s VAL 17 Cb 0.44 -2.31 0.42 0.00 0.56 0.00 0.00 36.38 35.49 2k6p s VAL 17 CO 0.02 -0.30 1.21 0.00 -0.31 0.00 0.00 175.10 175.72 2k6p n LEU 18 N -0.33 2.29 -4.95 1.32 -0.00 -1.26 -5.06 117.00 109.01 2k6p n LEU 18 Ca -0.04 -3.44 -0.23 0.00 -0.00 0.00 0.00 56.01 52.29 2k6p n LEU 18 Cb 0.64 -0.40 -0.02 0.00 -0.00 0.00 0.00 43.42 43.64 2k6p n LEU 18 CO 0.35 1.19 0.05 0.00 -0.00 0.00 0.00 177.39 178.98 2k6p s ALA 19 N -2.45 3.82 -0.46 1.47 0.00 -1.26 -5.08 121.76 117.81 2k6p s ALA 19 Ca 0.37 -1.04 -0.05 0.00 0.00 0.00 0.00 51.96 51.24 2k6p s ALA 19 Cb 0.37 -1.92 0.12 0.00 0.00 0.00 0.00 23.12 21.70 2k6p s ALA 19 CO -0.09 0.18 0.29 0.95 0.00 0.00 0.00 175.76 177.08 2k6p s THR 20 N -2.09 3.67 -0.15 0.00 -4.23 -1.26 -4.88 115.64 106.70 2k6p s THR 20 Ca 0.37 -2.10 0.19 0.00 -1.18 0.00 0.00 61.69 58.96 2k6p s THR 20 Cb -0.10 -3.46 -0.26 0.00 1.34 0.00 0.00 72.50 70.02 2k6p s THR 20 CO 0.32 -0.75 0.25 0.47 -0.54 0.00 0.00 174.62 174.37 2k6p n ASP 21 N 4.53 0.11 -0.03 3.99 9.92 -1.26 -4.45 116.55 129.37 2k6p n ASP 21 Ca -0.02 0.05 -0.09 0.00 -0.53 0.00 0.00 54.79 54.20 2k6p n ASP 21 Cb 0.41 1.11 -0.02 0.00 -0.64 0.00 0.00 41.12 41.98 2k6p n ASP 21 CO 0.00 0.00 0.00 -0.03 0.13 0.00 0.00 177.20 177.30 2k6p h MET 22 N 0.00 -0.22 -0.10 -1.24 4.05 -1.98 0.37 114.93 115.81 2k6p h MET 22 Ca -0.38 0.01 0.03 0.00 -0.28 0.00 0.00 59.70 59.08 2k6p h MET 22 Cb 1.90 0.05 -0.00 0.00 -0.80 0.00 0.00 31.60 32.74 2k6p h MET 22 CO 0.03 -0.15 0.18 0.00 0.23 0.00 0.00 176.91 177.20 2k6p h ASN 24 N 0.00 0.00 -0.13 0.00 -0.73 -1.02 -3.36 115.58 110.33 2k6p h ASN 24 Ca 0.05 -0.23 0.04 0.00 1.87 0.00 0.00 56.30 58.02 2k6p h ASN 24 Cb 0.41 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.99 2k6p h ASN 24 CO -0.00 0.94 0.15 -0.37 -0.37 0.00 0.00 177.43 177.77 2k6p h VAL 25 N -1.00 0.50 -0.81 2.57 -1.51 -0.12 -3.46 116.25 112.42 2k6p h VAL 25 Ca -0.10 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.37 2k6p h VAL 25 Cb 0.69 0.88 0.00 0.00 -2.13 0.00 0.00 31.29 30.73 2k6p h VAL 25 CO -0.06 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.89 2k6p n GLY 26 N -1.39 0.75 0.01 5.19 0.00 0.14 -5.05 105.19 104.85 2k6p n GLY 26 Ca 0.00 -0.47 -0.02 0.00 0.00 0.00 0.00 46.02 45.53 2k6p n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k6p n ALA 27 N -0.41 1.93 -1.73 4.61 0.00 -0.69 -4.42 120.51 119.81 2k6p n ALA 27 Ca 0.00 -0.14 -0.43 0.00 0.00 0.00 0.00 53.44 52.88 2k6p n ALA 27 Cb 0.15 0.38 -0.03 0.00 0.00 0.00 0.00 19.45 19.96 2k6p n ALA 27 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2k6p s VAL 28 N -2.06 3.14 -0.20 0.00 -7.23 -1.25 -3.74 120.40 109.05 2k6p s VAL 28 Ca -0.04 0.16 -0.04 0.00 -1.81 0.00 0.00 61.98 60.25 2k6p s VAL 28 Cb 0.01 -3.15 0.08 0.00 0.56 0.00 0.00 36.38 33.89 2k6p s VAL 28 CO 0.08 -0.07 0.17 0.26 -0.31 0.00 0.00 175.10 175.23 2k6p s TRP 29 N 6.44 -0.06 -0.24 2.82 0.52 -1.24 -1.87 118.94 125.31 2k6p s TRP 29 Ca 0.91 -0.10 -0.16 0.00 0.02 0.00 0.00 56.10 56.77 2k6p s TRP 29 Cb -0.35 -0.54 -0.04 0.00 -1.15 0.00 0.00 33.47 31.40 2k6p s TRP 29 CO 0.36 -0.61 0.40 -1.17 0.02 0.00 0.00 176.95 175.95 2k6p s LEU 30 N 2.24 4.09 -1.37 2.99 0.20 0.23 -1.85 118.68 125.21 2k6p s LEU 30 Ca 0.05 0.40 -0.05 0.00 0.69 0.00 0.00 54.13 55.23 2k6p s LEU 30 Cb -0.16 -2.48 0.02 0.00 -0.43 0.00 0.00 46.19 43.14 2k6p s LEU 30 CO -0.14 -0.15 0.83 -3.20 -0.29 0.00 0.00 176.35 173.40 2k6p n ASN 31 N 5.01 -2.60 -1.73 3.68 4.05 -1.11 -1.04 115.26 121.52 2k6p n ASN 31 Ca -0.08 -0.78 -0.17 0.00 0.45 0.00 0.00 54.58 54.01 2k6p n ASN 31 Cb 0.51 -4.15 -0.03 0.00 1.23 0.00 0.00 39.78 37.33 2k6p n ASN 31 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2k6p n GLY 32 N -1.61 0.34 3.01 8.20 0.00 -1.26 -4.99 105.19 108.89 2k6p n GLY 32 Ca -0.18 -0.18 -0.16 0.00 0.00 0.00 0.00 46.02 45.49 2k6p n GLY 32 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2k6p s SER 33 N -2.43 0.87 0.06 1.61 0.15 -0.20 -5.11 113.70 108.65 2k6p s SER 33 Ca 0.00 -0.23 -0.31 0.00 0.70 0.00 0.00 55.95 56.10 2k6p s SER 33 Cb 0.00 -0.06 -0.10 0.00 -1.71 0.00 0.00 66.02 64.14 2k6p s SER 33 CO 0.00 0.02 1.89 0.00 1.20 0.00 0.00 173.24 176.35 2k6p n ALA 35 N 6.42 0.06 -3.57 0.00 0.00 -0.78 -4.77 120.51 117.87 2k6p n ALA 35 Ca 0.19 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2k6p n ALA 35 Cb 0.37 0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.88 2k6p n ALA 35 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2k6p n LYS 36 N -0.65 1.63 -0.88 0.00 4.81 -1.26 -4.87 118.16 116.93 2k6p n LYS 36 Ca -0.00 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.34 2k6p n LYS 36 Cb 0.04 0.00 0.21 0.00 0.02 0.00 0.00 35.03 35.30 2k6p n LYS 36 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2k6p n ALA 37 N -3.00 4.49 -1.96 3.14 0.00 -1.26 -4.07 120.51 117.85 2k6p n ALA 37 Ca 0.00 -2.03 -0.05 0.00 0.00 0.00 0.00 53.44 51.36 2k6p n ALA 37 Cb 0.00 -1.27 -0.05 0.00 0.00 0.00 0.00 19.45 18.14 2k6p n ALA 37 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2k6p n SER 38 N -0.35 -0.84 -4.62 0.00 7.64 -1.26 -4.70 113.62 109.50 2k6p n SER 38 Ca 0.39 -1.65 -0.40 0.00 1.01 0.00 0.00 58.87 58.21 2k6p n SER 38 Cb 1.29 0.27 -0.07 0.00 -1.01 0.00 0.00 64.21 64.68 2k6p n SER 38 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2k6p s LYS 39 N 0.01 4.05 -0.25 1.43 -0.14 -1.26 -5.00 119.74 118.59 2k6p s LYS 39 Ca 0.00 0.35 -0.29 0.00 -1.36 0.00 0.00 55.97 54.68 2k6p s LYS 39 Cb 0.02 -3.66 -0.03 0.00 -1.68 0.00 0.00 37.83 32.49 2k6p s LYS 39 CO -0.01 -0.39 1.74 -1.21 -0.76 0.00 0.00 175.35 174.73 2k6p s GLU 40 N 2.37 3.60 0.91 1.68 2.02 -1.26 -2.60 118.70 125.42 2k6p s GLU 40 Ca 0.22 1.65 -0.11 0.00 0.02 0.00 0.00 54.97 56.75 2k6p s GLU 40 Cb -0.16 -4.13 0.20 0.00 0.10 0.00 0.00 34.13 30.15 2k6p s GLU 40 CO 0.09 -1.54 1.24 1.33 0.02 0.00 0.00 175.26 176.40 2k6p n VAL 41 N 6.85 0.00 -4.14 2.63 0.24 0.12 -4.96 118.33 119.07 2k6p n VAL 41 Ca 0.21 -1.19 -0.12 0.00 -2.04 0.00 0.00 64.34 61.20 2k6p n VAL 41 Cb 0.46 -1.30 -0.08 0.00 -1.47 0.00 0.00 33.84 31.45 2k6p n VAL 41 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2k6p s LYS 42 N -5.69 1.43 0.66 7.34 -0.14 -1.26 -4.53 119.74 117.54 2k6p s LYS 42 Ca 0.74 -1.57 -0.12 0.00 -1.36 0.00 0.00 55.97 53.66 2k6p s LYS 42 Cb -0.03 0.35 -0.01 0.00 -1.68 0.00 0.00 37.83 36.46 2k6p s LYS 42 CO 0.51 -0.53 1.05 0.00 -0.76 0.00 0.00 175.35 175.62 2k6p s ALA 43 N -3.93 2.80 -1.65 5.17 0.00 -1.26 -3.66 121.76 119.22 2k6p s ALA 43 Ca 0.33 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.38 2k6p s ALA 43 Cb 0.04 -3.16 0.00 0.00 0.00 0.00 0.00 23.12 20.00 2k6p s ALA 43 CO 0.13 -1.00 0.00 0.41 0.00 0.00 0.00 175.76 175.30 2k6p n GLY 44 N -2.02 -0.00 3.93 0.00 0.00 0.31 -4.95 105.19 102.45 2k6p n GLY 44 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 2k6p n GLY 44 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k6p s ASP 45 N -2.16 4.88 0.04 1.61 -1.08 -1.06 -4.85 116.67 114.06 2k6p s ASP 45 Ca 0.00 -0.99 0.02 0.00 -0.52 0.00 0.00 52.55 51.06 2k6p s ASP 45 Cb 0.00 0.08 -0.04 0.00 -1.46 0.00 0.00 42.92 41.50 2k6p s ASP 45 CO 0.00 -1.02 0.05 -0.89 0.52 0.00 0.00 175.17 173.84 2k6p s THR 46 N -2.65 4.45 -0.31 1.71 2.01 -1.26 0.99 115.64 120.58 2k6p s THR 46 Ca 0.45 -0.67 -0.01 0.00 0.31 0.00 0.00 61.69 61.76 2k6p s THR 46 Cb -0.03 -3.08 0.10 0.00 0.01 0.00 0.00 72.50 69.49 2k6p s THR 46 CO 0.27 0.23 0.10 -0.63 -0.69 0.00 0.00 174.62 173.91 2k6p s ILE 47 N -1.27 0.69 0.45 1.82 -1.09 -0.03 -2.76 121.20 119.00 2k6p s ILE 47 Ca 0.25 -1.27 -0.12 0.00 -2.23 0.00 0.00 60.65 57.28 2k6p s ILE 47 Cb -0.12 -1.53 -0.07 0.00 -1.58 0.00 0.00 42.46 39.16 2k6p s ILE 47 CO 0.17 -0.69 0.84 -0.44 -1.23 0.00 0.00 174.94 173.60 2k6p s SER 48 N 1.71 6.54 -0.09 3.58 0.01 -0.77 0.58 113.70 125.26 2k6p s SER 48 Ca 0.10 1.28 -0.04 0.00 1.31 0.00 0.00 55.95 58.59 2k6p s SER 48 Cb -0.17 -2.38 0.05 0.00 0.21 0.00 0.00 66.02 63.72 2k6p s SER 48 CO -0.28 -0.47 0.21 -0.76 0.41 0.00 0.00 173.24 172.36 2k6p s LEU 49 N -3.96 0.41 -0.15 2.44 1.02 0.21 -3.69 118.68 114.96 2k6p s LEU 49 Ca 0.54 0.46 -0.21 0.00 0.02 0.00 0.00 54.13 54.93 2k6p s LEU 49 Cb -0.10 0.60 -0.03 0.00 0.02 0.00 0.00 46.19 46.68 2k6p s LEU 49 CO 0.32 -0.17 0.62 -2.28 0.02 0.00 0.00 176.35 174.86 2k6p s HIS 50 N 1.39 3.46 0.19 0.29 2.46 -1.25 -1.25 115.29 120.58 2k6p s HIS 50 Ca -0.08 1.01 0.03 0.00 0.47 0.00 0.00 55.06 56.49 2k6p s HIS 50 Cb -0.11 -2.75 -0.01 0.00 -0.13 0.00 0.00 32.58 29.58 2k6p s HIS 50 CO -0.08 -0.04 0.10 0.66 -2.47 0.00 0.00 174.74 172.92 2k6p n TYR 51 N 4.43 -0.09 -0.05 3.88 4.02 -1.26 -4.83 117.16 123.26 2k6p n TYR 51 Ca -0.02 -1.36 -0.03 0.00 -0.01 0.00 0.00 57.90 56.48 2k6p n TYR 51 Cb 0.50 0.05 -0.15 0.00 -0.02 0.00 0.00 39.34 39.73 2k6p n TYR 51 CO 0.00 0.00 0.00 1.47 -1.01 0.00 0.00 176.86 177.32 2k6p n LEU 52 N 0.00 0.24 0.05 7.72 -0.00 -1.26 -4.30 117.00 119.44 2k6p n LEU 52 Ca -0.01 0.11 -0.02 0.00 -0.00 0.00 0.00 56.01 56.09 2k6p n LEU 52 Cb 0.31 0.28 -0.07 0.00 -0.00 0.00 0.00 43.42 43.94 2k6p n LEU 52 CO 0.16 0.32 -0.12 0.07 -0.00 0.00 0.00 177.39 177.82 2k6p h LYS 53 N 0.00 0.00 0.00 1.47 2.10 -2.01 -3.49 116.57 114.64 2k6p h LYS 53 Ca -0.34 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 2k6p h LYS 53 Cb 1.83 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.16 2k6p h LYS 53 CO 0.03 0.44 0.00 0.41 -2.00 0.00 0.00 179.45 178.33 2k6p n GLY 54 N 1.38 3.09 3.72 0.07 0.00 -1.26 -5.13 105.19 107.06 2k6p n GLY 54 Ca -0.07 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 44.96 2k6p n GLY 54 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k6p s ILE 55 N -2.00 3.76 -0.18 -0.61 -1.09 -1.26 -4.00 121.20 115.81 2k6p s ILE 55 Ca 0.00 1.35 -0.03 0.00 -2.23 0.00 0.00 60.65 59.74 2k6p s ILE 55 Cb 0.00 -3.86 -0.02 0.00 -1.58 0.00 0.00 42.46 37.00 2k6p s ILE 55 CO 0.00 0.16 -0.04 -1.61 -1.23 0.00 0.00 174.94 172.21 2k6p s GLU 56 N 0.48 3.51 -0.47 2.79 2.02 -0.38 -4.95 118.70 121.70 2k6p s GLU 56 Ca 0.57 -0.58 -0.03 0.00 0.02 0.00 0.00 54.97 54.94 2k6p s GLU 56 Cb -0.32 -2.94 0.13 0.00 0.10 0.00 0.00 34.13 31.10 2k6p s GLU 56 CO 0.33 0.03 0.28 -2.00 0.02 0.00 0.00 175.26 173.91 2k6p s GLU 57 N 0.90 2.17 0.93 1.61 2.12 -1.25 0.68 118.70 125.87 2k6p s GLU 57 Ca -0.01 -2.03 -0.13 0.00 0.36 0.00 0.00 54.97 53.16 2k6p s GLU 57 Cb -0.15 -3.63 0.21 0.00 0.26 0.00 0.00 34.13 30.82 2k6p s GLU 57 CO 0.01 -1.11 1.27 0.66 -0.54 0.00 0.00 175.26 175.56 2k6p n TYR 58 N 4.27 -3.75 -3.68 5.30 4.02 0.20 0.46 117.16 123.97 2k6p n TYR 58 Ca 0.01 -1.33 -0.16 0.00 -0.01 0.00 0.00 57.90 56.41 2k6p n TYR 58 Cb 0.40 -0.97 -0.15 0.00 -0.02 0.00 0.00 39.34 38.60 2k6p n TYR 58 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 2k6p s THR 59 N -3.76 -0.23 -0.05 -0.72 2.01 -0.28 -0.85 115.64 111.76 2k6p s THR 59 Ca 0.74 0.31 -0.30 0.00 0.31 0.00 0.00 61.69 62.76 2k6p s THR 59 Cb -0.02 -0.30 -0.03 0.00 0.01 0.00 0.00 72.50 72.16 2k6p s THR 59 CO 0.52 0.13 1.19 -0.63 -0.69 0.00 0.00 174.62 175.13 2k6p s ILE 60 N 2.06 4.28 -0.32 1.82 1.01 0.28 -2.62 121.20 127.72 2k6p s ILE 60 Ca 0.00 1.60 0.22 0.00 0.00 0.00 0.00 60.65 62.48 2k6p s ILE 60 Cb -0.12 -4.03 -0.28 0.00 0.01 0.00 0.00 42.46 38.04 2k6p s ILE 60 CO -0.06 0.01 0.66 0.18 0.00 0.00 0.00 174.94 175.72 2k6p n LEU 61 N 5.10 0.33 -3.64 2.97 4.77 0.22 0.12 117.00 126.87 2k6p n LEU 61 Ca 0.11 -0.10 -0.03 0.00 -0.03 0.00 0.00 56.01 55.96 2k6p n LEU 61 Cb 0.46 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.51 2k6p n LEU 61 CO 0.55 0.05 1.13 -1.10 -1.33 0.00 0.00 177.39 176.70 2k6p s GLN 62 N -3.36 0.10 -0.59 3.23 -0.21 -1.23 -4.39 119.66 113.20 2k6p s GLN 62 Ca -0.03 -0.01 0.01 0.00 0.02 0.00 0.00 55.36 55.35 2k6p s GLN 62 Cb 0.14 0.05 0.15 0.00 1.00 0.00 0.00 33.01 34.35 2k6p s GLN 62 CO 0.88 -0.04 0.37 0.42 -2.12 0.00 0.00 175.29 174.81 2k6p s ILE 63 N -1.54 3.19 -0.84 1.08 -1.09 -1.26 -4.77 121.20 115.97 2k6p s ILE 63 Ca 0.10 -3.21 0.15 0.00 -2.23 0.00 0.00 60.65 55.46 2k6p s ILE 63 Cb -0.01 -3.13 0.14 0.00 -1.58 0.00 0.00 42.46 37.88 2k6p s ILE 63 CO -0.05 -0.85 1.48 -0.81 -1.23 0.00 0.00 174.94 173.48 2k6p n PRO 64 N 3.21 0.05 -3.22 2.79 -0.04 -1.26 -4.90 135.00 131.63 2k6p n PRO 64 Ca 0.07 0.33 -0.15 0.00 -0.04 0.00 0.00 63.50 63.72 2k6p n PRO 64 Cb 0.35 -1.61 0.07 0.00 -0.04 0.00 0.00 33.50 32.28 2k6p n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k6p n ALA 65 N -1.58 -2.18 -2.36 0.55 0.00 -1.26 -5.03 120.51 108.65 2k6p n ALA 65 Ca 0.03 0.06 -0.22 0.00 0.00 0.00 0.00 53.44 53.30 2k6p n ALA 65 Cb 0.16 -4.21 -0.05 0.00 0.00 0.00 0.00 19.45 15.36 2k6p n ALA 65 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k6p s LEU 66 N -5.59 3.34 -0.14 0.00 1.43 -1.26 -5.05 118.68 111.41 2k6p s LEU 66 Ca 0.26 -0.79 0.14 0.00 -1.03 0.00 0.00 54.13 52.71 2k6p s LEU 66 Cb -0.03 -1.89 -0.20 0.00 0.03 0.00 0.00 46.19 44.10 2k6p s LEU 66 CO 0.69 -0.52 0.09 1.17 0.23 0.00 0.00 176.35 178.01 2k6p n LYS 67 N -1.38 1.36 -3.47 1.70 4.81 -1.26 -4.94 118.16 114.98 2k6p n LYS 67 Ca 0.01 -0.03 -0.10 0.00 -0.87 0.00 0.00 58.31 57.33 2k6p n LYS 67 Cb 0.62 -1.40 -0.09 0.00 0.02 0.00 0.00 35.03 34.18 2k6p n LYS 67 CO 0.00 0.00 0.00 1.21 1.17 0.00 0.00 177.40 179.78 2k6p s ASN 68 N -4.78 0.14 -0.05 3.14 2.47 -1.26 -4.59 114.94 110.01 2k6p s ASN 68 Ca -0.07 0.46 0.06 0.00 0.42 0.00 0.00 52.86 53.73 2k6p s ASN 68 Cb 0.05 1.13 -0.01 0.00 -1.45 0.00 0.00 41.25 40.97 2k6p s ASN 68 CO 0.64 -0.28 -0.25 -0.69 -3.72 0.00 0.00 177.10 172.81 2k6p s VAL 69 N 2.55 2.11 0.97 -5.21 1.01 -0.27 -5.00 120.40 116.56 2k6p s VAL 69 Ca 0.08 -1.05 -0.11 0.00 0.00 0.00 0.00 61.98 60.89 2k6p s VAL 69 Cb -0.14 -1.76 0.17 0.00 0.00 0.00 0.00 36.38 34.65 2k6p s VAL 69 CO -0.14 0.57 1.09 -2.16 0.00 0.00 0.00 175.10 174.46 2k6p s PRO 70 N -0.27 0.65 -0.58 2.72 0.04 -1.26 -3.72 135.00 132.59 2k6p s PRO 70 Ca -0.00 1.00 -0.04 0.00 0.04 0.00 0.00 61.00 61.99 2k6p s PRO 70 Cb -0.13 -1.73 0.08 0.00 0.04 0.00 0.00 34.50 32.76 2k6p s PRO 70 CO 0.03 -2.71 2.70 -2.13 0.04 0.00 0.00 177.00 174.93 2k6p n ARG 71 N -4.23 2.72 0.00 4.56 0.63 -1.26 -3.46 116.66 115.63 2k6p n ARG 71 Ca 0.07 -2.53 0.00 0.00 -0.92 0.00 0.00 57.85 54.47 2k6p n ARG 71 Cb 0.54 -2.21 0.00 0.00 0.45 0.00 0.00 32.46 31.24 2k6p n ARG 71 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 2k6p n LYS 72 N 0.95 0.00 0.03 -0.14 4.81 -1.26 -4.89 118.16 117.67 2k6p n LYS 72 Ca 0.51 0.00 0.06 0.00 -0.87 0.00 0.00 58.31 58.00 2k6p n LYS 72 Cb 0.50 -0.14 -0.08 0.00 0.02 0.00 0.00 35.03 35.33 2k6p n LYS 72 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2k6p n ASP 73 N -2.21 0.57 0.32 3.14 8.00 -1.26 -4.07 116.55 121.04 2k6p n ASP 73 Ca 0.00 0.23 0.19 0.00 0.71 0.00 0.00 54.79 55.93 2k6p n ASP 73 Cb 0.00 0.79 1.03 0.00 -0.02 0.00 0.00 41.12 42.92 2k6p n ASP 73 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k6p h THR 74 N 0.00 0.10 -0.03 -3.53 1.03 -1.88 -1.42 112.91 107.18 2k6p h THR 74 Ca -0.10 0.00 0.01 0.00 -0.01 0.00 0.00 66.41 66.31 2k6p h THR 74 Cb 1.30 0.88 -0.00 0.00 -1.07 0.00 0.00 68.15 69.26 2k6p h THR 74 CO 0.02 0.00 0.20 -0.74 -0.01 0.00 0.00 175.52 174.99 2k6p h HIS 75 N 0.00 0.00 -0.01 0.00 -0.00 -1.75 0.49 115.15 113.89 2k6p h HIS 75 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.38 2k6p h HIS 75 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.67 2k6p h HIS 75 CO 0.00 0.00 -0.22 1.28 -0.00 0.00 0.00 177.93 178.99 2k6p n LEU 76 N -3.09 1.10 -0.05 0.26 4.77 -0.54 -4.02 117.00 115.43 2k6p n LEU 76 Ca -0.02 -0.30 -0.04 0.00 -0.03 0.00 0.00 56.01 55.62 2k6p n LEU 76 Cb 0.27 -0.10 -0.08 0.00 -2.33 0.00 0.00 43.42 41.17 2k6p n LEU 76 CO 0.18 0.20 -0.83 -1.22 -1.33 0.00 0.00 177.39 174.39 2k6p n TYR 77 N -0.52 0.00 -3.68 -1.77 4.01 0.16 -4.36 117.16 110.99 2k6p n TYR 77 Ca 0.13 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.75 2k6p n TYR 77 Cb 0.35 -0.50 -0.09 0.00 -0.31 0.00 0.00 39.34 38.79 2k6p n TYR 77 CO 0.00 0.00 0.00 -1.50 -0.46 0.00 0.00 176.86 174.90 2k6p s ILE 78 N -2.30 -0.00 -0.06 -0.72 2.07 -0.51 0.73 121.20 120.41 2k6p s ILE 78 Ca -0.05 0.01 -0.11 0.00 -1.41 0.00 0.00 60.65 59.09 2k6p s ILE 78 Cb 0.03 -0.76 0.02 0.00 0.13 0.00 0.00 42.46 41.88 2k6p s ILE 78 CO 0.44 0.01 0.27 0.00 -1.91 0.00 0.00 174.94 173.74 2k6p s ALA 79 N 0.61 -0.66 0.01 1.50 0.00 -1.08 -4.29 121.76 117.86 2k6p s ALA 79 Ca -0.03 0.47 -0.31 0.00 0.00 0.00 0.00 51.96 52.09 2k6p s ALA 79 Cb -0.05 -0.18 -0.10 0.00 0.00 0.00 0.00 23.12 22.79 2k6p s ALA 79 CO -0.04 -0.19 1.93 -2.30 0.00 0.00 0.00 175.76 175.16 2k6p n PRO 80 N 2.10 2.65 -4.44 0.00 -0.02 -1.26 -1.13 135.00 132.91 2k6p n PRO 80 Ca -0.18 0.97 -0.26 0.00 -2.02 0.00 0.00 63.50 62.01 2k6p n PRO 80 Cb 0.57 -2.89 -0.07 0.00 -0.02 0.00 0.00 33.50 31.09 2k6p n PRO 80 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2k6p n LYS 81 N 7.00 0.62 -3.74 -0.52 4.81 0.17 -4.90 118.16 121.60 2k6p n LYS 81 Ca 0.21 -3.47 -0.12 0.00 -0.87 0.00 0.00 58.31 54.05 2k6p n LYS 81 Cb 0.37 1.70 -0.11 0.00 0.02 0.00 0.00 35.03 37.00 2k6p n LYS 81 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2k6p s THR 82 N -3.03 -0.02 -0.29 3.15 2.01 -1.25 -3.92 115.64 112.30 2k6p s THR 82 Ca 0.17 0.06 0.09 0.00 0.31 0.00 0.00 61.69 62.31 2k6p s THR 82 Cb 0.01 -0.48 0.47 0.00 0.01 0.00 0.00 72.50 72.51 2k6p s THR 82 CO 0.12 0.02 1.18 0.29 -0.69 0.00 0.00 174.62 175.54 2k6p n LYS 83 N 3.54 3.39 0.00 4.92 4.76 -1.26 -5.16 118.16 128.35 2k6p n LYS 83 Ca -0.18 -4.09 0.13 0.00 -2.87 0.00 0.00 58.31 51.29 2k6p n LYS 83 Cb 0.56 -2.20 0.26 0.00 -1.84 0.00 0.00 35.03 31.82 2k6p n LYS 83 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42