#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 0.72 0.60 2.12 1.70 -1.26 -0.73 118.95 122.09 2k6p s ARG 2 Ca 0.00 -1.00 0.28 0.00 -0.47 0.00 0.00 55.73 54.55 2k6p s ARG 2 Cb 0.00 0.28 1.36 0.00 -0.57 0.00 0.00 34.95 36.02 2k6p s ARG 2 CO 0.00 -0.19 1.76 0.97 -1.08 0.00 0.00 175.30 176.76 2k6p h ILE 3 N 3.06 0.26 0.29 4.99 -0.00 -1.91 1.25 117.51 125.45 2k6p h ILE 3 Ca -0.34 0.00 -0.01 0.00 -0.00 0.00 0.00 64.86 64.51 2k6p h ILE 3 Cb 1.18 0.48 0.00 0.00 -0.00 0.00 0.00 36.82 38.48 2k6p h ILE 3 CO 0.58 0.00 -0.14 -0.78 -0.00 0.00 0.00 178.15 177.81 2k6p h ASP 4 N 0.00 -0.33 0.21 2.19 3.58 -1.86 -3.27 116.42 116.94 2k6p h ASP 4 Ca 0.27 -0.19 0.00 0.00 0.42 0.00 0.00 57.03 57.52 2k6p h ASP 4 Cb 1.55 0.09 0.00 0.00 1.72 0.00 0.00 39.33 42.69 2k6p h ASP 4 CO -0.00 0.13 -0.23 1.17 -2.88 0.00 0.00 179.24 177.43 2k6p n LYS 5 N -5.06 0.94 0.01 0.28 4.81 -0.46 -3.44 118.16 115.24 2k6p n LYS 5 Ca -0.08 -0.56 -0.02 0.00 -0.87 0.00 0.00 58.31 56.79 2k6p n LYS 5 Cb 0.26 -1.49 -0.01 0.00 0.02 0.00 0.00 35.03 33.81 2k6p n LYS 5 CO 0.00 0.00 0.00 0.35 1.17 0.00 0.00 177.40 178.92 2k6p h PHE 6 N 1.36 -0.09 0.00 5.64 3.57 0.14 -3.04 116.94 124.52 2k6p h PHE 6 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2k6p h PHE 6 Cb 0.51 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.28 2k6p h PHE 6 CO 0.00 -0.06 -0.31 1.37 -2.23 0.00 0.00 178.31 177.09 2k6p h LEU 7 N -0.63 0.00 0.00 0.59 8.10 -1.77 -3.06 115.31 118.55 2k6p h LEU 7 Ca -0.01 -0.05 -0.10 0.00 0.11 0.00 0.00 57.88 57.83 2k6p h LEU 7 Cb 0.08 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.28 2k6p h LEU 7 CO 0.02 0.02 -0.94 1.56 -4.11 0.00 0.00 178.44 174.99 2k6p h GLN 8 N 0.00 0.00 0.03 0.17 4.20 -1.74 -2.45 115.11 115.32 2k6p h GLN 8 Ca 0.00 0.00 -0.30 0.00 0.06 0.00 0.00 58.65 58.41 2k6p h GLN 8 Cb 0.87 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.61 2k6p h GLN 8 CO 0.00 0.26 -1.65 0.77 -0.67 0.00 0.00 178.83 177.54 2k6p h SER 9 N 0.00 0.11 0.21 1.46 0.02 -1.60 -3.34 113.55 110.41 2k6p h SER 9 Ca -0.07 -0.21 -0.04 0.00 -0.84 0.00 0.00 61.79 60.63 2k6p h SER 9 Cb 1.35 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.85 2k6p h SER 9 CO 0.04 1.18 -0.20 -0.37 -1.14 0.00 0.00 176.83 176.34 2k6p h VAL 10 N 0.02 1.13 0.00 2.27 -1.51 -1.66 -3.25 116.25 113.25 2k6p h VAL 10 Ca -0.27 -0.70 0.00 0.00 -1.23 0.00 0.00 66.70 64.50 2k6p h VAL 10 Cb 1.99 1.38 0.00 0.00 -2.13 0.00 0.00 31.29 32.53 2k6p h VAL 10 CO 0.10 0.20 0.00 0.61 -1.23 0.00 0.00 177.57 177.24 2k6p n GLY 11 N -0.94 0.95 0.18 5.19 0.00 -1.25 -4.76 105.19 104.56 2k6p n GLY 11 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 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 2.53 -4.71 0.99 0.00 -0.93 -5.03 117.00 109.85 2k6p n LEU 12 Ca 0.00 -0.02 -0.31 0.00 0.00 0.00 0.00 56.01 55.68 2k6p n LEU 12 Cb 0.00 -0.43 0.13 0.00 0.00 0.00 0.00 43.42 43.12 2k6p n LEU 12 CO 0.00 0.61 0.70 0.54 0.00 0.00 0.00 177.39 179.25 2k6p s VAL 13 N -2.25 2.46 0.08 1.96 0.11 -1.22 -5.03 120.40 116.51 2k6p s VAL 13 Ca -0.17 0.16 0.07 0.00 -2.93 0.00 0.00 61.98 59.10 2k6p s VAL 13 Cb 0.05 -2.39 -0.04 0.00 -1.53 0.00 0.00 36.38 32.47 2k6p s VAL 13 CO 0.28 -0.18 -0.11 -0.54 -3.33 0.00 0.00 175.10 171.22 2k6p s LYS 14 N -4.61 2.17 -0.60 1.54 -0.14 -1.26 -5.04 119.74 111.80 2k6p s LYS 14 Ca 0.66 -0.98 -0.26 0.00 -1.36 0.00 0.00 55.97 54.02 2k6p s LYS 14 Cb -0.22 -2.31 -0.10 0.00 -1.68 0.00 0.00 37.83 33.51 2k6p s LYS 14 CO 0.55 0.52 2.46 2.89 -0.76 0.00 0.00 175.35 181.02 2k6p n ARG 15 N 0.93 0.82 -3.59 1.68 1.85 -1.26 -4.83 116.66 112.25 2k6p n ARG 15 Ca -0.14 -0.08 -0.01 0.00 -1.00 0.00 0.00 57.85 56.61 2k6p n ARG 15 Cb 0.52 -3.14 -0.06 0.00 -1.05 0.00 0.00 32.46 28.74 2k6p n ARG 15 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 2k6p s ARG 16 N 8.44 0.36 0.64 2.89 3.00 -1.26 -5.15 118.95 127.87 2k6p s ARG 16 Ca 1.04 0.67 0.00 0.00 -1.00 0.00 0.00 55.73 56.44 2k6p s ARG 16 Cb -0.35 0.16 0.00 0.00 0.00 0.00 0.00 34.95 34.76 2k6p s ARG 16 CO 0.28 -0.08 0.00 0.28 0.00 0.00 0.00 175.30 175.78 2k6p n VAL 17 N 3.98 -1.15 -3.36 7.11 0.31 -1.26 -4.97 118.33 118.98 2k6p n VAL 17 Ca -0.16 1.03 -0.21 0.00 -0.01 0.00 0.00 64.34 64.98 2k6p n VAL 17 Cb 0.56 -1.57 0.02 0.00 -0.91 0.00 0.00 33.84 31.95 2k6p n VAL 17 CO 0.00 0.00 0.00 -1.48 -1.32 0.00 0.00 176.83 174.03 2k6p s LEU 18 N -7.19 3.11 0.00 7.52 0.05 -1.26 -4.81 118.68 116.10 2k6p s LEU 18 Ca 0.00 -0.89 0.00 0.00 0.05 0.00 0.00 54.13 53.29 2k6p s LEU 18 Cb 0.00 -1.71 0.00 0.00 -2.05 0.00 0.00 46.19 42.43 2k6p s LEU 18 CO 0.00 -1.09 0.00 0.00 -0.55 0.00 0.00 176.35 174.71 2k6p n ALA 19 N -1.94 0.00 -1.00 1.48 0.00 -1.26 -4.31 120.51 113.48 2k6p n ALA 19 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2k6p n ALA 19 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 2k6p n ALA 19 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2k6p n THR 20 N 0.00 0.00 -0.22 0.00 5.66 -1.26 -5.02 114.28 113.44 2k6p n THR 20 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2k6p n THR 20 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 2k6p n THR 20 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 2k6p n ASP 21 N -0.85 0.00 0.08 1.09 2.03 -1.26 -4.83 116.55 112.80 2k6p n ASP 21 Ca 0.00 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.26 2k6p n ASP 21 Cb 0.00 -0.09 -0.04 0.00 -0.72 0.00 0.00 41.12 40.27 2k6p n ASP 21 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 2k6p h MET 22 N 2.11 0.00 0.00 -0.67 2.86 -1.95 -2.29 114.93 114.99 2k6p h MET 22 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2k6p h MET 22 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 2k6p h MET 22 CO 0.00 0.90 0.00 0.00 1.06 0.00 0.00 176.91 178.87 2k6p n ASN 24 N -2.74 1.97 0.22 0.00 5.15 -1.19 -4.31 115.26 114.36 2k6p n ASN 24 Ca 0.02 0.19 0.13 0.00 -0.60 0.00 0.00 54.58 54.33 2k6p n ASN 24 Cb 0.31 -0.73 0.75 0.00 -0.53 0.00 0.00 39.78 39.58 2k6p n ASN 24 CO 0.00 0.00 0.00 -0.37 1.40 0.00 0.00 177.26 178.29 2k6p h VAL 25 N -0.55 0.74 0.00 3.44 -1.51 -1.44 -3.45 116.25 113.47 2k6p h VAL 25 Ca -0.57 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.90 2k6p h VAL 25 Cb 1.71 0.92 0.00 0.00 -2.13 0.00 0.00 31.29 31.79 2k6p h VAL 25 CO -0.22 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.73 2k6p n GLY 26 N -1.48 1.84 1.80 5.19 0.00 -1.05 -5.02 105.19 106.47 2k6p n GLY 26 Ca -0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.76 5.13 -3.50 4.61 0.00 0.35 -4.35 120.51 121.99 2k6p n ALA 27 Ca 0.00 -3.45 -0.22 0.00 0.00 0.00 0.00 53.44 49.77 2k6p n ALA 27 Cb 0.00 -0.88 -0.13 0.00 0.00 0.00 0.00 19.45 18.44 2k6p n ALA 27 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2k6p s VAL 28 N -4.12 -0.25 -0.18 0.00 1.01 -1.23 -4.31 120.40 111.32 2k6p s VAL 28 Ca 0.52 -0.39 -0.04 0.00 0.00 0.00 0.00 61.98 62.07 2k6p s VAL 28 Cb 0.44 -0.83 0.08 0.00 0.00 0.00 0.00 36.38 36.07 2k6p s VAL 28 CO 0.01 -0.42 0.20 0.26 0.00 0.00 0.00 175.10 175.15 2k6p s TRP 29 N 2.25 -0.21 -0.32 5.22 0.52 -1.26 -2.62 118.94 122.51 2k6p s TRP 29 Ca 0.07 0.24 -0.15 0.00 0.02 0.00 0.00 56.10 56.28 2k6p s TRP 29 Cb -0.15 -0.38 -0.02 0.00 -1.15 0.00 0.00 33.47 31.77 2k6p s TRP 29 CO -0.24 -0.54 0.35 -1.17 0.02 0.00 0.00 176.95 175.37 2k6p s LEU 30 N 2.30 4.31 -1.21 2.99 1.98 0.50 -2.37 118.68 127.18 2k6p s LEU 30 Ca 0.06 -0.09 -0.04 0.00 -2.89 0.00 0.00 54.13 51.17 2k6p s LEU 30 Cb -0.15 -2.35 -0.02 0.00 0.66 0.00 0.00 46.19 44.34 2k6p s LEU 30 CO -0.11 -0.28 0.83 0.59 -1.89 0.00 0.00 176.35 175.49 2k6p n ASN 31 N 5.35 -2.97 -3.20 3.68 4.13 -1.25 -2.00 115.26 118.99 2k6p n ASN 31 Ca -0.09 -0.77 -0.23 0.00 1.68 0.00 0.00 54.58 55.17 2k6p n ASN 31 Cb 0.50 -4.48 0.03 0.00 -1.54 0.00 0.00 39.78 34.29 2k6p n ASN 31 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2k6p n GLY 32 N -1.40 -0.52 2.87 7.41 0.00 -1.26 -4.98 105.19 107.32 2k6p n GLY 32 Ca -0.23 0.14 -0.16 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.80 0.48 0.26 1.61 0.15 -0.85 -5.13 113.70 107.42 2k6p s SER 33 Ca 0.37 0.34 -0.31 0.00 0.70 0.00 0.00 55.95 57.06 2k6p s SER 33 Cb -0.17 0.28 -0.12 0.00 -1.71 0.00 0.00 66.02 64.30 2k6p s SER 33 CO 0.46 -0.22 1.65 0.00 1.20 0.00 0.00 173.24 176.33 2k6p s ALA 35 N 0.44 0.81 0.90 0.00 0.00 -1.08 -4.86 121.76 117.97 2k6p s ALA 35 Ca 0.68 -1.32 0.00 0.00 0.00 0.00 0.00 51.96 51.32 2k6p s ALA 35 Cb -0.50 0.28 0.00 0.00 0.00 0.00 0.00 23.12 22.90 2k6p s ALA 35 CO 0.42 -0.31 0.00 1.63 0.00 0.00 0.00 175.76 177.50 2k6p n LYS 36 N 0.00 0.61 -0.90 0.00 4.76 -1.26 -4.75 118.16 116.62 2k6p n LYS 36 Ca -0.12 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.19 2k6p n LYS 36 Cb 0.61 0.00 0.18 0.00 -1.84 0.00 0.00 35.03 33.99 2k6p n LYS 36 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2k6p n ALA 37 N -3.00 4.62 -2.29 7.82 0.00 -1.26 -4.01 120.51 122.39 2k6p n ALA 37 Ca 0.00 -2.09 -0.00 0.00 0.00 0.00 0.00 53.44 51.35 2k6p n ALA 37 Cb 0.00 -1.29 -0.01 0.00 0.00 0.00 0.00 19.45 18.15 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 -0.49 0.24 -4.54 0.00 7.64 -1.26 -4.71 113.62 110.51 2k6p n SER 38 Ca 0.41 -1.97 -0.41 0.00 1.01 0.00 0.00 58.87 57.91 2k6p n SER 38 Cb 1.32 -0.08 -0.09 0.00 -1.01 0.00 0.00 64.21 64.35 2k6p n SER 38 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2k6p s LYS 39 N 0.00 3.51 0.24 1.43 2.47 -1.26 -5.05 119.74 121.08 2k6p s LYS 39 Ca 0.20 -0.40 -0.30 0.00 -1.56 0.00 0.00 55.97 53.91 2k6p s LYS 39 Cb 0.23 -3.83 -0.10 0.00 -1.46 0.00 0.00 37.83 32.67 2k6p s LYS 39 CO -0.10 -0.60 1.40 -1.21 0.16 0.00 0.00 175.35 175.00 2k6p s GLU 40 N 2.13 4.30 0.41 4.03 8.01 -1.26 -3.30 118.70 133.02 2k6p s GLU 40 Ca 0.14 2.23 0.08 0.00 0.01 0.00 0.00 54.97 57.42 2k6p s GLU 40 Cb -0.16 -3.13 -0.02 0.00 -4.31 0.00 0.00 34.13 26.51 2k6p s GLU 40 CO 0.12 -0.36 0.37 0.14 0.01 0.00 0.00 175.26 175.54 2k6p s VAL 41 N -0.02 2.77 0.43 2.63 -7.23 0.09 -4.94 120.40 114.13 2k6p s VAL 41 Ca 0.58 -1.34 0.04 0.00 -1.81 0.00 0.00 61.98 59.45 2k6p s VAL 41 Cb -0.40 -3.02 -0.01 0.00 0.56 0.00 0.00 36.38 33.50 2k6p s VAL 41 CO 0.42 -0.02 0.14 1.17 -0.31 0.00 0.00 175.10 176.50 2k6p n LYS 42 N -1.53 0.57 -2.19 4.82 4.81 -1.26 -4.63 118.16 118.76 2k6p n LYS 42 Ca 0.03 -3.62 -0.32 0.00 -0.87 0.00 0.00 58.31 53.53 2k6p n LYS 42 Cb 0.61 1.91 -0.01 0.00 0.02 0.00 0.00 35.03 37.56 2k6p n LYS 42 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2k6p s ALA 43 N -3.14 3.00 -1.75 3.14 0.00 -1.26 -3.77 121.76 117.97 2k6p s ALA 43 Ca 0.20 0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.32 2k6p s ALA 43 Cb 0.01 -3.13 0.00 0.00 0.00 0.00 0.00 23.12 20.00 2k6p s ALA 43 CO 0.14 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 175.84 2k6p n GLY 44 N -1.74 -0.20 3.75 0.00 0.00 0.31 -4.95 105.19 102.36 2k6p n GLY 44 Ca 0.07 -0.05 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 2k6p n GLY 44 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k6p s ASP 45 N -2.17 5.02 0.46 1.61 1.11 -1.18 -4.85 116.67 116.67 2k6p s ASP 45 Ca 0.00 -0.51 -0.04 0.00 0.18 0.00 0.00 52.55 52.18 2k6p s ASP 45 Cb 0.00 -1.04 -0.03 0.00 1.07 0.00 0.00 42.92 42.91 2k6p s ASP 45 CO 0.00 -0.12 0.75 -0.89 1.18 0.00 0.00 175.17 176.09 2k6p s THR 46 N -2.27 4.90 -0.27 -1.27 2.01 -1.26 0.89 115.64 118.37 2k6p s THR 46 Ca 0.34 0.08 -0.03 0.00 0.31 0.00 0.00 61.69 62.39 2k6p s THR 46 Cb -0.06 -3.85 0.11 0.00 0.01 0.00 0.00 72.50 68.70 2k6p s THR 46 CO 0.23 -0.79 0.18 -0.63 -0.69 0.00 0.00 174.62 172.92 2k6p s ILE 47 N -2.68 -0.19 0.42 1.82 -1.09 0.64 -3.90 121.20 116.22 2k6p s ILE 47 Ca 0.46 -0.55 -0.11 0.00 -2.23 0.00 0.00 60.65 58.23 2k6p s ILE 47 Cb -0.10 -0.91 -0.06 0.00 -1.58 0.00 0.00 42.46 39.81 2k6p s ILE 47 CO 0.43 -0.55 0.79 -0.44 -1.23 0.00 0.00 174.94 173.94 2k6p s SER 48 N 2.20 6.52 -0.14 3.58 0.01 -1.00 0.10 113.70 124.97 2k6p s SER 48 Ca 0.08 1.16 -0.06 0.00 1.31 0.00 0.00 55.95 58.44 2k6p s SER 48 Cb -0.15 -2.33 0.06 0.00 0.21 0.00 0.00 66.02 63.80 2k6p s SER 48 CO -0.30 -0.42 0.32 -0.22 0.41 0.00 0.00 173.24 173.02 2k6p s LEU 49 N -3.90 -0.08 0.00 2.44 2.96 0.73 -4.17 118.68 116.66 2k6p s LEU 49 Ca 0.52 0.70 -0.18 0.00 -0.22 0.00 0.00 54.13 54.95 2k6p s LEU 49 Cb -0.10 0.96 -0.06 0.00 0.50 0.00 0.00 46.19 47.49 2k6p s LEU 49 CO 0.32 -0.20 0.51 -2.28 -1.32 0.00 0.00 176.35 173.37 2k6p s HIS 50 N 1.84 3.71 0.27 5.38 2.46 -1.26 -0.95 115.29 126.74 2k6p s HIS 50 Ca -0.05 1.11 0.01 0.00 0.47 0.00 0.00 55.06 56.60 2k6p s HIS 50 Cb -0.11 -2.46 -0.03 0.00 -0.13 0.00 0.00 32.58 29.85 2k6p s HIS 50 CO -0.10 0.49 0.25 0.71 -2.47 0.00 0.00 174.74 173.62 2k6p s TYR 51 N -0.63 1.34 0.19 3.88 1.51 0.64 -4.79 117.35 119.50 2k6p s TYR 51 Ca 0.27 -1.45 0.06 0.00 -1.01 0.00 0.00 57.07 54.94 2k6p s TYR 51 Cb -0.18 -0.52 0.06 0.00 -0.11 0.00 0.00 41.96 41.21 2k6p s TYR 51 CO 0.15 -0.82 1.43 1.37 -1.11 0.00 0.00 175.55 176.58 2k6p h LEU 52 N 2.34 0.13 0.00 -1.29 -0.00 -2.04 -3.22 115.31 111.23 2k6p h LEU 52 Ca -0.30 -0.10 -0.22 0.00 -0.00 0.00 0.00 57.88 57.26 2k6p h LEU 52 Cb 1.24 -0.04 -0.03 0.00 -0.00 0.00 0.00 40.66 41.83 2k6p h LEU 52 CO 0.43 0.89 -1.16 0.07 -0.00 0.00 0.00 178.44 178.68 2k6p h LYS 53 N 0.06 0.00 0.00 0.17 2.10 -2.02 -3.50 116.57 113.38 2k6p h LYS 53 Ca -0.02 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 2k6p h LYS 53 Cb 1.43 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.76 2k6p h LYS 53 CO 0.12 0.77 0.00 0.41 -2.00 0.00 0.00 179.45 178.75 2k6p n GLY 54 N 1.39 -0.72 2.97 0.07 0.00 -1.22 -5.15 105.19 102.53 2k6p n GLY 54 Ca -0.05 -0.03 -0.12 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.45 0.01 -0.13 -0.61 1.09 -1.26 -0.26 121.20 117.58 2k6p s ILE 55 Ca 0.00 -0.04 0.02 0.00 -1.10 0.00 0.00 60.65 59.53 2k6p s ILE 55 Cb 0.00 -0.14 0.01 0.00 -1.06 0.00 0.00 42.46 41.26 2k6p s ILE 55 CO 0.00 -0.02 -0.21 -1.61 -0.10 0.00 0.00 174.94 172.99 2k6p s GLU 56 N -0.03 3.05 -0.32 2.79 2.02 -0.12 -4.94 118.70 121.16 2k6p s GLU 56 Ca -0.01 -0.84 -0.04 0.00 0.02 0.00 0.00 54.97 54.10 2k6p s GLU 56 Cb -0.01 -2.44 0.04 0.00 0.10 0.00 0.00 34.13 31.83 2k6p s GLU 56 CO 0.00 0.03 0.05 -2.00 0.02 0.00 0.00 175.26 173.36 2k6p s GLU 57 N 0.73 2.53 0.68 1.61 2.12 -1.26 -0.19 118.70 124.91 2k6p s GLU 57 Ca -0.09 -1.22 0.04 0.00 0.36 0.00 0.00 54.97 54.06 2k6p s GLU 57 Cb -0.16 -3.32 0.13 0.00 0.26 0.00 0.00 34.13 31.04 2k6p s GLU 57 CO 0.00 -0.64 0.93 0.66 -0.54 0.00 0.00 175.26 175.68 2k6p n TYR 58 N 4.72 -2.66 -3.78 5.30 4.02 0.29 -2.20 117.16 122.84 2k6p n TYR 58 Ca -0.13 -1.95 -0.17 0.00 -0.01 0.00 0.00 57.90 55.64 2k6p n TYR 58 Cb 0.44 -0.67 -0.17 0.00 -0.02 0.00 0.00 39.34 38.93 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 -2.95 0.01 -0.26 -0.72 2.01 0.09 -0.26 115.64 113.57 2k6p s THR 59 Ca 0.65 0.24 -0.29 0.00 0.31 0.00 0.00 61.69 62.61 2k6p s THR 59 Cb -0.04 -0.17 0.00 0.00 0.01 0.00 0.00 72.50 72.30 2k6p s THR 59 CO 0.43 0.14 1.16 -0.63 -0.69 0.00 0.00 174.62 175.02 2k6p s ILE 60 N 1.44 4.42 -0.39 1.82 1.01 0.26 -2.24 121.20 127.51 2k6p s ILE 60 Ca -0.04 1.67 0.23 0.00 0.00 0.00 0.00 60.65 62.51 2k6p s ILE 60 Cb -0.13 -4.24 0.19 0.00 0.01 0.00 0.00 42.46 38.30 2k6p s ILE 60 CO -0.03 -0.33 1.39 -0.07 0.00 0.00 0.00 174.94 175.91 2k6p h LEU 61 N 10.02 0.00 -7.21 2.97 3.38 0.33 0.89 115.31 125.69 2k6p h LEU 61 Ca -0.23 -0.01 0.33 0.00 0.09 0.00 0.00 57.88 58.07 2k6p h LEU 61 Cb 1.08 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.71 2k6p h LEU 61 CO 1.01 0.01 0.85 -1.10 0.09 0.00 0.00 178.44 179.29 2k6p s GLN 62 N -3.26 0.36 -0.41 1.13 -1.52 -1.20 -4.46 119.66 110.30 2k6p s GLN 62 Ca 0.04 -0.20 0.02 0.00 -1.95 0.00 0.00 55.36 53.28 2k6p s GLN 62 Cb 0.08 0.12 0.12 0.00 -0.22 0.00 0.00 33.01 33.11 2k6p s GLN 62 CO 0.71 -0.16 0.18 0.42 -0.25 0.00 0.00 175.29 176.19 2k6p s ILE 63 N -2.37 1.65 -0.67 1.08 -1.09 -1.26 -4.77 121.20 113.77 2k6p s ILE 63 Ca 0.15 -2.39 0.20 0.00 -2.23 0.00 0.00 60.65 56.38 2k6p s ILE 63 Cb 0.05 -2.19 0.20 0.00 -1.58 0.00 0.00 42.46 38.94 2k6p s ILE 63 CO -0.04 -0.77 1.61 -0.81 -1.23 0.00 0.00 174.94 173.70 2k6p n PRO 64 N 3.90 0.12 -2.56 2.79 -0.04 -1.26 -4.87 135.00 133.07 2k6p n PRO 64 Ca 0.05 0.37 -0.21 0.00 -0.04 0.00 0.00 63.50 63.66 2k6p n PRO 64 Cb 0.37 -1.74 0.00 0.00 -0.04 0.00 0.00 33.50 32.10 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 -1.67 -0.72 -2.11 0.55 0.00 -1.26 -4.98 120.51 110.32 2k6p n ALA 65 Ca 0.02 0.20 -0.15 0.00 0.00 0.00 0.00 53.44 53.52 2k6p n ALA 65 Cb 0.20 -2.62 0.10 0.00 0.00 0.00 0.00 19.45 17.13 2k6p n ALA 65 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2k6p n LEU 66 N -3.27 0.00 -0.05 0.00 4.32 -1.26 -4.93 117.00 111.80 2k6p n LEU 66 Ca -0.21 -1.19 -0.06 0.00 -0.02 0.00 0.00 56.01 54.53 2k6p n LEU 66 Cb 0.67 -0.52 -0.07 0.00 -1.62 0.00 0.00 43.42 41.88 2k6p n LEU 66 CO 0.33 -0.94 -0.84 1.17 -1.22 0.00 0.00 177.39 175.89 2k6p n LYS 67 N -2.46 1.62 -3.66 3.23 4.81 -1.26 -4.93 118.16 115.51 2k6p n LYS 67 Ca 0.11 0.02 -0.07 0.00 -0.87 0.00 0.00 58.31 57.51 2k6p n LYS 67 Cb 0.38 -1.24 -0.07 0.00 0.02 0.00 0.00 35.03 34.12 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 -4.54 -0.82 -0.10 3.14 2.47 -1.26 -4.78 114.94 109.05 2k6p s ASN 68 Ca -0.09 1.34 0.00 0.00 0.42 0.00 0.00 52.86 54.53 2k6p s ASN 68 Cb 0.03 1.45 -0.02 0.00 -1.45 0.00 0.00 41.25 41.26 2k6p s ASN 68 CO 0.34 -0.22 -0.10 -0.69 -3.72 0.00 0.00 177.10 172.71 2k6p s VAL 69 N 1.98 3.43 0.00 -5.21 1.01 -1.23 -5.03 120.40 115.35 2k6p s VAL 69 Ca -0.08 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.34 2k6p s VAL 69 Cb -0.08 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 33.88 2k6p s VAL 69 CO -0.17 0.56 0.00 -0.81 0.00 0.00 0.00 175.10 174.67 2k6p n PRO 70 N 2.85 -0.64 -1.14 2.72 -0.04 -1.26 -4.54 135.00 132.94 2k6p n PRO 70 Ca -0.18 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.03 2k6p n PRO 70 Cb 0.53 0.00 0.11 0.00 -0.04 0.00 0.00 33.50 34.10 2k6p n PRO 70 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2k6p n ARG 71 N -1.16 2.28 0.00 0.54 3.00 -1.26 -3.99 116.66 116.07 2k6p n ARG 71 Ca 0.00 -2.72 0.00 0.00 -0.00 0.00 0.00 57.85 55.13 2k6p n ARG 71 Cb 0.00 -2.07 0.00 0.00 0.00 0.00 0.00 32.46 30.39 2k6p n ARG 71 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2k6p n LYS 72 N -0.74 0.00 -1.06 -0.14 4.01 -1.26 -4.79 118.16 114.18 2k6p n LYS 72 Ca 0.53 0.00 -0.15 0.00 -0.51 0.00 0.00 58.31 58.18 2k6p n LYS 72 Cb 1.05 -0.59 0.21 0.00 -0.51 0.00 0.00 35.03 35.19 2k6p n LYS 72 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 2k6p n ASP 73 N -2.53 3.54 -1.97 4.39 8.00 -1.26 -4.48 116.55 122.25 2k6p n ASP 73 Ca 0.00 -3.59 -0.15 0.00 0.71 0.00 0.00 54.79 51.76 2k6p n ASP 73 Cb 0.34 -0.76 0.22 0.00 -0.02 0.00 0.00 41.12 40.91 2k6p n ASP 73 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 2k6p n THR 74 N -0.98 3.01 -1.14 -3.53 5.66 -1.26 -4.16 114.28 111.88 2k6p n THR 74 Ca 0.49 -1.97 0.01 0.00 -3.05 0.00 0.00 64.05 59.52 2k6p n THR 74 Cb 1.43 -0.41 0.01 0.00 -1.55 0.00 0.00 70.33 69.81 2k6p n THR 74 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 175.07 173.59 2k6p n HIS 75 N -0.85 0.00 0.02 1.09 -0.00 -1.26 -4.69 115.22 109.53 2k6p n HIS 75 Ca 0.50 -0.12 0.00 0.00 -0.00 0.00 0.00 57.72 58.10 2k6p n HIS 75 Cb 1.48 -0.03 -0.00 0.00 -0.00 0.00 0.00 29.99 31.44 2k6p n HIS 75 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 2k6p n LEU 76 N -0.14 0.29 -0.01 0.27 4.77 -1.26 -4.69 117.00 116.22 2k6p n LEU 76 Ca 0.01 -0.63 0.02 0.00 -0.03 0.00 0.00 56.01 55.37 2k6p n LEU 76 Cb 0.53 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.56 2k6p n LEU 76 CO 0.00 0.07 -0.64 -1.22 -1.33 0.00 0.00 177.39 174.27 2k6p n TYR 77 N -0.74 0.00 -3.71 -1.77 4.01 -1.26 -4.37 117.16 109.32 2k6p n TYR 77 Ca 0.00 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.61 2k6p n TYR 77 Cb 0.01 -0.24 -0.09 0.00 -0.31 0.00 0.00 39.34 38.71 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 -2.43 0.01 -0.04 -0.72 2.07 -1.26 0.95 121.20 119.77 2k6p s ILE 78 Ca -0.03 -0.04 -0.15 0.00 -1.41 0.00 0.00 60.65 59.02 2k6p s ILE 78 Cb 0.04 -0.65 0.03 0.00 0.13 0.00 0.00 42.46 42.01 2k6p s ILE 78 CO 0.32 -0.02 0.33 0.00 -1.91 0.00 0.00 174.94 173.65 2k6p s ALA 79 N 0.04 -0.84 -0.47 1.50 0.00 -0.95 -4.47 121.76 116.57 2k6p s ALA 79 Ca -0.02 0.51 -0.28 0.00 0.00 0.00 0.00 51.96 52.17 2k6p s ALA 79 Cb -0.03 -0.07 -0.00 0.00 0.00 0.00 0.00 23.12 23.01 2k6p s ALA 79 CO 0.01 -0.24 1.62 -1.25 0.00 0.00 0.00 175.76 175.90 2k6p s PRO 80 N -0.98 3.23 -0.52 0.00 0.04 -1.26 -0.73 135.00 134.77 2k6p s PRO 80 Ca -0.10 0.88 -0.27 0.00 0.04 0.00 0.00 61.00 61.54 2k6p s PRO 80 Cb -0.04 -4.18 -0.02 0.00 0.04 0.00 0.00 34.50 30.30 2k6p s PRO 80 CO 0.04 -2.00 1.82 0.21 0.04 0.00 0.00 177.00 177.10 2k6p s LYS 81 N 5.75 2.87 -0.04 4.56 2.36 -0.94 -4.94 119.74 129.36 2k6p s LYS 81 Ca 0.66 0.85 -0.04 0.00 -2.55 0.00 0.00 55.97 54.89 2k6p s LYS 81 Cb -0.15 -4.32 0.01 0.00 -1.05 0.00 0.00 37.83 32.32 2k6p s LYS 81 CO 0.28 -2.43 0.11 0.99 1.55 0.00 0.00 175.35 175.85 2k6p s THR 82 N 8.30 0.01 -0.06 3.43 2.01 -1.26 -4.78 115.64 123.29 2k6p s THR 82 Ca 0.70 -0.05 0.25 0.00 0.31 0.00 0.00 61.69 62.90 2k6p s THR 82 Cb -0.15 -0.17 0.44 0.00 0.01 0.00 0.00 72.50 72.63 2k6p s THR 82 CO 0.25 -0.03 1.16 0.29 -0.69 0.00 0.00 174.62 175.60 2k6p n LYS 83 N 2.92 0.40 0.00 4.92 5.02 -1.26 -5.27 118.16 124.89 2k6p n LYS 83 Ca -0.13 -2.33 0.08 0.00 -2.02 0.00 0.00 58.31 53.91 2k6p n LYS 83 Cb 0.59 -0.36 0.07 0.00 -0.02 0.00 0.00 35.03 35.31 2k6p n LYS 83 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03