#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 0.30 0.57 2.12 0.52 -1.26 -1.26 118.95 119.93 2k6p s ARG 2 Ca 0.00 -0.50 0.36 0.00 -0.52 0.00 0.00 55.73 55.07 2k6p s ARG 2 Cb 0.00 -0.02 1.46 0.00 0.52 0.00 0.00 34.95 36.91 2k6p s ARG 2 CO 0.00 -0.01 1.70 0.97 0.02 0.00 0.00 175.30 177.97 2k6p h ILE 3 N 4.73 0.26 0.39 1.52 -0.00 -1.90 0.90 117.51 123.41 2k6p h ILE 3 Ca -0.31 0.00 -0.02 0.00 -0.00 0.00 0.00 64.86 64.53 2k6p h ILE 3 Cb 1.21 0.31 0.00 0.00 -0.00 0.00 0.00 36.82 38.34 2k6p h ILE 3 CO 0.43 0.00 -0.19 0.44 -0.00 0.00 0.00 178.15 178.84 2k6p h ASP 4 N 0.00 -0.44 0.21 2.19 5.19 -1.89 -3.21 116.42 118.47 2k6p h ASP 4 Ca 0.55 -0.12 0.00 0.00 -0.62 0.00 0.00 57.03 56.83 2k6p h ASP 4 Cb 2.43 0.11 0.00 0.00 0.18 0.00 0.00 39.33 42.05 2k6p h ASP 4 CO -0.01 -0.09 -0.25 1.17 -3.12 0.00 0.00 179.24 176.94 2k6p n LYS 5 N -5.19 0.90 0.01 3.56 3.00 -0.02 -3.55 118.16 116.87 2k6p n LYS 5 Ca -0.10 -0.54 -0.01 0.00 -0.00 0.00 0.00 58.31 57.66 2k6p n LYS 5 Cb 0.28 -1.49 -0.01 0.00 0.00 0.00 0.00 35.03 33.82 2k6p n LYS 5 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.40 177.75 2k6p h PHE 6 N 1.32 -0.07 0.00 5.64 3.57 0.70 -3.00 116.94 125.10 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 0.52 0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.28 2k6p h PHE 6 CO 0.00 -0.04 -0.10 1.47 -2.23 0.00 0.00 178.31 177.41 2k6p n LEU 7 N -3.22 0.66 0.06 0.59 -0.00 -1.21 -2.77 117.00 111.10 2k6p n LEU 7 Ca -0.01 0.50 0.12 0.00 -0.00 0.00 0.00 56.01 56.62 2k6p n LEU 7 Cb 0.03 -0.33 0.12 0.00 -0.00 0.00 0.00 43.42 43.24 2k6p n LEU 7 CO 0.02 -0.13 0.23 1.56 -0.00 0.00 0.00 177.39 179.08 2k6p h GLN 8 N 0.00 0.00 0.04 1.47 4.20 -1.73 -2.50 115.11 116.60 2k6p h GLN 8 Ca 0.00 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.34 2k6p h GLN 8 Cb 0.69 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.43 2k6p h GLN 8 CO 0.00 0.00 -2.11 0.45 -0.67 0.00 0.00 178.83 176.50 2k6p n SER 9 N -2.12 2.01 0.24 1.46 2.88 -1.13 -4.21 113.62 112.74 2k6p n SER 9 Ca 0.03 0.17 0.18 0.00 -1.33 0.00 0.00 58.87 57.91 2k6p n SER 9 Cb 0.45 -0.74 0.87 0.00 -0.75 0.00 0.00 64.21 64.04 2k6p n SER 9 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 2k6p h VAL 10 N -0.33 0.31 0.00 2.46 -1.51 -1.69 -3.27 116.25 112.23 2k6p h VAL 10 Ca -0.51 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.96 2k6p h VAL 10 Cb 1.79 0.81 0.00 0.00 -2.13 0.00 0.00 31.29 31.76 2k6p h VAL 10 CO -0.11 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.84 2k6p n GLY 11 N -1.33 1.74 0.10 5.19 0.00 -1.26 -4.74 105.19 104.89 2k6p n GLY 11 Ca 0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.85 2k6p n GLY 11 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2k6p h LEU 12 N 0.00 0.31 -9.94 0.99 6.46 -1.73 -3.47 115.31 107.94 2k6p h LEU 12 Ca 0.00 -0.97 -0.53 0.00 -0.12 0.00 0.00 57.88 56.27 2k6p h LEU 12 Cb 0.00 -0.10 -0.04 0.00 -0.73 0.00 0.00 40.66 39.79 2k6p h LEU 12 CO 0.00 1.26 -0.51 0.68 -0.62 0.00 0.00 178.44 179.25 2k6p s VAL 13 N -2.36 4.79 -0.19 1.05 -7.23 -1.19 -5.04 120.40 110.24 2k6p s VAL 13 Ca -0.16 -1.07 0.20 0.00 -1.81 0.00 0.00 61.98 59.14 2k6p s VAL 13 Cb -0.00 -3.52 0.47 0.00 0.56 0.00 0.00 36.38 33.89 2k6p s VAL 13 CO 0.78 -0.21 1.16 2.29 -0.31 0.00 0.00 175.10 178.81 2k6p n LYS 14 N -0.80 1.56 -3.75 4.82 2.85 -1.26 -4.92 118.16 116.66 2k6p n LYS 14 Ca -0.08 -3.17 -0.30 0.00 -1.05 0.00 0.00 58.31 53.71 2k6p n LYS 14 Cb 0.56 -1.27 -0.14 0.00 -0.65 0.00 0.00 35.03 33.53 2k6p n LYS 14 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 2k6p s ARG 15 N -2.62 1.23 -0.22 -1.58 1.81 -1.26 -5.07 118.95 111.24 2k6p s ARG 15 Ca 0.35 -1.86 -0.01 0.00 -1.72 0.00 0.00 55.73 52.49 2k6p s ARG 15 Cb 0.36 -2.38 0.06 0.00 -0.45 0.00 0.00 34.95 32.55 2k6p s ARG 15 CO -0.07 -1.11 0.00 0.50 -0.68 0.00 0.00 175.30 173.94 2k6p s ARG 16 N 0.59 1.07 -0.04 3.54 3.00 -1.26 -4.86 118.95 120.98 2k6p s ARG 16 Ca 0.16 -0.69 -0.03 0.00 -1.00 0.00 0.00 55.73 54.17 2k6p s ARG 16 Cb -0.23 -2.32 -0.01 0.00 0.00 0.00 0.00 34.95 32.39 2k6p s ARG 16 CO -0.05 -0.64 -0.05 0.28 0.00 0.00 0.00 175.30 174.85 2k6p n VAL 17 N 4.88 0.40 0.01 7.11 0.31 -1.26 -5.01 118.33 124.77 2k6p n VAL 17 Ca -0.10 0.42 0.00 0.00 -0.01 0.00 0.00 64.34 64.65 2k6p n VAL 17 Cb 0.46 -1.75 0.00 0.00 -0.91 0.00 0.00 33.84 31.63 2k6p n VAL 17 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2k6p n LEU 18 N -2.93 0.06 0.00 7.52 0.00 -1.26 -5.07 117.00 115.32 2k6p n LEU 18 Ca -0.02 0.04 0.00 0.00 0.00 0.00 0.00 56.01 56.03 2k6p n LEU 18 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.50 2k6p n LEU 18 CO 0.03 -0.53 0.00 0.00 0.00 0.00 0.00 177.39 176.89 2k6p n ALA 19 N -2.61 1.03 -2.88 1.96 0.00 -1.26 -5.14 120.51 111.60 2k6p n ALA 19 Ca 0.00 -0.02 -0.11 0.00 0.00 0.00 0.00 53.44 53.30 2k6p n ALA 19 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 2k6p n ALA 19 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2k6p s THR 20 N -0.19 0.00 0.00 0.00 -1.32 -1.26 -5.05 115.64 107.82 2k6p s THR 20 Ca 0.00 -1.59 0.00 0.00 -1.21 0.00 0.00 61.69 58.89 2k6p s THR 20 Cb 0.00 -2.41 0.00 0.00 -1.51 0.00 0.00 72.50 68.58 2k6p s THR 20 CO 0.00 0.00 0.00 0.47 -2.21 0.00 0.00 174.62 172.88 2k6p n ASP 21 N -0.69 0.00 -0.34 8.08 8.00 -1.26 -4.91 116.55 125.43 2k6p n ASP 21 Ca -0.00 0.00 0.22 0.00 0.71 0.00 0.00 54.79 55.72 2k6p n ASP 21 Cb 0.63 0.09 0.46 0.00 -0.02 0.00 0.00 41.12 42.27 2k6p n ASP 21 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 2k6p h MET 22 N 0.00 0.43 0.00 -1.24 2.86 -1.92 0.88 114.93 115.94 2k6p h MET 22 Ca 0.00 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.59 2k6p h MET 22 Cb 0.00 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 31.56 2k6p h MET 22 CO 0.00 0.28 -0.12 0.00 1.06 0.00 0.00 176.91 178.14 2k6p h ASN 24 N 0.00 0.00 -0.31 0.00 -1.24 0.36 -3.36 115.58 111.03 2k6p h ASN 24 Ca -0.00 -0.39 0.07 0.00 0.71 0.00 0.00 56.30 56.69 2k6p h ASN 24 Cb 0.28 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.31 2k6p h ASN 24 CO 0.02 1.09 0.22 -0.37 -1.29 0.00 0.00 177.43 177.09 2k6p h VAL 25 N -1.00 0.89 0.00 2.57 -1.51 -1.11 -3.45 116.25 112.64 2k6p h VAL 25 Ca -0.16 -0.03 0.00 0.00 -1.23 0.00 0.00 66.70 65.29 2k6p h VAL 25 Cb 0.89 0.80 0.00 0.00 -2.13 0.00 0.00 31.29 30.85 2k6p h VAL 25 CO -0.09 0.01 0.00 0.61 -1.23 0.00 0.00 177.57 176.87 2k6p n GLY 26 N -1.58 1.86 2.11 5.19 0.00 -0.28 -5.02 105.19 107.47 2k6p n GLY 26 Ca 0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.63 5.29 -3.74 4.61 0.00 0.22 -3.53 120.51 122.74 2k6p n ALA 27 Ca 0.00 -2.61 -0.28 0.00 0.00 0.00 0.00 53.44 50.55 2k6p n ALA 27 Cb 0.00 -1.40 -0.16 0.00 0.00 0.00 0.00 19.45 17.89 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 -2.98 0.63 -0.29 0.00 1.01 -1.24 -4.62 120.40 112.91 2k6p s VAL 28 Ca 0.51 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.71 2k6p s VAL 28 Cb 0.43 -1.20 0.13 0.00 0.00 0.00 0.00 36.38 35.74 2k6p s VAL 28 CO 0.10 -0.31 0.25 0.26 0.00 0.00 0.00 175.10 175.39 2k6p s TRP 29 N 1.79 -0.22 -0.40 5.22 0.52 -1.25 -1.72 118.94 122.88 2k6p s TRP 29 Ca 0.01 -0.40 -0.25 0.00 0.02 0.00 0.00 56.10 55.48 2k6p s TRP 29 Cb -0.17 -0.60 0.02 0.00 -1.15 0.00 0.00 33.47 31.57 2k6p s TRP 29 CO -0.12 -0.90 0.88 -1.17 0.02 0.00 0.00 176.95 175.67 2k6p s LEU 30 N 2.27 4.04 -1.47 2.99 0.20 -0.62 -1.94 118.68 124.15 2k6p s LEU 30 Ca 0.09 0.34 -0.06 0.00 0.69 0.00 0.00 54.13 55.19 2k6p s LEU 30 Cb -0.15 -3.17 0.03 0.00 -0.43 0.00 0.00 46.19 42.47 2k6p s LEU 30 CO -0.34 -0.89 0.60 0.59 -0.29 0.00 0.00 176.35 176.02 2k6p n ASN 31 N 6.81 -5.43 -1.62 3.68 3.02 -1.15 -2.95 115.26 117.63 2k6p n ASN 31 Ca 0.06 -0.33 -0.02 0.00 -0.03 0.00 0.00 54.58 54.26 2k6p n ASN 31 Cb 0.48 -4.40 0.01 0.00 -0.61 0.00 0.00 39.78 35.26 2k6p n ASN 31 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k6p n GLY 32 N -1.44 0.53 3.40 7.41 0.00 -1.25 -5.08 105.19 108.76 2k6p n GLY 32 Ca -0.08 -0.23 0.02 0.00 0.00 0.00 0.00 46.02 45.73 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 -3.10 -0.91 -0.31 1.61 0.15 -1.15 -5.11 113.70 104.88 2k6p s SER 33 Ca 0.04 0.99 -0.32 0.00 0.70 0.00 0.00 55.95 57.37 2k6p s SER 33 Cb -0.01 1.93 -0.09 0.00 -1.71 0.00 0.00 66.02 66.15 2k6p s SER 33 CO 0.10 -0.17 2.22 0.00 1.20 0.00 0.00 173.24 176.59 2k6p s ALA 35 N 7.96 2.87 1.00 0.00 0.00 -0.70 -4.96 121.76 127.94 2k6p s ALA 35 Ca 1.06 -0.99 0.00 0.00 0.00 0.00 0.00 51.96 52.03 2k6p s ALA 35 Cb -0.61 -1.08 0.00 0.00 0.00 0.00 0.00 23.12 21.43 2k6p s ALA 35 CO 0.42 0.58 0.00 1.17 0.00 0.00 0.00 175.76 177.93 2k6p n LYS 36 N 1.95 0.50 -0.85 0.00 4.81 -1.26 -4.67 118.16 118.63 2k6p n LYS 36 Ca -0.17 0.00 -0.14 0.00 -0.87 0.00 0.00 58.31 57.13 2k6p n LYS 36 Cb 0.52 0.00 0.15 0.00 0.02 0.00 0.00 35.03 35.73 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 4.57 -2.24 3.14 0.00 -1.26 -3.91 120.51 117.81 2k6p n ALA 37 Ca 0.00 -1.99 0.02 0.00 0.00 0.00 0.00 53.44 51.47 2k6p n ALA 37 Cb 0.00 -1.29 0.01 0.00 0.00 0.00 0.00 19.45 18.17 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 -0.52 0.45 -4.81 0.00 7.64 -1.26 -4.86 113.62 110.26 2k6p n SER 38 Ca 0.40 -1.97 -0.37 0.00 1.01 0.00 0.00 58.87 57.94 2k6p n SER 38 Cb 1.29 -0.23 -0.06 0.00 -1.01 0.00 0.00 64.21 64.20 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 0.00 3.92 0.20 1.43 -0.14 -1.25 -5.08 119.74 118.81 2k6p s LYS 39 Ca 0.16 0.19 -0.19 0.00 -1.36 0.00 0.00 55.97 54.77 2k6p s LYS 39 Cb 0.19 -3.28 -0.08 0.00 -1.68 0.00 0.00 37.83 32.97 2k6p s LYS 39 CO -0.08 0.56 0.69 -2.00 -0.76 0.00 0.00 175.35 173.76 2k6p s GLU 40 N -0.53 4.23 0.14 1.68 2.12 -1.26 -3.53 118.70 121.55 2k6p s GLU 40 Ca 0.19 0.83 0.10 0.00 0.36 0.00 0.00 54.97 56.45 2k6p s GLU 40 Cb -0.14 -2.94 -0.04 0.00 0.26 0.00 0.00 34.13 31.27 2k6p s GLU 40 CO 0.08 0.44 -0.22 0.14 -0.54 0.00 0.00 175.26 175.16 2k6p s VAL 41 N -1.46 2.58 0.52 3.70 -7.23 -0.39 -4.89 120.40 113.22 2k6p s VAL 41 Ca 0.41 -1.70 0.02 0.00 -1.81 0.00 0.00 61.98 58.89 2k6p s VAL 41 Cb -0.17 -2.19 -0.00 0.00 0.56 0.00 0.00 36.38 34.58 2k6p s VAL 41 CO 0.21 0.04 0.08 -0.75 -0.31 0.00 0.00 175.10 174.37 2k6p s LYS 42 N -2.27 2.21 0.59 4.82 2.20 -1.26 -4.03 119.74 122.00 2k6p s LYS 42 Ca 0.18 -2.32 -0.10 0.00 -0.36 0.00 0.00 55.97 53.37 2k6p s LYS 42 Cb -0.10 -1.65 -0.04 0.00 -1.51 0.00 0.00 37.83 34.53 2k6p s LYS 42 CO 0.09 -0.41 0.98 0.00 -0.36 0.00 0.00 175.35 175.65 2k6p s ALA 43 N -2.85 3.16 -1.82 3.13 0.00 -1.26 -3.89 121.76 118.23 2k6p s ALA 43 Ca 0.12 -0.18 0.00 0.00 0.00 0.00 0.00 51.96 51.90 2k6p s ALA 43 Cb 0.01 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 20.16 2k6p s ALA 43 CO 0.07 -0.62 0.00 0.41 0.00 0.00 0.00 175.76 175.62 2k6p n GLY 44 N -2.65 0.30 3.94 0.00 0.00 0.21 -4.93 105.19 102.07 2k6p n GLY 44 Ca 0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.25 4.97 -0.08 1.61 2.15 -1.06 -4.85 116.67 117.14 2k6p s ASP 45 Ca 0.00 -0.92 0.00 0.00 0.43 0.00 0.00 52.55 52.06 2k6p s ASP 45 Cb 0.00 0.00 -0.03 0.00 -0.30 0.00 0.00 42.92 42.59 2k6p s ASP 45 CO 0.00 -1.01 -0.06 -0.89 -0.17 0.00 0.00 175.17 173.04 2k6p s THR 46 N -2.62 3.73 -0.37 1.71 2.01 -1.26 0.98 115.64 119.82 2k6p s THR 46 Ca 0.48 -0.46 -0.01 0.00 0.31 0.00 0.00 61.69 62.01 2k6p s THR 46 Cb -0.04 -2.54 0.10 0.00 0.01 0.00 0.00 72.50 70.02 2k6p s THR 46 CO 0.29 0.58 0.12 -0.63 -0.69 0.00 0.00 174.62 174.29 2k6p s ILE 47 N -0.59 2.93 0.56 1.82 -1.09 0.94 -2.91 121.20 122.86 2k6p s ILE 47 Ca 0.09 -2.02 -0.12 0.00 -2.23 0.00 0.00 60.65 56.37 2k6p s ILE 47 Cb -0.12 -2.99 -0.05 0.00 -1.58 0.00 0.00 42.46 37.72 2k6p s ILE 47 CO 0.02 -0.56 0.97 -0.55 -1.23 0.00 0.00 174.94 173.59 2k6p s SER 48 N 1.46 6.36 -0.23 3.58 0.15 -0.82 0.12 113.70 124.32 2k6p s SER 48 Ca 0.06 1.38 -0.03 0.00 0.70 0.00 0.00 55.95 58.07 2k6p s SER 48 Cb -0.21 -2.44 0.12 0.00 -1.71 0.00 0.00 66.02 61.78 2k6p s SER 48 CO -0.05 -0.72 0.34 -0.76 1.20 0.00 0.00 173.24 173.25 2k6p s LEU 49 N -4.72 -0.52 -0.30 3.45 1.02 -1.26 -3.76 118.68 112.59 2k6p s LEU 49 Ca 0.55 0.13 -0.26 0.00 0.02 0.00 0.00 54.13 54.57 2k6p s LEU 49 Cb -0.11 0.96 0.01 0.00 0.02 0.00 0.00 46.19 47.07 2k6p s LEU 49 CO 0.45 -0.31 0.93 -2.28 0.02 0.00 0.00 176.35 175.17 2k6p s HIS 50 N 2.50 3.21 0.25 0.29 2.46 -1.23 -3.70 115.29 119.07 2k6p s HIS 50 Ca 0.11 1.07 0.08 0.00 0.47 0.00 0.00 55.06 56.80 2k6p s HIS 50 Cb -0.15 -3.39 -0.05 0.00 -0.13 0.00 0.00 32.58 28.86 2k6p s HIS 50 CO -0.15 -0.61 -0.12 0.71 -2.47 0.00 0.00 174.74 172.09 2k6p s TYR 51 N 3.24 1.92 0.35 3.88 1.51 0.23 -4.38 117.35 124.11 2k6p s TYR 51 Ca 0.39 -0.57 0.10 0.00 -1.01 0.00 0.00 57.07 55.99 2k6p s TYR 51 Cb -0.14 -0.96 0.64 0.00 -0.11 0.00 0.00 41.96 41.39 2k6p s TYR 51 CO 0.12 0.41 1.80 1.37 -1.11 0.00 0.00 175.55 178.14 2k6p h LEU 52 N 2.39 0.11 0.00 -1.29 -0.00 -2.01 -2.85 115.31 111.65 2k6p h LEU 52 Ca -0.39 -0.04 -0.22 0.00 -0.00 0.00 0.00 57.88 57.23 2k6p h LEU 52 Cb 1.23 -0.03 -0.03 0.00 -0.00 0.00 0.00 40.66 41.83 2k6p h LEU 52 CO 0.64 0.46 -1.17 0.07 -0.00 0.00 0.00 178.44 178.44 2k6p h LYS 53 N 0.09 0.00 0.00 0.17 5.09 -2.00 -3.50 116.57 116.42 2k6p h LYS 53 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.75 2k6p h LYS 53 Cb 0.67 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.00 2k6p h LYS 53 CO 0.05 0.76 0.00 0.41 -2.09 0.00 0.00 179.45 178.58 2k6p n GLY 54 N 1.40 -0.60 2.99 0.07 0.00 -1.08 -5.15 105.19 102.82 2k6p n GLY 54 Ca -0.05 -0.42 -0.11 0.00 0.00 0.00 0.00 46.02 45.43 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 -4.00 0.26 -0.20 -0.61 1.09 -1.26 -0.60 121.20 115.88 2k6p s ILE 55 Ca 0.00 -0.74 -0.13 0.00 -1.10 0.00 0.00 60.65 58.68 2k6p s ILE 55 Cb 0.00 -0.34 -0.08 0.00 -1.06 0.00 0.00 42.46 40.98 2k6p s ILE 55 CO 0.00 -0.32 -0.30 -0.62 -0.10 0.00 0.00 174.94 173.60 2k6p n GLU 56 N 1.94 0.48 -2.45 2.79 4.71 -1.24 -5.03 120.64 121.83 2k6p n GLU 56 Ca -0.21 0.20 -0.03 0.00 -0.01 0.00 0.00 57.16 57.12 2k6p n GLU 56 Cb 0.56 -1.31 -0.02 0.00 -1.01 0.00 0.00 31.44 29.66 2k6p n GLU 56 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2k6p n GLU 57 N -4.14 -3.47 -2.71 3.49 1.02 -1.25 -3.88 120.64 109.70 2k6p n GLU 57 Ca -0.34 2.75 -0.22 0.00 -0.02 0.00 0.00 57.16 59.33 2k6p n GLU 57 Cb 0.68 -4.51 0.10 0.00 -0.02 0.00 0.00 31.44 27.70 2k6p n GLU 57 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2k6p n TYR 58 N 1.07 -2.72 -3.74 -0.32 4.02 0.33 0.70 117.16 116.50 2k6p n TYR 58 Ca -0.21 -1.89 -0.17 0.00 -0.01 0.00 0.00 57.90 55.63 2k6p n TYR 58 Cb 0.32 -0.67 -0.17 0.00 -0.02 0.00 0.00 39.34 38.80 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 -0.08 -0.05 -0.72 2.01 0.52 -0.04 115.64 114.33 2k6p s THR 59 Ca 0.65 0.29 -0.29 0.00 0.31 0.00 0.00 61.69 62.65 2k6p s THR 59 Cb -0.04 -0.11 -0.02 0.00 0.01 0.00 0.00 72.50 72.34 2k6p s THR 59 CO 0.42 0.12 0.94 -0.63 -0.69 0.00 0.00 174.62 174.79 2k6p s ILE 60 N 1.45 4.87 -0.11 1.82 1.01 0.28 -2.42 121.20 128.10 2k6p s ILE 60 Ca -0.04 1.95 0.21 0.00 0.00 0.00 0.00 60.65 62.76 2k6p s ILE 60 Cb -0.13 -4.27 -0.23 0.00 0.01 0.00 0.00 42.46 37.84 2k6p s ILE 60 CO -0.03 0.12 0.56 0.18 0.00 0.00 0.00 174.94 175.77 2k6p n LEU 61 N 4.29 0.28 -3.61 2.97 4.77 -0.41 0.68 117.00 125.97 2k6p n LEU 61 Ca 0.06 0.12 0.01 0.00 -0.03 0.00 0.00 56.01 56.16 2k6p n LEU 61 Cb 0.50 0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.67 2k6p n LEU 61 CO 0.51 0.08 1.09 -1.58 -1.33 0.00 0.00 177.39 176.15 2k6p s GLN 62 N -3.22 0.30 -0.48 3.23 0.74 -1.25 -4.20 119.66 114.78 2k6p s GLN 62 Ca -0.06 -0.16 0.03 0.00 0.05 0.00 0.00 55.36 55.22 2k6p s GLN 62 Cb 0.11 0.11 0.13 0.00 1.10 0.00 0.00 33.01 34.46 2k6p s GLN 62 CO 0.86 -0.14 0.25 0.42 -0.55 0.00 0.00 175.29 176.13 2k6p s ILE 63 N -2.34 2.04 -0.46 -2.34 -1.09 -1.26 -4.82 121.20 110.93 2k6p s ILE 63 Ca 0.13 -2.95 0.21 0.00 -2.23 0.00 0.00 60.65 55.81 2k6p s ILE 63 Cb 0.04 -2.42 0.22 0.00 -1.58 0.00 0.00 42.46 38.72 2k6p s ILE 63 CO -0.04 -0.84 1.64 -0.81 -1.23 0.00 0.00 174.94 173.66 2k6p n PRO 64 N 3.33 0.15 -3.15 2.79 -0.04 -1.26 -4.87 135.00 131.95 2k6p n PRO 64 Ca 0.06 0.48 -0.22 0.00 -0.04 0.00 0.00 63.50 63.78 2k6p n PRO 64 Cb 0.33 -1.85 0.05 0.00 -0.04 0.00 0.00 33.50 31.99 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 -1.74 -1.02 -2.61 0.55 0.00 -1.26 -5.00 120.51 109.43 2k6p n ALA 65 Ca 0.01 0.31 -0.23 0.00 0.00 0.00 0.00 53.44 53.54 2k6p n ALA 65 Cb 0.16 -4.21 0.12 0.00 0.00 0.00 0.00 19.45 15.51 2k6p n ALA 65 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2k6p n LEU 66 N -4.13 0.00 -0.03 0.00 -0.00 -1.26 -5.04 117.00 106.53 2k6p n LEU 66 Ca -0.07 -2.06 -0.02 0.00 -0.00 0.00 0.00 56.01 53.86 2k6p n LEU 66 Cb 0.60 -0.63 -0.07 0.00 -0.00 0.00 0.00 43.42 43.31 2k6p n LEU 66 CO 0.50 -0.98 -0.74 0.29 -0.00 0.00 0.00 177.39 176.46 2k6p n LYS 67 N -2.81 1.84 -3.69 1.47 5.02 -1.26 -5.01 118.16 113.72 2k6p n LYS 67 Ca 0.16 -0.03 -0.10 0.00 -2.02 0.00 0.00 58.31 56.32 2k6p n LYS 67 Cb 0.58 -1.23 -0.10 0.00 -0.02 0.00 0.00 35.03 34.25 2k6p n LYS 67 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2k6p s ASN 68 N -3.82 -0.54 -0.64 4.39 3.84 -1.26 -4.82 114.94 112.08 2k6p s ASN 68 Ca -0.04 0.93 -0.16 0.00 0.21 0.00 0.00 52.86 53.81 2k6p s ASN 68 Cb 0.04 0.83 0.16 0.00 -0.55 0.00 0.00 41.25 41.72 2k6p s ASN 68 CO 0.38 -0.19 0.61 -0.69 -2.79 0.00 0.00 177.10 174.42 2k6p s VAL 69 N 1.30 5.32 0.51 -5.21 1.01 -1.23 -5.02 120.40 117.07 2k6p s VAL 69 Ca -0.09 -1.79 -0.09 0.00 0.00 0.00 0.00 61.98 60.02 2k6p s VAL 69 Cb -0.08 -4.40 0.13 0.00 0.00 0.00 0.00 36.38 32.04 2k6p s VAL 69 CO -0.12 -0.94 0.40 -0.81 0.00 0.00 0.00 175.10 173.62 2k6p n PRO 70 N 4.91 -2.27 -1.27 2.72 -0.04 -1.26 -4.81 135.00 132.98 2k6p n PRO 70 Ca -0.04 -0.64 -0.37 0.00 -0.04 0.00 0.00 63.50 62.41 2k6p n PRO 70 Cb 0.42 -0.67 -0.02 0.00 -0.04 0.00 0.00 33.50 33.19 2k6p n PRO 70 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2k6p n ARG 71 N -3.03 3.17 0.00 0.54 5.12 -1.26 -3.91 116.66 117.29 2k6p n ARG 71 Ca 0.06 -2.11 0.00 0.00 -1.93 0.00 0.00 57.85 53.86 2k6p n ARG 71 Cb 0.23 -2.82 0.00 0.00 -1.16 0.00 0.00 32.46 28.71 2k6p n ARG 71 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2k6p n LYS 72 N 4.26 0.00 0.00 5.56 5.02 -1.26 -5.07 118.16 126.67 2k6p n LYS 72 Ca 0.67 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.96 2k6p n LYS 72 Cb 0.25 -0.61 0.00 0.00 -0.02 0.00 0.00 35.03 34.64 2k6p n LYS 72 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2k6p n ASP 73 N -2.59 0.00 -2.51 4.39 9.92 -1.25 -4.99 116.55 119.52 2k6p n ASP 73 Ca 0.00 0.00 -0.04 0.00 -0.53 0.00 0.00 54.79 54.22 2k6p n ASP 73 Cb 0.38 0.00 -0.00 0.00 -0.64 0.00 0.00 41.12 40.86 2k6p n ASP 73 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 2k6p n THR 74 N -0.66 -0.18 0.00 -3.53 5.66 -1.26 -4.58 114.28 109.73 2k6p n THR 74 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2k6p n THR 74 Cb 0.00 -0.54 0.00 0.00 -1.55 0.00 0.00 70.33 68.24 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 -2.79 0.00 -0.84 1.09 -0.00 -1.26 -4.80 115.22 106.62 2k6p n HIS 75 Ca -0.04 0.00 0.07 0.00 -0.00 0.00 0.00 57.72 57.75 2k6p n HIS 75 Cb 0.53 0.00 0.40 0.00 -0.00 0.00 0.00 29.99 30.92 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 -0.84 5.59 -0.01 0.27 4.77 -1.26 -4.18 117.00 121.34 2k6p n LEU 76 Ca 0.00 -2.84 -0.01 0.00 -0.03 0.00 0.00 56.01 53.14 2k6p n LEU 76 Cb 0.10 -0.67 -0.01 0.00 -2.33 0.00 0.00 43.42 40.51 2k6p n LEU 76 CO 0.00 0.64 -0.54 -1.22 -1.33 0.00 0.00 177.39 174.94 2k6p n TYR 77 N 0.67 0.00 -3.64 -1.77 4.01 -1.26 -4.26 117.16 110.91 2k6p n TYR 77 Ca 0.27 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.93 2k6p n TYR 77 Cb 1.16 -0.06 -0.07 0.00 -0.31 0.00 0.00 39.34 40.06 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 -2.03 0.00 0.00 -0.72 2.07 -1.26 -1.29 121.20 117.97 2k6p s ILE 78 Ca -0.01 0.00 -0.08 0.00 -1.41 0.00 0.00 60.65 59.16 2k6p s ILE 78 Cb 0.00 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.60 2k6p s ILE 78 CO 0.05 0.00 0.15 0.00 -1.91 0.00 0.00 174.94 173.22 2k6p s ALA 79 N 0.64 -0.35 -0.08 1.50 0.00 -1.01 -4.62 121.76 117.84 2k6p s ALA 79 Ca -0.01 -0.10 -0.30 0.00 0.00 0.00 0.00 51.96 51.55 2k6p s ALA 79 Cb -0.05 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.14 2k6p s ALA 79 CO -0.08 -0.21 1.36 -1.25 0.00 0.00 0.00 175.76 175.58 2k6p s PRO 80 N -1.36 4.26 -0.21 0.00 0.04 -1.26 -0.36 135.00 136.12 2k6p s PRO 80 Ca -0.14 1.84 -0.18 0.00 0.04 0.00 0.00 61.00 62.56 2k6p s PRO 80 Cb -0.07 -3.71 -0.03 0.00 0.04 0.00 0.00 34.50 30.73 2k6p s PRO 80 CO 0.02 -0.64 0.50 0.21 0.04 0.00 0.00 177.00 177.13 2k6p s LYS 81 N 3.03 4.18 -0.15 4.56 2.47 0.22 -4.92 119.74 129.12 2k6p s LYS 81 Ca 0.61 0.38 -0.02 0.00 -1.56 0.00 0.00 55.97 55.38 2k6p s LYS 81 Cb -0.27 -3.57 0.05 0.00 -1.46 0.00 0.00 37.83 32.58 2k6p s LYS 81 CO 0.22 -0.16 0.02 0.95 0.16 0.00 0.00 175.35 176.54 2k6p s THR 82 N 1.66 0.53 -0.19 3.43 -4.23 -1.26 -4.47 115.64 111.11 2k6p s THR 82 Ca 0.23 -0.33 -0.10 0.00 -1.18 0.00 0.00 61.69 60.31 2k6p s THR 82 Cb -0.15 -0.89 0.07 0.00 1.34 0.00 0.00 72.50 72.87 2k6p s THR 82 CO 0.09 -0.02 0.45 -0.54 -0.54 0.00 0.00 174.62 174.06 2k6p s LYS 83 N 1.88 0.42 0.00 3.99 -0.14 -1.26 -5.24 119.74 119.38 2k6p s LYS 83 Ca 0.01 0.90 0.00 0.00 -1.36 0.00 0.00 55.97 55.52 2k6p s LYS 83 Cb -0.15 0.08 0.00 0.00 -1.68 0.00 0.00 37.83 36.08 2k6p s LYS 83 CO -0.07 -0.18 0.00 -1.91 -0.76 0.00 0.00 175.35 172.43