#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 3.15 0.60 2.12 3.03 -1.26 0.73 118.95 127.32 2k6p s ARG 2 Ca 0.00 -0.74 0.28 0.00 2.03 0.00 0.00 55.73 57.31 2k6p s ARG 2 Cb 0.00 -2.80 1.38 0.00 -1.03 0.00 0.00 34.95 32.50 2k6p s ARG 2 CO 0.00 0.50 1.79 0.97 -1.13 0.00 0.00 175.30 177.43 2k6p h ILE 3 N 1.87 0.26 0.71 4.99 -0.00 -1.83 1.07 117.51 124.58 2k6p h ILE 3 Ca -0.48 0.00 -0.03 0.00 -0.00 0.00 0.00 64.86 64.35 2k6p h ILE 3 Cb 1.20 0.51 0.01 0.00 -0.00 0.00 0.00 36.82 38.53 2k6p h ILE 3 CO 0.66 0.00 -0.34 -0.78 -0.00 0.00 0.00 178.15 177.69 2k6p h ASP 4 N 0.00 -0.81 0.21 2.19 3.58 -1.81 -3.24 116.42 116.53 2k6p h ASP 4 Ca 0.24 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.72 2k6p h ASP 4 Cb 1.44 0.21 0.00 0.00 1.72 0.00 0.00 39.33 42.70 2k6p h ASP 4 CO -0.00 -0.46 -0.23 0.29 -2.88 0.00 0.00 179.24 175.96 2k6p n LYS 5 N -5.25 0.93 0.09 0.28 5.02 -0.66 -3.46 118.16 115.12 2k6p n LYS 5 Ca -0.12 -0.55 -0.04 0.00 -2.02 0.00 0.00 58.31 55.58 2k6p n LYS 5 Cb 0.38 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.88 2k6p n LYS 5 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 2k6p h PHE 6 N 1.34 -0.26 0.00 2.13 3.57 0.11 -2.81 116.94 121.02 2k6p h PHE 6 Ca 0.00 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 2k6p h PHE 6 Cb 0.51 0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.33 2k6p h PHE 6 CO 0.00 -0.16 -0.41 1.47 -2.23 0.00 0.00 178.31 176.98 2k6p n LEU 7 N -3.68 0.58 0.09 0.59 -0.00 -1.22 -3.21 117.00 110.15 2k6p n LEU 7 Ca -0.03 0.27 0.12 0.00 -0.00 0.00 0.00 56.01 56.36 2k6p n LEU 7 Cb 0.11 -0.26 0.03 0.00 -0.00 0.00 0.00 43.42 43.29 2k6p n LEU 7 CO 0.08 -0.03 0.06 0.00 -0.00 0.00 0.00 177.39 177.51 2k6p n GLN 8 N -1.91 0.53 0.00 1.47 6.02 -1.23 -3.28 117.38 118.98 2k6p n GLN 8 Ca 0.05 0.10 0.09 0.00 -0.01 0.00 0.00 57.00 57.23 2k6p n GLN 8 Cb 0.40 -1.78 -0.04 0.00 1.02 0.00 0.00 30.24 29.84 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 -2.52 1.52 -1.14 1.08 7.64 -1.06 -4.30 113.62 114.83 2k6p n SER 9 Ca 0.01 -1.26 0.06 0.00 1.01 0.00 0.00 58.87 58.68 2k6p n SER 9 Cb 0.52 0.64 0.23 0.00 -1.01 0.00 0.00 64.21 64.60 2k6p n SER 9 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2k6p n VAL 10 N -0.51 1.24 -1.21 0.44 0.24 -1.20 -1.66 118.33 115.68 2k6p n VAL 10 Ca 0.06 -0.75 -0.07 0.00 -2.04 0.00 0.00 64.34 61.54 2k6p n VAL 10 Cb 0.36 -0.09 -0.03 0.00 -1.47 0.00 0.00 33.84 32.62 2k6p n VAL 10 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k6p n GLY 11 N 0.74 0.93 0.07 7.63 0.00 -1.26 -4.72 105.19 108.58 2k6p n GLY 11 Ca 0.16 -0.63 -0.10 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.02-10.06 0.99 6.46 -1.82 -3.46 115.31 107.40 2k6p h LEU 12 Ca -0.15 -0.66 -0.52 0.00 -0.12 0.00 0.00 57.88 56.43 2k6p h LEU 12 Cb 0.50 0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 40.42 2k6p h LEU 12 CO 0.22 0.79 -0.12 0.68 -0.62 0.00 0.00 178.44 179.39 2k6p s VAL 13 N -2.25 4.98 0.04 1.05 -7.23 -1.23 -5.07 120.40 110.69 2k6p s VAL 13 Ca -0.13 0.24 -0.21 0.00 -1.81 0.00 0.00 61.98 60.07 2k6p s VAL 13 Cb -0.02 -3.69 0.05 0.00 0.56 0.00 0.00 36.38 33.28 2k6p s VAL 13 CO 0.49 -0.25 0.48 -1.59 -0.31 0.00 0.00 175.10 173.92 2k6p s LYS 14 N -3.31 0.97 0.50 4.82 0.00 -1.26 -4.99 119.74 116.47 2k6p s LYS 14 Ca 0.46 -0.25 0.00 0.00 0.00 0.00 0.00 55.97 56.17 2k6p s LYS 14 Cb -0.11 0.44 0.00 0.00 0.00 0.00 0.00 37.83 38.16 2k6p s LYS 14 CO 0.27 -0.34 0.00 -2.13 0.00 0.00 0.00 175.35 173.15 2k6p n ARG 15 N 0.52 -4.11 -2.94 1.78 0.63 -1.26 -4.92 116.66 106.35 2k6p n ARG 15 Ca -0.19 3.09 -0.06 0.00 -0.92 0.00 0.00 57.85 59.77 2k6p n ARG 15 Cb 0.60 -3.56 0.01 0.00 0.45 0.00 0.00 32.46 29.96 2k6p n ARG 15 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2k6p n ARG 16 N -1.25 -2.02 -3.96 -0.14 1.74 -1.26 -5.01 116.66 104.76 2k6p n ARG 16 Ca 0.00 1.90 -0.34 0.00 -0.77 0.00 0.00 57.85 58.63 2k6p n ARG 16 Cb 0.09 -5.60 -0.14 0.00 -1.02 0.00 0.00 32.46 25.79 2k6p n ARG 16 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2k6p s VAL 17 N -2.72 2.87 -0.40 1.55 1.01 -1.26 -5.03 120.40 116.43 2k6p s VAL 17 Ca 0.17 -0.99 0.06 0.00 0.00 0.00 0.00 61.98 61.22 2k6p s VAL 17 Cb -0.05 -2.44 0.21 0.00 0.00 0.00 0.00 36.38 34.11 2k6p s VAL 17 CO 0.77 0.23 0.43 -0.11 0.00 0.00 0.00 175.10 176.42 2k6p n LEU 18 N 4.67 -0.19 0.00 3.92 0.00 -1.26 -5.03 117.00 119.11 2k6p n LEU 18 Ca -0.17 -4.52 0.00 0.00 0.00 0.00 0.00 56.01 51.32 2k6p n LEU 18 Cb 0.47 0.60 0.00 0.00 0.00 0.00 0.00 43.42 44.49 2k6p n LEU 18 CO 0.27 1.96 0.00 0.00 0.00 0.00 0.00 177.39 179.62 2k6p n ALA 19 N 2.13 0.00 -3.58 1.96 0.00 -1.26 -4.35 120.51 115.41 2k6p n ALA 19 Ca 0.25 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.68 2k6p n ALA 19 Cb 0.51 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.91 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 0.00 -0.65 -0.08 0.00 -1.32 -1.26 -5.03 115.64 107.29 2k6p s THR 20 Ca 0.00 0.00 0.08 0.00 -1.21 0.00 0.00 61.69 60.56 2k6p s THR 20 Cb 0.00 -1.00 -0.11 0.00 -1.51 0.00 0.00 72.50 69.88 2k6p s THR 20 CO 0.00 0.00 0.04 0.47 -2.21 0.00 0.00 174.62 172.92 2k6p n ASP 21 N 5.03 2.78 -0.27 8.08 9.92 -1.26 -4.60 116.55 136.24 2k6p n ASP 21 Ca -0.13 0.00 0.02 0.00 -0.53 0.00 0.00 54.79 54.15 2k6p n ASP 21 Cb 0.52 0.76 0.15 0.00 -0.64 0.00 0.00 41.12 41.91 2k6p n ASP 21 CO 0.00 0.00 0.00 0.24 0.13 0.00 0.00 177.20 177.57 2k6p h MET 22 N 0.00 0.68 0.00 -1.24 2.86 -1.97 0.31 114.93 115.57 2k6p h MET 22 Ca -0.23 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.36 2k6p h MET 22 Cb 1.49 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 33.00 2k6p h MET 22 CO 0.01 0.45 -0.02 0.00 1.06 0.00 0.00 176.91 178.41 2k6p n ASN 24 N -3.23 2.00 0.12 0.00 5.03 0.35 -4.29 115.26 115.23 2k6p n ASN 24 Ca -0.02 0.27 -0.02 0.00 0.87 0.00 0.00 54.58 55.68 2k6p n ASN 24 Cb 0.18 -0.86 0.20 0.00 -1.02 0.00 0.00 39.78 38.28 2k6p n ASN 24 CO 0.00 0.00 0.00 -0.37 -1.83 0.00 0.00 177.26 175.06 2k6p h VAL 25 N -0.44 1.37 0.00 2.41 -1.51 -0.36 -3.48 116.25 114.24 2k6p h VAL 25 Ca -0.44 -1.82 0.00 0.00 -1.23 0.00 0.00 66.70 63.21 2k6p h VAL 25 Cb 1.71 1.93 0.00 0.00 -2.13 0.00 0.00 31.29 32.80 2k6p h VAL 25 CO -0.09 0.53 0.00 0.61 -1.23 0.00 0.00 177.57 177.39 2k6p n GLY 26 N 0.05 0.63 0.03 5.19 0.00 0.72 -5.06 105.19 106.75 2k6p n GLY 26 Ca -0.02 -0.16 -0.04 0.00 0.00 0.00 0.00 46.02 45.80 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 0.00 1.86 -1.71 4.61 0.00 -0.05 -4.52 120.51 120.70 2k6p n ALA 27 Ca 0.00 -0.29 -0.42 0.00 0.00 0.00 0.00 53.44 52.72 2k6p n ALA 27 Cb 0.00 0.29 -0.03 0.00 0.00 0.00 0.00 19.45 19.71 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 -2.13 3.11 -0.20 0.00 -7.23 -1.24 -3.67 120.40 109.04 2k6p s VAL 28 Ca -0.07 0.12 -0.04 0.00 -1.81 0.00 0.00 61.98 60.18 2k6p s VAL 28 Cb 0.02 -3.10 0.09 0.00 0.56 0.00 0.00 36.38 33.94 2k6p s VAL 28 CO 0.17 -0.04 0.18 0.26 -0.31 0.00 0.00 175.10 175.36 2k6p s TRP 29 N 5.94 -0.13 -0.20 2.82 0.52 -1.23 -2.66 118.94 124.00 2k6p s TRP 29 Ca 0.91 0.01 -0.16 0.00 0.02 0.00 0.00 56.10 56.88 2k6p s TRP 29 Cb -0.37 -0.48 -0.04 0.00 -1.15 0.00 0.00 33.47 31.43 2k6p s TRP 29 CO 0.37 -0.60 0.39 -1.17 0.02 0.00 0.00 176.95 175.97 2k6p s LEU 30 N 2.27 4.16 -1.37 2.99 0.20 0.17 -2.07 118.68 125.03 2k6p s LEU 30 Ca 0.06 0.52 -0.06 0.00 0.69 0.00 0.00 54.13 55.34 2k6p s LEU 30 Cb -0.16 -2.51 0.03 0.00 -0.43 0.00 0.00 46.19 43.12 2k6p s LEU 30 CO -0.13 -0.07 0.92 -3.20 -0.29 0.00 0.00 176.35 173.59 2k6p n ASN 31 N 4.41 -3.33 -2.08 3.68 5.15 -1.10 -1.17 115.26 120.81 2k6p n ASN 31 Ca -0.09 -0.73 -0.19 0.00 -0.60 0.00 0.00 54.58 52.97 2k6p n ASN 31 Cb 0.51 -4.34 -0.02 0.00 -0.53 0.00 0.00 39.78 35.40 2k6p n ASN 31 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2k6p n GLY 32 N -1.62 -0.04 3.04 8.20 0.00 -1.26 -4.98 105.19 108.53 2k6p n GLY 32 Ca -0.14 -0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.71 2k6p n GLY 32 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k6p s SER 33 N -2.24 0.52 0.41 1.61 0.01 -0.32 -5.12 113.70 108.57 2k6p s SER 33 Ca 0.00 -0.68 -0.27 0.00 1.31 0.00 0.00 55.95 56.32 2k6p s SER 33 Cb 0.00 0.11 -0.10 0.00 0.21 0.00 0.00 66.02 66.24 2k6p s SER 33 CO 0.00 -0.36 1.40 0.00 0.41 0.00 0.00 173.24 174.68 2k6p n ALA 35 N 0.06 0.04 -3.42 0.00 0.00 -1.09 -4.60 120.51 111.50 2k6p n ALA 35 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2k6p n ALA 35 Cb 0.39 0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.93 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 -0.04 2.00 -0.93 0.00 4.81 -1.26 -4.89 118.16 117.85 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 0.03 0.00 0.23 0.00 0.02 0.00 0.00 35.03 35.31 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 4.56 -2.01 3.14 0.00 -1.26 -4.12 120.51 117.82 2k6p n ALA 37 Ca 0.00 -2.12 -0.05 0.00 0.00 0.00 0.00 53.44 51.27 2k6p n ALA 37 Cb 0.00 -1.27 -0.03 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 -0.34 -0.86 -4.50 0.00 7.64 -1.26 -4.57 113.62 109.73 2k6p n SER 38 Ca 0.40 -1.66 -0.42 0.00 1.01 0.00 0.00 58.87 58.20 2k6p n SER 38 Cb 1.32 0.29 -0.09 0.00 -1.01 0.00 0.00 64.21 64.72 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 0.02 3.23 0.29 1.43 2.20 -1.26 -4.92 119.74 120.73 2k6p s LYS 39 Ca 0.01 -0.65 -0.30 0.00 -0.36 0.00 0.00 55.97 54.67 2k6p s LYS 39 Cb 0.05 -3.92 -0.12 0.00 -1.51 0.00 0.00 37.83 32.33 2k6p s LYS 39 CO -0.02 -0.77 1.49 -0.85 -0.36 0.00 0.00 175.35 174.85 2k6p n GLU 40 N 5.56 2.42 -3.11 4.03 0.28 -1.26 -2.97 120.64 125.59 2k6p n GLU 40 Ca -0.08 0.86 -0.20 0.00 -0.16 0.00 0.00 57.16 57.58 2k6p n GLU 40 Cb 0.48 -2.57 0.05 0.00 1.43 0.00 0.00 31.44 30.83 2k6p n GLU 40 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 2k6p s VAL 41 N -0.28 2.13 0.32 3.84 -7.23 0.22 -4.90 120.40 114.50 2k6p s VAL 41 Ca 0.63 -1.04 0.03 0.00 -1.81 0.00 0.00 61.98 59.79 2k6p s VAL 41 Cb -0.55 -2.18 -0.05 0.00 0.56 0.00 0.00 36.38 34.16 2k6p s VAL 41 CO 0.52 0.00 0.08 -0.75 -0.31 0.00 0.00 175.10 174.65 2k6p s LYS 42 N -4.62 1.62 0.51 4.82 2.47 -1.26 -4.64 119.74 118.63 2k6p s LYS 42 Ca 0.59 -1.91 -0.19 0.00 -1.56 0.00 0.00 55.97 52.91 2k6p s LYS 42 Cb -0.06 -0.62 -0.08 0.00 -1.46 0.00 0.00 37.83 35.62 2k6p s LYS 42 CO 0.37 -0.27 1.02 0.00 0.16 0.00 0.00 175.35 176.63 2k6p s ALA 43 N -3.43 2.90 -1.74 3.13 0.00 -1.26 -3.53 121.76 117.82 2k6p s ALA 43 Ca 0.35 0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.77 2k6p s ALA 43 Cb 0.07 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.98 2k6p s ALA 43 CO 0.15 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 175.97 2k6p n GLY 44 N -0.70 -0.06 3.97 0.00 0.00 0.31 -4.92 105.19 103.79 2k6p n GLY 44 Ca 0.08 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.16 5.46 0.11 1.61 1.11 -1.09 -4.83 116.67 116.89 2k6p s ASP 45 Ca 0.00 -0.53 0.03 0.00 0.18 0.00 0.00 52.55 52.23 2k6p s ASP 45 Cb 0.00 -0.62 -0.04 0.00 1.07 0.00 0.00 42.92 43.34 2k6p s ASP 45 CO 0.00 -0.74 0.18 -0.89 1.18 0.00 0.00 175.17 174.90 2k6p s THR 46 N -2.39 4.94 -0.31 -1.27 2.01 -1.26 0.91 115.64 118.26 2k6p s THR 46 Ca 0.53 -0.72 -0.01 0.00 0.31 0.00 0.00 61.69 61.80 2k6p s THR 46 Cb -0.08 -3.46 0.10 0.00 0.01 0.00 0.00 72.50 69.07 2k6p s THR 46 CO 0.31 0.02 0.10 -0.63 -0.69 0.00 0.00 174.62 173.74 2k6p s ILE 47 N -1.59 0.79 0.44 1.82 -1.09 0.18 -2.72 121.20 119.04 2k6p s ILE 47 Ca 0.32 -1.35 -0.17 0.00 -2.23 0.00 0.00 60.65 57.22 2k6p s ILE 47 Cb -0.12 -1.61 -0.09 0.00 -1.58 0.00 0.00 42.46 39.07 2k6p s ILE 47 CO 0.25 -0.68 0.90 -0.44 -1.23 0.00 0.00 174.94 173.74 2k6p s SER 48 N 1.65 6.75 -0.17 3.58 0.01 -0.88 0.11 113.70 124.75 2k6p s SER 48 Ca 0.10 1.50 -0.06 0.00 1.31 0.00 0.00 55.95 58.80 2k6p s SER 48 Cb -0.17 -2.47 0.08 0.00 0.21 0.00 0.00 66.02 63.66 2k6p s SER 48 CO -0.26 -0.41 0.36 -0.76 0.41 0.00 0.00 173.24 172.57 2k6p s LEU 49 N -3.53 -0.45 -0.31 2.44 1.43 -1.24 -3.57 118.68 113.44 2k6p s LEU 49 Ca 0.58 0.83 -0.18 0.00 -1.03 0.00 0.00 54.13 54.33 2k6p s LEU 49 Cb -0.10 1.09 -0.01 0.00 0.03 0.00 0.00 46.19 47.20 2k6p s LEU 49 CO 0.22 -0.23 0.50 -2.28 0.23 0.00 0.00 176.35 174.79 2k6p s HIS 50 N 2.42 3.21 0.46 0.29 2.46 -1.25 -3.34 115.29 119.53 2k6p s HIS 50 Ca -0.01 0.34 0.05 0.00 0.47 0.00 0.00 55.06 55.90 2k6p s HIS 50 Cb -0.12 -2.82 -0.04 0.00 -0.13 0.00 0.00 32.58 29.47 2k6p s HIS 50 CO -0.11 -0.43 0.06 0.71 -2.47 0.00 0.00 174.74 172.50 2k6p s TYR 51 N 2.33 2.20 0.10 3.88 1.51 0.74 -4.72 117.35 123.40 2k6p s TYR 51 Ca 0.19 -0.79 0.27 0.00 -1.01 0.00 0.00 57.07 55.73 2k6p s TYR 51 Cb -0.16 -1.75 1.02 0.00 -0.11 0.00 0.00 41.96 40.97 2k6p s TYR 51 CO 0.12 0.26 1.86 1.37 -1.11 0.00 0.00 175.55 178.05 2k6p h LEU 52 N 1.48 0.00 0.00 -1.29 8.10 -2.04 -3.05 115.31 118.51 2k6p h LEU 52 Ca -0.43 0.00 -0.17 0.00 0.11 0.00 0.00 57.88 57.39 2k6p h LEU 52 Cb 1.28 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 41.47 2k6p h LEU 52 CO 0.75 0.15 -1.86 2.29 -4.11 0.00 0.00 178.44 175.66 2k6p n LYS 53 N -3.29 0.65 -1.13 0.17 2.85 -1.26 -5.09 118.16 111.07 2k6p n LYS 53 Ca 0.00 0.02 0.00 0.00 -1.05 0.00 0.00 58.31 57.28 2k6p n LYS 53 Cb 0.40 -1.64 0.00 0.00 -0.65 0.00 0.00 35.03 33.14 2k6p n LYS 53 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2k6p n GLY 54 N 1.45 -0.28 3.37 2.58 0.00 -1.15 -5.13 105.19 106.02 2k6p n GLY 54 Ca -0.14 -1.02 -0.30 0.00 0.00 0.00 0.00 46.02 44.55 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 -3.67 2.30 -0.27 -0.61 1.09 -1.26 -0.18 121.20 118.60 2k6p s ILE 55 Ca 0.00 -1.32 -0.14 0.00 -1.10 0.00 0.00 60.65 58.09 2k6p s ILE 55 Cb 0.00 -1.91 -0.12 0.00 -1.06 0.00 0.00 42.46 39.38 2k6p s ILE 55 CO 0.00 0.38 -0.35 -0.62 -0.10 0.00 0.00 174.94 174.24 2k6p n GLU 56 N 1.77 0.58 -2.51 2.79 4.71 -1.21 -5.01 120.64 121.76 2k6p n GLU 56 Ca -0.17 0.26 -0.05 0.00 -0.01 0.00 0.00 57.16 57.20 2k6p n GLU 56 Cb 0.52 -1.49 -0.04 0.00 -1.01 0.00 0.00 31.44 29.42 2k6p n GLU 56 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 2k6p n GLU 57 N -4.27 -4.10 -3.05 3.49 2.13 -1.24 -4.35 120.64 109.25 2k6p n GLU 57 Ca -0.52 3.14 -0.20 0.00 0.66 0.00 0.00 57.16 60.25 2k6p n GLU 57 Cb 0.86 -4.76 0.06 0.00 0.27 0.00 0.00 31.44 27.87 2k6p n GLU 57 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 2k6p n TYR 58 N 1.44 -2.18 -3.86 4.31 4.02 0.29 -2.34 117.16 118.85 2k6p n TYR 58 Ca -0.35 -2.15 -0.16 0.00 -0.01 0.00 0.00 57.90 55.23 2k6p n TYR 58 Cb 0.53 -0.55 -0.16 0.00 -0.02 0.00 0.00 39.34 39.14 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 -2.64 0.08 0.05 -0.72 2.01 -0.89 0.52 115.64 114.04 2k6p s THR 59 Ca 0.60 0.15 -0.27 0.00 0.31 0.00 0.00 61.69 62.48 2k6p s THR 59 Cb -0.05 -0.20 -0.05 0.00 0.01 0.00 0.00 72.50 72.21 2k6p s THR 59 CO 0.38 0.13 0.84 -0.63 -0.69 0.00 0.00 174.62 174.64 2k6p s ILE 60 N 1.10 4.72 -0.12 1.82 1.01 0.26 -2.33 121.20 127.66 2k6p s ILE 60 Ca -0.09 1.78 0.20 0.00 0.00 0.00 0.00 60.65 62.54 2k6p s ILE 60 Cb -0.13 -4.19 -0.22 0.00 0.01 0.00 0.00 42.46 37.93 2k6p s ILE 60 CO -0.02 0.32 0.53 0.18 0.00 0.00 0.00 174.94 175.94 2k6p n LEU 61 N 3.03 0.34 -3.66 2.97 4.77 0.21 0.11 117.00 124.78 2k6p n LEU 61 Ca -0.00 0.14 0.01 0.00 -0.03 0.00 0.00 56.01 56.13 2k6p n LEU 61 Cb 0.50 0.14 -0.01 0.00 -2.33 0.00 0.00 43.42 41.73 2k6p n LEU 61 CO 0.49 0.15 1.00 -1.58 -1.33 0.00 0.00 177.39 176.11 2k6p s GLN 62 N -3.07 0.56 -0.43 3.23 0.74 -1.25 -4.13 119.66 115.32 2k6p s GLN 62 Ca -0.06 -0.31 0.02 0.00 0.05 0.00 0.00 55.36 55.06 2k6p s GLN 62 Cb 0.10 0.19 0.13 0.00 1.10 0.00 0.00 33.01 34.52 2k6p s GLN 62 CO 0.85 -0.26 0.21 0.42 -0.55 0.00 0.00 175.29 175.96 2k6p s ILE 63 N -2.57 1.56 -0.83 -2.34 -1.09 -1.26 -4.76 121.20 109.91 2k6p s ILE 63 Ca 0.14 -2.49 0.20 0.00 -2.23 0.00 0.00 60.65 56.28 2k6p s ILE 63 Cb 0.03 -2.10 0.19 0.00 -1.58 0.00 0.00 42.46 39.00 2k6p s ILE 63 CO -0.03 -0.83 1.62 -0.81 -1.23 0.00 0.00 174.94 173.67 2k6p n PRO 64 N 3.72 0.08 -3.27 2.79 -0.04 -1.26 -4.91 135.00 132.09 2k6p n PRO 64 Ca 0.06 0.26 -0.15 0.00 -0.04 0.00 0.00 63.50 63.63 2k6p n PRO 64 Cb 0.36 -1.63 0.08 0.00 -0.04 0.00 0.00 33.50 32.26 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 -1.60 -2.01 -3.44 0.55 0.00 -1.26 -5.03 120.51 107.72 2k6p n ALA 65 Ca 0.04 -0.01 -0.11 0.00 0.00 0.00 0.00 53.44 53.36 2k6p n ALA 65 Cb 0.23 -3.14 0.01 0.00 0.00 0.00 0.00 19.45 16.55 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 -3.69 0.00 -0.03 0.00 4.77 -1.26 -4.94 117.00 111.85 2k6p n LEU 66 Ca -0.21 -1.09 -0.05 0.00 -0.03 0.00 0.00 56.01 54.63 2k6p n LEU 66 Cb 0.65 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.64 2k6p n LEU 66 CO 0.56 -0.45 -0.71 0.29 -1.33 0.00 0.00 177.39 175.76 2k6p n LYS 67 N -1.17 0.15 -3.74 3.23 4.76 -1.26 -4.86 118.16 115.26 2k6p n LYS 67 Ca 0.02 0.04 -0.14 0.00 -2.87 0.00 0.00 58.31 55.36 2k6p n LYS 67 Cb 0.24 -0.99 -0.14 0.00 -1.84 0.00 0.00 35.03 32.30 2k6p n LYS 67 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2k6p s ASN 68 N -4.92 -0.06 -0.42 4.39 2.47 -1.26 -4.74 114.94 110.41 2k6p s ASN 68 Ca -0.08 0.32 0.02 0.00 0.42 0.00 0.00 52.86 53.53 2k6p s ASN 68 Cb 0.03 0.21 0.13 0.00 -1.45 0.00 0.00 41.25 40.17 2k6p s ASN 68 CO 0.13 -0.16 0.22 -0.69 -3.72 0.00 0.00 177.10 172.89 2k6p s VAL 69 N 1.27 1.29 1.02 -5.21 1.01 -0.66 -5.04 120.40 114.07 2k6p s VAL 69 Ca -0.08 -2.41 -0.13 0.00 0.00 0.00 0.00 61.98 59.36 2k6p s VAL 69 Cb -0.12 -1.91 0.18 0.00 0.00 0.00 0.00 36.38 34.54 2k6p s VAL 69 CO -0.06 -0.88 0.37 -2.65 0.00 0.00 0.00 175.10 171.88 2k6p n PRO 70 N 3.69 -2.40 -2.44 2.72 -0.02 -1.26 -4.30 135.00 130.98 2k6p n PRO 70 Ca 0.08 -0.71 -0.41 0.00 -2.02 0.00 0.00 63.50 60.44 2k6p n PRO 70 Cb 0.35 -1.48 -0.03 0.00 -0.02 0.00 0.00 33.50 32.32 2k6p n PRO 70 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 2k6p s ARG 71 N -3.54 3.11 0.14 -0.52 6.06 -1.26 -4.13 118.95 118.81 2k6p s ARG 71 Ca 0.36 0.01 0.00 0.00 -2.50 0.00 0.00 55.73 53.60 2k6p s ARG 71 Cb -0.06 -4.21 0.00 0.00 0.06 0.00 0.00 34.95 30.74 2k6p s ARG 71 CO 0.33 -2.22 0.00 1.17 -2.50 0.00 0.00 175.30 172.08 2k6p n LYS 72 N 9.23 0.00 -0.76 5.12 0.00 -1.26 -4.97 118.16 125.52 2k6p n LYS 72 Ca 0.07 0.00 0.06 0.00 0.00 0.00 0.00 58.31 58.44 2k6p n LYS 72 Cb 0.50 0.00 0.14 0.00 0.00 0.00 0.00 35.03 35.66 2k6p n LYS 72 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2k6p n ASP 73 N -3.05 1.50 -0.38 3.14 9.92 -1.26 -4.70 116.55 121.73 2k6p n ASP 73 Ca 0.00 -3.17 0.11 0.00 -0.53 0.00 0.00 54.79 51.20 2k6p n ASP 73 Cb 0.00 -0.43 0.04 0.00 -0.64 0.00 0.00 41.12 40.08 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 0.00 1.82 -3.53 5.66 -1.26 -4.14 114.28 112.17 2k6p n THR 74 Ca 0.14 -0.20 0.13 0.00 -3.05 0.00 0.00 64.05 61.07 2k6p n THR 74 Cb 0.81 1.07 0.66 0.00 -1.55 0.00 0.00 70.33 71.32 2k6p n THR 74 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2k6p n HIS 75 N -0.36 0.03 -0.38 1.09 1.44 -1.26 -3.27 115.22 112.51 2k6p n HIS 75 Ca 0.09 -0.02 0.09 0.00 -2.01 0.00 0.00 57.72 55.87 2k6p n HIS 75 Cb 0.43 0.00 0.27 0.00 0.12 0.00 0.00 29.99 30.80 2k6p n HIS 75 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2k6p n LEU 76 N -0.57 3.72 -0.00 2.39 4.77 -1.26 -4.37 117.00 121.69 2k6p n LEU 76 Ca 0.19 -2.13 -0.00 0.00 -0.03 0.00 0.00 56.01 54.04 2k6p n LEU 76 Cb 0.16 -0.42 -0.01 0.00 -2.33 0.00 0.00 43.42 40.83 2k6p n LEU 76 CO 0.14 0.85 -0.53 -1.22 -1.33 0.00 0.00 177.39 175.31 2k6p n TYR 77 N 1.05 0.00 -3.68 -1.77 4.01 -1.20 -4.45 117.16 111.11 2k6p n TYR 77 Ca 0.20 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.80 2k6p n TYR 77 Cb 0.61 -0.04 -0.08 0.00 -0.31 0.00 0.00 39.34 39.51 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 -2.05 0.01 0.00 -0.72 2.07 -1.26 0.66 121.20 119.92 2k6p s ILE 78 Ca -0.01 -0.12 -0.01 0.00 -1.41 0.00 0.00 60.65 59.10 2k6p s ILE 78 Cb 0.01 -0.73 -0.01 0.00 0.13 0.00 0.00 42.46 41.85 2k6p s ILE 78 CO 0.05 -0.06 0.02 0.00 -1.91 0.00 0.00 174.94 173.03 2k6p s ALA 79 N -0.40 -0.02 -0.42 1.50 0.00 -0.98 -4.70 121.76 116.75 2k6p s ALA 79 Ca -0.05 -0.26 -0.28 0.00 0.00 0.00 0.00 51.96 51.37 2k6p s ALA 79 Cb -0.03 0.06 0.00 0.00 0.00 0.00 0.00 23.12 23.15 2k6p s ALA 79 CO 0.03 -0.11 1.54 -1.25 0.00 0.00 0.00 175.76 175.98 2k6p s PRO 80 N -0.84 3.43 -0.99 0.00 0.04 -1.26 -2.09 135.00 133.28 2k6p s PRO 80 Ca -0.09 1.00 -0.17 0.00 0.04 0.00 0.00 61.00 61.78 2k6p s PRO 80 Cb -0.06 -4.10 0.15 0.00 0.04 0.00 0.00 34.50 30.53 2k6p s PRO 80 CO -0.00 -1.75 1.17 0.21 0.04 0.00 0.00 177.00 176.67 2k6p s LYS 81 N 5.31 3.72 -0.13 4.56 2.36 -0.99 -4.97 119.74 129.60 2k6p s LYS 81 Ca 0.66 -2.02 -0.00 0.00 -2.55 0.00 0.00 55.97 52.06 2k6p s LYS 81 Cb -0.16 -4.91 0.03 0.00 -1.05 0.00 0.00 37.83 31.74 2k6p s LYS 81 CO 0.32 -1.73 -0.08 0.95 1.55 0.00 0.00 175.35 176.36 2k6p s THR 82 N 2.21 1.12 -0.09 3.43 -4.23 -1.26 -4.63 115.64 112.18 2k6p s THR 82 Ca 0.34 -0.44 -0.19 0.00 -1.18 0.00 0.00 61.69 60.22 2k6p s THR 82 Cb -0.05 -1.17 0.04 0.00 1.34 0.00 0.00 72.50 72.67 2k6p s THR 82 CO -0.07 0.30 0.46 -0.54 -0.54 0.00 0.00 174.62 174.23 2k6p s LYS 83 N 1.66 0.72 0.00 3.99 -0.14 -1.26 -5.23 119.74 119.48 2k6p s LYS 83 Ca 0.04 0.25 0.00 0.00 -1.36 0.00 0.00 55.97 54.89 2k6p s LYS 83 Cb -0.13 0.34 0.00 0.00 -1.68 0.00 0.00 37.83 36.35 2k6p s LYS 83 CO -0.08 -0.17 0.00 0.39 -0.76 0.00 0.00 175.35 174.72