#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rlz s VAL 2 N 0.00 -0.05 -0.04 2.03 1.01 -1.26 -5.16 120.40 116.94 2rlz s VAL 2 Ca 0.00 0.13 -0.06 0.00 0.00 0.00 0.00 61.98 62.05 2rlz s VAL 2 Cb 0.00 -0.47 0.01 0.00 0.00 0.00 0.00 36.38 35.92 2rlz s VAL 2 CO 0.00 0.05 0.15 0.00 0.00 0.00 0.00 175.10 175.30 2rlz s GLN 3 N 1.36 0.29 -0.02 2.72 -2.07 -1.26 -5.16 119.66 115.52 2rlz s GLN 3 Ca -0.09 -0.01 -0.03 0.00 -1.82 0.00 0.00 55.36 53.40 2rlz s GLN 3 Cb -0.10 0.13 0.00 0.00 -1.09 0.00 0.00 33.01 31.96 2rlz s GLN 3 CO -0.10 -0.06 0.08 -0.65 -1.32 0.00 0.00 175.29 173.24 2rlz s GLN 4 N -0.46 0.17 0.89 9.60 -0.21 -1.26 -5.15 119.66 123.24 2rlz s GLN 4 Ca -0.05 -0.03 -0.11 0.00 0.02 0.00 0.00 55.36 55.18 2rlz s GLN 4 Cb -0.04 0.08 0.13 0.00 1.00 0.00 0.00 33.01 34.18 2rlz s GLN 4 CO 0.01 -0.03 1.10 0.21 -2.12 0.00 0.00 175.29 174.46 2rlz s LYS 5 N -0.32 1.30 0.35 2.91 2.20 -1.26 -5.06 119.74 119.87 2rlz s LYS 5 Ca -0.04 1.14 -0.01 0.00 -0.36 0.00 0.00 55.97 56.69 2rlz s LYS 5 Cb -0.03 -1.79 0.00 0.00 -1.51 0.00 0.00 37.83 34.51 2rlz s LYS 5 CO 0.00 -2.30 0.47 0.14 -0.36 0.00 0.00 175.35 173.30 2rlz s VAL 6 N -2.80 0.00 -0.01 4.02 -7.23 -1.26 -5.17 120.40 107.95 2rlz s VAL 6 Ca 0.64 -1.63 0.06 0.00 -1.81 0.00 0.00 61.98 59.24 2rlz s VAL 6 Cb -0.20 -2.65 -0.02 0.00 0.56 0.00 0.00 36.38 34.07 2rlz s VAL 6 CO 0.58 0.00 -0.19 -1.61 -0.31 0.00 0.00 175.10 173.57 2rlz s GLU 7 N -3.00 1.52 0.10 4.82 2.02 -1.26 -5.12 118.70 117.76 2rlz s GLU 7 Ca 0.31 -0.71 -0.30 0.00 0.02 0.00 0.00 54.97 54.30 2rlz s GLU 7 Cb -0.00 -1.48 -0.06 0.00 0.10 0.00 0.00 34.13 32.69 2rlz s GLU 7 CO 0.22 0.40 0.94 0.08 0.02 0.00 0.00 175.26 176.92 2rlz s VAL 8 N -0.49 4.55 0.00 2.63 1.01 -1.26 -4.89 120.40 121.95 2rlz s VAL 8 Ca 0.07 2.03 0.00 0.00 0.00 0.00 0.00 61.98 64.08 2rlz s VAL 8 Cb -0.07 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 32.00 2rlz s VAL 8 CO -0.00 0.31 0.31 -1.14 0.00 0.00 0.00 175.10 174.57 2rlz n ARG 9 N 2.88 0.00 -0.25 2.72 0.63 -1.26 -5.12 116.66 116.26 2rlz n ARG 9 Ca 0.02 -0.31 -0.23 0.00 -0.92 0.00 0.00 57.85 56.42 2rlz n ARG 9 Cb 0.49 -0.37 0.22 0.00 0.45 0.00 0.00 32.46 33.25 2rlz n ARG 9 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2rlz n LEU 10 N 0.00 0.00 -4.97 6.15 4.77 -1.26 -5.01 117.00 116.68 2rlz n LEU 10 Ca 0.00 -0.65 -0.22 0.00 -0.03 0.00 0.00 56.01 55.12 2rlz n LEU 10 Cb 0.46 -0.80 0.03 0.00 -2.33 0.00 0.00 43.42 40.78 2rlz n LEU 10 CO 0.00 -2.56 0.33 -0.54 -1.33 0.00 0.00 177.39 173.29 2rlz s LYS 11 N -4.35 2.73 0.09 3.23 1.02 -1.26 -5.12 119.74 116.08 2rlz s LYS 11 Ca 0.50 -0.69 -0.13 0.00 0.02 0.00 0.00 55.97 55.67 2rlz s LYS 11 Cb -0.09 -2.52 0.02 0.00 -0.52 0.00 0.00 37.83 34.72 2rlz s LYS 11 CO 0.42 -0.55 0.30 0.95 -0.92 0.00 0.00 175.35 175.55 2rlz s THR 12 N -2.68 0.10 0.00 2.17 -4.23 -1.26 -5.18 115.64 104.56 2rlz s THR 12 Ca 0.54 -0.82 0.00 0.00 -1.18 0.00 0.00 61.69 60.23 2rlz s THR 12 Cb -0.10 -1.18 0.00 0.00 1.34 0.00 0.00 72.50 72.56 2rlz s THR 12 CO 0.38 -0.45 0.00 0.61 -0.54 0.00 0.00 174.62 174.62 2rlz n GLY 13 N 0.02 1.07 3.38 3.99 0.00 -1.26 -4.86 105.19 107.53 2rlz n GLY 13 Ca -0.16 -0.62 -0.46 0.00 0.00 0.00 0.00 46.02 44.77 2rlz n GLY 13 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2rlz n LEU 14 N 0.00 -1.48 0.00 0.99 4.32 -1.26 -4.94 117.00 114.63 2rlz n LEU 14 Ca 0.00 1.05 0.00 0.00 -0.02 0.00 0.00 56.01 57.04 2rlz n LEU 14 Cb 0.00 -0.95 0.00 0.00 -1.62 0.00 0.00 43.42 40.85 2rlz n LEU 14 CO 0.00 -3.21 0.00 0.00 -1.22 0.00 0.00 177.39 172.96 2rlz n GLN 15 N 1.06 0.41 -0.02 3.23 6.02 -1.26 -4.96 117.38 121.86 2rlz n GLN 15 Ca 0.16 0.00 -0.21 0.00 -0.01 0.00 0.00 57.00 56.94 2rlz n GLN 15 Cb 0.29 0.00 -0.13 0.00 1.02 0.00 0.00 30.24 31.42 2rlz n GLN 15 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2rlz n ALA 16 N -3.00 0.90 -0.06 -1.58 0.00 -1.26 -4.02 120.51 111.49 2rlz n ALA 16 Ca 0.00 -0.61 -0.08 0.00 0.00 0.00 0.00 53.44 52.76 2rlz n ALA 16 Cb 0.00 -0.62 -0.02 0.00 0.00 0.00 0.00 19.45 18.81 2rlz n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rlz h ARG 17 N -0.11 0.06 -0.89 0.00 3.08 -1.99 -1.58 114.38 112.95 2rlz h ARG 17 Ca -0.43 -0.00 0.10 0.00 0.07 0.00 0.00 59.98 59.72 2rlz h ARG 17 Cb 1.91 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 31.88 2rlz h ARG 17 CO 0.03 0.04 0.57 -1.35 -1.07 0.00 0.00 179.97 178.19 2rlz h PRO 18 N 0.06 0.85 -0.26 0.04 0.11 -1.96 0.66 132.00 131.51 2rlz h PRO 18 Ca 0.12 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 66.05 2rlz h PRO 18 Cb 0.15 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.06 2rlz h PRO 18 CO -0.20 0.56 -0.37 0.00 -0.21 0.00 0.00 178.00 177.78 2rlz h ALA 19 N 1.56 0.87 -0.04 -0.75 0.00 -1.53 -0.58 119.26 118.79 2rlz h ALA 19 Ca 0.41 -0.42 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 2rlz h ALA 19 Cb 0.41 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2rlz h ALA 19 CO -0.18 0.63 -0.76 0.00 0.00 0.00 0.00 179.25 178.95 2rlz h ALA 20 N 1.11 0.62 0.00 0.00 0.00 -0.28 -3.12 119.26 117.58 2rlz h ALA 20 Ca 0.05 -0.64 -0.15 0.00 0.00 0.00 0.00 54.91 54.17 2rlz h ALA 20 Cb 0.86 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 2rlz h ALA 20 CO 0.07 0.81 -0.71 -0.07 0.00 0.00 0.00 179.25 179.35 2rlz h LEU 21 N 0.19 0.00 -0.85 0.00 3.38 -0.77 -2.95 115.31 114.31 2rlz h LEU 21 Ca -0.03 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.95 2rlz h LEU 21 Cb 1.34 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.05 2rlz h LEU 21 CO 0.12 0.71 0.56 0.15 0.09 0.00 0.00 178.44 180.07 2rlz h PHE 22 N 0.00 1.06 -0.05 1.13 3.04 -1.04 -2.23 116.94 118.84 2rlz h PHE 22 Ca -0.01 0.03 -0.19 0.00 3.98 0.00 0.00 57.97 61.78 2rlz h PHE 22 Cb 1.35 -0.36 -0.00 0.00 2.56 0.00 0.00 35.95 39.50 2rlz h PHE 22 CO 0.00 0.65 -0.79 0.28 -2.02 0.00 0.00 178.31 176.43 2rlz h VAL 23 N 1.13 1.40 -0.44 1.41 2.07 -1.57 -2.46 116.25 117.78 2rlz h VAL 23 Ca 0.32 -2.25 0.08 0.00 0.82 0.00 0.00 66.70 65.67 2rlz h VAL 23 Cb -0.09 2.21 -0.07 0.00 -1.52 0.00 0.00 31.29 31.82 2rlz h VAL 23 CO -0.08 0.67 -0.03 1.56 0.02 0.00 0.00 177.57 179.72 2rlz h GLN 24 N 0.24 0.08 -0.18 1.57 1.08 -1.23 2.93 115.11 119.61 2rlz h GLN 24 Ca -0.04 -0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 56.98 2rlz h GLN 24 Cb 1.38 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 28.79 2rlz h GLN 24 CO 0.13 0.05 -0.61 0.93 -0.95 0.00 0.00 178.83 178.39 2rlz h GLU 25 N 0.08 0.60 0.00 1.46 4.39 -1.50 -2.88 114.58 116.73 2rlz h GLU 25 Ca 0.22 -0.41 0.00 0.00 0.34 0.00 0.00 59.36 59.51 2rlz h GLU 25 Cb 0.32 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.03 2rlz h GLU 25 CO -0.39 1.03 0.00 0.00 -1.16 0.00 0.00 179.01 178.49 2rlz h ALA 26 N 0.88 1.00 -0.13 3.43 0.00 -0.74 -3.13 119.26 120.56 2rlz h ALA 26 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.94 2rlz h ALA 26 Cb 1.18 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2rlz h ALA 26 CO 0.12 0.00 0.38 -0.97 0.00 0.00 0.00 179.25 178.77 2rlz h ASN 27 N 0.00 0.00 -0.52 0.00 -1.24 0.55 1.59 115.58 115.96 2rlz h ASN 27 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2rlz h ASN 27 Cb 0.76 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.81 2rlz h ASN 27 CO 0.00 0.00 0.00 0.54 -1.29 0.00 0.00 177.43 176.68 2rlz n ARG 28 N -3.16 3.48 -0.21 6.67 1.74 -1.18 -4.65 116.66 119.35 2rlz n ARG 28 Ca 0.01 -2.41 -0.05 0.00 -0.77 0.00 0.00 57.85 54.63 2rlz n ARG 28 Cb 0.46 -1.87 -0.05 0.00 -1.02 0.00 0.00 32.46 29.99 2rlz n ARG 28 CO 0.00 0.00 0.00 1.97 -1.52 0.00 0.00 177.63 178.08 2rlz n PHE 29 N 0.81 -0.22 -0.84 -1.55 -1.74 0.54 -4.59 117.46 109.87 2rlz n PHE 29 Ca 0.22 0.61 -0.01 0.00 -0.56 0.00 0.00 57.45 57.71 2rlz n PHE 29 Cb 0.82 -0.49 -0.01 0.00 1.52 0.00 0.00 39.48 41.32 2rlz n PHE 29 CO 0.00 0.00 0.00 2.41 -0.56 0.00 0.00 176.76 178.61 2rlz n THR 30 N -4.22 0.00 -0.87 1.97 -1.04 -1.26 -4.04 114.28 104.82 2rlz n THR 30 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 2rlz n THR 30 Cb 0.13 -0.15 0.00 0.00 -1.82 0.00 0.00 70.33 68.48 2rlz n THR 30 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2rlz n SER 31 N 1.20 0.00 -1.07 8.00 3.41 -1.26 -4.72 113.62 119.18 2rlz n SER 31 Ca -0.01 -0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.34 2rlz n SER 31 Cb 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 2rlz n SER 31 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2rlz n ASP 32 N 0.00 -3.48 -4.39 4.04 8.00 -1.26 -4.11 116.55 115.35 2rlz n ASP 32 Ca 0.00 0.33 -0.33 0.00 0.71 0.00 0.00 54.79 55.50 2rlz n ASP 32 Cb 0.06 -1.84 -0.14 0.00 -0.02 0.00 0.00 41.12 39.19 2rlz n ASP 32 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2rlz s VAL 33 N -0.11 3.27 -0.08 2.53 1.01 -1.26 -4.34 120.40 121.42 2rlz s VAL 33 Ca 0.00 -0.57 -0.01 0.00 0.00 0.00 0.00 61.98 61.40 2rlz s VAL 33 Cb 0.00 -2.40 0.03 0.00 0.00 0.00 0.00 36.38 34.00 2rlz s VAL 33 CO 0.00 0.51 -0.03 -0.36 0.00 0.00 0.00 175.10 175.21 2rlz s PHE 34 N 0.50 0.93 -0.30 5.22 0.40 -0.94 -4.10 117.98 119.68 2rlz s PHE 34 Ca -0.07 -0.34 -0.17 0.00 -0.60 0.00 0.00 56.93 55.75 2rlz s PHE 34 Cb -0.15 -0.91 -0.02 0.00 0.51 0.00 0.00 43.02 42.45 2rlz s PHE 34 CO 0.04 -0.36 0.46 -0.51 0.70 0.00 0.00 175.22 175.55 2rlz s LEU 35 N 1.70 4.18 0.10 -0.37 1.43 -1.26 -1.42 118.68 123.03 2rlz s LEU 35 Ca 0.02 0.20 0.07 0.00 -1.03 0.00 0.00 54.13 53.39 2rlz s LEU 35 Cb -0.13 -2.54 -0.04 0.00 0.03 0.00 0.00 46.19 43.52 2rlz s LEU 35 CO -0.05 -0.33 -0.12 -0.70 0.23 0.00 0.00 176.35 175.39 2rlz s GLU 36 N 2.24 2.08 -0.29 1.70 2.12 -0.06 -2.60 118.70 123.90 2rlz s GLU 36 Ca 0.18 -1.04 0.00 0.00 0.36 0.00 0.00 54.97 54.47 2rlz s GLU 36 Cb -0.16 -2.27 0.19 0.00 0.26 0.00 0.00 34.13 32.15 2rlz s GLU 36 CO 0.11 0.51 0.72 0.21 -0.54 0.00 0.00 175.26 176.27 2rlz s LYS 37 N -2.12 0.44 -0.34 4.30 2.20 0.18 -0.11 119.74 124.29 2rlz s LYS 37 Ca 0.20 0.49 -0.01 0.00 -0.36 0.00 0.00 55.97 56.30 2rlz s LYS 37 Cb -0.11 0.24 0.00 0.00 -1.51 0.00 0.00 37.83 36.45 2rlz s LYS 37 CO 0.12 -0.77 0.14 -3.47 -0.36 0.00 0.00 175.35 171.01 2rlz n ASP 38 N 5.35 -2.57 0.00 1.43 -0.08 -1.26 -3.02 116.55 116.41 2rlz n ASP 38 Ca 0.05 -0.07 0.00 0.00 -1.51 0.00 0.00 54.79 53.26 2rlz n ASP 38 Cb 0.55 -1.49 0.00 0.00 2.34 0.00 0.00 41.12 42.52 2rlz n ASP 38 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2rlz n GLY 39 N -0.91 3.00 3.84 0.27 0.00 -1.26 -4.99 105.19 105.14 2rlz n GLY 39 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 2rlz n GLY 39 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2rlz s LYS 40 N -0.12 3.92 0.18 1.61 2.20 -1.17 -5.08 119.74 121.29 2rlz s LYS 40 Ca 0.00 0.41 -0.05 0.00 -0.36 0.00 0.00 55.97 55.96 2rlz s LYS 40 Cb 0.00 -3.06 -0.02 0.00 -1.51 0.00 0.00 37.83 33.23 2rlz s LYS 40 CO 0.00 0.58 0.22 -1.59 -0.36 0.00 0.00 175.35 174.20 2rlz s LYS 41 N -1.61 1.19 0.51 4.03 -2.85 -1.26 0.47 119.74 120.23 2rlz s LYS 41 Ca 0.32 -1.39 0.08 0.00 -1.00 0.00 0.00 55.97 53.98 2rlz s LYS 41 Cb -0.16 0.33 0.04 0.00 -2.06 0.00 0.00 37.83 35.99 2rlz s LYS 41 CO 0.17 -0.42 0.58 0.14 0.10 0.00 0.00 175.35 175.93 2rlz s VAL 42 N -4.05 2.25 0.07 1.79 -7.23 -1.07 -5.02 120.40 107.13 2rlz s VAL 42 Ca 0.26 -1.19 -0.13 0.00 -1.81 0.00 0.00 61.98 59.12 2rlz s VAL 42 Cb 0.05 -2.44 -0.03 0.00 0.56 0.00 0.00 36.38 34.52 2rlz s VAL 42 CO 0.06 0.00 1.22 -1.13 -0.31 0.00 0.00 175.10 174.94 2rlz h ASN 43 N 0.55 -0.89 0.00 4.85 -0.73 -1.93 -3.42 115.58 114.01 2rlz h ASN 43 Ca -0.35 0.13 0.00 0.00 1.87 0.00 0.00 56.30 57.95 2rlz h ASN 43 Cb 1.29 0.39 0.00 0.00 0.27 0.00 0.00 38.32 40.27 2rlz h ASN 43 CO 0.49 -0.10 0.00 0.00 -0.37 0.00 0.00 177.43 177.44 2rlz n ALA 44 N -3.08 0.00 -2.65 1.57 0.00 -1.26 -4.87 120.51 110.21 2rlz n ALA 44 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.42 2rlz n ALA 44 Cb 0.11 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.67 2rlz n ALA 44 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2rlz n LYS 45 N 0.00 0.03 -4.25 0.00 2.85 -1.26 -4.38 118.16 111.15 2rlz n LYS 45 Ca 0.00 -0.55 -0.17 0.00 -1.05 0.00 0.00 58.31 56.54 2rlz n LYS 45 Cb 0.00 -0.04 -0.14 0.00 -0.65 0.00 0.00 35.03 34.20 2rlz n LYS 45 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2rlz s SER 46 N -0.05 1.03 0.07 -5.58 0.15 -1.26 -4.85 113.70 103.21 2rlz s SER 46 Ca 0.22 -0.29 -0.34 0.00 0.70 0.00 0.00 55.95 56.24 2rlz s SER 46 Cb 0.26 -0.07 -0.19 0.00 -1.71 0.00 0.00 66.02 64.31 2rlz s SER 46 CO -0.16 0.02 1.62 0.40 1.20 0.00 0.00 173.24 176.31 2rlz h ILE 47 N 4.77 0.27 0.00 6.45 2.04 -1.97 -2.15 117.51 126.92 2rlz h ILE 47 Ca -0.33 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 2rlz h ILE 47 Cb 1.19 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 37.54 2rlz h ILE 47 CO 0.47 0.00 -0.02 0.00 0.00 0.00 0.00 178.15 178.60 2rlz h MET 48 N -0.98 0.00 -0.21 2.37 -0.00 -1.97 -2.24 114.93 111.90 2rlz h MET 48 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.60 2rlz h MET 48 Cb 0.75 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.34 2rlz h MET 48 CO 0.15 0.02 0.14 0.78 -0.00 0.00 0.00 176.91 177.99 2rlz h GLY 49 N 0.13 0.30 1.45 -3.00 0.00 -1.81 -2.13 103.07 98.00 2rlz h GLY 49 Ca -0.00 -0.11 -0.16 0.00 0.00 0.00 0.00 47.33 47.06 2rlz h GLY 49 CO 0.00 0.11 -0.53 1.41 0.00 0.00 0.00 176.54 177.53 2rlz h LEU 50 N 0.28 0.65 -0.63 3.11 3.38 -1.18 -3.09 115.31 117.82 2rlz h LEU 50 Ca 0.08 -0.34 0.09 0.00 0.09 0.00 0.00 57.88 57.80 2rlz h LEU 50 Cb -0.02 -0.19 -0.07 0.00 0.09 0.00 0.00 40.66 40.48 2rlz h LEU 50 CO -0.02 1.05 0.26 0.24 0.09 0.00 0.00 178.44 180.07 2rlz h MET 51 N 0.45 0.44 -0.83 1.13 2.86 -1.16 -1.05 114.93 116.77 2rlz h MET 51 Ca 0.01 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.59 2rlz h MET 51 Cb 1.07 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 32.60 2rlz h MET 51 CO 0.10 0.29 0.37 0.66 1.06 0.00 0.00 176.91 179.39 2rlz h SER 52 N 0.45 1.11 -3.42 1.22 4.64 -1.34 -3.38 113.55 112.82 2rlz h SER 52 Ca 0.32 -0.15 -0.66 0.00 -0.47 0.00 0.00 61.79 60.83 2rlz h SER 52 Cb 0.38 -0.29 -0.16 0.00 -0.31 0.00 0.00 62.40 62.03 2rlz h SER 52 CO -0.30 0.96 0.18 -0.22 -0.87 0.00 0.00 176.83 176.58 2rlz s LEU 53 N -9.76 4.57 0.03 5.97 0.20 -0.40 -5.04 118.68 114.25 2rlz s LEU 53 Ca -0.12 -0.51 -0.01 0.00 0.69 0.00 0.00 54.13 54.17 2rlz s LEU 53 Cb 0.16 -2.67 -0.04 0.00 -0.43 0.00 0.00 46.19 43.21 2rlz s LEU 53 CO 0.84 -0.89 0.19 0.00 -0.29 0.00 0.00 176.35 176.19 2rlz s ALA 54 N 2.96 3.95 0.00 5.97 0.00 -1.26 -4.81 121.76 128.57 2rlz s ALA 54 Ca 0.22 -0.82 0.00 0.00 0.00 0.00 0.00 51.96 51.36 2rlz s ALA 54 Cb -0.15 -1.82 0.00 0.00 0.00 0.00 0.00 23.12 21.15 2rlz s ALA 54 CO 0.17 0.79 0.00 1.33 0.00 0.00 0.00 175.76 178.05 2rlz n VAL 55 N 0.59 0.00 -3.95 0.00 0.24 -1.26 -5.17 118.33 108.78 2rlz n VAL 55 Ca -0.08 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.12 2rlz n VAL 55 Cb 0.52 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.87 2rlz n VAL 55 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2rlz s SER 56 N 0.21 0.27 0.23 -1.34 0.01 -1.26 -4.83 113.70 106.99 2rlz s SER 56 Ca 0.00 -1.16 -0.30 0.00 1.31 0.00 0.00 55.95 55.80 2rlz s SER 56 Cb 0.00 0.72 -0.09 0.00 0.21 0.00 0.00 66.02 66.85 2rlz s SER 56 CO 0.00 -1.40 1.38 0.42 0.41 0.00 0.00 173.24 174.05 2rlz s THR 57 N -3.10 2.91 0.00 1.44 -4.23 -1.26 -2.22 115.64 109.18 2rlz s THR 57 Ca 0.22 0.75 0.00 0.00 -1.18 0.00 0.00 61.69 61.48 2rlz s THR 57 Cb -0.03 -3.48 0.00 0.00 1.34 0.00 0.00 72.50 70.33 2rlz s THR 57 CO 0.13 0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.94 2rlz n GLY 58 N 2.28 0.82 3.80 3.99 0.00 -1.26 -5.05 105.19 109.77 2rlz n GLY 58 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 2rlz n GLY 58 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2rlz s THR 59 N -2.32 1.94 0.06 2.61 -4.23 -0.94 -5.09 115.64 107.67 2rlz s THR 59 Ca 0.00 0.00 -0.04 0.00 -1.18 0.00 0.00 61.69 60.47 2rlz s THR 59 Cb 0.00 -2.79 -0.02 0.00 1.34 0.00 0.00 72.50 71.03 2rlz s THR 59 CO 0.00 0.00 0.06 -1.61 -0.54 0.00 0.00 174.62 172.53 2rlz s GLU 60 N -5.45 0.67 -0.06 3.99 2.02 -1.26 -5.02 118.70 113.59 2rlz s GLU 60 Ca 0.67 -1.04 -0.02 0.00 0.02 0.00 0.00 54.97 54.60 2rlz s GLU 60 Cb -0.11 0.25 0.04 0.00 0.10 0.00 0.00 34.13 34.40 2rlz s GLU 60 CO 0.53 -0.16 0.10 0.54 0.02 0.00 0.00 175.26 176.29 2rlz s VAL 61 N -3.59 -0.15 -0.57 2.63 0.11 -1.26 -4.90 120.40 112.67 2rlz s VAL 61 Ca 0.04 0.34 -0.28 0.00 -2.93 0.00 0.00 61.98 59.15 2rlz s VAL 61 Cb 0.05 -0.20 0.01 0.00 -1.53 0.00 0.00 36.38 34.71 2rlz s VAL 61 CO -0.09 0.14 1.42 -0.89 -3.33 0.00 0.00 175.10 172.35 2rlz s THR 62 N 1.91 3.77 0.29 5.04 2.01 0.84 -4.87 115.64 124.62 2rlz s THR 62 Ca 0.00 0.64 -0.27 0.00 0.31 0.00 0.00 61.69 62.37 2rlz s THR 62 Cb -0.12 -4.45 -0.09 0.00 0.01 0.00 0.00 72.50 67.85 2rlz s THR 62 CO -0.04 -1.20 0.93 -0.22 -0.69 0.00 0.00 174.62 173.40 2rlz s LEU 63 N 6.15 4.45 -0.17 4.42 2.96 -1.26 -0.88 118.68 134.36 2rlz s LEU 63 Ca 0.52 1.86 0.00 0.00 -0.22 0.00 0.00 54.13 56.29 2rlz s LEU 63 Cb -0.11 -3.85 0.04 0.00 0.50 0.00 0.00 46.19 42.77 2rlz s LEU 63 CO 0.24 0.02 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.56 2rlz s ILE 64 N -1.45 1.46 -0.16 6.68 1.01 -0.51 -4.97 121.20 123.26 2rlz s ILE 64 Ca 0.46 -0.77 -0.04 0.00 0.00 0.00 0.00 60.65 60.30 2rlz s ILE 64 Cb -0.21 -1.51 0.08 0.00 0.01 0.00 0.00 42.46 40.83 2rlz s ILE 64 CO 0.27 0.26 0.24 0.00 0.00 0.00 0.00 174.94 175.70 2rlz s ALA 65 N 1.49 -0.40 -0.14 9.38 0.00 -1.26 -2.23 121.76 128.61 2rlz s ALA 65 Ca 0.01 0.57 -0.00 0.00 0.00 0.00 0.00 51.96 52.55 2rlz s ALA 65 Cb -0.15 -1.16 0.03 0.00 0.00 0.00 0.00 23.12 21.83 2rlz s ALA 65 CO -0.09 -0.92 -0.11 1.14 0.00 0.00 0.00 175.76 175.78 2rlz s GLN 66 N 2.37 1.91 0.00 0.00 -2.07 -1.26 -4.99 119.66 115.62 2rlz s GLN 66 Ca 0.05 -0.45 0.00 0.00 -1.82 0.00 0.00 55.36 53.13 2rlz s GLN 66 Cb -0.14 -1.91 0.00 0.00 -1.09 0.00 0.00 33.01 29.87 2rlz s GLN 66 CO -0.10 -0.28 0.00 0.41 -1.32 0.00 0.00 175.29 174.00 2rlz n GLY 67 N 4.84 -0.45 0.20 2.60 0.00 -1.26 -4.75 105.19 106.38 2rlz n GLY 67 Ca -0.15 -1.01 -0.24 0.00 0.00 0.00 0.00 46.02 44.62 2rlz n GLY 67 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2rlz n GLU 68 N 0.00 0.53 0.00 1.61 2.13 -1.26 -4.37 120.64 119.28 2rlz n GLU 68 Ca 0.00 0.23 0.07 0.00 0.66 0.00 0.00 57.16 58.12 2rlz n GLU 68 Cb 0.00 -1.40 0.41 0.00 0.27 0.00 0.00 31.44 30.72 2rlz n GLU 68 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2rlz n ASP 69 N -4.19 0.00 0.00 4.31 8.00 -1.26 -3.49 116.55 119.92 2rlz n ASP 69 Ca -0.43 -0.87 0.00 0.00 0.71 0.00 0.00 54.79 54.20 2rlz n ASP 69 Cb 0.78 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.89 2rlz n ASP 69 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 2rlz n GLU 70 N -0.83 0.00 -0.17 -1.24 0.28 -1.26 -2.93 120.64 114.49 2rlz n GLU 70 Ca 0.10 0.00 -0.01 0.00 -0.16 0.00 0.00 57.16 57.09 2rlz n GLU 70 Cb 0.05 -1.44 0.07 0.00 1.43 0.00 0.00 31.44 31.54 2rlz n GLU 70 CO 0.00 0.00 0.00 0.37 -0.16 0.00 0.00 177.13 177.34 2rlz h GLN 71 N 0.00 0.09 -0.48 3.44 4.15 -1.90 0.40 115.11 120.81 2rlz h GLN 71 Ca 0.00 -0.01 0.14 0.00 0.77 0.00 0.00 58.65 59.55 2rlz h GLN 71 Cb 0.00 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.65 2rlz h GLN 71 CO 0.00 0.06 0.52 0.93 -1.93 0.00 0.00 178.83 178.42 2rlz h GLU 72 N 0.10 0.00 0.31 1.69 4.39 -1.89 0.94 114.58 120.11 2rlz h GLU 72 Ca 0.27 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.96 2rlz h GLU 72 Cb 0.42 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.08 2rlz h GLU 72 CO -0.47 0.00 -0.15 0.00 -1.16 0.00 0.00 179.01 177.23 2rlz h ALA 73 N 1.41 -0.42 0.14 3.43 0.00 -0.44 0.77 119.26 124.15 2rlz h ALA 73 Ca 0.23 -0.18 -0.30 0.00 0.00 0.00 0.00 54.91 54.66 2rlz h ALA 73 Cb 1.27 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.23 2rlz h ALA 73 CO -0.00 -0.57 -1.44 -0.07 0.00 0.00 0.00 179.25 177.16 2rlz h LEU 74 N -0.74 0.46 0.20 0.00 3.38 -1.18 -2.50 115.31 114.92 2rlz h LEU 74 Ca -0.04 -0.57 -0.01 0.00 0.09 0.00 0.00 57.88 57.35 2rlz h LEU 74 Cb 0.50 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2rlz h LEU 74 CO 0.07 1.46 -0.09 -0.08 0.09 0.00 0.00 178.44 179.89 2rlz h GLU 75 N 0.08 -0.26 0.00 1.13 4.81 0.75 -3.32 114.58 117.77 2rlz h GLU 75 Ca -0.21 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.03 2rlz h GLU 75 Cb 2.02 0.06 0.00 0.00 0.63 0.00 0.00 28.75 31.46 2rlz h GLU 75 CO 0.19 -0.17 -0.14 -0.22 -0.73 0.00 0.00 179.01 177.94 2rlz h LYS 76 N -0.46 0.00 -1.00 1.92 1.63 -1.46 -3.25 116.57 113.95 2rlz h LYS 76 Ca -0.03 0.00 0.25 0.00 -0.85 0.00 0.00 60.65 60.03 2rlz h LYS 76 Cb 0.20 0.00 -0.08 0.00 -0.60 0.00 0.00 32.23 31.76 2rlz h LYS 76 CO 0.04 0.00 0.67 -0.07 -3.45 0.00 0.00 179.45 176.64 2rlz h LEU 77 N -0.68 0.35 -0.35 5.20 3.38 -0.92 1.00 115.31 123.28 2rlz h LEU 77 Ca 0.00 0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.90 2rlz h LEU 77 Cb 0.14 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2rlz h LEU 77 CO 0.00 0.09 -0.28 0.00 0.09 0.00 0.00 178.44 178.35 2rlz h ALA 78 N 1.59 0.51 0.02 1.53 0.00 -1.55 0.27 119.26 121.62 2rlz h ALA 78 Ca 0.54 -0.40 -0.20 0.00 0.00 0.00 0.00 54.91 54.84 2rlz h ALA 78 Cb 1.50 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.16 2rlz h ALA 78 CO -0.20 0.52 -0.94 0.00 0.00 0.00 0.00 179.25 178.63 2rlz h ALA 79 N 0.76 0.46 -0.11 0.00 0.00 -0.78 -2.54 119.26 117.05 2rlz h ALA 79 Ca 0.06 -0.80 -0.06 0.00 0.00 0.00 0.00 54.91 54.12 2rlz h ALA 79 Cb 0.85 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 2rlz h ALA 79 CO 0.07 1.03 -0.17 -0.92 0.00 0.00 0.00 179.25 179.26 2rlz h TYR 80 N 0.05 0.38 0.00 0.00 3.20 0.95 -2.89 116.97 118.65 2rlz h TYR 80 Ca -0.04 -0.13 -0.04 0.00 3.14 0.00 0.00 58.73 61.66 2rlz h TYR 80 Cb 1.61 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 39.81 2rlz h TYR 80 CO 0.02 0.77 -0.21 0.28 -1.64 0.00 0.00 178.16 177.38 2rlz h VAL 81 N -0.13 0.74 -0.63 1.81 2.07 -1.02 -2.10 116.25 117.00 2rlz h VAL 81 Ca 0.01 -0.89 -0.22 0.00 0.82 0.00 0.00 66.70 66.43 2rlz h VAL 81 Cb 0.74 1.55 -0.13 0.00 -1.52 0.00 0.00 31.29 31.92 2rlz h VAL 81 CO 0.04 0.21 0.27 0.00 0.02 0.00 0.00 177.57 178.11 2rlz n GLN 82 N -3.68 2.98 -1.57 1.57 1.13 -0.96 -5.03 117.38 111.82 2rlz n GLN 82 Ca -0.01 -2.43 0.06 0.00 -1.94 0.00 0.00 57.00 52.68 2rlz n GLN 82 Cb 0.33 -2.01 -0.03 0.00 0.11 0.00 0.00 30.24 28.64 2rlz n GLN 82 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2rlz n GLU 83 N -0.19 -3.95 -1.75 -1.09 1.02 -0.79 -4.79 120.64 109.09 2rlz n GLU 83 Ca 0.35 3.12 -0.39 0.00 -0.02 0.00 0.00 57.16 60.22 2rlz n GLU 83 Cb 1.23 -4.07 0.03 0.00 -0.02 0.00 0.00 31.44 28.61 2rlz n GLU 83 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2rlz n GLU 84 N -3.24 1.92 0.00 3.49 1.02 -1.26 -4.66 120.64 117.92 2rlz n GLU 84 Ca -0.03 0.70 0.00 0.00 -0.02 0.00 0.00 57.16 57.80 2rlz n GLU 84 Cb 0.57 -2.61 0.00 0.00 -0.02 0.00 0.00 31.44 29.38 2rlz n GLU 84 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59