#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k70 n SER 2 N 0.00 0.00 -4.66 1.61 3.41 -1.26 -5.01 113.62 107.70 2k70 n SER 2 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 2k70 n SER 2 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2k70 n SER 2 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2k70 s PHE 3 N 0.00 2.00 0.00 7.33 0.40 -1.26 -2.94 117.98 123.51 2k70 s PHE 3 Ca 0.00 0.18 0.00 0.00 -0.60 0.00 0.00 56.93 56.51 2k70 s PHE 3 Cb 0.00 -3.93 0.00 0.00 0.51 0.00 0.00 43.02 39.60 2k70 s PHE 3 CO 0.00 -3.93 0.00 2.41 0.70 0.00 0.00 175.22 174.40 2k70 n THR 4 N 5.39 0.00 -3.39 0.64 -1.04 -1.26 -5.09 114.28 109.52 2k70 n THR 4 Ca 0.17 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.18 2k70 n THR 4 Cb 0.42 -0.45 0.00 0.00 -1.82 0.00 0.00 70.33 68.49 2k70 n THR 4 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 2k70 n GLU 5 N -0.42 0.00 -4.59 -2.82 2.13 -1.15 -4.75 120.64 109.03 2k70 n GLU 5 Ca 0.00 0.00 -0.27 0.00 0.66 0.00 0.00 57.16 57.55 2k70 n GLU 5 Cb 0.18 0.00 -0.09 0.00 0.27 0.00 0.00 31.44 31.81 2k70 n GLU 5 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2k70 s GLY 6 N -0.81 2.63 -0.11 8.31 0.00 -1.26 -2.17 107.32 113.91 2k70 s GLY 6 Ca 0.00 -1.23 -0.15 0.00 0.00 0.00 0.00 44.72 43.34 2k70 s GLY 6 CO 0.00 -1.97 0.40 0.66 0.00 0.00 0.00 173.10 172.19 2k70 s TRP 7 N -3.07 -0.39 0.01 1.90 -2.14 -0.16 -4.09 118.94 111.00 2k70 s TRP 7 Ca 0.22 0.90 -0.12 0.00 2.66 0.00 0.00 56.10 59.75 2k70 s TRP 7 Cb 0.04 0.15 -0.05 0.00 -3.10 0.00 0.00 33.47 30.51 2k70 s TRP 7 CO 0.11 -0.28 0.37 0.08 -2.66 0.00 0.00 176.95 174.58 2k70 s VAL 8 N -0.23 5.11 -0.18 -0.66 1.01 0.30 -1.73 120.40 124.01 2k70 s VAL 8 Ca -0.04 0.63 -0.29 0.00 0.00 0.00 0.00 61.98 62.28 2k70 s VAL 8 Cb -0.03 -3.65 -0.02 0.00 0.00 0.00 0.00 36.38 32.67 2k70 s VAL 8 CO 0.02 0.49 1.39 -0.60 0.00 0.00 0.00 175.10 176.40 2k70 s ARG 9 N -1.35 4.09 0.29 2.72 3.52 0.27 -1.29 118.95 127.20 2k70 s ARG 9 Ca 0.26 1.66 -0.29 0.00 -0.13 0.00 0.00 55.73 57.23 2k70 s ARG 9 Cb -0.15 -3.87 -0.10 0.00 -1.56 0.00 0.00 34.95 29.27 2k70 s ARG 9 CO 0.14 -0.91 1.29 0.12 -0.81 0.00 0.00 175.30 175.13 2k70 s PHE 10 N 4.05 3.15 -0.15 5.12 5.36 -0.07 -4.43 117.98 131.02 2k70 s PHE 10 Ca 0.61 1.38 -0.30 0.00 -0.96 0.00 0.00 56.93 57.66 2k70 s PHE 10 Cb -0.23 -3.63 0.12 0.00 -0.34 0.00 0.00 43.02 38.94 2k70 s PHE 10 CO 0.21 -1.77 0.96 -1.12 -1.46 0.00 0.00 175.22 172.04 2k70 s SER 11 N -0.31 -0.41 -0.08 6.13 0.01 -1.26 -3.64 113.70 114.14 2k70 s SER 11 Ca 0.51 0.45 -0.04 0.00 1.31 0.00 0.00 55.95 58.18 2k70 s SER 11 Cb -0.38 0.35 -0.15 0.00 0.21 0.00 0.00 66.02 66.04 2k70 s SER 11 CO 0.48 -0.37 3.16 -0.81 0.41 0.00 0.00 173.24 176.11 2k70 n PRO 12 N 0.79 1.89 -4.34 12.44 -0.04 -1.26 -4.85 135.00 139.63 2k70 n PRO 12 Ca -0.11 -1.06 -0.19 0.00 -0.04 0.00 0.00 63.50 62.09 2k70 n PRO 12 Cb 0.58 -1.84 -0.10 0.00 -0.04 0.00 0.00 33.50 32.09 2k70 n PRO 12 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k70 s GLY 13 N 1.67 1.40 0.50 0.55 0.00 -1.26 -5.05 107.32 105.13 2k70 s GLY 13 Ca 0.53 -1.60 0.32 0.00 0.00 0.00 0.00 44.72 43.97 2k70 s GLY 13 CO -0.03 -1.68 1.94 -0.56 0.00 0.00 0.00 173.10 172.76 2k70 h PRO 14 N 2.78 0.00 -6.19 2.90 0.13 -1.97 -3.43 132.00 126.21 2k70 h PRO 14 Ca -0.39 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.23 2k70 h PRO 14 Cb 1.22 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.29 2k70 h PRO 14 CO 0.59 0.00 -0.53 0.54 -0.23 0.00 0.00 178.00 178.36 2k70 s ASN 15 N -5.45 5.35 0.14 1.44 2.20 -1.26 -2.26 114.94 115.09 2k70 s ASN 15 Ca 0.02 -0.35 -0.03 0.00 -0.94 0.00 0.00 52.86 51.56 2k70 s ASN 15 Cb 0.09 -1.26 0.01 0.00 -2.00 0.00 0.00 41.25 38.09 2k70 s ASN 15 CO 0.52 -0.08 0.24 0.00 -2.94 0.00 0.00 177.10 174.85 2k70 n ALA 16 N -1.17 -0.43 -2.46 3.54 0.00 0.23 -4.86 120.51 115.35 2k70 n ALA 16 Ca -0.07 -0.52 -0.08 0.00 0.00 0.00 0.00 53.44 52.77 2k70 n ALA 16 Cb 0.58 0.42 -0.08 0.00 0.00 0.00 0.00 19.45 20.37 2k70 n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k70 s ALA 17 N -1.65 -0.05 -0.03 0.00 0.00 -1.26 -0.73 121.76 118.04 2k70 s ALA 17 Ca 0.08 -0.76 0.05 0.00 0.00 0.00 0.00 51.96 51.33 2k70 s ALA 17 Cb -0.01 0.46 -0.01 0.00 0.00 0.00 0.00 23.12 23.56 2k70 s ALA 17 CO 0.06 -0.49 -0.17 0.00 0.00 0.00 0.00 175.76 175.16 2k70 s ALA 18 N -3.88 1.49 -0.06 0.00 0.00 0.24 -0.56 121.76 118.98 2k70 s ALA 18 Ca 0.06 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 51.33 2k70 s ALA 18 Cb 0.05 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 2k70 s ALA 18 CO -0.10 0.31 -0.12 0.71 0.00 0.00 0.00 175.76 176.56 2k70 s TYR 19 N -0.17 2.78 -0.20 0.00 2.02 -0.70 -2.01 117.35 119.07 2k70 s TYR 19 Ca 0.01 -0.16 -0.28 0.00 -0.37 0.00 0.00 57.07 56.27 2k70 s TYR 19 Cb -0.09 -1.68 0.11 0.00 -0.40 0.00 0.00 41.96 39.90 2k70 s TYR 19 CO 0.01 0.18 0.92 -0.48 -1.57 0.00 0.00 175.55 174.61 2k70 s LEU 20 N -0.61 -0.49 -0.01 -1.29 -0.00 -0.36 -0.99 118.68 114.93 2k70 s LEU 20 Ca 0.09 0.75 -0.29 0.00 -0.00 0.00 0.00 54.13 54.68 2k70 s LEU 20 Cb -0.11 2.05 -0.03 0.00 -0.00 0.00 0.00 46.19 48.10 2k70 s LEU 20 CO 0.01 -0.30 0.94 -0.89 -0.00 0.00 0.00 176.35 176.11 2k70 s THR 21 N -0.45 4.89 0.01 5.48 2.01 -0.92 -0.44 115.64 126.22 2k70 s THR 21 Ca -0.01 1.97 0.08 0.00 0.31 0.00 0.00 61.69 64.04 2k70 s THR 21 Cb -0.03 -4.28 -0.03 0.00 0.01 0.00 0.00 72.50 68.18 2k70 s THR 21 CO 0.00 0.18 -0.24 -0.22 -0.69 0.00 0.00 174.62 173.64 2k70 s LEU 22 N 0.96 2.22 0.08 4.42 2.96 0.17 -4.77 118.68 124.72 2k70 s LEU 22 Ca 0.50 -0.49 0.06 0.00 -0.22 0.00 0.00 54.13 53.98 2k70 s LEU 22 Cb -0.21 -1.36 -0.03 0.00 0.50 0.00 0.00 46.19 45.10 2k70 s LEU 22 CO 0.27 0.29 -0.17 -1.83 -1.32 0.00 0.00 176.35 173.58 2k70 s GLU 23 N -0.97 0.97 -0.48 1.98 -1.05 -1.26 -1.17 118.70 116.71 2k70 s GLU 23 Ca 0.11 -1.03 -0.12 0.00 -0.15 0.00 0.00 54.97 53.78 2k70 s GLU 23 Cb -0.10 -1.09 0.10 0.00 -0.44 0.00 0.00 34.13 32.61 2k70 s GLU 23 CO 0.01 0.25 0.37 1.21 0.95 0.00 0.00 175.26 178.05 2k70 s ASN 24 N -1.77 5.89 0.01 0.83 2.47 -0.34 -4.96 114.94 117.06 2k70 s ASN 24 Ca 0.02 -1.69 0.23 0.00 0.42 0.00 0.00 52.86 51.84 2k70 s ASN 24 Cb -0.10 -2.09 0.97 0.00 -1.45 0.00 0.00 41.25 38.59 2k70 s ASN 24 CO 0.03 -0.69 1.73 -0.81 -3.72 0.00 0.00 177.10 173.64 2k70 n PRO 25 N 5.05 0.01 -2.08 0.43 -0.04 -1.26 -0.99 135.00 136.12 2k70 n PRO 25 Ca -0.11 0.11 -0.29 0.00 -0.04 0.00 0.00 63.50 63.18 2k70 n PRO 25 Cb 0.42 -1.51 0.18 0.00 -0.04 0.00 0.00 33.50 32.54 2k70 n PRO 25 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k70 s GLY 26 N -3.02 1.79 0.00 0.55 0.00 -1.26 -4.71 107.32 100.66 2k70 s GLY 26 Ca 0.11 -1.36 0.17 0.00 0.00 0.00 0.00 44.72 43.63 2k70 s GLY 26 CO 0.42 -0.61 0.91 1.22 0.00 0.00 0.00 173.10 175.04 2k70 n ASP 27 N -3.60 1.83 -4.42 1.64 9.92 -1.26 -2.44 116.55 118.21 2k70 n ASP 27 Ca 0.16 -1.41 -0.25 0.00 -0.53 0.00 0.00 54.79 52.76 2k70 n ASP 27 Cb 0.60 0.36 -0.11 0.00 -0.64 0.00 0.00 41.12 41.33 2k70 n ASP 27 CO 0.00 0.00 0.00 -1.48 0.13 0.00 0.00 177.20 175.85 2k70 s LEU 28 N -1.92 2.48 0.48 0.64 0.05 -1.26 -4.80 118.68 114.35 2k70 s LEU 28 Ca 0.15 -0.92 -0.19 0.00 0.05 0.00 0.00 54.13 53.22 2k70 s LEU 28 Cb 0.14 -1.07 -0.09 0.00 -2.05 0.00 0.00 46.19 43.12 2k70 s LEU 28 CO 0.37 0.06 0.98 -2.16 -0.55 0.00 0.00 176.35 175.05 2k70 s PRO 29 N -2.97 4.01 0.02 1.48 0.04 -1.26 -4.22 135.00 132.10 2k70 s PRO 29 Ca 0.22 1.11 0.01 0.00 0.04 0.00 0.00 61.00 62.38 2k70 s PRO 29 Cb -0.06 -2.14 -0.04 0.00 0.04 0.00 0.00 34.50 32.29 2k70 s PRO 29 CO 0.11 -0.22 0.08 -0.51 0.04 0.00 0.00 177.00 176.50 2k70 s LEU 30 N -3.61 3.88 -0.18 -3.56 1.43 -0.13 -4.97 118.68 111.55 2k70 s LEU 30 Ca 0.62 0.10 -0.02 0.00 -1.03 0.00 0.00 54.13 53.80 2k70 s LEU 30 Cb -0.11 -2.36 0.05 0.00 0.03 0.00 0.00 46.19 43.80 2k70 s LEU 30 CO 0.22 0.24 0.02 -0.60 0.23 0.00 0.00 176.35 176.46 2k70 s ARG 31 N -1.96 0.73 -0.49 1.70 3.52 -1.26 -0.35 118.95 120.83 2k70 s ARG 31 Ca 0.25 -0.38 -0.20 0.00 -0.13 0.00 0.00 55.73 55.27 2k70 s ARG 31 Cb -0.12 -1.97 0.04 0.00 -1.56 0.00 0.00 34.95 31.34 2k70 s ARG 31 CO 0.17 -0.58 0.68 -1.17 -0.81 0.00 0.00 175.30 173.59 2k70 s LEU 32 N 1.85 4.68 -0.02 -0.88 1.98 0.84 -1.37 118.68 125.76 2k70 s LEU 32 Ca -0.00 -0.65 0.14 0.00 -2.89 0.00 0.00 54.13 50.73 2k70 s LEU 32 Cb -0.16 -2.59 -0.20 0.00 0.66 0.00 0.00 46.19 43.89 2k70 s LEU 32 CO -0.08 -0.91 0.36 1.33 -1.89 0.00 0.00 176.35 175.17 2k70 n VAL 33 N 5.78 0.00 -3.47 1.68 0.24 0.09 -0.46 118.33 122.19 2k70 n VAL 33 Ca -0.04 -0.29 -0.05 0.00 -2.04 0.00 0.00 64.34 61.92 2k70 n VAL 33 Cb 0.46 0.35 0.01 0.00 -1.47 0.00 0.00 33.84 33.20 2k70 n VAL 33 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k70 n GLY 34 N 1.63 1.59 2.73 7.63 0.00 -0.91 -4.77 105.19 113.09 2k70 n GLY 34 Ca -0.01 -1.18 -0.08 0.00 0.00 0.00 0.00 46.02 44.74 2k70 n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k70 n ALA 35 N -1.72 -1.05 -3.24 4.61 0.00 -1.26 -0.98 120.51 116.88 2k70 n ALA 35 Ca -0.09 -1.02 -0.09 0.00 0.00 0.00 0.00 53.44 52.24 2k70 n ALA 35 Cb 0.31 0.81 -0.04 0.00 0.00 0.00 0.00 19.45 20.54 2k70 n ALA 35 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2k70 s ARG 36 N -2.21 1.38 -0.20 0.00 0.52 -0.48 -4.82 118.95 113.15 2k70 s ARG 36 Ca 0.14 -0.94 -0.29 0.00 -0.52 0.00 0.00 55.73 54.12 2k70 s ARG 36 Cb -0.03 0.50 0.13 0.00 0.52 0.00 0.00 34.95 36.07 2k70 s ARG 36 CO 0.11 -0.58 1.03 -0.08 0.02 0.00 0.00 175.30 175.79 2k70 s THR 37 N -3.90 0.00 -0.16 0.02 -1.32 -1.26 -0.54 115.64 108.48 2k70 s THR 37 Ca 0.11 0.00 0.29 0.00 -1.21 0.00 0.00 61.69 60.89 2k70 s THR 37 Cb -0.01 -1.00 0.32 0.00 -1.51 0.00 0.00 72.50 70.31 2k70 s THR 37 CO -0.01 0.00 1.86 1.55 -2.21 0.00 0.00 174.62 175.81 2k70 h PRO 38 N 2.96 0.00 -0.92 7.08 0.13 -2.00 -3.29 132.00 135.97 2k70 h PRO 38 Ca -0.21 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.31 2k70 h PRO 38 Cb 1.17 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 31.93 2k70 h PRO 38 CO 0.26 0.00 -0.06 1.33 -0.23 0.00 0.00 178.00 179.29 2k70 n VAL 39 N -2.68 3.01 -3.94 1.56 0.24 -1.26 -4.50 118.33 110.77 2k70 n VAL 39 Ca 0.01 -3.71 -0.09 0.00 -2.04 0.00 0.00 64.34 58.51 2k70 n VAL 39 Cb 0.26 -1.16 -0.04 0.00 -1.47 0.00 0.00 33.84 31.43 2k70 n VAL 39 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k70 s ALA 40 N -3.71 -0.51 -0.04 2.33 0.00 -1.24 -3.88 121.76 114.71 2k70 s ALA 40 Ca 0.57 -0.69 -0.07 0.00 0.00 0.00 0.00 51.96 51.76 2k70 s ALA 40 Cb 0.45 1.00 -0.02 0.00 0.00 0.00 0.00 23.12 24.54 2k70 s ALA 40 CO -0.00 -0.88 -0.14 -1.91 0.00 0.00 0.00 175.76 172.83 2k70 n GLU 41 N -0.39 0.21 -2.89 0.00 0.00 0.13 -4.83 120.64 112.87 2k70 n GLU 41 Ca -0.03 0.08 -0.41 0.00 0.00 0.00 0.00 57.16 56.80 2k70 n GLU 41 Cb 0.61 -0.80 -0.04 0.00 0.00 0.00 0.00 31.44 31.22 2k70 n GLU 41 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 2k70 s ARG 42 N -2.04 4.31 0.31 5.31 1.81 -1.05 -4.99 118.95 122.61 2k70 s ARG 42 Ca -0.11 1.02 -0.00 0.00 -1.72 0.00 0.00 55.73 54.92 2k70 s ARG 42 Cb 0.02 -3.57 -0.04 0.00 -0.45 0.00 0.00 34.95 30.91 2k70 s ARG 42 CO 0.17 -0.30 0.52 0.54 -0.68 0.00 0.00 175.30 175.54 2k70 s VAL 43 N 2.06 5.11 0.07 3.52 0.11 -1.26 -0.90 120.40 129.12 2k70 s VAL 43 Ca 0.39 -0.38 -0.15 0.00 -2.93 0.00 0.00 61.98 58.91 2k70 s VAL 43 Cb -0.17 -3.82 0.03 0.00 -1.53 0.00 0.00 36.38 30.89 2k70 s VAL 43 CO 0.13 -0.45 0.34 -0.70 -3.33 0.00 0.00 175.10 171.09 2k70 s GLU 44 N -4.01 0.92 -0.21 1.54 -6.30 -0.07 -4.99 118.70 105.58 2k70 s GLU 44 Ca 0.40 -0.60 0.01 0.00 -2.50 0.00 0.00 54.97 52.28 2k70 s GLU 44 Cb -0.10 0.40 0.05 0.00 0.00 0.00 0.00 34.13 34.48 2k70 s GLU 44 CO 0.34 -0.32 -0.09 -1.17 0.02 0.00 0.00 175.26 174.04 2k70 s LEU 45 N -2.39 2.41 0.23 2.70 2.96 -1.26 -0.54 118.68 122.79 2k70 s LEU 45 Ca -0.01 -1.00 0.10 0.00 -0.22 0.00 0.00 54.13 53.01 2k70 s LEU 45 Cb 0.01 -1.22 -0.05 0.00 0.50 0.00 0.00 46.19 45.43 2k70 s LEU 45 CO -0.07 -0.18 -0.19 -1.00 -1.32 0.00 0.00 176.35 173.59 2k70 s HIS 46 N 1.39 2.09 0.39 5.38 3.76 -0.29 -0.59 115.29 127.42 2k70 s HIS 46 Ca -0.03 -0.41 0.06 0.00 -0.15 0.00 0.00 55.06 54.53 2k70 s HIS 46 Cb -0.17 -0.97 0.07 0.00 1.11 0.00 0.00 32.58 32.62 2k70 s HIS 46 CO -0.07 0.54 0.54 -0.85 -0.85 0.00 0.00 174.74 174.04 2k70 n GLU 47 N -0.24 0.71 -3.63 1.40 -0.00 -0.23 -1.07 120.64 117.58 2k70 n GLU 47 Ca -0.08 -2.06 -0.15 0.00 -0.00 0.00 0.00 57.16 54.86 2k70 n GLU 47 Cb 0.59 -0.17 -0.07 0.00 -0.00 0.00 0.00 31.44 31.78 2k70 n GLU 47 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 2k70 s THR 48 N -1.41 0.01 0.29 3.84 2.01 -1.19 -3.88 115.64 115.30 2k70 s THR 48 Ca 0.41 -0.07 -0.05 0.00 0.31 0.00 0.00 61.69 62.28 2k70 s THR 48 Cb -0.03 -0.86 0.02 0.00 0.01 0.00 0.00 72.50 71.64 2k70 s THR 48 CO 0.26 -0.04 0.48 2.22 -0.69 0.00 0.00 174.62 176.84 2k70 n PHE 49 N 1.89 -1.57 -4.94 4.92 -1.74 -0.35 -4.11 117.46 111.56 2k70 n PHE 49 Ca -0.17 -1.70 -0.31 0.00 -0.56 0.00 0.00 57.45 54.72 2k70 n PHE 49 Cb 0.56 0.55 -0.14 0.00 1.52 0.00 0.00 39.48 41.97 2k70 n PHE 49 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2k70 s MET 50 N -2.41 1.96 0.14 3.97 0.23 -1.26 -1.20 119.30 120.73 2k70 s MET 50 Ca 0.19 -1.02 -0.17 0.00 -1.03 0.00 0.00 55.69 53.65 2k70 s MET 50 Cb -0.02 -2.06 0.04 0.00 -1.53 0.00 0.00 34.83 31.26 2k70 s MET 50 CO 0.14 0.53 0.44 0.50 -2.03 0.00 0.00 175.02 174.60 2k70 s ARG 51 N -1.11 1.12 0.00 3.16 3.00 0.02 -4.89 118.95 120.24 2k70 s ARG 51 Ca 0.12 -0.68 0.06 0.00 -1.00 0.00 0.00 55.73 54.23 2k70 s ARG 51 Cb -0.10 0.49 -0.03 0.00 0.00 0.00 0.00 34.95 35.31 2k70 s ARG 51 CO 0.02 -0.45 -0.19 -2.00 0.00 0.00 0.00 175.30 172.68 2k70 s GLU 52 N -3.80 2.18 0.00 5.12 2.56 -1.26 -0.16 118.70 123.34 2k70 s GLU 52 Ca 0.03 -0.90 0.00 0.00 0.00 0.00 0.00 54.97 54.10 2k70 s GLU 52 Cb 0.01 -2.20 0.00 0.00 2.00 0.00 0.00 34.13 33.94 2k70 s GLU 52 CO -0.12 0.57 0.00 0.28 -0.56 0.00 0.00 175.26 175.43 2k70 n VAL 53 N 1.95 0.00 -0.38 3.70 0.31 0.05 -4.88 118.33 119.08 2k70 n VAL 53 Ca -0.16 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.14 2k70 n VAL 53 Cb 0.52 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 33.41 2k70 n VAL 53 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2k70 n GLU 54 N 0.00 0.76 -1.12 5.55 4.71 -1.26 -4.15 120.64 125.13 2k70 n GLU 54 Ca 0.00 -0.23 -0.04 0.00 -0.01 0.00 0.00 57.16 56.88 2k70 n GLU 54 Cb 0.00 -1.46 -0.02 0.00 -1.01 0.00 0.00 31.44 28.95 2k70 n GLU 54 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2k70 n GLY 55 N 2.16 0.71 3.43 0.62 0.00 -1.26 -5.03 105.19 105.82 2k70 n GLY 55 Ca 0.10 -0.67 -0.44 0.00 0.00 0.00 0.00 46.02 45.00 2k70 n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k70 s LYS 56 N -2.08 3.08 -0.08 1.61 1.02 -1.26 -5.06 119.74 116.97 2k70 s LYS 56 Ca 0.00 -1.01 -0.30 0.00 0.02 0.00 0.00 55.97 54.69 2k70 s LYS 56 Cb 0.00 -4.09 -0.03 0.00 -0.52 0.00 0.00 37.83 33.19 2k70 s LYS 56 CO 0.00 -1.11 1.20 -1.59 -0.92 0.00 0.00 175.35 172.93 2k70 s LYS 57 N 2.27 4.33 0.29 1.68 0.00 -1.26 -0.77 119.74 126.28 2k70 s LYS 57 Ca 0.11 1.66 0.01 0.00 0.00 0.00 0.00 55.97 57.76 2k70 s LYS 57 Cb -0.20 -3.59 -0.02 0.00 0.00 0.00 0.00 37.83 34.01 2k70 s LYS 57 CO 0.11 -0.49 0.30 0.54 0.00 0.00 0.00 175.35 175.81 2k70 s VAL 58 N 2.44 0.00 0.09 1.79 0.11 0.78 -4.99 120.40 120.62 2k70 s VAL 58 Ca 0.55 -1.86 0.08 0.00 -2.93 0.00 0.00 61.98 57.82 2k70 s VAL 58 Cb -0.24 -2.51 -0.03 0.00 -1.53 0.00 0.00 36.38 32.07 2k70 s VAL 58 CO 0.20 0.00 -0.21 -0.04 -3.33 0.00 0.00 175.10 171.72 2k70 s MET 59 N -3.59 1.17 0.28 1.54 -1.94 -1.26 -0.80 119.30 114.70 2k70 s MET 59 Ca 0.37 -1.13 0.04 0.00 -1.71 0.00 0.00 55.69 53.25 2k70 s MET 59 Cb 0.03 -1.42 -0.06 0.00 2.01 0.00 0.00 34.83 35.39 2k70 s MET 59 CO 0.20 0.34 0.03 0.20 -0.01 0.00 0.00 175.02 175.78 2k70 s GLY 60 N -1.79 1.81 -0.15 -0.03 0.00 -0.34 -4.91 107.32 101.91 2k70 s GLY 60 Ca 0.07 -1.91 -0.12 0.00 0.00 0.00 0.00 44.72 42.76 2k70 s GLY 60 CO 0.04 -1.73 0.38 -0.29 0.00 0.00 0.00 173.10 171.50 2k70 s MET 61 N -3.89 0.42 0.01 2.90 0.00 -1.26 -1.21 119.30 116.27 2k70 s MET 61 Ca 0.33 0.59 -0.08 0.00 0.00 0.00 0.00 55.69 56.53 2k70 s MET 61 Cb 0.07 0.14 0.00 0.00 0.00 0.00 0.00 34.83 35.05 2k70 s MET 61 CO 0.12 -0.08 0.16 1.03 0.00 0.00 0.00 175.02 176.25 2k70 s ARG 62 N 0.54 0.53 0.58 4.11 1.81 -1.25 -5.03 118.95 120.25 2k70 s ARG 62 Ca -0.03 -0.41 -0.15 0.00 -1.72 0.00 0.00 55.73 53.42 2k70 s ARG 62 Cb -0.04 0.22 -0.04 0.00 -0.45 0.00 0.00 34.95 34.63 2k70 s ARG 62 CO -0.03 -0.13 1.03 -1.25 -0.68 0.00 0.00 175.30 174.24 2k70 s PRO 63 N -1.51 3.49 0.05 3.54 0.04 -1.26 -1.06 135.00 138.27 2k70 s PRO 63 Ca -0.14 1.07 0.04 0.00 0.04 0.00 0.00 61.00 62.01 2k70 s PRO 63 Cb -0.07 -2.06 -0.02 0.00 0.04 0.00 0.00 34.50 32.39 2k70 s PRO 63 CO 0.01 -0.66 -0.11 0.14 0.04 0.00 0.00 177.00 176.42 2k70 s VAL 64 N -2.62 0.87 0.10 -0.36 -7.23 0.25 -4.80 120.40 106.61 2k70 s VAL 64 Ca 0.61 -1.04 0.27 0.00 -1.81 0.00 0.00 61.98 60.01 2k70 s VAL 64 Cb -0.14 -0.84 0.29 0.00 0.56 0.00 0.00 36.38 36.25 2k70 s VAL 64 CO 0.38 -0.17 1.86 1.55 -0.31 0.00 0.00 175.10 178.41 2k70 h PRO 65 N 4.71 0.00 -1.87 4.82 0.13 -1.96 -3.44 132.00 134.39 2k70 h PRO 65 Ca -0.37 0.00 0.28 0.00 -0.87 0.00 0.00 66.00 65.04 2k70 h PRO 65 Cb 1.19 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.23 2k70 h PRO 65 CO 0.42 0.15 0.74 -0.59 -0.23 0.00 0.00 178.00 178.49 2k70 s PHE 66 N -3.64 -0.03 0.29 1.56 -0.12 -1.26 -4.71 117.98 110.06 2k70 s PHE 66 Ca 0.01 -0.15 0.10 0.00 -0.05 0.00 0.00 56.93 56.84 2k70 s PHE 66 Cb 0.10 0.59 -0.05 0.00 -0.63 0.00 0.00 43.02 43.03 2k70 s PHE 66 CO 0.61 -0.47 -0.04 -0.51 -0.05 0.00 0.00 175.22 174.76 2k70 s LEU 67 N -3.16 3.03 0.07 -1.99 1.43 0.39 -4.99 118.68 113.46 2k70 s LEU 67 Ca 0.17 -0.80 0.04 0.00 -1.03 0.00 0.00 54.13 52.51 2k70 s LEU 67 Cb 0.02 -1.52 -0.03 0.00 0.03 0.00 0.00 46.19 44.69 2k70 s LEU 67 CO -0.01 -0.04 -0.11 -0.70 0.23 0.00 0.00 176.35 175.72 2k70 s GLU 68 N -3.65 0.72 -0.03 1.70 2.12 -1.26 -0.11 118.70 118.18 2k70 s GLU 68 Ca 0.32 -0.93 0.00 0.00 0.36 0.00 0.00 54.97 54.72 2k70 s GLU 68 Cb -0.05 -0.56 0.03 0.00 0.26 0.00 0.00 34.13 33.81 2k70 s GLU 68 CO 0.19 0.11 0.01 0.08 -0.54 0.00 0.00 175.26 175.11 2k70 s VAL 69 N -1.58 0.13 0.87 3.70 1.01 0.53 -4.94 120.40 120.11 2k70 s VAL 69 Ca -0.03 0.12 -0.11 0.00 0.00 0.00 0.00 61.98 61.96 2k70 s VAL 69 Cb -0.08 -0.24 0.11 0.00 0.00 0.00 0.00 36.38 36.17 2k70 s VAL 69 CO 0.01 0.14 1.09 -2.16 0.00 0.00 0.00 175.10 174.18 2k70 s PRO 70 N 1.11 1.50 0.39 2.72 0.04 -1.26 -0.96 135.00 138.54 2k70 s PRO 70 Ca -0.09 0.80 -0.27 0.00 0.04 0.00 0.00 61.00 61.48 2k70 s PRO 70 Cb -0.13 -1.84 -0.10 0.00 0.04 0.00 0.00 34.50 32.47 2k70 s PRO 70 CO -0.02 -2.07 1.45 -1.25 0.04 0.00 0.00 177.00 175.15 2k70 s PRO 71 N -4.98 4.02 0.00 0.56 0.04 -1.26 -2.58 135.00 130.80 2k70 s PRO 71 Ca 0.63 2.48 0.00 0.00 0.04 0.00 0.00 61.00 64.15 2k70 s PRO 71 Cb -0.17 -2.89 0.00 0.00 0.04 0.00 0.00 34.50 31.48 2k70 s PRO 71 CO 0.56 -0.57 0.00 1.63 0.04 0.00 0.00 177.00 178.66 2k70 n LYS 72 N 0.31 0.00 -2.23 4.56 4.76 -0.16 -4.98 118.16 120.42 2k70 n LYS 72 Ca 0.02 0.00 -0.26 0.00 -2.87 0.00 0.00 58.31 55.20 2k70 n LYS 72 Cb 0.40 -3.61 0.07 0.00 -1.84 0.00 0.00 35.03 30.06 2k70 n LYS 72 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2k70 s GLY 73 N -2.00 1.70 0.18 0.72 0.00 -1.07 -4.82 107.32 102.04 2k70 s GLY 73 Ca 0.00 -1.00 0.10 0.00 0.00 0.00 0.00 44.72 43.82 2k70 s GLY 73 CO 0.00 -0.58 -0.22 0.50 0.00 0.00 0.00 173.10 172.81 2k70 s ARG 74 N -5.24 1.40 -0.02 2.90 0.52 -1.26 -1.20 118.95 116.04 2k70 s ARG 74 Ca 0.61 -1.46 -0.02 0.00 -0.52 0.00 0.00 55.73 54.35 2k70 s ARG 74 Cb -0.10 -1.61 0.01 0.00 0.52 0.00 0.00 34.95 33.77 2k70 s ARG 74 CO 0.45 0.34 0.06 0.08 0.02 0.00 0.00 175.30 176.25 2k70 s VAL 75 N -1.79 -0.02 -0.13 3.52 1.01 -0.32 -4.97 120.40 117.70 2k70 s VAL 75 Ca 0.18 0.06 -0.06 0.00 0.00 0.00 0.00 61.98 62.16 2k70 s VAL 75 Cb -0.07 -0.10 -0.04 0.00 0.00 0.00 0.00 36.38 36.17 2k70 s VAL 75 CO 0.08 0.02 0.07 -1.61 0.00 0.00 0.00 175.10 173.66 2k70 s GLU 76 N 0.35 3.50 -0.62 2.72 8.01 -1.26 -0.65 118.70 130.74 2k70 s GLU 76 Ca -0.03 -0.30 -0.27 0.00 0.01 0.00 0.00 54.97 54.39 2k70 s GLU 76 Cb -0.04 -3.07 -0.00 0.00 -4.31 0.00 0.00 34.13 26.71 2k70 s GLU 76 CO -0.01 0.57 1.63 -0.51 0.01 0.00 0.00 175.26 176.94 2k70 s LEU 77 N -0.47 3.29 0.14 1.80 1.02 0.42 -4.72 118.68 120.16 2k70 s LEU 77 Ca 0.10 0.17 0.08 0.00 0.02 0.00 0.00 54.13 54.50 2k70 s LEU 77 Cb -0.12 -2.68 -0.04 0.00 0.02 0.00 0.00 46.19 43.37 2k70 s LEU 77 CO 0.02 -2.09 -0.10 -1.59 0.02 0.00 0.00 176.35 172.62 2k70 s LYS 78 N 6.36 2.09 0.13 1.70 -2.85 0.23 -1.22 119.74 126.19 2k70 s LYS 78 Ca 0.57 -1.15 -0.30 0.00 -1.00 0.00 0.00 55.97 54.09 2k70 s LYS 78 Cb -0.12 -2.23 -0.06 0.00 -2.06 0.00 0.00 37.83 33.37 2k70 s LYS 78 CO 0.21 0.47 1.57 -1.00 0.10 0.00 0.00 175.35 176.70 2k70 h PRO 79 N 3.24 -0.47 -2.65 1.78 0.13 -1.94 -1.81 132.00 130.28 2k70 h PRO 79 Ca -0.48 0.03 -0.63 0.00 -0.87 0.00 0.00 66.00 64.06 2k70 h PRO 79 Cb 1.19 0.11 -0.06 0.00 0.13 0.00 0.00 31.00 32.36 2k70 h PRO 79 CO 0.53 -0.31 2.52 0.41 -0.23 0.00 0.00 178.00 180.91 2k70 n GLY 80 N -1.43 4.48 0.00 1.56 0.00 -1.26 -4.83 105.19 103.70 2k70 n GLY 80 Ca -0.04 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.27 2k70 n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k70 n GLY 81 N 2.51 -0.54 3.77 -0.02 0.00 -0.69 -4.84 105.19 105.38 2k70 n GLY 81 Ca 0.66 -0.01 -0.39 0.00 0.00 0.00 0.00 46.02 46.28 2k70 n GLY 81 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k70 s TYR 82 N 0.00 3.23 -0.02 1.61 2.02 -1.19 -3.20 117.35 119.80 2k70 s TYR 82 Ca 0.00 1.57 -0.29 0.00 -0.37 0.00 0.00 57.07 57.98 2k70 s TYR 82 Cb 0.00 -3.42 0.08 0.00 -0.40 0.00 0.00 41.96 38.23 2k70 s TYR 82 CO 0.00 -1.17 0.73 -3.38 -1.57 0.00 0.00 175.55 170.15 2k70 s HIS 83 N -1.28 -0.57 0.31 2.71 -3.43 -0.23 -0.60 115.29 112.20 2k70 s HIS 83 Ca 0.51 0.82 -0.27 0.00 -0.80 0.00 0.00 55.06 55.32 2k70 s HIS 83 Cb -0.33 0.46 -0.09 0.00 -1.43 0.00 0.00 32.58 31.18 2k70 s HIS 83 CO 0.42 -0.61 1.01 -0.06 -2.00 0.00 0.00 174.74 173.50 2k70 s PHE 84 N -1.85 3.62 -0.04 0.38 0.08 -0.85 -1.14 117.98 118.17 2k70 s PHE 84 Ca -0.06 1.75 -0.17 0.00 0.12 0.00 0.00 56.93 58.58 2k70 s PHE 84 Cb -0.00 -3.08 -0.05 0.00 -0.57 0.00 0.00 43.02 39.32 2k70 s PHE 84 CO 0.03 -0.14 0.45 1.41 -0.10 0.00 0.00 175.22 176.86 2k70 s MET 85 N -1.84 4.14 -0.04 0.44 1.75 0.30 -0.59 119.30 123.46 2k70 s MET 85 Ca 0.49 0.45 0.06 0.00 -1.25 0.00 0.00 55.69 55.44 2k70 s MET 85 Cb -0.24 -3.32 -0.02 0.00 2.84 0.00 0.00 34.83 34.09 2k70 s MET 85 CO 0.31 0.45 -0.21 -0.51 -0.65 0.00 0.00 175.02 174.41 2k70 s LEU 86 N -0.34 2.30 0.02 4.11 1.02 0.09 -0.89 118.68 125.00 2k70 s LEU 86 Ca 0.25 -0.38 0.01 0.00 0.02 0.00 0.00 54.13 54.02 2k70 s LEU 86 Cb -0.16 -1.43 -0.02 0.00 0.02 0.00 0.00 46.19 44.60 2k70 s LEU 86 CO 0.12 0.31 -0.04 -0.76 0.02 0.00 0.00 176.35 176.00 2k70 s LEU 87 N -0.53 2.20 -0.11 1.79 1.02 -0.08 -0.60 118.68 122.37 2k70 s LEU 87 Ca 0.07 -0.43 -0.01 0.00 0.02 0.00 0.00 54.13 53.79 2k70 s LEU 87 Cb -0.11 -0.01 0.00 0.00 0.02 0.00 0.00 46.19 46.09 2k70 s LEU 87 CO 0.01 -0.21 0.09 0.61 0.02 0.00 0.00 176.35 176.87 2k70 n GLY 88 N 1.83 0.82 3.43 -3.19 0.00 -0.96 -0.70 105.19 106.42 2k70 n GLY 88 Ca -0.21 -0.60 -0.44 0.00 0.00 0.00 0.00 46.02 44.77 2k70 n GLY 88 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2k70 n LEU 89 N -0.88 -0.62 -0.29 0.99 -0.00 -1.25 -2.92 117.00 112.03 2k70 n LEU 89 Ca -0.00 1.01 0.05 0.00 -0.00 0.00 0.00 56.01 57.07 2k70 n LEU 89 Cb 0.51 -1.05 0.01 0.00 -0.00 0.00 0.00 43.42 42.89 2k70 n LEU 89 CO 0.05 -2.91 0.27 0.29 -0.00 0.00 0.00 177.39 175.09 2k70 n LYS 90 N 0.88 1.68 -4.07 1.47 4.76 -1.26 -4.87 118.16 116.76 2k70 n LYS 90 Ca 0.13 -0.76 -0.11 0.00 -2.87 0.00 0.00 58.31 54.71 2k70 n LYS 90 Cb 0.34 -1.13 -0.11 0.00 -1.84 0.00 0.00 35.03 32.29 2k70 n LYS 90 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2k70 s ARG 91 N -1.31 0.54 0.44 1.97 1.70 -1.26 -5.01 118.95 116.01 2k70 s ARG 91 Ca 0.10 -0.90 -0.24 0.00 -0.47 0.00 0.00 55.73 54.22 2k70 s ARG 91 Cb 0.09 -0.09 -0.08 0.00 -0.57 0.00 0.00 34.95 34.30 2k70 s ARG 91 CO 0.24 -0.01 1.20 -1.25 -1.08 0.00 0.00 175.30 174.40 2k70 s PRO 92 N -2.33 3.85 -0.17 3.89 0.04 -1.26 -5.05 135.00 133.97 2k70 s PRO 92 Ca -0.05 1.90 0.00 0.00 0.04 0.00 0.00 61.00 62.89 2k70 s PRO 92 Cb -0.04 -2.55 0.03 0.00 0.04 0.00 0.00 34.50 31.98 2k70 s PRO 92 CO -0.03 -0.51 -0.10 -0.51 0.04 0.00 0.00 177.00 175.89 2k70 s LEU 93 N -2.77 1.88 -0.13 -3.56 1.02 -1.26 -5.02 118.68 108.84 2k70 s LEU 93 Ca 0.61 -0.67 0.18 0.00 0.02 0.00 0.00 54.13 54.27 2k70 s LEU 93 Cb -0.32 -1.13 0.75 0.00 0.02 0.00 0.00 46.19 45.51 2k70 s LEU 93 CO 0.39 -0.12 1.66 2.29 0.02 0.00 0.00 176.35 180.59 2k70 n LYS 94 N 4.77 3.94 -1.49 1.70 -0.00 -1.26 -4.93 118.16 120.88 2k70 n LYS 94 Ca -0.15 -2.94 0.13 0.00 -0.00 0.00 0.00 58.31 55.36 2k70 n LYS 94 Cb 0.48 -1.96 -0.07 0.00 -0.00 0.00 0.00 35.03 33.48 2k70 n LYS 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2k70 n ALA 95 N 1.09 -3.38 -3.53 0.58 0.00 -1.26 -4.92 120.51 109.09 2k70 n ALA 95 Ca 0.26 0.84 -0.22 0.00 0.00 0.00 0.00 53.44 54.33 2k70 n ALA 95 Cb 0.94 -1.58 0.08 0.00 0.00 0.00 0.00 19.45 18.90 2k70 n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k70 n GLY 96 N -3.94 -0.47 4.04 0.00 0.00 -0.03 -5.01 105.19 99.77 2k70 n GLY 96 Ca -0.07 0.20 -0.20 0.00 0.00 0.00 0.00 46.02 45.95 2k70 n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k70 s GLU 97 N -6.06 2.23 0.12 1.61 0.41 -1.23 -4.91 118.70 110.87 2k70 s GLU 97 Ca 0.44 -1.71 0.08 0.00 -0.41 0.00 0.00 54.97 53.37 2k70 s GLU 97 Cb -0.19 -2.62 -0.04 0.00 -1.78 0.00 0.00 34.13 29.49 2k70 s GLU 97 CO 0.71 -0.95 -0.11 -1.83 -0.49 0.00 0.00 175.26 172.59 2k70 s GLU 98 N -4.71 2.05 -0.08 1.61 4.04 -1.26 -0.25 118.70 120.09 2k70 s GLU 98 Ca 0.62 -1.10 -0.12 0.00 0.04 0.00 0.00 54.97 54.41 2k70 s GLU 98 Cb -0.05 -2.24 0.03 0.00 0.02 0.00 0.00 34.13 31.89 2k70 s GLU 98 CO 0.40 0.49 0.31 0.08 -1.84 0.00 0.00 175.26 174.70 2k70 s VAL 99 N -1.29 0.02 0.02 1.83 1.01 0.15 -4.80 120.40 117.34 2k70 s VAL 99 Ca 0.21 -0.18 -0.04 0.00 0.00 0.00 0.00 61.98 61.98 2k70 s VAL 99 Cb -0.11 -0.51 -0.04 0.00 0.00 0.00 0.00 36.38 35.72 2k70 s VAL 99 CO 0.13 -0.10 0.23 -1.61 0.00 0.00 0.00 175.10 173.76 2k70 s GLU 100 N -0.36 3.51 -0.09 2.72 2.02 -1.26 -1.53 118.70 123.70 2k70 s GLU 100 Ca -0.05 -0.22 0.03 0.00 0.02 0.00 0.00 54.97 54.75 2k70 s GLU 100 Cb -0.03 -3.06 -0.01 0.00 0.10 0.00 0.00 34.13 31.12 2k70 s GLU 100 CO 0.02 0.64 -0.19 -0.51 0.02 0.00 0.00 175.26 175.24 2k70 s LEU 101 N -1.99 2.43 0.07 1.80 2.01 -0.45 -4.02 118.68 118.52 2k70 s LEU 101 Ca 0.29 -0.40 -0.13 0.00 0.01 0.00 0.00 54.13 53.91 2k70 s LEU 101 Cb -0.13 -1.50 -0.06 0.00 0.01 0.00 0.00 46.19 44.51 2k70 s LEU 101 CO 0.19 0.22 0.45 -1.81 1.01 0.00 0.00 176.35 176.40 2k70 s ASP 102 N 0.02 6.76 -0.12 2.29 1.01 0.30 -0.11 116.67 126.83 2k70 s ASP 102 Ca -0.07 0.94 0.03 0.00 0.71 0.00 0.00 52.55 54.16 2k70 s ASP 102 Cb -0.15 -2.24 0.01 0.00 1.01 0.00 0.00 42.92 41.55 2k70 s ASP 102 CO 0.05 0.21 -0.22 -0.76 0.21 0.00 0.00 175.17 174.66 2k70 s LEU 103 N -1.61 2.04 -0.30 1.23 1.02 0.67 -1.38 118.68 120.34 2k70 s LEU 103 Ca 0.31 -0.55 -0.11 0.00 0.02 0.00 0.00 54.13 53.80 2k70 s LEU 103 Cb -0.15 -1.37 -0.02 0.00 0.02 0.00 0.00 46.19 44.67 2k70 s LEU 103 CO 0.17 0.11 0.18 -0.76 0.02 0.00 0.00 176.35 176.06 2k70 s LEU 104 N 0.62 4.11 0.18 1.79 1.43 -0.15 -2.20 118.68 124.46 2k70 s LEU 104 Ca -0.12 -0.32 0.06 0.00 -1.03 0.00 0.00 54.13 52.72 2k70 s LEU 104 Cb -0.17 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 2k70 s LEU 104 CO 0.03 -0.15 0.09 -0.36 0.23 0.00 0.00 176.35 176.19 2k70 s PHE 105 N 1.68 3.03 0.54 0.29 0.08 -0.45 -0.73 117.98 122.42 2k70 s PHE 105 Ca 0.06 -0.07 -0.21 0.00 0.12 0.00 0.00 56.93 56.83 2k70 s PHE 105 Cb -0.17 -1.45 -0.06 0.00 -0.57 0.00 0.00 43.02 40.77 2k70 s PHE 105 CO 0.08 0.52 1.17 0.00 -0.10 0.00 0.00 175.22 176.89 2k70 n ALA 106 N -0.33 0.88 -0.47 5.36 0.00 -0.47 -3.24 120.51 122.24 2k70 n ALA 106 Ca -0.09 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2k70 n ALA 106 Cb 0.55 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.77 2k70 n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k70 n GLY 107 N 1.00 0.76 2.39 0.00 0.00 -1.26 -4.37 105.19 103.71 2k70 n GLY 107 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2k70 n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k70 n GLY 108 N -2.35 0.66 3.72 -0.02 0.00 -1.20 -5.02 105.19 100.98 2k70 n GLY 108 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2k70 n GLY 108 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k70 s LYS 109 N -0.05 4.65 0.13 1.61 2.20 -1.24 -4.96 119.74 122.07 2k70 s LYS 109 Ca 0.00 1.47 0.08 0.00 -0.36 0.00 0.00 55.97 57.16 2k70 s LYS 109 Cb 0.00 -3.39 -0.04 0.00 -1.51 0.00 0.00 37.83 32.89 2k70 s LYS 109 CO 0.00 0.12 -0.09 0.54 -0.36 0.00 0.00 175.35 175.55 2k70 s VAL 110 N 0.28 3.33 -0.26 4.02 0.11 -1.26 -1.34 120.40 125.28 2k70 s VAL 110 Ca 0.49 -1.38 -0.19 0.00 -2.93 0.00 0.00 61.98 57.96 2k70 s VAL 110 Cb -0.23 -2.59 0.07 0.00 -1.53 0.00 0.00 36.38 32.10 2k70 s VAL 110 CO 0.30 0.04 0.67 -0.22 -3.33 0.00 0.00 175.10 172.55 2k70 s LEU 111 N -2.42 -0.72 0.30 2.54 0.20 -0.93 -4.99 118.68 112.66 2k70 s LEU 111 Ca 0.23 1.40 0.07 0.00 0.69 0.00 0.00 54.13 56.52 2k70 s LEU 111 Cb -0.10 2.30 -0.02 0.00 -0.43 0.00 0.00 46.19 47.93 2k70 s LEU 111 CO 0.14 -0.24 0.33 -1.59 -0.29 0.00 0.00 176.35 174.71 2k70 s LYS 112 N 0.97 3.01 0.03 1.98 -2.85 -1.26 -0.24 119.74 121.38 2k70 s LYS 112 Ca -0.05 -1.06 0.03 0.00 -1.00 0.00 0.00 55.97 53.89 2k70 s LYS 112 Cb -0.05 -2.67 -0.02 0.00 -2.06 0.00 0.00 37.83 33.03 2k70 s LYS 112 CO -0.09 0.22 -0.09 0.14 0.10 0.00 0.00 175.35 175.63 2k70 s VAL 113 N -2.17 0.66 -0.09 1.79 -7.23 0.85 -4.97 120.40 109.24 2k70 s VAL 113 Ca 0.39 -0.84 -0.01 0.00 -1.81 0.00 0.00 61.98 59.72 2k70 s VAL 113 Cb -0.08 -0.65 -0.03 0.00 0.56 0.00 0.00 36.38 36.18 2k70 s VAL 113 CO 0.28 -0.15 -0.05 0.54 -0.31 0.00 0.00 175.10 175.41 2k70 s VAL 114 N -0.91 3.89 0.05 1.32 0.11 -1.26 -1.34 120.40 122.25 2k70 s VAL 114 Ca -0.04 -0.40 -0.22 0.00 -2.93 0.00 0.00 61.98 58.40 2k70 s VAL 114 Cb -0.07 -2.62 0.05 0.00 -1.53 0.00 0.00 36.38 32.21 2k70 s VAL 114 CO 0.00 0.58 0.51 -1.48 -3.33 0.00 0.00 175.10 171.38 2k70 s LEU 115 N -0.64 -0.02 0.98 2.54 2.34 -0.58 -4.88 118.68 118.43 2k70 s LEU 115 Ca 0.10 0.14 -0.12 0.00 0.06 0.00 0.00 54.13 54.31 2k70 s LEU 115 Cb -0.12 2.08 0.18 0.00 -0.56 0.00 0.00 46.19 47.78 2k70 s LEU 115 CO 0.02 -0.72 1.11 -2.16 -1.06 0.00 0.00 176.35 173.54 2k70 s PRO 116 N -2.50 0.55 -0.17 1.48 0.04 -1.26 -0.67 135.00 132.47 2k70 s PRO 116 Ca -0.05 0.43 -0.06 0.00 0.04 0.00 0.00 61.00 61.36 2k70 s PRO 116 Cb -0.01 -1.76 -0.04 0.00 0.04 0.00 0.00 34.50 32.74 2k70 s PRO 116 CO -0.02 -2.63 0.05 0.08 0.04 0.00 0.00 177.00 174.51 2k70 s VAL 117 N -3.05 4.67 0.32 -0.36 1.01 0.65 -0.54 120.40 123.10 2k70 s VAL 117 Ca 0.65 -0.08 0.03 0.00 0.00 0.00 0.00 61.98 62.58 2k70 s VAL 117 Cb -0.18 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 2k70 s VAL 117 CO 0.56 0.48 0.15 -1.61 0.00 0.00 0.00 175.10 174.69 2k70 s GLU 118 N 0.19 1.66 -1.03 2.72 2.02 -0.41 -0.85 118.70 123.01 2k70 s GLU 118 Ca 0.03 -1.96 -0.03 0.00 0.02 0.00 0.00 54.97 53.03 2k70 s GLU 118 Cb -0.12 -0.23 0.21 0.00 0.10 0.00 0.00 34.13 34.09 2k70 s GLU 118 CO 0.01 -0.44 2.20 0.00 0.02 0.00 0.00 175.26 177.04 2k70 n ALA 119 N -0.65 6.46 0.00 5.21 0.00 -1.26 -0.89 120.51 129.39 2k70 n ALA 119 Ca -0.00 -4.12 0.00 0.00 0.00 0.00 0.00 53.44 49.31 2k70 n ALA 119 Cb 0.65 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.73 2k70 n ALA 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04