#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 -3.80 1.61 2.88 -1.26 -4.96 113.62 108.09 2k70 n SER 2 Ca 0.00 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.27 2k70 n SER 2 Cb 0.00 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.29 2k70 n SER 2 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 2k70 s PHE 3 N 0.00 1.26 0.00 0.66 -0.71 -1.26 -4.73 117.98 113.19 2k70 s PHE 3 Ca 0.00 -0.89 0.00 0.00 -1.04 0.00 0.00 56.93 55.00 2k70 s PHE 3 Cb 0.00 -1.11 0.00 0.00 -1.21 0.00 0.00 43.02 40.70 2k70 s PHE 3 CO 0.00 -0.58 0.00 -2.37 -1.34 0.00 0.00 175.22 170.93 2k70 n THR 4 N 4.99 0.00 -4.64 -4.49 5.66 -1.26 -5.01 114.28 109.53 2k70 n THR 4 Ca -0.10 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.61 2k70 n THR 4 Cb 0.47 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.19 2k70 n THR 4 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2k70 n GLU 5 N -2.00 0.70 -3.06 1.09 1.02 -1.26 -4.67 120.64 112.45 2k70 n GLU 5 Ca 0.00 -3.55 -0.08 0.00 -0.02 0.00 0.00 57.16 53.51 2k70 n GLU 5 Cb 0.00 1.35 0.01 0.00 -0.02 0.00 0.00 31.44 32.78 2k70 n GLU 5 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k70 n GLY 6 N -0.89 1.68 3.19 0.62 0.00 -1.26 -0.48 105.19 108.05 2k70 n GLY 6 Ca -0.14 -1.31 -0.13 0.00 0.00 0.00 0.00 46.02 44.44 2k70 n GLY 6 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2k70 s TRP 7 N -3.97 -0.19 0.10 1.61 -2.14 -0.15 -4.21 118.94 109.99 2k70 s TRP 7 Ca 0.15 0.38 -0.16 0.00 2.66 0.00 0.00 56.10 59.12 2k70 s TRP 7 Cb -0.02 0.07 -0.07 0.00 -3.10 0.00 0.00 33.47 30.35 2k70 s TRP 7 CO 0.11 -0.28 0.54 0.08 -2.66 0.00 0.00 176.95 174.73 2k70 s VAL 8 N -0.80 4.83 -0.03 -0.66 1.01 -0.04 -2.15 120.40 122.56 2k70 s VAL 8 Ca -0.09 0.98 -0.24 0.00 0.00 0.00 0.00 61.98 62.63 2k70 s VAL 8 Cb -0.05 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 2k70 s VAL 8 CO 0.02 0.39 0.73 -0.60 0.00 0.00 0.00 175.10 175.65 2k70 s ARG 9 N -1.55 4.45 0.16 2.72 3.52 0.09 -1.42 118.95 126.91 2k70 s ARG 9 Ca 0.33 0.96 -0.31 0.00 -0.13 0.00 0.00 55.73 56.58 2k70 s ARG 9 Cb -0.17 -3.42 -0.18 0.00 -1.56 0.00 0.00 34.95 29.63 2k70 s ARG 9 CO 0.18 0.13 0.70 0.34 -0.81 0.00 0.00 175.30 175.85 2k70 n PHE 10 N 3.46 -0.06 -3.51 5.12 -0.00 0.02 -4.38 117.46 118.11 2k70 n PHE 10 Ca -0.01 0.97 0.02 0.00 -0.00 0.00 0.00 57.45 58.42 2k70 n PHE 10 Cb 0.51 -2.02 -0.05 0.00 -0.00 0.00 0.00 39.48 37.92 2k70 n PHE 10 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 2k70 s SER 11 N -0.70 -0.21 0.00 -2.13 0.15 0.47 -4.92 113.70 106.36 2k70 s SER 11 Ca 0.71 0.32 0.29 0.00 0.70 0.00 0.00 55.95 57.97 2k70 s SER 11 Cb -1.00 1.15 1.29 0.00 -1.71 0.00 0.00 66.02 65.75 2k70 s SER 11 CO 0.56 -0.05 1.88 -0.81 1.20 0.00 0.00 173.24 176.02 2k70 n PRO 12 N 3.76 1.48 -0.33 5.44 -0.04 -1.26 -1.51 135.00 142.54 2k70 n PRO 12 Ca -0.14 -0.69 0.00 0.00 -0.04 0.00 0.00 63.50 62.63 2k70 n PRO 12 Cb 0.56 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 2k70 n PRO 12 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k70 n GLY 13 N 1.12 0.55 0.22 0.55 0.00 -1.26 -4.90 105.19 101.46 2k70 n GLY 13 Ca 0.20 -1.89 0.09 0.00 0.00 0.00 0.00 46.02 44.43 2k70 n GLY 13 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k70 h PRO 14 N 0.00 0.00 -4.45 1.61 0.13 -1.97 -3.45 132.00 123.87 2k70 h PRO 14 Ca 0.00 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.95 2k70 h PRO 14 Cb 0.00 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 30.98 2k70 h PRO 14 CO 0.00 0.25 -0.66 0.54 -0.23 0.00 0.00 178.00 177.90 2k70 s ASN 15 N -6.25 0.57 0.22 1.44 2.20 -1.26 -0.66 114.94 111.20 2k70 s ASN 15 Ca 0.00 -1.13 -0.04 0.00 -0.94 0.00 0.00 52.86 50.75 2k70 s ASN 15 Cb 0.11 0.22 0.02 0.00 -2.00 0.00 0.00 41.25 39.60 2k70 s ASN 15 CO 0.64 -0.64 0.36 0.00 -2.94 0.00 0.00 177.10 174.52 2k70 n ALA 16 N -0.05 -0.54 -2.82 3.54 0.00 0.72 -4.76 120.51 116.60 2k70 n ALA 16 Ca -0.09 -0.87 -0.10 0.00 0.00 0.00 0.00 53.44 52.38 2k70 n ALA 16 Cb 0.63 0.70 -0.07 0.00 0.00 0.00 0.00 19.45 20.70 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 -2.02 -0.47 -0.02 0.00 0.00 -1.26 -0.90 121.76 117.09 2k70 s ALA 17 Ca 0.14 -0.28 0.01 0.00 0.00 0.00 0.00 51.96 51.83 2k70 s ALA 17 Cb -0.02 0.39 0.02 0.00 0.00 0.00 0.00 23.12 23.51 2k70 s ALA 17 CO 0.10 -0.45 -0.01 0.00 0.00 0.00 0.00 175.76 175.41 2k70 s ALA 18 N -3.07 0.27 -0.03 0.00 0.00 0.63 -0.73 121.76 118.84 2k70 s ALA 18 Ca -0.01 0.07 0.05 0.00 0.00 0.00 0.00 51.96 52.07 2k70 s ALA 18 Cb 0.01 -0.22 -0.03 0.00 0.00 0.00 0.00 23.12 22.88 2k70 s ALA 18 CO -0.07 -0.02 -0.18 0.71 0.00 0.00 0.00 175.76 176.20 2k70 s TYR 19 N 0.62 2.59 -0.07 0.00 2.02 -0.91 -1.82 117.35 119.78 2k70 s TYR 19 Ca -0.06 -0.24 -0.30 0.00 -0.37 0.00 0.00 57.07 56.10 2k70 s TYR 19 Cb -0.09 -1.57 0.11 0.00 -0.40 0.00 0.00 41.96 40.01 2k70 s TYR 19 CO -0.01 0.15 0.94 -0.48 -1.57 0.00 0.00 175.55 174.58 2k70 s LEU 20 N -0.84 -0.36 -0.45 -1.29 0.05 -0.25 -0.98 118.68 114.56 2k70 s LEU 20 Ca 0.12 0.15 -0.18 0.00 0.05 0.00 0.00 54.13 54.27 2k70 s LEU 20 Cb -0.10 1.94 0.03 0.00 -2.05 0.00 0.00 46.19 46.01 2k70 s LEU 20 CO 0.01 -0.50 0.53 -0.89 -0.55 0.00 0.00 176.35 174.95 2k70 s THR 21 N -2.35 4.99 -0.06 5.48 2.01 0.37 0.05 115.64 126.12 2k70 s THR 21 Ca 0.03 -0.34 -0.23 0.00 0.31 0.00 0.00 61.69 61.46 2k70 s THR 21 Cb -0.01 -4.15 -0.04 0.00 0.01 0.00 0.00 72.50 68.32 2k70 s THR 21 CO -0.05 -0.57 0.69 -0.22 -0.69 0.00 0.00 174.62 173.78 2k70 s LEU 22 N 2.38 4.32 -0.03 4.42 1.98 -0.77 -4.50 118.68 126.49 2k70 s LEU 22 Ca 0.15 1.18 0.02 0.00 -2.89 0.00 0.00 54.13 52.59 2k70 s LEU 22 Cb -0.17 -3.07 0.00 0.00 0.66 0.00 0.00 46.19 43.61 2k70 s LEU 22 CO 0.14 -0.10 -0.09 -1.61 -1.89 0.00 0.00 176.35 172.80 2k70 s GLU 23 N 0.73 1.02 -0.36 1.98 2.02 -1.26 -0.54 118.70 122.29 2k70 s GLU 23 Ca 0.37 -0.31 -0.10 0.00 0.02 0.00 0.00 54.97 54.95 2k70 s GLU 23 Cb -0.18 -0.94 0.03 0.00 0.10 0.00 0.00 34.13 33.14 2k70 s GLU 23 CO 0.18 0.10 0.18 1.21 0.02 0.00 0.00 175.26 176.95 2k70 s ASN 24 N 0.25 5.62 0.06 -0.19 3.84 -0.05 -4.97 114.94 119.50 2k70 s ASN 24 Ca -0.04 -1.02 0.27 0.00 0.21 0.00 0.00 52.86 52.28 2k70 s ASN 24 Cb -0.09 -1.98 0.94 0.00 -0.55 0.00 0.00 41.25 39.57 2k70 s ASN 24 CO 0.01 -0.37 1.76 -0.81 -2.79 0.00 0.00 177.10 174.90 2k70 n PRO 25 N 4.95 0.09 -2.16 0.43 -0.04 -1.26 -1.68 135.00 135.32 2k70 n PRO 25 Ca -0.12 0.06 -0.27 0.00 -0.04 0.00 0.00 63.50 63.13 2k70 n PRO 25 Cb 0.46 -1.59 0.12 0.00 -0.04 0.00 0.00 33.50 32.45 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 -3.19 1.73 0.00 0.55 0.00 -1.26 -4.67 107.32 100.48 2k70 s GLY 26 Ca 0.12 -1.20 0.23 0.00 0.00 0.00 0.00 44.72 43.87 2k70 s GLY 26 CO 0.59 -0.61 1.15 1.22 0.00 0.00 0.00 173.10 175.45 2k70 n ASP 27 N -3.26 2.01 -4.46 1.64 8.00 -1.26 -1.87 116.55 117.36 2k70 n ASP 27 Ca 0.12 -1.50 -0.26 0.00 0.71 0.00 0.00 54.79 53.87 2k70 n ASP 27 Cb 0.60 0.41 -0.11 0.00 -0.02 0.00 0.00 41.12 42.00 2k70 n ASP 27 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 2k70 s LEU 28 N -2.44 2.56 0.35 0.64 0.05 -1.26 -4.82 118.68 113.75 2k70 s LEU 28 Ca 0.20 -0.91 -0.26 0.00 0.05 0.00 0.00 54.13 53.21 2k70 s LEU 28 Cb 0.18 -1.19 -0.09 0.00 -2.05 0.00 0.00 46.19 43.04 2k70 s LEU 28 CO 0.55 0.08 1.04 -2.16 -0.55 0.00 0.00 176.35 175.31 2k70 s PRO 29 N -3.06 4.39 0.09 1.48 0.04 -1.26 -4.17 135.00 132.51 2k70 s PRO 29 Ca 0.25 1.57 0.02 0.00 0.04 0.00 0.00 61.00 62.88 2k70 s PRO 29 Cb -0.07 -2.80 -0.04 0.00 0.04 0.00 0.00 34.50 31.64 2k70 s PRO 29 CO 0.13 0.05 0.15 -0.51 0.04 0.00 0.00 177.00 176.86 2k70 s LEU 30 N -2.15 4.07 -0.19 -3.56 1.43 -0.32 -4.97 118.68 112.99 2k70 s LEU 30 Ca 0.52 0.11 -0.04 0.00 -1.03 0.00 0.00 54.13 53.68 2k70 s LEU 30 Cb -0.25 -2.70 0.08 0.00 0.03 0.00 0.00 46.19 43.35 2k70 s LEU 30 CO 0.31 0.15 0.16 -0.60 0.23 0.00 0.00 176.35 176.60 2k70 s ARG 31 N -2.58 0.13 -0.51 1.70 3.52 -1.26 -0.03 118.95 119.91 2k70 s ARG 31 Ca 0.32 0.06 -0.23 0.00 -0.13 0.00 0.00 55.73 55.74 2k70 s ARG 31 Cb -0.12 -1.51 0.04 0.00 -1.56 0.00 0.00 34.95 31.80 2k70 s ARG 31 CO 0.25 -0.67 0.86 -1.17 -0.81 0.00 0.00 175.30 173.76 2k70 s LEU 32 N 2.23 4.25 -0.01 -0.88 2.96 0.22 -0.42 118.68 127.03 2k70 s LEU 32 Ca 0.05 -0.33 0.13 0.00 -0.22 0.00 0.00 54.13 53.75 2k70 s LEU 32 Cb -0.16 -2.84 -0.18 0.00 0.50 0.00 0.00 46.19 43.51 2k70 s LEU 32 CO -0.11 -1.09 0.32 1.33 -1.32 0.00 0.00 176.35 175.48 2k70 n VAL 33 N 6.12 0.00 -3.75 1.68 0.24 0.05 -0.65 118.33 122.02 2k70 n VAL 33 Ca 0.01 -0.27 -0.09 0.00 -2.04 0.00 0.00 64.34 61.95 2k70 n VAL 33 Cb 0.47 0.36 0.01 0.00 -1.47 0.00 0.00 33.84 33.22 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 1.69 1.39 3.70 7.63 0.00 -1.13 -4.73 105.19 113.74 2k70 n GLY 34 Ca -0.01 -1.31 -0.11 0.00 0.00 0.00 0.00 46.02 44.59 2k70 n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k70 s ALA 35 N -2.08 -0.19 0.22 4.61 0.00 -1.26 -0.74 121.76 122.31 2k70 s ALA 35 Ca 0.16 -1.05 -0.18 0.00 0.00 0.00 0.00 51.96 50.89 2k70 s ALA 35 Cb -0.03 0.81 0.03 0.00 0.00 0.00 0.00 23.12 23.92 2k70 s ALA 35 CO 0.12 -0.92 0.56 1.03 0.00 0.00 0.00 175.76 176.55 2k70 s ARG 36 N -2.37 1.47 -0.24 0.00 0.52 -0.29 -4.84 118.95 113.21 2k70 s ARG 36 Ca 0.21 -0.91 -0.30 0.00 -0.52 0.00 0.00 55.73 54.21 2k70 s ARG 36 Cb -0.04 0.54 0.17 0.00 0.52 0.00 0.00 34.95 36.14 2k70 s ARG 36 CO 0.15 -0.64 1.23 -0.08 0.02 0.00 0.00 175.30 175.99 2k70 s THR 37 N -3.89 0.00 -1.21 0.02 -1.32 -1.26 -1.11 115.64 106.87 2k70 s THR 37 Ca 0.10 0.00 0.29 0.00 -1.21 0.00 0.00 61.69 60.88 2k70 s THR 37 Cb -0.02 -1.00 0.37 0.00 -1.51 0.00 0.00 72.50 70.34 2k70 s THR 37 CO -0.00 0.00 1.97 -0.81 -2.21 0.00 0.00 174.62 173.57 2k70 n PRO 38 N 0.51 0.21 -1.92 7.08 -0.04 -1.26 -3.94 135.00 135.64 2k70 n PRO 38 Ca -0.03 0.01 -0.28 0.00 -0.04 0.00 0.00 63.50 63.16 2k70 n PRO 38 Cb 0.58 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.58 2k70 n PRO 38 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2k70 n VAL 39 N -1.39 2.83 -3.63 0.52 0.24 -1.26 -4.54 118.33 111.10 2k70 n VAL 39 Ca 0.10 -4.02 -0.10 0.00 -2.04 0.00 0.00 64.34 58.29 2k70 n VAL 39 Cb 0.29 -1.17 -0.02 0.00 -1.47 0.00 0.00 33.84 31.46 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 -3.67 -1.35 -0.26 2.33 0.00 -1.25 -3.83 121.76 113.72 2k70 s ALA 40 Ca 0.54 0.09 -0.08 0.00 0.00 0.00 0.00 51.96 52.51 2k70 s ALA 40 Cb 0.43 0.87 -0.13 0.00 0.00 0.00 0.00 23.12 24.29 2k70 s ALA 40 CO -0.03 -0.87 -0.30 -1.91 0.00 0.00 0.00 175.76 172.65 2k70 n GLU 41 N -0.40 0.59 -4.08 0.00 4.07 0.44 -4.85 120.64 116.40 2k70 n GLU 41 Ca -0.11 0.21 -0.36 0.00 -0.06 0.00 0.00 57.16 56.84 2k70 n GLU 41 Cb 0.62 -1.47 -0.08 0.00 -0.06 0.00 0.00 31.44 30.46 2k70 n GLU 41 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 2k70 s ARG 42 N -2.49 3.37 0.11 5.31 0.52 -0.42 -5.02 118.95 120.33 2k70 s ARG 42 Ca -0.36 -0.27 0.01 0.00 -0.52 0.00 0.00 55.73 54.59 2k70 s ARG 42 Cb 0.12 -3.05 -0.04 0.00 0.52 0.00 0.00 34.95 32.51 2k70 s ARG 42 CO 0.51 0.66 0.26 0.54 0.02 0.00 0.00 175.30 177.30 2k70 s VAL 43 N -0.73 5.34 0.03 3.52 0.11 -1.26 -1.13 120.40 126.28 2k70 s VAL 43 Ca 0.12 -0.51 0.02 0.00 -2.93 0.00 0.00 61.98 58.69 2k70 s VAL 43 Cb -0.12 -3.69 -0.02 0.00 -1.53 0.00 0.00 36.38 31.02 2k70 s VAL 43 CO 0.03 0.01 -0.08 -1.61 -3.33 0.00 0.00 175.10 170.11 2k70 s GLU 44 N -2.91 0.54 -0.28 1.54 2.02 -0.05 -4.99 118.70 114.57 2k70 s GLU 44 Ca 0.35 -0.65 -0.10 0.00 0.02 0.00 0.00 54.97 54.60 2k70 s GLU 44 Cb -0.12 -0.38 -0.03 0.00 0.10 0.00 0.00 34.13 33.70 2k70 s GLU 44 CO 0.28 0.08 0.15 -1.17 0.02 0.00 0.00 175.26 174.62 2k70 s LEU 45 N -1.26 3.88 0.21 1.80 2.96 -1.26 -0.37 118.68 124.63 2k70 s LEU 45 Ca -0.06 -0.21 0.10 0.00 -0.22 0.00 0.00 54.13 53.74 2k70 s LEU 45 Cb -0.08 -2.03 -0.05 0.00 0.50 0.00 0.00 46.19 44.53 2k70 s LEU 45 CO 0.00 -0.09 -0.20 -1.00 -1.32 0.00 0.00 176.35 173.74 2k70 s HIS 46 N 1.68 2.12 0.59 5.38 3.76 -0.04 -0.55 115.29 128.24 2k70 s HIS 46 Ca 0.06 -0.40 0.07 0.00 -0.15 0.00 0.00 55.06 54.65 2k70 s HIS 46 Cb -0.16 -1.00 0.09 0.00 1.11 0.00 0.00 32.58 32.62 2k70 s HIS 46 CO 0.07 0.51 0.82 -1.83 -0.85 0.00 0.00 174.74 173.46 2k70 s GLU 47 N -3.03 2.21 -0.03 1.40 -1.05 0.10 -1.05 118.70 117.25 2k70 s GLU 47 Ca 0.22 -1.50 -0.20 0.00 -0.15 0.00 0.00 54.97 53.34 2k70 s GLU 47 Cb -0.06 -2.59 0.04 0.00 -0.44 0.00 0.00 34.13 31.08 2k70 s GLU 47 CO 0.10 -0.94 0.43 0.99 0.95 0.00 0.00 175.26 176.78 2k70 s THR 48 N -2.75 0.04 0.22 1.83 2.01 -1.16 -3.42 115.64 112.41 2k70 s THR 48 Ca 0.62 -0.32 -0.20 0.00 0.31 0.00 0.00 61.69 62.10 2k70 s THR 48 Cb -0.06 -0.74 0.03 0.00 0.01 0.00 0.00 72.50 71.75 2k70 s THR 48 CO 0.40 -0.18 0.62 0.72 -0.69 0.00 0.00 174.62 175.49 2k70 s PHE 49 N -1.28 -0.23 0.03 4.92 -0.12 -0.30 -4.38 117.98 116.62 2k70 s PHE 49 Ca -0.13 -0.12 -0.10 0.00 -0.05 0.00 0.00 56.93 56.53 2k70 s PHE 49 Cb -0.04 0.55 -0.05 0.00 -0.63 0.00 0.00 43.02 42.85 2k70 s PHE 49 CO 0.06 -1.03 0.35 1.41 -0.05 0.00 0.00 175.22 175.97 2k70 s MET 50 N -3.87 3.73 0.00 1.99 -2.45 -1.26 -0.89 119.30 116.56 2k70 s MET 50 Ca 0.08 0.15 -0.11 0.00 -1.25 0.00 0.00 55.69 54.55 2k70 s MET 50 Cb -0.03 -3.08 0.01 0.00 1.25 0.00 0.00 34.83 32.98 2k70 s MET 50 CO -0.01 0.63 0.23 0.50 1.05 0.00 0.00 175.02 177.42 2k70 s ARG 51 N -1.63 0.61 -0.09 4.11 3.00 0.09 -4.91 118.95 120.13 2k70 s ARG 51 Ca 0.28 -0.33 -0.01 0.00 -1.00 0.00 0.00 55.73 54.67 2k70 s ARG 51 Cb -0.14 0.26 -0.03 0.00 0.00 0.00 0.00 34.95 35.04 2k70 s ARG 51 CO 0.15 -0.16 -0.03 -2.00 0.00 0.00 0.00 175.30 173.26 2k70 s GLU 52 N -1.53 3.05 -0.03 5.12 2.56 -1.26 -0.12 118.70 126.50 2k70 s GLU 52 Ca -0.13 -0.47 -0.00 0.00 0.00 0.00 0.00 54.97 54.36 2k70 s GLU 52 Cb -0.06 -2.76 0.03 0.00 2.00 0.00 0.00 34.13 33.35 2k70 s GLU 52 CO 0.02 0.59 0.03 0.08 -0.56 0.00 0.00 175.26 175.43 2k70 s VAL 53 N -0.60 -0.03 -1.88 3.70 1.01 -0.32 -4.86 120.40 117.42 2k70 s VAL 53 Ca 0.09 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.31 2k70 s VAL 53 Cb -0.12 -0.12 0.00 0.00 0.00 0.00 0.00 36.38 36.14 2k70 s VAL 53 CO 0.02 0.11 0.00 -0.62 0.00 0.00 0.00 175.10 174.61 2k70 n GLU 54 N 4.37 -1.40 -1.01 2.72 1.02 -1.26 -0.86 120.64 124.22 2k70 n GLU 54 Ca -0.23 1.12 -0.01 0.00 -0.02 0.00 0.00 57.16 58.02 2k70 n GLU 54 Cb 0.50 -5.45 -0.00 0.00 -0.02 0.00 0.00 31.44 26.47 2k70 n GLU 54 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k70 n GLY 55 N -0.47 0.44 3.33 0.62 0.00 -1.26 -5.02 105.19 102.84 2k70 n GLY 55 Ca -0.18 -0.12 -0.36 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.63 3.35 -0.26 1.61 1.02 -0.04 -5.09 119.74 119.69 2k70 s LYS 56 Ca 0.00 -0.66 -0.16 0.00 0.02 0.00 0.00 55.97 55.17 2k70 s LYS 56 Cb 0.00 -3.13 -0.03 0.00 -0.52 0.00 0.00 37.83 34.15 2k70 s LYS 56 CO 0.00 -0.25 0.43 -1.59 -0.92 0.00 0.00 175.35 173.02 2k70 s LYS 57 N 1.50 4.04 0.43 1.68 -2.85 -1.26 -1.18 119.74 122.11 2k70 s LYS 57 Ca 0.05 0.15 0.00 0.00 -1.00 0.00 0.00 55.97 55.17 2k70 s LYS 57 Cb -0.15 -3.65 -0.00 0.00 -2.06 0.00 0.00 37.83 31.97 2k70 s LYS 57 CO -0.01 -0.30 0.02 1.33 0.10 0.00 0.00 175.35 176.49 2k70 n VAL 58 N 5.10 0.00 -4.35 1.79 0.24 0.83 -4.97 118.33 116.97 2k70 n VAL 58 Ca -0.07 -2.10 -0.24 0.00 -2.04 0.00 0.00 64.34 59.89 2k70 n VAL 58 Cb 0.50 0.46 -0.08 0.00 -1.47 0.00 0.00 33.84 33.25 2k70 n VAL 58 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 2k70 s MET 59 N -3.57 2.06 0.32 7.34 -1.94 -1.26 -0.73 119.30 121.51 2k70 s MET 59 Ca 0.02 -1.68 -0.12 0.00 -1.71 0.00 0.00 55.69 52.20 2k70 s MET 59 Cb 0.00 -1.95 0.02 0.00 2.01 0.00 0.00 34.83 34.91 2k70 s MET 59 CO 0.02 0.22 0.61 0.20 -0.01 0.00 0.00 175.02 176.06 2k70 s GLY 60 N -3.67 0.65 -0.11 -0.03 0.00 -0.06 -4.86 107.32 99.23 2k70 s GLY 60 Ca 0.33 -0.93 -0.21 0.00 0.00 0.00 0.00 44.72 43.92 2k70 s GLY 60 CO 0.19 -0.55 0.51 -0.29 0.00 0.00 0.00 173.10 172.96 2k70 s MET 61 N -3.20 0.75 0.03 2.90 1.75 -1.26 -1.14 119.30 119.12 2k70 s MET 61 Ca 0.21 0.37 -0.12 0.00 -1.25 0.00 0.00 55.69 54.90 2k70 s MET 61 Cb -0.03 0.35 0.01 0.00 2.84 0.00 0.00 34.83 38.01 2k70 s MET 61 CO 0.13 -0.17 0.25 1.03 -0.65 0.00 0.00 175.02 175.60 2k70 s ARG 62 N -0.53 0.73 0.57 4.11 0.52 -1.22 -5.01 118.95 118.11 2k70 s ARG 62 Ca -0.07 -0.51 -0.16 0.00 -0.52 0.00 0.00 55.73 54.47 2k70 s ARG 62 Cb -0.03 0.31 -0.05 0.00 0.52 0.00 0.00 34.95 35.70 2k70 s ARG 62 CO 0.04 -0.22 1.05 -1.25 0.02 0.00 0.00 175.30 174.94 2k70 s PRO 63 N -2.35 3.44 0.04 3.54 0.04 -1.26 -0.72 135.00 137.73 2k70 s PRO 63 Ca -0.07 1.20 -0.00 0.00 0.04 0.00 0.00 61.00 62.17 2k70 s PRO 63 Cb -0.02 -2.05 -0.03 0.00 0.04 0.00 0.00 34.50 32.44 2k70 s PRO 63 CO -0.02 -0.71 -0.04 0.14 0.04 0.00 0.00 177.00 176.41 2k70 s VAL 64 N -2.41 0.22 0.02 -0.36 -7.23 0.29 -4.78 120.40 106.14 2k70 s VAL 64 Ca 0.64 -1.32 0.11 0.00 -1.81 0.00 0.00 61.98 59.60 2k70 s VAL 64 Cb -0.15 -0.84 -0.06 0.00 0.56 0.00 0.00 36.38 35.88 2k70 s VAL 64 CO 0.34 -0.70 1.40 1.55 -0.31 0.00 0.00 175.10 177.38 2k70 h PRO 65 N 3.98 0.00 -1.38 4.82 0.13 -1.95 -3.43 132.00 134.17 2k70 h PRO 65 Ca -0.33 0.00 0.30 0.00 -0.87 0.00 0.00 66.00 65.10 2k70 h PRO 65 Cb 1.18 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.15 2k70 h PRO 65 CO 0.52 0.73 0.85 -0.59 -0.23 0.00 0.00 178.00 179.28 2k70 s PHE 66 N -2.93 -0.07 0.14 1.56 -0.71 -1.26 -4.71 117.98 110.00 2k70 s PHE 66 Ca 0.02 0.01 0.08 0.00 -1.04 0.00 0.00 56.93 56.00 2k70 s PHE 66 Cb 0.09 0.52 -0.04 0.00 -1.21 0.00 0.00 43.02 42.39 2k70 s PHE 66 CO 0.78 -0.19 -0.11 -0.51 -1.34 0.00 0.00 175.22 173.85 2k70 s LEU 67 N -2.54 2.97 0.04 -1.99 1.43 0.17 -4.99 118.68 113.77 2k70 s LEU 67 Ca 0.12 -0.50 0.05 0.00 -1.03 0.00 0.00 54.13 52.76 2k70 s LEU 67 Cb 0.02 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.49 2k70 s LEU 67 CO -0.04 0.14 -0.09 -0.70 0.23 0.00 0.00 176.35 175.89 2k70 s GLU 68 N -2.52 2.40 -0.08 1.70 2.56 -1.26 -0.61 118.70 120.89 2k70 s GLU 68 Ca 0.23 -0.83 -0.01 0.00 0.00 0.00 0.00 54.97 54.36 2k70 s GLU 68 Cb -0.10 -2.42 0.03 0.00 2.00 0.00 0.00 34.13 33.64 2k70 s GLU 68 CO 0.14 0.57 -0.01 0.08 -0.56 0.00 0.00 175.26 175.48 2k70 s VAL 69 N -1.05 0.49 0.74 3.70 1.01 0.96 -4.88 120.40 121.37 2k70 s VAL 69 Ca 0.18 0.04 -0.11 0.00 0.00 0.00 0.00 61.98 62.09 2k70 s VAL 69 Cb -0.11 -0.63 0.04 0.00 0.00 0.00 0.00 36.38 35.68 2k70 s VAL 69 CO 0.09 0.27 1.09 -2.16 0.00 0.00 0.00 175.10 174.39 2k70 s PRO 70 N 1.92 2.42 0.35 2.72 0.04 -1.26 -1.17 135.00 140.02 2k70 s PRO 70 Ca 0.05 1.19 -0.29 0.00 0.04 0.00 0.00 61.00 61.99 2k70 s PRO 70 Cb -0.12 -1.92 -0.11 0.00 0.04 0.00 0.00 34.50 32.39 2k70 s PRO 70 CO -0.06 -1.52 1.52 -1.25 0.04 0.00 0.00 177.00 175.73 2k70 s PRO 71 N -4.77 4.11 0.00 0.56 0.04 -1.26 -2.00 135.00 131.68 2k70 s PRO 71 Ca 0.62 2.58 0.00 0.00 0.04 0.00 0.00 61.00 64.24 2k70 s PRO 71 Cb -0.17 -2.98 0.00 0.00 0.04 0.00 0.00 34.50 31.38 2k70 s PRO 71 CO 0.53 -0.57 0.00 1.63 0.04 0.00 0.00 177.00 178.63 2k70 n LYS 72 N 0.96 0.00 -2.19 4.56 4.76 -0.68 -4.95 118.16 120.62 2k70 n LYS 72 Ca 0.03 0.00 -0.17 0.00 -2.87 0.00 0.00 58.31 55.30 2k70 n LYS 72 Cb 0.39 -3.74 0.08 0.00 -1.84 0.00 0.00 35.03 29.92 2k70 n LYS 72 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k70 n GLY 73 N -2.00 0.95 3.28 0.72 0.00 -0.85 -4.82 105.19 102.48 2k70 n GLY 73 Ca 0.00 -2.05 -0.13 0.00 0.00 0.00 0.00 46.02 43.84 2k70 n GLY 73 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2k70 s ARG 74 N -4.36 0.80 -0.20 1.61 1.70 -1.26 -0.87 118.95 116.36 2k70 s ARG 74 Ca 0.50 -0.29 -0.08 0.00 -0.47 0.00 0.00 55.73 55.38 2k70 s ARG 74 Cb -0.03 0.35 0.08 0.00 -0.57 0.00 0.00 34.95 34.78 2k70 s ARG 74 CO 0.33 -0.25 0.44 0.08 -1.08 0.00 0.00 175.30 174.82 2k70 s VAL 75 N -1.95 -0.45 0.19 4.99 1.01 0.30 -4.96 120.40 119.54 2k70 s VAL 75 Ca -0.09 0.13 -0.24 0.00 0.00 0.00 0.00 61.98 61.78 2k70 s VAL 75 Cb -0.03 -0.68 -0.08 0.00 0.00 0.00 0.00 36.38 35.59 2k70 s VAL 75 CO 0.01 0.05 0.77 -1.61 0.00 0.00 0.00 175.10 174.32 2k70 s GLU 76 N 2.22 4.48 -1.12 2.72 8.01 -1.26 -1.84 118.70 131.91 2k70 s GLU 76 Ca -0.05 1.09 -0.25 0.00 0.01 0.00 0.00 54.97 55.77 2k70 s GLU 76 Cb -0.11 -3.13 -0.16 0.00 -4.31 0.00 0.00 34.13 26.42 2k70 s GLU 76 CO -0.13 0.51 2.04 -0.51 0.01 0.00 0.00 175.26 177.17 2k70 s LEU 77 N -1.42 2.70 0.28 1.80 1.02 0.11 -4.73 118.68 118.44 2k70 s LEU 77 Ca 0.38 -1.25 -0.14 0.00 0.02 0.00 0.00 54.13 53.14 2k70 s LEU 77 Cb -0.21 -2.59 -0.08 0.00 0.02 0.00 0.00 46.19 43.32 2k70 s LEU 77 CO 0.25 -3.95 0.68 -1.59 0.02 0.00 0.00 176.35 171.76 2k70 s LYS 78 N 7.55 3.99 0.55 1.70 -2.85 -0.80 -1.09 119.74 128.79 2k70 s LYS 78 Ca 0.76 0.60 0.30 0.00 -1.00 0.00 0.00 55.97 56.63 2k70 s LYS 78 Cb -0.03 -2.56 1.63 0.00 -2.06 0.00 0.00 37.83 34.80 2k70 s LYS 78 CO 0.15 0.24 2.15 -1.00 0.10 0.00 0.00 175.35 176.99 2k70 h PRO 79 N 2.55 0.00 -0.99 1.78 0.13 -1.93 -1.25 132.00 132.27 2k70 h PRO 79 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2k70 h PRO 79 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2k70 h PRO 79 CO 0.66 0.07 0.00 0.41 -0.23 0.00 0.00 178.00 178.91 2k70 n GLY 80 N -0.87 1.57 0.00 1.56 0.00 -1.26 -4.89 105.19 101.31 2k70 n GLY 80 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 0.09 -0.30 3.76 -0.02 0.00 -0.48 -4.76 105.19 103.48 2k70 n GLY 81 Ca 0.00 0.49 -0.40 0.00 0.00 0.00 0.00 46.02 46.11 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 3.38 0.03 1.61 2.02 -1.17 -3.00 117.35 120.22 2k70 s TYR 82 Ca 0.00 1.61 -0.27 0.00 -0.37 0.00 0.00 57.07 58.03 2k70 s TYR 82 Cb 0.00 -3.40 0.08 0.00 -0.40 0.00 0.00 41.96 38.24 2k70 s TYR 82 CO 0.00 -0.99 0.73 -3.38 -1.57 0.00 0.00 175.55 170.35 2k70 s HIS 83 N -1.19 -0.51 0.20 2.71 -3.43 -0.21 -1.91 115.29 110.95 2k70 s HIS 83 Ca 0.47 0.55 -0.26 0.00 -0.80 0.00 0.00 55.06 55.02 2k70 s HIS 83 Cb -0.34 0.50 -0.08 0.00 -1.43 0.00 0.00 32.58 31.23 2k70 s HIS 83 CO 0.44 -0.66 0.82 -0.06 -2.00 0.00 0.00 174.74 173.28 2k70 s PHE 84 N -2.63 3.90 -0.11 0.38 0.08 -0.76 -0.86 117.98 117.99 2k70 s PHE 84 Ca -0.02 1.70 -0.16 0.00 0.12 0.00 0.00 56.93 58.57 2k70 s PHE 84 Cb -0.01 -2.82 -0.05 0.00 -0.57 0.00 0.00 43.02 39.58 2k70 s PHE 84 CO -0.04 0.48 0.42 1.41 -0.10 0.00 0.00 175.22 177.38 2k70 s MET 85 N -1.26 4.24 -0.18 0.44 1.75 0.50 -0.27 119.30 124.52 2k70 s MET 85 Ca 0.38 0.36 -0.03 0.00 -1.25 0.00 0.00 55.69 55.15 2k70 s MET 85 Cb -0.23 -3.39 -0.02 0.00 2.84 0.00 0.00 34.83 34.03 2k70 s MET 85 CO 0.27 0.28 -0.05 -0.51 -0.65 0.00 0.00 175.02 174.36 2k70 s LEU 86 N 0.26 3.02 0.01 4.11 1.02 -0.08 -0.87 118.68 126.15 2k70 s LEU 86 Ca 0.23 -0.28 0.04 0.00 0.02 0.00 0.00 54.13 54.15 2k70 s LEU 86 Cb -0.15 -1.74 -0.01 0.00 0.02 0.00 0.00 46.19 44.30 2k70 s LEU 86 CO 0.09 0.08 -0.12 -0.76 0.02 0.00 0.00 176.35 175.66 2k70 s LEU 87 N 0.90 2.09 -0.17 1.79 1.02 -0.28 -0.20 118.68 123.83 2k70 s LEU 87 Ca -0.01 -0.32 -0.01 0.00 0.02 0.00 0.00 54.13 53.82 2k70 s LEU 87 Cb -0.15 -0.59 0.00 0.00 0.02 0.00 0.00 46.19 45.48 2k70 s LEU 87 CO 0.01 0.09 0.15 0.61 0.02 0.00 0.00 176.35 177.22 2k70 n GLY 88 N 2.39 0.62 3.61 -3.19 0.00 0.17 -0.42 105.19 108.38 2k70 n GLY 88 Ca -0.16 -0.51 -0.35 0.00 0.00 0.00 0.00 46.02 45.01 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 -1.19 3.30 -0.00 0.99 -0.00 -1.20 -2.17 117.00 116.74 2k70 n LEU 89 Ca -0.01 0.61 0.02 0.00 -0.00 0.00 0.00 56.01 56.63 2k70 n LEU 89 Cb 0.51 -1.41 -0.03 0.00 -0.00 0.00 0.00 43.42 42.50 2k70 n LEU 89 CO 0.08 -2.13 -0.38 0.29 -0.00 0.00 0.00 177.39 175.25 2k70 n LYS 90 N -2.18 1.91 -4.51 1.47 4.76 -1.25 -4.81 118.16 113.55 2k70 n LYS 90 Ca 0.12 -0.02 -0.33 0.00 -2.87 0.00 0.00 58.31 55.21 2k70 n LYS 90 Cb 0.50 -0.96 -0.14 0.00 -1.84 0.00 0.00 35.03 32.59 2k70 n LYS 90 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2k70 s ARG 91 N -1.97 3.41 -0.30 1.97 0.52 -1.26 -5.02 118.95 116.29 2k70 s ARG 91 Ca -0.01 -0.65 -0.28 0.00 -0.52 0.00 0.00 55.73 54.27 2k70 s ARG 91 Cb 0.03 -2.75 -0.02 0.00 0.52 0.00 0.00 34.95 32.72 2k70 s ARG 91 CO 0.16 0.11 1.88 -1.25 0.02 0.00 0.00 175.30 176.22 2k70 s PRO 92 N 0.64 3.31 0.07 3.54 0.04 -1.26 -4.93 135.00 136.39 2k70 s PRO 92 Ca -0.06 1.56 0.07 0.00 0.04 0.00 0.00 61.00 62.61 2k70 s PRO 92 Cb -0.15 -4.23 -0.04 0.00 0.04 0.00 0.00 34.50 30.12 2k70 s PRO 92 CO 0.03 -1.89 -0.14 -0.48 0.04 0.00 0.00 177.00 174.55 2k70 s LEU 93 N 7.13 2.83 0.22 -3.56 0.05 -0.57 -4.88 118.68 119.90 2k70 s LEU 93 Ca 0.84 -0.39 -0.18 0.00 0.05 0.00 0.00 54.13 54.45 2k70 s LEU 93 Cb -0.25 -1.66 0.02 0.00 -2.05 0.00 0.00 46.19 42.26 2k70 s LEU 93 CO 0.34 0.23 0.56 -1.59 -0.55 0.00 0.00 176.35 175.33 2k70 s LYS 94 N -1.77 1.47 0.11 1.48 -2.85 -1.26 -0.40 119.74 116.52 2k70 s LYS 94 Ca 0.17 -0.91 -0.32 0.00 -1.00 0.00 0.00 55.97 53.91 2k70 s LYS 94 Cb -0.11 0.54 -0.12 0.00 -2.06 0.00 0.00 37.83 36.08 2k70 s LYS 94 CO 0.09 -0.64 1.77 0.00 0.10 0.00 0.00 175.35 176.67 2k70 n ALA 95 N -0.37 1.85 -0.40 0.59 0.00 -1.26 -2.04 120.51 118.88 2k70 n ALA 95 Ca -0.08 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.71 2k70 n ALA 95 Cb 0.62 -2.51 0.00 0.00 0.00 0.00 0.00 19.45 17.56 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 4.03 0.71 0.00 0.00 0.00 -0.19 -4.97 105.19 104.78 2k70 n GLY 96 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2k70 n GLY 96 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2k70 n GLU 97 N -2.04 0.21 -3.65 1.61 1.02 -0.86 -4.79 120.64 112.13 2k70 n GLU 97 Ca 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.11 2k70 n GLU 97 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.36 2k70 n GLU 97 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2k70 s GLU 98 N -2.35 0.55 -0.13 3.49 -1.05 -1.26 -0.07 118.70 117.89 2k70 s GLU 98 Ca 0.00 1.34 -0.08 0.00 -0.15 0.00 0.00 54.97 56.08 2k70 s GLU 98 Cb 0.00 0.66 0.04 0.00 -0.44 0.00 0.00 34.13 34.39 2k70 s GLU 98 CO 0.00 -0.20 0.32 0.08 0.95 0.00 0.00 175.26 176.41 2k70 s VAL 99 N 2.62 -0.02 0.33 1.83 1.01 0.39 -4.91 120.40 121.66 2k70 s VAL 99 Ca -0.06 0.08 -0.26 0.00 0.00 0.00 0.00 61.98 61.74 2k70 s VAL 99 Cb -0.11 -0.47 -0.10 0.00 0.00 0.00 0.00 36.38 35.70 2k70 s VAL 99 CO -0.18 0.03 0.96 -1.61 0.00 0.00 0.00 175.10 174.31 2k70 s GLU 100 N 0.93 4.52 0.01 2.72 2.02 -1.26 -0.84 118.70 126.80 2k70 s GLU 100 Ca -0.06 1.37 0.09 0.00 0.02 0.00 0.00 54.97 56.38 2k70 s GLU 100 Cb -0.07 -2.76 -0.02 0.00 0.10 0.00 0.00 34.13 31.37 2k70 s GLU 100 CO -0.07 0.21 -0.26 -0.51 0.02 0.00 0.00 175.26 174.65 2k70 s LEU 101 N -2.14 2.11 -0.13 1.80 1.02 -0.49 -4.18 118.68 116.67 2k70 s LEU 101 Ca 0.51 -0.53 -0.05 0.00 0.02 0.00 0.00 54.13 54.09 2k70 s LEU 101 Cb -0.19 -1.30 -0.04 0.00 0.02 0.00 0.00 46.19 44.68 2k70 s LEU 101 CO 0.25 0.28 0.04 -1.81 0.02 0.00 0.00 176.35 175.13 2k70 s ASP 102 N -0.94 5.54 -0.23 2.29 1.01 -0.27 -0.55 116.67 123.53 2k70 s ASP 102 Ca 0.11 0.17 -0.00 0.00 0.71 0.00 0.00 52.55 53.53 2k70 s ASP 102 Cb -0.10 -1.75 0.06 0.00 1.01 0.00 0.00 42.92 42.14 2k70 s ASP 102 CO 0.01 0.31 -0.03 -0.76 0.21 0.00 0.00 175.17 174.91 2k70 s LEU 103 N -0.46 2.21 -0.46 1.23 1.02 0.31 -1.14 118.68 121.39 2k70 s LEU 103 Ca 0.09 -1.10 -0.29 0.00 0.02 0.00 0.00 54.13 52.86 2k70 s LEU 103 Cb -0.12 -1.02 0.03 0.00 0.02 0.00 0.00 46.19 45.10 2k70 s LEU 103 CO 0.02 -0.26 1.17 -0.76 0.02 0.00 0.00 176.35 176.54 2k70 s LEU 104 N 1.52 3.64 -0.12 1.79 1.43 0.08 -1.89 118.68 125.14 2k70 s LEU 104 Ca -0.04 0.54 -0.05 0.00 -1.03 0.00 0.00 54.13 53.54 2k70 s LEU 104 Cb -0.18 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.45 2k70 s LEU 104 CO -0.07 -1.26 0.07 -0.36 0.23 0.00 0.00 176.35 174.96 2k70 s PHE 105 N 4.55 3.35 0.15 0.29 0.40 -0.61 -0.77 117.98 125.35 2k70 s PHE 105 Ca 0.50 0.29 -0.31 0.00 -0.60 0.00 0.00 56.93 56.80 2k70 s PHE 105 Cb -0.08 -1.92 -0.11 0.00 0.51 0.00 0.00 43.02 41.42 2k70 s PHE 105 CO 0.31 0.49 1.76 0.00 0.70 0.00 0.00 175.22 178.48 2k70 s ALA 106 N -0.62 3.82 -0.01 5.36 0.00 0.43 -2.85 121.76 127.89 2k70 s ALA 106 Ca 0.11 1.47 -0.00 0.00 0.00 0.00 0.00 51.96 53.55 2k70 s ALA 106 Cb -0.12 -3.72 0.00 0.00 0.00 0.00 0.00 23.12 19.28 2k70 s ALA 106 CO 0.02 -1.08 0.01 0.41 0.00 0.00 0.00 175.76 175.13 2k70 n GLY 107 N 4.09 -0.32 2.14 0.00 0.00 -1.26 -4.63 105.19 105.21 2k70 n GLY 107 Ca 0.17 -0.19 -0.06 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.01 0.51 3.31 -0.02 0.00 -1.26 -5.03 105.19 101.70 2k70 n GLY 108 Ca 0.00 -0.74 -0.20 0.00 0.00 0.00 0.00 46.02 45.08 2k70 n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k70 s LYS 109 N -3.29 1.22 -0.00 1.61 1.02 -1.13 -5.08 119.74 114.10 2k70 s LYS 109 Ca 0.00 -1.40 -0.18 0.00 0.02 0.00 0.00 55.97 54.41 2k70 s LYS 109 Cb 0.00 -1.20 0.03 0.00 -0.52 0.00 0.00 37.83 36.14 2k70 s LYS 109 CO 0.00 0.23 0.39 0.54 -0.92 0.00 0.00 175.35 175.60 2k70 s VAL 110 N -2.22 0.05 0.01 3.17 0.11 -1.26 -1.57 120.40 118.69 2k70 s VAL 110 Ca 0.15 -0.41 0.08 0.00 -2.93 0.00 0.00 61.98 58.88 2k70 s VAL 110 Cb -0.05 -0.78 -0.02 0.00 -1.53 0.00 0.00 36.38 34.00 2k70 s VAL 110 CO 0.06 -0.23 -0.26 -0.22 -3.33 0.00 0.00 175.10 171.13 2k70 s LEU 111 N -1.52 2.10 -0.13 2.54 2.96 -0.79 -4.95 118.68 118.89 2k70 s LEU 111 Ca -0.11 -0.52 -0.04 0.00 -0.22 0.00 0.00 54.13 53.25 2k70 s LEU 111 Cb -0.03 -1.28 -0.03 0.00 0.50 0.00 0.00 46.19 45.34 2k70 s LEU 111 CO 0.03 0.28 0.00 -0.75 -1.32 0.00 0.00 176.35 174.60 2k70 s LYS 112 N -0.88 3.45 0.15 1.98 2.47 -1.26 -0.53 119.74 125.11 2k70 s LYS 112 Ca 0.10 -0.43 0.09 0.00 -1.56 0.00 0.00 55.97 54.17 2k70 s LYS 112 Cb -0.10 -2.94 -0.04 0.00 -1.46 0.00 0.00 37.83 33.30 2k70 s LYS 112 CO 0.00 0.45 -0.19 0.14 0.16 0.00 0.00 175.35 175.91 2k70 s VAL 113 N -0.19 1.82 -0.14 4.02 -7.23 0.28 -5.02 120.40 113.95 2k70 s VAL 113 Ca 0.05 -1.81 0.02 0.00 -1.81 0.00 0.00 61.98 58.43 2k70 s VAL 113 Cb -0.12 -1.78 0.00 0.00 0.56 0.00 0.00 36.38 35.04 2k70 s VAL 113 CO 0.02 -0.23 -0.19 -0.69 -0.31 0.00 0.00 175.10 173.70 2k70 s VAL 114 N -1.76 2.36 0.07 1.32 1.01 -1.26 -1.39 120.40 120.74 2k70 s VAL 114 Ca 0.13 -0.89 0.09 0.00 0.00 0.00 0.00 61.98 61.32 2k70 s VAL 114 Cb -0.07 -1.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.32 2k70 s VAL 114 CO 0.06 0.54 -0.24 -0.76 0.00 0.00 0.00 175.10 174.70 2k70 s LEU 115 N 0.70 2.22 0.83 3.92 1.43 -0.02 -4.90 118.68 122.87 2k70 s LEU 115 Ca -0.09 -0.63 -0.11 0.00 -1.03 0.00 0.00 54.13 52.27 2k70 s LEU 115 Cb -0.16 -1.12 0.09 0.00 0.03 0.00 0.00 46.19 45.03 2k70 s LEU 115 CO 0.01 0.18 1.09 -2.16 0.23 0.00 0.00 176.35 175.71 2k70 s PRO 116 N -1.53 1.80 -0.11 1.29 0.04 -1.26 -0.46 135.00 134.77 2k70 s PRO 116 Ca 0.10 0.74 -0.05 0.00 0.04 0.00 0.00 61.00 61.83 2k70 s PRO 116 Cb -0.10 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 2k70 s PRO 116 CO 0.03 -1.84 0.08 0.08 0.04 0.00 0.00 177.00 175.39 2k70 s VAL 117 N -3.06 4.95 0.01 -0.36 1.01 0.90 -0.86 120.40 122.99 2k70 s VAL 117 Ca 0.62 -0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.59 2k70 s VAL 117 Cb -0.16 -3.13 -0.01 0.00 0.00 0.00 0.00 36.38 33.08 2k70 s VAL 117 CO 0.55 0.60 -0.02 -0.70 0.00 0.00 0.00 175.10 175.54 2k70 s GLU 118 N -0.88 0.23 -1.31 2.72 -6.30 -0.51 -1.02 118.70 111.62 2k70 s GLU 118 Ca 0.14 -0.44 -0.08 0.00 -2.50 0.00 0.00 54.97 52.08 2k70 s GLU 118 Cb -0.12 0.08 -0.06 0.00 0.00 0.00 0.00 34.13 34.03 2k70 s GLU 118 CO 0.03 -0.04 2.92 0.00 0.02 0.00 0.00 175.26 178.20 2k70 n ALA 119 N 2.01 7.22 -0.37 6.30 0.00 -1.26 -0.80 120.51 133.61 2k70 n ALA 119 Ca -0.21 -3.41 0.00 0.00 0.00 0.00 0.00 53.44 49.83 2k70 n ALA 119 Cb 0.56 -3.06 0.00 0.00 0.00 0.00 0.00 19.45 16.95 2k70 n ALA 119 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37