#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k70 s SER 2 N 0.00 1.41 0.86 1.61 0.01 -1.26 -5.16 113.70 111.18 2k70 s SER 2 Ca 0.00 -1.67 -0.10 0.00 1.31 0.00 0.00 55.95 55.49 2k70 s SER 2 Cb 0.00 0.59 0.11 0.00 0.21 0.00 0.00 66.02 66.93 2k70 s SER 2 CO 0.00 -1.13 1.13 0.72 0.41 0.00 0.00 173.24 174.37 2k70 s PHE 3 N -3.33 1.96 -0.28 2.43 -0.12 -1.26 -5.06 117.98 112.33 2k70 s PHE 3 Ca 0.38 1.71 0.02 0.00 -0.05 0.00 0.00 56.93 58.98 2k70 s PHE 3 Cb 0.02 -3.25 0.07 0.00 -0.63 0.00 0.00 43.02 39.23 2k70 s PHE 3 CO 0.25 -2.45 -0.02 0.95 -0.05 0.00 0.00 175.22 173.89 2k70 s THR 4 N -2.72 1.79 -0.16 -4.49 -4.23 -1.26 -5.05 115.64 99.53 2k70 s THR 4 Ca 0.65 -1.62 -0.29 0.00 -1.18 0.00 0.00 61.69 59.25 2k70 s THR 4 Cb -0.21 -2.12 -0.01 0.00 1.34 0.00 0.00 72.50 71.50 2k70 s THR 4 CO 0.57 -0.27 1.14 -1.83 -0.54 0.00 0.00 174.62 173.68 2k70 s GLU 5 N 1.23 4.29 0.27 3.99 1.03 -1.26 -4.91 118.70 123.33 2k70 s GLU 5 Ca -0.01 1.52 -0.21 0.00 0.03 0.00 0.00 54.97 56.31 2k70 s GLU 5 Cb -0.19 -3.65 0.04 0.00 -0.80 0.00 0.00 34.13 29.53 2k70 s GLU 5 CO -0.08 -0.57 0.80 0.20 -1.33 0.00 0.00 175.26 174.27 2k70 s GLY 6 N 1.49 -0.02 0.02 -3.83 0.00 -1.26 -1.07 107.32 102.65 2k70 s GLY 6 Ca 0.50 -0.31 -0.22 0.00 0.00 0.00 0.00 44.72 44.69 2k70 s GLY 6 CO 0.14 0.03 0.51 0.66 0.00 0.00 0.00 173.10 174.44 2k70 s TRP 7 N -3.37 -0.42 -0.02 1.90 -2.14 -0.26 -4.28 118.94 110.36 2k70 s TRP 7 Ca 0.13 0.54 -0.13 0.00 2.66 0.00 0.00 56.10 59.29 2k70 s TRP 7 Cb -0.05 0.31 -0.05 0.00 -3.10 0.00 0.00 33.47 30.58 2k70 s TRP 7 CO 0.07 -0.60 0.36 0.08 -2.66 0.00 0.00 176.95 174.21 2k70 s VAL 8 N -2.08 5.11 -0.45 -0.66 1.01 0.08 -1.12 120.40 122.29 2k70 s VAL 8 Ca -0.07 0.74 -0.29 0.00 0.00 0.00 0.00 61.98 62.36 2k70 s VAL 8 Cb -0.01 -3.66 0.01 0.00 0.00 0.00 0.00 36.38 32.72 2k70 s VAL 8 CO 0.01 0.58 1.39 -0.60 0.00 0.00 0.00 175.10 176.48 2k70 s ARG 9 N -1.06 3.54 0.08 2.72 3.52 -0.32 -1.47 118.95 125.95 2k70 s ARG 9 Ca 0.22 0.81 -0.37 0.00 -0.13 0.00 0.00 55.73 56.27 2k70 s ARG 9 Cb -0.16 -4.03 -0.17 0.00 -1.56 0.00 0.00 34.95 29.03 2k70 s ARG 9 CO 0.12 -1.62 1.30 0.34 -0.81 0.00 0.00 175.30 174.63 2k70 n PHE 10 N 8.88 1.40 -3.86 5.12 7.35 -0.85 -4.47 117.46 131.03 2k70 n PHE 10 Ca 0.15 0.69 -0.09 0.00 -0.76 0.00 0.00 57.45 57.44 2k70 n PHE 10 Cb 0.48 -2.30 -0.04 0.00 0.35 0.00 0.00 39.48 37.97 2k70 n PHE 10 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 2k70 s SER 11 N 0.40 -0.19 0.00 -2.13 0.01 -0.93 -4.76 113.70 106.10 2k70 s SER 11 Ca 0.85 -0.67 0.26 0.00 1.31 0.00 0.00 55.95 57.69 2k70 s SER 11 Cb -0.98 0.61 0.59 0.00 0.21 0.00 0.00 66.02 66.44 2k70 s SER 11 CO 0.48 -1.13 1.47 -0.81 0.41 0.00 0.00 173.24 173.66 2k70 n PRO 12 N -0.37 1.62 -0.91 12.44 -0.04 -1.26 -4.38 135.00 142.09 2k70 n PRO 12 Ca -0.06 -1.15 0.00 0.00 -0.04 0.00 0.00 63.50 62.25 2k70 n PRO 12 Cb 0.62 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 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 1.29 2.33 0.01 0.55 0.00 -1.26 -5.03 105.19 103.09 2k70 n GLY 13 Ca 0.15 -2.12 0.12 0.00 0.00 0.00 0.00 46.02 44.17 2k70 n GLY 13 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k70 n PRO 14 N -0.69 0.01 -4.17 1.61 -0.04 -1.26 -4.90 135.00 125.55 2k70 n PRO 14 Ca 0.00 0.07 -0.12 0.00 -0.04 0.00 0.00 63.50 63.41 2k70 n PRO 14 Cb 0.00 -1.52 -0.10 0.00 -0.04 0.00 0.00 33.50 31.84 2k70 n PRO 14 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2k70 s ASN 15 N -3.07 1.22 0.20 3.54 4.22 -1.26 -1.40 114.94 118.39 2k70 s ASN 15 Ca 0.12 -0.95 -0.06 0.00 -2.14 0.00 0.00 52.86 49.83 2k70 s ASN 15 Cb 0.17 0.07 0.03 0.00 1.28 0.00 0.00 41.25 42.79 2k70 s ASN 15 CO 0.48 -0.41 0.38 0.00 -2.04 0.00 0.00 177.10 175.50 2k70 n ALA 16 N 0.13 -0.77 -2.81 3.54 0.00 0.11 -4.83 120.51 115.88 2k70 n ALA 16 Ca -0.13 -0.68 -0.10 0.00 0.00 0.00 0.00 53.44 52.52 2k70 n ALA 16 Cb 0.60 0.55 -0.11 0.00 0.00 0.00 0.00 19.45 20.49 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 -1.67 0.37 0.03 0.00 0.00 -1.26 -0.71 121.76 118.51 2k70 s ALA 17 Ca 0.09 -0.75 0.04 0.00 0.00 0.00 0.00 51.96 51.34 2k70 s ALA 17 Cb -0.02 0.12 -0.02 0.00 0.00 0.00 0.00 23.12 23.20 2k70 s ALA 17 CO 0.07 -0.13 -0.12 0.00 0.00 0.00 0.00 175.76 175.58 2k70 s ALA 18 N -1.78 0.95 0.02 0.00 0.00 0.29 -1.18 121.76 120.06 2k70 s ALA 18 Ca -0.10 -0.68 0.07 0.00 0.00 0.00 0.00 51.96 51.25 2k70 s ALA 18 Cb -0.08 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 2k70 s ALA 18 CO -0.01 0.17 -0.21 0.71 0.00 0.00 0.00 175.76 176.42 2k70 s TYR 19 N -0.74 1.85 -0.03 0.00 2.02 -0.27 -1.32 117.35 118.86 2k70 s TYR 19 Ca 0.00 -0.37 -0.31 0.00 -0.37 0.00 0.00 57.07 56.03 2k70 s TYR 19 Cb -0.07 -1.13 0.11 0.00 -0.40 0.00 0.00 41.96 40.47 2k70 s TYR 19 CO 0.01 0.05 1.18 -0.48 -1.57 0.00 0.00 175.55 174.74 2k70 s LEU 20 N -0.95 -0.13 0.25 -1.29 -0.00 -1.26 -1.10 118.68 114.20 2k70 s LEU 20 Ca 0.08 -0.13 0.06 0.00 -0.00 0.00 0.00 54.13 54.14 2k70 s LEU 20 Cb -0.09 1.57 -0.03 0.00 -0.00 0.00 0.00 46.19 47.64 2k70 s LEU 20 CO 0.01 -0.41 0.29 0.28 -0.00 0.00 0.00 176.35 176.52 2k70 s THR 21 N -2.63 4.85 -0.06 5.48 -1.32 -0.23 -1.79 115.64 119.93 2k70 s THR 21 Ca 0.12 -1.18 0.02 0.00 -1.21 0.00 0.00 61.69 59.43 2k70 s THR 21 Cb 0.02 -3.64 0.02 0.00 -1.51 0.00 0.00 72.50 67.38 2k70 s THR 21 CO -0.04 -0.34 -0.11 -0.22 -2.21 0.00 0.00 174.62 171.71 2k70 s LEU 22 N -3.92 1.56 0.01 9.08 2.96 -0.15 -4.92 118.68 123.30 2k70 s LEU 22 Ca 0.34 -0.27 0.07 0.00 -0.22 0.00 0.00 54.13 54.05 2k70 s LEU 22 Cb -0.08 -0.77 -0.03 0.00 0.50 0.00 0.00 46.19 45.81 2k70 s LEU 22 CO 0.27 0.01 -0.21 -1.83 -1.32 0.00 0.00 176.35 173.27 2k70 s GLU 23 N 0.77 2.11 -0.42 1.98 -1.05 -1.26 -0.33 118.70 120.50 2k70 s GLU 23 Ca -0.13 -0.94 -0.18 0.00 -0.15 0.00 0.00 54.97 53.57 2k70 s GLU 23 Cb -0.15 -2.14 0.02 0.00 -0.44 0.00 0.00 34.13 31.41 2k70 s GLU 23 CO 0.02 0.56 0.51 1.21 0.95 0.00 0.00 175.26 178.51 2k70 s ASN 24 N -1.02 6.25 0.00 0.83 3.84 -0.24 -4.96 114.94 119.63 2k70 s ASN 24 Ca 0.12 -0.51 0.27 0.00 0.21 0.00 0.00 52.86 52.96 2k70 s ASN 24 Cb -0.10 -2.26 0.95 0.00 -0.55 0.00 0.00 41.25 39.29 2k70 s ASN 24 CO 0.02 -0.64 1.72 -0.81 -2.79 0.00 0.00 177.10 174.60 2k70 n PRO 25 N 5.83 0.11 -2.31 0.43 -0.04 -1.26 -1.37 135.00 136.39 2k70 n PRO 25 Ca -0.05 -0.04 -0.26 0.00 -0.04 0.00 0.00 63.50 63.11 2k70 n PRO 25 Cb 0.48 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.57 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 -2.91 1.76 0.00 0.55 0.00 -1.26 -4.80 107.32 100.66 2k70 s GLY 26 Ca 0.15 -1.47 0.26 0.00 0.00 0.00 0.00 44.72 43.67 2k70 s GLY 26 CO 0.59 -0.84 1.55 1.34 0.00 0.00 0.00 173.10 175.73 2k70 n ASP 27 N -3.18 0.83 -4.46 1.64 2.03 -1.26 -3.43 116.55 108.71 2k70 n ASP 27 Ca 0.14 -0.67 -0.23 0.00 0.52 0.00 0.00 54.79 54.55 2k70 n ASP 27 Cb 0.60 0.15 -0.10 0.00 -0.72 0.00 0.00 41.12 41.05 2k70 n ASP 27 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 2k70 s LEU 28 N -2.65 2.59 0.44 -2.67 0.05 -1.26 -4.79 118.68 110.39 2k70 s LEU 28 Ca 0.21 -1.03 -0.22 0.00 0.05 0.00 0.00 54.13 53.14 2k70 s LEU 28 Cb 0.19 -1.05 -0.10 0.00 -2.05 0.00 0.00 46.19 43.18 2k70 s LEU 28 CO 0.57 0.01 1.00 -2.16 -0.55 0.00 0.00 176.35 175.22 2k70 s PRO 29 N -3.53 4.07 0.14 1.48 0.04 -1.26 -3.98 135.00 131.95 2k70 s PRO 29 Ca 0.29 1.30 0.07 0.00 0.04 0.00 0.00 61.00 62.70 2k70 s PRO 29 Cb -0.04 -2.24 -0.04 0.00 0.04 0.00 0.00 34.50 32.21 2k70 s PRO 29 CO 0.14 -0.19 -0.02 -0.51 0.04 0.00 0.00 177.00 176.46 2k70 s LEU 30 N -3.14 3.29 -0.13 -3.56 1.02 -0.37 -4.97 118.68 110.83 2k70 s LEU 30 Ca 0.63 -0.34 -0.03 0.00 0.02 0.00 0.00 54.13 54.40 2k70 s LEU 30 Cb -0.15 -1.99 0.05 0.00 0.02 0.00 0.00 46.19 44.12 2k70 s LEU 30 CO 0.19 0.13 0.06 -0.60 0.02 0.00 0.00 176.35 176.15 2k70 s ARG 31 N -2.63 0.16 -0.18 1.70 3.52 -1.26 -0.55 118.95 119.71 2k70 s ARG 31 Ca 0.26 0.02 -0.23 0.00 -0.13 0.00 0.00 55.73 55.65 2k70 s ARG 31 Cb -0.10 -1.40 -0.02 0.00 -1.56 0.00 0.00 34.95 31.87 2k70 s ARG 31 CO 0.17 -0.53 0.72 -1.17 -0.81 0.00 0.00 175.30 173.69 2k70 s LEU 32 N 2.09 4.17 -0.00 -0.88 0.20 0.29 -1.38 118.68 123.17 2k70 s LEU 32 Ca 0.03 1.01 0.05 0.00 0.69 0.00 0.00 54.13 55.90 2k70 s LEU 32 Cb -0.15 -3.05 -0.07 0.00 -0.43 0.00 0.00 46.19 42.49 2k70 s LEU 32 CO -0.07 -0.32 0.17 1.33 -0.29 0.00 0.00 176.35 177.17 2k70 n VAL 33 N 4.66 0.00 -3.44 1.68 0.24 0.47 -0.28 118.33 121.66 2k70 n VAL 33 Ca 0.01 -0.26 -0.05 0.00 -2.04 0.00 0.00 64.34 62.01 2k70 n VAL 33 Cb 0.49 0.71 0.01 0.00 -1.47 0.00 0.00 33.84 33.59 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 1.62 1.70 2.24 7.63 0.00 -1.01 -4.73 105.19 112.64 2k70 n GLY 34 Ca 0.00 -1.19 -0.09 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 -1.86 -0.29 -3.30 4.61 0.00 -1.26 -0.93 120.51 117.49 2k70 n ALA 35 Ca -0.08 -1.05 -0.09 0.00 0.00 0.00 0.00 53.44 52.22 2k70 n ALA 35 Cb 0.28 0.85 -0.05 0.00 0.00 0.00 0.00 19.45 20.53 2k70 n ALA 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2k70 s ARG 36 N -2.49 1.54 -0.15 0.00 3.52 -0.23 -4.79 118.95 116.34 2k70 s ARG 36 Ca 0.19 -1.14 -0.29 0.00 -0.13 0.00 0.00 55.73 54.36 2k70 s ARG 36 Cb -0.01 0.50 0.11 0.00 -1.56 0.00 0.00 34.95 33.99 2k70 s ARG 36 CO 0.13 -0.65 0.90 -0.08 -0.81 0.00 0.00 175.30 174.79 2k70 s THR 37 N -3.97 0.00 -1.98 4.11 -1.32 -1.26 -0.71 115.64 110.51 2k70 s THR 37 Ca 0.18 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.90 2k70 s THR 37 Cb -0.01 -1.00 0.67 0.00 -1.51 0.00 0.00 72.50 70.65 2k70 s THR 37 CO 0.06 0.00 1.80 -0.81 -2.21 0.00 0.00 174.62 173.46 2k70 n PRO 38 N 1.09 0.74 -2.56 7.08 -0.04 -1.26 -3.66 135.00 136.39 2k70 n PRO 38 Ca -0.13 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.22 2k70 n PRO 38 Cb 0.57 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.56 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 -1.01 1.65 -3.64 0.52 0.24 -1.26 -4.57 118.33 110.26 2k70 n VAL 39 Ca 0.18 -3.52 -0.09 0.00 -2.04 0.00 0.00 64.34 58.87 2k70 n VAL 39 Cb 0.09 0.26 -0.07 0.00 -1.47 0.00 0.00 33.84 32.64 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 -3.57 -1.93 -0.09 2.33 0.00 -1.24 -3.97 121.76 113.29 2k70 s ALA 40 Ca 0.35 2.15 0.14 0.00 0.00 0.00 0.00 51.96 54.61 2k70 s ALA 40 Cb 0.38 -1.39 -0.06 0.00 0.00 0.00 0.00 23.12 22.05 2k70 s ALA 40 CO -0.02 -0.33 1.18 1.49 0.00 0.00 0.00 175.76 178.08 2k70 h GLU 41 N 5.64 0.00 -5.47 0.00 4.57 0.31 -3.43 114.58 116.20 2k70 h GLU 41 Ca -0.29 0.00 -0.65 0.00 -1.18 0.00 0.00 59.36 57.24 2k70 h GLU 41 Cb 1.19 0.00 -0.20 0.00 -0.16 0.00 0.00 28.75 29.58 2k70 h GLU 41 CO 0.12 0.52 -0.66 1.03 -1.18 0.00 0.00 179.01 178.84 2k70 s ARG 42 N -2.88 3.51 -0.02 1.92 0.52 -0.33 -5.01 118.95 116.66 2k70 s ARG 42 Ca 0.01 -0.50 0.06 0.00 -0.52 0.00 0.00 55.73 54.78 2k70 s ARG 42 Cb 0.08 -2.88 -0.03 0.00 0.52 0.00 0.00 34.95 32.64 2k70 s ARG 42 CO 0.78 0.34 -0.18 0.54 0.02 0.00 0.00 175.30 176.80 2k70 s VAL 43 N 0.09 2.72 0.09 3.52 0.11 -1.26 -1.37 120.40 124.29 2k70 s VAL 43 Ca -0.00 -0.95 0.04 0.00 -2.93 0.00 0.00 61.98 58.14 2k70 s VAL 43 Cb -0.13 -2.06 -0.03 0.00 -1.53 0.00 0.00 36.38 32.62 2k70 s VAL 43 CO 0.03 0.52 -0.11 -1.61 -3.33 0.00 0.00 175.10 170.60 2k70 s GLU 44 N -0.89 0.81 -0.23 1.54 2.02 -0.01 -4.91 118.70 117.04 2k70 s GLU 44 Ca 0.12 -1.07 -0.05 0.00 0.02 0.00 0.00 54.97 53.99 2k70 s GLU 44 Cb -0.10 -0.60 -0.02 0.00 0.10 0.00 0.00 34.13 33.51 2k70 s GLU 44 CO 0.01 0.11 0.00 -1.17 0.02 0.00 0.00 175.26 174.23 2k70 s LEU 45 N -2.18 3.12 0.28 1.80 2.96 -1.26 -0.51 118.68 122.89 2k70 s LEU 45 Ca 0.02 -0.31 0.10 0.00 -0.22 0.00 0.00 54.13 53.72 2k70 s LEU 45 Cb -0.05 -1.81 -0.05 0.00 0.50 0.00 0.00 46.19 44.77 2k70 s LEU 45 CO 0.01 -0.02 -0.15 -1.00 -1.32 0.00 0.00 176.35 173.87 2k70 s HIS 46 N 1.49 2.17 0.23 5.38 3.76 -0.10 -0.92 115.29 127.28 2k70 s HIS 46 Ca 0.06 -0.45 0.08 0.00 -0.15 0.00 0.00 55.06 54.60 2k70 s HIS 46 Cb -0.15 -1.05 -0.05 0.00 1.11 0.00 0.00 32.58 32.45 2k70 s HIS 46 CO -0.00 0.58 -0.14 -1.83 -0.85 0.00 0.00 174.74 172.49 2k70 s GLU 47 N -3.58 1.41 -0.08 1.40 4.04 0.25 -1.73 118.70 120.41 2k70 s GLU 47 Ca 0.29 -1.64 0.00 0.00 0.04 0.00 0.00 54.97 53.66 2k70 s GLU 47 Cb -0.02 -1.22 0.02 0.00 0.02 0.00 0.00 34.13 32.94 2k70 s GLU 47 CO 0.13 0.19 -0.05 0.99 -1.84 0.00 0.00 175.26 174.68 2k70 s THR 48 N -2.91 0.73 0.42 1.83 2.01 -1.06 -1.01 115.64 115.66 2k70 s THR 48 Ca 0.24 -0.15 0.07 0.00 0.31 0.00 0.00 61.69 62.16 2k70 s THR 48 Cb -0.01 -0.78 -0.05 0.00 0.01 0.00 0.00 72.50 71.68 2k70 s THR 48 CO 0.09 0.30 0.19 0.72 -0.69 0.00 0.00 174.62 175.23 2k70 s PHE 49 N 1.44 2.55 -0.08 4.92 -0.12 0.20 -4.41 117.98 122.48 2k70 s PHE 49 Ca -0.02 -0.61 -0.06 0.00 -0.05 0.00 0.00 56.93 56.19 2k70 s PHE 49 Cb -0.13 -1.96 -0.04 0.00 -0.63 0.00 0.00 43.02 40.26 2k70 s PHE 49 CO -0.04 0.15 0.17 1.41 -0.05 0.00 0.00 175.22 176.86 2k70 s MET 50 N -3.93 3.46 0.14 1.99 -2.45 -1.26 -1.36 119.30 115.89 2k70 s MET 50 Ca 0.40 -0.15 0.03 0.00 -1.25 0.00 0.00 55.69 54.72 2k70 s MET 50 Cb 0.03 -3.16 -0.04 0.00 1.25 0.00 0.00 34.83 32.91 2k70 s MET 50 CO 0.22 0.75 -0.07 1.03 1.05 0.00 0.00 175.02 178.00 2k70 s ARG 51 N -1.28 1.01 0.20 4.11 0.52 0.14 -4.93 118.95 118.72 2k70 s ARG 51 Ca 0.19 -1.44 -0.12 0.00 -0.52 0.00 0.00 55.73 53.84 2k70 s ARG 51 Cb -0.12 -0.42 -0.07 0.00 0.52 0.00 0.00 34.95 34.85 2k70 s ARG 51 CO 0.08 -0.00 0.57 -2.00 0.02 0.00 0.00 175.30 173.97 2k70 s GLU 52 N -3.81 3.89 -0.01 3.54 2.56 -1.26 -0.49 118.70 123.12 2k70 s GLU 52 Ca 0.17 0.40 0.02 0.00 0.00 0.00 0.00 54.97 55.56 2k70 s GLU 52 Cb 0.04 -2.75 0.00 0.00 2.00 0.00 0.00 34.13 33.43 2k70 s GLU 52 CO -0.00 0.37 -0.07 0.14 -0.56 0.00 0.00 175.26 175.14 2k70 s VAL 53 N -1.68 0.56 0.00 3.70 -7.23 -0.04 -4.90 120.40 110.81 2k70 s VAL 53 Ca 0.44 -0.27 0.00 0.00 -1.81 0.00 0.00 61.98 60.34 2k70 s VAL 53 Cb -0.13 -0.50 0.00 0.00 0.56 0.00 0.00 36.38 36.31 2k70 s VAL 53 CO 0.20 0.18 0.00 -0.62 -0.31 0.00 0.00 175.10 174.55 2k70 n GLU 54 N 3.15 -1.77 -0.20 4.82 1.02 -1.26 -0.82 120.64 125.58 2k70 n GLU 54 Ca -0.16 0.44 0.00 0.00 -0.02 0.00 0.00 57.16 57.42 2k70 n GLU 54 Cb 0.56 -4.80 0.00 0.00 -0.02 0.00 0.00 31.44 27.18 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 0.57 0.78 3.22 0.62 0.00 -1.26 -5.09 105.19 104.02 2k70 n GLY 55 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2k70 n GLY 55 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k70 s LYS 56 N -0.80 2.40 0.11 1.61 -2.85 0.00 -5.12 119.74 115.09 2k70 s LYS 56 Ca 0.00 -0.80 -0.30 0.00 -1.00 0.00 0.00 55.97 53.86 2k70 s LYS 56 Cb 0.00 -2.00 -0.07 0.00 -2.06 0.00 0.00 37.83 33.71 2k70 s LYS 56 CO 0.00 0.30 1.22 0.15 0.10 0.00 0.00 175.35 177.12 2k70 s LYS 57 N 0.00 4.44 0.16 1.78 -0.14 -1.26 -0.86 119.74 123.86 2k70 s LYS 57 Ca -0.07 1.84 -0.00 0.00 -1.36 0.00 0.00 55.97 56.38 2k70 s LYS 57 Cb -0.14 -3.30 -0.04 0.00 -1.68 0.00 0.00 37.83 32.67 2k70 s LYS 57 CO 0.04 -0.23 0.06 0.14 -0.76 0.00 0.00 175.35 174.61 2k70 s VAL 58 N 0.72 0.24 -0.06 3.17 -7.23 0.36 -4.93 120.40 112.66 2k70 s VAL 58 Ca 0.58 -1.95 0.02 0.00 -1.81 0.00 0.00 61.98 58.82 2k70 s VAL 58 Cb -0.31 -2.19 0.01 0.00 0.56 0.00 0.00 36.38 34.45 2k70 s VAL 58 CO 0.32 -0.34 -0.11 -0.04 -0.31 0.00 0.00 175.10 174.61 2k70 s MET 59 N -4.04 1.59 0.45 4.82 -1.94 -1.26 -0.68 119.30 118.23 2k70 s MET 59 Ca 0.28 -0.37 0.03 0.00 -1.71 0.00 0.00 55.69 53.92 2k70 s MET 59 Cb 0.07 -1.34 -0.04 0.00 2.01 0.00 0.00 34.83 35.53 2k70 s MET 59 CO 0.05 0.01 0.03 0.20 -0.01 0.00 0.00 175.02 175.30 2k70 s GLY 60 N 0.72 2.72 0.05 -0.03 0.00 -0.46 -4.97 107.32 105.34 2k70 s GLY 60 Ca -0.14 -1.21 -0.00 0.00 0.00 0.00 0.00 44.72 43.38 2k70 s GLY 60 CO 0.03 -2.07 -0.04 -0.29 0.00 0.00 0.00 173.10 170.73 2k70 s MET 61 N -3.81 0.56 -0.05 2.90 1.75 -1.26 -0.63 119.30 118.77 2k70 s MET 61 Ca 0.20 -1.05 -0.30 0.00 -1.25 0.00 0.00 55.69 53.29 2k70 s MET 61 Cb 0.05 0.09 0.08 0.00 2.84 0.00 0.00 34.83 37.89 2k70 s MET 61 CO 0.10 -0.07 0.72 -0.98 -0.65 0.00 0.00 175.02 174.14 2k70 s ARG 62 N -3.13 1.01 0.57 4.11 1.70 -0.18 -4.98 118.95 118.05 2k70 s ARG 62 Ca 0.01 0.17 -0.17 0.00 -0.47 0.00 0.00 55.73 55.27 2k70 s ARG 62 Cb 0.02 0.48 -0.05 0.00 -0.57 0.00 0.00 34.95 34.83 2k70 s ARG 62 CO -0.06 -0.33 1.05 -1.25 -1.08 0.00 0.00 175.30 173.63 2k70 s PRO 63 N -1.45 3.43 0.05 3.89 0.04 -1.26 -0.59 135.00 139.12 2k70 s PRO 63 Ca -0.08 1.25 0.01 0.00 0.04 0.00 0.00 61.00 62.22 2k70 s PRO 63 Cb -0.00 -2.05 -0.03 0.00 0.04 0.00 0.00 34.50 32.46 2k70 s PRO 63 CO 0.06 -0.72 -0.06 0.14 0.04 0.00 0.00 177.00 176.47 2k70 s VAL 64 N -2.33 0.42 0.00 -0.36 -7.23 -0.10 -4.75 120.40 106.05 2k70 s VAL 64 Ca 0.65 -1.28 0.11 0.00 -1.81 0.00 0.00 61.98 59.64 2k70 s VAL 64 Cb -0.16 -0.82 -0.14 0.00 0.56 0.00 0.00 36.38 35.82 2k70 s VAL 64 CO 0.33 -0.58 1.19 1.55 -0.31 0.00 0.00 175.10 177.28 2k70 h PRO 65 N 4.09 0.00 -1.48 4.82 0.13 -1.95 -3.42 132.00 134.19 2k70 h PRO 65 Ca -0.34 0.00 0.30 0.00 -0.87 0.00 0.00 66.00 65.09 2k70 h PRO 65 Cb 1.19 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.18 2k70 h PRO 65 CO 0.48 0.74 0.82 -0.59 -0.23 0.00 0.00 178.00 179.21 2k70 s PHE 66 N -2.78 -0.07 0.09 1.56 -0.12 -1.26 -4.70 117.98 110.70 2k70 s PHE 66 Ca 0.01 -0.02 0.08 0.00 -0.05 0.00 0.00 56.93 56.94 2k70 s PHE 66 Cb 0.09 0.54 -0.04 0.00 -0.63 0.00 0.00 43.02 42.98 2k70 s PHE 66 CO 0.80 -0.27 -0.15 -0.51 -0.05 0.00 0.00 175.22 175.04 2k70 s LEU 67 N -2.76 2.79 -0.05 -1.99 1.43 0.62 -4.99 118.68 113.73 2k70 s LEU 67 Ca 0.13 -0.47 0.04 0.00 -1.03 0.00 0.00 54.13 52.80 2k70 s LEU 67 Cb 0.03 -1.63 -0.02 0.00 0.03 0.00 0.00 46.19 44.60 2k70 s LEU 67 CO -0.04 0.20 -0.16 -0.70 0.23 0.00 0.00 176.35 175.88 2k70 s GLU 68 N -1.98 2.54 -0.03 1.70 2.56 -1.26 -0.55 118.70 121.67 2k70 s GLU 68 Ca 0.18 -0.73 -0.01 0.00 0.00 0.00 0.00 54.97 54.41 2k70 s GLU 68 Cb -0.11 -2.35 0.03 0.00 2.00 0.00 0.00 34.13 33.70 2k70 s GLU 68 CO 0.10 0.57 0.05 0.08 -0.56 0.00 0.00 175.26 175.50 2k70 s VAL 69 N -0.60 -0.09 0.76 3.70 1.01 0.29 -5.00 120.40 120.47 2k70 s VAL 69 Ca 0.09 0.32 -0.11 0.00 0.00 0.00 0.00 61.98 62.28 2k70 s VAL 69 Cb -0.11 -0.13 0.05 0.00 0.00 0.00 0.00 36.38 36.19 2k70 s VAL 69 CO 0.01 0.13 1.08 -2.16 0.00 0.00 0.00 175.10 174.16 2k70 s PRO 70 N 1.65 2.35 0.31 2.72 0.04 -1.26 -1.23 135.00 139.58 2k70 s PRO 70 Ca -0.02 0.98 -0.30 0.00 0.04 0.00 0.00 61.00 61.71 2k70 s PRO 70 Cb -0.12 -1.92 -0.12 0.00 0.04 0.00 0.00 34.50 32.37 2k70 s PRO 70 CO -0.03 -1.52 1.49 -0.35 0.04 0.00 0.00 177.00 176.63 2k70 n PRO 71 N -3.42 2.49 -0.08 0.56 -0.04 -1.26 -2.05 135.00 131.21 2k70 n PRO 71 Ca 0.08 0.88 0.00 0.00 -0.04 0.00 0.00 63.50 64.42 2k70 n PRO 71 Cb 0.54 -2.60 0.00 0.00 -0.04 0.00 0.00 33.50 31.40 2k70 n PRO 71 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2k70 n LYS 72 N 1.55 0.00 -2.75 0.54 4.01 -0.47 -5.00 118.16 116.04 2k70 n LYS 72 Ca 0.07 0.00 -0.36 0.00 -0.51 0.00 0.00 58.31 57.51 2k70 n LYS 72 Cb 0.36 -2.48 -0.06 0.00 -0.51 0.00 0.00 35.03 32.34 2k70 n LYS 72 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 2k70 s GLY 73 N -2.00 2.67 -0.06 0.72 0.00 -0.87 -4.77 107.32 103.02 2k70 s GLY 73 Ca 0.00 0.52 0.02 0.00 0.00 0.00 0.00 44.72 45.26 2k70 s GLY 73 CO 0.00 0.91 -0.09 -1.60 0.00 0.00 0.00 173.10 172.33 2k70 s ARG 74 N -2.45 2.67 -0.11 2.90 6.06 -1.26 -1.08 118.95 125.67 2k70 s ARG 74 Ca 0.55 -0.60 -0.04 0.00 -2.50 0.00 0.00 55.73 53.13 2k70 s ARG 74 Cb -0.16 -2.53 0.05 0.00 0.06 0.00 0.00 34.95 32.37 2k70 s ARG 74 CO 0.21 0.65 0.23 0.08 -2.50 0.00 0.00 175.30 173.97 2k70 s VAL 75 N -0.81 -0.25 -0.05 7.11 1.01 0.55 -4.99 120.40 122.97 2k70 s VAL 75 Ca 0.13 0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.36 2k70 s VAL 75 Cb -0.11 -0.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.86 2k70 s VAL 75 CO 0.02 0.10 -0.03 -0.70 0.00 0.00 0.00 175.10 174.49 2k70 s GLU 76 N 1.95 2.78 -1.45 2.72 -6.30 -1.26 -0.98 118.70 116.16 2k70 s GLU 76 Ca -0.02 -0.55 -0.13 0.00 -2.50 0.00 0.00 54.97 51.76 2k70 s GLU 76 Cb -0.11 -2.65 -0.02 0.00 0.00 0.00 0.00 34.13 31.35 2k70 s GLU 76 CO -0.08 0.66 2.47 1.28 0.02 0.00 0.00 175.26 179.61 2k70 n LEU 77 N 1.90 7.30 -4.65 2.70 4.32 -0.74 -4.95 117.00 122.89 2k70 n LEU 77 Ca -0.17 -4.09 -0.45 0.00 -0.02 0.00 0.00 56.01 51.28 2k70 n LEU 77 Cb 0.53 -1.56 -0.02 0.00 -1.62 0.00 0.00 43.42 40.74 2k70 n LEU 77 CO 0.29 1.35 0.88 2.29 -1.22 0.00 0.00 177.39 180.98 2k70 n LYS 78 N 5.15 1.81 0.32 3.23 0.00 -1.26 -4.48 118.16 122.94 2k70 n LYS 78 Ca 0.61 0.64 0.20 0.00 -0.00 0.00 0.00 58.31 59.77 2k70 n LYS 78 Cb 0.32 -2.21 1.04 0.00 -0.00 0.00 0.00 35.03 34.17 2k70 n LYS 78 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 2k70 h PRO 79 N 3.40 0.00 -0.00 -1.58 0.13 -1.93 0.31 132.00 132.32 2k70 h PRO 79 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2k70 h PRO 79 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2k70 h PRO 79 CO 0.70 0.01 -0.09 0.41 -0.23 0.00 0.00 178.00 178.80 2k70 n GLY 80 N -0.81 -0.84 0.00 1.56 0.00 -1.26 -4.88 105.19 98.96 2k70 n GLY 80 Ca -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.72 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 1.24 2.10 3.77 -0.02 0.00 0.09 -4.73 105.19 107.64 2k70 n GLY 81 Ca 0.16 -0.20 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 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 1.81 3.24 0.20 1.61 1.51 -1.23 -2.55 117.35 121.94 2k70 s TYR 82 Ca 0.00 1.59 -0.23 0.00 -1.01 0.00 0.00 57.07 57.42 2k70 s TYR 82 Cb 0.00 -3.36 0.05 0.00 -0.11 0.00 0.00 41.96 38.54 2k70 s TYR 82 CO 0.00 -1.06 0.80 -3.38 -1.11 0.00 0.00 175.55 170.80 2k70 s HIS 83 N -1.34 -0.22 0.12 2.71 -3.43 -0.71 -4.01 115.29 108.42 2k70 s HIS 83 Ca 0.52 -0.14 -0.09 0.00 -0.80 0.00 0.00 55.06 54.56 2k70 s HIS 83 Cb -0.31 0.66 -0.06 0.00 -1.43 0.00 0.00 32.58 31.44 2k70 s HIS 83 CO 0.39 -1.01 0.43 -0.06 -2.00 0.00 0.00 174.74 172.49 2k70 s PHE 84 N -3.63 3.53 -0.14 0.38 0.08 -0.43 -0.93 117.98 116.85 2k70 s PHE 84 Ca 0.10 0.75 -0.06 0.00 0.12 0.00 0.00 56.93 57.84 2k70 s PHE 84 Cb -0.03 -2.14 -0.04 0.00 -0.57 0.00 0.00 43.02 40.23 2k70 s PHE 84 CO 0.02 0.45 0.09 1.41 -0.10 0.00 0.00 175.22 177.09 2k70 s MET 85 N -2.27 3.55 -0.13 0.44 1.75 0.34 -0.55 119.30 122.44 2k70 s MET 85 Ca 0.38 -0.25 0.02 0.00 -1.25 0.00 0.00 55.69 54.59 2k70 s MET 85 Cb -0.13 -3.14 -0.00 0.00 2.84 0.00 0.00 34.83 34.40 2k70 s MET 85 CO 0.20 0.59 -0.19 -0.51 -0.65 0.00 0.00 175.02 174.47 2k70 s LEU 86 N -0.52 2.33 0.04 4.11 1.02 0.12 -0.83 118.68 124.96 2k70 s LEU 86 Ca 0.11 -0.49 0.06 0.00 0.02 0.00 0.00 54.13 53.83 2k70 s LEU 86 Cb -0.12 -1.50 -0.02 0.00 0.02 0.00 0.00 46.19 44.57 2k70 s LEU 86 CO 0.02 0.13 -0.18 -0.76 0.02 0.00 0.00 176.35 175.58 2k70 s LEU 87 N 0.54 2.17 -0.43 1.79 1.02 -0.47 -0.71 118.68 122.58 2k70 s LEU 87 Ca -0.12 -0.50 -0.00 0.00 0.02 0.00 0.00 54.13 53.53 2k70 s LEU 87 Cb -0.16 -0.83 -0.00 0.00 0.02 0.00 0.00 46.19 45.21 2k70 s LEU 87 CO 0.04 0.11 0.36 0.61 0.02 0.00 0.00 176.35 177.50 2k70 n GLY 88 N 1.84 0.15 3.64 -3.19 0.00 -0.49 -1.19 105.19 105.95 2k70 n GLY 88 Ca -0.18 -0.22 -0.34 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.15 3.62 -0.08 0.99 -0.00 -1.17 -1.19 117.00 117.03 2k70 n LEU 89 Ca -0.09 0.57 0.03 0.00 -0.00 0.00 0.00 56.01 56.51 2k70 n LEU 89 Cb 0.56 -1.45 -0.02 0.00 -0.00 0.00 0.00 43.42 42.51 2k70 n LEU 89 CO 0.22 -2.02 0.09 0.29 -0.00 0.00 0.00 177.39 175.98 2k70 n LYS 90 N -2.85 3.59 -4.19 1.47 4.01 -1.25 -4.86 118.16 114.08 2k70 n LYS 90 Ca 0.13 -0.26 -0.11 0.00 -0.51 0.00 0.00 58.31 57.56 2k70 n LYS 90 Cb 0.51 -0.88 -0.10 0.00 -0.51 0.00 0.00 35.03 34.05 2k70 n LYS 90 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 2k70 s ARG 91 N -1.26 1.12 0.95 1.97 0.52 -1.26 -5.03 118.95 115.96 2k70 s ARG 91 Ca 0.04 -1.57 -0.11 0.00 -0.52 0.00 0.00 55.73 53.57 2k70 s ARG 91 Cb 0.05 0.26 0.14 0.00 0.52 0.00 0.00 34.95 35.92 2k70 s ARG 91 CO 0.19 -0.35 1.01 -0.35 0.02 0.00 0.00 175.30 175.82 2k70 n PRO 92 N -0.22 -0.63 -3.75 3.54 -0.04 -1.26 -5.04 135.00 127.60 2k70 n PRO 92 Ca -0.00 -0.13 -0.29 0.00 -0.04 0.00 0.00 63.50 63.04 2k70 n PRO 92 Cb 0.65 -2.27 -0.15 0.00 -0.04 0.00 0.00 33.50 31.69 2k70 n PRO 92 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2k70 s LEU 93 N -5.75 1.97 0.25 1.53 0.05 -1.26 -5.05 118.68 110.43 2k70 s LEU 93 Ca 0.65 -1.39 0.10 0.00 0.05 0.00 0.00 54.13 53.55 2k70 s LEU 93 Cb -0.23 -0.82 -0.04 0.00 -2.05 0.00 0.00 46.19 43.05 2k70 s LEU 93 CO 0.60 -0.37 -0.08 -0.54 -0.55 0.00 0.00 176.35 175.41 2k70 s LYS 94 N 1.67 2.07 0.02 1.48 -0.14 -1.26 -2.18 119.74 121.39 2k70 s LYS 94 Ca 0.06 -1.49 -0.30 0.00 -1.36 0.00 0.00 55.97 52.88 2k70 s LYS 94 Cb -0.17 -2.05 -0.08 0.00 -1.68 0.00 0.00 37.83 33.85 2k70 s LYS 94 CO -0.19 0.37 1.90 0.00 -0.76 0.00 0.00 175.35 176.66 2k70 s ALA 95 N -2.25 3.59 0.00 5.17 0.00 -1.26 -1.28 121.76 125.73 2k70 s ALA 95 Ca 0.30 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.51 2k70 s ALA 95 Cb -0.06 -3.82 0.00 0.00 0.00 0.00 0.00 23.12 19.23 2k70 s ALA 95 CO 0.17 -1.52 0.00 0.41 0.00 0.00 0.00 175.76 174.82 2k70 n GLY 96 N 4.45 0.51 1.84 0.00 0.00 -0.44 -4.95 105.19 106.60 2k70 n GLY 96 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.85 -0.45 -3.65 1.61 1.02 -0.40 -4.92 120.64 112.01 2k70 n GLU 97 Ca 0.00 -1.04 -0.15 0.00 -0.02 0.00 0.00 57.16 55.95 2k70 n GLU 97 Cb 0.00 -0.59 -0.08 0.00 -0.02 0.00 0.00 31.44 30.76 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 -4.25 0.79 -0.13 3.49 -1.05 -1.26 -0.09 118.70 116.20 2k70 s GLU 98 Ca 0.35 0.39 -0.07 0.00 -0.15 0.00 0.00 54.97 55.49 2k70 s GLU 98 Cb -0.01 0.37 0.05 0.00 -0.44 0.00 0.00 34.13 34.10 2k70 s GLU 98 CO 0.24 -0.18 0.31 0.08 0.95 0.00 0.00 175.26 176.66 2k70 s VAL 99 N -0.56 -0.03 0.22 1.83 1.01 0.44 -4.83 120.40 118.47 2k70 s VAL 99 Ca -0.07 0.12 -0.30 0.00 0.00 0.00 0.00 61.98 61.74 2k70 s VAL 99 Cb -0.03 -0.47 -0.08 0.00 0.00 0.00 0.00 36.38 35.79 2k70 s VAL 99 CO 0.05 0.05 0.97 -1.61 0.00 0.00 0.00 175.10 174.56 2k70 s GLU 100 N 1.28 4.79 -0.07 2.72 2.02 -1.26 -1.54 118.70 126.64 2k70 s GLU 100 Ca -0.09 1.53 0.04 0.00 0.02 0.00 0.00 54.97 56.47 2k70 s GLU 100 Cb -0.09 -3.29 0.00 0.00 0.10 0.00 0.00 34.13 30.85 2k70 s GLU 100 CO -0.10 0.40 -0.19 -0.51 0.02 0.00 0.00 175.26 174.88 2k70 s LEU 101 N -0.96 1.93 -0.01 1.80 2.01 -0.60 -3.98 118.68 118.86 2k70 s LEU 101 Ca 0.43 -0.43 -0.13 0.00 0.01 0.00 0.00 54.13 54.00 2k70 s LEU 101 Cb -0.26 -1.14 -0.05 0.00 0.01 0.00 0.00 46.19 44.74 2k70 s LEU 101 CO 0.33 0.14 0.37 -1.81 1.01 0.00 0.00 176.35 176.39 2k70 s ASP 102 N 0.26 6.75 -0.16 2.29 1.01 0.11 0.05 116.67 126.97 2k70 s ASP 102 Ca -0.11 0.89 -0.05 0.00 0.71 0.00 0.00 52.55 53.99 2k70 s ASP 102 Cb -0.15 -2.22 -0.03 0.00 1.01 0.00 0.00 42.92 41.53 2k70 s ASP 102 CO 0.05 0.33 -0.00 -0.76 0.21 0.00 0.00 175.17 175.00 2k70 s LEU 103 N -1.11 3.44 -0.18 1.23 1.02 0.31 -1.07 118.68 122.32 2k70 s LEU 103 Ca 0.23 -0.05 -0.04 0.00 0.02 0.00 0.00 54.13 54.29 2k70 s LEU 103 Cb -0.16 -1.84 -0.02 0.00 0.02 0.00 0.00 46.19 44.19 2k70 s LEU 103 CO 0.12 0.18 -0.03 -0.76 0.02 0.00 0.00 176.35 175.87 2k70 s LEU 104 N 0.33 3.15 0.16 1.79 1.43 -0.10 -1.75 118.68 123.69 2k70 s LEU 104 Ca -0.02 -0.21 0.11 0.00 -1.03 0.00 0.00 54.13 52.99 2k70 s LEU 104 Cb -0.14 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 2k70 s LEU 104 CO 0.02 0.11 -0.26 -0.36 0.23 0.00 0.00 176.35 176.09 2k70 s PHE 105 N 0.71 2.31 0.68 0.29 0.40 -0.53 -0.39 117.98 121.45 2k70 s PHE 105 Ca -0.02 -0.37 -0.17 0.00 -0.60 0.00 0.00 56.93 55.77 2k70 s PHE 105 Cb -0.14 -1.20 0.00 0.00 0.51 0.00 0.00 43.02 42.18 2k70 s PHE 105 CO 0.02 0.41 1.16 0.00 0.70 0.00 0.00 175.22 177.51 2k70 n ALA 106 N 0.64 0.52 -1.18 5.36 0.00 -0.48 -3.44 120.51 121.93 2k70 n ALA 106 Ca -0.16 -0.09 -0.06 0.00 0.00 0.00 0.00 53.44 53.13 2k70 n ALA 106 Cb 0.54 -2.24 -0.03 0.00 0.00 0.00 0.00 19.45 17.73 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 0.96 0.84 1.49 0.00 0.00 -1.26 -4.33 105.19 102.89 2k70 n GLY 107 Ca 0.15 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.66 -0.60 3.33 -0.02 0.00 -1.23 -5.13 105.19 99.88 2k70 n GLY 108 Ca -0.06 -0.13 -0.13 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.38 0.54 0.02 1.61 1.02 -1.22 -5.06 119.74 115.26 2k70 s LYS 109 Ca 0.00 0.54 0.01 0.00 0.02 0.00 0.00 55.97 56.53 2k70 s LYS 109 Cb 0.00 0.26 -0.02 0.00 -0.52 0.00 0.00 37.83 37.55 2k70 s LYS 109 CO 0.00 -0.08 -0.04 0.08 -0.92 0.00 0.00 175.35 174.39 2k70 s VAL 110 N 0.07 0.22 -0.20 3.17 1.01 -1.26 -1.45 120.40 121.96 2k70 s VAL 110 Ca -0.01 -0.77 -0.05 0.00 0.00 0.00 0.00 61.98 61.14 2k70 s VAL 110 Cb -0.03 -0.31 0.10 0.00 0.00 0.00 0.00 36.38 36.13 2k70 s VAL 110 CO 0.01 -0.36 0.37 -0.22 0.00 0.00 0.00 175.10 174.90 2k70 s LEU 111 N -1.19 -0.55 -0.25 3.92 0.20 -0.72 -4.99 118.68 115.11 2k70 s LEU 111 Ca -0.11 0.65 -0.15 0.00 0.69 0.00 0.00 54.13 55.21 2k70 s LEU 111 Cb -0.08 1.12 -0.04 0.00 -0.43 0.00 0.00 46.19 46.76 2k70 s LEU 111 CO -0.00 -0.26 0.37 -0.75 -0.29 0.00 0.00 176.35 175.42 2k70 s LYS 112 N 2.54 4.07 0.51 1.98 2.36 -1.26 -0.53 119.74 129.41 2k70 s LYS 112 Ca 0.03 0.08 0.08 0.00 -2.55 0.00 0.00 55.97 53.61 2k70 s LYS 112 Cb -0.13 -3.61 0.04 0.00 -1.05 0.00 0.00 37.83 33.08 2k70 s LYS 112 CO -0.13 -0.18 0.53 0.14 1.55 0.00 0.00 175.35 177.26 2k70 s VAL 113 N 1.76 2.15 -0.02 4.02 -7.23 0.11 -4.98 120.40 116.22 2k70 s VAL 113 Ca 0.16 -1.27 0.00 0.00 -1.81 0.00 0.00 61.98 59.07 2k70 s VAL 113 Cb -0.15 -2.42 0.02 0.00 0.56 0.00 0.00 36.38 34.39 2k70 s VAL 113 CO 0.09 0.00 0.01 -0.69 -0.31 0.00 0.00 175.10 174.19 2k70 s VAL 114 N -2.63 0.08 0.10 1.32 1.01 -1.26 -1.56 120.40 117.45 2k70 s VAL 114 Ca 0.48 0.09 0.08 0.00 0.00 0.00 0.00 61.98 62.63 2k70 s VAL 114 Cb -0.04 -0.17 -0.03 0.00 0.00 0.00 0.00 36.38 36.14 2k70 s VAL 114 CO 0.29 0.10 -0.21 -0.76 0.00 0.00 0.00 175.10 174.52 2k70 s LEU 115 N 0.78 2.30 0.82 3.92 2.01 -0.59 -4.94 118.68 122.98 2k70 s LEU 115 Ca -0.07 -0.68 -0.11 0.00 0.01 0.00 0.00 54.13 53.27 2k70 s LEU 115 Cb -0.10 -0.89 0.09 0.00 0.01 0.00 0.00 46.19 45.30 2k70 s LEU 115 CO -0.02 0.06 1.13 -2.16 1.01 0.00 0.00 176.35 176.37 2k70 s PRO 116 N -1.90 1.76 -0.04 1.29 0.04 -1.26 -0.42 135.00 134.47 2k70 s PRO 116 Ca 0.06 1.40 -0.18 0.00 0.04 0.00 0.00 61.00 62.32 2k70 s PRO 116 Cb -0.10 -1.82 -0.05 0.00 0.04 0.00 0.00 34.50 32.57 2k70 s PRO 116 CO 0.04 -2.05 0.51 0.08 0.04 0.00 0.00 177.00 175.62 2k70 s VAL 117 N -2.67 5.02 0.30 -0.36 1.01 0.86 -0.74 120.40 123.82 2k70 s VAL 117 Ca 0.65 1.05 0.03 0.00 0.00 0.00 0.00 61.98 63.71 2k70 s VAL 117 Cb -0.21 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.30 2k70 s VAL 117 CO 0.55 0.43 0.17 -1.61 0.00 0.00 0.00 175.10 174.64 2k70 s GLU 118 N -0.18 1.57 -0.79 2.72 0.41 -0.54 -1.32 118.70 120.57 2k70 s GLU 118 Ca 0.27 -1.89 -0.08 0.00 -0.41 0.00 0.00 54.97 52.86 2k70 s GLU 118 Cb -0.17 -0.03 -0.16 0.00 -1.78 0.00 0.00 34.13 31.99 2k70 s GLU 118 CO 0.14 -0.46 3.11 0.00 -0.49 0.00 0.00 175.26 177.56 2k70 n ALA 119 N -0.56 6.59 0.00 5.21 0.00 -1.26 -2.01 120.51 128.48 2k70 n ALA 119 Ca 0.02 -2.53 0.00 0.00 0.00 0.00 0.00 53.44 50.93 2k70 n ALA 119 Cb 0.65 -2.84 0.00 0.00 0.00 0.00 0.00 19.45 17.26 2k70 n ALA 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04