#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 -0.14 0.71 1.61 1.04 -1.26 -5.19 113.70 110.48 2k70 s SER 2 Ca 0.00 -0.21 -0.05 0.00 0.48 0.00 0.00 55.95 56.17 2k70 s SER 2 Cb 0.00 0.30 0.08 0.00 0.10 0.00 0.00 66.02 66.51 2k70 s SER 2 CO 0.00 -0.55 1.01 0.72 0.98 0.00 0.00 173.24 175.40 2k70 s PHE 3 N -2.81 2.51 0.12 5.02 -0.12 -1.26 -5.15 117.98 116.29 2k70 s PHE 3 Ca 0.12 0.22 -0.05 0.00 -0.05 0.00 0.00 56.93 57.17 2k70 s PHE 3 Cb 0.01 -3.19 -0.02 0.00 -0.63 0.00 0.00 43.02 39.19 2k70 s PHE 3 CO -0.02 -1.52 0.14 0.95 -0.05 0.00 0.00 175.22 174.72 2k70 s THR 4 N -3.22 0.12 0.07 -4.49 -4.23 -1.26 -5.19 115.64 97.44 2k70 s THR 4 Ca 0.62 -1.55 0.04 0.00 -1.18 0.00 0.00 61.69 59.62 2k70 s THR 4 Cb -0.09 -1.71 -0.03 0.00 1.34 0.00 0.00 72.50 72.01 2k70 s THR 4 CO 0.45 -0.56 -0.11 -0.70 -0.54 0.00 0.00 174.62 173.16 2k70 s GLU 5 N -3.95 0.74 0.51 3.99 2.56 -1.26 -4.75 118.70 116.54 2k70 s GLU 5 Ca 0.14 -0.98 -0.03 0.00 0.00 0.00 0.00 54.97 54.11 2k70 s GLU 5 Cb 0.06 -0.55 -0.00 0.00 2.00 0.00 0.00 34.13 35.64 2k70 s GLU 5 CO -0.04 0.10 0.78 0.20 -0.56 0.00 0.00 175.26 175.74 2k70 s GLY 6 N -1.98 1.58 0.39 -1.50 0.00 -1.26 -4.85 107.32 99.70 2k70 s GLY 6 Ca -0.01 -0.86 0.08 0.00 0.00 0.00 0.00 44.72 43.92 2k70 s GLY 6 CO 0.01 -0.65 0.31 0.66 0.00 0.00 0.00 173.10 173.43 2k70 s TRP 7 N -2.75 2.73 -0.09 1.90 -2.14 -1.26 -4.03 118.94 113.30 2k70 s TRP 7 Ca 0.51 -0.46 -0.19 0.00 2.66 0.00 0.00 56.10 58.62 2k70 s TRP 7 Cb -0.10 -2.02 -0.04 0.00 -3.10 0.00 0.00 33.47 28.21 2k70 s TRP 7 CO 0.41 0.03 0.52 0.08 -2.66 0.00 0.00 176.95 175.33 2k70 s VAL 8 N -2.46 5.12 -0.53 -0.66 1.01 -0.01 -2.09 120.40 120.79 2k70 s VAL 8 Ca 0.45 1.05 -0.28 0.00 0.00 0.00 0.00 61.98 63.19 2k70 s VAL 8 Cb -0.02 -3.85 0.03 0.00 0.00 0.00 0.00 36.38 32.53 2k70 s VAL 8 CO 0.26 0.35 1.23 -0.60 0.00 0.00 0.00 175.10 176.35 2k70 s ARG 9 N 0.39 3.56 0.51 2.72 3.00 -0.08 -3.33 118.95 125.72 2k70 s ARG 9 Ca 0.28 0.46 -0.18 0.00 -1.00 0.00 0.00 55.73 55.28 2k70 s ARG 9 Cb -0.16 -4.00 -0.13 0.00 0.00 0.00 0.00 34.95 30.66 2k70 s ARG 9 CO 0.12 -1.61 0.09 0.34 0.00 0.00 0.00 175.30 174.25 2k70 n PHE 10 N 8.47 -2.14 -3.69 5.12 -0.00 -1.20 -3.81 117.46 120.21 2k70 n PHE 10 Ca 0.11 0.47 -0.14 0.00 -0.00 0.00 0.00 57.45 57.89 2k70 n PHE 10 Cb 0.49 -1.78 -0.07 0.00 -0.00 0.00 0.00 39.48 38.12 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 -1.05 -0.30 0.00 -2.13 0.15 -1.26 -4.90 113.70 104.21 2k70 s SER 11 Ca 0.61 0.16 0.28 0.00 0.70 0.00 0.00 55.95 57.70 2k70 s SER 11 Cb -0.50 0.39 1.04 0.00 -1.71 0.00 0.00 66.02 65.25 2k70 s SER 11 CO 0.62 -0.55 1.74 -0.81 1.20 0.00 0.00 173.24 175.45 2k70 n PRO 12 N 0.96 1.14 -3.91 5.44 -0.04 -1.26 -4.41 135.00 132.91 2k70 n PRO 12 Ca -0.20 -0.59 -0.26 0.00 -0.04 0.00 0.00 63.50 62.41 2k70 n PRO 12 Cb 0.57 -1.49 -0.01 0.00 -0.04 0.00 0.00 33.50 32.53 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 1.24 2.91 0.20 0.55 0.00 -1.26 -5.04 105.19 103.79 2k70 n GLY 13 Ca 0.16 -2.31 0.15 0.00 0.00 0.00 0.00 46.02 44.02 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 -6.34 1.61 0.13 -1.95 -3.44 132.00 122.02 2k70 h PRO 14 Ca -0.35 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.17 2k70 h PRO 14 Cb 1.23 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.25 2k70 h PRO 14 CO 0.56 0.00 -0.65 0.54 -0.23 0.00 0.00 178.00 178.21 2k70 s ASN 15 N -4.93 4.84 0.32 1.44 2.20 -1.26 -1.53 114.94 116.02 2k70 s ASN 15 Ca 0.03 -0.35 -0.04 0.00 -0.94 0.00 0.00 52.86 51.55 2k70 s ASN 15 Cb 0.09 -1.06 0.02 0.00 -2.00 0.00 0.00 41.25 38.30 2k70 s ASN 15 CO 0.46 0.10 0.49 0.00 -2.94 0.00 0.00 177.10 175.21 2k70 n ALA 16 N -0.02 -0.60 -3.08 3.54 0.00 -0.15 -4.72 120.51 115.48 2k70 n ALA 16 Ca -0.10 -1.35 -0.12 0.00 0.00 0.00 0.00 53.44 51.87 2k70 n ALA 16 Cb 0.55 1.08 -0.08 0.00 0.00 0.00 0.00 19.45 21.00 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 -2.46 -0.66 0.00 0.00 0.00 -1.25 -0.83 121.76 116.56 2k70 s ALA 17 Ca 0.23 0.09 -0.02 0.00 0.00 0.00 0.00 51.96 52.25 2k70 s ALA 17 Cb -0.02 0.21 -0.01 0.00 0.00 0.00 0.00 23.12 23.31 2k70 s ALA 17 CO 0.16 -0.34 0.04 0.00 0.00 0.00 0.00 175.76 175.62 2k70 s ALA 18 N -2.02 -0.07 -0.24 0.00 0.00 -0.63 -0.91 121.76 117.89 2k70 s ALA 18 Ca -0.09 -0.23 0.10 0.00 0.00 0.00 0.00 51.96 51.74 2k70 s ALA 18 Cb -0.03 0.06 0.45 0.00 0.00 0.00 0.00 23.12 23.60 2k70 s ALA 18 CO -0.00 -0.13 1.31 0.66 0.00 0.00 0.00 175.76 177.60 2k70 n TYR 19 N 2.05 0.38 -0.82 0.00 4.01 -0.89 -1.81 117.16 120.09 2k70 n TYR 19 Ca -0.20 -1.53 -0.34 0.00 -0.16 0.00 0.00 57.90 55.68 2k70 n TYR 19 Cb 0.57 -0.33 0.11 0.00 -0.31 0.00 0.00 39.34 39.37 2k70 n TYR 19 CO 0.00 0.00 0.00 1.47 -0.46 0.00 0.00 176.86 177.87 2k70 n LEU 20 N -1.13 -1.67 -4.66 7.72 -0.00 -1.26 -3.73 117.00 112.27 2k70 n LEU 20 Ca 0.24 0.22 -0.43 0.00 -0.00 0.00 0.00 56.01 56.04 2k70 n LEU 20 Cb 0.81 -1.06 -0.02 0.00 -0.00 0.00 0.00 43.42 43.15 2k70 n LEU 20 CO 0.04 -3.93 0.93 -0.89 -0.00 0.00 0.00 177.39 173.54 2k70 s THR 21 N -2.29 4.64 0.16 1.47 2.01 -1.26 -0.70 115.64 119.67 2k70 s THR 21 Ca 0.53 1.98 -0.26 0.00 0.31 0.00 0.00 61.69 64.25 2k70 s THR 21 Cb -0.18 -4.29 -0.08 0.00 0.01 0.00 0.00 72.50 67.96 2k70 s THR 21 CO 0.70 -0.19 0.81 -0.22 -0.69 0.00 0.00 174.62 175.02 2k70 s LEU 22 N 3.25 4.59 0.26 4.42 1.98 -0.17 -4.94 118.68 128.06 2k70 s LEU 22 Ca 0.45 1.68 -0.06 0.00 -2.89 0.00 0.00 54.13 53.30 2k70 s LEU 22 Cb -0.15 -3.35 -0.01 0.00 0.66 0.00 0.00 46.19 43.33 2k70 s LEU 22 CO 0.07 0.17 0.38 -1.83 -1.89 0.00 0.00 176.35 173.25 2k70 s GLU 23 N -1.00 1.56 -0.27 1.98 4.04 -1.26 -0.56 118.70 123.18 2k70 s GLU 23 Ca 0.37 -1.50 -0.02 0.00 0.04 0.00 0.00 54.97 53.86 2k70 s GLU 23 Cb -0.23 0.41 0.16 0.00 0.02 0.00 0.00 34.13 34.48 2k70 s GLU 23 CO 0.27 -0.62 0.49 1.21 -1.84 0.00 0.00 175.26 174.78 2k70 s ASN 24 N -3.12 -0.59 0.00 0.83 3.84 -0.33 -4.95 114.94 110.61 2k70 s ASN 24 Ca 0.29 0.59 0.26 0.00 0.21 0.00 0.00 52.86 54.21 2k70 s ASN 24 Cb 0.02 1.66 0.68 0.00 -0.55 0.00 0.00 41.25 43.05 2k70 s ASN 24 CO 0.13 -0.28 1.52 -0.81 -2.79 0.00 0.00 177.10 174.87 2k70 n PRO 25 N 5.40 0.72 -2.54 0.43 -0.04 -1.26 -2.13 135.00 135.57 2k70 n PRO 25 Ca -0.03 -0.43 -0.24 0.00 -0.04 0.00 0.00 63.50 62.76 2k70 n PRO 25 Cb 0.51 -1.49 0.12 0.00 -0.04 0.00 0.00 33.50 32.59 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 -2.58 1.76 0.00 0.55 0.00 -1.26 -4.70 107.32 101.09 2k70 s GLY 26 Ca 0.22 -1.72 0.22 0.00 0.00 0.00 0.00 44.72 43.44 2k70 s GLY 26 CO 0.55 -1.12 1.31 1.22 0.00 0.00 0.00 173.10 175.06 2k70 n ASP 27 N -2.93 3.20 -4.50 1.64 8.00 -1.26 -1.86 116.55 118.83 2k70 n ASP 27 Ca 0.15 -1.96 -0.24 0.00 0.71 0.00 0.00 54.79 53.46 2k70 n ASP 27 Cb 0.61 -0.15 -0.10 0.00 -0.02 0.00 0.00 41.12 41.46 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 -1.59 2.70 0.29 0.64 0.05 -1.26 -4.81 118.68 114.69 2k70 s LEU 28 Ca 0.33 -0.97 -0.28 0.00 0.05 0.00 0.00 54.13 53.26 2k70 s LEU 28 Cb 0.21 -1.21 -0.09 0.00 -2.05 0.00 0.00 46.19 43.04 2k70 s LEU 28 CO 0.29 0.02 0.95 -2.16 -0.55 0.00 0.00 176.35 174.90 2k70 s PRO 29 N -3.54 4.70 0.20 1.48 0.04 -1.26 -3.96 135.00 132.65 2k70 s PRO 29 Ca 0.30 1.42 0.05 0.00 0.04 0.00 0.00 61.00 62.81 2k70 s PRO 29 Cb -0.05 -3.03 -0.03 0.00 0.04 0.00 0.00 34.50 31.43 2k70 s PRO 29 CO 0.16 0.38 0.24 -0.51 0.04 0.00 0.00 177.00 177.31 2k70 s LEU 30 N -1.65 4.06 -0.27 -3.56 2.01 0.03 -4.97 118.68 114.33 2k70 s LEU 30 Ca 0.46 -0.03 0.00 0.00 0.01 0.00 0.00 54.13 54.57 2k70 s LEU 30 Cb -0.22 -2.63 0.16 0.00 0.01 0.00 0.00 46.19 43.50 2k70 s LEU 30 CO 0.28 0.01 0.43 -0.60 1.01 0.00 0.00 176.35 177.48 2k70 s ARG 31 N -3.49 0.41 -0.16 1.70 3.52 -1.26 -0.44 118.95 119.23 2k70 s ARG 31 Ca 0.33 0.38 -0.27 0.00 -0.13 0.00 0.00 55.73 56.04 2k70 s ARG 31 Cb -0.10 -0.26 -0.01 0.00 -1.56 0.00 0.00 34.95 33.02 2k70 s ARG 31 CO 0.26 -0.86 0.89 -1.17 -0.81 0.00 0.00 175.30 173.62 2k70 s LEU 32 N 2.59 4.18 -0.01 -0.88 0.20 0.31 -1.39 118.68 123.68 2k70 s LEU 32 Ca 0.12 1.27 0.10 0.00 0.69 0.00 0.00 54.13 56.30 2k70 s LEU 32 Cb -0.14 -3.33 -0.13 0.00 -0.43 0.00 0.00 46.19 42.16 2k70 s LEU 32 CO -0.24 -0.44 0.31 1.33 -0.29 0.00 0.00 176.35 177.03 2k70 n VAL 33 N 4.76 0.00 -3.65 1.68 0.24 0.31 -0.47 118.33 121.19 2k70 n VAL 33 Ca 0.06 -0.25 -0.07 0.00 -2.04 0.00 0.00 64.34 62.04 2k70 n VAL 33 Cb 0.48 0.63 0.01 0.00 -1.47 0.00 0.00 33.84 33.49 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 1.59 1.51 3.43 7.63 0.00 -1.04 -4.74 105.19 113.57 2k70 n GLY 34 Ca -0.00 -1.27 -0.13 0.00 0.00 0.00 0.00 46.02 44.62 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 -1.26 -0.74 -3.51 4.61 0.00 -1.26 -1.28 120.51 117.07 2k70 n ALA 35 Ca -0.12 -1.50 -0.09 0.00 0.00 0.00 0.00 53.44 51.73 2k70 n ALA 35 Cb 0.43 1.21 -0.02 0.00 0.00 0.00 0.00 19.45 21.06 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 -2.59 1.84 0.00 0.00 1.81 -0.23 -4.84 118.95 114.93 2k70 s ARG 36 Ca 0.25 -1.28 0.00 0.00 -1.72 0.00 0.00 55.73 52.98 2k70 s ARG 36 Cb -0.02 0.55 0.00 0.00 -0.45 0.00 0.00 34.95 35.03 2k70 s ARG 36 CO 0.18 -0.82 0.00 -2.37 -0.68 0.00 0.00 175.30 171.61 2k70 n THR 37 N -0.47 0.00 0.38 0.02 5.66 -1.26 -0.71 114.28 117.90 2k70 n THR 37 Ca -0.04 0.00 0.13 0.00 -3.05 0.00 0.00 64.05 61.09 2k70 n THR 37 Cb 0.60 0.00 0.53 0.00 -1.55 0.00 0.00 70.33 69.91 2k70 n THR 37 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2k70 h PRO 38 N 0.00 0.00 -0.64 1.09 0.13 -2.01 -3.05 132.00 127.52 2k70 h PRO 38 Ca 0.00 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.02 2k70 h PRO 38 Cb 0.00 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.07 2k70 h PRO 38 CO 0.00 0.00 0.13 1.33 -0.23 0.00 0.00 178.00 179.23 2k70 n VAL 39 N -2.39 2.84 -3.81 1.56 0.24 -1.26 -4.73 118.33 110.77 2k70 n VAL 39 Ca 0.02 -1.57 -0.13 0.00 -2.04 0.00 0.00 64.34 60.62 2k70 n VAL 39 Cb 0.24 -0.32 -0.13 0.00 -1.47 0.00 0.00 33.84 32.17 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 -2.90 -0.33 -0.03 2.33 0.00 -1.15 -3.37 121.76 116.31 2k70 s ALA 40 Ca 0.54 0.43 -0.15 0.00 0.00 0.00 0.00 51.96 52.79 2k70 s ALA 40 Cb 0.43 -0.26 -0.32 0.00 0.00 0.00 0.00 23.12 22.97 2k70 s ALA 40 CO 0.14 -0.08 0.78 1.49 0.00 0.00 0.00 175.76 178.09 2k70 h GLU 41 N 6.14 0.41 -5.23 0.00 4.81 -0.95 -3.43 114.58 116.33 2k70 h GLU 41 Ca -0.28 -0.71 -0.38 0.00 -0.13 0.00 0.00 59.36 57.86 2k70 h GLU 41 Cb 1.19 0.26 -0.19 0.00 0.63 0.00 0.00 28.75 30.64 2k70 h GLU 41 CO 0.42 1.34 -0.76 1.03 -0.73 0.00 0.00 179.01 180.31 2k70 s ARG 42 N -2.55 0.87 -0.04 1.92 0.52 -0.61 -5.03 118.95 114.03 2k70 s ARG 42 Ca -0.14 -1.09 -0.09 0.00 -0.52 0.00 0.00 55.73 53.89 2k70 s ARG 42 Cb 0.04 -0.75 0.01 0.00 0.52 0.00 0.00 34.95 34.78 2k70 s ARG 42 CO 0.87 0.15 0.22 0.54 0.02 0.00 0.00 175.30 177.09 2k70 s VAL 43 N -1.86 0.05 0.03 3.52 0.11 -1.26 -1.27 120.40 119.72 2k70 s VAL 43 Ca 0.03 -0.38 0.04 0.00 -2.93 0.00 0.00 61.98 58.73 2k70 s VAL 43 Cb -0.07 -0.44 -0.02 0.00 -1.53 0.00 0.00 36.38 34.33 2k70 s VAL 43 CO 0.02 -0.21 -0.11 -1.61 -3.33 0.00 0.00 175.10 169.86 2k70 s GLU 44 N -0.81 0.76 -0.30 1.54 2.02 -0.14 -4.99 118.70 116.78 2k70 s GLU 44 Ca -0.09 -0.64 -0.12 0.00 0.02 0.00 0.00 54.97 54.14 2k70 s GLU 44 Cb -0.05 -0.71 -0.04 0.00 0.10 0.00 0.00 34.13 33.43 2k70 s GLU 44 CO 0.02 0.17 0.22 -1.17 0.02 0.00 0.00 175.26 174.52 2k70 s LEU 45 N -1.01 4.15 0.17 1.80 2.96 -1.26 -0.38 118.68 125.10 2k70 s LEU 45 Ca -0.01 -0.09 0.10 0.00 -0.22 0.00 0.00 54.13 53.91 2k70 s LEU 45 Cb -0.07 -2.15 -0.04 0.00 0.50 0.00 0.00 46.19 44.43 2k70 s LEU 45 CO 0.01 -0.11 -0.21 -1.00 -1.32 0.00 0.00 176.35 173.71 2k70 s HIS 46 N 1.78 2.06 0.31 5.38 3.76 -0.10 -0.46 115.29 128.01 2k70 s HIS 46 Ca 0.07 -0.41 0.07 0.00 -0.15 0.00 0.00 55.06 54.64 2k70 s HIS 46 Cb -0.16 -1.03 -0.02 0.00 1.11 0.00 0.00 32.58 32.47 2k70 s HIS 46 CO 0.11 0.40 0.38 -1.83 -0.85 0.00 0.00 174.74 172.95 2k70 s GLU 47 N -2.63 3.07 -0.09 1.40 -1.05 -0.02 -0.72 118.70 118.65 2k70 s GLU 47 Ca 0.17 -1.03 0.04 0.00 -0.15 0.00 0.00 54.97 54.00 2k70 s GLU 47 Cb -0.07 -2.73 0.00 0.00 -0.44 0.00 0.00 34.13 30.89 2k70 s GLU 47 CO 0.08 0.18 -0.23 0.99 0.95 0.00 0.00 175.26 177.22 2k70 s THR 48 N -2.16 1.97 0.31 1.83 2.01 0.80 -2.48 115.64 117.91 2k70 s THR 48 Ca 0.41 -0.97 0.05 0.00 0.31 0.00 0.00 61.69 61.48 2k70 s THR 48 Cb -0.08 -1.70 -0.06 0.00 0.01 0.00 0.00 72.50 70.66 2k70 s THR 48 CO 0.29 0.54 0.03 0.72 -0.69 0.00 0.00 174.62 175.51 2k70 s PHE 49 N 0.31 1.96 0.06 4.92 -0.12 -0.09 -4.35 117.98 120.68 2k70 s PHE 49 Ca -0.17 -0.88 0.04 0.00 -0.05 0.00 0.00 56.93 55.87 2k70 s PHE 49 Cb -0.17 -1.25 -0.04 0.00 -0.63 0.00 0.00 43.02 40.93 2k70 s PHE 49 CO 0.08 0.09 -0.02 0.00 -0.05 0.00 0.00 175.22 175.31 2k70 s MET 50 N -3.84 2.53 -0.06 1.99 0.23 -1.26 -1.15 119.30 117.74 2k70 s MET 50 Ca 0.34 -0.81 -0.23 0.00 -1.03 0.00 0.00 55.69 53.96 2k70 s MET 50 Cb 0.08 -2.52 0.05 0.00 -1.53 0.00 0.00 34.83 30.90 2k70 s MET 50 CO 0.14 0.56 0.53 0.50 -2.03 0.00 0.00 175.02 174.72 2k70 s ARG 51 N -2.03 0.86 -0.09 3.16 3.00 -0.08 -4.94 118.95 118.81 2k70 s ARG 51 Ca 0.23 0.18 -0.09 0.00 -1.00 0.00 0.00 55.73 55.05 2k70 s ARG 51 Cb -0.11 0.40 -0.04 0.00 0.00 0.00 0.00 34.95 35.19 2k70 s ARG 51 CO 0.15 -0.24 0.20 -2.00 0.00 0.00 0.00 175.30 173.41 2k70 s GLU 52 N -1.02 3.54 -0.08 5.12 2.56 -1.26 0.00 118.70 127.57 2k70 s GLU 52 Ca -0.10 -0.01 -0.02 0.00 0.00 0.00 0.00 54.97 54.84 2k70 s GLU 52 Cb -0.02 -3.20 0.03 0.00 2.00 0.00 0.00 34.13 32.94 2k70 s GLU 52 CO 0.07 0.76 0.04 0.08 -0.56 0.00 0.00 175.26 175.64 2k70 s VAL 53 N -1.04 0.13 -0.77 3.70 1.01 -0.08 -4.88 120.40 118.47 2k70 s VAL 53 Ca 0.17 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.33 2k70 s VAL 53 Cb -0.13 -0.40 0.00 0.00 0.00 0.00 0.00 36.38 35.85 2k70 s VAL 53 CO 0.06 0.14 0.00 -0.62 0.00 0.00 0.00 175.10 174.69 2k70 n GLU 54 N 5.22 -1.16 -0.90 2.72 1.02 -1.26 -0.86 120.64 125.42 2k70 n GLU 54 Ca -0.05 0.68 0.00 0.00 -0.02 0.00 0.00 57.16 57.76 2k70 n GLU 54 Cb 0.50 -4.74 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 -0.78 0.56 2.98 0.62 0.00 -1.26 -5.07 105.19 102.24 2k70 n GLY 55 Ca -0.07 -0.82 -0.30 0.00 0.00 0.00 0.00 46.02 44.82 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 -1.83 1.94 -0.17 1.61 1.02 -0.04 -5.11 119.74 117.16 2k70 s LYS 56 Ca 0.00 -0.88 -0.27 0.00 0.02 0.00 0.00 55.97 54.84 2k70 s LYS 56 Cb 0.00 -2.46 -0.01 0.00 -0.52 0.00 0.00 37.83 34.84 2k70 s LYS 56 CO 0.00 -0.47 0.90 -1.59 -0.92 0.00 0.00 175.35 173.28 2k70 s LYS 57 N 1.39 4.30 0.47 1.68 0.00 -1.26 -0.90 119.74 125.42 2k70 s LYS 57 Ca -0.02 1.14 0.03 0.00 0.00 0.00 0.00 55.97 57.12 2k70 s LYS 57 Cb -0.17 -3.59 -0.01 0.00 0.00 0.00 0.00 37.83 34.06 2k70 s LYS 57 CO -0.08 -0.40 0.09 0.14 0.00 0.00 0.00 175.35 175.11 2k70 s VAL 58 N 2.37 0.70 0.17 1.79 -7.23 0.10 -4.99 120.40 113.31 2k70 s VAL 58 Ca 0.41 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.61 2k70 s VAL 58 Cb -0.16 -2.17 -0.05 0.00 0.56 0.00 0.00 36.38 34.56 2k70 s VAL 58 CO 0.12 0.00 -0.05 -0.04 -0.31 0.00 0.00 175.10 174.82 2k70 s MET 59 N -3.75 1.12 0.25 4.82 -1.94 -1.26 -0.91 119.30 117.63 2k70 s MET 59 Ca 0.13 -1.52 -0.06 0.00 -1.71 0.00 0.00 55.69 52.54 2k70 s MET 59 Cb 0.01 -0.48 0.03 0.00 2.01 0.00 0.00 34.83 36.40 2k70 s MET 59 CO 0.09 -0.03 0.45 0.41 -0.01 0.00 0.00 175.02 175.93 2k70 n GLY 60 N -0.25 1.78 3.27 -0.03 0.00 -0.30 -4.93 105.19 104.73 2k70 n GLY 60 Ca -0.08 -1.32 -0.14 0.00 0.00 0.00 0.00 46.02 44.48 2k70 n GLY 60 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2k70 s MET 61 N -2.26 0.66 0.10 1.61 1.75 -1.26 -0.91 119.30 118.99 2k70 s MET 61 Ca 0.14 -0.01 -0.23 0.00 -1.25 0.00 0.00 55.69 54.34 2k70 s MET 61 Cb -0.02 0.30 0.06 0.00 2.84 0.00 0.00 34.83 38.01 2k70 s MET 61 CO 0.10 -0.17 0.58 -0.98 -0.65 0.00 0.00 175.02 173.90 2k70 s ARG 62 N -1.01 1.17 0.61 4.11 1.70 -1.04 -4.99 118.95 119.50 2k70 s ARG 62 Ca -0.11 -0.33 -0.16 0.00 -0.47 0.00 0.00 55.73 54.67 2k70 s ARG 62 Cb -0.04 0.54 -0.03 0.00 -0.57 0.00 0.00 34.95 34.85 2k70 s ARG 62 CO 0.04 -0.47 1.07 -1.25 -1.08 0.00 0.00 175.30 173.61 2k70 s PRO 63 N -3.08 3.18 0.06 3.89 0.04 -1.26 -0.84 135.00 136.99 2k70 s PRO 63 Ca -0.02 1.26 0.01 0.00 0.04 0.00 0.00 61.00 62.29 2k70 s PRO 63 Cb -0.00 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.49 2k70 s PRO 63 CO -0.07 -0.93 -0.05 0.14 0.04 0.00 0.00 177.00 176.12 2k70 s VAL 64 N -2.42 0.46 -0.07 -0.36 -7.23 0.39 -4.79 120.40 106.39 2k70 s VAL 64 Ca 0.65 -1.58 0.13 0.00 -1.81 0.00 0.00 61.98 59.36 2k70 s VAL 64 Cb -0.17 -1.22 -0.05 0.00 0.56 0.00 0.00 36.38 35.50 2k70 s VAL 64 CO 0.38 -0.75 1.30 1.55 -0.31 0.00 0.00 175.10 177.27 2k70 h PRO 65 N 3.57 0.00 -1.47 4.82 0.13 -1.95 -3.42 132.00 133.67 2k70 h PRO 65 Ca -0.35 0.00 0.29 0.00 -0.87 0.00 0.00 66.00 65.07 2k70 h PRO 65 Cb 1.17 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.15 2k70 h PRO 65 CO 0.57 0.63 0.82 -0.59 -0.23 0.00 0.00 178.00 179.19 2k70 s PHE 66 N -2.87 -0.09 0.17 1.56 -0.12 -1.26 -4.72 117.98 110.65 2k70 s PHE 66 Ca 0.02 0.01 0.08 0.00 -0.05 0.00 0.00 56.93 56.99 2k70 s PHE 66 Cb 0.08 0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 42.96 2k70 s PHE 66 CO 0.78 -0.24 -0.07 -0.51 -0.05 0.00 0.00 175.22 175.12 2k70 s LEU 67 N -2.55 3.07 0.03 -1.99 1.43 0.38 -4.99 118.68 114.05 2k70 s LEU 67 Ca 0.12 -0.51 0.02 0.00 -1.03 0.00 0.00 54.13 52.73 2k70 s LEU 67 Cb 0.02 -1.76 -0.02 0.00 0.03 0.00 0.00 46.19 44.46 2k70 s LEU 67 CO -0.04 0.11 -0.07 -0.70 0.23 0.00 0.00 176.35 175.88 2k70 s GLU 68 N -2.78 0.48 -0.04 1.70 2.12 -1.26 -0.53 118.70 118.39 2k70 s GLU 68 Ca 0.25 -0.63 -0.01 0.00 0.36 0.00 0.00 54.97 54.94 2k70 s GLU 68 Cb -0.09 -0.28 0.03 0.00 0.26 0.00 0.00 34.13 34.05 2k70 s GLU 68 CO 0.16 0.05 0.08 0.08 -0.54 0.00 0.00 175.26 175.09 2k70 s VAL 69 N -1.13 -0.05 0.82 3.70 1.01 0.42 -4.98 120.40 120.18 2k70 s VAL 69 Ca -0.08 0.17 -0.11 0.00 0.00 0.00 0.00 61.98 61.96 2k70 s VAL 69 Cb -0.08 -0.14 0.08 0.00 0.00 0.00 0.00 36.38 36.24 2k70 s VAL 69 CO 0.00 0.07 1.09 -2.16 0.00 0.00 0.00 175.10 174.10 2k70 s PRO 70 N 0.96 1.89 0.36 2.72 0.04 -1.26 -0.79 135.00 138.93 2k70 s PRO 70 Ca -0.08 1.02 -0.27 0.00 0.04 0.00 0.00 61.00 61.72 2k70 s PRO 70 Cb -0.11 -1.87 -0.12 0.00 0.04 0.00 0.00 34.50 32.45 2k70 s PRO 70 CO -0.04 -1.86 1.24 -0.35 0.04 0.00 0.00 177.00 176.03 2k70 n PRO 71 N -3.65 1.96 -0.77 0.56 -0.04 -1.25 -2.68 135.00 129.12 2k70 n PRO 71 Ca 0.08 0.69 0.00 0.00 -0.04 0.00 0.00 63.50 64.23 2k70 n PRO 71 Cb 0.54 -2.28 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 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 0.41 -0.38 -2.68 0.54 4.76 -0.78 -4.98 118.16 115.06 2k70 n LYS 72 Ca 0.06 0.09 -0.27 0.00 -2.87 0.00 0.00 58.31 55.32 2k70 n LYS 72 Cb 0.37 -3.95 0.00 0.00 -1.84 0.00 0.00 35.03 29.61 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 1.49 -0.01 0.72 0.00 -1.09 -4.88 107.32 101.54 2k70 s GLY 73 Ca 0.00 -0.55 -0.05 0.00 0.00 0.00 0.00 44.72 44.12 2k70 s GLY 73 CO 0.00 -0.39 0.10 1.09 0.00 0.00 0.00 173.10 173.90 2k70 s ARG 74 N -4.73 0.31 -0.22 2.90 1.04 -1.26 -1.19 118.95 115.81 2k70 s ARG 74 Ca 0.47 -0.22 -0.15 0.00 -1.04 0.00 0.00 55.73 54.79 2k70 s ARG 74 Cb -0.10 0.13 0.07 0.00 -2.04 0.00 0.00 34.95 33.00 2k70 s ARG 74 CO 0.44 -0.06 0.56 0.08 -0.04 0.00 0.00 175.30 176.28 2k70 s VAL 75 N -0.83 -0.01 0.21 4.99 1.01 0.27 -4.99 120.40 121.06 2k70 s VAL 75 Ca -0.09 0.03 -0.25 0.00 0.00 0.00 0.00 61.98 61.67 2k70 s VAL 75 Cb -0.05 -0.80 -0.08 0.00 0.00 0.00 0.00 36.38 35.44 2k70 s VAL 75 CO 0.01 0.01 0.81 -1.61 0.00 0.00 0.00 175.10 174.32 2k70 s GLU 76 N 1.17 4.54 0.29 2.72 8.01 -1.26 -1.00 118.70 133.17 2k70 s GLU 76 Ca -0.07 1.17 0.03 0.00 0.01 0.00 0.00 54.97 56.11 2k70 s GLU 76 Cb -0.06 -3.11 0.73 0.00 -4.31 0.00 0.00 34.13 27.39 2k70 s GLU 76 CO -0.11 0.48 1.67 -0.07 0.01 0.00 0.00 175.26 177.23 2k70 h LEU 77 N 3.92 0.16 0.00 1.80 4.07 -1.00 -3.47 115.31 120.79 2k70 h LEU 77 Ca -0.47 0.18 0.00 0.00 0.08 0.00 0.00 57.88 57.67 2k70 h LEU 77 Cb 1.20 0.21 0.00 0.00 1.08 0.00 0.00 40.66 43.15 2k70 h LEU 77 CO 0.66 -0.10 0.00 1.17 -1.08 0.00 0.00 178.44 179.09 2k70 n LYS 78 N -5.15 0.00 -1.64 1.13 3.00 -1.10 -1.30 118.16 113.11 2k70 n LYS 78 Ca 0.22 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 58.11 2k70 n LYS 78 Cb 0.69 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.69 2k70 n LYS 78 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 2k70 n PRO 79 N 1.78 2.53 -1.64 1.64 -0.04 -1.26 -2.50 135.00 135.51 2k70 n PRO 79 Ca 0.00 0.86 -0.01 0.00 -0.04 0.00 0.00 63.50 64.30 2k70 n PRO 79 Cb 0.00 -3.11 -0.00 0.00 -0.04 0.00 0.00 33.50 30.35 2k70 n PRO 79 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k70 n GLY 80 N 5.03 0.38 0.55 0.55 0.00 -1.26 -4.92 105.19 105.51 2k70 n GLY 80 Ca 0.24 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.72 0.01 2.99 -0.02 0.00 -1.04 -4.66 105.19 100.75 2k70 n GLY 81 Ca -0.01 -0.03 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.27 0.46 0.00 1.61 1.51 -0.42 -0.14 117.35 119.10 2k70 s TYR 82 Ca 0.00 -0.33 -0.29 0.00 -1.01 0.00 0.00 57.07 55.45 2k70 s TYR 82 Cb 0.00 -0.29 0.07 0.00 -0.11 0.00 0.00 41.96 41.64 2k70 s TYR 82 CO 0.00 -0.07 0.68 -3.38 -1.11 0.00 0.00 175.55 171.67 2k70 s HIS 83 N -0.87 -0.61 0.46 2.71 -3.43 0.10 -2.69 115.29 110.97 2k70 s HIS 83 Ca -0.06 0.86 -0.20 0.00 -0.80 0.00 0.00 55.06 54.86 2k70 s HIS 83 Cb -0.07 0.46 -0.10 0.00 -1.43 0.00 0.00 32.58 31.45 2k70 s HIS 83 CO -0.00 -0.66 0.98 -0.06 -2.00 0.00 0.00 174.74 173.00 2k70 s PHE 84 N -1.94 3.26 -0.20 0.38 0.08 -0.75 -0.93 117.98 117.88 2k70 s PHE 84 Ca -0.07 1.57 -0.09 0.00 0.12 0.00 0.00 56.93 58.46 2k70 s PHE 84 Cb -0.00 -2.89 -0.05 0.00 -0.57 0.00 0.00 43.02 39.51 2k70 s PHE 84 CO 0.03 -0.35 0.11 1.41 -0.10 0.00 0.00 175.22 176.32 2k70 s MET 85 N -3.39 4.12 -0.08 0.44 1.75 0.49 -1.61 119.30 121.01 2k70 s MET 85 Ca 0.63 -0.26 0.01 0.00 -1.25 0.00 0.00 55.69 54.82 2k70 s MET 85 Cb -0.11 -3.38 -0.03 0.00 2.84 0.00 0.00 34.83 34.16 2k70 s MET 85 CO 0.19 0.27 -0.09 -0.51 -0.65 0.00 0.00 175.02 174.22 2k70 s LEU 86 N 0.44 2.99 0.02 4.11 1.02 -0.01 -0.96 118.68 126.29 2k70 s LEU 86 Ca 0.07 -0.12 0.00 0.00 0.02 0.00 0.00 54.13 54.10 2k70 s LEU 86 Cb -0.12 -1.65 -0.01 0.00 0.02 0.00 0.00 46.19 44.43 2k70 s LEU 86 CO -0.01 0.31 -0.03 -0.76 0.02 0.00 0.00 176.35 175.89 2k70 s LEU 87 N -0.51 2.16 -0.60 1.79 1.43 -0.39 -0.98 118.68 121.58 2k70 s LEU 87 Ca 0.07 -0.34 0.00 0.00 -1.03 0.00 0.00 54.13 52.83 2k70 s LEU 87 Cb -0.12 0.03 0.00 0.00 0.03 0.00 0.00 46.19 46.13 2k70 s LEU 87 CO 0.02 -0.19 0.00 0.61 0.23 0.00 0.00 176.35 177.02 2k70 n GLY 88 N 2.08 0.34 3.50 -3.19 0.00 -0.58 -0.63 105.19 106.70 2k70 n GLY 88 Ca -0.20 -0.66 -0.39 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 1.11 0.00 0.99 -0.00 -1.22 -3.67 117.00 113.32 2k70 n LEU 89 Ca -0.07 0.82 0.00 0.00 -0.00 0.00 0.00 56.01 56.76 2k70 n LEU 89 Cb 0.45 -1.20 0.00 0.00 -0.00 0.00 0.00 43.42 42.67 2k70 n LEU 89 CO 0.09 -2.69 0.30 0.29 -0.00 0.00 0.00 177.39 175.38 2k70 n LYS 90 N 0.04 -0.01 -3.83 1.47 5.02 -1.22 -4.95 118.16 114.68 2k70 n LYS 90 Ca 0.11 -0.73 -0.12 0.00 -2.02 0.00 0.00 58.31 55.56 2k70 n LYS 90 Cb 0.44 -0.98 -0.11 0.00 -0.02 0.00 0.00 35.03 34.36 2k70 n LYS 90 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2k70 s ARG 91 N -0.24 0.35 0.67 1.97 1.81 -1.26 -5.03 118.95 117.22 2k70 s ARG 91 Ca 0.00 -0.03 -0.12 0.00 -1.72 0.00 0.00 55.73 53.86 2k70 s ARG 91 Cb 0.00 0.15 -0.00 0.00 -0.45 0.00 0.00 34.95 34.65 2k70 s ARG 91 CO 0.00 -0.07 1.06 -1.25 -0.68 0.00 0.00 175.30 174.36 2k70 s PRO 92 N -0.57 2.97 -0.49 3.54 0.04 -1.26 -5.03 135.00 134.20 2k70 s PRO 92 Ca -0.07 1.06 -0.10 0.00 0.04 0.00 0.00 61.00 61.94 2k70 s PRO 92 Cb -0.04 -1.99 0.12 0.00 0.04 0.00 0.00 34.50 32.63 2k70 s PRO 92 CO 0.01 -1.08 0.37 -0.51 0.04 0.00 0.00 177.00 175.83 2k70 s LEU 93 N -5.26 5.76 0.03 -3.56 2.01 -1.26 -5.07 118.68 111.33 2k70 s LEU 93 Ca 0.60 -1.94 -0.27 0.00 0.01 0.00 0.00 54.13 52.53 2k70 s LEU 93 Cb -0.15 -2.03 -0.05 0.00 0.01 0.00 0.00 46.19 43.97 2k70 s LEU 93 CO 0.49 -0.70 0.85 -0.54 1.01 0.00 0.00 176.35 177.46 2k70 s LYS 94 N 1.32 4.55 -0.25 1.70 3.01 -1.26 -4.75 119.74 124.06 2k70 s LYS 94 Ca 0.06 1.20 -0.36 0.00 -1.01 0.00 0.00 55.97 55.86 2k70 s LYS 94 Cb -0.26 -3.40 -0.12 0.00 -1.01 0.00 0.00 37.83 33.03 2k70 s LYS 94 CO -0.01 0.15 1.99 0.00 0.51 0.00 0.00 175.35 177.99 2k70 n ALA 95 N 3.23 0.72 0.00 5.17 0.00 -1.26 -1.43 120.51 126.93 2k70 n ALA 95 Ca 0.01 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.60 2k70 n ALA 95 Cb 0.50 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.49 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 5.29 0.48 3.27 0.00 0.00 -0.58 -5.03 105.19 108.63 2k70 n GLY 96 Ca 0.32 0.00 -0.26 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 -1.61 -1.75 -3.85 1.61 1.02 -0.52 -4.85 120.64 110.69 2k70 n GLU 97 Ca 0.00 -1.71 -0.12 0.00 -0.02 0.00 0.00 57.16 55.31 2k70 n GLU 97 Cb 0.00 -1.28 -0.14 0.00 -0.02 0.00 0.00 31.44 30.00 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 -5.42 0.02 -0.05 3.49 -1.05 -1.26 -0.25 118.70 114.19 2k70 s GLU 98 Ca 0.65 0.05 0.00 0.00 -0.15 0.00 0.00 54.97 55.52 2k70 s GLU 98 Cb -0.03 -0.01 0.02 0.00 -0.44 0.00 0.00 34.13 33.67 2k70 s GLU 98 CO 0.47 -0.02 -0.02 0.08 0.95 0.00 0.00 175.26 176.72 2k70 s VAL 99 N 0.12 0.39 0.24 1.83 1.01 0.36 -4.93 120.40 119.41 2k70 s VAL 99 Ca -0.01 0.01 -0.30 0.00 0.00 0.00 0.00 61.98 61.68 2k70 s VAL 99 Cb -0.01 -0.47 -0.09 0.00 0.00 0.00 0.00 36.38 35.80 2k70 s VAL 99 CO -0.00 0.21 0.99 -1.61 0.00 0.00 0.00 175.10 174.69 2k70 s GLU 100 N 1.28 4.78 0.05 2.72 2.02 -1.26 -1.26 118.70 127.03 2k70 s GLU 100 Ca -0.06 1.58 0.06 0.00 0.02 0.00 0.00 54.97 56.57 2k70 s GLU 100 Cb -0.13 -3.26 -0.04 0.00 0.10 0.00 0.00 34.13 30.80 2k70 s GLU 100 CO -0.02 0.41 -0.12 -0.51 0.02 0.00 0.00 175.26 175.04 2k70 s LEU 101 N -1.17 2.94 -0.11 1.80 2.01 -0.55 -4.53 118.68 119.07 2k70 s LEU 101 Ca 0.43 -0.32 -0.05 0.00 0.01 0.00 0.00 54.13 54.19 2k70 s LEU 101 Cb -0.28 -1.72 -0.04 0.00 0.01 0.00 0.00 46.19 44.17 2k70 s LEU 101 CO 0.34 0.24 0.09 -1.81 1.01 0.00 0.00 176.35 176.22 2k70 s ASP 102 N -1.69 5.97 -0.09 2.29 1.01 0.12 -1.02 116.67 123.25 2k70 s ASP 102 Ca 0.18 0.34 -0.01 0.00 0.71 0.00 0.00 52.55 53.77 2k70 s ASP 102 Cb -0.11 -1.87 -0.03 0.00 1.01 0.00 0.00 42.92 41.92 2k70 s ASP 102 CO 0.09 0.38 -0.05 -0.76 0.21 0.00 0.00 175.17 175.04 2k70 s LEU 103 N -0.88 3.28 -0.32 1.23 1.02 0.40 -1.07 118.68 122.34 2k70 s LEU 103 Ca 0.14 -0.00 -0.04 0.00 0.02 0.00 0.00 54.13 54.24 2k70 s LEU 103 Cb -0.12 -1.74 0.04 0.00 0.02 0.00 0.00 46.19 44.40 2k70 s LEU 103 CO 0.03 0.33 0.05 -0.76 0.02 0.00 0.00 176.35 176.02 2k70 s LEU 104 N -0.60 4.10 0.12 1.79 1.43 -0.41 -3.02 118.68 122.08 2k70 s LEU 104 Ca 0.09 -1.20 0.05 0.00 -1.03 0.00 0.00 54.13 52.04 2k70 s LEU 104 Cb -0.12 -1.79 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 2k70 s LEU 104 CO 0.02 -0.29 0.05 -0.36 0.23 0.00 0.00 176.35 176.00 2k70 s PHE 105 N 1.33 3.05 -0.24 0.29 0.08 -0.19 -0.53 117.98 121.77 2k70 s PHE 105 Ca -0.03 -0.02 -0.35 0.00 0.12 0.00 0.00 56.93 56.65 2k70 s PHE 105 Cb -0.20 -1.53 -0.11 0.00 -0.57 0.00 0.00 43.02 40.61 2k70 s PHE 105 CO 0.01 0.50 2.03 0.00 -0.10 0.00 0.00 175.22 177.67 2k70 n ALA 106 N 0.23 0.91 -1.39 5.36 0.00 -0.49 -3.07 120.51 122.06 2k70 n ALA 106 Ca -0.10 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2k70 n ALA 106 Cb 0.53 -2.53 0.00 0.00 0.00 0.00 0.00 19.45 17.45 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 5.46 -0.14 2.54 0.00 0.00 -1.26 -4.61 105.19 107.18 2k70 n GLY 107 Ca 0.32 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.96 0.40 3.68 -0.02 0.00 -1.23 -4.99 105.19 102.06 2k70 n GLY 108 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.60 4.15 0.01 1.61 1.02 -1.18 -5.01 119.74 119.74 2k70 s LYS 109 Ca 0.00 0.02 0.05 0.00 0.02 0.00 0.00 55.97 56.07 2k70 s LYS 109 Cb 0.00 -3.52 -0.02 0.00 -0.52 0.00 0.00 37.83 33.77 2k70 s LYS 109 CO 0.00 0.04 -0.16 0.08 -0.92 0.00 0.00 175.35 174.39 2k70 s VAL 110 N 1.09 1.27 0.05 3.17 1.01 -1.26 -1.02 120.40 124.71 2k70 s VAL 110 Ca 0.15 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.29 2k70 s VAL 110 Cb -0.14 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.12 2k70 s VAL 110 CO 0.06 0.25 -0.01 -0.22 0.00 0.00 0.00 175.10 175.18 2k70 s LEU 111 N -0.65 2.40 0.03 3.92 2.96 -1.17 -5.00 118.68 121.16 2k70 s LEU 111 Ca 0.05 -0.96 0.03 0.00 -0.22 0.00 0.00 54.13 53.04 2k70 s LEU 111 Cb -0.07 0.27 -0.02 0.00 0.50 0.00 0.00 46.19 46.87 2k70 s LEU 111 CO 0.00 -0.60 -0.11 -0.54 -1.32 0.00 0.00 176.35 173.78 2k70 s LYS 112 N -3.87 0.73 0.08 1.98 1.02 -1.26 -0.45 119.74 117.97 2k70 s LYS 112 Ca 0.06 -0.61 0.00 0.00 0.02 0.00 0.00 55.97 55.44 2k70 s LYS 112 Cb 0.07 -0.67 -0.04 0.00 -0.52 0.00 0.00 37.83 36.67 2k70 s LYS 112 CO -0.10 0.16 -0.04 0.14 -0.92 0.00 0.00 175.35 174.59 2k70 s VAL 113 N -0.79 0.43 -0.38 3.17 -7.23 -0.19 -5.01 120.40 110.40 2k70 s VAL 113 Ca -0.01 -1.87 0.01 0.00 -1.81 0.00 0.00 61.98 58.30 2k70 s VAL 113 Cb -0.07 -1.62 0.12 0.00 0.56 0.00 0.00 36.38 35.37 2k70 s VAL 113 CO 0.01 -0.91 0.17 -0.69 -0.31 0.00 0.00 175.10 173.36 2k70 s VAL 114 N -3.79 1.24 -0.24 1.32 1.01 -1.26 -1.48 120.40 117.19 2k70 s VAL 114 Ca 0.10 -2.07 -0.12 0.00 0.00 0.00 0.00 61.98 59.89 2k70 s VAL 114 Cb 0.07 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 34.50 2k70 s VAL 114 CO -0.07 -0.79 0.23 -0.76 0.00 0.00 0.00 175.10 173.71 2k70 s LEU 115 N 0.90 4.10 0.66 3.92 1.43 -0.39 -4.86 118.68 124.45 2k70 s LEU 115 Ca 0.14 0.18 -0.16 0.00 -1.03 0.00 0.00 54.13 53.27 2k70 s LEU 115 Cb -0.21 -2.21 -0.00 0.00 0.03 0.00 0.00 46.19 43.79 2k70 s LEU 115 CO -0.10 -0.00 1.14 -2.16 0.23 0.00 0.00 176.35 175.45 2k70 s PRO 116 N 1.31 2.75 -0.25 1.29 0.04 -1.26 -0.49 135.00 138.40 2k70 s PRO 116 Ca 0.10 1.51 -0.17 0.00 0.04 0.00 0.00 61.00 62.48 2k70 s PRO 116 Cb -0.14 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 2k70 s PRO 116 CO 0.07 -1.31 0.48 0.08 0.04 0.00 0.00 177.00 176.36 2k70 s VAL 117 N -2.16 5.10 -0.06 -0.36 1.01 0.65 -0.83 120.40 123.75 2k70 s VAL 117 Ca 0.70 0.82 0.05 0.00 0.00 0.00 0.00 61.98 63.55 2k70 s VAL 117 Cb -0.23 -3.80 -0.02 0.00 0.00 0.00 0.00 36.38 32.34 2k70 s VAL 117 CO 0.40 0.13 -0.21 -1.61 0.00 0.00 0.00 175.10 173.81 2k70 s GLU 118 N 2.08 2.64 -1.12 2.72 2.02 -1.21 -1.52 118.70 124.31 2k70 s GLU 118 Ca 0.20 -0.83 -0.06 0.00 0.02 0.00 0.00 54.97 54.31 2k70 s GLU 118 Cb -0.16 -2.27 0.05 0.00 0.10 0.00 0.00 34.13 31.85 2k70 s GLU 118 CO 0.09 0.42 2.64 0.00 0.02 0.00 0.00 175.26 178.43 2k70 n ALA 119 N 2.86 6.85 -1.86 5.21 0.00 -1.26 -3.25 120.51 129.06 2k70 n ALA 119 Ca -0.17 -3.65 0.00 0.00 0.00 0.00 0.00 53.44 49.62 2k70 n ALA 119 Cb 0.52 -2.73 0.00 0.00 0.00 0.00 0.00 19.45 17.24 2k70 n ALA 119 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39