#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 -0.13 -0.00 1.61 1.04 -1.26 -4.64 113.70 110.32 2k70 s SER 2 Ca 0.00 0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.63 2k70 s SER 2 Cb 0.00 0.18 0.00 0.00 0.10 0.00 0.00 66.02 66.30 2k70 s SER 2 CO 0.00 -0.08 0.91 0.49 0.98 0.00 0.00 173.24 175.54 2k70 n PHE 3 N 1.11 0.00 -1.00 5.02 3.72 -1.26 -5.01 117.46 120.04 2k70 n PHE 3 Ca -0.06 -0.02 -0.00 0.00 -0.05 0.00 0.00 57.45 57.32 2k70 n PHE 3 Cb 0.58 -0.04 -0.00 0.00 -0.94 0.00 0.00 39.48 39.07 2k70 n PHE 3 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 2k70 n THR 4 N -0.02 0.00 -1.80 4.37 -1.04 -1.26 -4.96 114.28 109.57 2k70 n THR 4 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.60 2k70 n THR 4 Cb 0.66 -0.16 -0.00 0.00 -1.82 0.00 0.00 70.33 69.01 2k70 n THR 4 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2k70 n GLU 5 N -2.95 3.23 -3.86 -2.82 1.02 -1.26 -4.82 120.64 109.18 2k70 n GLU 5 Ca -0.00 -2.77 -0.10 0.00 -0.02 0.00 0.00 57.16 54.27 2k70 n GLU 5 Cb 0.01 -3.11 0.02 0.00 -0.02 0.00 0.00 31.44 28.34 2k70 n GLU 5 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2k70 s GLY 6 N 2.42 0.65 0.03 0.62 0.00 -1.26 -1.69 107.32 108.08 2k70 s GLY 6 Ca 0.49 -0.95 -0.24 0.00 0.00 0.00 0.00 44.72 44.02 2k70 s GLY 6 CO -0.07 -0.47 0.54 0.66 0.00 0.00 0.00 173.10 173.77 2k70 s TRP 7 N -2.25 -0.46 -0.14 1.90 -2.14 0.02 -4.24 118.94 111.63 2k70 s TRP 7 Ca 0.19 0.59 -0.08 0.00 2.66 0.00 0.00 56.10 59.46 2k70 s TRP 7 Cb -0.04 0.34 -0.04 0.00 -3.10 0.00 0.00 33.47 30.63 2k70 s TRP 7 CO 0.14 -0.62 0.13 0.08 -2.66 0.00 0.00 176.95 174.01 2k70 s VAL 8 N -2.14 5.39 -0.40 -0.66 1.01 0.14 -1.37 120.40 122.36 2k70 s VAL 8 Ca -0.07 0.17 -0.28 0.00 0.00 0.00 0.00 61.98 61.80 2k70 s VAL 8 Cb -0.01 -3.38 -0.00 0.00 0.00 0.00 0.00 36.38 32.99 2k70 s VAL 8 CO 0.01 0.56 1.56 -0.60 0.00 0.00 0.00 175.10 176.63 2k70 s ARG 9 N -0.56 3.44 0.15 2.72 6.06 0.12 -1.81 118.95 129.07 2k70 s ARG 9 Ca 0.12 1.05 -0.33 0.00 -2.50 0.00 0.00 55.73 54.07 2k70 s ARG 9 Cb -0.12 -4.10 -0.16 0.00 0.06 0.00 0.00 34.95 30.62 2k70 s ARG 9 CO 0.02 -1.74 1.08 0.34 -2.50 0.00 0.00 175.30 172.50 2k70 n PHE 10 N 9.52 1.01 -3.74 5.12 7.35 -1.26 -4.26 117.46 131.19 2k70 n PHE 10 Ca 0.18 0.76 -0.13 0.00 -0.76 0.00 0.00 57.45 57.51 2k70 n PHE 10 Cb 0.48 -2.22 -0.10 0.00 0.35 0.00 0.00 39.48 38.00 2k70 n PHE 10 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2k70 s SER 11 N -0.12 -0.33 0.00 -2.13 0.15 -0.11 -5.00 113.70 106.16 2k70 s SER 11 Ca 0.74 0.52 0.28 0.00 0.70 0.00 0.00 55.95 58.20 2k70 s SER 11 Cb -0.92 0.60 1.07 0.00 -1.71 0.00 0.00 66.02 65.07 2k70 s SER 11 CO 0.53 -0.26 1.76 -0.81 1.20 0.00 0.00 173.24 175.67 2k70 n PRO 12 N 2.25 0.77 -2.55 5.44 -0.04 -1.26 -3.74 135.00 135.86 2k70 n PRO 12 Ca -0.16 -0.34 -0.14 0.00 -0.04 0.00 0.00 63.50 62.82 2k70 n PRO 12 Cb 0.57 -1.49 0.02 0.00 -0.04 0.00 0.00 33.50 32.56 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 2.36 0.12 0.55 0.00 -1.26 -5.01 105.19 103.25 2k70 n GLY 13 Ca 0.14 -2.22 0.12 0.00 0.00 0.00 0.00 46.02 44.06 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 -1.57 0.20 -4.20 1.61 -0.04 -1.26 -4.83 135.00 124.91 2k70 n PRO 14 Ca 0.05 0.39 -0.17 0.00 -0.04 0.00 0.00 63.50 63.73 2k70 n PRO 14 Cb 0.38 -1.85 -0.11 0.00 -0.04 0.00 0.00 33.50 31.88 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 -4.26 1.70 0.24 3.54 4.22 -1.26 -1.14 114.94 117.98 2k70 s ASN 15 Ca 0.05 -0.75 -0.08 0.00 -2.14 0.00 0.00 52.86 49.95 2k70 s ASN 15 Cb 0.10 -0.04 0.03 0.00 1.28 0.00 0.00 41.25 42.62 2k70 s ASN 15 CO 0.42 -0.16 0.46 0.00 -2.04 0.00 0.00 177.10 175.78 2k70 n ALA 16 N 0.79 -0.96 -2.31 3.54 0.00 -0.20 -4.79 120.51 116.58 2k70 n ALA 16 Ca -0.18 -0.82 -0.09 0.00 0.00 0.00 0.00 53.44 52.35 2k70 n ALA 16 Cb 0.56 0.66 -0.10 0.00 0.00 0.00 0.00 19.45 20.57 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 -1.78 0.62 0.03 0.00 0.00 -1.26 -0.59 121.76 118.78 2k70 s ALA 17 Ca 0.11 -1.13 -0.00 0.00 0.00 0.00 0.00 51.96 50.94 2k70 s ALA 17 Cb -0.03 0.19 -0.03 0.00 0.00 0.00 0.00 23.12 23.26 2k70 s ALA 17 CO 0.08 -0.26 -0.03 0.00 0.00 0.00 0.00 175.76 175.55 2k70 s ALA 18 N -3.23 0.24 0.01 0.00 0.00 -0.36 -0.70 121.76 117.72 2k70 s ALA 18 Ca 0.04 -0.76 0.00 0.00 0.00 0.00 0.00 51.96 51.24 2k70 s ALA 18 Cb 0.03 0.18 -0.01 0.00 0.00 0.00 0.00 23.12 23.31 2k70 s ALA 18 CO -0.06 -0.21 -0.02 0.71 0.00 0.00 0.00 175.76 176.18 2k70 s TYR 19 N -2.09 0.19 0.05 0.00 1.51 -0.47 -1.96 117.35 114.58 2k70 s TYR 19 Ca -0.10 -0.36 -0.28 0.00 -1.01 0.00 0.00 57.07 55.32 2k70 s TYR 19 Cb -0.05 -0.14 0.10 0.00 -0.11 0.00 0.00 41.96 41.76 2k70 s TYR 19 CO -0.03 -0.13 1.19 -0.48 -1.11 0.00 0.00 175.55 174.99 2k70 s LEU 20 N -1.00 -0.06 0.32 -1.29 2.34 -1.26 -0.80 118.68 116.92 2k70 s LEU 20 Ca -0.11 -0.27 -0.27 0.00 0.06 0.00 0.00 54.13 53.54 2k70 s LEU 20 Cb -0.07 1.63 -0.09 0.00 -0.56 0.00 0.00 46.19 47.09 2k70 s LEU 20 CO -0.01 -0.51 1.01 -0.89 -1.06 0.00 0.00 176.35 174.89 2k70 s THR 21 N -2.51 3.87 -0.17 5.48 2.01 -0.68 -1.28 115.64 122.34 2k70 s THR 21 Ca 0.17 1.64 -0.04 0.00 0.31 0.00 0.00 61.69 63.78 2k70 s THR 21 Cb 0.02 -3.96 0.06 0.00 0.01 0.00 0.00 72.50 68.63 2k70 s THR 21 CO -0.01 0.22 0.06 -0.22 -0.69 0.00 0.00 174.62 173.98 2k70 s LEU 22 N -1.93 0.67 -0.01 4.42 1.98 -1.26 -4.88 118.68 117.67 2k70 s LEU 22 Ca 0.49 -0.65 0.07 0.00 -2.89 0.00 0.00 54.13 51.15 2k70 s LEU 22 Cb -0.24 -0.38 -0.02 0.00 0.66 0.00 0.00 46.19 46.21 2k70 s LEU 22 CO 0.30 -0.32 -0.21 -1.83 -1.89 0.00 0.00 176.35 172.40 2k70 s GLU 23 N 2.02 1.69 -0.35 1.98 -1.05 -1.26 -0.90 118.70 120.84 2k70 s GLU 23 Ca 0.01 -0.77 -0.10 0.00 -0.15 0.00 0.00 54.97 53.96 2k70 s GLU 23 Cb -0.16 -1.65 0.02 0.00 -0.44 0.00 0.00 34.13 31.90 2k70 s GLU 23 CO -0.08 0.45 0.19 1.21 0.95 0.00 0.00 175.26 177.97 2k70 s ASN 24 N -0.54 5.67 0.36 0.83 3.84 -0.63 -4.31 114.94 120.15 2k70 s ASN 24 Ca 0.08 -0.84 0.23 0.00 0.21 0.00 0.00 52.86 52.55 2k70 s ASN 24 Cb -0.08 -2.02 0.28 0.00 -0.55 0.00 0.00 41.25 38.89 2k70 s ASN 24 CO -0.01 -0.32 1.47 1.55 -2.79 0.00 0.00 177.10 177.00 2k70 h PRO 25 N 8.41 0.00 0.00 0.43 0.13 -1.92 -0.13 132.00 138.91 2k70 h PRO 25 Ca -0.28 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.53 2k70 h PRO 25 Cb 1.12 0.00 0.12 0.00 0.13 0.00 0.00 31.00 32.36 2k70 h PRO 25 CO 0.65 0.00 0.26 0.41 -0.23 0.00 0.00 178.00 179.09 2k70 n GLY 26 N 1.14 -1.01 0.61 1.56 0.00 -1.26 -4.73 105.19 101.49 2k70 n GLY 26 Ca 0.03 -1.76 0.07 0.00 0.00 0.00 0.00 46.02 44.37 2k70 n GLY 26 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2k70 n ASP 27 N -3.50 2.31 -4.50 1.61 9.92 -1.26 -3.54 116.55 117.59 2k70 n ASP 27 Ca 0.12 -1.64 -0.24 0.00 -0.53 0.00 0.00 54.79 52.50 2k70 n ASP 27 Cb 0.42 -0.03 -0.10 0.00 -0.64 0.00 0.00 41.12 40.78 2k70 n ASP 27 CO 0.00 0.00 0.00 -1.48 0.13 0.00 0.00 177.20 175.85 2k70 s LEU 28 N -1.20 2.69 0.43 0.64 0.05 -1.26 -4.84 118.68 115.18 2k70 s LEU 28 Ca 0.18 -0.98 -0.22 0.00 0.05 0.00 0.00 54.13 53.16 2k70 s LEU 28 Cb 0.13 -1.19 -0.09 0.00 -2.05 0.00 0.00 46.19 42.99 2k70 s LEU 28 CO 0.19 0.02 1.04 -2.16 -0.55 0.00 0.00 176.35 174.88 2k70 s PRO 29 N -3.54 4.05 0.07 1.48 0.04 -1.26 -4.17 135.00 131.66 2k70 s PRO 29 Ca 0.30 1.42 0.02 0.00 0.04 0.00 0.00 61.00 62.78 2k70 s PRO 29 Cb -0.05 -2.36 -0.04 0.00 0.04 0.00 0.00 34.50 32.09 2k70 s PRO 29 CO 0.16 -0.23 0.12 -0.51 0.04 0.00 0.00 177.00 176.58 2k70 s LEU 30 N -2.97 3.97 -0.23 -3.56 1.43 -0.17 -4.98 118.68 112.16 2k70 s LEU 30 Ca 0.61 0.09 -0.02 0.00 -1.03 0.00 0.00 54.13 53.78 2k70 s LEU 30 Cb -0.19 -2.60 0.07 0.00 0.03 0.00 0.00 46.19 43.51 2k70 s LEU 30 CO 0.24 0.18 0.05 -0.60 0.23 0.00 0.00 176.35 176.45 2k70 s ARG 31 N -2.35 0.69 -0.34 1.70 3.52 -1.26 -0.27 118.95 120.64 2k70 s ARG 31 Ca 0.30 -0.62 -0.28 0.00 -0.13 0.00 0.00 55.73 55.00 2k70 s ARG 31 Cb -0.12 -2.05 0.02 0.00 -1.56 0.00 0.00 34.95 31.24 2k70 s ARG 31 CO 0.23 -0.75 1.03 -1.17 -0.81 0.00 0.00 175.30 173.83 2k70 s LEU 32 N 1.79 3.93 -0.01 -0.88 0.20 0.31 -1.06 118.68 122.96 2k70 s LEU 32 Ca 0.02 0.90 0.10 0.00 0.69 0.00 0.00 54.13 55.83 2k70 s LEU 32 Cb -0.17 -3.46 -0.14 0.00 -0.43 0.00 0.00 46.19 41.99 2k70 s LEU 32 CO -0.14 -0.88 0.24 1.33 -0.29 0.00 0.00 176.35 176.61 2k70 n VAL 33 N 5.93 0.00 -3.38 1.68 0.24 0.42 -0.82 118.33 122.40 2k70 n VAL 33 Ca 0.10 -0.23 -0.04 0.00 -2.04 0.00 0.00 64.34 62.13 2k70 n VAL 33 Cb 0.47 0.41 0.01 0.00 -1.47 0.00 0.00 33.84 33.26 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 1.82 1.75 1.65 7.63 0.00 -1.00 -4.76 105.19 112.28 2k70 n GLY 34 Ca -0.01 -1.16 -0.09 0.00 0.00 0.00 0.00 46.02 44.76 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 -2.03 0.12 -3.52 4.61 0.00 -1.26 -0.93 120.51 117.50 2k70 n ALA 35 Ca -0.07 -0.90 -0.11 0.00 0.00 0.00 0.00 53.44 52.37 2k70 n ALA 35 Cb 0.24 0.73 0.00 0.00 0.00 0.00 0.00 19.45 20.42 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 -2.55 2.13 -0.27 0.00 0.52 0.26 -4.75 118.95 114.29 2k70 s ARG 36 Ca 0.18 -1.54 -0.33 0.00 -0.52 0.00 0.00 55.73 53.51 2k70 s ARG 36 Cb 0.00 0.57 0.17 0.00 0.52 0.00 0.00 34.95 36.21 2k70 s ARG 36 CO 0.12 -0.97 1.34 -0.08 0.02 0.00 0.00 175.30 175.74 2k70 s THR 37 N -2.56 0.00 -1.31 0.02 -1.32 -1.26 -0.69 115.64 108.52 2k70 s THR 37 Ca 0.20 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.92 2k70 s THR 37 Cb -0.04 -1.00 0.36 0.00 -1.51 0.00 0.00 72.50 70.32 2k70 s THR 37 CO 0.14 0.00 1.80 -0.81 -2.21 0.00 0.00 174.62 173.54 2k70 n PRO 38 N 0.25 0.25 -2.43 7.08 -0.04 -1.26 -4.16 135.00 134.69 2k70 n PRO 38 Ca 0.02 0.07 -0.21 0.00 -0.04 0.00 0.00 63.50 63.33 2k70 n PRO 38 Cb 0.58 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.55 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 -1.35 2.09 -3.51 0.52 0.24 -1.26 -4.59 118.33 110.48 2k70 n VAL 39 Ca 0.10 -4.30 -0.11 0.00 -2.04 0.00 0.00 64.34 57.99 2k70 n VAL 39 Cb 0.22 -0.71 -0.03 0.00 -1.47 0.00 0.00 33.84 31.84 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 -3.50 -1.80 -0.12 2.33 0.00 -1.26 -3.94 121.76 113.46 2k70 s ALA 40 Ca 0.44 1.10 0.17 0.00 0.00 0.00 0.00 51.96 53.66 2k70 s ALA 40 Cb 0.41 0.18 -0.18 0.00 0.00 0.00 0.00 23.12 23.53 2k70 s ALA 40 CO -0.09 -0.57 0.65 -1.91 0.00 0.00 0.00 175.76 173.84 2k70 n GLU 41 N 0.13 0.64 -3.83 0.00 4.07 0.32 -4.83 120.64 117.13 2k70 n GLU 41 Ca -0.12 0.15 -0.12 0.00 -0.06 0.00 0.00 57.16 57.00 2k70 n GLU 41 Cb 0.61 -1.73 -0.13 0.00 -0.06 0.00 0.00 31.44 30.13 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 -2.88 0.14 -0.45 5.31 1.81 -1.05 -5.02 118.95 116.81 2k70 s ARG 42 Ca -0.05 0.14 0.07 0.00 -1.72 0.00 0.00 55.73 54.17 2k70 s ARG 42 Cb 0.09 0.07 0.32 0.00 -0.45 0.00 0.00 34.95 34.98 2k70 s ARG 42 CO 0.83 -0.02 1.07 1.55 -0.68 0.00 0.00 175.30 178.04 2k70 n VAL 43 N 2.97 -0.02 -3.46 3.52 3.14 -1.23 -1.62 118.33 121.62 2k70 n VAL 43 Ca -0.13 -1.93 -0.38 0.00 -2.96 0.00 0.00 64.34 58.95 2k70 n VAL 43 Cb 0.59 1.25 -0.06 0.00 -1.06 0.00 0.00 33.84 34.56 2k70 n VAL 43 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 2k70 s GLU 44 N -0.11 4.09 -0.22 1.45 8.01 -0.27 -4.07 118.70 127.59 2k70 s GLU 44 Ca 0.25 0.35 -0.24 0.00 0.01 0.00 0.00 54.97 55.34 2k70 s GLU 44 Cb 0.30 -3.32 -0.01 0.00 -4.31 0.00 0.00 34.13 26.79 2k70 s GLU 44 CO -0.05 0.45 0.77 -1.17 0.01 0.00 0.00 175.26 175.28 2k70 s LEU 45 N -0.29 4.11 0.16 1.80 2.96 -1.26 -0.57 118.68 125.58 2k70 s LEU 45 Ca 0.23 0.99 0.09 0.00 -0.22 0.00 0.00 54.13 55.23 2k70 s LEU 45 Cb -0.15 -3.11 -0.04 0.00 0.50 0.00 0.00 46.19 43.38 2k70 s LEU 45 CO 0.10 -0.44 -0.21 -1.00 -1.32 0.00 0.00 176.35 173.49 2k70 s HIS 46 N 2.50 1.97 0.50 5.38 3.76 -0.09 -0.52 115.29 128.80 2k70 s HIS 46 Ca 0.34 -0.42 0.07 0.00 -0.15 0.00 0.00 55.06 54.89 2k70 s HIS 46 Cb -0.16 -1.00 0.04 0.00 1.11 0.00 0.00 32.58 32.58 2k70 s HIS 46 CO 0.09 0.36 0.69 -1.83 -0.85 0.00 0.00 174.74 173.20 2k70 s GLU 47 N -2.58 2.56 -0.12 1.40 -1.05 0.23 -1.19 118.70 117.95 2k70 s GLU 47 Ca 0.16 -1.32 -0.17 0.00 -0.15 0.00 0.00 54.97 53.49 2k70 s GLU 47 Cb -0.07 -2.67 0.04 0.00 -0.44 0.00 0.00 34.13 30.99 2k70 s GLU 47 CO 0.07 -0.58 0.44 0.99 0.95 0.00 0.00 175.26 177.13 2k70 s THR 48 N -2.54 0.02 0.23 1.83 2.01 0.14 -3.07 115.64 114.25 2k70 s THR 48 Ca 0.58 -0.13 -0.18 0.00 0.31 0.00 0.00 61.69 62.27 2k70 s THR 48 Cb -0.08 -0.67 0.02 0.00 0.01 0.00 0.00 72.50 71.78 2k70 s THR 48 CO 0.36 -0.07 0.59 0.72 -0.69 0.00 0.00 174.62 175.54 2k70 s PHE 49 N -0.33 -0.09 0.25 4.92 -0.12 -0.47 -4.43 117.98 117.70 2k70 s PHE 49 Ca -0.05 -0.29 -0.03 0.00 -0.05 0.00 0.00 56.93 56.52 2k70 s PHE 49 Cb -0.03 0.49 -0.05 0.00 -0.63 0.00 0.00 43.02 42.80 2k70 s PHE 49 CO 0.03 -1.05 0.47 -1.64 -0.05 0.00 0.00 175.22 172.98 2k70 s MET 50 N -3.91 3.58 0.09 1.99 -1.94 -1.26 -1.06 119.30 116.78 2k70 s MET 50 Ca 0.12 -0.17 -0.21 0.00 -1.71 0.00 0.00 55.69 53.71 2k70 s MET 50 Cb -0.03 -2.74 0.05 0.00 2.01 0.00 0.00 34.83 34.12 2k70 s MET 50 CO 0.02 0.31 0.51 0.50 -0.01 0.00 0.00 175.02 176.35 2k70 s ARG 51 N -3.44 1.10 -0.11 2.03 3.00 -0.05 -4.86 118.95 116.63 2k70 s ARG 51 Ca 0.41 -0.38 -0.05 0.00 -1.00 0.00 0.00 55.73 54.71 2k70 s ARG 51 Cb -0.11 0.50 -0.04 0.00 0.00 0.00 0.00 34.95 35.30 2k70 s ARG 51 CO 0.29 -0.43 0.07 -2.00 0.00 0.00 0.00 175.30 173.24 2k70 s GLU 52 N -3.02 3.25 -0.05 5.12 2.56 -1.26 0.01 118.70 125.31 2k70 s GLU 52 Ca -0.02 -0.26 -0.00 0.00 0.00 0.00 0.00 54.97 54.68 2k70 s GLU 52 Cb -0.00 -3.01 0.03 0.00 2.00 0.00 0.00 34.13 33.14 2k70 s GLU 52 CO -0.06 0.73 -0.00 0.08 -0.56 0.00 0.00 175.26 175.44 2k70 s VAL 53 N -0.92 0.27 -2.05 3.70 1.01 -0.25 -4.88 120.40 117.29 2k70 s VAL 53 Ca 0.14 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.22 2k70 s VAL 53 Cb -0.12 -0.39 0.00 0.00 0.00 0.00 0.00 36.38 35.88 2k70 s VAL 53 CO 0.03 0.20 0.00 -0.62 0.00 0.00 0.00 175.10 174.71 2k70 n GLU 54 N 4.54 -1.45 -0.99 2.72 1.02 -1.26 -0.91 120.64 124.31 2k70 n GLU 54 Ca -0.18 1.16 0.00 0.00 -0.02 0.00 0.00 57.16 58.12 2k70 n GLU 54 Cb 0.50 -5.57 0.00 0.00 -0.02 0.00 0.00 31.44 26.35 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 -0.61 0.52 3.45 0.62 0.00 -1.26 -5.02 105.19 102.88 2k70 n GLY 55 Ca -0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.18 3.62 -0.20 1.61 1.02 -0.09 -5.08 119.74 120.45 2k70 s LYS 56 Ca 0.00 -0.52 -0.29 0.00 0.02 0.00 0.00 55.97 55.18 2k70 s LYS 56 Cb 0.00 -3.10 -0.01 0.00 -0.52 0.00 0.00 37.83 34.21 2k70 s LYS 56 CO 0.00 -0.00 1.22 0.15 -0.92 0.00 0.00 175.35 175.80 2k70 s LYS 57 N 1.05 4.20 0.44 1.68 3.01 -1.26 -1.09 119.74 127.77 2k70 s LYS 57 Ca 0.02 1.54 0.01 0.00 -1.01 0.00 0.00 55.97 56.53 2k70 s LYS 57 Cb -0.14 -3.75 -0.00 0.00 -1.01 0.00 0.00 37.83 32.92 2k70 s LYS 57 CO 0.02 -0.74 0.02 1.33 0.51 0.00 0.00 175.35 176.48 2k70 n VAL 58 N 5.47 0.00 -4.39 3.17 0.24 0.10 -4.98 118.33 117.94 2k70 n VAL 58 Ca 0.14 -2.15 -0.20 0.00 -2.04 0.00 0.00 64.34 60.09 2k70 n VAL 58 Cb 0.45 0.48 -0.10 0.00 -1.47 0.00 0.00 33.84 33.20 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 -3.61 1.46 0.35 7.34 -1.94 -1.26 -0.87 119.30 120.77 2k70 s MET 59 Ca 0.03 -1.70 -0.12 0.00 -1.71 0.00 0.00 55.69 52.19 2k70 s MET 59 Cb 0.00 -1.16 0.03 0.00 2.01 0.00 0.00 34.83 35.71 2k70 s MET 59 CO 0.02 0.11 0.65 0.20 -0.01 0.00 0.00 175.02 175.99 2k70 s GLY 60 N -3.39 0.68 -0.27 -0.03 0.00 -0.23 -4.86 107.32 99.22 2k70 s GLY 60 Ca 0.27 -0.95 -0.22 0.00 0.00 0.00 0.00 44.72 43.82 2k70 s GLY 60 CO 0.10 -0.53 0.69 -0.29 0.00 0.00 0.00 173.10 173.07 2k70 s MET 61 N -2.90 0.78 0.04 2.90 1.75 -1.26 -1.37 119.30 119.24 2k70 s MET 61 Ca 0.20 1.04 0.00 0.00 -1.25 0.00 0.00 55.69 55.68 2k70 s MET 61 Cb -0.03 0.32 -0.03 0.00 2.84 0.00 0.00 34.83 37.93 2k70 s MET 61 CO 0.13 -0.11 -0.04 1.03 -0.65 0.00 0.00 175.02 175.38 2k70 s ARG 62 N 0.73 0.47 0.49 4.11 1.81 -1.18 -5.00 118.95 120.38 2k70 s ARG 62 Ca -0.03 -0.84 -0.19 0.00 -1.72 0.00 0.00 55.73 52.95 2k70 s ARG 62 Cb -0.05 0.03 -0.09 0.00 -0.45 0.00 0.00 34.95 34.40 2k70 s ARG 62 CO -0.05 -0.04 0.99 -1.25 -0.68 0.00 0.00 175.30 174.27 2k70 s PRO 63 N -2.27 3.96 0.05 3.54 0.04 -1.26 -0.60 135.00 138.46 2k70 s PRO 63 Ca -0.07 1.10 0.02 0.00 0.04 0.00 0.00 61.00 62.10 2k70 s PRO 63 Cb -0.04 -2.13 -0.03 0.00 0.04 0.00 0.00 34.50 32.33 2k70 s PRO 63 CO -0.03 -0.27 -0.08 0.14 0.04 0.00 0.00 177.00 176.80 2k70 s VAL 64 N -2.35 0.61 -0.06 -0.36 -7.23 0.32 -4.81 120.40 106.52 2k70 s VAL 64 Ca 0.62 -1.25 0.14 0.00 -1.81 0.00 0.00 61.98 59.68 2k70 s VAL 64 Cb -0.11 -0.84 0.03 0.00 0.56 0.00 0.00 36.38 36.02 2k70 s VAL 64 CO 0.24 -0.46 1.46 1.55 -0.31 0.00 0.00 175.10 177.58 2k70 h PRO 65 N 4.20 0.00 -1.32 4.82 0.13 -1.95 -3.42 132.00 134.46 2k70 h PRO 65 Ca -0.36 0.00 0.31 0.00 -0.87 0.00 0.00 66.00 65.08 2k70 h PRO 65 Cb 1.19 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.16 2k70 h PRO 65 CO 0.45 0.56 0.87 -0.59 -0.23 0.00 0.00 178.00 179.07 2k70 s PHE 66 N -3.02 -0.06 0.13 1.56 -0.12 -1.26 -4.68 117.98 110.53 2k70 s PHE 66 Ca 0.03 0.01 0.06 0.00 -0.05 0.00 0.00 56.93 56.97 2k70 s PHE 66 Cb 0.08 0.52 -0.04 0.00 -0.63 0.00 0.00 43.02 42.96 2k70 s PHE 66 CO 0.75 -0.17 0.02 -0.51 -0.05 0.00 0.00 175.22 175.26 2k70 s LEU 67 N -2.53 3.46 -0.01 -1.99 1.43 -0.00 -4.97 118.68 114.07 2k70 s LEU 67 Ca 0.12 -0.24 0.07 0.00 -1.03 0.00 0.00 54.13 53.05 2k70 s LEU 67 Cb 0.02 -2.15 -0.03 0.00 0.03 0.00 0.00 46.19 44.07 2k70 s LEU 67 CO -0.04 0.13 -0.21 -0.70 0.23 0.00 0.00 176.35 175.76 2k70 s GLU 68 N -2.63 2.16 -0.04 1.70 2.56 -1.26 -0.53 118.70 120.67 2k70 s GLU 68 Ca 0.27 -0.90 0.00 0.00 0.00 0.00 0.00 54.97 54.34 2k70 s GLU 68 Cb -0.11 -2.15 0.03 0.00 2.00 0.00 0.00 34.13 33.90 2k70 s GLU 68 CO 0.19 0.57 -0.00 0.08 -0.56 0.00 0.00 175.26 175.54 2k70 s VAL 69 N -0.73 0.22 0.66 3.70 1.01 0.63 -4.93 120.40 120.96 2k70 s VAL 69 Ca 0.12 0.09 -0.12 0.00 0.00 0.00 0.00 61.98 62.06 2k70 s VAL 69 Cb -0.10 -0.32 -0.01 0.00 0.00 0.00 0.00 36.38 35.95 2k70 s VAL 69 CO 0.01 0.17 1.05 -2.16 0.00 0.00 0.00 175.10 174.17 2k70 s PRO 70 N 1.17 3.10 0.26 2.72 0.04 -1.26 -1.00 135.00 140.02 2k70 s PRO 70 Ca -0.08 1.01 -0.30 0.00 0.04 0.00 0.00 61.00 61.67 2k70 s PRO 70 Cb -0.13 -2.01 -0.11 0.00 0.04 0.00 0.00 34.50 32.29 2k70 s PRO 70 CO -0.02 -0.97 1.58 -1.25 0.04 0.00 0.00 177.00 176.38 2k70 s PRO 71 N -4.76 4.16 0.00 0.56 0.04 -1.26 -2.11 135.00 131.63 2k70 s PRO 71 Ca 0.59 2.51 0.00 0.00 0.04 0.00 0.00 61.00 64.14 2k70 s PRO 71 Cb -0.14 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.34 2k70 s PRO 71 CO 0.49 -0.61 0.00 1.63 0.04 0.00 0.00 177.00 178.55 2k70 n LYS 72 N 2.72 0.00 -1.85 4.56 4.01 -0.06 -4.98 118.16 122.55 2k70 n LYS 72 Ca 0.10 0.00 -0.30 0.00 -0.51 0.00 0.00 58.31 57.60 2k70 n LYS 72 Cb 0.38 -2.47 0.07 0.00 -0.51 0.00 0.00 35.03 32.50 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 -1.72 1.61 0.06 0.72 0.00 -0.90 -4.74 107.32 102.37 2k70 s GLY 73 Ca 0.00 -0.43 0.09 0.00 0.00 0.00 0.00 44.72 44.37 2k70 s GLY 73 CO 0.00 -0.02 -0.23 0.50 0.00 0.00 0.00 173.10 173.35 2k70 s ARG 74 N -5.41 1.49 -0.39 2.90 0.52 -1.26 -1.61 118.95 115.19 2k70 s ARG 74 Ca 0.60 -1.08 0.05 0.00 -0.52 0.00 0.00 55.73 54.78 2k70 s ARG 74 Cb -0.11 -1.70 0.17 0.00 0.52 0.00 0.00 34.95 33.82 2k70 s ARG 74 CO 0.51 0.43 0.48 0.08 0.02 0.00 0.00 175.30 176.82 2k70 s VAL 75 N -0.88 -0.60 0.45 3.52 1.01 -0.07 -4.98 120.40 118.85 2k70 s VAL 75 Ca 0.10 -0.62 -0.22 0.00 0.00 0.00 0.00 61.98 61.23 2k70 s VAL 75 Cb -0.09 -0.39 -0.08 0.00 0.00 0.00 0.00 36.38 35.81 2k70 s VAL 75 CO 0.03 -0.35 1.09 -1.61 0.00 0.00 0.00 175.10 174.25 2k70 s GLU 76 N 1.56 3.87 0.16 2.72 8.01 -1.26 -4.30 118.70 129.45 2k70 s GLU 76 Ca 0.17 1.56 -0.32 0.00 0.01 0.00 0.00 54.97 56.39 2k70 s GLU 76 Cb -0.10 -2.33 -0.11 0.00 -4.31 0.00 0.00 34.13 27.27 2k70 s GLU 76 CO -0.04 -0.41 1.79 1.28 0.01 0.00 0.00 175.26 177.89 2k70 n LEU 77 N -0.55 4.03 -4.67 1.80 4.32 -0.41 -4.90 117.00 116.61 2k70 n LEU 77 Ca 0.07 1.02 -0.43 0.00 -0.02 0.00 0.00 56.01 56.66 2k70 n LEU 77 Cb 0.50 -1.56 -0.02 0.00 -1.62 0.00 0.00 43.42 40.72 2k70 n LEU 77 CO 0.44 0.18 1.06 -0.54 -1.22 0.00 0.00 177.39 177.30 2k70 s LYS 78 N 2.07 4.28 0.04 3.23 3.01 -1.08 -4.49 119.74 126.80 2k70 s LYS 78 Ca 0.79 1.73 0.05 0.00 -1.01 0.00 0.00 55.97 57.53 2k70 s LYS 78 Cb -0.49 -3.68 0.25 0.00 -1.01 0.00 0.00 37.83 32.90 2k70 s LYS 78 CO 0.35 -0.61 1.16 -0.35 0.51 0.00 0.00 175.35 176.42 2k70 n PRO 79 N 5.99 0.02 0.00 -1.68 -0.04 -1.26 -1.30 135.00 136.73 2k70 n PRO 79 Ca 0.13 0.47 0.00 0.00 -0.04 0.00 0.00 63.50 64.06 2k70 n PRO 79 Cb 0.45 -1.56 0.00 0.00 -0.04 0.00 0.00 33.50 32.35 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 -1.20 -0.68 0.00 0.55 0.00 -1.26 -4.96 105.19 97.64 2k70 n GLY 80 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.01 0.00 3.26 -0.02 0.00 -0.42 -4.53 105.19 103.48 2k70 n GLY 81 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.96 -0.49 0.01 1.61 1.51 -0.76 0.23 117.35 118.50 2k70 s TYR 82 Ca 0.00 1.12 -0.26 0.00 -1.01 0.00 0.00 57.07 56.92 2k70 s TYR 82 Cb 0.00 0.18 0.06 0.00 -0.11 0.00 0.00 41.96 42.10 2k70 s TYR 82 CO 0.00 -0.26 0.59 -3.38 -1.11 0.00 0.00 175.55 171.39 2k70 s HIS 83 N 0.72 -0.53 0.36 2.71 -3.43 -0.33 -2.63 115.29 112.15 2k70 s HIS 83 Ca -0.04 0.75 -0.25 0.00 -0.80 0.00 0.00 55.06 54.73 2k70 s HIS 83 Cb -0.05 0.38 -0.10 0.00 -1.43 0.00 0.00 32.58 31.38 2k70 s HIS 83 CO -0.05 -0.63 0.96 -0.06 -2.00 0.00 0.00 174.74 172.96 2k70 s PHE 84 N -1.92 3.54 -0.21 0.38 0.08 -0.83 -0.91 117.98 118.11 2k70 s PHE 84 Ca -0.08 1.72 -0.06 0.00 0.12 0.00 0.00 56.93 58.63 2k70 s PHE 84 Cb -0.01 -2.94 -0.03 0.00 -0.57 0.00 0.00 43.02 39.47 2k70 s PHE 84 CO 0.03 -0.00 0.04 1.41 -0.10 0.00 0.00 175.22 176.59 2k70 s MET 85 N -2.37 3.71 -0.14 0.44 1.75 0.26 -1.23 119.30 121.73 2k70 s MET 85 Ca 0.54 -0.47 -0.04 0.00 -1.25 0.00 0.00 55.69 54.48 2k70 s MET 85 Cb -0.17 -3.19 -0.03 0.00 2.84 0.00 0.00 34.83 34.27 2k70 s MET 85 CO 0.22 -0.00 -0.01 -0.51 -0.65 0.00 0.00 175.02 174.07 2k70 s LEU 86 N 1.09 3.45 0.04 4.11 1.02 0.24 -1.11 118.68 127.52 2k70 s LEU 86 Ca 0.03 -0.00 0.02 0.00 0.02 0.00 0.00 54.13 54.20 2k70 s LEU 86 Cb -0.14 -1.82 -0.02 0.00 0.02 0.00 0.00 46.19 44.22 2k70 s LEU 86 CO 0.02 0.24 -0.08 -0.22 0.02 0.00 0.00 176.35 176.34 2k70 s LEU 87 N -0.07 2.23 -0.26 1.79 2.96 -0.64 -1.03 118.68 123.66 2k70 s LEU 87 Ca 0.03 -0.50 -0.02 0.00 -0.22 0.00 0.00 54.13 53.42 2k70 s LEU 87 Cb -0.13 -0.20 0.00 0.00 0.50 0.00 0.00 46.19 46.36 2k70 s LEU 87 CO 0.02 -0.16 0.23 0.61 -1.32 0.00 0.00 176.35 175.72 2k70 n GLY 88 N 1.62 0.67 3.60 7.98 0.00 -0.30 -0.52 105.19 118.24 2k70 n GLY 88 Ca -0.22 -0.50 -0.34 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.37 2.92 -0.00 0.99 -0.00 -1.10 -2.95 117.00 115.49 2k70 n LEU 89 Ca 0.00 0.54 0.05 0.00 -0.00 0.00 0.00 56.01 56.60 2k70 n LEU 89 Cb 0.51 -1.40 -0.07 0.00 -0.00 0.00 0.00 43.42 42.46 2k70 n LEU 89 CO 0.12 -2.31 -0.60 0.29 -0.00 0.00 0.00 177.39 174.90 2k70 n LYS 90 N -2.56 0.36 -3.78 1.47 4.76 -1.25 -4.86 118.16 112.29 2k70 n LYS 90 Ca 0.12 -0.08 -0.13 0.00 -2.87 0.00 0.00 58.31 55.35 2k70 n LYS 90 Cb 0.51 -1.22 -0.13 0.00 -1.84 0.00 0.00 35.03 32.36 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 -2.64 0.21 0.27 1.97 0.52 -1.26 -5.04 118.95 112.98 2k70 s ARG 91 Ca -0.03 0.35 -0.29 0.00 -0.52 0.00 0.00 55.73 55.23 2k70 s ARG 91 Cb 0.06 0.03 -0.10 0.00 0.52 0.00 0.00 34.95 35.46 2k70 s ARG 91 CO 0.39 -0.08 1.30 -1.25 0.02 0.00 0.00 175.30 175.69 2k70 s PRO 92 N 0.50 4.39 -0.95 3.54 0.04 -1.26 -4.93 135.00 136.32 2k70 s PRO 92 Ca -0.03 2.13 -0.10 0.00 0.04 0.00 0.00 61.00 63.04 2k70 s PRO 92 Cb -0.05 -3.13 0.24 0.00 0.04 0.00 0.00 34.50 31.60 2k70 s PRO 92 CO -0.02 -0.20 0.91 -0.48 0.04 0.00 0.00 177.00 177.24 2k70 s LEU 93 N -0.97 6.38 0.68 -3.56 0.05 -1.25 -5.05 118.68 114.97 2k70 s LEU 93 Ca 0.53 -3.21 -0.06 0.00 0.05 0.00 0.00 54.13 51.44 2k70 s LEU 93 Cb -0.38 -2.16 0.06 0.00 -2.05 0.00 0.00 46.19 41.65 2k70 s LEU 93 CO 0.45 -0.39 0.98 -0.54 -0.55 0.00 0.00 176.35 176.30 2k70 s LYS 94 N -0.64 2.26 -0.20 1.48 1.02 -1.26 -0.93 119.74 121.47 2k70 s LYS 94 Ca 0.25 -0.31 -0.29 0.00 0.02 0.00 0.00 55.97 55.64 2k70 s LYS 94 Cb -0.10 -2.21 -0.04 0.00 -0.52 0.00 0.00 37.83 34.95 2k70 s LYS 94 CO -0.09 -1.16 1.96 0.00 -0.92 0.00 0.00 175.35 175.14 2k70 s ALA 95 N -3.18 3.01 0.00 5.17 0.00 -1.26 -3.23 121.76 122.27 2k70 s ALA 95 Ca 0.60 0.68 0.00 0.00 0.00 0.00 0.00 51.96 53.24 2k70 s ALA 95 Cb -0.11 -3.98 0.00 0.00 0.00 0.00 0.00 23.12 19.04 2k70 s ALA 95 CO 0.44 -2.39 0.00 0.41 0.00 0.00 0.00 175.76 174.22 2k70 n GLY 96 N 5.26 0.79 4.00 0.00 0.00 -0.70 -4.97 105.19 109.58 2k70 n GLY 96 Ca 0.24 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.02 2k70 n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k70 s GLU 97 N -0.43 1.47 -0.72 1.61 2.02 -1.20 -4.65 118.70 116.79 2k70 s GLU 97 Ca 0.00 -1.25 0.04 0.00 0.02 0.00 0.00 54.97 53.78 2k70 s GLU 97 Cb 0.00 -2.31 0.20 0.00 0.10 0.00 0.00 34.13 32.11 2k70 s GLU 97 CO 0.00 -1.61 0.61 -0.85 0.02 0.00 0.00 175.26 173.43 2k70 n GLU 98 N -2.93 2.15 -3.46 1.61 0.00 -1.26 0.15 120.64 116.90 2k70 n GLU 98 Ca 0.17 -4.54 -0.37 0.00 0.00 0.00 0.00 57.16 52.42 2k70 n GLU 98 Cb 0.61 -2.30 -0.07 0.00 0.00 0.00 0.00 31.44 29.67 2k70 n GLU 98 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2k70 s VAL 99 N -1.73 5.25 0.17 3.84 1.01 0.10 -4.86 120.40 124.19 2k70 s VAL 99 Ca 0.29 0.63 -0.30 0.00 0.00 0.00 0.00 61.98 62.60 2k70 s VAL 99 Cb 0.00 -3.68 -0.07 0.00 0.00 0.00 0.00 36.38 32.63 2k70 s VAL 99 CO -0.12 0.32 1.01 -1.61 0.00 0.00 0.00 175.10 174.70 2k70 s GLU 100 N 0.88 4.70 0.14 2.72 2.02 -1.26 -0.93 118.70 126.96 2k70 s GLU 100 Ca 0.18 1.57 0.09 0.00 0.02 0.00 0.00 54.97 56.83 2k70 s GLU 100 Cb -0.14 -3.31 -0.04 0.00 0.10 0.00 0.00 34.13 30.74 2k70 s GLU 100 CO 0.06 0.24 -0.17 -0.51 0.02 0.00 0.00 175.26 174.90 2k70 s LEU 101 N -0.46 2.74 -0.07 1.80 1.02 -0.52 -4.13 118.68 119.07 2k70 s LEU 101 Ca 0.46 -0.60 -0.03 0.00 0.02 0.00 0.00 54.13 53.98 2k70 s LEU 101 Cb -0.26 -1.53 -0.04 0.00 0.02 0.00 0.00 46.19 44.38 2k70 s LEU 101 CO 0.33 0.15 0.06 -1.81 0.02 0.00 0.00 176.35 175.10 2k70 s ASP 102 N -2.38 5.69 -0.16 2.29 1.01 0.13 -0.40 116.67 122.86 2k70 s ASP 102 Ca 0.20 0.24 -0.05 0.00 0.71 0.00 0.00 52.55 53.65 2k70 s ASP 102 Cb -0.10 -1.69 -0.03 0.00 1.01 0.00 0.00 42.92 42.11 2k70 s ASP 102 CO 0.11 0.35 0.00 -0.76 0.21 0.00 0.00 175.17 175.09 2k70 s LEU 103 N -1.19 3.48 -0.39 1.23 1.02 0.56 -0.58 118.68 122.81 2k70 s LEU 103 Ca 0.17 -0.03 -0.14 0.00 0.02 0.00 0.00 54.13 54.15 2k70 s LEU 103 Cb -0.12 -1.85 0.01 0.00 0.02 0.00 0.00 46.19 44.26 2k70 s LEU 103 CO 0.06 0.19 0.27 -0.76 0.02 0.00 0.00 176.35 176.14 2k70 s LEU 104 N 0.24 4.94 -0.07 1.79 1.43 -0.11 -2.00 118.68 124.90 2k70 s LEU 104 Ca -0.00 -0.83 -0.07 0.00 -1.03 0.00 0.00 54.13 52.20 2k70 s LEU 104 Cb -0.13 -2.14 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 2k70 s LEU 104 CO 0.02 -0.40 0.20 -0.36 0.23 0.00 0.00 176.35 176.04 2k70 s PHE 105 N 1.67 3.61 -0.09 0.29 0.08 -0.14 -0.43 117.98 122.96 2k70 s PHE 105 Ca 0.05 0.58 -0.39 0.00 0.12 0.00 0.00 56.93 57.29 2k70 s PHE 105 Cb -0.19 -1.98 -0.17 0.00 -0.57 0.00 0.00 43.02 40.11 2k70 s PHE 105 CO 0.10 0.70 1.46 0.00 -0.10 0.00 0.00 175.22 177.38 2k70 n ALA 106 N 1.73 -1.08 -1.78 5.36 0.00 -0.23 -2.28 120.51 122.23 2k70 n ALA 106 Ca -0.17 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.75 2k70 n ALA 106 Cb 0.54 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.92 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 3.07 0.79 1.67 0.00 0.00 -1.26 -4.58 105.19 104.87 2k70 n GLY 107 Ca 0.22 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.77 0.54 3.66 -0.02 0.00 -1.00 -5.03 105.19 102.57 2k70 n GLY 108 Ca 0.00 -0.38 -0.40 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.79 4.22 -0.11 1.61 1.02 -0.96 -4.95 119.74 119.78 2k70 s LYS 109 Ca 0.00 0.64 0.02 0.00 0.02 0.00 0.00 55.97 56.65 2k70 s LYS 109 Cb 0.00 -3.57 -0.01 0.00 -0.52 0.00 0.00 37.83 33.72 2k70 s LYS 109 CO 0.00 -0.23 -0.16 0.08 -0.92 0.00 0.00 175.35 174.11 2k70 s VAL 110 N 1.89 2.76 -0.13 3.17 1.01 -1.26 -0.96 120.40 126.88 2k70 s VAL 110 Ca 0.29 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.51 2k70 s VAL 110 Cb -0.16 -2.12 0.02 0.00 0.00 0.00 0.00 36.38 34.12 2k70 s VAL 110 CO 0.11 0.54 -0.15 -0.22 0.00 0.00 0.00 175.10 175.38 2k70 s LEU 111 N 0.22 1.71 0.42 3.92 2.96 -0.85 -4.95 118.68 122.11 2k70 s LEU 111 Ca -0.10 -0.46 -0.22 0.00 -0.22 0.00 0.00 54.13 53.13 2k70 s LEU 111 Cb -0.16 -1.14 -0.10 0.00 0.50 0.00 0.00 46.19 45.29 2k70 s LEU 111 CO 0.06 -0.02 0.97 -0.75 -1.32 0.00 0.00 176.35 175.29 2k70 s LYS 112 N 1.21 4.21 0.07 1.98 2.47 -1.26 -0.32 119.74 128.10 2k70 s LYS 112 Ca -0.01 1.22 -0.09 0.00 -1.56 0.00 0.00 55.97 55.53 2k70 s LYS 112 Cb -0.14 -2.29 -0.00 0.00 -1.46 0.00 0.00 37.83 33.94 2k70 s LYS 112 CO -0.06 -0.05 0.19 0.08 0.16 0.00 0.00 175.35 175.67 2k70 s VAL 113 N -2.02 0.13 -0.12 4.02 1.01 0.46 -4.95 120.40 118.92 2k70 s VAL 113 Ca 0.61 -1.06 -0.04 0.00 0.00 0.00 0.00 61.98 61.48 2k70 s VAL 113 Cb -0.13 -1.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 2k70 s VAL 113 CO 0.17 -0.59 0.04 -0.69 0.00 0.00 0.00 175.10 174.03 2k70 s VAL 114 N -3.27 4.63 -0.07 2.92 1.01 -1.26 -1.44 120.40 122.92 2k70 s VAL 114 Ca 0.00 -0.12 0.03 0.00 0.00 0.00 0.00 61.98 61.90 2k70 s VAL 114 Cb 0.02 -3.00 0.01 0.00 0.00 0.00 0.00 36.38 33.41 2k70 s VAL 114 CO -0.08 0.57 -0.17 -0.76 0.00 0.00 0.00 175.10 174.66 2k70 s LEU 115 N -0.52 1.84 0.29 3.92 1.02 -0.10 -4.54 118.68 120.57 2k70 s LEU 115 Ca 0.10 -0.40 -0.29 0.00 0.02 0.00 0.00 54.13 53.56 2k70 s LEU 115 Cb -0.12 -1.05 -0.10 0.00 0.02 0.00 0.00 46.19 44.94 2k70 s LEU 115 CO 0.02 0.09 1.25 -2.16 0.02 0.00 0.00 176.35 175.57 2k70 s PRO 116 N 0.47 4.45 0.28 1.29 0.04 -1.26 -0.72 135.00 139.55 2k70 s PRO 116 Ca -0.15 2.06 -0.29 0.00 0.04 0.00 0.00 61.00 62.67 2k70 s PRO 116 Cb -0.16 -3.13 -0.09 0.00 0.04 0.00 0.00 34.50 31.15 2k70 s PRO 116 CO 0.05 -0.09 1.00 0.08 0.04 0.00 0.00 177.00 178.08 2k70 s VAL 117 N -0.86 3.90 0.25 -0.36 1.01 0.12 -0.69 120.40 123.77 2k70 s VAL 117 Ca 0.49 1.80 0.04 0.00 0.00 0.00 0.00 61.98 64.31 2k70 s VAL 117 Cb -0.37 -4.10 0.04 0.00 0.00 0.00 0.00 36.38 31.95 2k70 s VAL 117 CO 0.46 0.34 0.32 -1.84 0.00 0.00 0.00 175.10 174.39 2k70 n GLU 118 N 1.08 0.87 -4.27 2.72 -0.00 -0.75 -1.72 120.64 118.57 2k70 n GLU 118 Ca -0.00 -1.39 -0.22 0.00 -0.00 0.00 0.00 57.16 55.55 2k70 n GLU 118 Cb 0.47 -0.06 -0.12 0.00 -0.00 0.00 0.00 31.44 31.73 2k70 n GLU 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2k70 s ALA 119 N -2.31 1.72 0.00 -1.84 0.00 -1.26 -4.02 121.76 114.05 2k70 s ALA 119 Ca 0.25 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 50.94 2k70 s ALA 119 Cb -0.02 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.91 2k70 s ALA 119 CO 0.16 0.28 0.00 2.89 0.00 0.00 0.00 175.76 179.09