#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k70 h SER 2 N 0.00 0.13 -5.36 1.61 4.64 -2.13 -3.49 113.55 108.96 2k70 h SER 2 Ca 0.00 -0.25 -0.16 0.00 -0.47 0.00 0.00 61.79 60.91 2k70 h SER 2 Cb 0.00 -0.04 -0.15 0.00 -0.31 0.00 0.00 62.40 61.90 2k70 h SER 2 CO 0.00 1.22 -0.66 -0.36 -0.87 0.00 0.00 176.83 176.16 2k70 s PHE 3 N -2.60 0.73 -0.03 4.77 0.08 -1.26 -5.05 117.98 114.63 2k70 s PHE 3 Ca -0.08 -1.17 0.05 0.00 0.12 0.00 0.00 56.93 55.84 2k70 s PHE 3 Cb 0.08 -0.45 0.07 0.00 -0.57 0.00 0.00 43.02 42.15 2k70 s PHE 3 CO 0.82 -0.47 1.04 -2.37 -0.10 0.00 0.00 175.22 174.14 2k70 n THR 4 N -0.02 0.44 -3.01 0.64 5.66 -1.26 -5.09 114.28 111.63 2k70 n THR 4 Ca -0.09 -0.53 -0.18 0.00 -3.05 0.00 0.00 64.05 60.20 2k70 n THR 4 Cb 0.63 0.33 0.02 0.00 -1.55 0.00 0.00 70.33 69.76 2k70 n THR 4 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 2k70 s GLU 5 N -0.67 2.73 0.36 1.09 2.02 -1.26 -4.74 118.70 118.23 2k70 s GLU 5 Ca 0.08 -1.32 0.04 0.00 0.02 0.00 0.00 54.97 53.79 2k70 s GLU 5 Cb 0.07 -2.74 -0.03 0.00 0.10 0.00 0.00 34.13 31.53 2k70 s GLU 5 CO 0.01 -0.39 0.14 0.20 0.02 0.00 0.00 175.26 175.24 2k70 s GLY 6 N -4.41 2.38 0.33 -1.39 0.00 -1.26 -4.20 107.32 98.77 2k70 s GLY 6 Ca 0.56 -1.53 -0.09 0.00 0.00 0.00 0.00 44.72 43.67 2k70 s GLY 6 CO 0.34 -1.74 0.59 -2.67 0.00 0.00 0.00 173.10 169.63 2k70 n TRP 7 N -0.77 -1.87 -4.74 1.90 2.14 -0.70 -4.13 117.44 109.26 2k70 n TRP 7 Ca -0.03 -1.82 -0.33 0.00 2.07 0.00 0.00 57.50 57.40 2k70 n TRP 7 Cb 0.65 0.69 -0.13 0.00 -0.81 0.00 0.00 31.31 31.71 2k70 n TRP 7 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 2k70 s VAL 8 N -2.43 3.27 0.64 -1.67 1.01 -1.25 -0.69 120.40 119.27 2k70 s VAL 8 Ca 0.19 -0.61 0.36 0.00 0.00 0.00 0.00 61.98 61.91 2k70 s VAL 8 Cb -0.03 -2.35 0.38 0.00 0.00 0.00 0.00 36.38 34.39 2k70 s VAL 8 CO 0.14 0.55 2.18 0.08 0.00 0.00 0.00 175.10 178.05 2k70 h ARG 9 N 6.05 0.00 -1.96 2.72 -0.00 -1.45 -3.39 114.38 116.34 2k70 h ARG 9 Ca -0.36 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.62 2k70 h ARG 9 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.16 2k70 h ARG 9 CO 0.54 0.00 -0.50 0.34 -0.00 0.00 0.00 179.97 180.35 2k70 n PHE 10 N -3.27 -2.28 -3.57 4.08 7.35 -1.26 -3.18 117.46 115.33 2k70 n PHE 10 Ca -0.02 1.23 -0.08 0.00 -0.76 0.00 0.00 57.45 57.83 2k70 n PHE 10 Cb 0.22 -2.19 -0.04 0.00 0.35 0.00 0.00 39.48 37.82 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 -3.80 -0.28 0.24 -2.13 0.01 -1.26 -4.92 113.70 101.57 2k70 s SER 11 Ca 0.00 0.17 0.16 0.00 1.31 0.00 0.00 55.95 57.59 2k70 s SER 11 Cb 0.00 0.26 0.04 0.00 0.21 0.00 0.00 66.02 66.52 2k70 s SER 11 CO 0.00 -0.36 1.30 1.55 0.41 0.00 0.00 173.24 176.15 2k70 h PRO 12 N 2.24 0.00 -6.78 12.44 0.13 -1.96 -3.45 132.00 134.61 2k70 h PRO 12 Ca -0.16 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.49 2k70 h PRO 12 Cb 1.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 2k70 h PRO 12 CO 0.28 0.40 0.17 0.20 -0.23 0.00 0.00 178.00 178.82 2k70 s GLY 13 N -4.51 2.43 0.17 1.56 0.00 -1.26 -5.03 107.32 100.69 2k70 s GLY 13 Ca 0.02 0.18 -0.08 0.00 0.00 0.00 0.00 44.72 44.84 2k70 s GLY 13 CO 0.76 0.45 1.54 -0.56 0.00 0.00 0.00 173.10 175.29 2k70 h PRO 14 N 2.47 0.88 -6.73 2.90 0.13 -1.99 -3.44 132.00 126.21 2k70 h PRO 14 Ca -0.48 -0.41 -0.49 0.00 -0.87 0.00 0.00 66.00 63.75 2k70 h PRO 14 Cb 1.18 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 2k70 h PRO 14 CO 0.64 1.06 0.35 -0.80 -0.23 0.00 0.00 178.00 179.02 2k70 s ASN 15 N -6.79 7.63 0.20 1.44 0.01 -1.26 -4.58 114.94 111.60 2k70 s ASN 15 Ca -0.10 1.93 -0.04 0.00 -0.71 0.00 0.00 52.86 53.94 2k70 s ASN 15 Cb 0.12 -2.61 0.02 0.00 0.41 0.00 0.00 41.25 39.19 2k70 s ASN 15 CO 0.86 0.14 0.34 0.00 -1.51 0.00 0.00 177.10 176.93 2k70 n ALA 16 N 1.61 -0.54 -2.69 0.60 0.00 -0.07 -4.93 120.51 114.49 2k70 n ALA 16 Ca -0.02 -0.80 -0.09 0.00 0.00 0.00 0.00 53.44 52.53 2k70 n ALA 16 Cb 0.47 0.64 -0.08 0.00 0.00 0.00 0.00 19.45 20.48 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 -1.94 -0.21 0.01 0.00 0.00 -1.26 -0.90 121.76 117.46 2k70 s ALA 17 Ca 0.13 -0.50 0.01 0.00 0.00 0.00 0.00 51.96 51.60 2k70 s ALA 17 Cb -0.02 0.34 -0.01 0.00 0.00 0.00 0.00 23.12 23.44 2k70 s ALA 17 CO 0.09 -0.40 -0.03 0.00 0.00 0.00 0.00 175.76 175.42 2k70 s ALA 18 N -3.08 0.22 -0.60 0.00 0.00 0.14 -1.27 121.76 117.18 2k70 s ALA 18 Ca -0.01 -0.31 0.06 0.00 0.00 0.00 0.00 51.96 51.69 2k70 s ALA 18 Cb 0.01 0.02 0.21 0.00 0.00 0.00 0.00 23.12 23.36 2k70 s ALA 18 CO -0.07 -0.02 0.56 0.66 0.00 0.00 0.00 175.76 176.90 2k70 n TYR 19 N 2.45 2.31 -1.49 0.00 4.01 0.13 -2.20 117.16 122.38 2k70 n TYR 19 Ca -0.17 -4.02 -0.30 0.00 -0.16 0.00 0.00 57.90 53.25 2k70 n TYR 19 Cb 0.58 -0.44 0.08 0.00 -0.31 0.00 0.00 39.34 39.25 2k70 n TYR 19 CO 0.00 0.00 0.00 -0.48 -0.46 0.00 0.00 176.86 175.92 2k70 s LEU 20 N -1.55 2.76 0.00 7.72 0.05 -1.26 -1.73 118.68 124.67 2k70 s LEU 20 Ca 0.32 1.47 0.08 0.00 0.05 0.00 0.00 54.13 56.06 2k70 s LEU 20 Cb 0.06 -4.15 -0.02 0.00 -2.05 0.00 0.00 46.19 40.03 2k70 s LEU 20 CO -0.11 -1.90 -0.25 -0.89 -0.55 0.00 0.00 176.35 172.64 2k70 s THR 21 N -3.07 1.97 0.35 5.48 2.01 -1.26 -0.79 115.64 120.33 2k70 s THR 21 Ca 0.60 -1.16 -0.06 0.00 0.31 0.00 0.00 61.69 61.38 2k70 s THR 21 Cb -0.15 -1.66 0.03 0.00 0.01 0.00 0.00 72.50 70.73 2k70 s THR 21 CO 0.55 0.47 0.57 0.18 -0.69 0.00 0.00 174.62 175.70 2k70 n LEU 22 N 2.22 0.00 -4.08 4.42 7.99 -0.23 -4.67 117.00 122.65 2k70 n LEU 22 Ca -0.16 -2.66 -0.09 0.00 -0.01 0.00 0.00 56.01 53.09 2k70 n LEU 22 Cb 0.52 2.88 -0.10 0.00 -0.11 0.00 0.00 43.42 46.61 2k70 n LEU 22 CO 0.23 -0.70 -0.37 -1.61 -1.51 0.00 0.00 177.39 173.43 2k70 s GLU 23 N -2.53 0.59 -0.64 3.23 2.02 -1.26 0.12 118.70 120.23 2k70 s GLU 23 Ca 0.24 -1.09 -0.12 0.00 0.02 0.00 0.00 54.97 54.02 2k70 s GLU 23 Cb -0.02 0.07 0.16 0.00 0.10 0.00 0.00 34.13 34.44 2k70 s GLU 23 CO 0.17 -0.07 0.54 1.21 0.02 0.00 0.00 175.26 177.14 2k70 s ASN 24 N -2.57 6.12 0.00 -0.19 2.47 0.03 -4.81 114.94 115.99 2k70 s ASN 24 Ca 0.02 -2.30 0.30 0.00 0.42 0.00 0.00 52.86 51.31 2k70 s ASN 24 Cb 0.03 -2.11 1.57 0.00 -1.45 0.00 0.00 41.25 39.29 2k70 s ASN 24 CO -0.06 -0.64 2.06 -0.81 -3.72 0.00 0.00 177.10 173.92 2k70 n PRO 25 N 4.45 0.65 -2.62 0.43 -0.04 -1.26 -1.66 135.00 134.95 2k70 n PRO 25 Ca 0.01 -0.06 -0.27 0.00 -0.04 0.00 0.00 63.50 63.13 2k70 n PRO 25 Cb 0.42 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 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 -2.39 1.51 -0.00 0.55 0.00 -1.26 -4.68 107.32 101.04 2k70 s GLY 26 Ca 0.34 -0.53 0.08 0.00 0.00 0.00 0.00 44.72 44.62 2k70 s GLY 26 CO 0.44 -0.35 1.20 1.22 0.00 0.00 0.00 173.10 175.60 2k70 n ASP 27 N -2.29 1.45 -4.52 1.64 8.00 -1.26 -1.41 116.55 118.17 2k70 n ASP 27 Ca 0.01 -2.00 -0.28 0.00 0.71 0.00 0.00 54.79 53.23 2k70 n ASP 27 Cb 0.55 -0.18 -0.10 0.00 -0.02 0.00 0.00 41.12 41.37 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 -1.00 2.79 0.51 0.64 0.05 -1.26 -4.84 118.68 115.57 2k70 s LEU 28 Ca 0.18 -0.62 -0.17 0.00 0.05 0.00 0.00 54.13 53.56 2k70 s LEU 28 Cb 0.09 -1.53 -0.08 0.00 -2.05 0.00 0.00 46.19 42.62 2k70 s LEU 28 CO 0.12 0.13 0.99 -2.16 -0.55 0.00 0.00 176.35 174.88 2k70 s PRO 29 N -2.57 3.94 0.05 1.48 0.04 -1.26 -3.99 135.00 132.69 2k70 s PRO 29 Ca 0.22 1.02 0.05 0.00 0.04 0.00 0.00 61.00 62.32 2k70 s PRO 29 Cb -0.09 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.28 2k70 s PRO 29 CO 0.13 -0.28 -0.08 -0.51 0.04 0.00 0.00 177.00 176.30 2k70 s LEU 30 N -3.94 3.11 -0.27 -3.56 1.43 -0.27 -4.94 118.68 110.25 2k70 s LEU 30 Ca 0.60 -0.26 -0.02 0.00 -1.03 0.00 0.00 54.13 53.43 2k70 s LEU 30 Cb -0.10 -1.84 0.09 0.00 0.03 0.00 0.00 46.19 44.36 2k70 s LEU 30 CO 0.28 0.23 0.08 -0.60 0.23 0.00 0.00 176.35 176.57 2k70 s ARG 31 N -1.79 0.64 -0.48 1.70 3.52 -1.26 -0.32 118.95 120.96 2k70 s ARG 31 Ca 0.19 -0.77 -0.27 0.00 -0.13 0.00 0.00 55.73 54.75 2k70 s ARG 31 Cb -0.11 -1.92 0.03 0.00 -1.56 0.00 0.00 34.95 31.39 2k70 s ARG 31 CO 0.11 -0.87 1.03 -1.17 -0.81 0.00 0.00 175.30 173.59 2k70 s LEU 32 N 1.76 3.82 -0.05 -0.88 1.98 0.26 -0.40 118.68 125.17 2k70 s LEU 32 Ca 0.06 0.25 0.15 0.00 -2.89 0.00 0.00 54.13 51.70 2k70 s LEU 32 Cb -0.17 -3.34 -0.23 0.00 0.66 0.00 0.00 46.19 43.11 2k70 s LEU 32 CO -0.21 -1.17 0.28 1.33 -1.89 0.00 0.00 176.35 174.70 2k70 n VAL 33 N 6.62 0.20 -3.57 1.68 0.24 0.38 -0.36 118.33 123.52 2k70 n VAL 33 Ca 0.09 -0.41 -0.06 0.00 -2.04 0.00 0.00 64.34 61.91 2k70 n VAL 33 Cb 0.49 -0.01 0.02 0.00 -1.47 0.00 0.00 33.84 32.86 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 1.71 1.39 3.66 7.63 0.00 -0.99 -4.70 105.19 113.89 2k70 n GLY 34 Ca -0.07 -1.21 -0.12 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 s ALA 35 N -1.78 0.01 0.28 4.61 0.00 -1.26 -1.30 121.76 122.32 2k70 s ALA 35 Ca 0.11 -1.14 -0.04 0.00 0.00 0.00 0.00 51.96 50.89 2k70 s ALA 35 Cb -0.03 0.90 -0.01 0.00 0.00 0.00 0.00 23.12 23.98 2k70 s ALA 35 CO 0.09 -0.89 0.37 1.03 0.00 0.00 0.00 175.76 176.35 2k70 s ARG 36 N -2.59 1.63 -0.19 0.00 0.52 0.28 -4.86 118.95 113.73 2k70 s ARG 36 Ca 0.23 -1.63 -0.30 0.00 -0.52 0.00 0.00 55.73 53.52 2k70 s ARG 36 Cb -0.03 0.40 0.14 0.00 0.52 0.00 0.00 34.95 35.98 2k70 s ARG 36 CO 0.16 -0.64 1.07 -0.08 0.02 0.00 0.00 175.30 175.83 2k70 s THR 37 N -3.61 0.00 -1.63 0.02 -1.32 -1.26 -0.89 115.64 106.95 2k70 s THR 37 Ca 0.32 0.00 0.21 0.00 -1.21 0.00 0.00 61.69 61.01 2k70 s THR 37 Cb 0.02 -1.00 0.46 0.00 -1.51 0.00 0.00 72.50 70.47 2k70 s THR 37 CO 0.16 0.00 1.68 -0.81 -2.21 0.00 0.00 174.62 173.44 2k70 n PRO 38 N 0.75 0.44 -2.85 7.08 -0.04 -1.26 -3.69 135.00 135.43 2k70 n PRO 38 Ca -0.08 0.06 -0.26 0.00 -0.04 0.00 0.00 63.50 63.17 2k70 n PRO 38 Cb 0.58 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.51 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 -1.18 2.67 -3.87 0.52 0.24 -1.26 -4.55 118.33 110.90 2k70 n VAL 39 Ca 0.12 -5.33 -0.08 0.00 -2.04 0.00 0.00 64.34 57.01 2k70 n VAL 39 Cb 0.14 -1.25 -0.01 0.00 -1.47 0.00 0.00 33.84 31.24 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 -3.42 -0.78 -0.05 2.33 0.00 -1.24 -4.09 121.76 114.51 2k70 s ALA 40 Ca 0.48 -0.63 -0.04 0.00 0.00 0.00 0.00 51.96 51.77 2k70 s ALA 40 Cb 0.31 0.84 -0.03 0.00 0.00 0.00 0.00 23.12 24.24 2k70 s ALA 40 CO -0.14 -0.98 -0.09 -1.91 0.00 0.00 0.00 175.76 172.64 2k70 n GLU 41 N -0.48 0.15 -3.88 0.00 4.07 -0.22 -4.76 120.64 115.52 2k70 n GLU 41 Ca -0.05 0.06 -0.35 0.00 -0.06 0.00 0.00 57.16 56.76 2k70 n GLU 41 Cb 0.60 -0.75 -0.08 0.00 -0.06 0.00 0.00 31.44 31.14 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 -2.15 3.93 0.13 5.31 0.52 -0.98 -5.03 118.95 120.67 2k70 s ARG 42 Ca -0.10 -0.26 -0.03 0.00 -0.52 0.00 0.00 55.73 54.83 2k70 s ARG 42 Cb 0.03 -3.28 -0.05 0.00 0.52 0.00 0.00 34.95 32.18 2k70 s ARG 42 CO 0.12 0.39 0.33 0.54 0.02 0.00 0.00 175.30 176.70 2k70 s VAL 43 N 0.07 5.24 0.06 3.52 0.11 -1.26 -0.93 120.40 127.21 2k70 s VAL 43 Ca 0.08 -0.15 0.02 0.00 -2.93 0.00 0.00 61.98 58.99 2k70 s VAL 43 Cb -0.12 -3.64 -0.03 0.00 -1.53 0.00 0.00 36.38 31.06 2k70 s VAL 43 CO -0.00 0.04 -0.07 -1.61 -3.33 0.00 0.00 175.10 170.13 2k70 s GLU 44 N -2.71 0.64 -0.25 1.54 2.02 0.05 -4.99 118.70 114.99 2k70 s GLU 44 Ca 0.39 -0.98 -0.05 0.00 0.02 0.00 0.00 54.97 54.35 2k70 s GLU 44 Cb -0.12 -0.23 0.00 0.00 0.10 0.00 0.00 34.13 33.88 2k70 s GLU 44 CO 0.26 0.02 0.01 -1.17 0.02 0.00 0.00 175.26 174.40 2k70 s LEU 45 N -2.16 3.34 0.09 1.80 2.96 -1.26 -0.44 118.68 123.00 2k70 s LEU 45 Ca -0.02 -0.57 0.08 0.00 -0.22 0.00 0.00 54.13 53.40 2k70 s LEU 45 Cb -0.04 -1.79 -0.03 0.00 0.50 0.00 0.00 46.19 44.83 2k70 s LEU 45 CO -0.02 -0.10 -0.21 -1.00 -1.32 0.00 0.00 176.35 173.70 2k70 s HIS 46 N 1.47 1.76 0.66 5.38 3.76 -0.21 -0.53 115.29 127.59 2k70 s HIS 46 Ca 0.04 -0.41 -0.04 0.00 -0.15 0.00 0.00 55.06 54.49 2k70 s HIS 46 Cb -0.16 -0.98 0.05 0.00 1.11 0.00 0.00 32.58 32.61 2k70 s HIS 46 CO -0.01 0.18 0.95 -1.83 -0.85 0.00 0.00 174.74 173.19 2k70 s GLU 47 N -1.81 2.30 -0.05 1.40 -1.05 0.36 -0.92 118.70 118.94 2k70 s GLU 47 Ca 0.06 -0.39 -0.12 0.00 -0.15 0.00 0.00 54.97 54.37 2k70 s GLU 47 Cb -0.10 -2.26 0.02 0.00 -0.44 0.00 0.00 34.13 31.36 2k70 s GLU 47 CO 0.04 -1.09 0.28 0.99 0.95 0.00 0.00 175.26 176.42 2k70 s THR 48 N -3.11 0.04 0.19 1.83 2.01 0.80 -3.16 115.64 114.24 2k70 s THR 48 Ca 0.59 -0.33 -0.20 0.00 0.31 0.00 0.00 61.69 62.06 2k70 s THR 48 Cb -0.11 -0.51 0.05 0.00 0.01 0.00 0.00 72.50 71.94 2k70 s THR 48 CO 0.43 -0.18 0.58 0.72 -0.69 0.00 0.00 174.62 175.47 2k70 s PHE 49 N -0.77 -0.32 0.20 4.92 -0.12 -0.52 -4.32 117.98 117.06 2k70 s PHE 49 Ca -0.09 0.01 -0.10 0.00 -0.05 0.00 0.00 56.93 56.71 2k70 s PHE 49 Cb -0.04 0.50 -0.07 0.00 -0.63 0.00 0.00 43.02 42.78 2k70 s PHE 49 CO 0.02 -0.92 0.52 1.41 -0.05 0.00 0.00 175.22 176.20 2k70 s MET 50 N -3.82 3.81 0.22 1.99 -2.45 -1.26 -1.03 119.30 116.75 2k70 s MET 50 Ca 0.05 0.26 -0.14 0.00 -1.25 0.00 0.00 55.69 54.61 2k70 s MET 50 Cb -0.02 -2.74 0.01 0.00 1.25 0.00 0.00 34.83 33.33 2k70 s MET 50 CO -0.06 0.38 0.48 0.50 1.05 0.00 0.00 175.02 177.36 2k70 s ARG 51 N -2.60 1.43 -0.05 4.11 3.00 0.61 -4.89 118.95 120.57 2k70 s ARG 51 Ca 0.44 -1.08 0.05 0.00 -1.00 0.00 0.00 55.73 54.14 2k70 s ARG 51 Cb -0.12 0.48 -0.00 0.00 0.00 0.00 0.00 34.95 35.31 2k70 s ARG 51 CO 0.21 -0.60 -0.19 -2.00 0.00 0.00 0.00 175.30 172.72 2k70 s GLU 52 N -3.95 1.98 -0.06 5.12 2.56 -1.26 -0.55 118.70 122.54 2k70 s GLU 52 Ca 0.16 -0.68 -0.01 0.00 0.00 0.00 0.00 54.97 54.43 2k70 s GLU 52 Cb -0.00 -1.70 0.03 0.00 2.00 0.00 0.00 34.13 34.45 2k70 s GLU 52 CO 0.03 0.27 0.02 0.08 -0.56 0.00 0.00 175.26 175.10 2k70 s VAL 53 N -0.00 0.24 -1.38 3.70 1.01 -0.26 -4.85 120.40 118.86 2k70 s VAL 53 Ca -0.04 0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.14 2k70 s VAL 53 Cb -0.12 -0.42 0.00 0.00 0.00 0.00 0.00 36.38 35.84 2k70 s VAL 53 CO 0.03 0.24 0.00 -0.62 0.00 0.00 0.00 175.10 174.74 2k70 n GLU 54 N 5.15 -1.12 -1.00 2.72 1.02 -1.26 -1.74 120.64 124.41 2k70 n GLU 54 Ca -0.07 0.83 -0.00 0.00 -0.02 0.00 0.00 57.16 57.90 2k70 n GLU 54 Cb 0.50 -5.08 -0.00 0.00 -0.02 0.00 0.00 31.44 26.84 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 -1.07 0.48 3.32 0.62 0.00 -1.26 -5.03 105.19 102.25 2k70 n GLY 55 Ca -0.17 -0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.22 3.15 0.18 1.61 1.02 -0.71 -5.09 119.74 119.69 2k70 s LYS 56 Ca 0.00 -0.80 -0.32 0.00 0.02 0.00 0.00 55.97 54.87 2k70 s LYS 56 Cb 0.00 -3.21 -0.12 0.00 -0.52 0.00 0.00 37.83 33.97 2k70 s LYS 56 CO 0.00 -0.36 1.71 1.63 -0.92 0.00 0.00 175.35 177.41 2k70 n LYS 57 N 4.82 2.62 -3.62 1.68 4.01 -1.26 -1.10 118.16 125.30 2k70 n LYS 57 Ca -0.16 0.95 -0.15 0.00 -0.51 0.00 0.00 58.31 58.43 2k70 n LYS 57 Cb 0.49 -2.78 -0.07 0.00 -0.51 0.00 0.00 35.03 32.15 2k70 n LYS 57 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 2k70 s VAL 58 N 1.35 0.01 0.33 -0.18 0.11 0.29 -4.94 120.40 117.37 2k70 s VAL 58 Ca 0.77 -0.09 0.02 0.00 -2.93 0.00 0.00 61.98 59.75 2k70 s VAL 58 Cb -0.55 -0.86 -0.03 0.00 -1.53 0.00 0.00 36.38 33.41 2k70 s VAL 58 CO 0.35 -0.05 0.51 -0.04 -3.33 0.00 0.00 175.10 172.54 2k70 s MET 59 N -0.62 3.38 0.37 1.54 -1.94 -1.26 -0.28 119.30 120.49 2k70 s MET 59 Ca -0.07 -0.53 -0.09 0.00 -1.71 0.00 0.00 55.69 53.28 2k70 s MET 59 Cb -0.03 -2.72 0.04 0.00 2.01 0.00 0.00 34.83 34.13 2k70 s MET 59 CO 0.05 0.15 0.65 0.41 -0.01 0.00 0.00 175.02 176.27 2k70 n GLY 60 N -1.72 1.46 3.53 -0.03 0.00 -0.20 -4.89 105.19 103.35 2k70 n GLY 60 Ca -0.05 -1.39 -0.17 0.00 0.00 0.00 0.00 46.02 44.41 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 -2.37 1.02 0.06 1.61 1.75 -1.26 -1.43 119.30 118.68 2k70 s MET 61 Ca 0.21 0.37 -0.14 0.00 -1.25 0.00 0.00 55.69 54.87 2k70 s MET 61 Cb -0.03 0.48 0.02 0.00 2.84 0.00 0.00 34.83 38.14 2k70 s MET 61 CO 0.15 -0.29 0.32 1.03 -0.65 0.00 0.00 175.02 175.58 2k70 s ARG 62 N -0.95 0.87 0.52 4.11 0.52 -1.19 -5.00 118.95 117.82 2k70 s ARG 62 Ca -0.09 -0.55 -0.18 0.00 -0.52 0.00 0.00 55.73 54.39 2k70 s ARG 62 Cb -0.01 0.38 -0.07 0.00 0.52 0.00 0.00 34.95 35.77 2k70 s ARG 62 CO 0.09 -0.29 1.02 -1.25 0.02 0.00 0.00 175.30 174.88 2k70 s PRO 63 N -2.83 3.75 0.03 3.54 0.04 -1.26 -0.48 135.00 137.79 2k70 s PRO 63 Ca -0.03 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.16 2k70 s PRO 63 Cb 0.00 -2.10 -0.02 0.00 0.04 0.00 0.00 34.50 32.42 2k70 s PRO 63 CO -0.05 -0.45 -0.04 0.14 0.04 0.00 0.00 177.00 176.64 2k70 s VAL 64 N -2.37 0.23 -0.07 -0.36 -7.23 0.31 -4.78 120.40 106.14 2k70 s VAL 64 Ca 0.63 -1.11 0.20 0.00 -1.81 0.00 0.00 61.98 59.88 2k70 s VAL 64 Cb -0.13 -0.56 0.17 0.00 0.56 0.00 0.00 36.38 36.41 2k70 s VAL 64 CO 0.28 -0.57 1.62 1.55 -0.31 0.00 0.00 175.10 177.68 2k70 h PRO 65 N 4.34 0.00 -1.89 4.82 0.13 -1.95 -3.43 132.00 134.03 2k70 h PRO 65 Ca -0.33 0.00 0.28 0.00 -0.87 0.00 0.00 66.00 65.08 2k70 h PRO 65 Cb 1.20 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.24 2k70 h PRO 65 CO 0.45 0.33 0.74 -0.59 -0.23 0.00 0.00 178.00 178.71 2k70 s PHE 66 N -3.28 -0.03 0.20 1.56 -0.12 -1.26 -4.72 117.98 110.32 2k70 s PHE 66 Ca 0.03 -0.16 0.11 0.00 -0.05 0.00 0.00 56.93 56.86 2k70 s PHE 66 Cb 0.08 0.59 -0.04 0.00 -0.63 0.00 0.00 43.02 43.02 2k70 s PHE 66 CO 0.69 -0.47 -0.20 -0.51 -0.05 0.00 0.00 175.22 174.68 2k70 s LEU 67 N -3.18 2.59 -0.04 -1.99 1.43 0.51 -4.99 118.68 113.01 2k70 s LEU 67 Ca 0.18 -0.81 0.04 0.00 -1.03 0.00 0.00 54.13 52.51 2k70 s LEU 67 Cb 0.02 -1.29 -0.03 0.00 0.03 0.00 0.00 46.19 44.92 2k70 s LEU 67 CO -0.01 0.11 -0.15 -0.70 0.23 0.00 0.00 176.35 175.83 2k70 s GLU 68 N -2.81 2.44 -0.04 1.70 2.56 -1.26 -0.58 118.70 120.71 2k70 s GLU 68 Ca 0.23 -0.74 -0.00 0.00 0.00 0.00 0.00 54.97 54.46 2k70 s GLU 68 Cb -0.08 -2.34 0.03 0.00 2.00 0.00 0.00 34.13 33.74 2k70 s GLU 68 CO 0.12 0.61 0.01 0.08 -0.56 0.00 0.00 175.26 175.52 2k70 s VAL 69 N -0.75 0.17 1.04 3.70 1.01 0.57 -4.98 120.40 121.15 2k70 s VAL 69 Ca 0.12 0.13 -0.13 0.00 0.00 0.00 0.00 61.98 62.10 2k70 s VAL 69 Cb -0.11 -0.29 0.21 0.00 0.00 0.00 0.00 36.38 36.19 2k70 s VAL 69 CO 0.01 0.16 1.08 -2.16 0.00 0.00 0.00 175.10 174.20 2k70 s PRO 70 N 1.26 0.13 0.45 2.72 0.04 -1.26 -1.11 135.00 137.22 2k70 s PRO 70 Ca -0.06 0.52 -0.25 0.00 0.04 0.00 0.00 61.00 61.25 2k70 s PRO 70 Cb -0.13 -1.70 -0.09 0.00 0.04 0.00 0.00 34.50 32.62 2k70 s PRO 70 CO -0.02 -2.94 1.33 -0.35 0.04 0.00 0.00 177.00 175.06 2k70 n PRO 71 N -4.32 1.99 -0.93 0.56 -0.04 -1.26 -2.84 135.00 128.17 2k70 n PRO 71 Ca 0.05 0.71 0.00 0.00 -0.04 0.00 0.00 63.50 64.22 2k70 n PRO 71 Cb 0.57 -2.48 0.00 0.00 -0.04 0.00 0.00 33.50 31.55 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 -0.17 -1.31 -2.31 0.54 4.76 -0.50 -4.97 118.16 114.20 2k70 n LYS 72 Ca 0.07 0.33 -0.28 0.00 -2.87 0.00 0.00 58.31 55.56 2k70 n LYS 72 Cb 0.41 -4.50 0.03 0.00 -1.84 0.00 0.00 35.03 29.13 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 1.60 0.15 0.72 0.00 -1.13 -4.89 107.32 101.77 2k70 s GLY 73 Ca 0.00 -0.58 -0.08 0.00 0.00 0.00 0.00 44.72 44.07 2k70 s GLY 73 CO 0.00 -0.30 0.44 0.50 0.00 0.00 0.00 173.10 173.74 2k70 s ARG 74 N -5.03 3.72 -0.58 2.90 0.52 -1.26 -0.79 118.95 118.43 2k70 s ARG 74 Ca 0.54 0.11 0.04 0.00 -0.52 0.00 0.00 55.73 55.90 2k70 s ARG 74 Cb -0.11 -2.84 0.36 0.00 0.52 0.00 0.00 34.95 32.89 2k70 s ARG 74 CO 0.47 0.45 1.08 0.28 0.02 0.00 0.00 175.30 177.60 2k70 n VAL 75 N 0.28 3.11 -3.17 3.52 0.31 0.12 -4.84 118.33 117.65 2k70 n VAL 75 Ca -0.03 -5.40 -0.39 0.00 -0.01 0.00 0.00 64.34 58.50 2k70 n VAL 75 Cb 0.52 -1.37 -0.05 0.00 -0.91 0.00 0.00 33.84 32.03 2k70 n VAL 75 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2k70 s GLU 76 N -3.57 4.37 0.37 5.55 -1.05 -1.25 -1.06 118.70 122.06 2k70 s GLU 76 Ca 0.48 0.66 0.20 0.00 -0.15 0.00 0.00 54.97 56.16 2k70 s GLU 76 Cb 0.31 -3.46 0.56 0.00 -0.44 0.00 0.00 34.13 31.11 2k70 s GLU 76 CO -0.16 0.07 1.67 1.25 0.95 0.00 0.00 175.26 179.04 2k70 h LEU 77 N 6.92 0.00 -2.77 1.83 5.85 -1.27 -3.49 115.31 122.38 2k70 h LEU 77 Ca -0.40 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.32 2k70 h LEU 77 Cb 1.18 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 2k70 h LEU 77 CO 0.76 0.34 -0.24 1.17 -0.34 0.00 0.00 178.44 180.12 2k70 n LYS 78 N -3.35 -0.72 0.26 1.25 3.00 -1.25 -2.42 118.16 114.92 2k70 n LYS 78 Ca 0.01 0.96 0.08 0.00 -0.00 0.00 0.00 58.31 59.36 2k70 n LYS 78 Cb 0.55 -1.58 0.64 0.00 0.00 0.00 0.00 35.03 34.63 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 0.63 0.00 -0.32 1.64 0.13 -1.94 0.68 132.00 132.82 2k70 h PRO 79 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2k70 h PRO 79 Cb 0.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.31 2k70 h PRO 79 CO 0.00 0.04 0.00 0.41 -0.23 0.00 0.00 178.00 178.22 2k70 n GLY 80 N -1.38 0.46 0.00 1.56 0.00 -1.26 -4.66 105.19 99.91 2k70 n GLY 80 Ca -0.03 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.67 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 0.93 0.00 2.97 -0.02 0.00 0.05 -4.49 105.19 104.63 2k70 n GLY 81 Ca 0.10 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.57 0.19 0.01 1.61 2.02 -0.17 -0.14 117.35 120.30 2k70 s TYR 82 Ca 0.00 -0.39 -0.27 0.00 -0.37 0.00 0.00 57.07 56.04 2k70 s TYR 82 Cb 0.00 -0.14 0.06 0.00 -0.40 0.00 0.00 41.96 41.48 2k70 s TYR 82 CO 0.00 -0.16 0.61 -3.38 -1.57 0.00 0.00 175.55 171.05 2k70 s HIS 83 N -1.15 -0.56 0.23 2.71 -3.43 -0.10 -3.97 115.29 109.03 2k70 s HIS 83 Ca -0.13 0.80 -0.30 0.00 -0.80 0.00 0.00 55.06 54.64 2k70 s HIS 83 Cb -0.08 0.40 -0.09 0.00 -1.43 0.00 0.00 32.58 31.38 2k70 s HIS 83 CO -0.01 -0.64 0.99 -0.06 -2.00 0.00 0.00 174.74 173.03 2k70 s PHE 84 N -1.86 3.84 -0.09 0.38 0.08 -0.93 -1.04 117.98 118.35 2k70 s PHE 84 Ca -0.08 1.83 -0.22 0.00 0.12 0.00 0.00 56.93 58.58 2k70 s PHE 84 Cb -0.01 -3.09 -0.04 0.00 -0.57 0.00 0.00 43.02 39.32 2k70 s PHE 84 CO 0.04 0.10 0.64 1.41 -0.10 0.00 0.00 175.22 177.31 2k70 s MET 85 N -1.05 4.40 -0.18 0.44 1.75 0.41 -0.68 119.30 124.39 2k70 s MET 85 Ca 0.43 0.76 -0.04 0.00 -1.25 0.00 0.00 55.69 55.58 2k70 s MET 85 Cb -0.27 -3.46 -0.03 0.00 2.84 0.00 0.00 34.83 33.91 2k70 s MET 85 CO 0.34 0.06 -0.02 -0.51 -0.65 0.00 0.00 175.02 174.24 2k70 s LEU 86 N 0.85 3.26 0.02 4.11 1.02 -0.07 -0.77 118.68 127.09 2k70 s LEU 86 Ca 0.34 -0.16 0.04 0.00 0.02 0.00 0.00 54.13 54.37 2k70 s LEU 86 Cb -0.17 -1.81 -0.02 0.00 0.02 0.00 0.00 46.19 44.22 2k70 s LEU 86 CO 0.16 0.12 -0.13 -0.76 0.02 0.00 0.00 176.35 175.75 2k70 s LEU 87 N 0.66 2.11 -0.56 1.79 1.02 -0.11 -0.89 118.68 122.70 2k70 s LEU 87 Ca -0.01 -0.36 -0.02 0.00 0.02 0.00 0.00 54.13 53.76 2k70 s LEU 87 Cb -0.14 -0.60 0.00 0.00 0.02 0.00 0.00 46.19 45.47 2k70 s LEU 87 CO 0.02 0.08 0.48 0.61 0.02 0.00 0.00 176.35 177.56 2k70 n GLY 88 N 2.26 0.17 3.61 -3.19 0.00 -1.26 -1.05 105.19 105.73 2k70 n GLY 88 Ca -0.16 -0.24 -0.39 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.43 3.32 -0.33 0.99 -0.00 -1.26 -2.44 117.00 114.86 2k70 n LEU 89 Ca -0.07 0.87 0.09 0.00 -0.00 0.00 0.00 56.01 56.89 2k70 n LEU 89 Cb 0.55 -1.38 -0.02 0.00 -0.00 0.00 0.00 43.42 42.58 2k70 n LEU 89 CO 0.28 -1.77 0.21 0.29 -0.00 0.00 0.00 177.39 176.40 2k70 n LYS 90 N -0.64 1.48 -3.77 1.47 4.76 -1.26 -4.84 118.16 115.36 2k70 n LYS 90 Ca 0.12 -0.70 -0.13 0.00 -2.87 0.00 0.00 58.31 54.73 2k70 n LYS 90 Cb 0.45 -1.34 -0.10 0.00 -1.84 0.00 0.00 35.03 32.20 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 -2.20 0.48 0.45 1.97 1.81 -1.26 -5.02 118.95 115.18 2k70 s ARG 91 Ca 0.13 0.13 -0.17 0.00 -1.72 0.00 0.00 55.73 54.11 2k70 s ARG 91 Cb 0.14 0.22 -0.09 0.00 -0.45 0.00 0.00 34.95 34.78 2k70 s ARG 91 CO 0.51 -0.10 0.91 -1.25 -0.68 0.00 0.00 175.30 174.69 2k70 s PRO 92 N -0.51 4.02 0.01 3.54 0.04 -1.26 -5.03 135.00 135.81 2k70 s PRO 92 Ca -0.06 0.91 0.09 0.00 0.04 0.00 0.00 61.00 61.97 2k70 s PRO 92 Cb -0.04 -2.22 -0.02 0.00 0.04 0.00 0.00 34.50 32.26 2k70 s PRO 92 CO 0.02 -0.11 -0.26 -0.48 0.04 0.00 0.00 177.00 176.21 2k70 s LEU 93 N -3.63 2.11 0.00 -3.56 2.34 -1.26 -5.15 118.68 109.54 2k70 s LEU 93 Ca 0.58 -0.53 0.00 0.00 0.06 0.00 0.00 54.13 54.24 2k70 s LEU 93 Cb -0.10 -1.31 0.00 0.00 -0.56 0.00 0.00 46.19 44.22 2k70 s LEU 93 CO 0.24 0.29 0.00 0.29 -1.06 0.00 0.00 176.35 176.11 2k70 n LYS 94 N 2.11 1.57 -3.88 1.48 4.76 -1.26 -4.95 118.16 117.99 2k70 n LYS 94 Ca -0.16 0.00 -0.37 0.00 -2.87 0.00 0.00 58.31 54.91 2k70 n LYS 94 Cb 0.51 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.64 2k70 n LYS 94 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2k70 s ALA 95 N -2.38 3.85 0.00 7.82 0.00 -1.26 -4.59 121.76 125.20 2k70 s ALA 95 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.31 2k70 s ALA 95 Cb 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 23.12 21.14 2k70 s ALA 95 CO 0.00 0.57 0.00 0.41 0.00 0.00 0.00 175.76 176.74 2k70 n GLY 96 N 2.14 0.91 3.92 0.00 0.00 0.12 -5.02 105.19 107.26 2k70 n GLY 96 Ca -0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.63 1.30 0.04 1.61 0.41 -1.23 -4.91 118.70 115.28 2k70 s GLU 97 Ca 0.00 -0.26 0.02 0.00 -0.41 0.00 0.00 54.97 54.32 2k70 s GLU 97 Cb 0.00 -1.94 -0.02 0.00 -1.78 0.00 0.00 34.13 30.39 2k70 s GLU 97 CO 0.00 -1.97 -0.07 -1.83 -0.49 0.00 0.00 175.26 170.90 2k70 s GLU 98 N -5.68 0.50 -0.08 1.61 -1.05 -1.26 -0.14 118.70 112.60 2k70 s GLU 98 Ca 0.68 -0.69 -0.05 0.00 -0.15 0.00 0.00 54.97 54.76 2k70 s GLU 98 Cb -0.07 -0.27 0.03 0.00 -0.44 0.00 0.00 34.13 33.38 2k70 s GLU 98 CO 0.50 0.05 0.19 0.08 0.95 0.00 0.00 175.26 177.03 2k70 s VAL 99 N -1.27 -0.02 0.13 1.83 1.01 0.46 -4.88 120.40 117.65 2k70 s VAL 99 Ca -0.09 0.09 -0.30 0.00 0.00 0.00 0.00 61.98 61.68 2k70 s VAL 99 Cb -0.09 -0.29 -0.06 0.00 0.00 0.00 0.00 36.38 35.93 2k70 s VAL 99 CO 0.00 0.04 1.00 -0.70 0.00 0.00 0.00 175.10 175.43 2k70 s GLU 100 N 0.71 4.68 0.05 2.72 2.12 -1.26 -1.42 118.70 126.29 2k70 s GLU 100 Ca -0.05 1.52 0.08 0.00 0.36 0.00 0.00 54.97 56.88 2k70 s GLU 100 Cb -0.07 -3.35 -0.03 0.00 0.26 0.00 0.00 34.13 30.95 2k70 s GLU 100 CO -0.04 0.19 -0.22 -0.51 -0.54 0.00 0.00 175.26 174.14 2k70 s LEU 101 N -0.13 2.17 -0.12 2.70 1.02 -0.29 -4.17 118.68 119.86 2k70 s LEU 101 Ca 0.47 -0.55 -0.02 0.00 0.02 0.00 0.00 54.13 54.05 2k70 s LEU 101 Cb -0.25 -1.05 -0.03 0.00 0.02 0.00 0.00 46.19 44.88 2k70 s LEU 101 CO 0.31 0.18 -0.04 -0.62 0.02 0.00 0.00 176.35 176.20 2k70 s ASP 102 N -1.23 4.80 -0.15 2.29 2.15 -0.06 -1.06 116.67 123.41 2k70 s ASP 102 Ca 0.09 -0.07 -0.04 0.00 0.43 0.00 0.00 52.55 52.96 2k70 s ASP 102 Cb -0.09 -1.57 -0.03 0.00 -0.30 0.00 0.00 42.92 40.93 2k70 s ASP 102 CO 0.02 0.25 -0.03 -0.76 -0.17 0.00 0.00 175.17 174.48 2k70 s LEU 103 N -0.12 3.32 -0.31 -1.34 1.02 0.34 -0.56 118.68 121.04 2k70 s LEU 103 Ca 0.02 -0.08 -0.08 0.00 0.02 0.00 0.00 54.13 54.01 2k70 s LEU 103 Cb -0.13 -1.80 0.00 0.00 0.02 0.00 0.00 46.19 44.29 2k70 s LEU 103 CO 0.03 0.20 0.12 -0.76 0.02 0.00 0.00 176.35 175.95 2k70 s LEU 104 N 0.18 4.01 -0.20 1.79 1.43 -0.42 -1.82 118.68 123.64 2k70 s LEU 104 Ca -0.01 -0.66 -0.03 0.00 -1.03 0.00 0.00 54.13 52.40 2k70 s LEU 104 Cb -0.14 -1.94 -0.00 0.00 0.03 0.00 0.00 46.19 44.14 2k70 s LEU 104 CO 0.03 -0.21 -0.08 -0.36 0.23 0.00 0.00 176.35 175.96 2k70 s PHE 105 N 1.55 2.92 -1.38 0.29 0.08 0.24 -0.47 117.98 121.20 2k70 s PHE 105 Ca 0.03 -1.01 0.00 0.00 0.12 0.00 0.00 56.93 56.07 2k70 s PHE 105 Cb -0.17 -2.05 0.00 0.00 -0.57 0.00 0.00 43.02 40.23 2k70 s PHE 105 CO 0.04 -0.55 0.00 0.00 -0.10 0.00 0.00 175.22 174.61 2k70 n ALA 106 N 4.63 -0.34 0.00 5.36 0.00 0.46 -1.69 120.51 128.93 2k70 n ALA 106 Ca -0.19 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2k70 n ALA 106 Cb 0.51 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.49 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 -0.40 1.28 0.00 0.00 0.00 -1.26 -4.68 105.19 100.13 2k70 n GLY 107 Ca -0.14 -0.02 0.14 0.00 0.00 0.00 0.00 46.02 46.00 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 0.00 -0.97 3.07 -0.02 0.00 -1.18 -4.75 105.19 101.35 2k70 n GLY 108 Ca 0.00 -0.18 -0.21 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.00 0.95 0.06 1.61 1.02 -0.68 -5.06 119.74 115.65 2k70 s LYS 109 Ca 0.43 -0.43 0.06 0.00 0.02 0.00 0.00 55.97 56.06 2k70 s LYS 109 Cb 0.20 -0.92 -0.03 0.00 -0.52 0.00 0.00 37.83 36.56 2k70 s LYS 109 CO 0.33 0.25 -0.17 0.54 -0.92 0.00 0.00 175.35 175.38 2k70 s VAL 110 N -0.29 1.39 -0.17 3.17 0.11 -1.26 -0.60 120.40 122.75 2k70 s VAL 110 Ca 0.04 -1.25 -0.07 0.00 -2.93 0.00 0.00 61.98 57.77 2k70 s VAL 110 Cb -0.05 -1.26 0.07 0.00 -1.53 0.00 0.00 36.38 33.61 2k70 s VAL 110 CO -0.00 -0.02 0.38 -0.22 -3.33 0.00 0.00 175.10 171.90 2k70 s LEU 111 N -1.48 -0.31 -0.09 2.54 2.96 -0.76 -4.99 118.68 116.55 2k70 s LEU 111 Ca 0.03 0.86 0.01 0.00 -0.22 0.00 0.00 54.13 54.82 2k70 s LEU 111 Cb -0.09 1.21 -0.02 0.00 0.50 0.00 0.00 46.19 47.78 2k70 s LEU 111 CO 0.02 -0.21 -0.12 -0.75 -1.32 0.00 0.00 176.35 173.97 2k70 s LYS 112 N 2.03 2.93 0.14 1.98 2.20 -1.26 -0.50 119.74 127.26 2k70 s LYS 112 Ca -0.05 -0.66 -0.08 0.00 -0.36 0.00 0.00 55.97 54.83 2k70 s LYS 112 Cb -0.11 -2.53 -0.01 0.00 -1.51 0.00 0.00 37.83 33.67 2k70 s LYS 112 CO -0.12 0.46 0.23 0.08 -0.36 0.00 0.00 175.35 175.64 2k70 s VAL 113 N -0.28 0.09 -0.06 4.02 1.01 -0.22 -5.00 120.40 119.95 2k70 s VAL 113 Ca 0.03 -1.40 0.03 0.00 0.00 0.00 0.00 61.98 60.63 2k70 s VAL 113 Cb -0.13 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.49 2k70 s VAL 113 CO 0.03 -0.41 -0.15 -0.69 0.00 0.00 0.00 175.10 173.88 2k70 s VAL 114 N -3.95 2.99 0.13 2.92 1.01 -1.26 -1.14 120.40 121.09 2k70 s VAL 114 Ca 0.15 -0.74 0.09 0.00 0.00 0.00 0.00 61.98 61.48 2k70 s VAL 114 Cb 0.04 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 2k70 s VAL 114 CO -0.03 0.58 -0.21 -0.76 0.00 0.00 0.00 175.10 174.68 2k70 s LEU 115 N -0.51 2.34 0.68 3.92 1.02 -0.51 -4.95 118.68 120.67 2k70 s LEU 115 Ca 0.07 -0.75 -0.15 0.00 0.02 0.00 0.00 54.13 53.32 2k70 s LEU 115 Cb -0.12 -0.92 0.01 0.00 0.02 0.00 0.00 46.19 45.18 2k70 s LEU 115 CO 0.01 0.05 1.12 -2.16 0.02 0.00 0.00 176.35 175.39 2k70 s PRO 116 N -2.19 2.68 -0.94 1.29 0.04 -1.26 -0.40 135.00 134.21 2k70 s PRO 116 Ca 0.10 1.40 -0.05 0.00 0.04 0.00 0.00 61.00 62.50 2k70 s PRO 116 Cb -0.09 -1.93 0.24 0.00 0.04 0.00 0.00 34.50 32.75 2k70 s PRO 116 CO 0.05 -1.35 0.87 0.08 0.04 0.00 0.00 177.00 176.69 2k70 s VAL 117 N -2.36 4.96 0.54 -0.36 1.01 0.81 -3.96 120.40 121.03 2k70 s VAL 117 Ca 0.67 -3.56 -0.15 0.00 0.00 0.00 0.00 61.98 58.95 2k70 s VAL 117 Cb -0.21 -4.04 -0.07 0.00 0.00 0.00 0.00 36.38 32.06 2k70 s VAL 117 CO 0.43 -1.10 0.99 -1.61 0.00 0.00 0.00 175.10 173.81 2k70 s GLU 118 N -1.12 3.84 0.91 2.72 0.41 -1.26 -0.71 118.70 123.49 2k70 s GLU 118 Ca 0.27 0.88 -0.12 0.00 -0.41 0.00 0.00 54.97 55.59 2k70 s GLU 118 Cb -0.09 -2.13 0.19 0.00 -1.78 0.00 0.00 34.13 30.32 2k70 s GLU 118 CO -0.10 -0.35 1.25 0.00 -0.49 0.00 0.00 175.26 175.57 2k70 s ALA 119 N -2.78 2.62 0.00 5.21 0.00 -1.26 -3.89 121.76 121.66 2k70 s ALA 119 Ca 0.58 -1.42 0.00 0.00 0.00 0.00 0.00 51.96 51.11 2k70 s ALA 119 Cb -0.10 -2.53 0.00 0.00 0.00 0.00 0.00 23.12 20.49 2k70 s ALA 119 CO 0.38 -2.25 0.00 2.89 0.00 0.00 0.00 175.76 176.78