#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k70 n SER 2 N 0.00 -2.76 -4.73 1.61 7.64 -1.26 -5.05 113.62 109.06 2k70 n SER 2 Ca 0.00 0.24 -0.29 0.00 1.01 0.00 0.00 58.87 59.83 2k70 n SER 2 Cb 0.00 -1.09 0.13 0.00 -1.01 0.00 0.00 64.21 62.25 2k70 n SER 2 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2k70 s PHE 3 N -2.30 2.48 0.08 1.43 0.40 -1.26 -5.03 117.98 113.77 2k70 s PHE 3 Ca 0.54 0.78 0.00 0.00 -0.60 0.00 0.00 56.93 57.65 2k70 s PHE 3 Cb -0.19 -3.46 0.00 0.00 0.51 0.00 0.00 43.02 39.88 2k70 s PHE 3 CO 0.70 -2.31 0.00 0.25 0.70 0.00 0.00 175.22 174.55 2k70 n THR 4 N -3.71 0.01 -4.23 0.64 -2.24 -1.26 -5.15 114.28 98.34 2k70 n THR 4 Ca 0.08 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.73 2k70 n THR 4 Cb 0.60 -0.52 -0.04 0.00 -2.10 0.00 0.00 70.33 68.27 2k70 n THR 4 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2k70 n GLU 5 N -2.78 0.51 -2.06 -0.78 0.28 -1.26 -4.63 120.64 109.92 2k70 n GLU 5 Ca 0.00 -1.92 -0.28 0.00 -0.16 0.00 0.00 57.16 54.81 2k70 n GLU 5 Cb 0.01 1.27 0.11 0.00 1.43 0.00 0.00 31.44 34.25 2k70 n GLU 5 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 2k70 s GLY 6 N -2.37 1.69 -0.08 -1.84 0.00 -1.25 -3.14 107.32 100.34 2k70 s GLY 6 Ca 0.16 -0.98 -0.13 0.00 0.00 0.00 0.00 44.72 43.77 2k70 s GLY 6 CO 0.12 -0.43 0.33 0.66 0.00 0.00 0.00 173.10 173.77 2k70 s TRP 7 N -3.52 -0.29 -0.15 1.90 -2.14 -0.63 -4.03 118.94 110.07 2k70 s TRP 7 Ca 0.65 0.63 -0.16 0.00 2.66 0.00 0.00 56.10 59.87 2k70 s TRP 7 Cb -0.08 0.12 -0.04 0.00 -3.10 0.00 0.00 33.47 30.36 2k70 s TRP 7 CO 0.48 -0.28 0.40 0.08 -2.66 0.00 0.00 176.95 174.97 2k70 s VAL 8 N -0.51 5.23 -0.49 -0.66 1.01 -0.02 -1.44 120.40 123.51 2k70 s VAL 8 Ca -0.06 0.76 -0.28 0.00 0.00 0.00 0.00 61.98 62.40 2k70 s VAL 8 Cb -0.04 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.61 2k70 s VAL 8 CO 0.02 0.33 1.51 -0.60 0.00 0.00 0.00 175.10 176.36 2k70 s ARG 9 N 0.76 3.32 0.09 2.72 3.00 0.25 -1.65 118.95 127.44 2k70 s ARG 9 Ca 0.21 0.74 -0.36 0.00 -1.00 0.00 0.00 55.73 55.33 2k70 s ARG 9 Cb -0.14 -4.13 -0.18 0.00 0.00 0.00 0.00 34.95 30.50 2k70 s ARG 9 CO 0.08 -1.90 1.05 0.34 0.00 0.00 0.00 175.30 174.87 2k70 n PHE 10 N 9.77 0.76 -3.73 5.12 7.35 -0.00 -4.31 117.46 132.42 2k70 n PHE 10 Ca 0.16 0.88 -0.13 0.00 -0.76 0.00 0.00 57.45 57.60 2k70 n PHE 10 Cb 0.49 -2.16 -0.10 0.00 0.35 0.00 0.00 39.48 38.06 2k70 n PHE 10 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 2k70 s SER 11 N -0.09 -0.44 -0.26 -2.13 0.01 -1.26 -4.78 113.70 104.76 2k70 s SER 11 Ca 0.81 0.83 -0.04 0.00 1.31 0.00 0.00 55.95 58.86 2k70 s SER 11 Cb -1.06 0.82 -0.04 0.00 0.21 0.00 0.00 66.02 65.95 2k70 s SER 11 CO 0.54 -0.15 2.92 -0.81 0.41 0.00 0.00 173.24 176.15 2k70 n PRO 12 N 3.10 2.11 -3.64 12.44 -0.04 -1.26 -4.88 135.00 142.83 2k70 n PRO 12 Ca -0.15 -1.66 -0.10 0.00 -0.04 0.00 0.00 63.50 61.55 2k70 n PRO 12 Cb 0.57 -1.96 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 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 1.40 1.51 0.15 0.55 0.00 -1.26 -5.06 105.19 102.47 2k70 n GLY 13 Ca 0.42 -1.38 0.13 0.00 0.00 0.00 0.00 46.02 45.19 2k70 n GLY 13 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k70 h PRO 14 N 0.00 0.00 -4.88 1.61 0.13 -1.93 -3.46 132.00 123.46 2k70 h PRO 14 Ca -0.29 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.49 2k70 h PRO 14 Cb 1.12 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.11 2k70 h PRO 14 CO 0.37 0.00 -0.61 0.54 -0.23 0.00 0.00 178.00 178.07 2k70 s ASN 15 N -4.72 1.24 0.37 1.44 2.20 -1.26 -0.87 114.94 113.33 2k70 s ASN 15 Ca 0.06 -1.41 -0.11 0.00 -0.94 0.00 0.00 52.86 50.46 2k70 s ASN 15 Cb 0.10 0.20 0.05 0.00 -2.00 0.00 0.00 41.25 39.59 2k70 s ASN 15 CO 0.51 -0.76 0.69 0.00 -2.94 0.00 0.00 177.10 174.60 2k70 n ALA 16 N -0.48 -1.40 -2.48 3.54 0.00 -0.21 -4.74 120.51 114.74 2k70 n ALA 16 Ca 0.00 -1.27 -0.24 0.00 0.00 0.00 0.00 53.44 51.94 2k70 n ALA 16 Cb 0.66 1.01 -0.10 0.00 0.00 0.00 0.00 19.45 21.02 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 -2.16 2.66 -0.01 0.00 0.00 -1.26 -1.33 121.76 119.66 2k70 s ALA 17 Ca 0.18 -1.94 -0.05 0.00 0.00 0.00 0.00 51.96 50.14 2k70 s ALA 17 Cb -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 23.12 23.02 2k70 s ALA 17 CO 0.13 0.10 0.11 0.00 0.00 0.00 0.00 175.76 176.10 2k70 s ALA 18 N -2.71 -0.26 0.28 0.00 0.00 -0.00 -0.58 121.76 118.50 2k70 s ALA 18 Ca 0.30 -0.04 0.10 0.00 0.00 0.00 0.00 51.96 52.32 2k70 s ALA 18 Cb 0.00 0.01 -0.05 0.00 0.00 0.00 0.00 23.12 23.09 2k70 s ALA 18 CO 0.14 -0.15 -0.06 0.71 0.00 0.00 0.00 175.76 176.40 2k70 s TYR 19 N -0.92 2.54 -0.09 0.00 2.02 -0.52 -2.05 117.35 118.33 2k70 s TYR 19 Ca -0.10 -0.30 -0.08 0.00 -0.37 0.00 0.00 57.07 56.22 2k70 s TYR 19 Cb -0.06 -1.19 0.03 0.00 -0.40 0.00 0.00 41.96 40.34 2k70 s TYR 19 CO 0.01 0.62 0.24 -1.17 -1.57 0.00 0.00 175.55 173.68 2k70 s LEU 20 N -3.63 1.01 -0.04 -1.29 2.96 -1.26 -1.60 118.68 114.82 2k70 s LEU 20 Ca 0.32 0.48 0.02 0.00 -0.22 0.00 0.00 54.13 54.73 2k70 s LEU 20 Cb -0.05 0.80 0.01 0.00 0.50 0.00 0.00 46.19 47.45 2k70 s LEU 20 CO 0.18 -0.09 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.14 2k70 s THR 21 N 0.27 0.86 0.33 3.68 2.01 -1.19 -1.11 115.64 120.49 2k70 s THR 21 Ca -0.01 -0.37 -0.12 0.00 0.31 0.00 0.00 61.69 61.50 2k70 s THR 21 Cb -0.03 -0.78 0.05 0.00 0.01 0.00 0.00 72.50 71.75 2k70 s THR 21 CO -0.01 0.28 0.65 -0.11 -0.69 0.00 0.00 174.62 174.73 2k70 n LEU 22 N 3.51 0.00 -4.10 4.42 7.94 -0.54 -3.77 117.00 124.46 2k70 n LEU 22 Ca -0.20 -2.14 -0.13 0.00 -1.11 0.00 0.00 56.01 52.42 2k70 n LEU 22 Cb 0.53 3.14 -0.11 0.00 0.53 0.00 0.00 43.42 47.51 2k70 n LEU 22 CO 0.25 -0.71 -0.41 -1.83 -1.11 0.00 0.00 177.39 173.58 2k70 s GLU 23 N -2.09 0.63 -0.50 1.96 1.03 -1.26 0.17 118.70 118.64 2k70 s GLU 23 Ca 0.13 -0.89 -0.21 0.00 0.03 0.00 0.00 54.97 54.04 2k70 s GLU 23 Cb -0.04 -0.36 0.04 0.00 -0.80 0.00 0.00 34.13 32.98 2k70 s GLU 23 CO 0.10 0.06 0.70 1.21 -1.33 0.00 0.00 175.26 176.00 2k70 s ASN 24 N -1.87 6.28 0.14 0.83 2.47 -0.04 -4.75 114.94 118.00 2k70 s ASN 24 Ca -0.05 -0.62 0.26 0.00 0.42 0.00 0.00 52.86 52.87 2k70 s ASN 24 Cb -0.07 -2.33 0.95 0.00 -1.45 0.00 0.00 41.25 38.35 2k70 s ASN 24 CO -0.00 -0.93 1.81 -0.81 -3.72 0.00 0.00 177.10 173.44 2k70 n PRO 25 N 6.47 0.16 -1.79 0.43 -0.04 -1.26 -1.41 135.00 137.56 2k70 n PRO 25 Ca -0.03 0.17 -0.29 0.00 -0.04 0.00 0.00 63.50 63.30 2k70 n PRO 25 Cb 0.47 -1.70 0.14 0.00 -0.04 0.00 0.00 33.50 32.36 2k70 n PRO 25 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k70 s GLY 26 N -3.37 1.65 0.00 0.55 0.00 -1.26 -4.70 107.32 100.19 2k70 s GLY 26 Ca 0.11 -0.84 0.22 0.00 0.00 0.00 0.00 44.72 44.21 2k70 s GLY 26 CO 0.54 -0.22 1.15 1.22 0.00 0.00 0.00 173.10 175.79 2k70 n ASP 27 N -3.65 2.46 -4.60 1.64 9.92 -1.26 -2.54 116.55 118.51 2k70 n ASP 27 Ca 0.11 -1.73 -0.26 0.00 -0.53 0.00 0.00 54.79 52.38 2k70 n ASP 27 Cb 0.60 0.24 -0.09 0.00 -0.64 0.00 0.00 41.12 41.24 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 -2.18 3.07 0.48 0.64 0.05 -1.26 -4.79 118.68 114.69 2k70 s LEU 28 Ca 0.22 -0.58 -0.19 0.00 0.05 0.00 0.00 54.13 53.63 2k70 s LEU 28 Cb 0.18 -1.70 -0.09 0.00 -2.05 0.00 0.00 46.19 42.53 2k70 s LEU 28 CO 0.42 0.07 0.98 -2.16 -0.55 0.00 0.00 176.35 175.12 2k70 s PRO 29 N -3.09 4.00 0.15 1.48 0.04 -1.26 -3.91 135.00 132.40 2k70 s PRO 29 Ca 0.27 1.11 0.01 0.00 0.04 0.00 0.00 61.00 62.43 2k70 s PRO 29 Cb -0.08 -2.14 -0.04 0.00 0.04 0.00 0.00 34.50 32.28 2k70 s PRO 29 CO 0.17 -0.23 0.30 -0.51 0.04 0.00 0.00 177.00 176.77 2k70 s LEU 30 N -3.62 4.32 -0.16 -3.56 1.43 0.16 -4.92 118.68 112.32 2k70 s LEU 30 Ca 0.62 0.24 -0.05 0.00 -1.03 0.00 0.00 54.13 53.91 2k70 s LEU 30 Cb -0.11 -2.98 0.06 0.00 0.03 0.00 0.00 46.19 43.20 2k70 s LEU 30 CO 0.22 0.05 0.11 -0.60 0.23 0.00 0.00 176.35 176.36 2k70 s ARG 31 N -3.14 0.07 -0.40 1.70 3.52 -1.26 -0.14 118.95 119.30 2k70 s ARG 31 Ca 0.35 0.02 -0.16 0.00 -0.13 0.00 0.00 55.73 55.81 2k70 s ARG 31 Cb -0.11 -1.58 0.01 0.00 -1.56 0.00 0.00 34.95 31.71 2k70 s ARG 31 CO 0.28 -0.63 0.39 -1.17 -0.81 0.00 0.00 175.30 173.36 2k70 s LEU 32 N 2.18 4.82 -0.01 -0.88 2.96 0.12 -0.96 118.68 126.91 2k70 s LEU 32 Ca 0.03 -0.62 0.07 0.00 -0.22 0.00 0.00 54.13 53.39 2k70 s LEU 32 Cb -0.16 -2.32 -0.11 0.00 0.50 0.00 0.00 46.19 44.10 2k70 s LEU 32 CO -0.09 -0.49 0.18 1.33 -1.32 0.00 0.00 176.35 175.96 2k70 n VAL 33 N 5.33 0.00 -3.37 1.68 0.24 -0.00 -0.66 118.33 121.54 2k70 n VAL 33 Ca -0.09 -0.19 -0.04 0.00 -2.04 0.00 0.00 64.34 61.98 2k70 n VAL 33 Cb 0.48 0.45 0.01 0.00 -1.47 0.00 0.00 33.84 33.31 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 1.93 1.57 2.76 7.63 0.00 -1.06 -4.74 105.19 113.29 2k70 n GLY 34 Ca -0.01 -1.14 -0.13 0.00 0.00 0.00 0.00 46.02 44.74 2k70 n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k70 n ALA 35 N -1.90 -0.06 -3.59 4.61 0.00 -1.26 -1.25 120.51 117.06 2k70 n ALA 35 Ca -0.08 -1.41 -0.10 0.00 0.00 0.00 0.00 53.44 51.85 2k70 n ALA 35 Cb 0.27 1.14 0.00 0.00 0.00 0.00 0.00 19.45 20.87 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 -2.78 2.12 -0.26 0.00 0.52 -0.30 -4.80 118.95 113.45 2k70 s ARG 36 Ca 0.26 -1.48 -0.34 0.00 -0.52 0.00 0.00 55.73 53.66 2k70 s ARG 36 Cb -0.00 0.58 0.17 0.00 0.52 0.00 0.00 34.95 36.22 2k70 s ARG 36 CO 0.19 -0.97 1.31 -0.08 0.02 0.00 0.00 175.30 175.77 2k70 s THR 37 N -2.62 0.00 -1.08 0.02 -1.32 -1.26 -0.46 115.64 108.92 2k70 s THR 37 Ca 0.19 0.00 0.11 0.00 -1.21 0.00 0.00 61.69 60.78 2k70 s THR 37 Cb -0.04 -1.00 0.11 0.00 -1.51 0.00 0.00 72.50 70.06 2k70 s THR 37 CO 0.13 0.00 1.33 -0.81 -2.21 0.00 0.00 174.62 173.06 2k70 n PRO 38 N 0.23 0.03 -2.43 7.08 -0.04 -1.26 -3.63 135.00 134.97 2k70 n PRO 38 Ca 0.01 0.29 -0.26 0.00 -0.04 0.00 0.00 63.50 63.50 2k70 n PRO 38 Cb 0.58 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 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 -1.46 2.36 -3.57 0.52 0.24 -1.26 -4.84 118.33 110.32 2k70 n VAL 39 Ca 0.03 -4.81 -0.10 0.00 -2.04 0.00 0.00 64.34 57.42 2k70 n VAL 39 Cb 0.12 -1.21 -0.02 0.00 -1.47 0.00 0.00 33.84 31.26 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 -3.54 -1.54 -0.16 2.33 0.00 -1.24 -4.14 121.76 113.47 2k70 s ALA 40 Ca 0.48 0.33 0.10 0.00 0.00 0.00 0.00 51.96 52.87 2k70 s ALA 40 Cb 0.40 0.80 -0.23 0.00 0.00 0.00 0.00 23.12 24.09 2k70 s ALA 40 CO -0.16 -0.85 0.20 -1.91 0.00 0.00 0.00 175.76 173.05 2k70 n GLU 41 N -0.39 0.68 -3.59 0.00 4.07 0.45 -4.82 120.64 117.04 2k70 n GLU 41 Ca -0.12 0.14 -0.13 0.00 -0.06 0.00 0.00 57.16 56.99 2k70 n GLU 41 Cb 0.63 -1.62 -0.05 0.00 -0.06 0.00 0.00 31.44 30.34 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 -2.53 1.05 -0.29 5.31 0.52 -1.24 -5.03 118.95 116.74 2k70 s ARG 42 Ca -0.15 -0.41 0.00 0.00 -0.52 0.00 0.00 55.73 54.65 2k70 s ARG 42 Cb 0.07 0.47 0.18 0.00 0.52 0.00 0.00 34.95 36.20 2k70 s ARG 42 CO 0.78 -0.40 0.56 0.54 0.02 0.00 0.00 175.30 176.80 2k70 s VAL 43 N -2.96 -0.93 -0.03 3.52 0.11 -1.26 -1.88 120.40 116.96 2k70 s VAL 43 Ca -0.02 -0.02 0.06 0.00 -2.93 0.00 0.00 61.98 59.06 2k70 s VAL 43 Cb -0.00 -0.97 -0.01 0.00 -1.53 0.00 0.00 36.38 33.86 2k70 s VAL 43 CO -0.06 -0.03 -0.21 -1.61 -3.33 0.00 0.00 175.10 169.87 2k70 s GLU 44 N 2.80 1.89 -0.15 1.54 8.01 -0.81 -4.25 118.70 127.73 2k70 s GLU 44 Ca 0.17 -0.74 -0.22 0.00 0.01 0.00 0.00 54.97 54.20 2k70 s GLU 44 Cb -0.14 -1.72 -0.03 0.00 -4.31 0.00 0.00 34.13 27.93 2k70 s GLU 44 CO -0.22 0.37 0.66 -1.17 0.01 0.00 0.00 175.26 174.92 2k70 s LEU 45 N -0.26 4.21 0.25 1.80 2.96 -1.26 -0.54 118.68 125.84 2k70 s LEU 45 Ca 0.02 0.98 0.12 0.00 -0.22 0.00 0.00 54.13 55.02 2k70 s LEU 45 Cb -0.10 -2.97 -0.05 0.00 0.50 0.00 0.00 46.19 43.57 2k70 s LEU 45 CO 0.01 -0.21 -0.20 -1.00 -1.32 0.00 0.00 176.35 173.63 2k70 s HIS 46 N 1.48 2.33 0.22 5.38 3.76 0.23 -0.43 115.29 128.26 2k70 s HIS 46 Ca 0.32 -0.33 0.05 0.00 -0.15 0.00 0.00 55.06 54.96 2k70 s HIS 46 Cb -0.16 -1.05 -0.03 0.00 1.11 0.00 0.00 32.58 32.44 2k70 s HIS 46 CO 0.13 0.65 0.28 -1.83 -0.85 0.00 0.00 174.74 173.12 2k70 s GLU 47 N -3.28 3.23 -0.09 1.40 -1.05 0.09 -1.09 118.70 117.91 2k70 s GLU 47 Ca 0.28 -0.84 0.01 0.00 -0.15 0.00 0.00 54.97 54.27 2k70 s GLU 47 Cb -0.06 -2.78 -0.02 0.00 -0.44 0.00 0.00 34.13 30.83 2k70 s GLU 47 CO 0.14 0.44 -0.12 0.99 0.95 0.00 0.00 175.26 177.66 2k70 s THR 48 N -1.97 3.18 0.27 1.83 2.01 -1.16 -1.87 115.64 117.92 2k70 s THR 48 Ca 0.33 -0.65 0.04 0.00 0.31 0.00 0.00 61.69 61.73 2k70 s THR 48 Cb -0.09 -2.29 -0.06 0.00 0.01 0.00 0.00 72.50 70.07 2k70 s THR 48 CO 0.27 0.56 0.00 0.72 -0.69 0.00 0.00 174.62 175.48 2k70 s PHE 49 N -0.24 1.78 -0.00 4.92 -0.12 -0.01 -4.69 117.98 119.62 2k70 s PHE 49 Ca 0.02 -0.88 -0.02 0.00 -0.05 0.00 0.00 56.93 56.00 2k70 s PHE 49 Cb -0.13 -1.07 -0.04 0.00 -0.63 0.00 0.00 43.02 41.15 2k70 s PHE 49 CO 0.03 0.06 0.17 -1.64 -0.05 0.00 0.00 175.22 173.78 2k70 s MET 50 N -3.84 3.39 -0.03 1.99 -1.94 -1.26 -1.21 119.30 116.40 2k70 s MET 50 Ca 0.31 -0.35 -0.24 0.00 -1.71 0.00 0.00 55.69 53.70 2k70 s MET 50 Cb 0.06 -3.06 0.05 0.00 2.01 0.00 0.00 34.83 33.89 2k70 s MET 50 CO 0.12 0.67 0.52 0.50 -0.01 0.00 0.00 175.02 176.81 2k70 s ARG 51 N -1.94 0.90 -0.20 2.03 3.00 -0.40 -4.91 118.95 117.43 2k70 s ARG 51 Ca 0.27 0.04 -0.08 0.00 -1.00 0.00 0.00 55.73 54.97 2k70 s ARG 51 Cb -0.13 0.42 -0.04 0.00 0.00 0.00 0.00 34.95 35.20 2k70 s ARG 51 CO 0.19 -0.27 0.07 -2.00 0.00 0.00 0.00 175.30 173.28 2k70 s GLU 52 N -1.33 3.92 -0.09 5.12 2.56 -1.26 -0.27 118.70 127.35 2k70 s GLU 52 Ca -0.12 -0.36 -0.08 0.00 0.00 0.00 0.00 54.97 54.41 2k70 s GLU 52 Cb -0.02 -3.26 0.03 0.00 2.00 0.00 0.00 34.13 32.88 2k70 s GLU 52 CO 0.07 0.17 0.24 0.08 -0.56 0.00 0.00 175.26 175.26 2k70 s VAL 53 N 0.66 -0.01 -1.43 3.70 1.01 0.07 -4.89 120.40 119.51 2k70 s VAL 53 Ca 0.04 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.04 2k70 s VAL 53 Cb -0.13 -0.34 0.00 0.00 0.00 0.00 0.00 36.38 35.91 2k70 s VAL 53 CO 0.02 0.01 0.00 1.21 0.00 0.00 0.00 175.10 176.34 2k70 n GLU 54 N 3.18 -1.01 -1.12 2.72 2.13 -1.26 -1.50 120.64 123.77 2k70 n GLU 54 Ca -0.15 0.93 -0.04 0.00 0.66 0.00 0.00 57.16 58.56 2k70 n GLU 54 Cb 0.57 -5.07 -0.02 0.00 0.27 0.00 0.00 31.44 27.20 2k70 n GLU 54 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2k70 n GLY 55 N -1.20 0.71 2.85 8.31 0.00 -1.26 -5.02 105.19 109.58 2k70 n GLY 55 Ca -0.15 -0.72 -0.14 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.14 0.02 0.09 1.61 1.02 -0.57 -5.14 119.74 114.63 2k70 s LYS 56 Ca 0.00 0.20 -0.31 0.00 0.02 0.00 0.00 55.97 55.88 2k70 s LYS 56 Cb 0.00 -0.16 -0.07 0.00 -0.52 0.00 0.00 37.83 37.08 2k70 s LYS 56 CO 0.00 -0.13 1.34 0.15 -0.92 0.00 0.00 175.35 175.79 2k70 s LYS 57 N 0.83 4.35 0.21 1.68 1.02 -1.26 -0.75 119.74 125.81 2k70 s LYS 57 Ca -0.07 1.98 -0.00 0.00 0.02 0.00 0.00 55.97 57.90 2k70 s LYS 57 Cb -0.09 -3.31 -0.04 0.00 -0.52 0.00 0.00 37.83 33.86 2k70 s LYS 57 CO -0.03 -0.40 0.11 0.14 -0.92 0.00 0.00 175.35 174.25 2k70 s VAL 58 N 1.25 0.18 0.06 3.17 -7.23 0.63 -4.97 120.40 113.49 2k70 s VAL 58 Ca 0.63 -1.99 0.08 0.00 -1.81 0.00 0.00 61.98 58.88 2k70 s VAL 58 Cb -0.34 -2.49 -0.03 0.00 0.56 0.00 0.00 36.38 34.07 2k70 s VAL 58 CO 0.29 -0.05 -0.19 -0.04 -0.31 0.00 0.00 175.10 174.81 2k70 s MET 59 N -4.11 2.00 0.28 4.82 -1.94 -1.26 -1.27 119.30 117.82 2k70 s MET 59 Ca 0.37 -1.03 0.04 0.00 -1.71 0.00 0.00 55.69 53.37 2k70 s MET 59 Cb 0.07 -2.16 -0.02 0.00 2.01 0.00 0.00 34.83 34.73 2k70 s MET 59 CO 0.11 0.53 0.15 0.41 -0.01 0.00 0.00 175.02 176.21 2k70 n GLY 60 N 1.42 3.35 3.27 -0.03 0.00 -0.35 -4.97 105.19 107.88 2k70 n GLY 60 Ca -0.16 -1.96 -0.14 0.00 0.00 0.00 0.00 46.02 43.76 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 -3.09 0.68 0.06 1.61 1.75 -1.26 -0.83 119.30 118.22 2k70 s MET 61 Ca 0.22 -0.08 -0.21 0.00 -1.25 0.00 0.00 55.69 54.37 2k70 s MET 61 Cb 0.01 0.30 0.05 0.00 2.84 0.00 0.00 34.83 38.03 2k70 s MET 61 CO 0.15 -0.18 0.50 -0.98 -0.65 0.00 0.00 175.02 173.86 2k70 s ARG 62 N -1.15 1.03 0.61 4.11 1.70 -0.78 -4.98 118.95 119.49 2k70 s ARG 62 Ca -0.12 -0.30 -0.16 0.00 -0.47 0.00 0.00 55.73 54.67 2k70 s ARG 62 Cb -0.04 0.47 -0.02 0.00 -0.57 0.00 0.00 34.95 34.78 2k70 s ARG 62 CO 0.04 -0.38 1.11 -1.25 -1.08 0.00 0.00 175.30 173.74 2k70 s PRO 63 N -2.63 3.04 0.02 3.89 0.04 -1.26 -0.74 135.00 137.37 2k70 s PRO 63 Ca -0.04 1.43 -0.01 0.00 0.04 0.00 0.00 61.00 62.42 2k70 s PRO 63 Cb -0.00 -1.98 -0.02 0.00 0.04 0.00 0.00 34.50 32.54 2k70 s PRO 63 CO -0.03 -1.07 -0.01 0.14 0.04 0.00 0.00 177.00 176.07 2k70 s VAL 64 N -2.18 0.12 -0.09 -0.36 -7.23 0.43 -4.76 120.40 106.33 2k70 s VAL 64 Ca 0.68 -0.99 0.13 0.00 -1.81 0.00 0.00 61.98 59.99 2k70 s VAL 64 Cb -0.21 -0.43 -0.02 0.00 0.56 0.00 0.00 36.38 36.29 2k70 s VAL 64 CO 0.36 -0.55 1.36 1.55 -0.31 0.00 0.00 175.10 177.51 2k70 h PRO 65 N 4.43 0.00 -1.52 4.82 0.13 -1.95 -3.41 132.00 134.51 2k70 h PRO 65 Ca -0.32 0.00 0.29 0.00 -0.87 0.00 0.00 66.00 65.09 2k70 h PRO 65 Cb 1.20 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.18 2k70 h PRO 65 CO 0.44 0.60 0.80 -0.59 -0.23 0.00 0.00 178.00 179.02 2k70 s PHE 66 N -2.90 -0.09 0.17 1.56 -0.12 -1.26 -4.67 117.98 110.67 2k70 s PHE 66 Ca 0.03 -0.00 0.06 0.00 -0.05 0.00 0.00 56.93 56.97 2k70 s PHE 66 Cb 0.08 0.54 -0.04 0.00 -0.63 0.00 0.00 43.02 42.97 2k70 s PHE 66 CO 0.77 -0.28 0.06 -0.51 -0.05 0.00 0.00 175.22 175.21 2k70 s LEU 67 N -2.64 3.55 0.06 -1.99 1.43 0.17 -4.98 118.68 114.29 2k70 s LEU 67 Ca 0.12 -0.26 0.05 0.00 -1.03 0.00 0.00 54.13 53.00 2k70 s LEU 67 Cb 0.02 -2.19 -0.04 0.00 0.03 0.00 0.00 46.19 44.02 2k70 s LEU 67 CO -0.04 0.08 -0.04 -0.70 0.23 0.00 0.00 176.35 175.88 2k70 s GLU 68 N -3.00 2.46 -0.07 1.70 2.56 -1.26 -0.70 118.70 120.39 2k70 s GLU 68 Ca 0.29 -0.83 -0.04 0.00 0.00 0.00 0.00 54.97 54.39 2k70 s GLU 68 Cb -0.10 -2.48 0.03 0.00 2.00 0.00 0.00 34.13 33.58 2k70 s GLU 68 CO 0.21 0.56 0.16 0.08 -0.56 0.00 0.00 175.26 175.71 2k70 s VAL 69 N -1.18 -0.03 0.98 3.70 1.01 0.80 -4.96 120.40 120.71 2k70 s VAL 69 Ca 0.22 0.11 -0.12 0.00 0.00 0.00 0.00 61.98 62.18 2k70 s VAL 69 Cb -0.11 -0.25 0.18 0.00 0.00 0.00 0.00 36.38 36.19 2k70 s VAL 69 CO 0.13 0.05 1.09 -2.16 0.00 0.00 0.00 175.10 174.21 2k70 s PRO 70 N 0.79 0.56 0.49 2.72 0.04 -1.26 -0.67 135.00 137.68 2k70 s PRO 70 Ca -0.06 0.63 -0.23 0.00 0.04 0.00 0.00 61.00 61.37 2k70 s PRO 70 Cb -0.08 -1.74 -0.07 0.00 0.04 0.00 0.00 34.50 32.66 2k70 s PRO 70 CO -0.04 -2.67 1.36 -1.25 0.04 0.00 0.00 177.00 174.44 2k70 s PRO 71 N -4.92 3.46 0.00 0.56 0.04 -1.25 -3.21 135.00 129.67 2k70 s PRO 71 Ca 0.65 2.25 0.00 0.00 0.04 0.00 0.00 61.00 63.94 2k70 s PRO 71 Cb -0.19 -2.45 0.00 0.00 0.04 0.00 0.00 34.50 31.90 2k70 s PRO 71 CO 0.58 -0.94 0.00 1.63 0.04 0.00 0.00 177.00 178.31 2k70 n LYS 72 N -0.59 0.00 -1.81 4.56 4.76 -0.50 -4.97 118.16 119.61 2k70 n LYS 72 Ca 0.08 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.22 2k70 n LYS 72 Cb 0.44 -3.35 0.07 0.00 -1.84 0.00 0.00 35.03 30.35 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 1.62 0.10 0.72 0.00 -1.20 -4.75 107.32 101.81 2k70 s GLY 73 Ca 0.00 -0.38 -0.27 0.00 0.00 0.00 0.00 44.72 44.07 2k70 s GLY 73 CO 0.00 0.03 0.84 0.50 0.00 0.00 0.00 173.10 174.47 2k70 s ARG 74 N -5.36 4.60 -1.08 2.90 0.52 -1.26 -0.86 118.95 118.40 2k70 s ARG 74 Ca 0.60 1.24 -0.10 0.00 -0.52 0.00 0.00 55.73 56.94 2k70 s ARG 74 Cb -0.12 -3.35 0.26 0.00 0.52 0.00 0.00 34.95 32.26 2k70 s ARG 74 CO 0.52 0.32 1.09 0.08 0.02 0.00 0.00 175.30 177.33 2k70 s VAL 75 N -0.27 5.85 -0.03 3.52 1.01 0.13 -4.87 120.40 125.74 2k70 s VAL 75 Ca 0.41 -3.20 0.00 0.00 0.00 0.00 0.00 61.98 59.19 2k70 s VAL 75 Cb -0.22 -4.62 0.03 0.00 0.00 0.00 0.00 36.38 31.57 2k70 s VAL 75 CO 0.26 -1.21 0.01 -1.83 0.00 0.00 0.00 175.10 172.34 2k70 s GLU 76 N -0.76 0.21 0.93 2.72 -1.05 -1.26 -1.47 118.70 118.01 2k70 s GLU 76 Ca 0.30 0.12 -0.12 0.00 -0.15 0.00 0.00 54.97 55.12 2k70 s GLU 76 Cb -0.09 -0.44 0.15 0.00 -0.44 0.00 0.00 34.13 33.31 2k70 s GLU 76 CO -0.07 -0.15 1.10 -0.51 0.95 0.00 0.00 175.26 176.57 2k70 s LEU 77 N 1.10 1.99 -0.17 1.83 1.02 -0.27 -5.01 118.68 119.18 2k70 s LEU 77 Ca -0.09 1.26 -0.09 0.00 0.02 0.00 0.00 54.13 55.23 2k70 s LEU 77 Cb -0.13 -3.60 -0.05 0.00 0.02 0.00 0.00 46.19 42.43 2k70 s LEU 77 CO -0.02 -2.75 0.15 -0.54 0.02 0.00 0.00 176.35 173.21 2k70 s LYS 78 N -5.02 3.95 0.51 1.70 3.01 -1.20 -4.81 119.74 117.87 2k70 s LYS 78 Ca 0.64 -0.16 0.34 0.00 -1.01 0.00 0.00 55.97 55.78 2k70 s LYS 78 Cb -0.17 -3.34 1.75 0.00 -1.01 0.00 0.00 37.83 35.06 2k70 s LYS 78 CO 0.56 0.46 2.04 -1.00 0.51 0.00 0.00 175.35 177.91 2k70 h PRO 79 N 6.10 0.00 0.00 -1.68 0.13 -1.96 -2.24 132.00 132.35 2k70 h PRO 79 Ca -0.46 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.67 2k70 h PRO 79 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 2k70 h PRO 79 CO 0.70 0.00 -1.13 0.41 -0.23 0.00 0.00 178.00 177.75 2k70 n GLY 80 N -0.87 -0.13 0.00 1.56 0.00 -1.26 -5.04 105.19 99.45 2k70 n GLY 80 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 2.40 1.54 3.76 -0.02 0.00 -0.84 -4.60 105.19 107.44 2k70 n GLY 81 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 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 0.39 3.18 -0.18 1.61 2.02 -1.24 -3.01 117.35 120.13 2k70 s TYR 82 Ca 0.00 1.44 -0.27 0.00 -0.37 0.00 0.00 57.07 57.87 2k70 s TYR 82 Cb 0.00 -3.60 0.07 0.00 -0.40 0.00 0.00 41.96 38.03 2k70 s TYR 82 CO 0.00 -1.62 0.68 -3.38 -1.57 0.00 0.00 175.55 169.66 2k70 s HIS 83 N -0.96 -0.71 0.57 2.71 -3.43 -0.25 -3.23 115.29 109.99 2k70 s HIS 83 Ca 0.49 1.56 -0.15 0.00 -0.80 0.00 0.00 55.06 56.16 2k70 s HIS 83 Cb -0.38 0.31 -0.05 0.00 -1.43 0.00 0.00 32.58 31.03 2k70 s HIS 83 CO 0.48 -0.46 1.02 -0.06 -2.00 0.00 0.00 174.74 173.72 2k70 s PHE 84 N -0.25 3.35 -0.11 0.38 0.08 -0.87 -0.60 117.98 119.96 2k70 s PHE 84 Ca -0.04 1.44 0.02 0.00 0.12 0.00 0.00 56.93 58.47 2k70 s PHE 84 Cb -0.03 -2.83 -0.01 0.00 -0.57 0.00 0.00 43.02 39.58 2k70 s PHE 84 CO 0.04 -0.67 -0.20 -1.64 -0.10 0.00 0.00 175.22 172.66 2k70 s MET 85 N -4.36 3.17 -0.13 0.44 -1.94 0.30 -0.82 119.30 115.96 2k70 s MET 85 Ca 0.59 -0.81 -0.05 0.00 -1.71 0.00 0.00 55.69 53.71 2k70 s MET 85 Cb -0.12 -2.43 -0.04 0.00 2.01 0.00 0.00 34.83 34.26 2k70 s MET 85 CO 0.39 0.18 0.06 -0.51 -0.01 0.00 0.00 175.02 175.13 2k70 s LEU 86 N 0.37 3.87 0.14 -0.03 1.02 -0.44 -1.92 118.68 121.68 2k70 s LEU 86 Ca -0.16 0.21 0.09 0.00 0.02 0.00 0.00 54.13 54.29 2k70 s LEU 86 Cb -0.17 -1.93 -0.04 0.00 0.02 0.00 0.00 46.19 44.07 2k70 s LEU 86 CO 0.07 0.32 -0.20 -0.76 0.02 0.00 0.00 176.35 175.80 2k70 s LEU 87 N -0.51 2.37 0.00 1.79 1.02 -0.79 -1.05 118.68 121.51 2k70 s LEU 87 Ca 0.10 -0.77 0.00 0.00 0.02 0.00 0.00 54.13 53.48 2k70 s LEU 87 Cb -0.12 -0.90 0.00 0.00 0.02 0.00 0.00 46.19 45.20 2k70 s LEU 87 CO 0.02 0.03 0.00 0.61 0.02 0.00 0.00 176.35 177.03 2k70 n GLY 88 N 0.70 1.76 4.55 -3.19 0.00 -0.05 -0.41 105.19 108.54 2k70 n GLY 88 Ca -0.16 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.79 2k70 n GLY 88 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2k70 n LEU 89 N 0.00 0.00 0.00 0.99 -0.00 -1.24 -4.64 117.00 112.11 2k70 n LEU 89 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2k70 n LEU 89 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2k70 n LEU 89 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 177.39 177.68 2k70 n LYS 90 N 0.00 0.00 -3.84 1.96 4.76 -1.26 -4.12 118.16 115.66 2k70 n LYS 90 Ca 0.00 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.32 2k70 n LYS 90 Cb 0.00 -2.19 -0.11 0.00 -1.84 0.00 0.00 35.03 30.90 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 0.00 0.41 0.59 1.97 1.81 -1.26 -5.07 118.95 117.39 2k70 s ARG 91 Ca 0.00 -0.15 -0.15 0.00 -1.72 0.00 0.00 55.73 53.71 2k70 s ARG 91 Cb 0.00 0.18 -0.04 0.00 -0.45 0.00 0.00 34.95 34.64 2k70 s ARG 91 CO 0.00 -0.09 1.03 -1.25 -0.68 0.00 0.00 175.30 174.31 2k70 s PRO 92 N -0.87 3.48 0.01 3.54 0.04 -1.26 -5.09 135.00 134.86 2k70 s PRO 92 Ca -0.10 1.06 -0.28 0.00 0.04 0.00 0.00 61.00 61.72 2k70 s PRO 92 Cb -0.05 -2.06 0.10 0.00 0.04 0.00 0.00 34.50 32.52 2k70 s PRO 92 CO 0.01 -0.67 0.86 -0.48 0.04 0.00 0.00 177.00 176.77 2k70 s LEU 93 N -4.56 -0.38 0.00 -3.56 0.05 -1.26 -5.19 118.68 103.77 2k70 s LEU 93 Ca 0.61 -0.01 0.02 0.00 0.05 0.00 0.00 54.13 54.80 2k70 s LEU 93 Cb -0.13 2.08 0.02 0.00 -2.05 0.00 0.00 46.19 46.11 2k70 s LEU 93 CO 0.39 -0.66 0.19 2.29 -0.55 0.00 0.00 176.35 178.01 2k70 n LYS 94 N -0.26 1.12 -0.68 1.48 -0.00 -1.26 -4.91 118.16 113.64 2k70 n LYS 94 Ca -0.09 -1.58 -0.28 0.00 -0.00 0.00 0.00 58.31 56.36 2k70 n LYS 94 Cb 0.62 0.17 0.24 0.00 -0.00 0.00 0.00 35.03 36.06 2k70 n LYS 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2k70 s ALA 95 N -2.36 -0.19 -1.44 0.58 0.00 -1.26 -4.28 121.76 112.81 2k70 s ALA 95 Ca 0.14 -0.18 -0.04 0.00 0.00 0.00 0.00 51.96 51.88 2k70 s ALA 95 Cb -0.01 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 19.90 2k70 s ALA 95 CO 0.09 -3.65 0.59 0.41 0.00 0.00 0.00 175.76 173.20 2k70 n GLY 96 N 0.38 -0.43 3.13 0.00 0.00 -0.58 -4.99 105.19 102.71 2k70 n GLY 96 Ca 0.03 0.07 -0.19 0.00 0.00 0.00 0.00 46.02 45.93 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 -3.83 0.76 -4.20 1.61 -0.58 -1.22 -4.96 120.64 108.23 2k70 n GLU 97 Ca -0.10 -2.68 -0.16 0.00 -0.42 0.00 0.00 57.16 53.80 2k70 n GLU 97 Cb 0.61 0.08 -0.13 0.00 -0.57 0.00 0.00 31.44 31.42 2k70 n GLU 97 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 2k70 s GLU 98 N -3.97 0.58 -0.03 3.49 -1.05 -1.26 -0.13 118.70 116.33 2k70 s GLU 98 Ca 0.36 -0.45 -0.03 0.00 -0.15 0.00 0.00 54.97 54.71 2k70 s GLU 98 Cb -0.03 -0.51 0.01 0.00 -0.44 0.00 0.00 34.13 33.16 2k70 s GLU 98 CO 0.23 0.13 0.08 0.08 0.95 0.00 0.00 175.26 176.73 2k70 s VAL 99 N -0.58 -0.01 0.16 1.83 1.01 0.74 -4.85 120.40 118.69 2k70 s VAL 99 Ca -0.01 0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.02 2k70 s VAL 99 Cb -0.05 -0.13 -0.04 0.00 0.00 0.00 0.00 36.38 36.16 2k70 s VAL 99 CO 0.00 0.02 0.32 -1.83 0.00 0.00 0.00 175.10 173.61 2k70 s GLU 100 N 0.25 3.47 -0.02 2.72 -1.05 -1.26 -1.34 118.70 121.47 2k70 s GLU 100 Ca -0.02 -0.48 0.00 0.00 -0.15 0.00 0.00 54.97 54.33 2k70 s GLU 100 Cb -0.03 -2.92 0.02 0.00 -0.44 0.00 0.00 34.13 30.76 2k70 s GLU 100 CO -0.01 0.48 0.01 -0.51 0.95 0.00 0.00 175.26 176.19 2k70 s LEU 101 N -3.19 1.34 0.02 1.83 1.43 -0.55 -4.37 118.68 115.19 2k70 s LEU 101 Ca 0.36 0.01 -0.30 0.00 -1.03 0.00 0.00 54.13 53.17 2k70 s LEU 101 Cb -0.11 -0.11 -0.04 0.00 0.03 0.00 0.00 46.19 45.96 2k70 s LEU 101 CO 0.29 -0.08 1.03 -1.81 0.23 0.00 0.00 176.35 176.00 2k70 s ASP 102 N 0.77 7.31 -0.21 2.29 1.01 0.40 0.05 116.67 128.28 2k70 s ASP 102 Ca -0.07 1.75 -0.13 0.00 0.71 0.00 0.00 52.55 54.82 2k70 s ASP 102 Cb -0.10 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.21 2k70 s ASP 102 CO -0.02 -0.30 0.25 -0.76 0.21 0.00 0.00 175.17 174.56 2k70 s LEU 103 N 0.96 4.16 -0.43 1.23 1.02 0.16 -1.15 118.68 124.64 2k70 s LEU 103 Ca 0.53 0.32 -0.17 0.00 0.02 0.00 0.00 54.13 54.83 2k70 s LEU 103 Cb -0.23 -2.28 0.02 0.00 0.02 0.00 0.00 46.19 43.72 2k70 s LEU 103 CO 0.28 0.04 0.45 -0.76 0.02 0.00 0.00 176.35 176.38 2k70 s LEU 104 N 0.93 4.88 -0.03 1.79 1.43 -0.38 -2.55 118.68 124.75 2k70 s LEU 104 Ca 0.13 -0.69 -0.01 0.00 -1.03 0.00 0.00 54.13 52.53 2k70 s LEU 104 Cb -0.13 -2.39 -0.04 0.00 0.03 0.00 0.00 46.19 43.66 2k70 s LEU 104 CO 0.05 -0.60 0.04 -0.36 0.23 0.00 0.00 176.35 175.71 2k70 s PHE 105 N 2.15 3.22 0.51 0.29 0.08 -0.73 -0.82 117.98 122.68 2k70 s PHE 105 Ca 0.12 0.19 -0.23 0.00 0.12 0.00 0.00 56.93 57.14 2k70 s PHE 105 Cb -0.17 -1.75 -0.06 0.00 -0.57 0.00 0.00 43.02 40.47 2k70 s PHE 105 CO 0.13 0.52 1.36 0.00 -0.10 0.00 0.00 175.22 177.13 2k70 s ALA 106 N -1.08 2.94 -0.36 5.36 0.00 -0.13 -3.23 121.76 125.25 2k70 s ALA 106 Ca 0.19 1.33 -0.00 0.00 0.00 0.00 0.00 51.96 53.48 2k70 s ALA 106 Cb -0.12 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.44 2k70 s ALA 106 CO 0.09 -1.27 0.02 0.41 0.00 0.00 0.00 175.76 175.02 2k70 n GLY 107 N 0.67 0.24 0.77 0.00 0.00 -1.26 -4.37 105.19 101.24 2k70 n GLY 107 Ca 0.09 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.99 0.76 3.10 -0.02 0.00 -1.25 -5.11 105.19 101.69 2k70 n GLY 108 Ca -0.05 -0.36 -0.19 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.58 0.82 -0.01 1.61 3.01 -1.20 -5.09 119.74 116.30 2k70 s LYS 109 Ca 0.00 -0.66 -0.05 0.00 -1.01 0.00 0.00 55.97 54.25 2k70 s LYS 109 Cb 0.00 -0.79 0.00 0.00 -1.01 0.00 0.00 37.83 36.03 2k70 s LYS 109 CO 0.00 0.20 0.12 0.08 0.51 0.00 0.00 175.35 176.25 2k70 s VAL 110 N -0.78 0.06 -0.13 3.17 1.01 -1.26 -1.77 120.40 120.70 2k70 s VAL 110 Ca 0.00 -0.48 -0.05 0.00 0.00 0.00 0.00 61.98 61.45 2k70 s VAL 110 Cb -0.07 -0.33 0.07 0.00 0.00 0.00 0.00 36.38 36.04 2k70 s VAL 110 CO 0.01 -0.26 0.27 -0.22 0.00 0.00 0.00 175.10 174.90 2k70 s LEU 111 N -0.89 -0.31 -0.39 3.92 0.20 -1.06 -4.99 118.68 115.16 2k70 s LEU 111 Ca -0.10 0.62 -0.18 0.00 0.69 0.00 0.00 54.13 55.16 2k70 s LEU 111 Cb -0.06 0.74 0.01 0.00 -0.43 0.00 0.00 46.19 46.45 2k70 s LEU 111 CO 0.01 -0.24 0.51 -0.75 -0.29 0.00 0.00 176.35 175.59 2k70 s LYS 112 N 2.41 3.41 0.55 1.98 2.20 -1.26 -0.66 119.74 128.36 2k70 s LYS 112 Ca 0.01 -0.38 -0.03 0.00 -0.36 0.00 0.00 55.97 55.21 2k70 s LYS 112 Cb -0.12 -3.88 0.02 0.00 -1.51 0.00 0.00 37.83 32.34 2k70 s LYS 112 CO -0.09 -0.76 0.82 0.14 -0.36 0.00 0.00 175.35 175.09 2k70 s VAL 113 N 2.38 3.42 0.02 4.02 -7.23 0.11 -4.91 120.40 118.21 2k70 s VAL 113 Ca 0.17 -0.31 0.06 0.00 -1.81 0.00 0.00 61.98 60.09 2k70 s VAL 113 Cb -0.16 -3.33 -0.02 0.00 0.56 0.00 0.00 36.38 33.44 2k70 s VAL 113 CO 0.14 -0.28 -0.18 0.54 -0.31 0.00 0.00 175.10 175.01 2k70 s VAL 114 N -2.84 1.40 0.03 1.32 0.11 -1.26 -1.48 120.40 117.69 2k70 s VAL 114 Ca 0.53 -0.97 -0.24 0.00 -2.93 0.00 0.00 61.98 58.38 2k70 s VAL 114 Cb -0.10 -1.21 0.05 0.00 -1.53 0.00 0.00 36.38 33.59 2k70 s VAL 114 CO 0.41 0.22 0.54 -1.48 -3.33 0.00 0.00 175.10 171.47 2k70 s LEU 115 N -0.86 -0.17 0.85 2.54 2.34 -0.45 -4.86 118.68 118.08 2k70 s LEU 115 Ca 0.06 0.25 -0.11 0.00 0.06 0.00 0.00 54.13 54.39 2k70 s LEU 115 Cb -0.08 2.19 0.10 0.00 -0.56 0.00 0.00 46.19 47.85 2k70 s LEU 115 CO 0.01 -0.70 1.10 -2.16 -1.06 0.00 0.00 176.35 173.53 2k70 s PRO 116 N -2.26 1.59 -0.23 1.48 0.04 -1.26 -0.19 135.00 134.18 2k70 s PRO 116 Ca -0.06 1.06 -0.08 0.00 0.04 0.00 0.00 61.00 61.95 2k70 s PRO 116 Cb -0.01 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.66 2k70 s PRO 116 CO -0.00 -2.08 0.10 0.08 0.04 0.00 0.00 177.00 175.14 2k70 s VAL 117 N -2.87 4.77 0.30 -0.36 1.01 0.81 -0.84 120.40 123.22 2k70 s VAL 117 Ca 0.63 -0.03 -0.11 0.00 0.00 0.00 0.00 61.98 62.47 2k70 s VAL 117 Cb -0.18 -3.20 0.01 0.00 0.00 0.00 0.00 36.38 33.00 2k70 s VAL 117 CO 0.57 0.37 0.55 -1.61 0.00 0.00 0.00 175.10 174.99 2k70 s GLU 118 N 1.09 1.79 0.67 2.72 0.41 -0.66 -1.52 118.70 123.21 2k70 s GLU 118 Ca 0.05 -1.40 -0.07 0.00 -0.41 0.00 0.00 54.97 53.14 2k70 s GLU 118 Cb -0.14 0.50 0.04 0.00 -1.78 0.00 0.00 34.13 32.75 2k70 s GLU 118 CO 0.04 -0.77 0.99 0.00 -0.49 0.00 0.00 175.26 175.03 2k70 s ALA 119 N -3.43 3.16 0.00 5.21 0.00 -1.26 -0.82 121.76 124.61 2k70 s ALA 119 Ca 0.22 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.40 2k70 s ALA 119 Cb -0.02 -2.66 0.00 0.00 0.00 0.00 0.00 23.12 20.44 2k70 s ALA 119 CO 0.12 -1.14 0.00 -2.13 0.00 0.00 0.00 175.76 172.61