#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o5p s ALA 2 N 0.00 3.04 0.88 0.00 0.00 -1.26 -4.97 121.76 119.44 1o5p s ALA 2 Ca 0.00 -2.22 -0.11 0.00 0.00 0.00 0.00 51.96 49.63 1o5p s ALA 2 Cb 0.00 0.13 0.12 0.00 0.00 0.00 0.00 23.12 23.37 1o5p s ALA 2 CO 0.00 -0.07 1.16 -2.30 0.00 0.00 0.00 175.76 174.56 1o5p n PRO 3 N -0.89 -0.20 -1.93 0.00 -0.02 -0.43 -4.19 135.00 127.33 1o5p n PRO 3 Ca -0.05 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 1o5p n PRO 3 Cb 0.66 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 1o5p n PRO 3 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 1o5p n THR 4 N -3.87 0.00 -3.64 3.45 5.66 0.25 -4.86 114.28 111.27 1o5p n THR 4 Ca 0.13 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 61.08 1o5p n THR 4 Cb 0.51 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.23 1o5p n THR 4 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1o5p s ALA 5 N -1.00 -2.12 -0.33 1.79 0.00 -1.26 -1.04 121.76 117.80 1o5p s ALA 5 Ca 0.00 2.22 -0.04 0.00 0.00 0.00 0.00 51.96 54.14 1o5p s ALA 5 Cb 0.00 -1.59 0.05 0.00 0.00 0.00 0.00 23.12 21.58 1o5p s ALA 5 CO 0.00 -0.34 0.07 -0.08 0.00 0.00 0.00 175.76 175.41 1o5p s THR 6 N 1.26 3.34 -0.04 0.00 -1.32 -0.06 -4.84 115.64 113.98 1o5p s THR 6 Ca -0.08 -1.38 0.05 0.00 -1.21 0.00 0.00 61.69 59.07 1o5p s THR 6 Cb -0.04 -2.96 -0.03 0.00 -1.51 0.00 0.00 72.50 67.96 1o5p s THR 6 CO -0.15 -0.22 -0.17 -0.69 -2.21 0.00 0.00 174.62 171.19 1o5p s VAL 7 N 1.30 2.87 -0.25 5.08 1.01 -1.26 -0.34 120.40 128.81 1o5p s VAL 7 Ca -0.02 -0.82 -0.29 0.00 0.00 0.00 0.00 61.98 60.84 1o5p s VAL 7 Cb -0.20 -2.11 0.17 0.00 0.00 0.00 0.00 36.38 34.24 1o5p s VAL 7 CO 0.00 0.57 1.26 -0.89 0.00 0.00 0.00 175.10 176.04 1o5p s THR 8 N -0.73 0.00 0.51 3.92 2.01 0.05 -4.54 115.64 116.86 1o5p s THR 8 Ca 0.11 0.00 -0.18 0.00 0.31 0.00 0.00 61.69 61.93 1o5p s THR 8 Cb -0.10 -1.00 -0.08 0.00 0.01 0.00 0.00 72.50 71.33 1o5p s THR 8 CO 0.01 0.00 1.01 -2.16 -0.69 0.00 0.00 174.62 172.78 1o5p s PRO 9 N -1.02 3.82 0.05 4.92 0.05 -1.26 -0.67 135.00 140.89 1o5p s PRO 9 Ca 0.06 1.14 0.16 0.00 0.05 0.00 0.00 61.00 62.41 1o5p s PRO 9 Cb -0.01 -2.11 -0.15 0.00 0.05 0.00 0.00 34.50 32.28 1o5p s PRO 9 CO -0.05 -0.39 0.82 0.77 0.05 0.00 0.00 177.00 178.19 1o5p h SER 10 N 1.15 0.00 -4.58 6.66 0.02 -1.90 -3.44 113.55 111.46 1o5p h SER 10 Ca -0.48 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.19 1o5p h SER 10 Cb 1.20 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.59 1o5p h SER 10 CO 0.60 0.65 -0.66 -0.44 -1.14 0.00 0.00 176.83 175.84 1o5p s SER 11 N -5.86 1.15 -0.13 3.07 0.01 -1.26 0.56 113.70 111.24 1o5p s SER 11 Ca -0.03 -1.17 -0.01 0.00 1.31 0.00 0.00 55.95 56.05 1o5p s SER 11 Cb 0.09 0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.45 1o5p s SER 11 CO 0.81 -0.58 0.07 0.61 0.41 0.00 0.00 173.24 174.57 1o5p n GLY 12 N -0.22 0.67 0.13 3.44 0.00 -1.12 -4.91 105.19 103.18 1o5p n GLY 12 Ca -0.07 -0.66 -0.22 0.00 0.00 0.00 0.00 46.02 45.08 1o5p n GLY 12 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1o5p n LEU 13 N -0.70 2.52 -1.11 0.99 4.77 -1.26 -5.06 117.00 117.15 1o5p n LEU 13 Ca -0.01 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 1o5p n LEU 13 Cb 0.51 -1.02 0.00 0.00 -2.33 0.00 0.00 43.42 40.58 1o5p n LEU 13 CO 0.05 0.75 -0.33 -0.24 -1.33 0.00 0.00 177.39 176.28 1o5p n SER 14 N -3.67 -6.11 -4.47 -1.43 2.88 -1.26 -3.81 113.62 95.74 1o5p n SER 14 Ca -0.37 1.10 -0.47 0.00 -1.33 0.00 0.00 58.87 57.80 1o5p n SER 14 Cb 0.96 -3.17 -0.07 0.00 -0.75 0.00 0.00 64.21 61.18 1o5p n SER 14 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1o5p n ASP 15 N -1.63 1.93 0.00 -3.46 5.75 -1.26 -2.02 116.55 115.86 1o5p n ASP 15 Ca 0.00 0.21 0.00 0.00 -0.01 0.00 0.00 54.79 54.99 1o5p n ASP 15 Cb 0.17 -1.28 0.00 0.00 -1.03 0.00 0.00 41.12 38.98 1o5p n ASP 15 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1o5p n GLY 16 N 6.43 1.51 0.96 6.12 0.00 -1.26 -5.05 105.19 113.89 1o5p n GLY 16 Ca 0.44 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.40 1o5p n GLY 16 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1o5p n THR 17 N -0.45 0.00 -4.79 2.61 5.66 -0.86 -4.97 114.28 111.49 1o5p n THR 17 Ca 0.00 -0.51 -0.25 0.00 -3.05 0.00 0.00 64.05 60.23 1o5p n THR 17 Cb 0.00 -0.61 -0.16 0.00 -1.55 0.00 0.00 70.33 68.01 1o5p n THR 17 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1o5p s VAL 18 N -0.31 1.37 0.21 1.08 1.01 -1.26 -2.09 120.40 120.41 1o5p s VAL 18 Ca 0.11 -0.68 0.07 0.00 0.00 0.00 0.00 61.98 61.48 1o5p s VAL 18 Cb -0.01 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 1o5p s VAL 18 CO 0.07 0.40 0.07 0.68 0.00 0.00 0.00 175.10 176.32 1o5p s VAL 19 N 0.03 3.99 -0.31 2.92 -7.23 0.21 -4.75 120.40 115.26 1o5p s VAL 19 Ca -0.03 -1.43 -0.02 0.00 -1.81 0.00 0.00 61.98 58.68 1o5p s VAL 19 Cb -0.11 -3.07 0.05 0.00 0.56 0.00 0.00 36.38 33.81 1o5p s VAL 19 CO 0.02 -0.21 0.02 -0.75 -0.31 0.00 0.00 175.10 173.87 1o5p s LYS 20 N -3.30 2.42 -0.10 4.82 2.20 0.16 -0.64 119.74 125.30 1o5p s LYS 20 Ca 0.30 -1.29 -0.04 0.00 -0.36 0.00 0.00 55.97 54.58 1o5p s LYS 20 Cb -0.09 -3.24 -0.04 0.00 -1.51 0.00 0.00 37.83 32.96 1o5p s LYS 20 CO 0.21 -0.65 0.06 0.54 -0.36 0.00 0.00 175.35 175.15 1o5p s VAL 21 N 1.26 4.81 0.12 4.02 0.11 -0.87 -0.77 120.40 129.07 1o5p s VAL 21 Ca -0.04 -0.06 0.02 0.00 -2.93 0.00 0.00 61.98 58.98 1o5p s VAL 21 Cb -0.20 -3.05 -0.04 0.00 -1.53 0.00 0.00 36.38 31.55 1o5p s VAL 21 CO -0.01 0.61 -0.07 0.00 -3.33 0.00 0.00 175.10 172.31 1o5p s ALA 22 N -0.95 1.12 0.03 1.54 0.00 0.54 -1.52 121.76 122.52 1o5p s ALA 22 Ca 0.14 -1.40 0.04 0.00 0.00 0.00 0.00 51.96 50.74 1o5p s ALA 22 Cb -0.12 0.17 -0.02 0.00 0.00 0.00 0.00 23.12 23.15 1o5p s ALA 22 CO 0.03 -0.21 -0.12 0.20 0.00 0.00 0.00 175.76 175.66 1o5p s GLY 23 N -3.08 0.68 -0.12 0.00 0.00 0.29 -0.89 107.32 104.20 1o5p s GLY 23 Ca 0.14 -0.72 -0.05 0.00 0.00 0.00 0.00 44.72 44.09 1o5p s GLY 23 CO -0.03 -0.70 0.26 0.00 0.00 0.00 0.00 173.10 172.64 1o5p s ALA 24 N -0.77 -0.57 0.00 3.20 0.00 -0.20 0.13 121.76 123.54 1o5p s ALA 24 Ca 0.01 0.98 0.00 0.00 0.00 0.00 0.00 51.96 52.95 1o5p s ALA 24 Cb -0.07 -0.85 0.00 0.00 0.00 0.00 0.00 23.12 22.19 1o5p s ALA 24 CO 0.01 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 175.73 1o5p n GLY 25 N 4.85 1.02 3.96 0.00 0.00 -1.06 0.85 105.19 114.81 1o5p n GLY 25 Ca -0.15 -0.48 -0.25 0.00 0.00 0.00 0.00 46.02 45.14 1o5p n GLY 25 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1o5p s LEU 26 N 0.00 2.90 -0.89 0.99 1.43 -0.69 -1.32 118.68 121.11 1o5p s LEU 26 Ca 0.00 0.07 -0.25 0.00 -1.03 0.00 0.00 54.13 52.92 1o5p s LEU 26 Cb 0.00 -2.49 -0.21 0.00 0.03 0.00 0.00 46.19 43.51 1o5p s LEU 26 CO 0.00 -1.89 2.50 0.00 0.23 0.00 0.00 176.35 177.19 1o5p n GLN 27 N -3.01 0.24 -1.19 1.70 3.00 -1.26 -4.06 117.38 112.80 1o5p n GLN 27 Ca 0.12 -0.07 -0.19 0.00 -0.01 0.00 0.00 57.00 56.85 1o5p n GLN 27 Cb 0.60 -1.94 -0.10 0.00 0.00 0.00 0.00 30.24 28.80 1o5p n GLN 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1o5p n ALA 28 N 11.12 0.38 0.00 -1.58 0.00 -1.23 -1.30 120.51 127.89 1o5p n ALA 28 Ca 0.59 -2.07 0.00 0.00 0.00 0.00 0.00 53.44 51.96 1o5p n ALA 28 Cb 0.19 -2.86 0.00 0.00 0.00 0.00 0.00 19.45 16.78 1o5p n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o5p n GLY 29 N 5.46 0.49 2.95 0.00 0.00 0.89 -4.82 105.19 110.16 1o5p n GLY 29 Ca 0.34 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.23 1o5p n GLY 29 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1o5p s THR 30 N -0.60 -0.47 0.02 2.61 -1.32 -0.42 -4.89 115.64 110.58 1o5p s THR 30 Ca 0.00 0.08 -0.39 0.00 -1.21 0.00 0.00 61.69 60.16 1o5p s THR 30 Cb 0.00 -0.62 -0.19 0.00 -1.51 0.00 0.00 72.50 70.18 1o5p s THR 30 CO 0.00 -0.03 1.16 0.00 -2.21 0.00 0.00 174.62 173.54 1o5p n ALA 31 N 5.35 -2.83 -2.41 11.08 0.00 -1.26 -2.71 120.51 127.73 1o5p n ALA 31 Ca -0.06 0.57 -0.29 0.00 0.00 0.00 0.00 53.44 53.67 1o5p n ALA 31 Cb 0.50 -1.86 -0.13 0.00 0.00 0.00 0.00 19.45 17.97 1o5p n ALA 31 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1o5p s TYR 32 N 0.19 2.34 0.23 0.00 2.02 0.19 -4.55 117.35 117.77 1o5p s TYR 32 Ca 0.89 -0.36 0.05 0.00 -0.37 0.00 0.00 57.07 57.29 1o5p s TYR 32 Cb -1.18 -1.24 -0.03 0.00 -0.40 0.00 0.00 41.96 39.11 1o5p s TYR 32 CO 0.54 0.38 0.29 0.34 -1.57 0.00 0.00 175.55 175.53 1o5p s ASP 33 N -2.19 6.04 -0.12 2.29 2.15 0.71 -1.66 116.67 123.89 1o5p s ASP 33 Ca 0.16 -0.03 -0.04 0.00 0.43 0.00 0.00 52.55 53.07 1o5p s ASP 33 Cb -0.10 -1.70 0.06 0.00 -0.30 0.00 0.00 42.92 40.88 1o5p s ASP 33 CO 0.07 -0.04 0.18 0.54 -0.17 0.00 0.00 175.17 175.75 1o5p s VAL 34 N -2.00 -0.28 0.17 1.11 0.11 -0.83 -0.90 120.40 117.78 1o5p s VAL 34 Ca 0.34 0.21 -0.19 0.00 -2.93 0.00 0.00 61.98 59.41 1o5p s VAL 34 Cb -0.09 -0.41 0.07 0.00 -1.53 0.00 0.00 36.38 34.42 1o5p s VAL 34 CO 0.27 0.04 0.90 0.61 -3.33 0.00 0.00 175.10 173.60 1o5p n GLY 35 N 5.32 0.70 3.44 6.54 0.00 -0.93 -0.22 105.19 120.04 1o5p n GLY 35 Ca -0.05 -1.13 -0.43 0.00 0.00 0.00 0.00 46.02 44.41 1o5p n GLY 35 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1o5p s GLN 36 N -2.05 2.95 0.06 1.61 -2.07 -1.26 -2.59 119.66 116.32 1o5p s GLN 36 Ca 0.20 -1.10 0.05 0.00 -1.82 0.00 0.00 55.36 52.69 1o5p s GLN 36 Cb -0.03 -3.99 -0.03 0.00 -1.09 0.00 0.00 33.01 27.87 1o5p s GLN 36 CO 0.05 -0.81 -0.14 0.00 -1.32 0.00 0.00 175.29 173.07 1o5p s ALA 38 N -1.10 1.95 -0.35 0.00 0.00 -0.72 -1.70 121.76 119.84 1o5p s ALA 38 Ca -0.00 -0.99 -0.17 0.00 0.00 0.00 0.00 51.96 50.80 1o5p s ALA 38 Cb -0.09 -0.53 -0.01 0.00 0.00 0.00 0.00 23.12 22.49 1o5p s ALA 38 CO 0.02 0.45 0.44 -1.58 0.00 0.00 0.00 175.76 175.09 1o5p s TRP 39 N -0.42 3.19 -0.82 0.00 0.51 -1.26 -1.70 118.94 118.44 1o5p s TRP 39 Ca 0.05 0.05 0.16 0.00 -2.12 0.00 0.00 56.10 54.24 1o5p s TRP 39 Cb -0.10 -2.81 0.56 0.00 -0.81 0.00 0.00 33.47 30.31 1o5p s TRP 39 CO 0.00 -0.50 1.47 1.33 -0.51 0.00 0.00 176.95 178.74 1o5p n VAL 40 N 5.34 1.72 -1.42 4.03 0.24 -0.90 -4.76 118.33 122.59 1o5p n VAL 40 Ca -0.07 -1.32 0.00 0.00 -2.04 0.00 0.00 64.34 60.91 1o5p n VAL 40 Cb 0.49 0.13 0.00 0.00 -1.47 0.00 0.00 33.84 32.99 1o5p n VAL 40 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1o5p n ASP 41 N 0.53 0.00 -4.55 -1.34 8.00 -1.26 -4.95 116.55 112.97 1o5p n ASP 41 Ca 0.21 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.35 1o5p n ASP 41 Cb 0.76 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.83 1o5p n ASP 41 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1o5p s THR 42 N -2.43 3.40 0.00 -3.53 -1.32 -1.26 -2.78 115.64 107.71 1o5p s THR 42 Ca 0.00 0.06 0.00 0.00 -1.21 0.00 0.00 61.69 60.54 1o5p s THR 42 Cb 0.00 -4.01 0.00 0.00 -1.51 0.00 0.00 72.50 66.98 1o5p s THR 42 CO 0.00 -0.97 0.00 0.61 -2.21 0.00 0.00 174.62 172.05 1o5p n GLY 43 N 5.97 0.66 3.14 6.08 0.00 -1.26 -5.04 105.19 114.74 1o5p n GLY 43 Ca 0.24 -0.75 -0.35 0.00 0.00 0.00 0.00 46.02 45.17 1o5p n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1o5p s VAL 44 N -2.00 2.99 -0.33 1.61 1.01 -1.12 -4.97 120.40 117.59 1o5p s VAL 44 Ca 0.00 -1.67 0.01 0.00 0.00 0.00 0.00 61.98 60.31 1o5p s VAL 44 Cb 0.00 -2.86 0.08 0.00 0.00 0.00 0.00 36.38 33.60 1o5p s VAL 44 CO 0.00 -0.32 0.04 -0.22 0.00 0.00 0.00 175.10 174.60 1o5p s LEU 45 N 1.18 4.38 -0.42 3.92 2.96 -1.26 -2.12 118.68 127.32 1o5p s LEU 45 Ca 0.00 -1.74 -0.16 0.00 -0.22 0.00 0.00 54.13 52.01 1o5p s LEU 45 Cb -0.21 -1.68 0.03 0.00 0.50 0.00 0.00 46.19 44.83 1o5p s LEU 45 CO -0.03 -0.35 0.40 0.00 -1.32 0.00 0.00 176.35 175.05 1o5p s ALA 46 N 1.09 3.45 0.30 5.97 0.00 -0.69 -3.51 121.76 128.38 1o5p s ALA 46 Ca 0.02 -1.63 0.07 0.00 0.00 0.00 0.00 51.96 50.42 1o5p s ALA 46 Cb -0.20 -3.01 -0.03 0.00 0.00 0.00 0.00 23.12 19.88 1o5p s ALA 46 CO -0.05 -1.57 0.25 0.00 0.00 0.00 0.00 175.76 174.39 1o5p s ASN 48 N -3.93 5.23 0.00 0.00 2.47 -0.90 -0.59 114.94 117.22 1o5p s ASN 48 Ca 0.37 0.12 0.00 0.00 0.42 0.00 0.00 52.86 53.77 1o5p s ASN 48 Cb -0.07 -1.45 0.00 0.00 -1.45 0.00 0.00 41.25 38.28 1o5p s ASN 48 CO 0.26 0.36 0.72 -0.81 -3.72 0.00 0.00 177.10 173.91 1o5p n PRO 49 N 2.00 0.82 0.00 0.43 -0.04 -1.26 -3.28 135.00 133.67 1o5p n PRO 49 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 1o5p n PRO 49 Cb 0.53 -1.17 0.00 0.00 -0.04 0.00 0.00 33.50 32.83 1o5p n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1o5p n ALA 50 N 0.47 2.18 -1.47 0.55 0.00 -1.26 -4.60 120.51 116.38 1o5p n ALA 50 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.80 1o5p n ALA 50 Cb 0.36 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.82 1o5p n ALA 50 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1o5p n ASP 51 N -0.16 0.17 -4.56 0.00 5.75 -1.20 -2.48 116.55 114.06 1o5p n ASP 51 Ca 0.00 -1.62 -0.41 0.00 -0.01 0.00 0.00 54.79 52.75 1o5p n ASP 51 Cb 0.11 -0.12 -0.03 0.00 -1.03 0.00 0.00 41.12 40.05 1o5p n ASP 51 CO 0.00 0.00 0.00 -0.36 -0.11 0.00 0.00 177.20 176.73 1o5p s PHE 52 N -0.15 2.49 0.00 2.11 0.08 -1.25 -3.14 117.98 118.12 1o5p s PHE 52 Ca 0.01 -0.71 0.00 0.00 0.12 0.00 0.00 56.93 56.35 1o5p s PHE 52 Cb 0.01 -4.68 0.00 0.00 -0.57 0.00 0.00 43.02 37.78 1o5p s PHE 52 CO 0.00 -1.96 0.00 0.43 -0.10 0.00 0.00 175.22 173.59 1o5p n SER 53 N 8.95 1.26 0.00 1.36 7.64 0.70 -4.93 113.62 128.59 1o5p n SER 53 Ca 0.28 -0.85 0.00 0.00 1.01 0.00 0.00 58.87 59.31 1o5p n SER 53 Cb 0.51 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.71 1o5p n SER 53 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1o5p n SER 54 N -1.48 0.00 -3.78 6.43 2.88 -1.26 -1.96 113.62 114.44 1o5p n SER 54 Ca 0.00 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.44 1o5p n SER 54 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.39 1o5p n SER 54 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1o5p s VAL 55 N -0.52 0.11 0.05 2.46 0.11 -0.66 -4.94 120.40 117.00 1o5p s VAL 55 Ca 0.00 -0.87 -0.05 0.00 -2.93 0.00 0.00 61.98 58.13 1o5p s VAL 55 Cb 0.00 -1.11 -0.05 0.00 -1.53 0.00 0.00 36.38 33.69 1o5p s VAL 55 CO 0.00 -0.48 0.29 -0.89 -3.33 0.00 0.00 175.10 170.69 1o5p s THR 56 N -3.22 5.27 -0.36 5.04 2.01 -1.26 0.52 115.64 123.64 1o5p s THR 56 Ca -0.00 0.07 -0.28 0.00 0.31 0.00 0.00 61.69 61.79 1o5p s THR 56 Cb 0.02 -3.59 -0.02 0.00 0.01 0.00 0.00 72.50 68.91 1o5p s THR 56 CO -0.08 0.26 1.86 0.00 -0.69 0.00 0.00 174.62 175.97 1o5p s ALA 57 N -1.41 2.73 0.00 7.40 0.00 -1.10 -4.70 121.76 124.67 1o5p s ALA 57 Ca 0.32 0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.47 1o5p s ALA 57 Cb -0.13 -4.07 0.00 0.00 0.00 0.00 0.00 23.12 18.92 1o5p s ALA 57 CO 0.20 -2.86 0.00 -3.47 0.00 0.00 0.00 175.76 169.63 1o5p n ASP 58 N 10.91 0.00 -0.12 0.00 2.03 -1.26 0.30 116.55 128.41 1o5p n ASP 58 Ca 0.24 0.00 -0.06 0.00 0.52 0.00 0.00 54.79 55.49 1o5p n ASP 58 Cb 0.48 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.88 1o5p n ASP 58 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1o5p h ALA 59 N -2.00 0.08 0.00 -1.67 0.00 -1.93 -3.09 119.26 110.65 1o5p h ALA 59 Ca 0.00 0.14 -0.30 0.00 0.00 0.00 0.00 54.91 54.75 1o5p h ALA 59 Cb 0.00 0.50 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 1o5p h ALA 59 CO 0.00 -0.57 -2.12 0.09 0.00 0.00 0.00 179.25 176.64 1o5p n ASN 60 N -5.38 1.34 0.00 0.00 3.02 -1.26 -4.56 115.26 108.41 1o5p n ASN 60 Ca 0.02 -0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1o5p n ASN 60 Cb 0.29 0.61 0.00 0.00 -0.61 0.00 0.00 39.78 40.07 1o5p n ASN 60 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1o5p n GLY 61 N 2.12 0.73 3.72 7.41 0.00 -1.17 -1.70 105.19 116.31 1o5p n GLY 61 Ca -0.29 -0.77 -0.35 0.00 0.00 0.00 0.00 46.02 44.61 1o5p n GLY 61 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1o5p s SER 62 N -1.29 6.22 -0.20 1.61 0.01 -1.26 -2.49 113.70 116.31 1o5p s SER 62 Ca 0.00 0.24 -0.04 0.00 1.31 0.00 0.00 55.95 57.46 1o5p s SER 62 Cb 0.00 -2.10 0.07 0.00 0.21 0.00 0.00 66.02 64.19 1o5p s SER 62 CO 0.00 0.15 0.07 0.00 0.41 0.00 0.00 173.24 173.88 1o5p s ALA 63 N 0.47 0.69 -0.17 1.44 0.00 0.12 -4.61 121.76 119.70 1o5p s ALA 63 Ca 0.09 -0.57 0.01 0.00 0.00 0.00 0.00 51.96 51.48 1o5p s ALA 63 Cb -0.12 -1.14 0.02 0.00 0.00 0.00 0.00 23.12 21.88 1o5p s ALA 63 CO -0.01 -1.24 -0.17 -1.54 0.00 0.00 0.00 175.76 172.81 1o5p s SER 64 N 2.01 2.99 -0.05 0.00 1.04 -1.26 0.11 113.70 118.54 1o5p s SER 64 Ca 0.02 -0.61 -0.07 0.00 0.48 0.00 0.00 55.95 55.77 1o5p s SER 64 Cb -0.16 -1.34 0.01 0.00 0.10 0.00 0.00 66.02 64.63 1o5p s SER 64 CO -0.12 -0.04 0.18 0.28 0.98 0.00 0.00 173.24 174.52 1o5p s THR 65 N 1.38 0.03 -0.11 2.02 -1.32 -0.58 -4.99 115.64 112.07 1o5p s THR 65 Ca 0.04 -0.23 -0.07 0.00 -1.21 0.00 0.00 61.69 60.22 1o5p s THR 65 Cb -0.13 -0.33 -0.04 0.00 -1.51 0.00 0.00 72.50 70.49 1o5p s THR 65 CO -0.12 -0.13 0.14 -0.94 -2.21 0.00 0.00 174.62 171.37 1o5p s SER 66 N -0.42 6.39 0.19 8.08 1.04 -1.26 -2.04 113.70 125.68 1o5p s SER 66 Ca -0.05 0.46 -0.01 0.00 0.48 0.00 0.00 55.95 56.83 1o5p s SER 66 Cb -0.03 -2.06 -0.04 0.00 0.10 0.00 0.00 66.02 63.98 1o5p s SER 66 CO 0.01 0.39 0.11 -1.48 0.98 0.00 0.00 173.24 173.25 1o5p s LEU 67 N -1.12 1.36 -0.22 2.42 0.05 0.19 -4.93 118.68 116.43 1o5p s LEU 67 Ca 0.16 -1.34 -0.14 0.00 0.05 0.00 0.00 54.13 52.86 1o5p s LEU 67 Cb -0.12 0.32 -0.04 0.00 -2.05 0.00 0.00 46.19 44.29 1o5p s LEU 67 CO 0.06 -0.80 0.30 0.42 -0.55 0.00 0.00 176.35 175.77 1o5p s THR 68 N -4.09 5.27 0.01 5.48 -4.23 -1.03 0.63 115.64 117.68 1o5p s THR 68 Ca 0.35 0.48 0.01 0.00 -1.18 0.00 0.00 61.69 61.35 1o5p s THR 68 Cb 0.07 -3.63 -0.01 0.00 1.34 0.00 0.00 72.50 70.27 1o5p s THR 68 CO 0.10 0.29 -0.05 0.68 -0.54 0.00 0.00 174.62 175.09 1o5p s VAL 69 N 1.25 0.35 0.20 2.29 -7.23 -0.89 -4.08 120.40 112.28 1o5p s VAL 69 Ca 0.14 -0.47 -0.01 0.00 -1.81 0.00 0.00 61.98 59.83 1o5p s VAL 69 Cb -0.14 -0.35 0.01 0.00 0.56 0.00 0.00 36.38 36.45 1o5p s VAL 69 CO 0.07 -0.09 0.27 -2.11 -0.31 0.00 0.00 175.10 172.93 1o5p n ARG 70 N 2.46 0.40 0.00 4.82 1.85 -1.26 -4.24 116.66 120.69 1o5p n ARG 70 Ca -0.16 -1.55 0.00 0.00 -1.00 0.00 0.00 57.85 55.13 1o5p n ARG 70 Cb 0.57 1.50 0.00 0.00 -1.05 0.00 0.00 32.46 33.48 1o5p n ARG 70 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 1o5p n ARG 71 N -0.32 0.00 -1.71 2.89 1.85 -1.26 -4.55 116.66 113.56 1o5p n ARG 71 Ca 0.00 0.00 -0.41 0.00 -1.00 0.00 0.00 57.85 56.44 1o5p n ARG 71 Cb 0.33 0.00 0.01 0.00 -1.05 0.00 0.00 32.46 31.75 1o5p n ARG 71 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1o5p n SER 72 N 0.00 2.68 -3.64 2.89 7.64 -1.26 -1.92 113.62 120.01 1o5p n SER 72 Ca 0.00 1.13 -0.08 0.00 1.01 0.00 0.00 58.87 60.93 1o5p n SER 72 Cb 0.00 -1.51 -0.07 0.00 -1.01 0.00 0.00 64.21 61.62 1o5p n SER 72 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1o5p s PHE 73 N -1.18 -0.76 -0.25 1.43 -0.71 -0.62 -4.81 117.98 111.08 1o5p s PHE 73 Ca 0.60 1.64 -0.31 0.00 -1.04 0.00 0.00 56.93 57.82 1o5p s PHE 73 Cb -0.51 0.42 -0.14 0.00 -1.21 0.00 0.00 43.02 41.58 1o5p s PHE 73 CO 0.59 -0.37 1.00 0.39 -1.34 0.00 0.00 175.22 175.49 1o5p n GLU 74 N 3.32 0.00 -1.51 1.99 -0.58 -1.26 -1.83 120.64 120.76 1o5p n GLU 74 Ca -0.17 0.00 -0.28 0.00 -0.42 0.00 0.00 57.16 56.29 1o5p n GLU 74 Cb 0.57 -1.04 -0.03 0.00 -0.57 0.00 0.00 31.44 30.37 1o5p n GLU 74 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1o5p n GLY 75 N 2.28 4.54 3.23 0.62 0.00 -0.44 -2.56 105.19 112.85 1o5p n GLY 75 Ca 0.19 -1.94 -0.59 0.00 0.00 0.00 0.00 46.02 43.69 1o5p n GLY 75 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1o5p n PHE 76 N 0.59 1.35 -3.02 1.61 3.72 0.25 -2.27 117.46 119.68 1o5p n PHE 76 Ca 0.49 0.89 -0.40 0.00 -0.05 0.00 0.00 57.45 58.37 1o5p n PHE 76 Cb 0.51 -2.09 -0.05 0.00 -0.94 0.00 0.00 39.48 36.91 1o5p n PHE 76 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1o5p s LEU 77 N 4.16 4.23 -0.24 4.37 2.96 -0.62 -1.97 118.68 131.56 1o5p s LEU 77 Ca 1.04 1.08 -0.02 0.00 -0.22 0.00 0.00 54.13 56.02 1o5p s LEU 77 Cb -1.39 -3.07 -0.02 0.00 0.50 0.00 0.00 46.19 42.22 1o5p s LEU 77 CO 0.68 -0.24 1.30 0.33 -1.32 0.00 0.00 176.35 177.10 1o5p n PHE 78 N 4.53 0.36 -1.90 5.38 7.35 -1.23 -2.87 117.46 129.09 1o5p n PHE 78 Ca 0.00 -0.85 -0.00 0.00 -0.76 0.00 0.00 57.45 55.84 1o5p n PHE 78 Cb 0.50 -0.88 -0.00 0.00 0.35 0.00 0.00 39.48 39.45 1o5p n PHE 78 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 1o5p n ASP 79 N 4.48 -0.02 0.00 -2.13 2.03 -1.26 -4.98 116.55 114.67 1o5p n ASP 79 Ca 0.13 -0.91 0.00 0.00 0.52 0.00 0.00 54.79 54.52 1o5p n ASP 79 Cb 0.06 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.46 1o5p n ASP 79 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1o5p n GLY 80 N 0.00 2.75 3.94 0.27 0.00 -1.14 -4.99 105.19 106.02 1o5p n GLY 80 Ca -0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 1o5p n GLY 80 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1o5p s THR 81 N -1.01 5.01 -0.11 2.61 -4.23 -1.26 -4.96 115.64 111.71 1o5p s THR 81 Ca 0.00 -0.36 -0.02 0.00 -1.18 0.00 0.00 61.69 60.13 1o5p s THR 81 Cb 0.00 -3.84 -0.03 0.00 1.34 0.00 0.00 72.50 69.96 1o5p s THR 81 CO 0.00 -0.60 -0.01 0.00 -0.54 0.00 0.00 174.62 173.47 1o5p s ARG 82 N -4.40 3.20 0.35 3.99 1.70 -1.26 -1.59 118.95 120.94 1o5p s ARG 82 Ca 0.42 -0.45 0.23 0.00 -0.47 0.00 0.00 55.73 55.46 1o5p s ARG 82 Cb -0.10 -2.83 0.32 0.00 -0.57 0.00 0.00 34.95 31.78 1o5p s ARG 82 CO 0.38 0.55 1.50 2.35 -1.08 0.00 0.00 175.30 178.99 1o5p h TRP 83 N 5.67 0.00 0.00 5.89 7.01 -1.78 -3.45 115.95 129.29 1o5p h TRP 83 Ca -0.45 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.55 1o5p h TRP 83 Cb 1.19 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.25 1o5p h TRP 83 CO 0.59 0.00 0.00 0.41 -2.79 0.00 0.00 178.44 176.65 1o5p n GLY 84 N 1.15 1.39 3.59 2.65 0.00 -1.26 -4.91 105.19 107.80 1o5p n GLY 84 Ca 0.03 -2.19 -0.41 0.00 0.00 0.00 0.00 46.02 43.45 1o5p n GLY 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1o5p s THR 85 N -1.46 3.26 -0.56 2.61 -4.23 -1.26 -1.33 115.64 112.67 1o5p s THR 85 Ca 0.00 0.24 -0.28 0.00 -1.18 0.00 0.00 61.69 60.47 1o5p s THR 85 Cb 0.00 -3.41 0.03 0.00 1.34 0.00 0.00 72.50 70.46 1o5p s THR 85 CO 0.00 -0.31 1.21 -0.69 -0.54 0.00 0.00 174.62 174.29 1o5p s VAL 86 N 8.38 4.02 -0.28 2.29 1.01 -0.76 -4.72 120.40 130.34 1o5p s VAL 86 Ca 0.87 0.94 -0.29 0.00 0.00 0.00 0.00 61.98 63.50 1o5p s VAL 86 Cb -0.23 -4.68 -0.02 0.00 0.00 0.00 0.00 36.38 31.44 1o5p s VAL 86 CO 0.31 -1.27 1.78 -1.81 0.00 0.00 0.00 175.10 174.11 1o5p s ASP 87 N 3.02 6.03 0.00 3.32 1.01 -1.26 -1.59 116.67 127.19 1o5p s ASP 87 Ca 0.45 1.48 0.05 0.00 0.71 0.00 0.00 52.55 55.24 1o5p s ASP 87 Cb -0.08 -2.53 0.24 0.00 1.01 0.00 0.00 42.92 41.57 1o5p s ASP 87 CO 0.27 -1.57 0.99 0.00 0.21 0.00 0.00 175.17 175.06 1o5p n THR 89 N -1.28 0.00 -0.04 0.00 -2.24 -1.26 -4.11 114.28 105.34 1o5p n THR 89 Ca 0.02 -0.15 -0.09 0.00 -2.27 0.00 0.00 64.05 61.55 1o5p n THR 89 Cb 0.04 0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.35 1o5p n THR 89 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1o5p n THR 90 N -0.28 0.48 -3.63 4.28 -2.24 -0.01 -5.06 114.28 107.82 1o5p n THR 90 Ca 0.21 -0.13 -0.25 0.00 -2.27 0.00 0.00 64.05 61.62 1o5p n THR 90 Cb 0.26 -1.60 0.02 0.00 -2.10 0.00 0.00 70.33 66.91 1o5p n THR 90 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1o5p s ALA 91 N -2.16 4.58 -0.31 6.98 0.00 -1.18 -5.09 121.76 124.57 1o5p s ALA 91 Ca -0.12 -1.49 -0.10 0.00 0.00 0.00 0.00 51.96 50.24 1o5p s ALA 91 Cb 0.05 -0.95 -0.01 0.00 0.00 0.00 0.00 23.12 22.20 1o5p s ALA 91 CO 0.16 -0.62 0.17 0.00 0.00 0.00 0.00 175.76 175.47 1o5p s ALA 92 N -2.77 3.35 -0.25 0.00 0.00 -1.26 -4.70 121.76 116.12 1o5p s ALA 92 Ca 0.42 -1.35 -0.14 0.00 0.00 0.00 0.00 51.96 50.89 1o5p s ALA 92 Cb -0.03 -2.45 -0.04 0.00 0.00 0.00 0.00 23.12 20.60 1o5p s ALA 92 CO 0.27 -0.87 0.31 0.00 0.00 0.00 0.00 175.76 175.47 1o5p s GLN 94 N 1.71 3.29 -0.39 0.00 -0.21 -0.69 -2.51 119.66 120.87 1o5p s GLN 94 Ca 0.13 -0.40 -0.12 0.00 0.02 0.00 0.00 55.36 54.98 1o5p s GLN 94 Cb -0.15 -3.00 0.03 0.00 1.00 0.00 0.00 33.01 30.89 1o5p s GLN 94 CO 0.09 0.65 0.24 0.08 -2.12 0.00 0.00 175.29 174.23 1o5p s VAL 95 N -1.31 4.80 0.11 1.09 1.01 0.11 -2.22 120.40 124.00 1o5p s VAL 95 Ca 0.27 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.45 1o5p s VAL 95 Cb -0.12 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.57 1o5p s VAL 95 CO 0.18 -0.27 0.14 0.61 0.00 0.00 0.00 175.10 175.77 1o5p n GLY 96 N 5.05 3.01 3.11 4.51 0.00 -1.07 0.25 105.19 120.05 1o5p n GLY 96 Ca -0.11 -1.51 -0.25 0.00 0.00 0.00 0.00 46.02 44.14 1o5p n GLY 96 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1o5p n LEU 97 N 0.00 0.00 -3.63 0.99 4.32 -1.24 -2.18 117.00 115.25 1o5p n LEU 97 Ca 0.01 -2.57 -0.02 0.00 -0.02 0.00 0.00 56.01 53.40 1o5p n LEU 97 Cb 0.18 0.17 -0.01 0.00 -1.62 0.00 0.00 43.42 42.14 1o5p n LEU 97 CO 0.09 -0.44 0.92 -0.94 -1.22 0.00 0.00 177.39 175.80 1o5p s SER 98 N -3.49 -0.14 -0.01 -1.43 1.04 -0.08 -4.36 113.70 105.24 1o5p s SER 98 Ca 0.10 -0.15 0.21 0.00 0.48 0.00 0.00 55.95 56.60 1o5p s SER 98 Cb -0.01 0.26 -0.24 0.00 0.10 0.00 0.00 66.02 66.14 1o5p s SER 98 CO 0.07 -0.47 0.79 0.47 0.98 0.00 0.00 173.24 175.07 1o5p n ASP 99 N -0.36 0.66 -1.00 7.02 8.00 -1.23 0.26 116.55 129.89 1o5p n ASP 99 Ca -0.06 -0.63 -0.05 0.00 0.71 0.00 0.00 54.79 54.76 1o5p n ASP 99 Cb 0.61 1.29 0.01 0.00 -0.02 0.00 0.00 41.12 43.01 1o5p n ASP 99 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1o5p n ALA 100 N -1.76 -0.25 0.00 2.24 0.00 -1.26 -4.74 120.51 114.74 1o5p n ALA 100 Ca 0.01 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1o5p n ALA 100 Cb 0.41 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1o5p n ALA 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o5p n ALA 101 N -2.50 1.48 0.00 0.00 0.00 -1.26 -5.03 120.51 113.19 1o5p n ALA 101 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1o5p n ALA 101 Cb 0.52 0.07 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1o5p n ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o5p n GLY 102 N 1.31 0.01 3.21 0.00 0.00 -1.26 -5.15 105.19 103.30 1o5p n GLY 102 Ca 0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 46.02 45.93 1o5p n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1o5p n ASN 103 N -1.00 -1.94 -0.62 1.61 5.03 -1.26 -5.06 115.26 112.02 1o5p n ASN 103 Ca 0.00 -2.38 0.00 0.00 0.87 0.00 0.00 54.58 53.07 1o5p n ASN 103 Cb 0.00 3.24 0.00 0.00 -1.02 0.00 0.00 39.78 42.00 1o5p n ASN 103 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1o5p n GLY 104 N -0.46 0.82 2.19 7.41 0.00 -1.26 -3.47 105.19 110.42 1o5p n GLY 104 Ca -0.07 -0.75 -0.10 0.00 0.00 0.00 0.00 46.02 45.09 1o5p n GLY 104 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1o5p n PRO 105 N 0.00 -0.82 -2.11 1.61 -0.02 -1.26 -4.95 135.00 127.46 1o5p n PRO 105 Ca 0.00 -0.50 -0.16 0.00 -2.02 0.00 0.00 63.50 60.83 1o5p n PRO 105 Cb 0.00 -1.05 0.07 0.00 -0.02 0.00 0.00 33.50 32.51 1o5p n PRO 105 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1o5p n GLU 106 N -1.01 0.27 -4.48 -0.52 0.28 -1.26 -4.70 120.64 109.23 1o5p n GLU 106 Ca 0.05 -2.00 -0.24 0.00 -0.16 0.00 0.00 57.16 54.80 1o5p n GLU 106 Cb 0.20 -0.39 -0.10 0.00 1.43 0.00 0.00 31.44 32.59 1o5p n GLU 106 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1o5p s GLY 107 N -4.18 1.94 -0.22 -1.84 0.00 -1.26 -3.73 107.32 98.02 1o5p s GLY 107 Ca 0.46 -1.92 -0.10 0.00 0.00 0.00 0.00 44.72 43.16 1o5p s GLY 107 CO 0.30 -1.97 0.14 0.14 0.00 0.00 0.00 173.10 171.70 1o5p s VAL 108 N -2.57 5.23 -0.13 1.40 1.01 0.14 -4.74 120.40 120.74 1o5p s VAL 108 Ca 0.30 0.13 -0.29 0.00 0.00 0.00 0.00 61.98 62.12 1o5p s VAL 108 Cb -0.03 -3.42 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 1o5p s VAL 108 CO 0.15 0.38 1.42 0.00 0.00 0.00 0.00 175.10 177.04 1o5p s ALA 109 N 0.86 3.63 0.43 5.51 0.00 -1.26 0.09 121.76 131.02 1o5p s ALA 109 Ca 0.07 0.62 0.06 0.00 0.00 0.00 0.00 51.96 52.71 1o5p s ALA 109 Cb -0.13 -3.68 0.01 0.00 0.00 0.00 0.00 23.12 19.32 1o5p s ALA 109 CO 0.03 -1.29 0.60 0.96 0.00 0.00 0.00 175.76 176.06 1o5p s ILE 110 N 3.76 3.24 0.04 0.00 -4.36 -1.04 -4.83 121.20 118.00 1o5p s ILE 110 Ca 0.62 -0.88 0.01 0.00 -0.26 0.00 0.00 60.65 60.14 1o5p s ILE 110 Cb -0.26 -3.13 -0.02 0.00 1.25 0.00 0.00 42.46 40.30 1o5p s ILE 110 CO 0.21 -0.06 -0.05 -0.44 0.24 0.00 0.00 174.94 174.83 1o5p s SER 111 N -4.32 0.55 -0.28 4.36 0.01 0.19 -4.69 113.70 109.52 1o5p s SER 111 Ca 0.53 -0.59 0.01 0.00 1.31 0.00 0.00 55.95 57.21 1o5p s SER 111 Cb -0.10 0.08 0.08 0.00 0.21 0.00 0.00 66.02 66.29 1o5p s SER 111 CO 0.34 -0.29 0.02 -0.36 0.41 0.00 0.00 173.24 173.35 1o5p s PHE 112 N -1.73 2.48 -2.00 2.43 0.08 -1.26 -2.78 117.98 115.20 1o5p s PHE 112 Ca -0.10 -2.01 0.07 0.00 0.12 0.00 0.00 56.93 55.01 1o5p s PHE 112 Cb -0.08 -1.92 0.44 0.00 -0.57 0.00 0.00 43.02 40.90 1o5p s PHE 112 CO -0.01 -0.84 0.90 0.27 -0.10 0.00 0.00 175.22 175.44