#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 3.11 0.81 0.00 0.00 -1.26 -5.03 121.76 119.39 1o5p s ALA 2 Ca 0.00 -1.31 -0.13 0.00 0.00 0.00 0.00 51.96 50.52 1o5p s ALA 2 Cb 0.00 -0.96 0.09 0.00 0.00 0.00 0.00 23.12 22.25 1o5p s ALA 2 CO 0.00 0.56 1.18 -1.25 0.00 0.00 0.00 175.76 176.25 1o5p s PRO 3 N -2.63 1.63 0.14 0.00 0.04 -0.31 -4.51 135.00 129.36 1o5p s PRO 3 Ca 0.25 1.67 -0.17 0.00 0.04 0.00 0.00 61.00 62.79 1o5p s PRO 3 Cb -0.10 -1.78 0.04 0.00 0.04 0.00 0.00 34.50 32.70 1o5p s PRO 3 CO 0.17 -2.20 0.46 0.95 0.04 0.00 0.00 177.00 176.41 1o5p s THR 4 N -2.28 0.05 -0.11 1.26 -4.23 1.11 -4.88 115.64 106.55 1o5p s THR 4 Ca 0.71 -0.53 -0.05 0.00 -1.18 0.00 0.00 61.69 60.64 1o5p s THR 4 Cb -0.27 -1.23 0.05 0.00 1.34 0.00 0.00 72.50 72.40 1o5p s THR 4 CO 0.51 -0.23 0.26 0.00 -0.54 0.00 0.00 174.62 174.63 1o5p s ALA 5 N -3.81 -0.58 -0.44 3.99 0.00 -1.26 0.23 121.76 119.90 1o5p s ALA 5 Ca 0.04 1.01 -0.11 0.00 0.00 0.00 0.00 51.96 52.90 1o5p s ALA 5 Cb 0.01 -0.72 0.08 0.00 0.00 0.00 0.00 23.12 22.48 1o5p s ALA 5 CO -0.10 -0.29 0.30 0.95 0.00 0.00 0.00 175.76 176.62 1o5p s THR 6 N 1.50 4.53 -0.18 0.00 -4.23 -0.17 -4.79 115.64 112.30 1o5p s THR 6 Ca -0.07 -1.31 0.01 0.00 -1.18 0.00 0.00 61.69 59.14 1o5p s THR 6 Cb -0.11 -3.75 0.02 0.00 1.34 0.00 0.00 72.50 70.00 1o5p s THR 6 CO -0.09 -0.53 -0.19 -0.69 -0.54 0.00 0.00 174.62 172.58 1o5p s VAL 7 N 1.49 2.15 -0.10 2.29 1.01 -1.24 0.12 120.40 126.11 1o5p s VAL 7 Ca 0.03 -0.91 -0.30 0.00 0.00 0.00 0.00 61.98 60.80 1o5p s VAL 7 Cb -0.23 -1.90 0.10 0.00 0.00 0.00 0.00 36.38 34.34 1o5p s VAL 7 CO 0.03 0.53 0.85 -0.89 0.00 0.00 0.00 175.10 175.62 1o5p s THR 8 N 1.30 0.00 0.58 3.92 2.01 -0.61 -4.40 115.64 118.44 1o5p s THR 8 Ca 0.05 0.00 -0.16 0.00 0.31 0.00 0.00 61.69 61.89 1o5p s THR 8 Cb -0.13 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.34 1o5p s THR 8 CO -0.12 0.00 1.06 -2.16 -0.69 0.00 0.00 174.62 172.70 1o5p s PRO 9 N -1.21 3.38 0.03 4.92 0.05 -1.26 -0.94 135.00 139.97 1o5p s PRO 9 Ca -0.06 1.23 0.19 0.00 0.05 0.00 0.00 61.00 62.42 1o5p s PRO 9 Cb -0.00 -2.04 -0.17 0.00 0.05 0.00 0.00 34.50 32.34 1o5p s PRO 9 CO 0.05 -0.76 0.69 0.43 0.05 0.00 0.00 177.00 177.45 1o5p n SER 10 N -1.88 0.55 -4.22 6.66 7.64 -1.26 -4.79 113.62 116.33 1o5p n SER 10 Ca 0.09 0.23 -0.12 0.00 1.01 0.00 0.00 58.87 60.08 1o5p n SER 10 Cb 0.53 0.73 -0.10 0.00 -1.01 0.00 0.00 64.21 64.36 1o5p n SER 10 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1o5p s SER 11 N -5.38 0.78 -0.35 6.43 0.01 -1.26 0.57 113.70 114.50 1o5p s SER 11 Ca -0.05 -1.24 -0.02 0.00 1.31 0.00 0.00 55.95 55.96 1o5p s SER 11 Cb 0.10 0.21 0.00 0.00 0.21 0.00 0.00 66.02 66.54 1o5p s SER 11 CO 0.83 -0.68 0.23 0.61 0.41 0.00 0.00 173.24 174.65 1o5p n GLY 12 N -0.23 0.51 0.12 3.44 0.00 -1.14 -4.90 105.19 102.99 1o5p n GLY 12 Ca -0.04 -0.49 -0.22 0.00 0.00 0.00 0.00 46.02 45.26 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 -1.43 2.26 -1.23 0.99 4.77 -1.26 -5.06 117.00 116.04 1o5p n LEU 13 Ca -0.01 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 1o5p n LEU 13 Cb 0.52 -1.02 0.00 0.00 -2.33 0.00 0.00 43.42 40.59 1o5p n LEU 13 CO 0.14 0.58 -0.37 -0.24 -1.33 0.00 0.00 177.39 176.18 1o5p n SER 14 N -3.95 -6.71 -4.45 -1.43 2.88 -1.26 -3.82 113.62 94.88 1o5p n SER 14 Ca -0.35 1.27 -0.50 0.00 -1.33 0.00 0.00 58.87 57.96 1o5p n SER 14 Cb 0.87 -3.65 -0.07 0.00 -0.75 0.00 0.00 64.21 60.61 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 -1.80 2.20 0.00 -3.46 5.75 -1.26 -2.03 116.55 115.94 1o5p n ASP 15 Ca 0.00 0.41 0.00 0.00 -0.01 0.00 0.00 54.79 55.19 1o5p n ASP 15 Cb 0.23 -1.28 0.00 0.00 -1.03 0.00 0.00 41.12 39.04 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 6.49 1.40 1.35 6.12 0.00 -1.26 -5.06 105.19 114.23 1o5p n GLY 16 Ca 0.40 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.35 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 -0.85 0.00 -4.41 2.61 5.66 -0.86 -4.96 114.28 111.46 1o5p n THR 17 Ca 0.00 -0.70 -0.20 0.00 -3.05 0.00 0.00 64.05 60.10 1o5p n THR 17 Cb 0.00 -0.70 -0.15 0.00 -1.55 0.00 0.00 70.33 67.93 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 -0.44 0.80 0.18 1.08 1.01 -1.26 -1.95 120.40 119.82 1o5p s VAL 18 Ca 0.18 -0.40 0.09 0.00 0.00 0.00 0.00 61.98 61.86 1o5p s VAL 18 Cb -0.01 -0.69 -0.04 0.00 0.00 0.00 0.00 36.38 35.63 1o5p s VAL 18 CO 0.12 0.24 -0.10 0.68 0.00 0.00 0.00 175.10 176.04 1o5p s VAL 19 N -0.01 3.17 -0.35 2.92 -7.23 0.18 -4.71 120.40 114.37 1o5p s VAL 19 Ca 0.00 -1.67 -0.07 0.00 -1.81 0.00 0.00 61.98 58.43 1o5p s VAL 19 Cb -0.06 -2.57 0.05 0.00 0.56 0.00 0.00 36.38 34.35 1o5p s VAL 19 CO 0.00 -0.11 0.13 -0.75 -0.31 0.00 0.00 175.10 174.06 1o5p s LYS 20 N -2.83 2.59 -0.22 4.82 2.20 -0.11 -0.81 119.74 125.38 1o5p s LYS 20 Ca 0.25 -1.24 -0.06 0.00 -0.36 0.00 0.00 55.97 54.56 1o5p s LYS 20 Cb -0.09 -3.51 -0.03 0.00 -1.51 0.00 0.00 37.83 32.70 1o5p s LYS 20 CO 0.15 -0.72 0.03 0.54 -0.36 0.00 0.00 175.35 175.00 1o5p s VAL 21 N 1.39 4.15 0.35 4.02 0.11 -0.88 -1.58 120.40 127.97 1o5p s VAL 21 Ca -0.01 -0.24 0.08 0.00 -2.93 0.00 0.00 61.98 58.89 1o5p s VAL 21 Cb -0.20 -2.90 -0.05 0.00 -1.53 0.00 0.00 36.38 31.69 1o5p s VAL 21 CO 0.02 0.39 0.08 0.00 -3.33 0.00 0.00 175.10 172.27 1o5p s ALA 22 N 1.23 3.36 -0.21 1.54 0.00 0.33 -2.25 121.76 125.75 1o5p s ALA 22 Ca 0.04 -1.96 -0.04 0.00 0.00 0.00 0.00 51.96 50.00 1o5p s ALA 22 Cb -0.15 -0.46 0.09 0.00 0.00 0.00 0.00 23.12 22.60 1o5p s ALA 22 CO 0.02 0.01 0.18 0.20 0.00 0.00 0.00 175.76 176.17 1o5p s GLY 23 N -3.79 0.15 -0.02 0.00 0.00 0.23 -1.00 107.32 102.90 1o5p s GLY 23 Ca 0.37 -0.13 0.06 0.00 0.00 0.00 0.00 44.72 45.01 1o5p s GLY 23 CO 0.21 2.06 -0.19 0.00 0.00 0.00 0.00 173.10 175.18 1o5p s ALA 24 N 2.25 2.49 0.00 3.20 0.00 0.64 0.64 121.76 130.97 1o5p s ALA 24 Ca 0.06 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.95 1o5p s ALA 24 Cb -0.16 -0.78 0.00 0.00 0.00 0.00 0.00 23.12 22.18 1o5p s ALA 24 CO -0.16 0.55 0.00 0.41 0.00 0.00 0.00 175.76 176.56 1o5p n GLY 25 N 2.18 0.68 3.99 0.00 0.00 -0.89 0.36 105.19 111.52 1o5p n GLY 25 Ca -0.17 -0.73 -0.21 0.00 0.00 0.00 0.00 46.02 44.92 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 3.20 -0.89 0.99 1.43 -0.87 -1.16 118.68 121.37 1o5p s LEU 26 Ca 0.00 -0.29 -0.28 0.00 -1.03 0.00 0.00 54.13 52.53 1o5p s LEU 26 Cb 0.00 -2.39 -0.20 0.00 0.03 0.00 0.00 46.19 43.63 1o5p s LEU 26 CO 0.00 -1.36 2.58 0.00 0.23 0.00 0.00 176.35 177.80 1o5p n GLN 27 N -2.43 0.23 -1.17 1.70 3.00 -1.26 -4.09 117.38 113.35 1o5p n GLN 27 Ca 0.11 -0.03 -0.20 0.00 -0.01 0.00 0.00 57.00 56.87 1o5p n GLN 27 Cb 0.60 -1.92 -0.10 0.00 0.00 0.00 0.00 30.24 28.82 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 11.40 0.39 0.00 -1.58 0.00 -1.24 -1.29 120.51 128.19 1o5p n ALA 28 Ca 0.60 -2.11 0.00 0.00 0.00 0.00 0.00 53.44 51.93 1o5p n ALA 28 Cb 0.16 -2.92 0.00 0.00 0.00 0.00 0.00 19.45 16.69 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 5.47 0.41 2.70 0.00 0.00 0.91 -4.82 105.19 109.86 1o5p n GLY 29 Ca 0.35 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.16 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 -0.49 -0.21 -0.33 2.61 -1.32 -0.41 -4.88 115.64 110.62 1o5p s THR 30 Ca 0.00 -0.05 -0.37 0.00 -1.21 0.00 0.00 61.69 60.06 1o5p s THR 30 Cb 0.00 -0.56 -0.13 0.00 -1.51 0.00 0.00 72.50 70.30 1o5p s THR 30 CO 0.00 -0.17 2.05 0.00 -2.21 0.00 0.00 174.62 174.29 1o5p n ALA 31 N 5.30 0.66 -2.75 11.08 0.00 -1.26 -2.67 120.51 130.88 1o5p n ALA 31 Ca -0.06 0.11 -0.28 0.00 0.00 0.00 0.00 53.44 53.21 1o5p n ALA 31 Cb 0.49 -2.42 -0.06 0.00 0.00 0.00 0.00 19.45 17.46 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 5.99 3.07 0.24 0.00 2.02 0.14 -4.61 117.35 124.20 1o5p s TYR 32 Ca 1.06 -0.02 0.05 0.00 -0.37 0.00 0.00 57.07 57.80 1o5p s TYR 32 Cb -0.96 -1.51 -0.03 0.00 -0.40 0.00 0.00 41.96 39.06 1o5p s TYR 32 CO 0.55 0.51 0.31 0.34 -1.57 0.00 0.00 175.55 175.69 1o5p s ASP 33 N -2.80 6.09 -0.11 2.29 2.15 0.82 -1.60 116.67 123.52 1o5p s ASP 33 Ca 0.29 -0.01 -0.04 0.00 0.43 0.00 0.00 52.55 53.22 1o5p s ASP 33 Cb -0.11 -1.73 0.05 0.00 -0.30 0.00 0.00 42.92 40.83 1o5p s ASP 33 CO 0.21 -0.05 0.07 0.54 -0.17 0.00 0.00 175.17 175.78 1o5p s VAL 34 N -2.00 -0.08 0.31 1.11 0.11 -0.92 -1.13 120.40 117.80 1o5p s VAL 34 Ca 0.34 0.10 -0.17 0.00 -2.93 0.00 0.00 61.98 59.33 1o5p s VAL 34 Cb -0.09 -0.39 0.06 0.00 -1.53 0.00 0.00 36.38 34.44 1o5p s VAL 34 CO 0.28 -0.06 0.84 0.61 -3.33 0.00 0.00 175.10 173.44 1o5p n GLY 35 N 5.28 0.88 3.41 6.54 0.00 -0.90 -0.24 105.19 120.17 1o5p n GLY 35 Ca -0.05 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 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 -2.07 2.90 0.07 1.61 -2.07 -1.26 -2.56 119.66 116.27 1o5p s GLN 36 Ca 0.18 -1.09 0.05 0.00 -1.82 0.00 0.00 55.36 52.67 1o5p s GLN 36 Cb -0.04 -3.89 -0.03 0.00 -1.09 0.00 0.00 33.01 27.96 1o5p s GLN 36 CO 0.09 -0.77 -0.14 0.00 -1.32 0.00 0.00 175.29 173.16 1o5p s ALA 38 N -1.21 1.83 -0.35 0.00 0.00 -0.81 -1.73 121.76 119.50 1o5p s ALA 38 Ca -0.02 -0.92 -0.17 0.00 0.00 0.00 0.00 51.96 50.86 1o5p s ALA 38 Cb -0.10 -0.51 -0.01 0.00 0.00 0.00 0.00 23.12 22.50 1o5p s ALA 38 CO 0.02 0.41 0.45 -1.58 0.00 0.00 0.00 175.76 175.06 1o5p s TRP 39 N -0.34 3.19 -0.98 0.00 0.51 -1.26 -1.83 118.94 118.23 1o5p s TRP 39 Ca 0.04 0.08 0.17 0.00 -2.12 0.00 0.00 56.10 54.26 1o5p s TRP 39 Cb -0.10 -2.81 0.60 0.00 -0.81 0.00 0.00 33.47 30.35 1o5p s TRP 39 CO 0.01 -0.49 1.51 1.33 -0.51 0.00 0.00 176.95 178.80 1o5p n VAL 40 N 5.34 1.69 -1.69 4.03 0.24 -0.90 -4.75 118.33 122.30 1o5p n VAL 40 Ca -0.07 -1.26 0.00 0.00 -2.04 0.00 0.00 64.34 60.98 1o5p n VAL 40 Cb 0.49 0.17 0.00 0.00 -1.47 0.00 0.00 33.84 33.03 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 0.77 0.00 -4.55 -1.34 9.92 -1.26 -4.96 116.55 115.13 1o5p n ASP 41 Ca 0.22 0.00 -0.38 0.00 -0.53 0.00 0.00 54.79 54.10 1o5p n ASP 41 Cb 0.78 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 41.23 1o5p n ASP 41 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1o5p s THR 42 N -2.51 3.48 0.00 -3.53 -4.23 -1.26 -2.92 115.64 104.67 1o5p s THR 42 Ca 0.00 0.17 0.00 0.00 -1.18 0.00 0.00 61.69 60.68 1o5p s THR 42 Cb 0.00 -4.26 0.00 0.00 1.34 0.00 0.00 72.50 69.58 1o5p s THR 42 CO 0.00 -1.21 0.00 0.61 -0.54 0.00 0.00 174.62 173.48 1o5p n GLY 43 N 5.77 0.76 3.09 3.99 0.00 -1.26 -5.05 105.19 112.49 1o5p n GLY 43 Ca 0.18 -0.68 -0.33 0.00 0.00 0.00 0.00 46.02 45.19 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 2.57 -0.32 1.61 1.01 -1.15 -4.99 120.40 117.13 1o5p s VAL 44 Ca 0.00 -1.82 0.02 0.00 0.00 0.00 0.00 61.98 60.18 1o5p s VAL 44 Cb 0.00 -2.64 0.08 0.00 0.00 0.00 0.00 36.38 33.82 1o5p s VAL 44 CO 0.00 -0.29 0.02 -0.22 0.00 0.00 0.00 175.10 174.61 1o5p s LEU 45 N 1.09 4.35 -0.43 3.92 2.96 -1.26 -2.11 118.68 127.20 1o5p s LEU 45 Ca -0.00 -1.78 -0.16 0.00 -0.22 0.00 0.00 54.13 51.96 1o5p s LEU 45 Cb -0.20 -1.66 0.03 0.00 0.50 0.00 0.00 46.19 44.86 1o5p s LEU 45 CO -0.05 -0.34 0.39 0.00 -1.32 0.00 0.00 176.35 175.04 1o5p s ALA 46 N 1.05 3.46 0.35 5.97 0.00 -0.76 -3.51 121.76 128.32 1o5p s ALA 46 Ca 0.02 -1.66 0.07 0.00 0.00 0.00 0.00 51.96 50.40 1o5p s ALA 46 Cb -0.20 -3.01 -0.02 0.00 0.00 0.00 0.00 23.12 19.89 1o5p s ALA 46 CO -0.05 -1.57 0.33 0.00 0.00 0.00 0.00 175.76 174.46 1o5p s ASN 48 N -4.04 4.58 0.00 0.00 2.47 -0.85 -1.12 114.94 115.98 1o5p s ASN 48 Ca 0.43 -0.11 0.00 0.00 0.42 0.00 0.00 52.86 53.59 1o5p s ASN 48 Cb -0.06 -1.44 0.00 0.00 -1.45 0.00 0.00 41.25 38.30 1o5p s ASN 48 CO 0.27 0.26 0.59 -0.81 -3.72 0.00 0.00 177.10 173.70 1o5p n PRO 49 N 2.88 0.77 -0.00 0.43 -0.04 -1.26 -3.20 135.00 134.58 1o5p n PRO 49 Ca -0.18 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.33 1o5p n PRO 49 Cb 0.53 -1.24 0.04 0.00 -0.04 0.00 0.00 33.50 32.79 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 0.39 2.48 -1.55 0.55 0.00 -1.26 -4.48 120.51 116.64 1o5p n ALA 50 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.87 1o5p n ALA 50 Cb 0.30 -0.29 0.01 0.00 0.00 0.00 0.00 19.45 19.46 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 0.49 0.15 -4.56 0.00 5.68 -1.19 -2.36 116.55 114.76 1o5p n ASP 51 Ca 0.05 -1.68 -0.40 0.00 -0.50 0.00 0.00 54.79 52.27 1o5p n ASP 51 Cb 0.22 -0.13 -0.03 0.00 -1.14 0.00 0.00 41.12 40.04 1o5p n ASP 51 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 1o5p s PHE 52 N -0.14 2.41 0.00 2.11 0.08 -1.25 -3.27 117.98 117.91 1o5p s PHE 52 Ca 0.01 -0.55 0.00 0.00 0.12 0.00 0.00 56.93 56.51 1o5p s PHE 52 Cb 0.01 -4.61 0.00 0.00 -0.57 0.00 0.00 43.02 37.85 1o5p s PHE 52 CO 0.00 -1.95 0.00 0.43 -0.10 0.00 0.00 175.22 173.60 1o5p n SER 53 N 9.53 1.01 0.00 1.36 7.64 0.67 -4.93 113.62 128.91 1o5p n SER 53 Ca 0.29 -0.66 0.00 0.00 1.01 0.00 0.00 58.87 59.51 1o5p n SER 53 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 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 -1.31 0.00 -3.62 6.43 2.88 -1.26 -2.16 113.62 114.58 1o5p n SER 54 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 1o5p n SER 54 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 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 -0.64 0.05 -0.02 2.46 0.11 -0.62 -4.97 120.40 116.77 1o5p s VAL 55 Ca 0.00 -0.44 -0.06 0.00 -2.93 0.00 0.00 61.98 58.55 1o5p s VAL 55 Cb 0.00 -1.05 -0.04 0.00 -1.53 0.00 0.00 36.38 33.76 1o5p s VAL 55 CO 0.00 -0.24 0.23 -0.89 -3.33 0.00 0.00 175.10 170.87 1o5p s THR 56 N -3.08 5.36 -0.37 5.04 2.01 -1.26 0.26 115.64 123.60 1o5p s THR 56 Ca -0.02 0.13 -0.28 0.00 0.31 0.00 0.00 61.69 61.84 1o5p s THR 56 Cb 0.00 -3.54 -0.04 0.00 0.01 0.00 0.00 72.50 68.94 1o5p s THR 56 CO -0.07 0.41 2.04 0.00 -0.69 0.00 0.00 174.62 176.31 1o5p s ALA 57 N -1.25 2.49 0.00 7.40 0.00 -1.09 -4.71 121.76 124.61 1o5p s ALA 57 Ca 0.25 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.44 1o5p s ALA 57 Cb -0.13 -4.14 0.00 0.00 0.00 0.00 0.00 23.12 18.85 1o5p s ALA 57 CO 0.14 -3.21 0.00 -0.40 0.00 0.00 0.00 175.76 172.30 1o5p n ASP 58 N 12.10 0.00 -0.12 0.00 5.75 -1.26 0.31 116.55 133.32 1o5p n ASP 58 Ca 0.27 0.00 -0.05 0.00 -0.01 0.00 0.00 54.79 55.00 1o5p n ASP 58 Cb 0.49 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.59 1o5p n ASP 58 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1o5p h ALA 59 N -2.04 0.26 0.00 2.12 0.00 -1.92 -3.13 119.26 114.56 1o5p h ALA 59 Ca 0.00 0.16 -0.31 0.00 0.00 0.00 0.00 54.91 54.76 1o5p h ALA 59 Cb 0.00 0.30 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 1o5p h ALA 59 CO 0.00 -0.45 -2.16 -1.71 0.00 0.00 0.00 179.25 174.93 1o5p n ASN 60 N -5.31 1.56 0.00 0.00 2.85 -1.26 -4.56 115.26 108.55 1o5p n ASN 60 Ca 0.02 -0.05 0.00 0.00 -0.11 0.00 0.00 54.58 54.44 1o5p n ASN 60 Cb 0.22 0.37 0.00 0.00 1.24 0.00 0.00 39.78 41.60 1o5p n ASN 60 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1o5p n GLY 61 N 2.21 0.72 3.54 8.20 0.00 -1.18 -2.06 105.19 116.62 1o5p n GLY 61 Ca -0.31 -0.76 -0.36 0.00 0.00 0.00 0.00 46.02 44.59 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 -1.22 5.45 -0.21 1.61 0.01 -1.21 -2.09 113.70 116.04 1o5p s SER 62 Ca 0.00 -0.06 -0.02 0.00 1.31 0.00 0.00 55.95 57.17 1o5p s SER 62 Cb 0.00 -1.96 0.06 0.00 0.21 0.00 0.00 66.02 64.33 1o5p s SER 62 CO 0.00 0.05 0.04 0.00 0.41 0.00 0.00 173.24 173.74 1o5p s ALA 63 N 1.11 1.10 -0.23 1.44 0.00 0.21 -4.63 121.76 120.75 1o5p s ALA 63 Ca 0.05 -0.81 -0.00 0.00 0.00 0.00 0.00 51.96 51.19 1o5p s ALA 63 Cb -0.14 -1.23 0.03 0.00 0.00 0.00 0.00 23.12 21.77 1o5p s ALA 63 CO 0.03 -1.22 -0.11 -1.12 0.00 0.00 0.00 175.76 173.35 1o5p s SER 64 N 1.82 3.99 -0.01 0.00 0.01 -1.26 0.76 113.70 119.00 1o5p s SER 64 Ca -0.00 -0.83 -0.01 0.00 1.31 0.00 0.00 55.95 56.41 1o5p s SER 64 Cb -0.17 -1.60 0.01 0.00 0.21 0.00 0.00 66.02 64.46 1o5p s SER 64 CO -0.09 -0.09 0.03 0.28 0.41 0.00 0.00 173.24 173.78 1o5p s THR 65 N 1.30 -0.01 -0.12 1.44 -1.32 -0.96 -4.98 115.64 111.00 1o5p s THR 65 Ca 0.01 0.02 -0.09 0.00 -1.21 0.00 0.00 61.69 60.42 1o5p s THR 65 Cb -0.16 -0.05 -0.04 0.00 -1.51 0.00 0.00 72.50 70.73 1o5p s THR 65 CO -0.07 0.01 0.18 -0.94 -2.21 0.00 0.00 174.62 171.59 1o5p s SER 66 N 0.11 6.42 0.16 8.08 1.04 -1.26 -2.07 113.70 126.19 1o5p s SER 66 Ca -0.01 0.50 -0.00 0.00 0.48 0.00 0.00 55.95 56.92 1o5p s SER 66 Cb -0.01 -2.10 -0.04 0.00 0.10 0.00 0.00 66.02 63.97 1o5p s SER 66 CO -0.00 0.36 0.06 -0.76 0.98 0.00 0.00 173.24 173.88 1o5p s LEU 67 N -0.81 1.71 -0.21 2.42 1.02 0.01 -4.93 118.68 117.90 1o5p s LEU 67 Ca 0.15 -1.25 -0.15 0.00 0.02 0.00 0.00 54.13 52.90 1o5p s LEU 67 Cb -0.12 0.22 -0.04 0.00 0.02 0.00 0.00 46.19 46.27 1o5p s LEU 67 CO 0.04 -0.72 0.36 0.42 0.02 0.00 0.00 176.35 176.47 1o5p s THR 68 N -3.97 5.22 0.01 5.49 -4.23 -0.99 0.51 115.64 117.68 1o5p s THR 68 Ca 0.28 0.62 0.03 0.00 -1.18 0.00 0.00 61.69 61.44 1o5p s THR 68 Cb 0.07 -3.69 -0.01 0.00 1.34 0.00 0.00 72.50 70.21 1o5p s THR 68 CO 0.05 0.26 -0.09 0.68 -0.54 0.00 0.00 174.62 174.98 1o5p s VAL 69 N 1.30 0.74 0.03 2.29 -7.23 -0.82 -3.93 120.40 112.77 1o5p s VAL 69 Ca 0.17 -0.65 0.00 0.00 -1.81 0.00 0.00 61.98 59.70 1o5p s VAL 69 Cb -0.15 -0.67 -0.00 0.00 0.56 0.00 0.00 36.38 36.13 1o5p s VAL 69 CO 0.07 0.03 0.03 -2.11 -0.31 0.00 0.00 175.10 172.82 1o5p n ARG 70 N 2.37 0.05 0.00 4.82 1.85 -1.26 -4.12 116.66 120.36 1o5p n ARG 70 Ca -0.16 -0.21 0.00 0.00 -1.00 0.00 0.00 57.85 56.48 1o5p n ARG 70 Cb 0.56 0.20 0.00 0.00 -1.05 0.00 0.00 32.46 32.17 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 -0.04 0.00 -1.75 2.89 1.85 -1.26 -4.69 116.66 113.66 1o5p n ARG 71 Ca 0.00 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.43 1o5p n ARG 71 Cb 0.04 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.45 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 3.64 -3.56 2.89 7.64 -1.26 -1.98 113.62 121.00 1o5p n SER 72 Ca 0.00 1.19 -0.13 0.00 1.01 0.00 0.00 58.87 60.94 1o5p n SER 72 Cb 0.00 -1.58 -0.05 0.00 -1.01 0.00 0.00 64.21 61.57 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 -0.66 -0.41 -0.19 1.43 -0.12 -0.70 -4.83 117.98 112.49 1o5p s PHE 73 Ca 0.58 0.35 -0.39 0.00 -0.05 0.00 0.00 56.93 57.42 1o5p s PHE 73 Cb -0.50 0.37 -0.16 0.00 -0.63 0.00 0.00 43.02 42.10 1o5p s PHE 73 CO 0.57 -0.69 1.66 0.39 -0.05 0.00 0.00 175.22 177.11 1o5p n GLU 74 N 0.15 1.20 -1.21 1.99 -0.58 -1.26 -0.02 120.64 120.91 1o5p n GLU 74 Ca -0.18 0.44 -0.21 0.00 -0.42 0.00 0.00 57.16 56.79 1o5p n GLU 74 Cb 0.62 -2.12 -0.05 0.00 -0.57 0.00 0.00 31.44 29.32 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 3.85 4.00 3.16 0.62 0.00 -0.21 -3.09 105.19 113.51 1o5p n GLY 75 Ca 0.25 -1.49 -0.58 0.00 0.00 0.00 0.00 46.02 44.20 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 1.00 1.24 -3.03 1.61 3.01 -0.28 -2.14 117.46 118.87 1o5p n PHE 76 Ca 0.41 0.82 -0.40 0.00 1.01 0.00 0.00 57.45 59.28 1o5p n PHE 76 Cb 0.61 -2.11 -0.05 0.00 -0.01 0.00 0.00 39.48 37.92 1o5p n PHE 76 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 1o5p s LEU 77 N 4.76 4.24 -0.25 4.37 2.96 -0.71 -1.90 118.68 132.16 1o5p s LEU 77 Ca 1.07 1.09 -0.02 0.00 -0.22 0.00 0.00 54.13 56.06 1o5p s LEU 77 Cb -1.39 -3.06 -0.02 0.00 0.50 0.00 0.00 46.19 42.21 1o5p s LEU 77 CO 0.66 -0.22 1.32 0.33 -1.32 0.00 0.00 176.35 177.11 1o5p n PHE 78 N 4.43 0.37 -1.94 5.38 7.35 -1.23 -2.88 117.46 128.94 1o5p n PHE 78 Ca -0.00 -0.87 0.00 0.00 -0.76 0.00 0.00 57.45 55.82 1o5p n PHE 78 Cb 0.50 -0.90 0.00 0.00 0.35 0.00 0.00 39.48 39.44 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 4.45 0.00 0.00 -2.13 2.03 -1.26 -4.98 116.55 114.66 1o5p n ASP 79 Ca 0.13 -0.95 0.00 0.00 0.52 0.00 0.00 54.79 54.50 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 2.80 3.94 0.27 0.00 -1.14 -4.99 105.19 106.07 1o5p n GLY 80 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.03 4.92 -0.12 2.61 -4.23 -1.26 -4.96 115.64 111.56 1o5p s THR 81 Ca 0.00 -0.44 -0.03 0.00 -1.18 0.00 0.00 61.69 60.04 1o5p s THR 81 Cb 0.00 -3.80 -0.03 0.00 1.34 0.00 0.00 72.50 70.01 1o5p s THR 81 CO 0.00 -0.54 -0.00 0.00 -0.54 0.00 0.00 174.62 173.54 1o5p s ARG 82 N -4.37 3.37 0.30 3.99 1.70 -1.26 -1.74 118.95 120.94 1o5p s ARG 82 Ca 0.42 -0.44 0.24 0.00 -0.47 0.00 0.00 55.73 55.48 1o5p s ARG 82 Cb -0.10 -2.90 0.49 0.00 -0.57 0.00 0.00 34.95 31.88 1o5p s ARG 82 CO 0.37 0.48 1.59 2.35 -1.08 0.00 0.00 175.30 179.01 1o5p h TRP 83 N 5.94 0.00 0.00 5.89 7.01 -1.75 -3.46 115.95 129.58 1o5p h TRP 83 Ca -0.42 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.58 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 0.58 0.00 0.00 0.41 -2.79 0.00 0.00 178.44 176.64 1o5p n GLY 84 N 1.21 1.65 3.59 2.65 0.00 -1.26 -4.90 105.19 108.12 1o5p n GLY 84 Ca 0.04 -2.15 -0.41 0.00 0.00 0.00 0.00 46.02 43.49 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 -1.65 3.20 -0.60 2.61 -4.23 -1.26 -1.05 115.64 112.65 1o5p s THR 85 Ca 0.00 0.19 -0.28 0.00 -1.18 0.00 0.00 61.69 60.42 1o5p s THR 85 Cb 0.00 -3.32 0.02 0.00 1.34 0.00 0.00 72.50 70.55 1o5p s THR 85 CO 0.00 -0.23 1.29 -0.69 -0.54 0.00 0.00 174.62 174.44 1o5p s VAL 86 N 8.56 3.88 -0.31 2.29 1.01 0.97 -4.66 120.40 132.12 1o5p s VAL 86 Ca 0.90 0.73 -0.28 0.00 0.00 0.00 0.00 61.98 63.33 1o5p s VAL 86 Cb -0.25 -4.66 -0.03 0.00 0.00 0.00 0.00 36.38 31.44 1o5p s VAL 86 CO 0.32 -1.38 1.98 -1.81 0.00 0.00 0.00 175.10 174.21 1o5p s ASP 87 N 3.63 5.62 0.00 3.32 1.01 -1.26 -1.72 116.67 127.27 1o5p s ASP 87 Ca 0.45 1.45 0.00 0.00 0.71 0.00 0.00 52.55 55.16 1o5p s ASP 87 Cb -0.09 -2.52 0.02 0.00 1.01 0.00 0.00 42.92 41.35 1o5p s ASP 87 CO 0.23 -1.90 0.80 0.00 0.21 0.00 0.00 175.17 174.51 1o5p n THR 89 N -1.28 0.04 -0.06 0.00 -2.24 -1.26 -4.20 114.28 105.29 1o5p n THR 89 Ca 0.00 -0.26 -0.12 0.00 -2.27 0.00 0.00 64.05 61.41 1o5p n THR 89 Cb 0.00 0.43 -0.04 0.00 -2.10 0.00 0.00 70.33 68.62 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 0.15 0.64 -3.67 4.28 -2.24 0.16 -5.06 114.28 108.53 1o5p n THR 90 Ca 0.19 -0.17 -0.25 0.00 -2.27 0.00 0.00 64.05 61.54 1o5p n THR 90 Cb 0.34 -1.55 0.02 0.00 -2.10 0.00 0.00 70.33 67.03 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 -2.21 4.55 -0.36 6.98 0.00 -1.20 -5.09 121.76 124.43 1o5p s ALA 91 Ca -0.16 -1.45 -0.13 0.00 0.00 0.00 0.00 51.96 50.23 1o5p s ALA 91 Cb 0.06 -0.91 0.00 0.00 0.00 0.00 0.00 23.12 22.27 1o5p s ALA 91 CO 0.21 -0.59 0.24 0.00 0.00 0.00 0.00 175.76 175.62 1o5p s ALA 92 N -2.77 3.43 -0.26 0.00 0.00 -1.26 -4.75 121.76 116.15 1o5p s ALA 92 Ca 0.40 -1.52 -0.14 0.00 0.00 0.00 0.00 51.96 50.71 1o5p s ALA 92 Cb -0.03 -2.67 -0.04 0.00 0.00 0.00 0.00 23.12 20.38 1o5p s ALA 92 CO 0.26 -1.14 0.33 0.00 0.00 0.00 0.00 175.76 175.20 1o5p s GLN 94 N 1.84 3.27 -0.38 0.00 -0.21 -0.70 -2.54 119.66 120.93 1o5p s GLN 94 Ca 0.14 -0.46 -0.11 0.00 0.02 0.00 0.00 55.36 54.94 1o5p s GLN 94 Cb -0.15 -2.96 0.03 0.00 1.00 0.00 0.00 33.01 30.92 1o5p s GLN 94 CO 0.09 0.63 0.21 0.08 -2.12 0.00 0.00 175.29 174.18 1o5p s VAL 95 N -1.38 4.58 0.04 1.09 1.01 0.15 -2.22 120.40 123.68 1o5p s VAL 95 Ca 0.30 -0.88 -0.00 0.00 0.00 0.00 0.00 61.98 61.39 1o5p s VAL 95 Cb -0.13 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.69 1o5p s VAL 95 CO 0.22 -0.25 0.06 0.61 0.00 0.00 0.00 175.10 175.74 1o5p n GLY 96 N 5.00 2.94 3.29 4.51 0.00 -1.06 0.28 105.19 120.14 1o5p n GLY 96 Ca -0.12 -1.38 -0.26 0.00 0.00 0.00 0.00 46.02 44.26 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 0.00 0.99 4.32 -1.23 -2.12 117.00 118.96 1o5p n LEU 97 Ca -0.00 -2.68 0.00 0.00 -0.02 0.00 0.00 56.01 53.31 1o5p n LEU 97 Cb 0.07 0.15 0.00 0.00 -1.62 0.00 0.00 43.42 42.02 1o5p n LEU 97 CO 0.03 -0.47 0.00 -1.54 -1.22 0.00 0.00 177.39 174.19 1o5p n SER 98 N -1.55 0.00 0.00 -1.43 3.41 -0.29 -4.38 113.62 109.38 1o5p n SER 98 Ca -0.11 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.50 1o5p n SER 98 Cb 0.56 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 1o5p n SER 98 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1o5p n ASP 99 N 0.00 1.70 -1.66 4.04 5.75 -1.24 0.29 116.55 125.42 1o5p n ASP 99 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 54.79 54.61 1o5p n ASP 99 Cb 0.00 0.00 0.09 0.00 -1.03 0.00 0.00 41.12 40.18 1o5p n ASP 99 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1o5p n ALA 100 N -3.00 4.82 -0.02 2.12 0.00 -1.26 -4.62 120.51 118.55 1o5p n ALA 100 Ca 0.00 -3.57 -0.02 0.00 0.00 0.00 0.00 53.44 49.85 1o5p n ALA 100 Cb 0.00 -0.56 -0.03 0.00 0.00 0.00 0.00 19.45 18.87 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 -0.88 1.90 0.00 0.00 0.00 -1.26 -5.02 120.51 115.26 1o5p n ALA 101 Ca 0.40 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1o5p n ALA 101 Cb 0.90 0.26 0.00 0.00 0.00 0.00 0.00 19.45 20.60 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 2.97 1.02 2.86 0.00 0.00 -1.26 -5.14 105.19 105.64 1o5p n GLY 102 Ca -0.07 -0.08 -0.06 0.00 0.00 0.00 0.00 46.02 45.82 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 0.00 -1.63 -0.37 1.61 5.03 -1.26 -4.99 115.26 113.65 1o5p n ASN 103 Ca 0.00 -2.07 0.00 0.00 0.87 0.00 0.00 54.58 53.38 1o5p n ASN 103 Cb 0.00 2.70 0.00 0.00 -1.02 0.00 0.00 39.78 41.46 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 -0.44 1.68 3.07 7.41 0.00 -1.26 -3.71 105.19 111.93 1o5p n GLY 104 Ca -0.05 -0.77 -0.28 0.00 0.00 0.00 0.00 46.02 44.92 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 -1.02 -2.00 1.61 -0.02 -1.26 -4.88 135.00 127.43 1o5p n PRO 105 Ca 0.00 -0.29 -0.18 0.00 -2.02 0.00 0.00 63.50 61.01 1o5p n PRO 105 Cb 0.00 -1.33 0.09 0.00 -0.02 0.00 0.00 33.50 32.24 1o5p n PRO 105 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1o5p n GLU 106 N 0.02 -0.03 -4.59 -0.52 -0.58 -1.26 -4.51 120.64 109.17 1o5p n GLU 106 Ca 0.01 -1.97 -0.27 0.00 -0.42 0.00 0.00 57.16 54.51 1o5p n GLU 106 Cb 0.55 -0.55 -0.11 0.00 -0.57 0.00 0.00 31.44 30.77 1o5p n GLU 106 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1o5p s GLY 107 N -4.48 2.39 -0.13 0.62 0.00 -1.26 -3.57 107.32 100.89 1o5p s GLY 107 Ca 0.50 -2.23 -0.04 0.00 0.00 0.00 0.00 44.72 42.95 1o5p s GLY 107 CO 0.33 -2.07 -0.01 0.14 0.00 0.00 0.00 173.10 171.49 1o5p s VAL 108 N -2.70 4.18 -0.07 1.40 1.01 0.14 -4.76 120.40 119.61 1o5p s VAL 108 Ca 0.34 -0.27 -0.30 0.00 0.00 0.00 0.00 61.98 61.75 1o5p s VAL 108 Cb 0.08 -2.81 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 1o5p s VAL 108 CO 0.17 0.53 1.30 0.00 0.00 0.00 0.00 175.10 177.10 1o5p s ALA 109 N -0.09 3.57 0.51 5.51 0.00 -1.26 0.31 121.76 130.31 1o5p s ALA 109 Ca 0.03 0.66 0.06 0.00 0.00 0.00 0.00 51.96 52.72 1o5p s ALA 109 Cb -0.13 -3.58 0.04 0.00 0.00 0.00 0.00 23.12 19.46 1o5p s ALA 109 CO 0.02 -0.95 0.70 0.96 0.00 0.00 0.00 175.76 176.49 1o5p s ILE 110 N 2.72 2.65 0.04 0.00 -4.36 -1.05 -4.85 121.20 116.35 1o5p s ILE 110 Ca 0.59 -0.90 -0.01 0.00 -0.26 0.00 0.00 60.65 60.07 1o5p s ILE 110 Cb -0.26 -2.75 -0.04 0.00 1.25 0.00 0.00 42.46 40.66 1o5p s ILE 110 CO 0.22 0.00 -0.03 -0.55 0.24 0.00 0.00 174.94 174.81 1o5p s SER 111 N -4.48 0.44 -0.37 4.36 0.15 0.19 -4.75 113.70 109.24 1o5p s SER 111 Ca 0.58 -0.89 0.00 0.00 0.70 0.00 0.00 55.95 56.35 1o5p s SER 111 Cb -0.09 0.18 0.12 0.00 -1.71 0.00 0.00 66.02 64.53 1o5p s SER 111 CO 0.37 -0.53 0.19 -0.36 1.20 0.00 0.00 173.24 174.10 1o5p s PHE 112 N -3.36 1.52 -0.59 3.44 0.40 -1.26 -2.91 117.98 115.22 1o5p s PHE 112 Ca 0.02 -1.96 0.00 0.00 -0.60 0.00 0.00 56.93 54.39 1o5p s PHE 112 Cb 0.04 -1.56 0.00 0.00 0.51 0.00 0.00 43.02 42.01 1o5p s PHE 112 CO -0.08 -0.82 0.15 0.27 0.70 0.00 0.00 175.22 175.44