#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 2.57 0.87 0.00 0.00 -1.26 -4.98 121.76 118.96 1o5p s ALA 2 Ca 0.00 -1.76 -0.12 0.00 0.00 0.00 0.00 51.96 50.08 1o5p s ALA 2 Cb 0.00 -0.26 0.11 0.00 0.00 0.00 0.00 23.12 22.97 1o5p s ALA 2 CO 0.00 0.30 1.13 -2.30 0.00 0.00 0.00 175.76 174.89 1o5p n PRO 3 N -0.27 -0.18 -1.92 0.00 -0.02 -0.48 -4.20 135.00 127.93 1o5p n PRO 3 Ca -0.08 0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 1o5p n PRO 3 Cb 0.59 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 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 -3.81 0.00 -3.64 3.45 5.66 0.27 -4.86 114.28 111.35 1o5p n THR 4 Ca 0.12 0.00 -0.04 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 -0.34 1.79 0.00 -1.26 -1.00 121.76 117.84 1o5p s ALA 5 Ca 0.00 2.27 -0.05 0.00 0.00 0.00 0.00 51.96 54.18 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 -0.35 0.09 -0.08 0.00 0.00 0.00 175.76 175.42 1o5p s THR 6 N 1.39 3.51 -0.03 0.00 -1.32 -0.02 -4.84 115.64 114.33 1o5p s THR 6 Ca -0.09 -1.32 0.05 0.00 -1.21 0.00 0.00 61.69 59.12 1o5p s THR 6 Cb -0.04 -3.05 -0.03 0.00 -1.51 0.00 0.00 72.50 67.87 1o5p s THR 6 CO -0.16 -0.23 -0.16 -0.69 -2.21 0.00 0.00 174.62 171.17 1o5p s VAL 7 N 1.33 2.88 -0.25 5.08 1.01 -1.26 -0.34 120.40 128.86 1o5p s VAL 7 Ca -0.02 -0.84 -0.29 0.00 0.00 0.00 0.00 61.98 60.83 1o5p s VAL 7 Cb -0.20 -2.12 0.17 0.00 0.00 0.00 0.00 36.38 34.23 1o5p s VAL 7 CO 0.01 0.56 1.25 -0.89 0.00 0.00 0.00 175.10 176.02 1o5p s THR 8 N -0.74 0.00 0.45 3.92 2.01 0.24 -4.51 115.64 117.01 1o5p s THR 8 Ca 0.12 0.00 -0.20 0.00 0.31 0.00 0.00 61.69 61.91 1o5p s THR 8 Cb -0.10 -1.00 -0.10 0.00 0.01 0.00 0.00 72.50 71.31 1o5p s THR 8 CO 0.01 0.00 0.98 -2.16 -0.69 0.00 0.00 174.62 172.76 1o5p s PRO 9 N -0.94 4.08 0.10 4.92 0.05 -1.26 -0.67 135.00 141.28 1o5p s PRO 9 Ca 0.05 1.17 0.18 0.00 0.05 0.00 0.00 61.00 62.45 1o5p s PRO 9 Cb -0.01 -2.15 -0.10 0.00 0.05 0.00 0.00 34.50 32.29 1o5p s PRO 9 CO -0.06 -0.17 0.89 0.66 0.05 0.00 0.00 177.00 178.38 1o5p h SER 10 N 1.71 0.00 -4.49 6.66 4.64 -1.90 -3.44 113.55 116.73 1o5p h SER 10 Ca -0.49 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 60.56 1o5p h SER 10 Cb 1.19 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.13 1o5p h SER 10 CO 0.60 0.46 -0.68 -0.44 -0.87 0.00 0.00 176.83 175.91 1o5p s SER 11 N -5.72 1.24 -0.16 4.97 0.01 -1.26 0.51 113.70 113.29 1o5p s SER 11 Ca -0.02 -1.11 -0.01 0.00 1.31 0.00 0.00 55.95 56.12 1o5p s SER 11 Cb 0.09 0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.42 1o5p s SER 11 CO 0.80 -0.52 0.10 0.61 0.41 0.00 0.00 173.24 174.64 1o5p n GLY 12 N -0.18 0.68 0.13 3.44 0.00 -1.14 -4.90 105.19 103.21 1o5p n GLY 12 Ca -0.08 -0.63 -0.22 0.00 0.00 0.00 0.00 46.02 45.09 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 -0.83 2.37 -1.22 0.99 4.77 -1.26 -5.04 117.00 116.79 1o5p n LEU 13 Ca -0.01 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 1o5p n LEU 13 Cb 0.51 -1.01 0.00 0.00 -2.33 0.00 0.00 43.42 40.59 1o5p n LEU 13 CO 0.06 0.66 -0.36 -0.24 -1.33 0.00 0.00 177.39 176.18 1o5p n SER 14 N -3.84 -6.70 -4.44 -1.43 2.88 -1.26 -3.84 113.62 94.99 1o5p n SER 14 Ca -0.37 1.15 -0.49 0.00 -1.33 0.00 0.00 58.87 57.83 1o5p n SER 14 Cb 0.91 -3.55 -0.08 0.00 -0.75 0.00 0.00 64.21 60.74 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 -1.49 1.82 0.00 -3.46 5.75 -1.26 -2.00 116.55 115.91 1o5p n ASP 15 Ca 0.00 0.31 0.00 0.00 -0.01 0.00 0.00 54.79 55.09 1o5p n ASP 15 Cb 0.15 -1.23 0.00 0.00 -1.03 0.00 0.00 41.12 39.01 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 6.58 1.50 1.21 6.12 0.00 -1.26 -5.05 105.19 114.29 1o5p n GLY 16 Ca 0.45 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.39 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 -4.75 2.61 5.66 -0.85 -4.97 114.28 111.52 1o5p n THR 17 Ca 0.00 -0.65 -0.25 0.00 -3.05 0.00 0.00 64.05 60.09 1o5p n THR 17 Cb 0.00 -0.56 -0.16 0.00 -1.55 0.00 0.00 70.33 68.06 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 -0.55 1.31 0.18 1.08 1.01 -1.26 -2.08 120.40 120.10 1o5p s VAL 18 Ca 0.14 -0.65 0.07 0.00 0.00 0.00 0.00 61.98 61.53 1o5p s VAL 18 Cb -0.01 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.19 1o5p s VAL 18 CO 0.09 0.38 0.07 0.68 0.00 0.00 0.00 175.10 176.32 1o5p s VAL 19 N 0.10 4.04 -0.31 2.92 -7.23 0.22 -4.73 120.40 115.41 1o5p s VAL 19 Ca -0.04 -1.33 -0.03 0.00 -1.81 0.00 0.00 61.98 58.77 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 -0.15 0.03 -0.75 -0.31 0.00 0.00 175.10 173.95 1o5p s LYS 20 N -3.12 2.44 -0.09 4.82 2.20 0.15 -0.60 119.74 125.54 1o5p s LYS 20 Ca 0.29 -1.28 -0.03 0.00 -0.36 0.00 0.00 55.97 54.59 1o5p s LYS 20 Cb -0.09 -3.26 -0.04 0.00 -1.51 0.00 0.00 37.83 32.93 1o5p s LYS 20 CO 0.21 -0.65 0.05 0.54 -0.36 0.00 0.00 175.35 175.14 1o5p s VAL 21 N 1.28 4.72 0.11 4.02 0.11 -0.86 -0.59 120.40 129.17 1o5p s VAL 21 Ca -0.04 -0.13 0.02 0.00 -2.93 0.00 0.00 61.98 58.91 1o5p s VAL 21 Cb -0.20 -3.02 -0.04 0.00 -1.53 0.00 0.00 36.38 31.58 1o5p s VAL 21 CO -0.00 0.58 -0.07 0.00 -3.33 0.00 0.00 175.10 172.28 1o5p s ALA 22 N -0.96 1.05 0.03 1.54 0.00 0.54 -1.49 121.76 122.48 1o5p s ALA 22 Ca 0.15 -1.37 0.05 0.00 0.00 0.00 0.00 51.96 50.78 1o5p s ALA 22 Cb -0.12 0.15 -0.02 0.00 0.00 0.00 0.00 23.12 23.14 1o5p s ALA 22 CO 0.04 -0.22 -0.14 0.20 0.00 0.00 0.00 175.76 175.64 1o5p s GLY 23 N -3.06 0.76 -0.12 0.00 0.00 0.29 -0.84 107.32 104.36 1o5p s GLY 23 Ca 0.13 -0.80 -0.05 0.00 0.00 0.00 0.00 44.72 44.00 1o5p s GLY 23 CO -0.04 -0.77 0.26 0.00 0.00 0.00 0.00 173.10 172.55 1o5p s ALA 24 N -0.81 -0.56 0.00 3.20 0.00 -0.17 0.11 121.76 123.53 1o5p s ALA 24 Ca 0.02 0.98 0.00 0.00 0.00 0.00 0.00 51.96 52.95 1o5p s ALA 24 Cb -0.08 -0.83 0.00 0.00 0.00 0.00 0.00 23.12 22.21 1o5p s ALA 24 CO 0.01 -0.42 0.00 0.41 0.00 0.00 0.00 175.76 175.76 1o5p n GLY 25 N 4.80 0.97 3.96 0.00 0.00 -1.02 0.95 105.19 114.85 1o5p n GLY 25 Ca -0.16 -0.51 -0.26 0.00 0.00 0.00 0.00 46.02 45.10 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 2.88 -0.83 0.99 1.43 -0.81 -1.38 118.68 120.97 1o5p s LEU 26 Ca 0.00 0.01 -0.26 0.00 -1.03 0.00 0.00 54.13 52.85 1o5p s LEU 26 Cb 0.00 -2.37 -0.18 0.00 0.03 0.00 0.00 46.19 43.67 1o5p s LEU 26 CO 0.00 -2.01 2.53 0.00 0.23 0.00 0.00 176.35 177.09 1o5p n GLN 27 N -3.09 0.36 -1.24 1.70 3.00 -1.26 -4.08 117.38 112.77 1o5p n GLN 27 Ca 0.13 -0.07 -0.17 0.00 -0.01 0.00 0.00 57.00 56.88 1o5p n GLN 27 Cb 0.60 -2.21 -0.09 0.00 0.00 0.00 0.00 30.24 28.54 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 12.21 0.35 0.00 -1.58 0.00 -1.22 -1.26 120.51 129.01 1o5p n ALA 28 Ca 0.56 -2.02 0.00 0.00 0.00 0.00 0.00 53.44 51.98 1o5p n ALA 28 Cb 0.23 -2.77 0.00 0.00 0.00 0.00 0.00 19.45 16.91 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 5.49 0.53 2.82 0.00 0.00 0.89 -4.83 105.19 110.10 1o5p n GLY 29 Ca 0.33 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.19 1o5p n GLY 29 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1o5p s THR 30 N -0.69 -0.38 -0.05 2.61 -4.23 -0.39 -4.88 115.64 107.63 1o5p s THR 30 Ca 0.00 -0.03 -0.40 0.00 -1.18 0.00 0.00 61.69 60.08 1o5p s THR 30 Cb 0.00 -0.65 -0.18 0.00 1.34 0.00 0.00 72.50 73.01 1o5p s THR 30 CO 0.00 -0.13 1.31 0.00 -0.54 0.00 0.00 174.62 175.26 1o5p n ALA 31 N 5.33 -1.97 -2.43 3.99 0.00 -1.26 -2.73 120.51 121.43 1o5p n ALA 31 Ca -0.05 0.53 -0.29 0.00 0.00 0.00 0.00 53.44 53.63 1o5p n ALA 31 Cb 0.50 -1.95 -0.12 0.00 0.00 0.00 0.00 19.45 17.87 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 0.93 2.40 0.12 0.00 2.02 0.16 -4.57 117.35 118.40 1o5p s TYR 32 Ca 0.91 -0.33 0.02 0.00 -0.37 0.00 0.00 57.07 57.30 1o5p s TYR 32 Cb -1.15 -1.27 -0.04 0.00 -0.40 0.00 0.00 41.96 39.10 1o5p s TYR 32 CO 0.57 0.38 0.24 -0.51 -1.57 0.00 0.00 175.55 174.66 1o5p s ASP 33 N -2.18 6.27 -0.07 2.29 1.11 0.41 -1.82 116.67 122.69 1o5p s ASP 33 Ca 0.16 0.18 -0.02 0.00 0.18 0.00 0.00 52.55 53.06 1o5p s ASP 33 Cb -0.10 -1.88 0.03 0.00 1.07 0.00 0.00 42.92 42.04 1o5p s ASP 33 CO 0.08 0.10 0.03 0.54 1.18 0.00 0.00 175.17 177.10 1o5p s VAL 34 N -1.65 0.16 0.16 -1.27 0.11 -0.93 -0.66 120.40 116.31 1o5p s VAL 34 Ca 0.34 0.20 -0.20 0.00 -2.93 0.00 0.00 61.98 59.40 1o5p s VAL 34 Cb -0.12 -0.40 0.07 0.00 -1.53 0.00 0.00 36.38 34.40 1o5p s VAL 34 CO 0.28 0.18 0.94 0.61 -3.33 0.00 0.00 175.10 173.77 1o5p n GLY 35 N 5.21 0.66 3.45 6.54 0.00 -0.94 -0.24 105.19 119.87 1o5p n GLY 35 Ca -0.05 -1.12 -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 -2.04 2.98 0.06 1.61 -2.07 -1.26 -2.59 119.66 116.35 1o5p s GLN 36 Ca 0.21 -1.06 0.05 0.00 -1.82 0.00 0.00 55.36 52.74 1o5p s GLN 36 Cb -0.02 -4.01 -0.03 0.00 -1.09 0.00 0.00 33.01 27.86 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 -1.15 1.88 -0.35 0.00 0.00 -0.76 -1.85 121.76 119.53 1o5p s ALA 38 Ca -0.01 -0.93 -0.17 0.00 0.00 0.00 0.00 51.96 50.85 1o5p s ALA 38 Cb -0.09 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.47 1o5p s ALA 38 CO 0.02 0.40 0.43 -1.58 0.00 0.00 0.00 175.76 175.04 1o5p s TRP 39 N -0.28 3.19 -0.85 0.00 0.51 -1.26 -1.84 118.94 118.41 1o5p s TRP 39 Ca 0.02 0.05 0.16 0.00 -2.12 0.00 0.00 56.10 54.21 1o5p s TRP 39 Cb -0.11 -2.80 0.57 0.00 -0.81 0.00 0.00 33.47 30.32 1o5p s TRP 39 CO 0.01 -0.49 1.48 1.33 -0.51 0.00 0.00 176.95 178.77 1o5p n VAL 40 N 5.33 1.72 -1.60 4.03 0.24 -0.90 -4.73 118.33 122.42 1o5p n VAL 40 Ca -0.07 -1.31 0.00 0.00 -2.04 0.00 0.00 64.34 60.92 1o5p n VAL 40 Cb 0.49 0.14 0.00 0.00 -1.47 0.00 0.00 33.84 33.00 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 0.58 0.00 -4.55 -1.34 8.00 -1.26 -4.96 116.55 113.03 1o5p n ASP 41 Ca 0.21 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.33 1o5p n ASP 41 Cb 0.77 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.84 1o5p n ASP 41 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1o5p s THR 42 N -2.49 3.47 0.00 -3.53 -4.23 -1.26 -2.90 115.64 104.70 1o5p s THR 42 Ca 0.00 0.15 0.00 0.00 -1.18 0.00 0.00 61.69 60.66 1o5p s THR 42 Cb 0.00 -4.22 0.00 0.00 1.34 0.00 0.00 72.50 69.62 1o5p s THR 42 CO 0.00 -1.18 0.00 0.61 -0.54 0.00 0.00 174.62 173.51 1o5p n GLY 43 N 5.79 0.72 3.10 3.99 0.00 -1.26 -5.05 105.19 112.49 1o5p n GLY 43 Ca 0.19 -0.70 -0.33 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 2.66 -0.32 1.61 1.01 -1.14 -4.98 120.40 117.25 1o5p s VAL 44 Ca 0.00 -1.78 0.02 0.00 0.00 0.00 0.00 61.98 60.22 1o5p s VAL 44 Cb 0.00 -2.69 0.08 0.00 0.00 0.00 0.00 36.38 33.77 1o5p s VAL 44 CO 0.00 -0.30 0.01 -0.22 0.00 0.00 0.00 175.10 174.59 1o5p s LEU 45 N 1.11 4.28 -0.42 3.92 2.96 -1.26 -2.12 118.68 127.15 1o5p s LEU 45 Ca -0.00 -1.81 -0.16 0.00 -0.22 0.00 0.00 54.13 51.94 1o5p s LEU 45 Cb -0.20 -1.63 0.03 0.00 0.50 0.00 0.00 46.19 44.88 1o5p s LEU 45 CO -0.04 -0.32 0.38 0.00 -1.32 0.00 0.00 176.35 175.05 1o5p s ALA 46 N 1.02 3.46 0.35 5.97 0.00 -0.77 -3.42 121.76 128.38 1o5p s ALA 46 Ca 0.02 -1.64 0.08 0.00 0.00 0.00 0.00 51.96 50.42 1o5p s ALA 46 Cb -0.20 -3.00 -0.03 0.00 0.00 0.00 0.00 23.12 19.90 1o5p s ALA 46 CO -0.06 -1.56 0.31 0.00 0.00 0.00 0.00 175.76 174.45 1o5p s ASN 48 N -4.02 4.87 0.00 0.00 3.84 -0.87 -0.27 114.94 118.48 1o5p s ASN 48 Ca 0.43 -0.04 0.00 0.00 0.21 0.00 0.00 52.86 53.46 1o5p s ASN 48 Cb -0.05 -1.55 0.00 0.00 -0.55 0.00 0.00 41.25 39.10 1o5p s ASN 48 CO 0.27 0.27 0.54 -0.81 -2.79 0.00 0.00 177.10 174.58 1o5p n PRO 49 N 2.88 0.74 -0.02 0.43 -0.04 -1.26 -3.11 135.00 134.61 1o5p n PRO 49 Ca -0.18 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.30 1o5p n PRO 49 Cb 0.53 -1.26 0.03 0.00 -0.04 0.00 0.00 33.50 32.76 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 0.36 2.30 -1.67 0.55 0.00 -1.26 -4.51 120.51 116.28 1o5p n ALA 50 Ca 0.00 -0.75 0.01 0.00 0.00 0.00 0.00 53.44 52.70 1o5p n ALA 50 Cb 0.27 -0.12 0.01 0.00 0.00 0.00 0.00 19.45 19.61 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 0.02 0.20 -4.54 0.00 5.75 -1.18 -2.44 116.55 114.36 1o5p n ASP 51 Ca 0.03 -1.85 -0.42 0.00 -0.01 0.00 0.00 54.79 52.54 1o5p n ASP 51 Cb 0.18 -0.17 -0.02 0.00 -1.03 0.00 0.00 41.12 40.08 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 -0.21 2.74 0.00 2.11 0.08 -1.25 -3.12 117.98 118.33 1o5p s PHE 52 Ca 0.02 -1.19 0.00 0.00 0.12 0.00 0.00 56.93 55.88 1o5p s PHE 52 Cb 0.02 -4.63 0.00 0.00 -0.57 0.00 0.00 43.02 37.84 1o5p s PHE 52 CO 0.00 -1.81 0.00 0.43 -0.10 0.00 0.00 175.22 173.74 1o5p n SER 53 N 8.23 0.50 0.00 1.36 7.64 0.67 -4.91 113.62 127.11 1o5p n SER 53 Ca 0.36 -0.59 0.00 0.00 1.01 0.00 0.00 58.87 59.65 1o5p n SER 53 Cb 0.49 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 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 -1.47 0.00 -3.67 6.43 2.88 -1.26 -2.20 113.62 114.32 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 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 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 -0.58 0.07 0.02 2.46 0.11 -0.76 -4.95 120.40 116.77 1o5p s VAL 55 Ca 0.00 -0.55 -0.06 0.00 -2.93 0.00 0.00 61.98 58.44 1o5p s VAL 55 Cb 0.00 -1.03 -0.05 0.00 -1.53 0.00 0.00 36.38 33.77 1o5p s VAL 55 CO 0.00 -0.30 0.27 -0.89 -3.33 0.00 0.00 175.10 170.85 1o5p s THR 56 N -2.96 5.30 -0.36 5.04 2.01 -1.26 0.37 115.64 123.78 1o5p s THR 56 Ca -0.02 0.12 -0.28 0.00 0.31 0.00 0.00 61.69 61.82 1o5p s THR 56 Cb 0.00 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 1o5p s THR 56 CO -0.06 0.33 1.98 0.00 -0.69 0.00 0.00 174.62 176.18 1o5p s ALA 57 N -1.34 2.60 0.00 7.40 0.00 -1.11 -4.70 121.76 124.62 1o5p s ALA 57 Ca 0.29 0.25 0.00 0.00 0.00 0.00 0.00 51.96 52.50 1o5p s ALA 57 Cb -0.13 -4.10 0.00 0.00 0.00 0.00 0.00 23.12 18.89 1o5p s ALA 57 CO 0.17 -3.04 0.00 -0.40 0.00 0.00 0.00 175.76 172.49 1o5p n ASP 58 N 11.60 0.00 -0.12 0.00 5.75 -1.26 0.30 116.55 132.82 1o5p n ASP 58 Ca 0.26 0.00 -0.05 0.00 -0.01 0.00 0.00 54.79 54.99 1o5p n ASP 58 Cb 0.48 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.58 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 -2.00 0.21 0.00 2.12 0.00 -1.92 -3.13 119.26 114.54 1o5p h ALA 59 Ca 0.00 0.15 -0.30 0.00 0.00 0.00 0.00 54.91 54.77 1o5p h ALA 59 Cb 0.00 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 1o5p h ALA 59 CO 0.00 -0.49 -2.12 -1.71 0.00 0.00 0.00 179.25 174.93 1o5p n ASN 60 N -5.33 1.62 0.00 0.00 2.85 -1.26 -4.56 115.26 108.57 1o5p n ASN 60 Ca 0.02 -0.04 0.00 0.00 -0.11 0.00 0.00 54.58 54.45 1o5p n ASN 60 Cb 0.25 0.41 0.00 0.00 1.24 0.00 0.00 39.78 41.67 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 2.22 0.70 3.67 8.20 0.00 -1.18 -1.93 105.19 116.87 1o5p n GLY 61 Ca -0.30 -0.76 -0.35 0.00 0.00 0.00 0.00 46.02 44.60 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 -1.09 5.93 -0.19 1.61 0.01 -1.26 -2.44 113.70 116.28 1o5p s SER 62 Ca 0.00 0.13 -0.04 0.00 1.31 0.00 0.00 55.95 57.35 1o5p s SER 62 Cb 0.00 -2.04 0.06 0.00 0.21 0.00 0.00 66.02 64.25 1o5p s SER 62 CO 0.00 0.14 0.07 0.00 0.41 0.00 0.00 173.24 173.87 1o5p s ALA 63 N 0.57 0.70 -0.18 1.44 0.00 0.12 -4.60 121.76 119.79 1o5p s ALA 63 Ca 0.06 -0.57 0.01 0.00 0.00 0.00 0.00 51.96 51.46 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 0.00 -1.23 -0.18 -1.12 0.00 0.00 0.00 175.76 173.24 1o5p s SER 64 N 2.01 3.17 -0.04 0.00 0.01 -1.26 0.10 113.70 117.69 1o5p s SER 64 Ca 0.02 -0.69 -0.06 0.00 1.31 0.00 0.00 55.95 56.52 1o5p s SER 64 Cb -0.16 -1.42 0.01 0.00 0.21 0.00 0.00 66.02 64.66 1o5p s SER 64 CO -0.12 -0.03 0.15 0.28 0.41 0.00 0.00 173.24 173.94 1o5p s THR 65 N 1.32 0.03 0.02 1.44 -1.32 -0.56 -4.99 115.64 111.59 1o5p s THR 65 Ca 0.04 -0.26 -0.03 0.00 -1.21 0.00 0.00 61.69 60.22 1o5p s THR 65 Cb -0.14 -0.31 -0.04 0.00 -1.51 0.00 0.00 72.50 70.50 1o5p s THR 65 CO -0.12 -0.14 0.22 -0.94 -2.21 0.00 0.00 174.62 171.43 1o5p s SER 66 N -0.47 6.41 0.20 8.08 1.04 -1.26 -2.03 113.70 125.67 1o5p s SER 66 Ca -0.06 0.40 -0.09 0.00 0.48 0.00 0.00 55.95 56.69 1o5p s SER 66 Cb -0.04 -2.02 -0.01 0.00 0.10 0.00 0.00 66.02 64.05 1o5p s SER 66 CO 0.01 0.22 0.32 -1.48 0.98 0.00 0.00 173.24 173.29 1o5p s LEU 67 N -2.09 0.77 -0.21 2.42 0.05 0.23 -4.94 118.68 114.91 1o5p s LEU 67 Ca 0.30 -1.00 -0.16 0.00 0.05 0.00 0.00 54.13 53.32 1o5p s LEU 67 Cb -0.13 1.22 -0.04 0.00 -2.05 0.00 0.00 46.19 45.19 1o5p s LEU 67 CO 0.21 -0.97 0.40 0.42 -0.55 0.00 0.00 176.35 175.85 1o5p s THR 68 N -4.03 5.20 0.02 5.48 -4.23 -1.02 0.69 115.64 117.74 1o5p s THR 68 Ca 0.24 0.69 0.02 0.00 -1.18 0.00 0.00 61.69 61.46 1o5p s THR 68 Cb 0.03 -3.73 -0.01 0.00 1.34 0.00 0.00 72.50 70.13 1o5p s THR 68 CO 0.06 0.24 -0.06 0.68 -0.54 0.00 0.00 174.62 175.00 1o5p s VAL 69 N 1.39 0.43 0.31 2.29 -7.23 -0.88 -4.08 120.40 112.62 1o5p s VAL 69 Ca 0.19 -0.63 -0.01 0.00 -1.81 0.00 0.00 61.98 59.72 1o5p s VAL 69 Cb -0.15 -0.44 0.00 0.00 0.56 0.00 0.00 36.38 36.36 1o5p s VAL 69 CO 0.08 -0.15 0.41 -2.11 -0.31 0.00 0.00 175.10 173.02 1o5p n ARG 70 N 2.22 0.59 0.00 4.82 1.85 -1.26 -4.17 116.66 120.72 1o5p n ARG 70 Ca -0.18 -2.53 0.00 0.00 -1.00 0.00 0.00 57.85 54.14 1o5p n ARG 70 Cb 0.57 2.39 0.00 0.00 -1.05 0.00 0.00 32.46 34.36 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 -0.52 0.00 -1.95 2.89 1.85 -1.26 -4.54 116.66 113.14 1o5p n ARG 71 Ca 0.01 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.49 1o5p n ARG 71 Cb 0.52 -0.09 0.03 0.00 -1.05 0.00 0.00 32.46 31.86 1o5p n ARG 71 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 1o5p s SER 72 N -2.50 5.53 -0.25 2.89 0.01 -1.26 -1.84 113.70 116.28 1o5p s SER 72 Ca 0.00 2.59 -0.26 0.00 1.31 0.00 0.00 55.95 59.59 1o5p s SER 72 Cb 0.00 -2.62 0.11 0.00 0.21 0.00 0.00 66.02 63.72 1o5p s SER 72 CO 0.00 -1.38 0.95 0.72 0.41 0.00 0.00 173.24 173.94 1o5p s PHE 73 N -1.40 -0.53 -0.37 2.43 -0.71 -0.59 -4.82 117.98 111.99 1o5p s PHE 73 Ca 0.70 1.24 -0.37 0.00 -1.04 0.00 0.00 56.93 57.45 1o5p s PHE 73 Cb -0.36 0.36 -0.16 0.00 -1.21 0.00 0.00 43.02 41.65 1o5p s PHE 73 CO 0.43 -0.29 1.25 0.39 -1.34 0.00 0.00 175.22 175.66 1o5p n GLU 74 N 2.05 0.00 -1.81 1.99 -0.58 -1.26 -1.19 120.64 119.84 1o5p n GLU 74 Ca -0.13 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.26 1o5p n GLU 74 Cb 0.56 -1.20 -0.00 0.00 -0.57 0.00 0.00 31.44 30.22 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 3.06 5.08 3.32 0.62 0.00 -0.51 -2.55 105.19 114.22 1o5p n GLY 75 Ca 0.24 -2.22 -0.61 0.00 0.00 0.00 0.00 46.02 43.43 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 0.22 1.34 -2.95 1.61 3.01 0.63 -2.32 117.46 118.99 1o5p n PHE 76 Ca 0.52 0.88 -0.41 0.00 1.01 0.00 0.00 57.45 59.45 1o5p n PHE 76 Cb 0.36 -2.19 -0.04 0.00 -0.01 0.00 0.00 39.48 37.60 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 4.72 4.24 -0.29 4.37 2.96 -0.65 -1.91 118.68 132.11 1o5p s LEU 77 Ca 1.11 1.18 -0.02 0.00 -0.22 0.00 0.00 54.13 56.18 1o5p s LEU 77 Cb -1.45 -3.17 -0.03 0.00 0.50 0.00 0.00 46.19 42.04 1o5p s LEU 77 CO 0.70 -0.28 1.38 0.33 -1.32 0.00 0.00 176.35 177.16 1o5p n PHE 78 N 4.60 0.43 -2.00 5.38 7.35 -1.22 -2.90 117.46 129.10 1o5p n PHE 78 Ca 0.02 -0.93 0.00 0.00 -0.76 0.00 0.00 57.45 55.78 1o5p n PHE 78 Cb 0.50 -0.95 0.00 0.00 0.35 0.00 0.00 39.48 39.38 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 4.37 0.00 0.00 -2.13 -0.08 -1.26 -4.98 116.55 112.47 1o5p n ASP 79 Ca 0.16 -1.00 0.00 0.00 -1.51 0.00 0.00 54.79 52.44 1o5p n ASP 79 Cb 0.08 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.54 1o5p n ASP 79 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1o5p n GLY 80 N 0.00 2.77 3.93 0.27 0.00 -1.14 -4.99 105.19 106.02 1o5p n GLY 80 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.05 5.10 -0.13 2.61 -4.23 -1.26 -4.96 115.64 111.72 1o5p s THR 81 Ca 0.00 -0.30 -0.05 0.00 -1.18 0.00 0.00 61.69 60.17 1o5p s THR 81 Cb 0.00 -3.80 -0.04 0.00 1.34 0.00 0.00 72.50 70.00 1o5p s THR 81 CO 0.00 -0.43 0.04 0.00 -0.54 0.00 0.00 174.62 173.69 1o5p s ARG 82 N -3.94 3.42 0.24 3.99 1.70 -1.26 -1.64 118.95 121.46 1o5p s ARG 82 Ca 0.41 -0.35 0.25 0.00 -0.47 0.00 0.00 55.73 55.57 1o5p s ARG 82 Cb -0.10 -3.00 0.52 0.00 -0.57 0.00 0.00 34.95 31.80 1o5p s ARG 82 CO 0.33 0.55 1.57 2.35 -1.08 0.00 0.00 175.30 179.02 1o5p h TRP 83 N 5.71 0.00 0.00 5.89 7.01 -1.79 -3.46 115.95 129.32 1o5p h TRP 83 Ca -0.46 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.54 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 0.62 0.00 0.00 0.41 -2.79 0.00 0.00 178.44 176.68 1o5p n GLY 84 N 1.26 1.25 3.57 2.65 0.00 -1.26 -4.87 105.19 107.78 1o5p n GLY 84 Ca 0.04 -2.16 -0.39 0.00 0.00 0.00 0.00 46.02 43.51 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 3.21 -0.48 2.61 -4.23 -1.26 -1.42 115.64 112.61 1o5p s THR 85 Ca 0.00 0.16 -0.28 0.00 -1.18 0.00 0.00 61.69 60.39 1o5p s THR 85 Cb 0.00 -3.43 0.01 0.00 1.34 0.00 0.00 72.50 70.42 1o5p s THR 85 CO 0.00 -0.37 1.48 -0.69 -0.54 0.00 0.00 174.62 174.50 1o5p s VAL 86 N 9.60 3.78 -0.26 2.29 1.01 -0.33 -4.60 120.40 131.89 1o5p s VAL 86 Ca 0.85 0.74 -0.29 0.00 0.00 0.00 0.00 61.98 63.28 1o5p s VAL 86 Cb -0.19 -4.23 -0.03 0.00 0.00 0.00 0.00 36.38 31.93 1o5p s VAL 86 CO 0.27 -0.90 1.80 -1.81 0.00 0.00 0.00 175.10 174.47 1o5p s ASP 87 N 4.60 6.02 0.00 3.32 1.11 -1.26 -1.54 116.67 128.91 1o5p s ASP 87 Ca 0.60 1.55 0.01 0.00 0.18 0.00 0.00 52.55 54.89 1o5p s ASP 87 Cb -0.13 -2.53 0.07 0.00 1.07 0.00 0.00 42.92 41.41 1o5p s ASP 87 CO 0.29 -1.56 0.85 0.00 1.18 0.00 0.00 175.17 175.92 1o5p n THR 89 N -1.29 0.00 -0.11 0.00 -2.24 -1.26 -4.11 114.28 105.27 1o5p n THR 89 Ca 0.01 -0.11 -0.22 0.00 -2.27 0.00 0.00 64.05 61.45 1o5p n THR 89 Cb 0.01 0.21 -0.08 0.00 -2.10 0.00 0.00 70.33 68.37 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 -0.70 1.22 -4.05 4.28 -2.24 0.06 -5.04 114.28 107.81 1o5p n THR 90 Ca 0.14 -0.34 -0.24 0.00 -2.27 0.00 0.00 64.05 61.34 1o5p n THR 90 Cb 0.32 -1.69 -0.01 0.00 -2.10 0.00 0.00 70.33 66.84 1o5p n THR 90 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1o5p n ALA 91 N -3.82 0.63 -2.74 6.98 0.00 -1.21 -5.10 120.51 115.25 1o5p n ALA 91 Ca -0.43 -1.91 -0.39 0.00 0.00 0.00 0.00 53.44 50.72 1o5p n ALA 91 Cb 0.83 0.86 -0.11 0.00 0.00 0.00 0.00 19.45 21.02 1o5p n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o5p s ALA 92 N -2.70 3.38 -0.24 0.00 0.00 -1.26 -4.71 121.76 116.24 1o5p s ALA 92 Ca 0.19 -1.27 -0.14 0.00 0.00 0.00 0.00 51.96 50.74 1o5p s ALA 92 Cb -0.02 -2.44 -0.04 0.00 0.00 0.00 0.00 23.12 20.63 1o5p s ALA 92 CO 0.12 -0.77 0.32 0.00 0.00 0.00 0.00 175.76 175.44 1o5p s GLN 94 N 1.59 2.86 -0.41 0.00 1.11 -0.77 -2.45 119.66 121.59 1o5p s GLN 94 Ca 0.14 -0.59 -0.14 0.00 0.01 0.00 0.00 55.36 54.78 1o5p s GLN 94 Cb -0.15 -2.72 0.02 0.00 -1.01 0.00 0.00 33.01 29.15 1o5p s GLN 94 CO 0.08 0.62 0.29 0.08 0.01 0.00 0.00 175.29 176.38 1o5p s VAL 95 N -1.15 5.13 0.08 1.09 1.01 0.12 -2.28 120.40 124.40 1o5p s VAL 95 Ca 0.21 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.47 1o5p s VAL 95 Cb -0.12 -3.87 -0.00 0.00 0.00 0.00 0.00 36.38 32.39 1o5p s VAL 95 CO 0.12 -0.31 0.10 0.61 0.00 0.00 0.00 175.10 175.62 1o5p n GLY 96 N 5.13 3.12 3.53 4.51 0.00 -1.07 0.29 105.19 120.71 1o5p n GLY 96 Ca -0.11 -1.50 -0.29 0.00 0.00 0.00 0.00 46.02 44.11 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 -3.60 0.99 4.32 -1.25 -2.22 117.00 115.24 1o5p n LEU 97 Ca 0.01 -2.96 -0.07 0.00 -0.02 0.00 0.00 56.01 52.97 1o5p n LEU 97 Cb 0.14 0.23 -0.02 0.00 -1.62 0.00 0.00 43.42 42.15 1o5p n LEU 97 CO 0.07 -0.47 0.67 -0.94 -1.22 0.00 0.00 177.39 175.50 1o5p s SER 98 N -3.79 -0.31 0.00 -1.43 1.04 0.16 -4.33 113.70 105.05 1o5p s SER 98 Ca 0.09 -0.17 0.20 0.00 0.48 0.00 0.00 55.95 56.54 1o5p s SER 98 Cb -0.01 0.45 -0.22 0.00 0.10 0.00 0.00 66.02 66.34 1o5p s SER 98 CO 0.05 -0.78 0.87 0.47 0.98 0.00 0.00 173.24 174.84 1o5p n ASP 99 N -0.35 0.97 -1.20 7.02 8.00 -1.22 0.16 116.55 129.93 1o5p n ASP 99 Ca -0.08 -0.99 -0.06 0.00 0.71 0.00 0.00 54.79 54.37 1o5p n ASP 99 Cb 0.62 1.00 0.02 0.00 -0.02 0.00 0.00 41.12 42.73 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 -1.47 -0.32 0.00 2.24 0.00 -1.26 -4.77 120.51 114.92 1o5p n ALA 100 Ca 0.04 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1o5p n ALA 100 Cb 0.32 -1.69 0.00 0.00 0.00 0.00 0.00 19.45 18.08 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 -2.77 1.48 0.00 0.00 0.00 -1.26 -5.04 120.51 112.92 1o5p n ALA 101 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1o5p n ALA 101 Cb 0.52 0.06 0.00 0.00 0.00 0.00 0.00 19.45 20.03 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 1.26 0.18 3.35 0.00 0.00 -1.26 -5.15 105.19 103.58 1o5p n GLY 102 Ca 0.00 -0.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.87 -0.58 1.61 5.03 -1.26 -5.06 115.26 113.13 1o5p n ASN 103 Ca 0.00 -2.55 0.00 0.00 0.87 0.00 0.00 54.58 52.90 1o5p n ASN 103 Cb 0.00 3.18 0.00 0.00 -1.02 0.00 0.00 39.78 41.94 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 -0.50 1.05 1.45 7.41 0.00 -1.26 -3.39 105.19 109.95 1o5p n GLY 104 Ca -0.06 -0.77 -0.07 0.00 0.00 0.00 0.00 46.02 45.12 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 -0.63 -2.63 1.61 -0.02 -1.26 -4.96 135.00 127.12 1o5p n PRO 105 Ca 0.00 -0.35 -0.22 0.00 -2.02 0.00 0.00 63.50 60.91 1o5p n PRO 105 Cb 0.00 -0.71 0.11 0.00 -0.02 0.00 0.00 33.50 32.88 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 -1.12 0.03 -4.38 -0.52 1.02 -1.26 -4.71 120.64 109.70 1o5p n GLU 106 Ca 0.03 -2.77 -0.24 0.00 -0.02 0.00 0.00 57.16 54.16 1o5p n GLU 106 Cb 0.14 -0.58 -0.09 0.00 -0.02 0.00 0.00 31.44 30.90 1o5p n GLU 106 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1o5p s GLY 107 N -4.99 1.76 -0.23 0.62 0.00 -1.26 -3.85 107.32 99.37 1o5p s GLY 107 Ca 0.65 -1.72 -0.12 0.00 0.00 0.00 0.00 44.72 43.53 1o5p s GLY 107 CO 0.43 -1.78 0.21 0.14 0.00 0.00 0.00 173.10 172.10 1o5p s VAL 108 N -2.25 5.32 -0.11 1.40 1.01 0.15 -4.73 120.40 121.19 1o5p s VAL 108 Ca 0.29 0.30 -0.29 0.00 0.00 0.00 0.00 61.98 62.27 1o5p s VAL 108 Cb -0.06 -3.55 -0.03 0.00 0.00 0.00 0.00 36.38 32.74 1o5p s VAL 108 CO 0.16 0.32 1.38 0.00 0.00 0.00 0.00 175.10 176.96 1o5p s ALA 109 N 1.13 3.63 0.44 5.51 0.00 -1.26 0.10 121.76 131.32 1o5p s ALA 109 Ca 0.10 0.64 0.06 0.00 0.00 0.00 0.00 51.96 52.76 1o5p s ALA 109 Cb -0.14 -3.64 0.01 0.00 0.00 0.00 0.00 23.12 19.35 1o5p s ALA 109 CO 0.05 -1.18 0.61 0.96 0.00 0.00 0.00 175.76 176.21 1o5p s ILE 110 N 3.44 3.11 0.07 0.00 -4.36 -1.03 -4.84 121.20 117.59 1o5p s ILE 110 Ca 0.61 -0.89 0.02 0.00 -0.26 0.00 0.00 60.65 60.13 1o5p s ILE 110 Cb -0.26 -3.08 -0.03 0.00 1.25 0.00 0.00 42.46 40.34 1o5p s ILE 110 CO 0.20 -0.04 -0.07 -0.55 0.24 0.00 0.00 174.94 174.72 1o5p s SER 111 N -4.34 1.03 -0.25 4.36 0.15 0.18 -4.73 113.70 110.10 1o5p s SER 111 Ca 0.54 -0.79 0.01 0.00 0.70 0.00 0.00 55.95 56.41 1o5p s SER 111 Cb -0.10 0.06 0.06 0.00 -1.71 0.00 0.00 66.02 64.34 1o5p s SER 111 CO 0.34 -0.34 -0.06 -0.36 1.20 0.00 0.00 173.24 174.03 1o5p s PHE 112 N -2.55 2.63 -0.53 3.44 0.40 -1.26 -2.88 117.98 117.23 1o5p s PHE 112 Ca 0.02 -1.94 0.00 0.00 -0.60 0.00 0.00 56.93 54.41 1o5p s PHE 112 Cb -0.02 -1.72 0.00 0.00 0.51 0.00 0.00 43.02 41.79 1o5p s PHE 112 CO -0.02 -0.81 0.13 0.27 0.70 0.00 0.00 175.22 175.49