#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ott s ARG 3 N 0.00 0.98 -0.30 1.45 0.52 0.55 -4.94 118.95 117.22 1ott s ARG 3 Ca 0.00 -0.84 0.02 0.00 -0.52 0.00 0.00 55.73 54.39 1ott s ARG 3 Cb 0.00 -1.02 0.09 0.00 0.52 0.00 0.00 34.95 34.53 1ott s ARG 3 CO 0.00 0.25 0.02 -1.17 0.02 0.00 0.00 175.30 174.41 1ott s LEU 4 N -1.30 3.57 -0.37 2.53 2.96 -1.26 -1.44 118.68 123.38 1ott s LEU 4 Ca 0.02 -1.73 -0.02 0.00 -0.22 0.00 0.00 54.13 52.18 1ott s LEU 4 Cb -0.08 -1.36 0.09 0.00 0.50 0.00 0.00 46.19 45.34 1ott s LEU 4 CO 0.02 -0.33 0.13 -0.22 -1.32 0.00 0.00 176.35 174.62 1ott s LEU 5 N 1.19 4.80 -0.25 -0.68 1.98 -0.12 -1.93 118.68 123.66 1ott s LEU 5 Ca 0.04 -1.82 -0.12 0.00 -2.89 0.00 0.00 54.13 49.34 1ott s LEU 5 Cb -0.19 -1.77 -0.05 0.00 0.66 0.00 0.00 46.19 44.84 1ott s LEU 5 CO -0.11 -0.44 0.24 -1.83 -1.89 0.00 0.00 176.35 172.32 1ott s GLU 6 N 1.15 4.03 0.00 1.98 1.03 -1.26 -0.41 118.70 125.22 1ott s GLU 6 Ca 0.05 -0.16 0.00 0.00 0.03 0.00 0.00 54.97 54.88 1ott s GLU 6 Cb -0.21 -3.60 0.00 0.00 -0.80 0.00 0.00 34.13 29.51 1ott s GLU 6 CO -0.04 -0.10 0.00 -1.13 -1.33 0.00 0.00 175.26 172.67 1ott n SER 7 N 4.77 0.00 0.00 0.83 3.41 0.97 -4.40 113.62 119.20 1ott n SER 7 Ca -0.13 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.48 1ott n SER 7 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 1ott n SER 7 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ott n GLY 8 N 5.00 1.72 0.79 5.00 0.00 -1.26 -2.98 105.19 113.46 1ott n GLY 8 Ca 0.00 -0.13 -0.06 0.00 0.00 0.00 0.00 46.02 45.84 1ott n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ott n GLY 9 N 0.00 -0.56 0.00 -0.02 0.00 -1.26 -4.82 105.19 98.53 1ott n GLY 9 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1ott n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ott n GLY 10 N 0.89 0.57 3.54 -0.02 0.00 1.72 -4.89 105.19 107.00 1ott n GLY 10 Ca -0.00 -1.45 -0.34 0.00 0.00 0.00 0.00 46.02 44.22 1ott n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ott s LEU 11 N 0.00 3.46 -0.03 0.99 2.96 -1.26 0.15 118.68 124.94 1ott s LEU 11 Ca 0.00 -0.07 -0.04 0.00 -0.22 0.00 0.00 54.13 53.80 1ott s LEU 11 Cb 0.00 -1.86 0.01 0.00 0.50 0.00 0.00 46.19 44.84 1ott s LEU 11 CO 0.00 0.15 0.10 0.68 -1.32 0.00 0.00 176.35 175.96 1ott s VAL 12 N 0.49 0.01 0.22 1.68 -7.23 -0.53 -4.97 120.40 110.08 1ott s VAL 12 Ca -0.01 -0.11 -0.26 0.00 -1.81 0.00 0.00 61.98 59.79 1ott s VAL 12 Cb -0.14 -0.19 -0.09 0.00 0.56 0.00 0.00 36.38 36.53 1ott s VAL 12 CO 0.02 -0.06 0.84 0.00 -0.31 0.00 0.00 175.10 175.58 1ott s GLN 13 N -0.16 4.60 0.31 4.82 -2.07 -1.21 -0.50 119.66 125.45 1ott s GLN 13 Ca -0.02 1.23 -0.25 0.00 -1.82 0.00 0.00 55.36 54.50 1ott s GLN 13 Cb -0.02 -3.14 -0.16 0.00 -1.09 0.00 0.00 33.01 28.60 1ott s GLN 13 CO 0.00 0.49 0.40 -2.30 -1.32 0.00 0.00 175.29 172.56 1ott n PRO 14 N 1.29 0.16 -1.44 9.60 -0.02 -1.26 -1.46 135.00 141.86 1ott n PRO 14 Ca -0.03 0.06 -0.06 0.00 -2.02 0.00 0.00 63.50 61.44 1ott n PRO 14 Cb 0.49 -1.12 -0.02 0.00 -0.02 0.00 0.00 33.50 32.83 1ott n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ott n GLY 15 N 2.04 0.66 2.16 -1.23 0.00 0.54 -4.89 105.19 104.47 1ott n GLY 15 Ca 0.14 -0.73 -0.14 0.00 0.00 0.00 0.00 46.02 45.30 1ott n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ott n GLY 16 N -1.88 2.60 2.85 -0.02 0.00 -0.53 -4.44 105.19 103.76 1ott n GLY 16 Ca -0.07 -2.23 -0.15 0.00 0.00 0.00 0.00 46.02 43.58 1ott n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ott s SER 17 N -2.88 0.07 -0.02 1.61 0.01 -1.25 -1.70 113.70 109.53 1ott s SER 17 Ca 0.23 0.19 0.03 0.00 1.31 0.00 0.00 55.95 57.71 1ott s SER 17 Cb -0.02 0.08 -0.00 0.00 0.21 0.00 0.00 66.02 66.29 1ott s SER 17 CO 0.14 -0.15 -0.10 -1.48 0.41 0.00 0.00 173.24 172.06 1ott s LEU 18 N 1.25 1.88 -0.91 2.44 2.34 -0.96 -4.96 118.68 119.77 1ott s LEU 18 Ca -0.08 -0.21 -0.14 0.00 0.06 0.00 0.00 54.13 53.77 1ott s LEU 18 Cb -0.12 -0.59 0.21 0.00 -0.56 0.00 0.00 46.19 45.13 1ott s LEU 18 CO -0.05 0.10 0.91 -0.75 -1.06 0.00 0.00 176.35 175.50 1ott s LYS 19 N 0.01 3.72 0.20 1.48 2.20 -1.26 -2.35 119.74 123.75 1ott s LYS 19 Ca -0.00 -2.48 -0.30 0.00 -0.36 0.00 0.00 55.97 52.82 1ott s LYS 19 Cb -0.07 -4.56 -0.09 0.00 -1.51 0.00 0.00 37.83 31.60 1ott s LYS 19 CO 0.00 -1.38 1.38 -0.51 -0.36 0.00 0.00 175.35 174.48 1ott s LEU 20 N 0.39 4.40 0.32 5.43 1.43 0.38 -4.60 118.68 126.42 1ott s LEU 20 Ca 0.23 2.50 0.08 0.00 -1.03 0.00 0.00 54.13 55.91 1ott s LEU 20 Cb -0.09 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.48 1ott s LEU 20 CO -0.09 -0.62 0.18 -0.44 0.23 0.00 0.00 176.35 175.61 1ott s SER 21 N 0.49 4.96 -0.28 2.29 0.01 -1.16 -2.05 113.70 117.96 1ott s SER 21 Ca 0.59 -0.61 0.02 0.00 1.31 0.00 0.00 55.95 57.27 1ott s SER 21 Cb -0.39 -0.90 0.17 0.00 0.21 0.00 0.00 66.02 65.11 1ott s SER 21 CO 0.38 -0.25 0.47 0.00 0.41 0.00 0.00 173.24 174.25 1ott s ALA 23 N 2.65 3.38 0.11 0.00 0.00 0.45 -1.17 121.76 127.19 1ott s ALA 23 Ca 0.11 0.05 0.03 0.00 0.00 0.00 0.00 51.96 52.15 1ott s ALA 23 Cb -0.12 -2.93 -0.04 0.00 0.00 0.00 0.00 23.12 20.02 1ott s ALA 23 CO -0.26 -0.17 0.16 0.00 0.00 0.00 0.00 175.76 175.49 1ott s ALA 24 N 0.96 3.72 -0.20 0.00 0.00 -0.58 -0.95 121.76 124.72 1ott s ALA 24 Ca 0.35 -1.04 -0.28 0.00 0.00 0.00 0.00 51.96 50.99 1ott s ALA 24 Cb -0.17 -1.55 0.11 0.00 0.00 0.00 0.00 23.12 21.51 1ott s ALA 24 CO 0.16 0.66 0.90 -1.54 0.00 0.00 0.00 175.76 175.94 1ott s SER 25 N -2.76 -0.51 0.00 0.00 1.04 -0.52 -4.88 113.70 106.06 1ott s SER 25 Ca 0.32 0.79 0.00 0.00 0.48 0.00 0.00 55.95 57.54 1ott s SER 25 Cb -0.12 0.74 0.00 0.00 0.10 0.00 0.00 66.02 66.74 1ott s SER 25 CO 0.25 -0.31 0.00 0.61 0.98 0.00 0.00 173.24 174.76 1ott n GLY 26 N 1.59 0.99 3.80 7.32 0.00 -1.26 0.21 105.19 117.84 1ott n GLY 26 Ca -0.13 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1ott n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ott s PHE 27 N -2.00 -0.01 -0.37 1.61 -0.71 -1.26 -3.78 117.98 111.46 1ott s PHE 27 Ca 0.00 -0.18 -0.26 0.00 -1.04 0.00 0.00 56.93 55.45 1ott s PHE 27 Cb 0.00 0.59 0.02 0.00 -1.21 0.00 0.00 43.02 42.42 1ott s PHE 27 CO 0.00 -0.47 0.92 0.34 -1.34 0.00 0.00 175.22 174.68 1ott s ASP 28 N -3.31 6.67 0.17 1.98 2.15 -1.26 -4.94 116.67 118.13 1ott s ASP 28 Ca 0.20 0.56 -0.14 0.00 0.43 0.00 0.00 52.55 53.60 1ott s ASP 28 Cb 0.01 -2.46 0.11 0.00 -0.30 0.00 0.00 42.92 40.27 1ott s ASP 28 CO -0.00 -0.86 1.78 0.22 -0.17 0.00 0.00 175.17 176.13 1ott h TYR 29 N 8.51 0.43 -0.90 -5.34 3.20 -1.95 -3.41 116.97 117.50 1ott h TYR 29 Ca -0.23 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.66 1ott h TYR 29 Cb 1.08 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 39.22 1ott h TYR 29 CO 0.83 0.21 0.00 0.43 -1.64 0.00 0.00 178.16 178.00 1ott n SER 30 N -4.90 -1.81 0.00 -2.11 7.64 -1.26 -2.86 113.62 108.32 1ott n SER 30 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.91 1ott n SER 30 Cb 0.12 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 1ott n SER 30 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1ott n ARG 31 N -1.81 0.00 -5.09 1.43 5.12 -1.26 -4.83 116.66 110.22 1ott n ARG 31 Ca 0.00 0.00 -0.32 0.00 -1.93 0.00 0.00 57.85 55.60 1ott n ARG 31 Cb 0.00 -2.75 -0.15 0.00 -1.16 0.00 0.00 32.46 28.40 1ott n ARG 31 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 1ott s TYR 32 N -0.57 2.58 -0.49 -1.55 1.51 -1.14 -4.98 117.35 112.71 1ott s TYR 32 Ca 0.00 -0.65 -0.22 0.00 -1.01 0.00 0.00 57.07 55.19 1ott s TYR 32 Cb 0.00 -1.67 0.04 0.00 -0.11 0.00 0.00 41.96 40.22 1ott s TYR 32 CO 0.00 -0.17 0.75 -1.58 -1.11 0.00 0.00 175.55 173.44 1ott s TRP 33 N -0.08 2.97 0.20 2.71 0.52 -1.26 -3.78 118.94 120.21 1ott s TRP 33 Ca -0.05 -0.12 -0.17 0.00 0.02 0.00 0.00 56.10 55.79 1ott s TRP 33 Cb -0.14 -3.67 -0.08 0.00 -1.15 0.00 0.00 33.47 28.43 1ott s TRP 33 CO 0.04 -1.07 0.64 -1.64 0.02 0.00 0.00 176.95 174.94 1ott s MET 34 N 3.19 4.10 0.31 4.98 -1.94 -1.22 -0.55 119.30 128.16 1ott s MET 34 Ca 0.24 0.67 0.05 0.00 -1.71 0.00 0.00 55.69 54.94 1ott s MET 34 Cb -0.15 -2.86 -0.02 0.00 2.01 0.00 0.00 34.83 33.82 1ott s MET 34 CO 0.18 0.41 0.31 -1.13 -0.01 0.00 0.00 175.02 174.77 1ott n SER 35 N 0.63 -0.80 -3.99 3.03 3.41 -1.05 -0.90 113.62 113.96 1ott n SER 35 Ca -0.03 -2.92 -0.13 0.00 -0.26 0.00 0.00 58.87 55.53 1ott n SER 35 Cb 0.52 1.73 -0.12 0.00 -0.26 0.00 0.00 64.21 66.07 1ott n SER 35 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1ott s TRP 36 N -3.19 0.43 -0.05 7.33 0.52 -0.96 -2.13 118.94 120.88 1ott s TRP 36 Ca 0.34 -0.32 -0.06 0.00 0.02 0.00 0.00 56.10 56.08 1ott s TRP 36 Cb 0.01 -0.27 0.01 0.00 -1.15 0.00 0.00 33.47 32.08 1ott s TRP 36 CO 0.24 -0.07 0.16 0.08 0.02 0.00 0.00 176.95 177.38 1ott s VAL 37 N -0.86 0.01 0.07 4.03 1.01 -0.37 -0.70 120.40 123.58 1ott s VAL 37 Ca -0.07 -0.08 0.09 0.00 0.00 0.00 0.00 61.98 61.92 1ott s VAL 37 Cb -0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 36.38 36.03 1ott s VAL 37 CO -0.00 -0.04 -0.24 0.00 0.00 0.00 0.00 175.10 174.82 1ott s ARG 38 N -0.07 1.49 -0.19 2.72 1.70 -0.81 -0.42 118.95 123.36 1ott s ARG 38 Ca -0.02 -1.09 0.00 0.00 -0.47 0.00 0.00 55.73 54.15 1ott s ARG 38 Cb -0.02 -1.71 0.02 0.00 -0.57 0.00 0.00 34.95 32.67 1ott s ARG 38 CO 0.00 0.43 -0.17 -1.14 -1.08 0.00 0.00 175.30 173.35 1ott s GLN 39 N -1.44 3.01 0.04 3.89 0.74 0.25 -1.44 119.66 124.70 1ott s GLN 39 Ca 0.10 -0.83 -0.28 0.00 0.05 0.00 0.00 55.36 54.40 1ott s GLN 39 Cb -0.10 -2.67 -0.04 0.00 1.10 0.00 0.00 33.01 31.30 1ott s GLN 39 CO 0.03 -0.23 0.89 0.00 -0.55 0.00 0.00 175.29 175.43 1ott s ALA 40 N 1.31 3.25 -0.46 1.58 0.00 -1.20 0.22 121.76 126.46 1ott s ALA 40 Ca 0.04 0.44 -0.42 0.00 0.00 0.00 0.00 51.96 52.02 1ott s ALA 40 Cb -0.14 -3.20 -0.18 0.00 0.00 0.00 0.00 23.12 19.61 1ott s ALA 40 CO -0.11 -0.09 1.74 -2.30 0.00 0.00 0.00 175.76 175.00 1ott n PRO 41 N 3.30 0.00 0.00 0.00 -0.02 -1.26 0.61 135.00 137.63 1ott n PRO 41 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 1ott n PRO 41 Cb 0.50 -1.39 0.00 0.00 -0.02 0.00 0.00 33.50 32.59 1ott n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ott n GLY 42 N 5.35 2.38 2.23 -1.23 0.00 -1.26 -5.00 105.19 107.66 1ott n GLY 42 Ca 0.40 -0.55 -0.18 0.00 0.00 0.00 0.00 46.02 45.69 1ott n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ott n LYS 43 N 0.00 -1.59 0.00 1.61 4.76 0.20 -5.10 118.16 118.04 1ott n LYS 43 Ca 0.00 -1.15 0.00 0.00 -2.87 0.00 0.00 58.31 54.29 1ott n LYS 43 Cb 0.00 -0.92 0.00 0.00 -1.84 0.00 0.00 35.03 32.27 1ott n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ott n GLY 44 N -1.15 1.25 3.59 0.72 0.00 -1.26 -4.47 105.19 103.86 1ott n GLY 44 Ca 0.10 -1.55 -0.30 0.00 0.00 0.00 0.00 46.02 44.26 1ott n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ott s LEU 45 N 0.00 3.10 -0.11 0.99 1.02 -1.26 -3.23 118.68 119.19 1ott s LEU 45 Ca 0.00 -0.36 -0.04 0.00 0.02 0.00 0.00 54.13 53.76 1ott s LEU 45 Cb 0.00 -1.88 0.05 0.00 0.02 0.00 0.00 46.19 44.38 1ott s LEU 45 CO 0.00 0.18 0.09 -0.54 0.02 0.00 0.00 176.35 176.10 1ott s LYS 46 N -2.21 0.01 0.25 1.70 1.02 -0.52 -4.96 119.74 115.03 1ott s LYS 46 Ca 0.22 0.18 -0.31 0.00 0.02 0.00 0.00 55.97 56.08 1ott s LYS 46 Cb -0.11 -1.12 -0.12 0.00 -0.52 0.00 0.00 37.83 35.96 1ott s LYS 46 CO 0.14 -0.50 1.66 1.87 -0.92 0.00 0.00 175.35 177.60 1ott n TRP 47 N 5.29 2.82 0.00 3.18 -0.00 -1.26 -1.93 117.44 125.54 1ott n TRP 47 Ca -0.05 0.15 0.00 0.00 -0.00 0.00 0.00 57.50 57.60 1ott n TRP 47 Cb 0.50 -2.64 0.00 0.00 -0.00 0.00 0.00 31.31 29.17 1ott n TRP 47 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 177.69 176.80 1ott n ILE 48 N 2.99 0.00 -3.74 5.87 2.08 0.12 -4.60 119.36 122.08 1ott n ILE 48 Ca 0.12 0.19 0.00 0.00 0.56 0.00 0.00 62.75 63.62 1ott n ILE 48 Cb 0.36 -1.03 0.00 0.00 -0.75 0.00 0.00 39.64 38.22 1ott n ILE 48 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1ott n GLY 49 N 2.18 4.01 3.63 7.39 0.00 -1.21 -1.20 105.19 119.98 1ott n GLY 49 Ca 0.00 -1.56 -0.13 0.00 0.00 0.00 0.00 46.02 44.33 1ott n GLY 49 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ott s GLU 50 N -1.52 0.82 -0.21 1.61 -1.05 -1.03 -2.27 118.70 115.06 1ott s GLU 50 Ca 0.00 1.01 -0.03 0.00 -0.15 0.00 0.00 54.97 55.80 1ott s GLU 50 Cb 0.00 0.38 0.07 0.00 -0.44 0.00 0.00 34.13 34.14 1ott s GLU 50 CO 0.00 -0.10 0.07 -1.50 0.95 0.00 0.00 175.26 174.67 1ott s ILE 51 N 0.49 0.35 1.09 1.83 2.07 -0.07 -2.60 121.20 124.35 1ott s ILE 51 Ca -0.01 -0.59 -0.21 0.00 -1.41 0.00 0.00 60.65 58.43 1ott s ILE 51 Cb -0.05 -0.99 0.03 0.00 0.13 0.00 0.00 42.46 41.58 1ott s ILE 51 CO -0.01 -0.34 -0.41 -0.46 -1.91 0.00 0.00 174.94 171.81 1ott n ASN 52 N 5.11 -2.55 0.00 4.50 6.94 -1.11 -3.43 115.26 124.72 1ott n ASN 52 Ca -0.07 -0.10 0.00 0.00 -0.02 0.00 0.00 54.58 54.39 1ott n ASN 52 Cb 0.46 -0.83 0.00 0.00 -2.36 0.00 0.00 39.78 37.05 1ott n ASN 52 CO 0.00 0.00 0.00 -2.65 -1.03 0.00 0.00 177.26 173.58 1ott n PRO 53 N -0.89 0.00 0.00 -0.53 -0.02 -1.25 -1.54 135.00 130.77 1ott n PRO 53 Ca -0.00 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1ott n PRO 53 Cb 0.66 -1.33 0.00 0.00 -0.02 0.00 0.00 33.50 32.81 1ott n PRO 53 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1ott n VAL 54 N -1.99 0.00 -2.15 -1.45 0.24 -1.26 -4.78 118.33 106.95 1ott n VAL 54 Ca 0.00 0.00 -0.08 0.00 -2.04 0.00 0.00 64.34 62.22 1ott n VAL 54 Cb 0.00 -0.31 -0.01 0.00 -1.47 0.00 0.00 33.84 32.05 1ott n VAL 54 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1ott n SER 55 N -0.47 -2.75 -0.66 -1.34 3.41 -0.59 -4.76 113.62 106.44 1ott n SER 55 Ca 0.00 0.27 0.04 0.00 -0.26 0.00 0.00 58.87 58.92 1ott n SER 55 Cb 0.00 -2.47 0.13 0.00 -0.26 0.00 0.00 64.21 61.61 1ott n SER 55 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1ott n SER 56 N -1.25 1.87 -3.72 4.04 3.41 -1.26 -4.74 113.62 111.97 1ott n SER 56 Ca -0.09 -2.11 -0.13 0.00 -0.26 0.00 0.00 58.87 56.28 1ott n SER 56 Cb 0.50 -0.30 -0.10 0.00 -0.26 0.00 0.00 64.21 64.05 1ott n SER 56 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1ott s THR 57 N -1.64 -0.00 -0.30 6.66 2.01 -1.26 -5.06 115.64 116.05 1ott s THR 57 Ca 0.19 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.20 1ott s THR 57 Cb 0.11 -0.64 0.19 0.00 0.01 0.00 0.00 72.50 72.17 1ott s THR 57 CO 0.10 0.00 0.61 -0.63 -0.69 0.00 0.00 174.62 174.02 1ott s ILE 58 N 0.30 -0.97 -0.02 1.82 1.01 -1.26 -2.75 121.20 119.33 1ott s ILE 58 Ca -0.00 0.00 0.08 0.00 0.00 0.00 0.00 60.65 60.72 1ott s ILE 58 Cb -0.03 -0.99 -0.02 0.00 0.01 0.00 0.00 42.46 41.42 1ott s ILE 58 CO -0.00 0.00 -0.25 0.20 0.00 0.00 0.00 174.94 174.89 1ott s ASN 59 N 2.85 3.18 0.49 3.58 0.01 -1.07 -4.98 114.94 119.00 1ott s ASN 59 Ca 0.17 -0.45 0.07 0.00 -0.71 0.00 0.00 52.86 51.94 1ott s ASN 59 Cb -0.13 -0.40 0.01 0.00 0.41 0.00 0.00 41.25 41.14 1ott s ASN 59 CO -0.23 0.32 0.39 -0.31 -1.51 0.00 0.00 177.10 175.76 1ott s TYR 60 N -0.64 2.11 0.83 2.20 1.51 -1.26 -2.47 117.35 119.62 1ott s TYR 60 Ca 0.10 -0.68 -0.12 0.00 -1.01 0.00 0.00 57.07 55.36 1ott s TYR 60 Cb -0.10 -2.03 0.09 0.00 -0.11 0.00 0.00 41.96 39.81 1ott s TYR 60 CO -0.01 -0.31 1.15 -0.08 -1.11 0.00 0.00 175.55 175.20 1ott s THR 61 N -2.64 2.22 -0.89 -0.71 -1.32 -0.34 -4.77 115.64 107.19 1ott s THR 61 Ca 0.41 0.07 -0.23 0.00 -1.21 0.00 0.00 61.69 60.74 1ott s THR 61 Cb -0.02 -2.98 -0.19 0.00 -1.51 0.00 0.00 72.50 67.79 1ott s THR 61 CO 0.25 -0.09 2.08 -2.65 -2.21 0.00 0.00 174.62 171.99 1ott n PRO 62 N -3.42 0.20 0.00 7.08 -0.02 -1.26 -4.75 135.00 132.82 1ott n PRO 62 Ca 0.07 -1.22 0.00 0.00 -2.02 0.00 0.00 63.50 60.33 1ott n PRO 62 Cb 0.60 -3.43 0.00 0.00 -0.02 0.00 0.00 33.50 30.65 1ott n PRO 62 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1ott n SER 63 N 17.40 0.38 0.00 2.55 3.41 -1.26 -5.15 113.62 130.95 1ott n SER 63 Ca 0.39 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.00 1ott n SER 63 Cb 0.45 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1ott n SER 63 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1ott n LEU 64 N 0.00 0.00 0.00 1.04 4.77 -1.26 -5.05 117.00 116.50 1ott n LEU 64 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1ott n LEU 64 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1ott n LEU 64 CO 0.00 0.00 0.01 0.29 -1.33 0.00 0.00 177.39 176.36 1ott n LYS 65 N 0.00 0.00 -2.13 3.23 4.76 -1.26 -4.67 118.16 118.09 1ott n LYS 65 Ca 0.00 0.00 -0.26 0.00 -2.87 0.00 0.00 58.31 55.18 1ott n LYS 65 Cb 0.00 -0.36 0.02 0.00 -1.84 0.00 0.00 35.03 32.85 1ott n LYS 65 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1ott n ASP 66 N -0.32 5.07 0.17 4.39 10.43 -1.26 -4.71 116.55 130.32 1ott n ASP 66 Ca 0.00 -3.74 -0.14 0.00 2.57 0.00 0.00 54.79 53.48 1ott n ASP 66 Cb 0.00 -0.43 -0.07 0.00 1.84 0.00 0.00 41.12 42.46 1ott n ASP 66 CO 0.00 0.00 0.00 0.50 -1.07 0.00 0.00 177.20 176.63 1ott h LYS 67 N 2.32 -0.49 -6.15 -1.24 1.63 -1.86 -3.37 116.57 107.41 1ott h LYS 67 Ca 0.37 0.03 -0.57 0.00 -0.85 0.00 0.00 60.65 59.63 1ott h LYS 67 Cb 1.26 0.11 -0.06 0.00 -0.60 0.00 0.00 32.23 32.95 1ott h LYS 67 CO 0.85 -0.33 -0.54 -0.06 -3.45 0.00 0.00 179.45 175.92 1ott s PHE 68 N -6.08 3.24 -0.48 1.91 2.99 -1.26 -0.99 117.98 117.32 1ott s PHE 68 Ca -0.16 0.03 0.06 0.00 0.00 0.00 0.00 56.93 56.86 1ott s PHE 68 Cb 0.07 -1.56 0.18 0.00 0.00 0.00 0.00 43.02 41.71 1ott s PHE 68 CO 0.64 0.52 0.61 0.42 -0.00 0.00 0.00 175.22 177.41 1ott s ILE 69 N -1.72 -0.61 0.31 0.64 1.01 -0.67 -4.96 121.20 115.20 1ott s ILE 69 Ca 0.32 -1.42 -0.27 0.00 0.00 0.00 0.00 60.65 59.28 1ott s ILE 69 Cb -0.10 -0.37 -0.10 0.00 0.01 0.00 0.00 42.46 41.91 1ott s ILE 69 CO 0.25 -0.36 0.97 -0.63 0.00 0.00 0.00 174.94 175.17 1ott s ILE 70 N 0.70 4.05 0.38 2.92 1.01 -1.26 -2.81 121.20 126.19 1ott s ILE 70 Ca 0.30 1.80 -0.09 0.00 0.00 0.00 0.00 60.65 62.66 1ott s ILE 70 Cb 0.00 -4.05 0.04 0.00 0.01 0.00 0.00 42.46 38.47 1ott s ILE 70 CO -0.09 0.23 0.66 -1.54 0.00 0.00 0.00 174.94 174.20 1ott n SER 71 N 0.77 -1.89 -3.54 3.58 3.41 -1.22 -4.99 113.62 109.74 1ott n SER 71 Ca 0.01 -2.76 -0.17 0.00 -0.26 0.00 0.00 58.87 55.69 1ott n SER 71 Cb 0.49 3.28 -0.06 0.00 -0.26 0.00 0.00 64.21 67.65 1ott n SER 71 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ott s ARG 72 N -2.43 1.01 -0.55 4.33 1.70 -1.26 -0.96 118.95 120.80 1ott s ARG 72 Ca 0.22 0.41 0.04 0.00 -0.47 0.00 0.00 55.73 55.93 1ott s ARG 72 Cb -0.03 0.48 0.14 0.00 -0.57 0.00 0.00 34.95 34.97 1ott s ARG 72 CO 0.16 -0.28 0.29 0.34 -1.08 0.00 0.00 175.30 174.73 1ott s ASP 73 N -0.87 4.36 0.19 -2.89 2.15 -0.59 -4.93 116.67 114.10 1ott s ASP 73 Ca -0.09 -3.13 0.10 0.00 0.43 0.00 0.00 52.55 49.86 1ott s ASP 73 Cb -0.01 -1.62 0.57 0.00 -0.30 0.00 0.00 42.92 41.56 1ott s ASP 73 CO 0.08 -0.21 1.26 0.59 -0.17 0.00 0.00 175.17 176.72 1ott n ASN 74 N 2.94 0.27 0.03 -0.34 3.02 -1.26 0.99 115.26 120.91 1ott n ASN 74 Ca 0.07 0.56 0.11 0.00 -0.03 0.00 0.00 54.58 55.30 1ott n ASN 74 Cb 0.33 -0.57 0.48 0.00 -0.61 0.00 0.00 39.78 39.40 1ott n ASN 74 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ott n ALA 75 N -1.57 2.03 -1.48 5.41 0.00 -1.26 -2.90 120.51 120.74 1ott n ALA 75 Ca -0.01 -0.05 0.03 0.00 0.00 0.00 0.00 53.44 53.40 1ott n ALA 75 Cb 0.13 -1.38 0.04 0.00 0.00 0.00 0.00 19.45 18.23 1ott n ALA 75 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ott n LYS 76 N -1.67 0.53 -3.77 0.00 5.02 0.28 -4.99 118.16 113.56 1ott n LYS 76 Ca 0.05 -1.36 -0.29 0.00 -2.02 0.00 0.00 58.31 54.69 1ott n LYS 76 Cb 0.28 -0.79 -0.05 0.00 -0.02 0.00 0.00 35.03 34.45 1ott n LYS 76 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1ott n ASP 77 N -0.40 -1.46 -4.34 4.39 9.92 -0.78 -4.70 116.55 119.18 1ott n ASP 77 Ca 0.04 -0.75 -0.32 0.00 -0.53 0.00 0.00 54.79 53.23 1ott n ASP 77 Cb 0.63 -1.30 -0.15 0.00 -0.64 0.00 0.00 41.12 39.65 1ott n ASP 77 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1ott s THR 78 N -2.72 2.37 0.08 -3.53 2.01 -1.18 -1.52 115.64 111.14 1ott s THR 78 Ca 0.57 -0.97 -0.03 0.00 0.31 0.00 0.00 61.69 61.57 1ott s THR 78 Cb -0.33 -1.88 -0.05 0.00 0.01 0.00 0.00 72.50 70.25 1ott s THR 78 CO 0.70 0.58 0.28 -0.22 -0.69 0.00 0.00 174.62 175.27 1ott s LEU 79 N -0.41 4.33 0.32 4.42 2.96 -0.31 -1.54 118.68 128.45 1ott s LEU 79 Ca 0.04 0.45 0.04 0.00 -0.22 0.00 0.00 54.13 54.44 1ott s LEU 79 Cb -0.12 -3.02 -0.06 0.00 0.50 0.00 0.00 46.19 43.49 1ott s LEU 79 CO 0.02 0.15 0.04 -0.31 -1.32 0.00 0.00 176.35 174.92 1ott s TYR 80 N -1.51 2.00 -0.30 5.38 1.51 -0.13 -1.94 117.35 122.35 1ott s TYR 80 Ca 0.35 -0.89 -0.11 0.00 -1.01 0.00 0.00 57.07 55.41 1ott s TYR 80 Cb -0.13 -1.29 0.14 0.00 -0.11 0.00 0.00 41.96 40.57 1ott s TYR 80 CO 0.24 0.08 0.74 -1.17 -1.11 0.00 0.00 175.55 174.33 1ott s LEU 81 N -3.49 -1.01 -0.12 -1.29 2.96 -0.87 -3.42 118.68 111.45 1ott s LEU 81 Ca 0.35 1.32 -0.01 0.00 -0.22 0.00 0.00 54.13 55.58 1ott s LEU 81 Cb 0.08 2.12 -0.02 0.00 0.50 0.00 0.00 46.19 48.87 1ott s LEU 81 CO 0.15 -0.19 -0.09 -1.10 -1.32 0.00 0.00 176.35 173.80 1ott s GLN 82 N 2.78 3.25 -0.11 1.98 -0.21 -1.12 -0.47 119.66 125.76 1ott s GLN 82 Ca -0.04 -0.61 0.02 0.00 0.02 0.00 0.00 55.36 54.76 1ott s GLN 82 Cb -0.11 -2.68 0.01 0.00 1.00 0.00 0.00 33.01 31.24 1ott s GLN 82 CO -0.19 0.36 -0.17 0.42 -2.12 0.00 0.00 175.29 173.60 1ott s ILE 83 N -0.00 1.59 0.25 1.08 1.01 -0.99 -1.66 121.20 122.48 1ott s ILE 83 Ca -0.02 -0.71 0.09 0.00 0.00 0.00 0.00 60.65 60.01 1ott s ILE 83 Cb -0.14 -1.44 -0.04 0.00 0.01 0.00 0.00 42.46 40.85 1ott s ILE 83 CO 0.03 0.46 0.02 -0.94 0.00 0.00 0.00 174.94 174.51 1ott s SER 84 N 0.87 4.70 -1.12 3.58 1.04 -0.16 -2.26 113.70 120.35 1ott s SER 84 Ca -0.09 -0.56 -0.26 0.00 0.48 0.00 0.00 55.95 55.52 1ott s SER 84 Cb -0.15 -0.94 0.03 0.00 0.10 0.00 0.00 66.02 65.06 1ott s SER 84 CO -0.00 0.01 0.68 0.29 0.98 0.00 0.00 173.24 175.20 1ott n LYS 85 N -0.83 -0.63 -2.53 4.02 5.02 -0.69 -4.76 118.16 117.76 1ott n LYS 85 Ca -0.07 0.28 -0.35 0.00 -2.02 0.00 0.00 58.31 56.15 1ott n LYS 85 Cb 0.58 -2.68 -0.03 0.00 -0.02 0.00 0.00 35.03 32.88 1ott n LYS 85 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1ott s VAL 86 N -3.40 3.73 0.10 -0.18 -7.23 -0.93 -4.65 120.40 107.85 1ott s VAL 86 Ca 0.38 1.13 -0.01 0.00 -1.81 0.00 0.00 61.98 61.67 1ott s VAL 86 Cb -0.20 -3.49 -0.04 0.00 0.56 0.00 0.00 36.38 33.21 1ott s VAL 86 CO 0.94 -0.18 0.02 0.00 -0.31 0.00 0.00 175.10 175.57 1ott s ARG 87 N -3.08 0.79 0.51 4.82 1.70 -1.26 -0.34 118.95 122.09 1ott s ARG 87 Ca 0.66 -1.34 0.41 0.00 -0.47 0.00 0.00 55.73 54.99 1ott s ARG 87 Cb -0.18 0.23 1.60 0.00 -0.57 0.00 0.00 34.95 36.03 1ott s ARG 87 CO 0.22 -0.20 1.62 0.66 -1.08 0.00 0.00 175.30 176.52 1ott h SER 88 N 2.98 0.10 0.32 -2.89 4.64 -1.98 1.39 113.55 118.12 1ott h SER 88 Ca -0.35 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1ott h SER 88 Cb 1.17 0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1ott h SER 88 CO 0.62 -0.08 0.00 -0.62 -0.87 0.00 0.00 176.83 175.87 1ott n GLU 89 N -4.28 0.14 -0.21 4.77 4.71 -1.26 -1.45 120.64 123.06 1ott n GLU 89 Ca 0.40 0.52 0.09 0.00 -0.01 0.00 0.00 57.16 58.16 1ott n GLU 89 Cb 1.70 -1.86 0.25 0.00 -1.01 0.00 0.00 31.44 30.52 1ott n GLU 89 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1ott n ASP 90 N -2.15 2.55 -4.44 1.62 9.92 0.48 -4.80 116.55 119.73 1ott n ASP 90 Ca 0.00 -1.94 -0.44 0.00 -0.53 0.00 0.00 54.79 51.88 1ott n ASP 90 Cb 0.12 -0.28 -0.06 0.00 -0.64 0.00 0.00 41.12 40.27 1ott n ASP 90 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1ott s THR 91 N -1.45 4.79 0.29 -3.53 2.01 -0.53 -4.81 115.64 112.42 1ott s THR 91 Ca 0.34 -0.48 -0.15 0.00 0.31 0.00 0.00 61.69 61.70 1ott s THR 91 Cb 0.18 -4.37 0.06 0.00 0.01 0.00 0.00 72.50 68.38 1ott s THR 91 CO 0.24 -0.92 0.77 0.00 -0.69 0.00 0.00 174.62 174.03 1ott n ALA 92 N 6.40 -1.84 -2.69 7.40 0.00 -1.02 -4.32 120.51 124.44 1ott n ALA 92 Ca -0.06 -1.06 -0.39 0.00 0.00 0.00 0.00 53.44 51.93 1ott n ALA 92 Cb 0.45 0.77 -0.06 0.00 0.00 0.00 0.00 19.45 20.61 1ott n ALA 92 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1ott s LEU 93 N 0.00 4.21 -0.38 0.00 2.96 0.59 -2.66 118.68 123.40 1ott s LEU 93 Ca 0.16 0.80 -0.10 0.00 -0.22 0.00 0.00 54.13 54.77 1ott s LEU 93 Cb -0.04 -2.76 0.04 0.00 0.50 0.00 0.00 46.19 43.93 1ott s LEU 93 CO 0.09 -0.12 0.20 -0.31 -1.32 0.00 0.00 176.35 174.89 1ott s TYR 94 N 1.21 3.27 0.00 5.38 4.12 0.81 0.86 117.35 133.00 1ott s TYR 94 Ca 0.27 -1.18 -0.03 0.00 0.02 0.00 0.00 57.07 56.14 1ott s TYR 94 Cb -0.16 -2.54 -0.04 0.00 -1.52 0.00 0.00 41.96 37.70 1ott s TYR 94 CO 0.11 -0.72 0.21 0.71 0.02 0.00 0.00 175.55 175.88 1ott s TYR 95 N 1.50 3.55 -0.21 2.71 2.02 0.44 -3.33 117.35 124.03 1ott s TYR 95 Ca 0.01 0.40 -0.02 0.00 -0.37 0.00 0.00 57.07 57.10 1ott s TYR 95 Cb -0.20 -1.87 0.01 0.00 -0.40 0.00 0.00 41.96 39.50 1ott s TYR 95 CO 0.05 0.63 -0.11 0.00 -1.57 0.00 0.00 175.55 174.55 1ott s ALA 97 N 1.39 4.48 -0.08 0.00 0.00 -0.91 -1.88 121.76 124.76 1ott s ALA 97 Ca 0.05 -1.81 0.04 0.00 0.00 0.00 0.00 51.96 50.24 1ott s ALA 97 Cb -0.14 -1.25 -0.01 0.00 0.00 0.00 0.00 23.12 21.72 1ott s ALA 97 CO -0.07 -0.52 -0.20 0.50 0.00 0.00 0.00 175.76 175.46 1ott s ARG 98 N -4.41 2.85 0.00 0.00 3.52 -1.10 -2.52 118.95 117.30 1ott s ARG 98 Ca 0.52 -0.82 -0.01 0.00 -0.13 0.00 0.00 55.73 55.29 1ott s ARG 98 Cb -0.05 -2.33 -0.04 0.00 -1.56 0.00 0.00 34.95 30.96 1ott s ARG 98 CO 0.32 0.33 0.10 -0.51 -0.81 0.00 0.00 175.30 174.73 1ott s LEU 99 N -0.02 3.97 0.00 -0.88 1.43 0.29 -0.04 118.68 123.43 1ott s LEU 99 Ca -0.06 0.17 0.00 0.00 -1.03 0.00 0.00 54.13 53.21 1ott s LEU 99 Cb -0.15 -2.35 0.00 0.00 0.03 0.00 0.00 46.19 43.73 1ott s LEU 99 CO 0.05 0.26 0.00 0.00 0.23 0.00 0.00 176.35 176.89 1ott n TYR 100 N 1.09 -0.92 -3.92 0.29 9.36 -1.14 -4.20 117.16 117.73 1ott n TYR 100 Ca -0.12 0.00 -0.08 0.00 3.32 0.00 0.00 57.90 61.01 1ott n TYR 100 Cb 0.53 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.21 1ott n TYR 100 CO 0.00 0.00 0.00 1.52 0.22 0.00 0.00 176.86 178.60 1ott s TYR 101 N -8.43 0.10 0.00 2.98 -0.85 -1.26 -0.65 117.35 109.24 1ott s TYR 101 Ca 0.00 -0.53 0.00 0.00 -0.52 0.00 0.00 57.07 56.02 1ott s TYR 101 Cb 0.00 0.50 0.00 0.00 0.38 0.00 0.00 41.96 42.84 1ott s TYR 101 CO 0.00 -1.18 0.00 0.41 -1.52 0.00 0.00 175.55 173.26 1ott n GLY 102 N -0.44 0.55 0.32 5.49 0.00 -1.26 -4.75 105.19 105.09 1ott n GLY 102 Ca -0.03 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.17 1ott n GLY 102 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1ott h TYR 103 N 0.00 0.00 0.00 1.61 0.05 -2.02 -3.44 116.97 113.17 1ott h TYR 103 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1ott h TYR 103 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 1ott h TYR 103 CO 0.00 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.52 1ott n GLY 104 N -1.16 0.94 2.50 3.88 0.00 -1.26 -5.04 105.19 105.05 1ott n GLY 104 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 1ott n GLY 104 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ott n TYR 105 N 0.00 2.91 0.00 1.61 4.02 -1.26 -4.93 117.16 119.51 1ott n TYR 105 Ca 0.00 -3.04 0.00 0.00 -0.01 0.00 0.00 57.90 54.85 1ott n TYR 105 Cb 0.00 -2.52 0.00 0.00 -0.02 0.00 0.00 39.34 36.80 1ott n TYR 105 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 1ott n TRP 106 N 4.72 0.00 -4.37 -0.72 7.02 -1.26 -4.81 117.44 118.03 1ott n TRP 106 Ca 0.67 0.00 -0.19 0.00 -1.02 0.00 0.00 57.50 56.96 1ott n TRP 106 Cb 0.30 0.00 -0.10 0.00 -2.42 0.00 0.00 31.31 29.09 1ott n TRP 106 CO 0.00 0.00 0.00 1.52 -2.02 0.00 0.00 177.69 177.19 1ott s TYR 107 N 0.00 1.68 -0.65 -5.99 -0.85 0.18 -4.96 117.35 106.75 1ott s TYR 107 Ca 0.00 -1.16 -0.17 0.00 -0.52 0.00 0.00 57.07 55.22 1ott s TYR 107 Cb 0.00 -1.02 0.13 0.00 0.38 0.00 0.00 41.96 41.46 1ott s TYR 107 CO 0.00 -0.27 0.71 -0.06 -1.52 0.00 0.00 175.55 174.41 1ott s PHE 108 N -3.57 3.20 0.00 -3.49 0.40 -1.26 -2.89 117.98 110.37 1ott s PHE 108 Ca 0.36 -1.26 0.00 0.00 -0.60 0.00 0.00 56.93 55.43 1ott s PHE 108 Cb 0.07 -3.96 0.00 0.00 0.51 0.00 0.00 43.02 39.64 1ott s PHE 108 CO 0.15 -1.20 0.77 -3.47 0.70 0.00 0.00 175.22 172.16 1ott n ASP 109 N 5.69 0.00 -4.01 1.36 2.03 0.94 -4.65 116.55 117.91 1ott n ASP 109 Ca -0.03 0.77 -0.31 0.00 0.52 0.00 0.00 54.79 55.73 1ott n ASP 109 Cb 0.43 -0.27 -0.15 0.00 -0.72 0.00 0.00 41.12 40.42 1ott n ASP 109 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1ott s VAL 110 N -2.06 2.18 0.14 5.18 1.01 -1.17 -4.94 120.40 120.73 1ott s VAL 110 Ca 0.00 -2.19 -0.30 0.00 0.00 0.00 0.00 61.98 59.49 1ott s VAL 110 Cb 0.00 -2.57 -0.07 0.00 0.00 0.00 0.00 36.38 33.75 1ott s VAL 110 CO 0.00 -0.52 0.99 0.26 0.00 0.00 0.00 175.10 175.83 1ott s TRP 111 N 0.97 3.78 0.00 5.22 0.52 -1.26 -2.70 118.94 125.47 1ott s TRP 111 Ca 0.08 1.76 0.00 0.00 0.02 0.00 0.00 56.10 57.96 1ott s TRP 111 Cb -0.19 -3.10 0.00 0.00 -1.15 0.00 0.00 33.47 29.03 1ott s TRP 111 CO -0.09 0.02 0.00 0.41 0.02 0.00 0.00 176.95 177.32 1ott n GLY 112 N 2.13 -2.71 0.00 0.98 0.00 -0.79 -4.88 105.19 99.92 1ott n GLY 112 Ca 0.02 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.70 1ott n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ott n ALA 113 N -3.00 0.00 0.00 4.61 0.00 -0.81 -4.88 120.51 116.42 1ott n ALA 113 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ott n ALA 113 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1ott n ALA 113 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ott n GLY 114 N 0.49 -2.64 3.65 0.00 0.00 -1.26 -4.95 105.19 100.48 1ott n GLY 114 Ca 0.00 -1.37 -0.03 0.00 0.00 0.00 0.00 46.02 44.62 1ott n GLY 114 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1ott s THR 115 N -1.96 0.00 0.06 2.61 -1.32 -1.21 -4.47 115.64 109.35 1ott s THR 115 Ca 0.00 0.00 0.05 0.00 -1.21 0.00 0.00 61.69 60.53 1ott s THR 115 Cb 0.00 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.95 1ott s THR 115 CO 0.00 0.00 -0.05 -0.89 -2.21 0.00 0.00 174.62 171.47 1ott s THR 116 N 0.53 3.71 -0.09 5.08 2.01 -1.26 -0.14 115.64 125.48 1ott s THR 116 Ca 0.00 -0.98 0.00 0.00 0.31 0.00 0.00 61.69 61.03 1ott s THR 116 Cb -0.04 -2.70 0.02 0.00 0.01 0.00 0.00 72.50 69.79 1ott s THR 116 CO -0.12 0.22 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.25 1ott s VAL 117 N -1.17 1.02 -0.14 3.82 1.01 -1.09 0.47 120.40 124.33 1ott s VAL 117 Ca 0.21 -0.33 0.02 0.00 0.00 0.00 0.00 61.98 61.88 1ott s VAL 117 Cb -0.11 -1.01 0.01 0.00 0.00 0.00 0.00 36.38 35.27 1ott s VAL 117 CO 0.13 0.35 -0.21 0.42 0.00 0.00 0.00 175.10 175.80 1ott s THR 118 N 1.35 2.17 -0.25 3.92 -4.23 0.39 -2.44 115.64 116.56 1ott s THR 118 Ca -0.02 -0.94 -0.15 0.00 -1.18 0.00 0.00 61.69 59.40 1ott s THR 118 Cb -0.14 -1.87 -0.04 0.00 1.34 0.00 0.00 72.50 71.79 1ott s THR 118 CO -0.04 0.54 0.37 -0.69 -0.54 0.00 0.00 174.62 174.26 1ott s VAL 119 N 0.79 5.19 0.03 2.29 1.01 -1.26 -1.45 120.40 126.99 1ott s VAL 119 Ca -0.07 0.58 -0.28 0.00 0.00 0.00 0.00 61.98 62.21 1ott s VAL 119 Cb -0.16 -3.70 0.10 0.00 0.00 0.00 0.00 36.38 32.62 1ott s VAL 119 CO -0.01 0.19 1.03 -0.55 0.00 0.00 0.00 175.10 175.76 1ott s SER 120 N 1.48 -0.20 0.00 3.32 0.15 0.35 -4.80 113.70 113.99 1ott s SER 120 Ca 0.16 -0.18 0.26 0.00 0.70 0.00 0.00 55.95 56.88 1ott s SER 120 Cb -0.15 0.35 0.62 0.00 -1.71 0.00 0.00 66.02 65.13 1ott s SER 120 CO 0.09 -0.62 1.50 -1.20 1.20 0.00 0.00 173.24 174.21 1ott n SER 121 N -0.36 2.27 -3.12 5.45 7.64 -1.26 -3.33 113.62 120.91 1ott n SER 121 Ca -0.07 -1.76 0.00 0.00 1.01 0.00 0.00 58.87 58.06 1ott n SER 121 Cb 0.61 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 1ott n SER 121 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ott n ALA 122 N 0.77 0.00 -2.46 -0.43 0.00 -1.26 -5.04 120.51 112.09 1ott n ALA 122 Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.35 1ott n ALA 122 Cb 0.47 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.77 1ott n ALA 122 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1ott s LYS 123 N -2.17 1.54 -0.54 0.00 1.02 -1.26 -5.02 119.74 113.31 1ott s LYS 123 Ca 0.00 -0.70 -0.27 0.00 0.02 0.00 0.00 55.97 55.02 1ott s LYS 123 Cb 0.00 -1.50 -0.03 0.00 -0.52 0.00 0.00 37.83 35.77 1ott s LYS 123 CO 0.00 0.41 2.00 0.95 -0.92 0.00 0.00 175.35 177.79 1ott s THR 124 N -0.47 3.28 -0.24 2.17 -4.23 -1.26 -4.72 115.64 110.16 1ott s THR 124 Ca 0.07 0.18 -0.06 0.00 -1.18 0.00 0.00 61.69 60.71 1ott s THR 124 Cb -0.07 -3.66 -0.02 0.00 1.34 0.00 0.00 72.50 70.09 1ott s THR 124 CO -0.01 -0.61 0.03 -0.89 -0.54 0.00 0.00 174.62 172.60 1ott s THR 125 N 9.59 3.90 1.14 3.99 2.01 0.99 -4.81 115.64 132.46 1ott s THR 125 Ca 0.77 -0.37 -0.16 0.00 0.31 0.00 0.00 61.69 62.23 1ott s THR 125 Cb -0.15 -2.84 0.18 0.00 0.01 0.00 0.00 72.50 69.70 1ott s THR 125 CO 0.24 0.33 0.39 -0.81 -0.69 0.00 0.00 174.62 174.08 1ott n PRO 126 N 4.87 -1.93 -3.84 4.92 -0.04 -1.26 -1.22 135.00 136.50 1ott n PRO 126 Ca -0.17 -0.54 -0.21 0.00 -0.04 0.00 0.00 63.50 62.54 1ott n PRO 126 Cb 0.51 -1.87 -0.04 0.00 -0.04 0.00 0.00 33.50 32.05 1ott n PRO 126 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1ott s PRO 127 N -3.80 2.70 -0.17 0.54 0.04 -1.26 -3.88 135.00 129.18 1ott s PRO 127 Ca 0.61 -1.31 -0.03 0.00 0.04 0.00 0.00 61.00 60.31 1ott s PRO 127 Cb -0.17 -2.46 -0.02 0.00 0.04 0.00 0.00 34.50 31.89 1ott s PRO 127 CO 0.66 0.10 -0.06 -1.12 0.04 0.00 0.00 177.00 176.62 1ott s SER 128 N -3.98 4.40 -0.23 6.66 0.01 0.29 -4.96 113.70 115.88 1ott s SER 128 Ca 0.41 -0.28 -0.06 0.00 1.31 0.00 0.00 55.95 57.33 1ott s SER 128 Cb -0.06 -1.72 -0.02 0.00 0.21 0.00 0.00 66.02 64.43 1ott s SER 128 CO 0.26 0.10 0.02 -0.69 0.41 0.00 0.00 173.24 173.34 1ott s VAL 129 N 0.78 3.89 -0.11 3.43 1.01 -1.26 -1.52 120.40 126.62 1ott s VAL 129 Ca -0.02 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 61.67 1ott s VAL 129 Cb -0.15 -2.80 -0.00 0.00 0.00 0.00 0.00 36.38 33.43 1ott s VAL 129 CO 0.02 0.38 -0.22 -0.31 0.00 0.00 0.00 175.10 174.97 1ott s TYR 130 N 1.53 2.62 0.11 5.22 2.02 0.43 -4.96 117.35 124.32 1ott s TYR 130 Ca 0.06 -1.00 -0.31 0.00 -0.37 0.00 0.00 57.07 55.45 1ott s TYR 130 Cb -0.15 -1.74 -0.07 0.00 -0.40 0.00 0.00 41.96 39.60 1ott s TYR 130 CO 0.01 -0.40 1.31 -1.25 -1.57 0.00 0.00 175.55 173.65 1ott s PRO 131 N 0.38 4.37 -0.99 -1.71 0.04 -1.26 0.42 135.00 136.25 1ott s PRO 131 Ca -0.16 1.97 -0.04 0.00 0.04 0.00 0.00 61.00 62.80 1ott s PRO 131 Cb -0.17 -3.27 0.25 0.00 0.04 0.00 0.00 34.50 31.34 1ott s PRO 131 CO 0.08 -0.35 0.94 1.28 0.04 0.00 0.00 177.00 178.99 1ott n LEU 132 N 3.73 4.80 -4.84 -3.56 4.77 0.17 -4.88 117.00 117.19 1ott n LEU 132 Ca 0.10 -5.11 -0.35 0.00 -0.03 0.00 0.00 56.01 50.62 1ott n LEU 132 Cb 0.44 -1.25 -0.06 0.00 -2.33 0.00 0.00 43.42 40.22 1ott n LEU 132 CO 0.57 1.50 0.27 0.00 -1.33 0.00 0.00 177.39 178.40 1ott s ALA 133 N -1.43 3.54 0.56 -1.18 0.00 -1.26 -3.29 121.76 118.69 1ott s ALA 133 Ca 0.29 -0.09 -0.20 0.00 0.00 0.00 0.00 51.96 51.96 1ott s ALA 133 Cb -0.07 -2.57 -0.05 0.00 0.00 0.00 0.00 23.12 20.42 1ott s ALA 133 CO -0.10 0.44 1.14 -2.30 0.00 0.00 0.00 175.76 174.93 1ott n PRO 134 N 0.62 1.25 -0.11 0.00 -0.02 -1.26 -4.84 135.00 130.64 1ott n PRO 134 Ca -0.04 0.47 -0.09 0.00 -2.02 0.00 0.00 63.50 61.82 1ott n PRO 134 Cb 0.52 -2.32 0.09 0.00 -0.02 0.00 0.00 33.50 31.76 1ott n PRO 134 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ott n GLY 135 N 1.06 -3.18 0.14 -1.23 0.00 -1.26 -4.23 105.19 96.49 1ott n GLY 135 Ca 0.12 -1.04 -0.06 0.00 0.00 0.00 0.00 46.02 45.04 1ott n GLY 135 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ott h SER 136 N -2.38 0.18 -0.32 1.61 0.02 -1.93 -3.11 113.55 107.62 1ott h SER 136 Ca -0.12 -0.13 -0.21 0.00 -0.84 0.00 0.00 61.79 60.50 1ott h SER 136 Cb 0.39 -0.05 -0.09 0.00 0.14 0.00 0.00 62.40 62.78 1ott h SER 136 CO 0.07 0.85 0.27 0.00 -1.14 0.00 0.00 176.83 176.88 1ott n ALA 137 N -2.45 4.52 -1.84 3.77 0.00 -1.26 -4.91 120.51 118.33 1ott n ALA 137 Ca -0.02 -1.08 -0.43 0.00 0.00 0.00 0.00 53.44 51.91 1ott n ALA 137 Cb 0.71 -1.23 -0.03 0.00 0.00 0.00 0.00 19.45 18.90 1ott n ALA 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ott s ALA 138 N -1.19 2.81 -0.53 0.00 0.00 -1.18 -4.85 121.76 116.82 1ott s ALA 138 Ca 0.20 0.46 -0.06 0.00 0.00 0.00 0.00 51.96 52.57 1ott s ALA 138 Cb 0.16 -4.04 -0.15 0.00 0.00 0.00 0.00 23.12 19.09 1ott s ALA 138 CO 0.00 -2.70 2.79 0.00 0.00 0.00 0.00 175.76 175.86 1ott n ALA 139 N 10.86 5.62 -1.05 0.00 0.00 -1.26 -4.88 120.51 129.79 1ott n ALA 139 Ca 0.26 -1.99 -0.12 0.00 0.00 0.00 0.00 53.44 51.59 1ott n ALA 139 Cb 0.46 -2.67 -0.13 0.00 0.00 0.00 0.00 19.45 17.11 1ott n ALA 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ott n ALA 140 N 3.13 0.74 -2.46 0.00 0.00 -1.26 -4.88 120.51 115.78 1ott n ALA 140 Ca 0.45 -0.68 -0.05 0.00 0.00 0.00 0.00 53.44 53.17 1ott n ALA 140 Cb 0.50 -1.45 0.02 0.00 0.00 0.00 0.00 19.45 18.53 1ott n ALA 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ott n ALA 141 N 4.05 0.08 -0.28 0.00 0.00 -1.26 -4.99 120.51 118.11 1ott n ALA 141 Ca 0.38 -0.40 0.04 0.00 0.00 0.00 0.00 53.44 53.47 1ott n ALA 141 Cb 0.19 0.07 0.13 0.00 0.00 0.00 0.00 19.45 19.84 1ott n ALA 141 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ott h SER 142 N -0.09 -0.64 -3.58 0.00 4.64 -1.98 -3.40 113.55 108.50 1ott h SER 142 Ca -0.06 0.24 -0.67 0.00 -0.47 0.00 0.00 61.79 60.82 1ott h SER 142 Cb 0.24 0.47 -0.16 0.00 -0.31 0.00 0.00 62.40 62.64 1ott h SER 142 CO 0.07 -0.26 -0.71 -0.04 -0.87 0.00 0.00 176.83 175.03 1ott s MET 143 N -6.20 2.47 -0.18 4.77 1.00 -1.26 -1.55 119.30 118.35 1ott s MET 143 Ca -0.14 -0.79 0.01 0.00 0.00 0.00 0.00 55.69 54.77 1ott s MET 143 Cb 0.23 -2.47 0.02 0.00 0.00 0.00 0.00 34.83 32.62 1ott s MET 143 CO 0.76 0.58 -0.18 0.54 0.00 0.00 0.00 175.02 176.71 1ott s VAL 144 N -1.06 1.97 -0.28 -6.03 0.11 0.22 -4.66 120.40 110.67 1ott s VAL 144 Ca 0.19 -0.92 -0.20 0.00 -2.93 0.00 0.00 61.98 58.12 1ott s VAL 144 Cb -0.11 -1.81 -0.01 0.00 -1.53 0.00 0.00 36.38 32.92 1ott s VAL 144 CO 0.10 0.50 0.64 -0.89 -3.33 0.00 0.00 175.10 172.11 1ott s THR 145 N 1.32 4.95 0.00 5.04 2.01 -1.26 -1.74 115.64 125.96 1ott s THR 145 Ca 0.04 1.01 0.00 0.00 0.31 0.00 0.00 61.69 63.06 1ott s THR 145 Cb -0.13 -3.98 0.00 0.00 0.01 0.00 0.00 72.50 68.40 1ott s THR 145 CO -0.12 -0.06 0.00 0.18 -0.69 0.00 0.00 174.62 173.93 1ott n LEU 146 N 5.82 0.00 0.00 4.42 4.77 -1.01 -4.63 117.00 126.36 1ott n LEU 146 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1ott n LEU 146 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1ott n LEU 146 CO 0.45 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1ott n GLY 147 N 5.00 4.25 3.09 -0.72 0.00 -1.21 -3.37 105.19 112.23 1ott n GLY 147 Ca 0.00 -1.29 -0.14 0.00 0.00 0.00 0.00 46.02 44.59 1ott n GLY 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ott s LEU 149 N -1.62 4.20 -0.28 0.00 2.96 0.17 -0.98 118.68 123.12 1ott s LEU 149 Ca -0.08 0.29 0.01 0.00 -0.22 0.00 0.00 54.13 54.13 1ott s LEU 149 Cb -0.10 -2.19 0.06 0.00 0.50 0.00 0.00 46.19 44.46 1ott s LEU 149 CO 0.01 0.12 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.42 1ott s VAL 150 N 0.58 2.58 0.08 1.68 1.01 0.28 -0.43 120.40 126.18 1ott s VAL 150 Ca 0.11 -1.52 -0.00 0.00 0.00 0.00 0.00 61.98 60.57 1ott s VAL 150 Cb -0.12 -2.50 -0.04 0.00 0.00 0.00 0.00 36.38 33.72 1ott s VAL 150 CO 0.01 -0.07 -0.02 -1.59 0.00 0.00 0.00 175.10 173.43 1ott s LYS 151 N 1.17 0.73 -0.54 2.72 -2.85 -0.57 0.45 119.74 120.86 1ott s LYS 151 Ca -0.07 -1.30 -0.01 0.00 -1.00 0.00 0.00 55.97 53.60 1ott s LYS 151 Cb -0.20 0.12 0.00 0.00 -2.06 0.00 0.00 37.83 35.70 1ott s LYS 151 CO -0.03 -0.13 0.46 0.41 0.10 0.00 0.00 175.35 176.16 1ott n GLY 152 N 0.03 0.12 3.18 0.59 0.00 -0.19 -0.55 105.19 108.37 1ott n GLY 152 Ca -0.12 -0.23 -0.12 0.00 0.00 0.00 0.00 46.02 45.55 1ott n GLY 152 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ott s TYR 153 N -3.16 1.00 -0.27 1.61 -0.85 -1.11 -4.32 117.35 110.24 1ott s TYR 153 Ca 0.04 -0.80 -0.23 0.00 -0.52 0.00 0.00 57.07 55.56 1ott s TYR 153 Cb -0.02 -0.55 0.08 0.00 0.38 0.00 0.00 41.96 41.86 1ott s TYR 153 CO 0.32 -0.06 0.77 0.12 -1.52 0.00 0.00 175.55 175.18 1ott s PHE 154 N -3.17 -0.79 0.32 -3.49 5.36 -0.36 0.76 117.98 116.61 1ott s PHE 154 Ca 0.10 1.83 0.05 0.00 -0.96 0.00 0.00 56.93 57.95 1ott s PHE 154 Cb 0.02 0.35 0.05 0.00 -0.34 0.00 0.00 43.02 43.10 1ott s PHE 154 CO -0.02 -0.38 0.38 -0.35 -1.46 0.00 0.00 175.22 173.38 1ott n PRO 155 N 2.96 0.86 -1.19 10.12 -0.04 -1.26 -0.01 135.00 146.44 1ott n PRO 155 Ca -0.15 -1.79 -0.34 0.00 -0.04 0.00 0.00 63.50 61.18 1ott n PRO 155 Cb 0.56 -0.03 0.12 0.00 -0.04 0.00 0.00 33.50 34.11 1ott n PRO 155 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1ott n GLU 156 N -1.55 0.30 -4.70 0.54 -0.58 -1.26 -4.81 120.64 108.57 1ott n GLU 156 Ca 0.06 0.18 -0.31 0.00 -0.42 0.00 0.00 57.16 56.66 1ott n GLU 156 Cb 0.34 -2.40 -0.08 0.00 -0.57 0.00 0.00 31.44 28.73 1ott n GLU 156 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1ott s PRO 157 N -3.92 2.13 0.07 3.49 0.04 -1.26 -4.88 135.00 130.68 1ott s PRO 157 Ca 0.74 -2.35 0.08 0.00 0.04 0.00 0.00 61.00 59.50 1ott s PRO 157 Cb -0.31 -1.31 -0.03 0.00 0.04 0.00 0.00 34.50 32.90 1ott s PRO 157 CO 0.50 -0.39 -0.21 0.14 0.04 0.00 0.00 177.00 177.09 1ott s VAL 158 N -2.95 1.67 -0.20 -0.36 -7.23 -1.26 -4.39 120.40 105.67 1ott s VAL 158 Ca 0.10 -1.35 -0.01 0.00 -1.81 0.00 0.00 61.98 58.91 1ott s VAL 158 Cb 0.02 -1.48 0.01 0.00 0.56 0.00 0.00 36.38 35.49 1ott s VAL 158 CO 0.06 0.07 -0.13 0.42 -0.31 0.00 0.00 175.10 175.21 1ott s THR 159 N -0.97 2.61 -0.20 5.32 -4.23 -0.75 -4.96 115.64 112.47 1ott s THR 159 Ca 0.07 -0.80 -0.02 0.00 -1.18 0.00 0.00 61.69 59.76 1ott s THR 159 Cb -0.09 -2.17 -0.00 0.00 1.34 0.00 0.00 72.50 71.58 1ott s THR 159 CO 0.03 0.45 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.77 1ott s VAL 160 N 1.36 2.96 0.36 2.29 1.01 -1.26 -2.08 120.40 125.04 1ott s VAL 160 Ca 0.05 -0.64 0.05 0.00 0.00 0.00 0.00 61.98 61.43 1ott s VAL 160 Cb -0.14 -2.31 -0.07 0.00 0.00 0.00 0.00 36.38 33.86 1ott s VAL 160 CO -0.09 0.47 0.04 0.42 0.00 0.00 0.00 175.10 175.95 1ott s THR 161 N 1.30 1.41 -0.11 3.92 -4.23 -0.78 -4.97 115.64 112.18 1ott s THR 161 Ca 0.04 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.57 1ott s THR 161 Cb -0.14 -2.82 0.01 0.00 1.34 0.00 0.00 72.50 70.89 1ott s THR 161 CO -0.05 0.00 -0.17 0.26 -0.54 0.00 0.00 174.62 174.12 1ott s TRP 162 N -3.10 2.09 -1.75 3.99 0.52 -1.26 -0.93 118.94 118.50 1ott s TRP 162 Ca 0.34 -0.98 0.00 0.00 0.02 0.00 0.00 56.10 55.49 1ott s TRP 162 Cb 0.09 -1.48 0.00 0.00 -1.15 0.00 0.00 33.47 30.92 1ott s TRP 162 CO 0.16 -0.48 0.00 0.09 0.02 0.00 0.00 176.95 176.74 1ott n ASN 163 N 4.11 -5.35 -0.83 2.95 3.02 0.33 -1.12 115.26 118.37 1ott n ASN 163 Ca -0.19 0.17 -0.05 0.00 -0.03 0.00 0.00 54.58 54.47 1ott n ASN 163 Cb 0.51 -4.56 0.01 0.00 -0.61 0.00 0.00 39.78 35.13 1ott n ASN 163 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1ott n SER 164 N -1.72 -2.49 0.00 6.41 7.64 -1.26 -3.22 113.62 118.97 1ott n SER 164 Ca -0.22 -0.06 0.00 0.00 1.01 0.00 0.00 58.87 59.61 1ott n SER 164 Cb 0.66 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.39 1ott n SER 164 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ott n GLY 165 N -0.92 2.79 0.29 0.23 0.00 -0.27 -4.84 105.19 102.48 1ott n GLY 165 Ca -0.03 -0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.05 1ott n GLY 165 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ott h SER 166 N 0.00 0.00 -3.64 1.61 4.64 -1.51 -2.89 113.55 111.76 1ott h SER 166 Ca 0.00 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.70 1ott h SER 166 Cb 0.00 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 61.69 1ott h SER 166 CO 0.00 0.00 -0.72 -0.22 -0.87 0.00 0.00 176.83 175.02 1ott s LEU 167 N -5.00 3.50 -0.07 5.97 2.96 -0.98 -4.94 118.68 120.12 1ott s LEU 167 Ca -0.02 -2.30 0.10 0.00 -0.22 0.00 0.00 54.13 51.69 1ott s LEU 167 Cb 0.04 -1.28 -0.15 0.00 0.50 0.00 0.00 46.19 45.30 1ott s LEU 167 CO 0.13 -0.33 0.12 0.00 -1.32 0.00 0.00 176.35 174.95 1ott n ALA 168 N 4.01 2.02 -2.45 5.97 0.00 -1.10 -4.28 120.51 124.68 1ott n ALA 168 Ca 0.04 -0.51 -0.41 0.00 0.00 0.00 0.00 53.44 52.56 1ott n ALA 168 Cb 0.38 -0.14 -0.04 0.00 0.00 0.00 0.00 19.45 19.65 1ott n ALA 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ott s ALA 169 N -2.47 3.28 0.00 0.00 0.00 -1.26 -3.43 121.76 117.88 1ott s ALA 169 Ca -0.05 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.33 1ott s ALA 169 Cb 0.05 -3.16 0.00 0.00 0.00 0.00 0.00 23.12 20.01 1ott s ALA 169 CO 0.44 -0.05 0.00 0.41 0.00 0.00 0.00 175.76 176.57 1ott n GLY 170 N 2.53 0.63 3.88 0.00 0.00 -1.26 -4.80 105.19 106.16 1ott n GLY 170 Ca 0.01 -0.66 -0.28 0.00 0.00 0.00 0.00 46.02 45.09 1ott n GLY 170 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ott s VAL 171 N -2.00 5.02 -0.06 1.61 1.01 -1.22 -0.09 120.40 124.67 1ott s VAL 171 Ca 0.00 -0.69 -0.09 0.00 0.00 0.00 0.00 61.98 61.19 1ott s VAL 171 Cb 0.00 -3.51 0.02 0.00 0.00 0.00 0.00 36.38 32.89 1ott s VAL 171 CO 0.00 0.02 0.23 -1.00 0.00 0.00 0.00 175.10 174.35 1ott s HIS 172 N -1.61 -0.19 -0.23 5.22 3.76 0.27 -4.93 115.29 117.57 1ott s HIS 172 Ca 0.33 0.44 -0.03 0.00 -0.15 0.00 0.00 55.06 55.65 1ott s HIS 172 Cb -0.12 0.06 0.10 0.00 1.11 0.00 0.00 32.58 33.74 1ott s HIS 172 CO 0.26 -0.20 0.22 0.99 -0.85 0.00 0.00 174.74 175.16 1ott s THR 173 N -0.38 -0.29 0.52 1.30 2.01 -1.26 -0.15 115.64 117.39 1ott s THR 173 Ca -0.05 -0.30 -0.20 0.00 0.31 0.00 0.00 61.69 61.45 1ott s THR 173 Cb -0.03 -0.79 -0.07 0.00 0.01 0.00 0.00 72.50 71.62 1ott s THR 173 CO 0.01 -0.35 1.08 -0.36 -0.69 0.00 0.00 174.62 174.31 1ott s PHE 174 N 2.29 2.85 0.29 4.92 0.08 -0.92 -4.97 117.98 122.53 1ott s PHE 174 Ca 0.07 1.56 -0.30 0.00 0.12 0.00 0.00 56.93 58.38 1ott s PHE 174 Cb -0.15 -3.16 -0.12 0.00 -0.57 0.00 0.00 43.02 39.02 1ott s PHE 174 CO -0.21 -1.17 1.53 -2.30 -0.10 0.00 0.00 175.22 172.98 1ott n PRO 175 N -1.19 2.53 -2.07 0.24 -0.02 -1.26 -4.58 135.00 128.66 1ott n PRO 175 Ca 0.10 0.90 -0.40 0.00 -2.02 0.00 0.00 63.50 62.08 1ott n PRO 175 Cb 0.52 -2.64 -0.02 0.00 -0.02 0.00 0.00 33.50 31.34 1ott n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ott s ALA 176 N -0.16 3.47 -0.09 3.55 0.00 -1.26 -4.84 121.76 122.43 1ott s ALA 176 Ca 0.64 1.29 -0.01 0.00 0.00 0.00 0.00 51.96 53.88 1ott s ALA 176 Cb -0.53 -3.49 -0.03 0.00 0.00 0.00 0.00 23.12 19.07 1ott s ALA 176 CO 0.51 -0.72 -0.04 0.14 0.00 0.00 0.00 175.76 175.65 1ott s VAL 177 N -1.16 3.91 0.08 0.00 -7.23 -0.36 -4.86 120.40 110.77 1ott s VAL 177 Ca 0.51 -0.39 -0.09 0.00 -1.81 0.00 0.00 61.98 60.20 1ott s VAL 177 Cb -0.40 -2.63 -0.06 0.00 0.56 0.00 0.00 36.38 33.85 1ott s VAL 177 CO 0.53 0.58 0.38 -0.22 -0.31 0.00 0.00 175.10 176.07 1ott s LEU 178 N -0.61 4.34 -0.30 1.32 2.96 -1.26 -0.52 118.68 124.61 1ott s LEU 178 Ca 0.09 0.74 -0.14 0.00 -0.22 0.00 0.00 54.13 54.60 1ott s LEU 178 Cb -0.12 -2.98 0.16 0.00 0.50 0.00 0.00 46.19 43.76 1ott s LEU 178 CO 0.02 0.17 0.96 -1.58 -1.32 0.00 0.00 176.35 174.60 1ott s GLN 179 N -1.97 0.31 -1.02 1.98 0.74 0.12 -4.95 119.66 114.87 1ott s GLN 179 Ca 0.33 0.75 -0.01 0.00 0.05 0.00 0.00 55.36 56.48 1ott s GLN 179 Cb -0.14 0.45 -0.01 0.00 1.10 0.00 0.00 33.01 34.41 1ott s GLN 179 CO 0.18 -0.14 0.86 0.00 -0.55 0.00 0.00 175.29 175.64 1ott n ALA 180 N 5.07 -1.86 -3.51 1.58 0.00 -1.26 -2.60 120.51 117.93 1ott n ALA 180 Ca -0.09 -0.01 -0.25 0.00 0.00 0.00 0.00 53.44 53.09 1ott n ALA 180 Cb 0.52 -2.81 -0.01 0.00 0.00 0.00 0.00 19.45 17.15 1ott n ALA 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ott n ALA 181 N -3.58 -1.10 -3.14 0.00 0.00 -1.26 -4.95 120.51 106.49 1ott n ALA 181 Ca -0.21 0.07 -0.12 0.00 0.00 0.00 0.00 53.44 53.18 1ott n ALA 181 Cb 0.64 -2.93 -0.11 0.00 0.00 0.00 0.00 19.45 17.05 1ott n ALA 181 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ott s LEU 182 N -6.62 1.15 0.06 0.00 1.43 -1.07 -4.84 118.68 108.80 1ott s LEU 182 Ca 0.46 0.27 0.00 0.00 -1.03 0.00 0.00 54.13 53.83 1ott s LEU 182 Cb -0.24 0.86 -0.04 0.00 0.03 0.00 0.00 46.19 46.79 1ott s LEU 182 CO 0.56 -0.20 0.21 -0.31 0.23 0.00 0.00 176.35 176.85 1ott s TYR 183 N -0.43 3.52 -0.16 0.29 4.12 0.23 0.13 117.35 125.04 1ott s TYR 183 Ca -0.05 0.25 -0.07 0.00 0.02 0.00 0.00 57.07 57.21 1ott s TYR 183 Cb -0.04 -1.76 0.07 0.00 -1.52 0.00 0.00 41.96 38.71 1ott s TYR 183 CO 0.01 0.59 0.36 0.99 0.02 0.00 0.00 175.55 177.52 1ott s THR 184 N -1.52 -0.24 0.06 -0.71 2.01 0.32 -1.02 115.64 114.54 1ott s THR 184 Ca 0.35 0.15 -0.09 0.00 0.31 0.00 0.00 61.69 62.41 1ott s THR 184 Cb -0.13 -0.56 0.00 0.00 0.01 0.00 0.00 72.50 71.82 1ott s THR 184 CO 0.28 0.06 0.20 -1.48 -0.69 0.00 0.00 174.62 172.99 1ott s LEU 185 N 1.83 1.37 0.12 4.42 0.05 0.17 -1.23 118.68 125.42 1ott s LEU 185 Ca -0.06 -0.50 0.08 0.00 0.05 0.00 0.00 54.13 53.70 1ott s LEU 185 Cb -0.10 1.01 -0.04 0.00 -2.05 0.00 0.00 46.19 45.02 1ott s LEU 185 CO -0.11 -0.64 -0.19 -0.94 -0.55 0.00 0.00 176.35 173.91 1ott s SER 186 N -2.46 2.48 -0.15 1.48 1.04 -1.26 1.00 113.70 115.83 1ott s SER 186 Ca -0.00 -0.74 0.02 0.00 0.48 0.00 0.00 55.95 55.71 1ott s SER 186 Cb 0.02 -0.13 0.01 0.00 0.10 0.00 0.00 66.02 66.02 1ott s SER 186 CO -0.07 0.01 -0.20 -0.55 0.98 0.00 0.00 173.24 173.41 1ott s SER 187 N -2.14 3.00 0.10 7.02 0.15 -0.15 -2.16 113.70 119.52 1ott s SER 187 Ca 0.09 -0.59 -0.08 0.00 0.70 0.00 0.00 55.95 56.07 1ott s SER 187 Cb -0.08 -1.39 -0.06 0.00 -1.71 0.00 0.00 66.02 62.78 1ott s SER 187 CO 0.05 0.04 0.39 -0.55 1.20 0.00 0.00 173.24 174.36 1ott s SER 188 N 1.02 6.58 -0.32 5.45 0.15 0.79 -1.68 113.70 125.70 1ott s SER 188 Ca -0.03 0.71 0.04 0.00 0.70 0.00 0.00 55.95 57.37 1ott s SER 188 Cb -0.15 -2.14 0.17 0.00 -1.71 0.00 0.00 66.02 62.19 1ott s SER 188 CO -0.06 0.13 0.48 0.54 1.20 0.00 0.00 173.24 175.53 1ott s VAL 189 N -1.49 -0.73 -0.12 4.45 0.11 -1.22 0.94 120.40 122.34 1ott s VAL 189 Ca 0.36 -0.27 -0.25 0.00 -2.93 0.00 0.00 61.98 58.89 1ott s VAL 189 Cb -0.13 -0.83 -0.03 0.00 -1.53 0.00 0.00 36.38 33.87 1ott s VAL 189 CO 0.20 -0.22 0.78 -0.89 -3.33 0.00 0.00 175.10 171.64 1ott s THR 190 N 2.39 4.95 0.29 5.04 2.01 0.88 -2.42 115.64 128.78 1ott s THR 190 Ca 0.11 1.56 0.02 0.00 0.31 0.00 0.00 61.69 63.70 1ott s THR 190 Cb -0.11 -4.10 -0.05 0.00 0.01 0.00 0.00 72.50 68.25 1ott s THR 190 CO -0.23 0.13 0.09 0.68 -0.69 0.00 0.00 174.62 174.60 1ott s VAL 191 N 1.53 0.75 0.00 3.82 -7.23 -0.71 -4.57 120.40 113.99 1ott s VAL 191 Ca 0.38 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.25 1ott s VAL 191 Cb -0.17 -2.67 -0.05 0.00 0.56 0.00 0.00 36.38 34.05 1ott s VAL 191 CO 0.16 0.00 1.26 -2.84 -0.31 0.00 0.00 175.10 173.37 1ott s PRO 192 N -3.96 4.35 0.25 4.82 0.02 -1.26 0.70 135.00 139.92 1ott s PRO 192 Ca 0.37 1.80 -0.08 0.00 0.02 0.00 0.00 61.00 63.10 1ott s PRO 192 Cb 0.08 -3.49 0.42 0.00 0.02 0.00 0.00 34.50 31.53 1ott s PRO 192 CO 0.15 -0.43 1.61 0.66 -0.33 0.00 0.00 177.00 178.65 1ott h SER 193 N 7.34 -0.58 0.00 2.53 4.64 -1.49 1.27 113.55 127.26 1ott h SER 193 Ca -0.38 0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1ott h SER 193 Cb 1.18 0.45 0.00 0.00 -0.31 0.00 0.00 62.40 63.72 1ott h SER 193 CO 0.87 -0.25 0.02 -1.54 -0.87 0.00 0.00 176.83 175.06 1ott n SER 194 N -5.46 0.48 -0.04 4.97 3.41 -1.26 -1.27 113.62 114.45 1ott n SER 194 Ca 0.14 0.72 -0.06 0.00 -0.26 0.00 0.00 58.87 59.40 1ott n SER 194 Cb 0.47 -0.77 -0.14 0.00 -0.26 0.00 0.00 64.21 63.51 1ott n SER 194 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1ott n SER 195 N -2.15 0.45 0.00 4.04 2.88 0.43 -4.66 113.62 114.61 1ott n SER 195 Ca -0.01 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.74 1ott n SER 195 Cb 0.05 0.57 0.00 0.00 -0.75 0.00 0.00 64.21 64.08 1ott n SER 195 CO 0.00 0.00 0.00 1.87 -1.23 0.00 0.00 175.04 175.68 1ott n TRP 196 N -2.84 0.00 -0.29 0.66 -0.00 -0.39 -2.84 117.44 111.74 1ott n TRP 196 Ca -0.21 0.00 0.09 0.00 -0.00 0.00 0.00 57.50 57.38 1ott n TRP 196 Cb 1.02 0.00 0.19 0.00 -0.00 0.00 0.00 31.31 32.51 1ott n TRP 196 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 177.69 175.39 1ott n PRO 197 N -0.56 -0.07 -0.09 5.87 -0.02 -1.25 0.14 135.00 139.01 1ott n PRO 197 Ca 0.00 1.24 0.07 0.00 -2.02 0.00 0.00 63.50 62.79 1ott n PRO 197 Cb 0.00 -1.93 0.42 0.00 -0.02 0.00 0.00 33.50 31.97 1ott n PRO 197 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1ott h SER 198 N 0.00 0.52 -4.03 2.55 4.64 -1.83 -3.44 113.55 111.96 1ott h SER 198 Ca 0.45 -0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.68 1ott h SER 198 Cb 0.84 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1ott h SER 198 CO -0.80 0.35 -0.04 -0.62 -0.87 0.00 0.00 176.83 174.85 1ott n GLU 199 N -4.47 1.25 -3.74 4.77 1.02 0.37 -5.11 120.64 114.73 1ott n GLU 199 Ca 0.08 -0.56 -0.38 0.00 -0.02 0.00 0.00 57.16 56.28 1ott n GLU 199 Cb 0.20 0.04 -0.12 0.00 -0.02 0.00 0.00 31.44 31.54 1ott n GLU 199 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1ott s THR 200 N -0.23 3.87 -0.39 2.62 2.01 -1.26 -4.88 115.64 117.38 1ott s THR 200 Ca 0.06 -1.05 -0.14 0.00 0.31 0.00 0.00 61.69 60.88 1ott s THR 200 Cb -0.01 -3.16 0.01 0.00 0.01 0.00 0.00 72.50 69.36 1ott s THR 200 CO 0.04 -0.14 0.27 -0.69 -0.69 0.00 0.00 174.62 173.41 1ott s VAL 201 N 1.43 5.18 -0.06 3.82 1.01 -1.26 -4.95 120.40 125.56 1ott s VAL 201 Ca -0.01 -0.58 0.05 0.00 0.00 0.00 0.00 61.98 61.45 1ott s VAL 201 Cb -0.19 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.35 1ott s VAL 201 CO 0.03 -0.23 -0.22 -0.89 0.00 0.00 0.00 175.10 173.80 1ott s THR 202 N 1.67 2.34 -0.18 3.92 2.01 -1.26 -0.98 115.64 123.16 1ott s THR 202 Ca 0.05 -0.97 -0.05 0.00 0.31 0.00 0.00 61.69 61.03 1ott s THR 202 Cb -0.19 -1.88 -0.03 0.00 0.01 0.00 0.00 72.50 70.42 1ott s THR 202 CO 0.10 0.57 0.00 0.00 -0.69 0.00 0.00 174.62 174.60 1ott s ASN 204 N 0.62 4.59 0.01 0.00 -0.87 -0.10 -0.98 114.94 118.20 1ott s ASN 204 Ca -0.00 -0.59 0.02 0.00 -1.57 0.00 0.00 52.86 50.72 1ott s ASN 204 Cb -0.14 -1.77 -0.04 0.00 -0.02 0.00 0.00 41.25 39.28 1ott s ASN 204 CO 0.02 -0.10 -0.02 -0.69 -2.57 0.00 0.00 177.10 173.75 1ott s VAL 205 N 1.45 4.01 -0.03 1.60 1.01 0.79 -1.86 120.40 127.38 1ott s VAL 205 Ca 0.03 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.34 1ott s VAL 205 Cb -0.16 -2.79 0.02 0.00 0.00 0.00 0.00 36.38 33.46 1ott s VAL 205 CO -0.02 0.36 -0.01 0.00 0.00 0.00 0.00 175.10 175.43 1ott s ALA 206 N -1.08 0.33 -0.43 5.51 0.00 -0.88 -0.67 121.76 124.54 1ott s ALA 206 Ca 0.19 0.10 0.02 0.00 0.00 0.00 0.00 51.96 52.28 1ott s ALA 206 Cb -0.11 -0.28 0.13 0.00 0.00 0.00 0.00 23.12 22.85 1ott s ALA 206 CO 0.10 -0.04 0.20 -1.58 0.00 0.00 0.00 175.76 174.45 1ott s HIS 207 N 0.81 2.33 0.13 0.00 2.46 0.31 -1.80 115.29 119.52 1ott s HIS 207 Ca -0.08 -2.52 -0.31 0.00 0.47 0.00 0.00 55.06 52.62 1ott s HIS 207 Cb -0.12 -2.13 -0.08 0.00 -0.13 0.00 0.00 32.58 30.12 1ott s HIS 207 CO -0.01 -0.80 1.56 -1.35 -2.47 0.00 0.00 174.74 171.67 1ott h PRO 208 N 6.96 -0.45 -0.16 2.88 0.11 -1.78 0.36 132.00 139.93 1ott h PRO 208 Ca -0.04 0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.12 1ott h PRO 208 Cb 0.94 0.10 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 1ott h PRO 208 CO 0.52 -0.30 -0.32 0.00 -0.21 0.00 0.00 178.00 177.69 1ott h ALA 209 N 0.02 -0.64 -0.07 -0.75 0.00 -1.89 0.56 119.26 116.49 1ott h ALA 209 Ca 0.08 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1ott h ALA 209 Cb 0.63 0.89 -0.00 0.00 0.00 0.00 0.00 17.79 19.31 1ott h ALA 209 CO -0.49 -0.78 0.28 1.03 0.00 0.00 0.00 179.25 179.29 1ott h SER 210 N -0.29 0.00 -2.19 0.00 0.87 -1.78 -3.45 113.55 106.71 1ott h SER 210 Ca 0.03 0.00 -0.24 0.00 -1.23 0.00 0.00 61.79 60.35 1ott h SER 210 Cb 0.37 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.34 1ott h SER 210 CO -0.30 0.00 -0.33 -0.24 -0.53 0.00 0.00 176.83 175.43 1ott n SER 211 N -3.11 -4.03 -4.41 6.23 2.88 0.19 -4.84 113.62 106.53 1ott n SER 211 Ca -0.01 -0.08 -0.24 0.00 -1.33 0.00 0.00 58.87 57.22 1ott n SER 211 Cb 0.36 -3.10 -0.11 0.00 -0.75 0.00 0.00 64.21 60.61 1ott n SER 211 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1ott s THR 212 N -2.74 2.19 -0.08 2.46 -4.23 -0.32 -4.98 115.64 107.95 1ott s THR 212 Ca 0.07 -2.14 -0.03 0.00 -1.18 0.00 0.00 61.69 58.41 1ott s THR 212 Cb -0.03 -2.10 0.04 0.00 1.34 0.00 0.00 72.50 71.75 1ott s THR 212 CO 0.09 -0.31 0.17 -0.54 -0.54 0.00 0.00 174.62 173.50 1ott s LYS 213 N -3.07 0.10 0.00 3.99 1.02 -1.26 -0.53 119.74 119.99 1ott s LYS 213 Ca 0.23 0.45 0.00 0.00 0.02 0.00 0.00 55.97 56.67 1ott s LYS 213 Cb -0.06 -0.18 -0.00 0.00 -0.52 0.00 0.00 37.83 37.07 1ott s LYS 213 CO 0.10 -0.20 -0.01 0.14 -0.92 0.00 0.00 175.35 174.47 1ott s VAL 214 N 1.45 0.08 -0.33 3.17 -7.23 0.15 -5.00 120.40 112.69 1ott s VAL 214 Ca -0.07 -0.08 -0.01 0.00 -1.81 0.00 0.00 61.98 60.01 1ott s VAL 214 Cb -0.11 -0.08 0.07 0.00 0.56 0.00 0.00 36.38 36.81 1ott s VAL 214 CO -0.07 -0.00 0.05 -1.81 -0.31 0.00 0.00 175.10 172.96 1ott s ASP 215 N -0.09 4.96 -0.23 4.85 1.01 -1.26 -0.15 116.67 125.76 1ott s ASP 215 Ca -0.00 -1.55 -0.13 0.00 0.71 0.00 0.00 52.55 51.58 1ott s ASP 215 Cb -0.01 -1.73 -0.04 0.00 1.01 0.00 0.00 42.92 42.15 1ott s ASP 215 CO -0.00 -0.34 0.29 -0.75 0.21 0.00 0.00 175.17 174.58 1ott s LYS 216 N 1.19 4.11 -0.25 8.23 2.47 -0.15 -4.92 119.74 130.41 1ott s LYS 216 Ca -0.00 -0.03 -0.21 0.00 -1.56 0.00 0.00 55.97 54.16 1ott s LYS 216 Cb -0.20 -3.55 -0.02 0.00 -1.46 0.00 0.00 37.83 32.60 1ott s LYS 216 CO -0.03 -0.02 0.67 0.21 0.16 0.00 0.00 175.35 176.34 1ott s LYS 217 N 1.29 4.13 -0.67 4.03 2.20 -1.26 -1.15 119.74 128.31 1ott s LYS 217 Ca 0.13 0.63 -0.27 0.00 -0.36 0.00 0.00 55.97 56.10 1ott s LYS 217 Cb -0.14 -3.65 0.03 0.00 -1.51 0.00 0.00 37.83 32.56 1ott s LYS 217 CO 0.07 -0.43 1.31 0.42 -0.36 0.00 0.00 175.35 176.36 1ott s ILE 218 N 2.55 3.78 -0.06 5.43 -1.09 -0.15 -4.93 121.20 126.73 1ott s ILE 218 Ca 0.28 0.55 -0.01 0.00 -2.23 0.00 0.00 60.65 59.24 1ott s ILE 218 Cb -0.15 -4.76 -0.04 0.00 -1.58 0.00 0.00 42.46 35.93 1ott s ILE 218 CO 0.08 -1.60 0.03 0.68 -1.23 0.00 0.00 174.94 172.90 1ott s VAL 219 N 5.77 4.50 0.62 2.92 -7.23 -1.26 -4.60 120.40 121.11 1ott s VAL 219 Ca 0.41 -0.30 -0.18 0.00 -1.81 0.00 0.00 61.98 60.10 1ott s VAL 219 Cb -0.08 -2.96 -0.06 0.00 0.56 0.00 0.00 36.38 33.84 1ott s VAL 219 CO 0.19 0.51 0.72 -0.81 -0.31 0.00 0.00 175.10 175.40 1ott n PRO 220 N 1.78 0.61 -2.06 4.82 -0.04 -1.26 -4.73 135.00 134.12 1ott n PRO 220 Ca -0.17 0.25 -0.28 0.00 -0.04 0.00 0.00 63.50 63.26 1ott n PRO 220 Cb 0.53 -1.93 -0.06 0.00 -0.04 0.00 0.00 33.50 32.01 1ott n PRO 220 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1ott s ARG 221 N -2.53 2.48 0.00 0.54 0.52 -1.26 -5.09 118.95 113.62 1ott s ARG 221 Ca 0.72 -1.05 0.16 0.00 -0.52 0.00 0.00 55.73 55.04 1ott s ARG 221 Cb -0.41 -5.22 0.94 0.00 0.52 0.00 0.00 34.95 30.78 1ott s ARG 221 CO 0.51 -3.93 1.35 0.00 0.02 0.00 0.00 175.30 173.26