#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mam s VAL 2 N 0.00 0.61 0.06 6.31 1.01 -1.26 -4.47 120.40 122.65 1mam s VAL 2 Ca 0.00 -1.94 -0.14 0.00 0.00 0.00 0.00 61.98 59.90 1mam s VAL 2 Cb 0.00 -1.44 -0.06 0.00 0.00 0.00 0.00 36.38 34.88 1mam s VAL 2 CO 0.00 -0.93 0.45 -0.54 0.00 0.00 0.00 175.10 174.08 1mam s LYS 3 N 0.90 3.92 -0.13 2.72 1.02 -0.62 -4.89 119.74 122.67 1mam s LYS 3 Ca 0.17 0.40 -0.04 0.00 0.02 0.00 0.00 55.97 56.52 1mam s LYS 3 Cb -0.23 -3.11 0.05 0.00 -0.52 0.00 0.00 37.83 34.03 1mam s LYS 3 CO -0.02 0.61 0.10 -0.51 -0.92 0.00 0.00 175.35 174.61 1mam s LEU 4 N -1.47 0.21 -0.17 3.17 1.43 -1.24 -0.69 118.68 119.92 1mam s LEU 4 Ca 0.29 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 53.10 1mam s LEU 4 Cb -0.16 -0.12 0.02 0.00 0.03 0.00 0.00 46.19 45.96 1mam s LEU 4 CO 0.16 -0.31 -0.20 -0.69 0.23 0.00 0.00 176.35 175.54 1mam s VAL 5 N 2.18 2.06 0.21 -1.59 1.01 0.13 -4.30 120.40 120.10 1mam s VAL 5 Ca 0.03 -0.95 -0.14 0.00 0.00 0.00 0.00 61.98 60.92 1mam s VAL 5 Cb -0.15 -1.85 -0.08 0.00 0.00 0.00 0.00 36.38 34.30 1mam s VAL 5 CO -0.07 0.54 0.62 -1.61 0.00 0.00 0.00 175.10 174.58 1mam s GLU 6 N 1.19 3.99 0.00 2.72 8.01 -1.26 -1.59 118.70 131.76 1mam s GLU 6 Ca 0.02 0.55 0.00 0.00 0.01 0.00 0.00 54.97 55.55 1mam s GLU 6 Cb -0.14 -2.76 0.00 0.00 -4.31 0.00 0.00 34.13 26.93 1mam s GLU 6 CO -0.11 0.36 0.00 0.45 0.01 0.00 0.00 175.26 175.98 1mam n SER 7 N 0.34 0.23 -1.04 -0.19 2.88 -0.56 -4.77 113.62 110.51 1mam n SER 7 Ca -0.02 -0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 1mam n SER 7 Cb 0.52 0.14 0.12 0.00 -0.75 0.00 0.00 64.21 64.24 1mam n SER 7 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1mam n GLY 8 N 0.21 2.14 3.68 0.46 0.00 -1.26 -4.86 105.19 105.56 1mam n GLY 8 Ca 0.00 -0.31 -0.29 0.00 0.00 0.00 0.00 46.02 45.42 1mam n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mam s GLY 9 N -0.16 1.56 0.00 -0.02 0.00 -1.26 -4.83 107.32 102.61 1mam s GLY 9 Ca 0.18 -0.45 0.00 0.00 0.00 0.00 0.00 44.72 44.45 1mam s GLY 9 CO 0.05 0.18 0.00 0.61 0.00 0.00 0.00 173.10 173.94 1mam n GLY 10 N -1.24 0.31 3.72 0.20 0.00 -0.89 -4.98 105.19 102.31 1mam n GLY 10 Ca 0.06 -1.68 -0.39 0.00 0.00 0.00 0.00 46.02 44.01 1mam n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1mam s LEU 11 N 0.00 4.30 0.11 0.99 0.20 -1.26 -1.56 118.68 121.46 1mam s LEU 11 Ca 0.00 0.98 0.08 0.00 0.69 0.00 0.00 54.13 55.87 1mam s LEU 11 Cb 0.00 -2.85 -0.03 0.00 -0.43 0.00 0.00 46.19 42.87 1mam s LEU 11 CO 0.00 -0.03 -0.20 -0.69 -0.29 0.00 0.00 176.35 175.14 1mam s VAL 12 N 0.62 1.63 0.50 1.68 1.01 0.14 -4.95 120.40 121.03 1mam s VAL 12 Ca 0.31 -1.56 -0.04 0.00 0.00 0.00 0.00 61.98 60.69 1mam s VAL 12 Cb -0.16 -1.52 -0.02 0.00 0.00 0.00 0.00 36.38 34.68 1mam s VAL 12 CO 0.14 -0.12 0.79 -1.58 0.00 0.00 0.00 175.10 174.32 1mam s GLN 13 N -2.00 3.28 0.55 2.72 2.00 -1.25 -0.45 119.66 124.51 1mam s GLN 13 Ca 0.06 -0.01 -0.21 0.00 -2.00 0.00 0.00 55.36 53.20 1mam s GLN 13 Cb -0.09 -2.39 -0.05 0.00 0.80 0.00 0.00 33.01 31.28 1mam s GLN 13 CO 0.04 -0.34 1.32 -2.14 -0.50 0.00 0.00 175.29 173.68 1mam s PRO 14 N -4.76 3.12 0.00 1.67 0.02 -1.26 -2.48 135.00 131.31 1mam s PRO 14 Ca 0.49 2.15 0.00 0.00 0.02 0.00 0.00 61.00 63.65 1mam s PRO 14 Cb -0.10 -2.20 0.00 0.00 0.02 0.00 0.00 34.50 32.22 1mam s PRO 14 CO 0.43 -1.18 0.00 0.41 -0.33 0.00 0.00 177.00 176.33 1mam n GLY 15 N 0.71 2.73 3.91 0.52 0.00 0.46 -4.93 105.19 108.59 1mam n GLY 15 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1mam n GLY 15 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mam s GLY 16 N -2.00 1.66 0.17 -0.02 0.00 -1.03 -3.98 107.32 102.11 1mam s GLY 16 Ca 0.00 -0.85 0.05 0.00 0.00 0.00 0.00 44.72 43.92 1mam s GLY 16 CO 0.00 -0.28 -0.09 -1.35 0.00 0.00 0.00 173.10 171.38 1mam s SER 17 N -4.67 1.94 -0.13 1.64 1.04 -1.26 -1.05 113.70 111.21 1mam s SER 17 Ca 0.65 -1.06 -0.17 0.00 0.48 0.00 0.00 55.95 55.86 1mam s SER 17 Cb -0.09 -0.03 0.04 0.00 0.10 0.00 0.00 66.02 66.05 1mam s SER 17 CO 0.50 -0.34 0.45 -0.76 0.98 0.00 0.00 173.24 174.07 1mam s LEU 18 N -3.22 0.27 -0.38 2.42 1.43 -0.99 -5.03 118.68 113.19 1mam s LEU 18 Ca 0.20 0.74 -0.14 0.00 -1.03 0.00 0.00 54.13 53.90 1mam s LEU 18 Cb 0.03 1.61 0.01 0.00 0.03 0.00 0.00 46.19 47.87 1mam s LEU 18 CO 0.03 -0.26 0.27 -0.60 0.23 0.00 0.00 176.35 176.01 1mam s ARG 19 N -0.22 3.17 -0.12 1.70 3.52 -1.26 -1.57 118.95 124.17 1mam s ARG 19 Ca -0.04 -0.87 -0.10 0.00 -0.13 0.00 0.00 55.73 54.59 1mam s ARG 19 Cb -0.03 -3.89 -0.05 0.00 -1.56 0.00 0.00 34.95 29.43 1mam s ARG 19 CO 0.02 -0.62 0.21 -0.51 -0.81 0.00 0.00 175.30 173.59 1mam s LEU 20 N 1.69 4.36 0.13 -0.88 1.02 0.55 -4.24 118.68 121.30 1mam s LEU 20 Ca 0.05 0.53 0.10 0.00 0.02 0.00 0.00 54.13 54.82 1mam s LEU 20 Cb -0.18 -2.21 -0.04 0.00 0.02 0.00 0.00 46.19 43.78 1mam s LEU 20 CO 0.10 0.32 -0.24 -0.94 0.02 0.00 0.00 176.35 175.61 1mam s SER 21 N -0.62 2.97 -0.12 2.29 1.04 -1.26 -0.64 113.70 117.36 1mam s SER 21 Ca 0.16 -0.74 -0.00 0.00 0.48 0.00 0.00 55.95 55.84 1mam s SER 21 Cb -0.13 -0.19 0.02 0.00 0.10 0.00 0.00 66.02 65.83 1mam s SER 21 CO 0.05 0.11 -0.09 0.00 0.98 0.00 0.00 173.24 174.28 1mam s ALA 23 N 1.60 3.69 0.10 0.00 0.00 -0.62 -2.06 121.76 124.47 1mam s ALA 23 Ca 0.04 -0.84 0.02 0.00 0.00 0.00 0.00 51.96 51.17 1mam s ALA 23 Cb -0.13 -1.66 -0.04 0.00 0.00 0.00 0.00 23.12 21.29 1mam s ALA 23 CO -0.08 0.71 -0.07 0.95 0.00 0.00 0.00 175.76 177.27 1mam s THR 24 N -1.24 0.73 -0.14 0.00 -4.23 -1.20 -0.69 115.64 108.88 1mam s THR 24 Ca 0.24 -1.92 -0.30 0.00 -1.18 0.00 0.00 61.69 58.53 1mam s THR 24 Cb -0.12 -1.67 0.10 0.00 1.34 0.00 0.00 72.50 72.15 1mam s THR 24 CO 0.16 -0.85 0.87 -0.94 -0.54 0.00 0.00 174.62 173.31 1mam s SER 25 N -3.02 -0.50 0.00 3.99 1.04 0.13 -4.89 113.70 110.45 1mam s SER 25 Ca 0.12 0.62 0.00 0.00 0.48 0.00 0.00 55.95 57.16 1mam s SER 25 Cb 0.05 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.67 1mam s SER 25 CO -0.04 -0.42 0.00 0.61 0.98 0.00 0.00 173.24 174.37 1mam n GLY 26 N 1.03 0.65 3.77 7.32 0.00 -1.26 -1.59 105.19 115.12 1mam n GLY 26 Ca -0.14 -0.54 -0.08 0.00 0.00 0.00 0.00 46.02 45.27 1mam n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1mam s PHE 27 N -2.00 -0.25 -0.70 1.61 -0.71 -1.26 -4.84 117.98 109.83 1mam s PHE 27 Ca 0.00 -0.15 -0.25 0.00 -1.04 0.00 0.00 56.93 55.49 1mam s PHE 27 Cb 0.00 0.68 0.05 0.00 -1.21 0.00 0.00 43.02 42.54 1mam s PHE 27 CO 0.00 -1.14 1.13 0.99 -1.34 0.00 0.00 175.22 174.86 1mam s THR 28 N -3.84 4.02 0.51 -4.49 2.01 -1.26 -4.87 115.64 107.70 1mam s THR 28 Ca 0.09 0.05 0.19 0.00 0.31 0.00 0.00 61.69 62.32 1mam s THR 28 Cb -0.05 -4.80 0.32 0.00 0.01 0.00 0.00 72.50 67.98 1mam s THR 28 CO 0.03 -1.66 2.06 0.15 -0.69 0.00 0.00 174.62 174.51 1mam h PHE 29 N 9.80 0.09 0.00 4.92 3.57 -1.97 -0.63 116.94 132.72 1mam h PHE 29 Ca -0.28 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.20 1mam h PHE 29 Cb 1.06 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.77 1mam h PHE 29 CO 1.05 0.05 -0.08 1.15 -2.23 0.00 0.00 178.31 178.25 1mam h THR 30 N 0.09 0.57 0.00 4.41 2.02 -1.93 -3.03 112.91 115.04 1mam h THR 30 Ca 0.14 -0.35 -0.08 0.00 0.77 0.00 0.00 66.41 66.90 1mam h THR 30 Cb 0.45 1.22 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 1mam h THR 30 CO -0.01 0.08 -0.37 0.44 0.37 0.00 0.00 175.52 176.02 1mam h ASP 31 N 0.00 0.00 -3.53 4.18 5.19 -1.42 -1.65 116.42 119.20 1mam h ASP 31 Ca -0.00 0.00 -0.67 0.00 -0.62 0.00 0.00 57.03 55.74 1mam h ASP 31 Cb 0.21 0.00 -0.16 0.00 0.18 0.00 0.00 39.33 39.57 1mam h ASP 31 CO 0.01 0.37 -0.69 -0.31 -3.12 0.00 0.00 179.24 175.51 1mam s TYR 32 N -3.22 2.93 0.15 4.55 2.02 -1.15 -4.79 117.35 117.85 1mam s TYR 32 Ca 0.03 -0.02 -0.31 0.00 -0.37 0.00 0.00 57.07 56.40 1mam s TYR 32 Cb 0.08 -1.61 -0.09 0.00 -0.40 0.00 0.00 41.96 39.95 1mam s TYR 32 CO 0.71 0.41 1.44 0.71 -1.57 0.00 0.00 175.55 177.24 1mam s TYR 33 N -1.06 3.16 -0.15 2.71 1.51 -1.26 -4.41 117.35 117.85 1mam s TYR 33 Ca 0.19 0.88 0.01 0.00 -1.01 0.00 0.00 57.07 57.14 1mam s TYR 33 Cb -0.11 -3.77 0.00 0.00 -0.11 0.00 0.00 41.96 37.97 1mam s TYR 33 CO 0.09 -2.70 -0.18 -1.64 -1.11 0.00 0.00 175.55 170.02 1mam s MET 34 N 0.84 3.14 0.08 -0.62 -1.94 -0.79 -0.98 119.30 119.02 1mam s MET 34 Ca 0.65 -0.79 0.07 0.00 -1.71 0.00 0.00 55.69 53.91 1mam s MET 34 Cb -0.40 -2.55 -0.03 0.00 2.01 0.00 0.00 34.83 33.86 1mam s MET 34 CO 0.33 -0.00 -0.20 0.45 -0.01 0.00 0.00 175.02 175.59 1mam s SER 35 N 0.83 2.36 -0.10 3.03 0.15 0.09 -0.74 113.70 119.31 1mam s SER 35 Ca -0.06 -0.61 0.02 0.00 0.70 0.00 0.00 55.95 56.01 1mam s SER 35 Cb -0.15 -0.15 -0.01 0.00 -1.71 0.00 0.00 66.02 64.00 1mam s SER 35 CO -0.01 0.08 -0.18 0.26 1.20 0.00 0.00 173.24 174.59 1mam s TRP 36 N -1.03 2.68 0.28 3.44 0.52 -0.55 -0.64 118.94 123.64 1mam s TRP 36 Ca 0.06 -0.72 0.06 0.00 0.02 0.00 0.00 56.10 55.52 1mam s TRP 36 Cb -0.09 -1.75 -0.06 0.00 -1.15 0.00 0.00 33.47 30.41 1mam s TRP 36 CO 0.03 -0.23 -0.05 0.08 0.02 0.00 0.00 176.95 176.80 1mam s VAL 37 N 0.17 1.58 0.08 4.03 1.01 -0.88 -1.14 120.40 125.26 1mam s VAL 37 Ca -0.10 -2.11 -0.09 0.00 0.00 0.00 0.00 61.98 59.68 1mam s VAL 37 Cb -0.16 -2.46 0.00 0.00 0.00 0.00 0.00 36.38 33.77 1mam s VAL 37 CO 0.06 -0.29 0.19 0.00 0.00 0.00 0.00 175.10 175.06 1mam s ARG 38 N -3.74 0.81 -0.25 2.72 1.70 -0.27 -1.09 118.95 118.83 1mam s ARG 38 Ca 0.30 -0.87 0.01 0.00 -0.47 0.00 0.00 55.73 54.70 1mam s ARG 38 Cb 0.04 0.33 0.07 0.00 -0.57 0.00 0.00 34.95 34.82 1mam s ARG 38 CO 0.12 -0.25 -0.05 -1.14 -1.08 0.00 0.00 175.30 172.90 1mam s GLN 39 N -3.54 1.69 0.76 3.89 0.74 0.12 -0.64 119.66 122.67 1mam s GLN 39 Ca 0.02 -1.15 -0.14 0.00 0.05 0.00 0.00 55.36 54.14 1mam s GLN 39 Cb 0.03 -2.68 0.05 0.00 1.10 0.00 0.00 33.01 31.52 1mam s GLN 39 CO -0.09 -0.64 1.19 -2.14 -0.55 0.00 0.00 175.29 173.05 1mam s PRO 40 N 1.30 2.00 0.10 1.67 0.02 -1.26 -1.40 135.00 137.44 1mam s PRO 40 Ca -0.04 1.70 -0.31 0.00 0.02 0.00 0.00 61.00 62.37 1mam s PRO 40 Cb -0.19 -1.82 -0.10 0.00 0.02 0.00 0.00 34.50 32.41 1mam s PRO 40 CO -0.07 -1.92 1.75 -2.14 -0.33 0.00 0.00 177.00 174.29 1mam s PRO 41 N -4.06 4.16 0.00 5.54 0.02 -1.26 -3.18 135.00 136.23 1mam s PRO 41 Ca 0.73 2.48 0.00 0.00 0.02 0.00 0.00 61.00 64.23 1mam s PRO 41 Cb -0.28 -3.58 0.00 0.00 0.02 0.00 0.00 34.50 30.66 1mam s PRO 41 CO 0.47 -0.79 0.00 0.41 -0.33 0.00 0.00 177.00 176.76 1mam n GLY 42 N 4.12 1.90 3.14 0.52 0.00 -1.26 -4.97 105.19 108.63 1mam n GLY 42 Ca 0.17 -0.65 -0.36 0.00 0.00 0.00 0.00 46.02 45.18 1mam n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1mam n LYS 43 N 0.00 -0.43 -0.93 1.61 4.76 -1.19 -5.00 118.16 116.98 1mam n LYS 43 Ca 0.00 -0.11 -0.29 0.00 -2.87 0.00 0.00 58.31 55.04 1mam n LYS 43 Cb 0.00 -1.31 0.22 0.00 -1.84 0.00 0.00 35.03 32.09 1mam n LYS 43 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1mam s ALA 44 N -2.12 0.32 0.35 7.82 0.00 -1.26 -4.51 121.76 122.36 1mam s ALA 44 Ca 0.45 -0.41 -0.26 0.00 0.00 0.00 0.00 51.96 51.74 1mam s ALA 44 Cb -0.08 -3.11 -0.09 0.00 0.00 0.00 0.00 23.12 19.84 1mam s ALA 44 CO 0.71 -3.37 1.01 -0.51 0.00 0.00 0.00 175.76 173.60 1mam s LEU 45 N -6.84 4.27 -0.18 0.00 1.43 -1.26 -4.30 118.68 111.80 1mam s LEU 45 Ca 0.67 1.99 -0.00 0.00 -1.03 0.00 0.00 54.13 55.76 1mam s LEU 45 Cb -0.19 -4.05 0.04 0.00 0.03 0.00 0.00 46.19 42.02 1mam s LEU 45 CO 0.60 -0.28 -0.06 -0.70 0.23 0.00 0.00 176.35 176.14 1mam s GLU 46 N -2.18 1.55 0.25 1.70 2.12 0.19 -4.99 118.70 117.33 1mam s GLU 46 Ca 0.53 -0.60 -0.30 0.00 0.36 0.00 0.00 54.97 54.96 1mam s GLU 46 Cb -0.22 -2.12 -0.09 0.00 0.26 0.00 0.00 34.13 31.96 1mam s GLU 46 CO 0.28 -0.44 1.10 -0.46 -0.54 0.00 0.00 175.26 175.19 1mam s TRP 47 N 1.58 3.60 -0.21 5.30 -0.00 -1.26 -1.11 118.94 126.84 1mam s TRP 47 Ca 0.00 1.68 -0.00 0.00 -0.00 0.00 0.00 56.10 57.78 1mam s TRP 47 Cb -0.16 -3.27 -0.13 0.00 -0.00 0.00 0.00 33.47 29.91 1mam s TRP 47 CO -0.08 -0.53 -0.20 1.28 -0.00 0.00 0.00 176.95 177.42 1mam n LEU 48 N 1.53 2.77 0.00 5.86 4.77 -0.29 -4.69 117.00 126.95 1mam n LEU 48 Ca -0.00 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1mam n LEU 48 Cb 0.45 -0.71 0.00 0.00 -2.33 0.00 0.00 43.42 40.83 1mam n LEU 48 CO 0.54 0.79 0.00 0.61 -1.33 0.00 0.00 177.39 178.00 1mam n GLY 49 N 2.38 2.14 3.47 -0.72 0.00 -1.15 -0.35 105.19 110.95 1mam n GLY 49 Ca -0.38 -0.47 -0.22 0.00 0.00 0.00 0.00 46.02 44.95 1mam n GLY 49 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1mam s PHE 50 N -2.00 2.04 -0.10 1.61 -0.12 -0.63 -1.48 117.98 117.31 1mam s PHE 50 Ca 0.00 -0.84 0.02 0.00 -0.05 0.00 0.00 56.93 56.07 1mam s PHE 50 Cb 0.00 -1.31 0.01 0.00 -0.63 0.00 0.00 43.02 41.09 1mam s PHE 50 CO 0.00 0.16 -0.18 -1.50 -0.05 0.00 0.00 175.22 173.65 1mam s ILE 51 N -3.12 1.63 1.41 -4.49 2.07 0.08 -0.49 121.20 118.29 1mam s ILE 51 Ca 0.34 -0.74 -0.23 0.00 -1.41 0.00 0.00 60.65 58.61 1mam s ILE 51 Cb 0.07 -1.46 0.36 0.00 0.13 0.00 0.00 42.46 41.57 1mam s ILE 51 CO 0.15 0.47 0.94 -0.13 -1.91 0.00 0.00 174.94 174.46 1mam s ARG 52 N 0.74 -2.88 0.29 3.50 0.52 0.46 -1.88 118.95 119.69 1mam s ARG 52 Ca -0.11 0.10 0.08 0.00 -0.52 0.00 0.00 55.73 55.27 1mam s ARG 52 Cb -0.16 -1.39 -0.04 0.00 0.52 0.00 0.00 34.95 33.89 1mam s ARG 52 CO 0.02 -4.83 0.15 0.54 0.02 0.00 0.00 175.30 171.20 1mam s ASN 53 N -3.23 5.06 -0.36 0.23 4.22 -1.23 -4.56 114.94 115.07 1mam s ASN 53 Ca 0.69 -0.51 -0.27 0.00 -2.14 0.00 0.00 52.86 50.63 1mam s ASN 53 Cb -0.12 -1.04 -0.05 0.00 1.28 0.00 0.00 41.25 41.31 1mam s ASN 53 CO 0.58 -0.14 2.25 -0.75 -2.04 0.00 0.00 177.10 177.00 1mam s LYS 54 N -3.83 2.69 0.00 3.55 2.20 -0.62 -3.19 119.74 120.54 1mam s LYS 54 Ca 0.35 1.67 0.00 0.00 -0.36 0.00 0.00 55.97 57.63 1mam s LYS 54 Cb -0.06 -4.45 0.00 0.00 -1.51 0.00 0.00 37.83 31.81 1mam s LYS 54 CO 0.23 -2.61 0.00 0.00 -0.36 0.00 0.00 175.35 172.62 1mam n ALA 55 N 13.40 0.00 0.92 3.13 0.00 -1.26 -4.80 120.51 131.90 1mam n ALA 55 Ca 0.32 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.88 1mam n ALA 55 Cb 0.49 0.00 0.18 0.00 0.00 0.00 0.00 19.45 20.12 1mam n ALA 55 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1mam n ASP 56 N -2.17 2.89 -0.77 0.00 -0.08 -1.19 -5.14 116.55 110.10 1mam n ASP 56 Ca 0.00 -1.94 0.00 0.00 -1.51 0.00 0.00 54.79 51.34 1mam n ASP 56 Cb 0.00 -0.06 0.00 0.00 2.34 0.00 0.00 41.12 43.40 1mam n ASP 56 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1mam n GLY 57 N 1.36 -0.50 2.72 0.27 0.00 -1.21 -3.76 105.19 104.06 1mam n GLY 57 Ca 0.16 -0.96 -0.34 0.00 0.00 0.00 0.00 46.02 44.88 1mam n GLY 57 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1mam n TYR 58 N -1.53 3.23 -1.94 1.61 4.01 -1.26 -3.57 117.16 117.71 1mam n TYR 58 Ca 0.00 -2.80 -0.38 0.00 -0.16 0.00 0.00 57.90 54.56 1mam n TYR 58 Cb 0.00 -0.69 0.02 0.00 -0.31 0.00 0.00 39.34 38.37 1mam n TYR 58 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1mam s THR 59 N -5.16 2.41 0.01 -0.72 -4.23 -1.25 -4.27 115.64 102.43 1mam s THR 59 Ca 0.49 0.31 0.03 0.00 -1.18 0.00 0.00 61.69 61.35 1mam s THR 59 Cb 0.39 -3.16 -0.03 0.00 1.34 0.00 0.00 72.50 71.03 1mam s THR 59 CO -0.28 0.00 -0.05 0.42 -0.54 0.00 0.00 174.62 174.17 1mam s THR 60 N -1.36 3.74 0.10 3.99 -4.23 -1.26 -0.41 115.64 116.21 1mam s THR 60 Ca 0.67 -0.79 0.07 0.00 -1.18 0.00 0.00 61.69 60.46 1mam s THR 60 Cb -0.37 -2.65 -0.04 0.00 1.34 0.00 0.00 72.50 70.78 1mam s THR 60 CO 0.45 0.36 -0.10 -0.70 -0.54 0.00 0.00 174.62 174.08 1mam s GLU 61 N -1.55 2.13 0.03 3.99 2.56 0.35 -4.97 118.70 121.24 1mam s GLU 61 Ca 0.18 -1.02 -0.02 0.00 0.00 0.00 0.00 54.97 54.12 1mam s GLU 61 Cb -0.11 -2.31 -0.02 0.00 2.00 0.00 0.00 34.13 33.69 1mam s GLU 61 CO 0.09 0.51 -0.00 0.71 -0.56 0.00 0.00 175.26 176.01 1mam s TYR 62 N -1.20 0.31 0.40 5.30 2.02 -1.26 -1.60 117.35 121.32 1mam s TYR 62 Ca 0.21 -0.65 -0.06 0.00 -0.37 0.00 0.00 57.07 56.21 1mam s TYR 62 Cb -0.11 -0.23 -0.05 0.00 -0.40 0.00 0.00 41.96 41.18 1mam s TYR 62 CO 0.13 -0.27 0.70 -1.54 -1.57 0.00 0.00 175.55 173.00 1mam s SER 63 N -1.95 6.37 0.36 2.29 1.04 0.53 -4.81 113.70 117.52 1mam s SER 63 Ca -0.08 0.87 0.17 0.00 0.48 0.00 0.00 55.95 57.39 1mam s SER 63 Cb -0.04 -2.22 1.22 0.00 0.10 0.00 0.00 66.02 65.09 1mam s SER 63 CO -0.04 -0.42 1.59 0.00 0.98 0.00 0.00 173.24 175.36 1mam h ALA 64 N 0.86 1.99 -0.22 5.32 0.00 -1.95 -0.32 119.26 124.94 1mam h ALA 64 Ca -0.47 0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 1mam h ALA 64 Cb 1.20 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1mam h ALA 64 CO 0.63 -0.85 0.04 0.77 0.00 0.00 0.00 179.25 179.84 1mam h SER 65 N 0.05 0.28 0.00 0.00 0.02 -1.96 -3.33 113.55 108.61 1mam h SER 65 Ca 0.80 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.72 1mam h SER 65 Cb 2.02 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 64.49 1mam h SER 65 CO -0.77 0.30 -0.49 1.33 -1.14 0.00 0.00 176.83 176.06 1mam n VAL 66 N -4.40 0.00 -1.59 2.27 0.24 -0.24 -4.95 118.33 109.66 1mam n VAL 66 Ca 0.00 -0.27 -0.49 0.00 -2.04 0.00 0.00 64.34 61.55 1mam n VAL 66 Cb 0.16 0.76 -0.04 0.00 -1.47 0.00 0.00 33.84 33.25 1mam n VAL 66 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1mam n LYS 67 N -1.25 1.27 0.00 7.34 4.81 -0.55 -0.26 118.16 129.52 1mam n LYS 67 Ca 0.00 0.45 0.00 0.00 -0.87 0.00 0.00 58.31 57.89 1mam n LYS 67 Cb 0.01 -1.99 0.00 0.00 0.02 0.00 0.00 35.03 33.07 1mam n LYS 67 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1mam n GLY 68 N 2.12 2.78 0.13 3.14 0.00 -1.26 -4.64 105.19 107.46 1mam n GLY 68 Ca 0.15 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.98 1mam n GLY 68 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1mam n ARG 69 N -0.74 0.66 -4.17 1.61 0.63 -0.25 -4.94 116.66 109.46 1mam n ARG 69 Ca 0.00 0.17 -0.27 0.00 -0.92 0.00 0.00 57.85 56.83 1mam n ARG 69 Cb 0.00 -1.55 -0.07 0.00 0.45 0.00 0.00 32.46 31.29 1mam n ARG 69 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 1mam s PHE 70 N -2.52 2.93 -0.07 -0.14 0.40 0.64 -2.06 117.98 117.16 1mam s PHE 70 Ca -0.33 -0.09 -0.03 0.00 -0.60 0.00 0.00 56.93 55.87 1mam s PHE 70 Cb 0.09 -1.43 0.04 0.00 0.51 0.00 0.00 43.02 42.23 1mam s PHE 70 CO 0.62 0.51 0.16 0.99 0.70 0.00 0.00 175.22 178.21 1mam s THR 71 N -1.67 -0.05 -0.15 0.64 2.01 0.00 -4.68 115.64 111.74 1mam s THR 71 Ca 0.28 0.17 -0.07 0.00 0.31 0.00 0.00 61.69 62.39 1mam s THR 71 Cb -0.10 -0.26 -0.04 0.00 0.01 0.00 0.00 72.50 72.11 1mam s THR 71 CO 0.20 0.07 0.08 -0.63 -0.69 0.00 0.00 174.62 173.65 1mam s ILE 72 N 1.18 4.97 0.36 1.82 1.01 -1.26 -1.50 121.20 127.78 1mam s ILE 72 Ca -0.09 0.02 0.03 0.00 0.00 0.00 0.00 60.65 60.61 1mam s ILE 72 Cb -0.11 -3.20 -0.04 0.00 0.01 0.00 0.00 42.46 39.11 1mam s ILE 72 CO -0.06 0.53 0.09 -0.44 0.00 0.00 0.00 174.94 175.05 1mam s SER 73 N -0.22 2.48 -0.04 3.58 0.01 -1.10 -4.99 113.70 113.41 1mam s SER 73 Ca 0.09 -1.51 -0.13 0.00 1.31 0.00 0.00 55.95 55.71 1mam s SER 73 Cb -0.12 0.20 0.02 0.00 0.21 0.00 0.00 66.02 66.34 1mam s SER 73 CO 0.01 -0.76 0.29 -0.60 0.41 0.00 0.00 173.24 172.58 1mam s ARG 74 N -3.83 0.55 -0.08 12.44 3.52 -1.26 -0.33 118.95 129.96 1mam s ARG 74 Ca 0.31 -0.03 0.01 0.00 -0.13 0.00 0.00 55.73 55.88 1mam s ARG 74 Cb 0.06 0.25 0.02 0.00 -1.56 0.00 0.00 34.95 33.71 1mam s ARG 74 CO 0.15 -0.13 -0.08 0.34 -0.81 0.00 0.00 175.30 174.76 1mam s ASP 75 N -0.87 1.79 -0.02 -2.12 2.15 0.11 -4.95 116.67 112.76 1mam s ASP 75 Ca -0.10 -0.26 0.22 0.00 0.43 0.00 0.00 52.55 52.84 1mam s ASP 75 Cb -0.05 -0.75 0.65 0.00 -0.30 0.00 0.00 42.92 42.48 1mam s ASP 75 CO 0.03 -0.05 1.55 0.59 -0.17 0.00 0.00 175.17 177.11 1mam n ASN 76 N 4.37 4.07 -0.12 -0.34 4.13 -1.26 -2.59 115.26 123.51 1mam n ASN 76 Ca -0.18 -2.07 -0.25 0.00 1.68 0.00 0.00 54.58 53.76 1mam n ASN 76 Cb 0.51 -0.50 -0.09 0.00 -1.54 0.00 0.00 39.78 38.16 1mam n ASN 76 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1mam n SER 77 N 1.55 1.93 0.17 6.41 7.64 -1.26 -4.49 113.62 125.57 1mam n SER 77 Ca 0.25 0.37 0.04 0.00 1.01 0.00 0.00 58.87 60.53 1mam n SER 77 Cb 0.66 -0.84 0.23 0.00 -1.01 0.00 0.00 64.21 63.25 1mam n SER 77 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1mam h GLN 78 N -1.00 0.00 -4.70 1.43 1.08 -2.02 -3.48 115.11 106.41 1mam h GLN 78 Ca -0.52 0.00 -0.27 0.00 -1.45 0.00 0.00 58.65 56.41 1mam h GLN 78 Cb 1.43 0.00 0.12 0.00 -0.05 0.00 0.00 27.48 28.98 1mam h GLN 78 CO -0.31 0.45 -0.55 0.43 -0.95 0.00 0.00 178.83 177.90 1mam n SER 79 N -3.47 -3.63 -4.63 1.46 7.64 -1.07 -4.93 113.62 105.00 1mam n SER 79 Ca 0.00 -0.44 -0.41 0.00 1.01 0.00 0.00 58.87 59.03 1mam n SER 79 Cb 0.59 -3.95 -0.05 0.00 -1.01 0.00 0.00 64.21 59.78 1mam n SER 79 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1mam s ILE 80 N -3.26 4.91 0.24 0.44 1.01 -1.17 -3.20 121.20 120.16 1mam s ILE 80 Ca 0.22 1.30 -0.20 0.00 0.00 0.00 0.00 60.65 61.96 1mam s ILE 80 Cb -0.09 -4.03 -0.08 0.00 0.01 0.00 0.00 42.46 38.26 1mam s ILE 80 CO 0.55 -0.04 0.75 -0.22 0.00 0.00 0.00 174.94 175.97 1mam s LEU 81 N 2.68 4.34 0.16 2.97 2.96 -0.87 0.06 118.68 130.97 1mam s LEU 81 Ca 0.30 1.46 0.06 0.00 -0.22 0.00 0.00 54.13 55.73 1mam s LEU 81 Cb -0.15 -3.64 -0.04 0.00 0.50 0.00 0.00 46.19 42.85 1mam s LEU 81 CO 0.08 0.02 -0.13 -0.31 -1.32 0.00 0.00 176.35 174.69 1mam s TYR 82 N -1.54 1.44 -0.20 5.38 2.02 0.56 -0.39 117.35 124.61 1mam s TYR 82 Ca 0.44 -0.64 -0.04 0.00 -0.37 0.00 0.00 57.07 56.46 1mam s TYR 82 Cb -0.17 -0.72 0.07 0.00 -0.40 0.00 0.00 41.96 40.74 1mam s TYR 82 CO 0.21 0.18 0.07 -1.17 -1.57 0.00 0.00 175.55 173.28 1mam s LEU 83 N -2.99 0.80 -0.27 -1.29 2.96 0.18 -2.72 118.68 115.35 1mam s LEU 83 Ca 0.16 -0.83 -0.13 0.00 -0.22 0.00 0.00 54.13 53.10 1mam s LEU 83 Cb -0.01 -0.43 -0.04 0.00 0.50 0.00 0.00 46.19 46.22 1mam s LEU 83 CO 0.03 -0.35 0.30 -1.58 -1.32 0.00 0.00 176.35 173.44 1mam s GLN 84 N 2.00 4.00 -0.19 1.98 2.00 -0.56 -0.33 119.66 128.55 1mam s GLN 84 Ca 0.02 -0.09 -0.06 0.00 -2.00 0.00 0.00 55.36 53.23 1mam s GLN 84 Cb -0.16 -3.65 -0.03 0.00 0.80 0.00 0.00 33.01 29.97 1mam s GLN 84 CO -0.13 -0.22 0.03 -1.64 -0.50 0.00 0.00 175.29 172.84 1mam s MET 85 N 1.88 3.78 0.33 1.67 -1.94 -0.61 -0.82 119.30 123.60 1mam s MET 85 Ca 0.12 -0.44 0.09 0.00 -1.71 0.00 0.00 55.69 53.75 1mam s MET 85 Cb -0.16 -3.14 -0.06 0.00 2.01 0.00 0.00 34.83 33.48 1mam s MET 85 CO 0.10 0.14 -0.08 -0.80 -0.01 0.00 0.00 175.02 174.37 1mam s ASN 86 N 0.70 3.47 -1.18 3.03 0.01 -0.87 -2.33 114.94 117.76 1mam s ASN 86 Ca 0.01 -1.21 -0.27 0.00 -0.71 0.00 0.00 52.86 50.68 1mam s ASN 86 Cb -0.14 -0.30 0.02 0.00 0.41 0.00 0.00 41.25 41.24 1mam s ASN 86 CO 0.02 -0.26 0.73 0.41 -1.51 0.00 0.00 177.10 176.49 1mam n THR 87 N -0.75 -4.31 -2.89 1.60 -1.04 -1.08 -4.83 114.28 100.98 1mam n THR 87 Ca -0.05 -0.79 -0.40 0.00 -2.04 0.00 0.00 64.05 60.77 1mam n THR 87 Cb 0.64 -3.33 -0.05 0.00 -1.82 0.00 0.00 70.33 65.76 1mam n THR 87 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1mam s LEU 88 N -6.96 4.55 0.36 -4.42 1.43 -0.21 -4.80 118.68 108.61 1mam s LEU 88 Ca 0.48 1.68 0.08 0.00 -1.03 0.00 0.00 54.13 55.34 1mam s LEU 88 Cb -0.22 -3.39 -0.05 0.00 0.03 0.00 0.00 46.19 42.56 1mam s LEU 88 CO 0.92 0.10 0.08 -0.13 0.23 0.00 0.00 176.35 177.54 1mam s ARG 89 N -0.64 2.19 0.41 1.70 0.52 -1.26 -0.40 118.95 121.47 1mam s ARG 89 Ca 0.40 -1.72 0.09 0.00 -0.52 0.00 0.00 55.73 53.98 1mam s ARG 89 Cb -0.23 -2.00 0.90 0.00 0.52 0.00 0.00 34.95 34.14 1mam s ARG 89 CO 0.27 0.08 2.02 0.00 0.02 0.00 0.00 175.30 177.69 1mam h ALA 90 N 1.66 1.81 0.00 2.13 0.00 -1.97 -0.66 119.26 122.23 1mam h ALA 90 Ca -0.43 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1mam h ALA 90 Cb 1.25 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1mam h ALA 90 CO 0.67 0.12 0.00 0.39 0.00 0.00 0.00 179.25 180.43 1mam n GLU 91 N -4.47 0.09 -0.02 0.00 4.71 -1.26 -1.59 120.64 118.09 1mam n GLU 91 Ca 0.06 0.18 0.13 0.00 -0.01 0.00 0.00 57.16 57.52 1mam n GLU 91 Cb 0.18 -1.50 0.63 0.00 -1.01 0.00 0.00 31.44 29.74 1mam n GLU 91 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1mam n ASP 92 N -1.42 0.80 -4.73 1.62 8.00 -0.25 -4.84 116.55 115.72 1mam n ASP 92 Ca 0.05 -1.38 -0.42 0.00 0.71 0.00 0.00 54.79 53.76 1mam n ASP 92 Cb 0.17 -0.02 -0.03 0.00 -0.02 0.00 0.00 41.12 41.22 1mam n ASP 92 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1mam s SER 93 N -1.83 6.85 -0.07 -2.24 0.01 -0.62 -4.83 113.70 110.96 1mam s SER 93 Ca 0.38 2.37 -0.32 0.00 1.31 0.00 0.00 55.95 59.69 1mam s SER 93 Cb 0.19 -2.60 0.13 0.00 0.21 0.00 0.00 66.02 63.96 1mam s SER 93 CO 0.31 -0.60 1.39 0.00 0.41 0.00 0.00 173.24 174.74 1mam s ALA 94 N 0.65 -2.47 -0.13 1.44 0.00 -1.11 -4.42 121.76 115.72 1mam s ALA 94 Ca 0.61 0.75 -0.15 0.00 0.00 0.00 0.00 51.96 53.17 1mam s ALA 94 Cb -0.37 0.38 -0.05 0.00 0.00 0.00 0.00 23.12 23.09 1mam s ALA 94 CO 0.34 -1.08 0.36 0.99 0.00 0.00 0.00 175.76 176.38 1mam s THR 95 N -2.12 5.25 -0.09 0.00 2.01 -0.49 -0.81 115.64 119.38 1mam s THR 95 Ca 0.17 0.71 0.01 0.00 0.31 0.00 0.00 61.69 62.89 1mam s THR 95 Cb 0.06 -3.70 -0.02 0.00 0.01 0.00 0.00 72.50 68.85 1mam s THR 95 CO -0.05 0.39 -0.11 -0.31 -0.69 0.00 0.00 174.62 173.84 1mam s TYR 96 N 0.37 2.82 -0.11 4.92 1.51 0.53 -0.70 117.35 126.69 1mam s TYR 96 Ca 0.20 -0.32 0.01 0.00 -1.01 0.00 0.00 57.07 55.95 1mam s TYR 96 Cb -0.14 -1.76 -0.02 0.00 -0.11 0.00 0.00 41.96 39.93 1mam s TYR 96 CO 0.07 0.04 -0.14 0.71 -1.11 0.00 0.00 175.55 175.12 1mam s TYR 97 N -0.22 2.78 -0.07 2.71 2.02 -0.25 -1.67 117.35 122.65 1mam s TYR 97 Ca 0.01 -0.56 -0.10 0.00 -0.37 0.00 0.00 57.07 56.05 1mam s TYR 97 Cb -0.13 -1.80 -0.05 0.00 -0.40 0.00 0.00 41.96 39.59 1mam s TYR 97 CO 0.03 -0.14 0.24 0.00 -1.57 0.00 0.00 175.55 174.11 1mam s THR 99 N -1.07 0.02 0.09 0.00 2.01 0.18 -1.13 115.64 115.75 1mam s THR 99 Ca 0.19 -0.14 -0.01 0.00 0.31 0.00 0.00 61.69 62.04 1mam s THR 99 Cb -0.14 -0.12 -0.04 0.00 0.01 0.00 0.00 72.50 72.21 1mam s THR 99 CO 0.08 -0.08 0.27 -0.60 -0.69 0.00 0.00 174.62 173.61 1mam s ARG 100 N -0.21 3.50 -0.85 4.92 3.00 0.16 -0.73 118.95 128.74 1mam s ARG 100 Ca -0.03 -0.33 -0.04 0.00 -1.00 0.00 0.00 55.73 54.33 1mam s ARG 100 Cb -0.02 -2.97 0.00 0.00 0.00 0.00 0.00 34.95 31.96 1mam s ARG 100 CO 0.00 0.56 0.66 -3.47 0.00 0.00 0.00 175.30 173.04 1mam n ASP 101 N 0.17 -5.76 -0.52 -2.12 2.03 -0.15 -3.17 116.55 107.03 1mam n ASP 101 Ca -0.04 -0.72 0.43 0.00 0.52 0.00 0.00 54.79 54.97 1mam n ASP 101 Cb 0.51 -2.95 0.73 0.00 -0.72 0.00 0.00 41.12 38.69 1mam n ASP 101 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1mam h PRO 102 N -0.35 0.05 -0.65 -0.67 0.13 -1.87 -3.10 132.00 125.55 1mam h PRO 102 Ca -0.45 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1mam h PRO 102 Cb 1.28 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1mam h PRO 102 CO 0.37 0.03 0.00 0.66 -0.23 0.00 0.00 178.00 178.83 1mam n TYR 103 N -4.31 1.63 0.00 1.56 4.02 -1.26 -5.00 117.16 113.80 1mam n TYR 103 Ca 0.38 -0.58 0.00 0.00 -0.01 0.00 0.00 57.90 57.69 1mam n TYR 103 Cb 1.61 -0.39 0.00 0.00 -0.02 0.00 0.00 39.34 40.54 1mam n TYR 103 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1mam n GLY 104 N 0.64 0.97 0.29 2.72 0.00 -1.17 -5.02 105.19 103.62 1mam n GLY 104 Ca 0.23 -0.65 0.14 0.00 0.00 0.00 0.00 46.02 45.73 1mam n GLY 104 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mam h PRO 105 N 0.00 0.00 -0.61 1.61 0.13 -1.95 -0.93 132.00 130.25 1mam h PRO 105 Ca 0.00 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.94 1mam h PRO 105 Cb 0.00 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.02 1mam h PRO 105 CO 0.00 0.03 0.19 0.00 -0.23 0.00 0.00 178.00 177.99 1mam n ALA 106 N -2.33 4.31 -1.60 -0.56 0.00 -1.26 -5.03 120.51 114.04 1mam n ALA 106 Ca -0.03 -2.49 -0.50 0.00 0.00 0.00 0.00 53.44 50.42 1mam n ALA 106 Cb 0.12 -1.08 -0.05 0.00 0.00 0.00 0.00 19.45 18.44 1mam n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mam n ALA 107 N -0.41 -0.59 -3.23 0.00 0.00 -0.36 -4.55 120.51 111.37 1mam n ALA 107 Ca 0.37 0.49 -0.01 0.00 0.00 0.00 0.00 53.44 54.29 1mam n ALA 107 Cb 1.26 -2.10 -0.04 0.00 0.00 0.00 0.00 19.45 18.58 1mam n ALA 107 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1mam s TYR 108 N 0.28 -1.31 -0.06 0.00 6.14 -1.19 -5.02 117.35 116.19 1mam s TYR 108 Ca 0.79 1.37 -0.08 0.00 0.64 0.00 0.00 57.07 59.80 1mam s TYR 108 Cb -0.88 0.35 -0.04 0.00 0.42 0.00 0.00 41.96 41.81 1mam s TYR 108 CO 0.48 -0.82 0.21 -1.58 0.64 0.00 0.00 175.55 174.48 1mam s TRP 109 N 2.74 3.61 0.00 4.97 0.52 -1.26 -0.66 118.94 128.86 1mam s TRP 109 Ca 0.18 0.60 0.00 0.00 0.02 0.00 0.00 56.10 56.90 1mam s TRP 109 Cb -0.15 -2.00 0.00 0.00 -1.15 0.00 0.00 33.47 30.17 1mam s TRP 109 CO -0.19 0.69 0.00 0.41 0.02 0.00 0.00 176.95 177.88 1mam n GLY 110 N 1.68 -0.83 0.37 0.98 0.00 -0.28 -4.94 105.19 102.18 1mam n GLY 110 Ca -0.16 -1.62 0.05 0.00 0.00 0.00 0.00 46.02 44.28 1mam n GLY 110 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1mam n GLN 111 N -0.02 0.29 0.00 1.61 3.00 -1.26 -4.85 117.38 116.15 1mam n GLN 111 Ca 0.00 -1.05 0.00 0.00 -0.01 0.00 0.00 57.00 55.94 1mam n GLN 111 Cb 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 30.24 29.06 1mam n GLN 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1mam n GLY 112 N 0.52 -0.02 3.39 1.08 0.00 -1.25 -5.00 105.19 103.91 1mam n GLY 112 Ca 0.05 -1.58 -0.30 0.00 0.00 0.00 0.00 46.02 44.20 1mam n GLY 112 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1mam s THR 113 N -2.92 2.36 -0.30 2.61 -4.23 -0.67 -4.81 115.64 107.69 1mam s THR 113 Ca 0.00 -1.41 -0.23 0.00 -1.18 0.00 0.00 61.69 58.87 1mam s THR 113 Cb 0.00 -1.97 -0.00 0.00 1.34 0.00 0.00 72.50 71.87 1mam s THR 113 CO 0.00 0.30 0.76 -0.22 -0.54 0.00 0.00 174.62 174.91 1mam s LEU 114 N -1.48 4.10 -0.08 4.79 2.96 -1.26 -0.34 118.68 127.36 1mam s LEU 114 Ca 0.13 0.64 -0.03 0.00 -0.22 0.00 0.00 54.13 54.65 1mam s LEU 114 Cb -0.10 -3.03 -0.04 0.00 0.50 0.00 0.00 46.19 43.53 1mam s LEU 114 CO 0.04 -0.58 0.05 0.68 -1.32 0.00 0.00 176.35 175.22 1mam s VAL 115 N 2.87 4.67 -0.21 1.68 -7.23 0.01 -2.10 120.40 120.09 1mam s VAL 115 Ca 0.31 -0.16 -0.03 0.00 -1.81 0.00 0.00 61.98 60.29 1mam s VAL 115 Cb -0.14 -3.01 -0.01 0.00 0.56 0.00 0.00 36.38 33.78 1mam s VAL 115 CO 0.12 0.57 -0.07 -0.89 -0.31 0.00 0.00 175.10 174.52 1mam s THR 116 N -0.97 3.23 -0.40 5.32 2.01 -0.60 -2.73 115.64 121.51 1mam s THR 116 Ca 0.15 -0.55 -0.13 0.00 0.31 0.00 0.00 61.69 61.47 1mam s THR 116 Cb -0.12 -2.45 0.02 0.00 0.01 0.00 0.00 72.50 69.97 1mam s THR 116 CO 0.05 0.45 0.27 -0.69 -0.69 0.00 0.00 174.62 174.00 1mam s VAL 117 N 1.32 5.00 -0.02 3.82 1.01 -1.26 -0.69 120.40 129.58 1mam s VAL 117 Ca 0.04 -0.75 -0.25 0.00 0.00 0.00 0.00 61.98 61.02 1mam s VAL 117 Cb -0.14 -3.79 0.05 0.00 0.00 0.00 0.00 36.38 32.50 1mam s VAL 117 CO -0.03 -0.29 0.54 -0.55 0.00 0.00 0.00 175.10 174.77 1mam s SER 118 N 1.65 -0.48 0.00 3.32 0.15 0.40 -4.36 113.70 114.38 1mam s SER 118 Ca 0.04 0.42 0.30 0.00 0.70 0.00 0.00 55.95 57.41 1mam s SER 118 Cb -0.19 0.47 1.55 0.00 -1.71 0.00 0.00 66.02 66.14 1mam s SER 118 CO 0.09 -0.59 2.02 0.00 1.20 0.00 0.00 173.24 175.96 1mam n ALA 119 N 0.89 2.64 -1.92 5.45 0.00 -1.26 -3.80 120.51 122.51 1mam n ALA 119 Ca -0.20 -0.29 -0.31 0.00 0.00 0.00 0.00 53.44 52.65 1mam n ALA 119 Cb 0.57 -1.38 -0.00 0.00 0.00 0.00 0.00 19.45 18.64 1mam n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mam s ALA 120 N -1.99 3.13 0.24 0.00 0.00 -1.26 -5.07 121.76 116.81 1mam s ALA 120 Ca 0.43 -0.09 0.05 0.00 0.00 0.00 0.00 51.96 52.36 1mam s ALA 120 Cb 0.21 -3.02 -0.03 0.00 0.00 0.00 0.00 23.12 20.28 1mam s ALA 120 CO 0.35 -0.54 0.35 -1.59 0.00 0.00 0.00 175.76 174.33 1mam s LYS 121 N -4.88 3.42 0.30 0.00 -2.85 -1.26 -5.01 119.74 109.47 1mam s LYS 121 Ca 0.55 -0.77 -0.30 0.00 -1.00 0.00 0.00 55.97 54.45 1mam s LYS 121 Cb -0.11 -2.88 -0.12 0.00 -2.06 0.00 0.00 37.83 32.67 1mam s LYS 121 CO 0.48 0.43 1.58 2.41 0.10 0.00 0.00 175.35 180.35 1mam n THR 122 N -1.40 1.11 -3.98 3.79 -1.04 -1.26 -4.77 114.28 106.72 1mam n THR 122 Ca -0.09 -0.28 -0.22 0.00 -2.04 0.00 0.00 64.05 61.43 1mam n THR 122 Cb 0.57 -1.95 -0.17 0.00 -1.82 0.00 0.00 70.33 66.97 1mam n THR 122 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1mam s THR 123 N -0.11 0.51 0.39 12.58 2.01 -0.15 -4.91 115.64 125.97 1mam s THR 123 Ca 0.63 -0.04 -0.20 0.00 0.31 0.00 0.00 61.69 62.39 1mam s THR 123 Cb -0.50 -0.59 -0.10 0.00 0.01 0.00 0.00 72.50 71.32 1mam s THR 123 CO 0.50 0.25 0.90 -2.16 -0.69 0.00 0.00 174.62 173.42 1mam s PRO 124 N 1.40 4.23 0.62 4.92 0.04 -1.26 -0.38 135.00 144.57 1mam s PRO 124 Ca -0.03 1.05 -0.17 0.00 0.04 0.00 0.00 61.00 61.89 1mam s PRO 124 Cb -0.13 -2.31 -0.02 0.00 0.04 0.00 0.00 34.50 32.08 1mam s PRO 124 CO -0.03 0.05 1.16 -1.25 0.04 0.00 0.00 177.00 176.97 1mam s PRO 125 N -2.99 2.89 -0.23 0.56 0.04 -1.26 -4.37 135.00 129.63 1mam s PRO 125 Ca 0.59 1.62 -0.13 0.00 0.04 0.00 0.00 61.00 63.12 1mam s PRO 125 Cb -0.10 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 1mam s PRO 125 CO 0.15 -1.22 0.28 -1.12 0.04 0.00 0.00 177.00 175.12 1mam s SER 126 N -2.02 6.25 -0.24 6.66 0.01 0.26 -4.94 113.70 119.68 1mam s SER 126 Ca 0.72 0.28 -0.08 0.00 1.31 0.00 0.00 55.95 58.19 1mam s SER 126 Cb -0.25 -2.17 -0.03 0.00 0.21 0.00 0.00 66.02 63.78 1mam s SER 126 CO 0.36 -0.02 0.08 -0.69 0.41 0.00 0.00 173.24 173.38 1mam s VAL 127 N 1.27 4.53 -0.13 3.43 1.01 -1.26 -0.15 120.40 129.11 1mam s VAL 127 Ca 0.13 -0.10 -0.00 0.00 0.00 0.00 0.00 61.98 62.00 1mam s VAL 127 Cb -0.14 -3.11 -0.02 0.00 0.00 0.00 0.00 36.38 33.11 1mam s VAL 127 CO 0.07 0.35 -0.11 -0.31 0.00 0.00 0.00 175.10 175.09 1mam s TYR 128 N 1.37 2.84 0.24 5.22 2.02 0.70 -4.97 117.35 124.78 1mam s TYR 128 Ca 0.05 -0.52 -0.30 0.00 -0.37 0.00 0.00 57.07 55.94 1mam s TYR 128 Cb -0.15 -1.84 -0.09 0.00 -0.40 0.00 0.00 41.96 39.48 1mam s TYR 128 CO 0.04 -0.13 1.08 -1.25 -1.57 0.00 0.00 175.55 173.72 1mam s PRO 129 N 0.22 4.66 -0.29 -1.71 0.04 -1.26 -1.04 135.00 135.61 1mam s PRO 129 Ca -0.07 1.73 -0.04 0.00 0.04 0.00 0.00 61.00 62.66 1mam s PRO 129 Cb -0.15 -3.23 0.03 0.00 0.04 0.00 0.00 34.50 31.19 1mam s PRO 129 CO 0.05 0.21 0.03 -0.51 0.04 0.00 0.00 177.00 176.82 1mam s LEU 130 N -1.06 3.80 0.16 -3.56 1.43 0.63 -4.92 118.68 115.16 1mam s LEU 130 Ca 0.46 -0.97 0.07 0.00 -1.03 0.00 0.00 54.13 52.66 1mam s LEU 130 Cb -0.30 -1.79 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 1mam s LEU 130 CO 0.38 -0.22 -0.15 0.00 0.23 0.00 0.00 176.35 176.59 1mam s ALA 131 N 1.38 1.79 0.68 4.21 0.00 -1.26 -1.96 121.76 126.60 1mam s ALA 131 Ca -0.01 -1.47 -0.06 0.00 0.00 0.00 0.00 51.96 50.42 1mam s ALA 131 Cb -0.18 -0.10 0.05 0.00 0.00 0.00 0.00 23.12 22.89 1mam s ALA 131 CO 0.00 0.11 0.99 -1.25 0.00 0.00 0.00 175.76 175.62 1mam s PRO 132 N -3.07 2.33 -0.36 0.00 0.04 -1.26 -4.96 135.00 127.72 1mam s PRO 132 Ca 0.15 -0.22 -0.28 0.00 0.04 0.00 0.00 61.00 60.69 1mam s PRO 132 Cb -0.03 -2.19 0.02 0.00 0.04 0.00 0.00 34.50 32.33 1mam s PRO 132 CO 0.05 -1.14 1.06 0.20 0.04 0.00 0.00 177.00 177.21 1mam s GLY 133 N -4.48 1.51 -0.14 0.56 0.00 -1.26 -4.96 107.32 98.56 1mam s GLY 133 Ca 0.59 -0.20 -0.40 0.00 0.00 0.00 0.00 44.72 44.71 1mam s GLY 133 CO 0.45 2.25 1.51 0.00 0.00 0.00 0.00 173.10 177.30 1mam n GLY 135 N 3.26 3.27 0.01 0.00 0.00 -1.26 -4.94 105.19 105.52 1mam n GLY 135 Ca 0.23 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1mam n GLY 135 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1mam n ASP 136 N 0.68 4.23 -3.64 1.61 9.92 -0.44 -5.10 116.55 123.81 1mam n ASP 136 Ca 0.00 0.00 -0.05 0.00 -0.53 0.00 0.00 54.79 54.21 1mam n ASP 136 Cb 0.00 0.88 -0.07 0.00 -0.64 0.00 0.00 41.12 41.30 1mam n ASP 136 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 1mam s THR 137 N -2.16 0.00 0.00 -3.53 -1.32 -1.19 -5.02 115.64 102.42 1mam s THR 137 Ca -0.01 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.47 1mam s THR 137 Cb 0.02 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.01 1mam s THR 137 CO 0.13 0.00 0.00 0.41 -2.21 0.00 0.00 174.62 172.95 1mam n THR 138 N 2.53 0.00 0.01 5.08 -1.04 -1.26 -4.74 114.28 114.86 1mam n THR 138 Ca -0.14 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.87 1mam n THR 138 Cb 0.57 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.08 1mam n THR 138 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1mam n GLY 139 N 0.00 -2.01 3.51 3.41 0.00 -1.26 -5.03 105.19 103.82 1mam n GLY 139 Ca 0.00 0.65 -0.00 0.00 0.00 0.00 0.00 46.02 46.67 1mam n GLY 139 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mam s SER 140 N -1.13 -0.68 -0.09 1.61 0.01 -1.26 -5.05 113.70 107.12 1mam s SER 140 Ca 0.00 0.97 -0.06 0.00 1.31 0.00 0.00 55.95 58.17 1mam s SER 140 Cb 0.00 1.64 0.02 0.00 0.21 0.00 0.00 66.02 67.90 1mam s SER 140 CO 0.00 -0.14 0.13 -1.20 0.41 0.00 0.00 173.24 172.44 1mam n SER 141 N 4.72 -3.64 -4.66 2.44 7.64 -1.26 -4.92 113.62 113.93 1mam n SER 141 Ca -0.12 1.29 -0.58 0.00 1.01 0.00 0.00 58.87 60.46 1mam n SER 141 Cb 0.53 -4.51 -0.07 0.00 -1.01 0.00 0.00 64.21 59.15 1mam n SER 141 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1mam n VAL 142 N 1.45 0.14 -3.99 0.44 0.31 -1.08 -4.93 118.33 110.67 1mam n VAL 142 Ca -0.21 -0.02 -0.34 0.00 -0.01 0.00 0.00 64.34 63.75 1mam n VAL 142 Cb 0.33 -0.84 -0.15 0.00 -0.91 0.00 0.00 33.84 32.27 1mam n VAL 142 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1mam s THR 143 N 2.22 2.85 0.31 2.52 2.01 -1.26 -0.46 115.64 123.83 1mam s THR 143 Ca 0.95 -0.69 0.08 0.00 0.31 0.00 0.00 61.69 62.34 1mam s THR 143 Cb -1.14 -2.28 -0.04 0.00 0.01 0.00 0.00 72.50 69.06 1mam s THR 143 CO 0.63 0.45 0.19 -0.76 -0.69 0.00 0.00 174.62 174.44 1mam s LEU 144 N 1.40 3.48 0.35 4.42 2.01 -0.26 -4.75 118.68 125.33 1mam s LEU 144 Ca 0.05 -0.55 -0.07 0.00 0.01 0.00 0.00 54.13 53.57 1mam s LEU 144 Cb -0.14 -2.03 0.02 0.00 0.01 0.00 0.00 46.19 44.05 1mam s LEU 144 CO -0.07 -0.22 0.56 -0.83 1.01 0.00 0.00 176.35 176.80 1mam s GLY 145 N -3.87 1.10 -0.16 -3.19 0.00 -0.83 -1.15 107.32 99.22 1mam s GLY 145 Ca 0.37 -1.25 -0.08 0.00 0.00 0.00 0.00 44.72 43.76 1mam s GLY 145 CO 0.24 -0.77 0.38 0.00 0.00 0.00 0.00 173.10 172.95 1mam s LEU 147 N 1.44 3.79 -0.41 0.00 1.98 -0.21 -2.28 118.68 123.00 1mam s LEU 147 Ca -0.09 -0.26 0.01 0.00 -2.89 0.00 0.00 54.13 50.90 1mam s LEU 147 Cb -0.09 -1.99 0.11 0.00 0.66 0.00 0.00 46.19 44.88 1mam s LEU 147 CO -0.12 -0.09 0.16 0.54 -1.89 0.00 0.00 176.35 174.95 1mam s VAL 148 N 1.65 2.79 0.08 1.68 0.11 -0.45 -0.22 120.40 126.04 1mam s VAL 148 Ca 0.06 -2.40 -0.05 0.00 -2.93 0.00 0.00 61.98 56.66 1mam s VAL 148 Cb -0.16 -2.96 -0.05 0.00 -1.53 0.00 0.00 36.38 31.68 1mam s VAL 148 CO 0.06 -0.68 0.32 -0.75 -3.33 0.00 0.00 175.10 170.73 1mam s LYS 149 N 0.78 3.59 -1.07 1.54 2.20 0.79 -1.85 119.74 125.72 1mam s LYS 149 Ca 0.11 -0.12 -0.05 0.00 -0.36 0.00 0.00 55.97 55.56 1mam s LYS 149 Cb -0.21 -2.96 0.01 0.00 -1.51 0.00 0.00 37.83 33.15 1mam s LYS 149 CO -0.05 0.55 0.60 0.41 -0.36 0.00 0.00 175.35 176.50 1mam n GLY 150 N 0.50 -0.16 3.86 5.54 0.00 -0.26 -0.57 105.19 114.08 1mam n GLY 150 Ca -0.06 -0.08 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 1mam n GLY 150 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1mam s TYR 151 N -3.09 2.96 -0.12 1.61 1.13 -0.94 -4.51 117.35 114.39 1mam s TYR 151 Ca 0.30 -0.26 -0.23 0.00 -1.41 0.00 0.00 57.07 55.47 1mam s TYR 151 Cb -0.13 -1.74 0.05 0.00 -1.10 0.00 0.00 41.96 39.04 1mam s TYR 151 CO 0.37 0.23 0.56 0.12 -2.51 0.00 0.00 175.55 174.32 1mam s PHE 152 N -2.26 -0.55 0.00 -3.49 5.36 0.49 -0.62 117.98 116.91 1mam s PHE 152 Ca 0.40 1.16 0.00 0.00 -0.96 0.00 0.00 56.93 57.53 1mam s PHE 152 Cb -0.06 0.26 0.00 0.00 -0.34 0.00 0.00 43.02 42.87 1mam s PHE 152 CO 0.27 -0.42 0.00 -0.35 -1.46 0.00 0.00 175.22 173.26 1mam n PRO 153 N 1.87 0.43 -2.11 10.12 -0.04 -1.26 -0.98 135.00 143.03 1mam n PRO 153 Ca -0.17 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.97 1mam n PRO 153 Cb 0.56 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 34.02 1mam n PRO 153 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1mam s GLU 154 N -1.96 3.57 -0.01 0.54 0.41 -1.26 -4.73 118.70 115.27 1mam s GLU 154 Ca 0.00 1.01 -0.01 0.00 -0.41 0.00 0.00 54.97 55.57 1mam s GLU 154 Cb 0.00 -2.08 0.00 0.00 -1.78 0.00 0.00 34.13 30.28 1mam s GLU 154 CO 0.00 -0.59 0.01 0.43 -0.49 0.00 0.00 175.26 174.63 1mam n SER 155 N -2.06 -1.91 -4.57 -0.19 7.64 -1.26 -5.01 113.62 106.26 1mam n SER 155 Ca 0.07 0.08 -0.53 0.00 1.01 0.00 0.00 58.87 59.50 1mam n SER 155 Cb 0.54 -1.24 -0.06 0.00 -1.01 0.00 0.00 64.21 62.43 1mam n SER 155 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1mam n VAL 156 N 0.09 0.13 -4.75 0.44 0.31 -1.26 -4.02 118.33 109.28 1mam n VAL 156 Ca -0.02 -0.03 -0.24 0.00 -0.01 0.00 0.00 64.34 64.03 1mam n VAL 156 Cb 0.04 -0.64 -0.15 0.00 -0.91 0.00 0.00 33.84 32.17 1mam n VAL 156 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1mam s THR 157 N 0.29 1.27 -0.22 2.52 -4.23 -0.32 -4.95 115.64 110.00 1mam s THR 157 Ca 0.84 -0.66 -0.05 0.00 -1.18 0.00 0.00 61.69 60.64 1mam s THR 157 Cb -1.01 -1.07 -0.02 0.00 1.34 0.00 0.00 72.50 71.75 1mam s THR 157 CO 0.50 0.36 -0.01 -0.69 -0.54 0.00 0.00 174.62 174.24 1mam s VAL 158 N -0.20 3.73 0.14 2.29 1.01 -1.25 -1.33 120.40 124.79 1mam s VAL 158 Ca 0.02 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 61.66 1mam s VAL 158 Cb -0.08 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 1mam s VAL 158 CO 0.00 0.41 0.25 -0.89 0.00 0.00 0.00 175.10 174.87 1mam s THR 159 N 1.38 5.18 0.00 3.92 2.01 0.19 -4.88 115.64 123.44 1mam s THR 159 Ca 0.05 -0.72 0.00 0.00 0.31 0.00 0.00 61.69 61.32 1mam s THR 159 Cb -0.15 -3.65 0.00 0.00 0.01 0.00 0.00 72.50 68.72 1mam s THR 159 CO -0.00 -0.07 0.00 0.79 -0.69 0.00 0.00 174.62 174.65 1mam n TRP 160 N -0.42 0.00 -3.65 4.92 7.02 -1.26 -0.81 117.44 123.24 1mam n TRP 160 Ca -0.07 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.39 1mam n TRP 160 Cb 0.54 0.00 -0.07 0.00 -2.42 0.00 0.00 31.31 29.36 1mam n TRP 160 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 1mam s ASN 161 N 1.00 -0.05 -0.24 -0.99 0.02 -1.26 -4.44 114.94 108.98 1mam s ASN 161 Ca 0.00 0.09 -0.00 0.00 -1.02 0.00 0.00 52.86 51.93 1mam s ASN 161 Cb 0.00 0.14 0.07 0.00 0.02 0.00 0.00 41.25 41.48 1mam s ASN 161 CO 0.00 -0.02 -0.01 -0.44 0.02 0.00 0.00 177.10 176.66 1mam s SER 162 N 0.08 3.73 -0.32 -1.22 0.01 -1.26 -4.97 113.70 109.75 1mam s SER 162 Ca 0.07 -1.22 -0.10 0.00 1.31 0.00 0.00 55.95 56.01 1mam s SER 162 Cb -0.05 -1.03 0.21 0.00 0.21 0.00 0.00 66.02 65.35 1mam s SER 162 CO -0.16 -0.29 1.14 -0.83 0.41 0.00 0.00 173.24 173.51 1mam s GLY 163 N 1.50 -1.86 0.00 3.44 0.00 -1.26 -5.09 107.32 104.05 1mam s GLY 163 Ca -0.02 0.98 0.00 0.00 0.00 0.00 0.00 44.72 45.69 1mam s GLY 163 CO -0.09 4.40 0.00 1.44 0.00 0.00 0.00 173.10 178.85 1mam n SER 164 N 2.92 0.00 0.29 1.64 7.64 -1.26 -4.34 113.62 120.51 1mam n SER 164 Ca 0.09 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.10 1mam n SER 164 Cb 0.65 0.00 0.72 0.00 -1.01 0.00 0.00 64.21 64.58 1mam n SER 164 CO 0.00 0.00 0.00 0.17 -3.01 0.00 0.00 175.04 172.20 1mam h LEU 165 N 0.27 0.00 0.00 -3.43 -0.00 -1.99 -3.35 115.31 106.81 1mam h LEU 165 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1mam h LEU 165 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 1mam h LEU 165 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 178.44 178.20 1mam n SER 166 N -2.67 0.00 -4.37 0.17 2.88 -1.26 -4.74 113.62 103.62 1mam n SER 166 Ca -0.02 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.38 1mam n SER 166 Cb 0.33 0.02 -0.10 0.00 -0.75 0.00 0.00 64.21 63.72 1mam n SER 166 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1mam n SER 167 N -2.10 0.64 -4.56 -3.46 7.64 -1.25 -4.85 113.62 105.68 1mam n SER 167 Ca 0.00 -2.25 -0.43 0.00 1.01 0.00 0.00 58.87 57.20 1mam n SER 167 Cb 0.00 -1.39 -0.00 0.00 -1.01 0.00 0.00 64.21 61.81 1mam n SER 167 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1mam s SER 168 N 6.76 6.82 0.26 6.43 0.01 -0.37 -4.74 113.70 128.86 1mam s SER 168 Ca 0.64 -2.38 -0.29 0.00 1.31 0.00 0.00 55.95 55.23 1mam s SER 168 Cb -0.02 -2.55 -0.09 0.00 0.21 0.00 0.00 66.02 63.57 1mam s SER 168 CO 0.16 -1.15 0.99 0.54 0.41 0.00 0.00 173.24 174.19 1mam s VAL 169 N 3.92 3.89 0.02 3.43 0.11 -1.26 -2.56 120.40 127.96 1mam s VAL 169 Ca 0.51 1.88 0.09 0.00 -2.93 0.00 0.00 61.98 61.53 1mam s VAL 169 Cb 0.02 -4.19 -0.03 0.00 -1.53 0.00 0.00 36.38 30.66 1mam s VAL 169 CO 0.04 0.43 -0.26 -1.00 -3.33 0.00 0.00 175.10 170.98 1mam s HIS 170 N -1.21 2.30 -0.14 1.54 3.76 0.26 -4.94 115.29 116.86 1mam s HIS 170 Ca 0.43 -0.42 0.02 0.00 -0.15 0.00 0.00 55.06 54.93 1mam s HIS 170 Cb -0.27 -1.42 0.01 0.00 1.11 0.00 0.00 32.58 32.01 1mam s HIS 170 CO 0.34 0.06 -0.19 0.99 -0.85 0.00 0.00 174.74 175.09 1mam s THR 171 N -0.72 1.89 -0.32 1.30 2.01 -1.26 -2.05 115.64 116.48 1mam s THR 171 Ca 0.11 -0.87 -0.13 0.00 0.31 0.00 0.00 61.69 61.12 1mam s THR 171 Cb -0.10 -1.70 -0.03 0.00 0.01 0.00 0.00 72.50 70.68 1mam s THR 171 CO 0.01 0.52 0.24 -0.36 -0.69 0.00 0.00 174.62 174.34 1mam s PHE 172 N 1.03 3.23 0.45 4.92 0.08 -0.59 -5.03 117.98 122.07 1mam s PHE 172 Ca -0.03 -0.10 -0.20 0.00 0.12 0.00 0.00 56.93 56.72 1mam s PHE 172 Cb -0.15 -2.47 -0.14 0.00 -0.57 0.00 0.00 43.02 39.69 1mam s PHE 172 CO -0.05 -0.31 0.14 -0.35 -0.10 0.00 0.00 175.22 174.54 1mam n PRO 173 N 5.12 0.13 -2.52 0.24 -0.04 -1.26 -3.54 135.00 133.13 1mam n PRO 173 Ca -0.13 0.05 -0.38 0.00 -0.04 0.00 0.00 63.50 63.01 1mam n PRO 173 Cb 0.50 -1.14 -0.04 0.00 -0.04 0.00 0.00 33.50 32.79 1mam n PRO 173 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mam s ALA 174 N -1.73 3.17 0.05 0.55 0.00 -1.26 -4.70 121.76 117.85 1mam s ALA 174 Ca 0.60 0.75 0.06 0.00 0.00 0.00 0.00 51.96 53.38 1mam s ALA 174 Cb -0.58 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.23 1mam s ALA 174 CO 0.62 -0.20 -0.18 -0.51 0.00 0.00 0.00 175.76 175.49 1mam s LEU 175 N -2.31 2.19 -0.03 0.00 1.02 0.09 -4.90 118.68 114.75 1mam s LEU 175 Ca 0.54 -0.52 -0.20 0.00 0.02 0.00 0.00 54.13 53.97 1mam s LEU 175 Cb -0.25 -0.80 -0.05 0.00 0.02 0.00 0.00 46.19 45.11 1mam s LEU 175 CO 0.31 0.09 0.57 -0.76 0.02 0.00 0.00 176.35 176.58 1mam s LEU 176 N -1.28 4.39 -0.27 1.79 1.43 -1.26 -0.60 118.68 122.89 1mam s LEU 176 Ca 0.05 1.09 -0.04 0.00 -1.03 0.00 0.00 54.13 54.20 1mam s LEU 176 Cb -0.09 -2.87 0.15 0.00 0.03 0.00 0.00 46.19 43.41 1mam s LEU 176 CO 0.02 0.08 0.53 -1.58 0.23 0.00 0.00 176.35 175.63 1mam s GLN 177 N -0.03 0.48 -1.35 1.70 -0.44 -0.00 -4.83 119.66 115.20 1mam s GLN 177 Ca 0.30 0.97 -0.02 0.00 -2.50 0.00 0.00 55.36 54.11 1mam s GLN 177 Cb -0.18 0.32 0.00 0.00 -1.64 0.00 0.00 33.01 31.52 1mam s GLN 177 CO 0.16 -0.50 0.29 0.43 0.50 0.00 0.00 175.29 176.16 1mam n SER 178 N 5.41 -5.18 0.00 6.67 7.64 -1.26 -2.70 113.62 124.21 1mam n SER 178 Ca -0.05 -0.14 0.00 0.00 1.01 0.00 0.00 58.87 59.69 1mam n SER 178 Cb 0.50 -4.12 0.00 0.00 -1.01 0.00 0.00 64.21 59.58 1mam n SER 178 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1mam n GLY 179 N -1.23 0.54 3.33 0.23 0.00 -1.26 -5.04 105.19 101.75 1mam n GLY 179 Ca -0.14 -0.41 -0.17 0.00 0.00 0.00 0.00 46.02 45.31 1mam n GLY 179 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mam s LEU 180 N 0.00 2.27 0.05 0.99 1.43 -1.10 -4.99 118.68 117.33 1mam s LEU 180 Ca 0.00 -1.18 -0.11 0.00 -1.03 0.00 0.00 54.13 51.80 1mam s LEU 180 Cb 0.00 -0.32 -0.06 0.00 0.03 0.00 0.00 46.19 45.84 1mam s LEU 180 CO 0.00 -0.46 0.40 -0.31 0.23 0.00 0.00 176.35 176.20 1mam s TYR 181 N -3.36 3.63 -0.03 0.29 2.02 0.21 -0.82 117.35 119.29 1mam s TYR 181 Ca 0.27 0.85 -0.00 0.00 -0.37 0.00 0.00 57.07 57.82 1mam s TYR 181 Cb 0.05 -2.20 0.03 0.00 -0.40 0.00 0.00 41.96 39.44 1mam s TYR 181 CO 0.08 0.57 0.02 0.99 -1.57 0.00 0.00 175.55 175.63 1mam s THR 182 N -1.28 0.10 0.25 -0.71 2.01 0.24 -1.11 115.64 115.14 1mam s THR 182 Ca 0.29 0.17 0.01 0.00 0.31 0.00 0.00 61.69 62.48 1mam s THR 182 Cb -0.15 -0.23 -0.05 0.00 0.01 0.00 0.00 72.50 72.08 1mam s THR 182 CO 0.16 0.15 0.09 0.00 -0.69 0.00 0.00 174.62 174.32 1mam s MET 183 N 1.27 1.39 0.17 4.92 0.23 -0.77 -0.73 119.30 125.78 1mam s MET 183 Ca -0.06 -1.75 -0.09 0.00 -1.03 0.00 0.00 55.69 52.76 1mam s MET 183 Cb -0.13 -0.27 -0.01 0.00 -1.53 0.00 0.00 34.83 32.89 1mam s MET 183 CO -0.02 -0.28 0.30 -1.54 -2.03 0.00 0.00 175.02 171.45 1mam s SER 184 N -3.30 0.02 0.00 -1.18 1.04 -1.23 -1.35 113.70 107.70 1mam s SER 184 Ca 0.37 -0.86 -0.08 0.00 0.48 0.00 0.00 55.95 55.86 1mam s SER 184 Cb 0.08 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.65 1mam s SER 184 CO 0.13 -0.91 0.15 -0.55 0.98 0.00 0.00 173.24 173.04 1mam s SER 185 N -2.97 0.02 0.18 7.02 0.15 -0.96 -1.54 113.70 115.60 1mam s SER 185 Ca 0.17 -0.21 0.07 0.00 0.70 0.00 0.00 55.95 56.69 1mam s SER 185 Cb 0.03 0.22 -0.04 0.00 -1.71 0.00 0.00 66.02 64.51 1mam s SER 185 CO 0.00 -0.39 -0.14 -0.94 1.20 0.00 0.00 173.24 172.97 1mam s SER 186 N -1.45 2.44 0.01 5.45 1.04 -0.87 -0.75 113.70 119.58 1mam s SER 186 Ca -0.14 -0.98 0.06 0.00 0.48 0.00 0.00 55.95 55.37 1mam s SER 186 Cb -0.07 -0.12 -0.02 0.00 0.10 0.00 0.00 66.02 65.92 1mam s SER 186 CO 0.01 -0.17 -0.18 0.54 0.98 0.00 0.00 173.24 174.43 1mam s VAL 187 N -2.80 1.43 -0.09 5.02 0.11 -0.30 -0.58 120.40 123.19 1mam s VAL 187 Ca 0.20 -0.90 0.04 0.00 -2.93 0.00 0.00 61.98 58.39 1mam s VAL 187 Cb -0.01 -1.22 -0.00 0.00 -1.53 0.00 0.00 36.38 33.62 1mam s VAL 187 CO 0.06 0.30 -0.24 0.28 -3.33 0.00 0.00 175.10 172.16 1mam s THR 188 N -0.57 2.03 0.13 5.04 -1.32 -1.06 -1.10 115.64 118.79 1mam s THR 188 Ca 0.06 -1.01 0.11 0.00 -1.21 0.00 0.00 61.69 59.64 1mam s THR 188 Cb -0.07 -1.75 -0.04 0.00 -1.51 0.00 0.00 72.50 69.13 1mam s THR 188 CO 0.00 0.55 -0.27 0.68 -2.21 0.00 0.00 174.62 173.38 1mam s VAL 189 N 0.26 2.25 0.42 5.08 -7.23 0.39 -1.24 120.40 120.33 1mam s VAL 189 Ca -0.16 -1.74 -0.27 0.00 -1.81 0.00 0.00 61.98 58.00 1mam s VAL 189 Cb -0.17 -1.99 -0.10 0.00 0.56 0.00 0.00 36.38 34.68 1mam s VAL 189 CO 0.08 0.10 1.46 -0.81 -0.31 0.00 0.00 175.10 175.63 1mam n PRO 190 N 0.96 2.46 0.19 4.82 -0.04 -1.26 -2.64 135.00 139.49 1mam n PRO 190 Ca -0.18 0.87 0.14 0.00 -0.04 0.00 0.00 63.50 64.29 1mam n PRO 190 Cb 0.53 -2.66 0.63 0.00 -0.04 0.00 0.00 33.50 31.96 1mam n PRO 190 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1mam h SER 191 N 2.60 0.00 0.00 3.54 0.02 -1.91 -2.44 113.55 115.37 1mam h SER 191 Ca -0.51 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.44 1mam h SER 191 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 1mam h SER 191 CO 0.62 0.00 0.23 0.28 -1.14 0.00 0.00 176.83 176.83 1mam h SER 192 N 0.00 0.00 -3.51 3.07 0.02 -2.02 -3.39 113.55 107.72 1mam h SER 192 Ca 0.00 0.00 -0.43 0.00 -0.84 0.00 0.00 61.79 60.52 1mam h SER 192 Cb 0.27 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 62.67 1mam h SER 192 CO 0.00 0.00 -0.65 0.28 -1.14 0.00 0.00 176.83 175.32 1mam s THR 193 N -3.49 1.21 -0.14 -2.27 -1.32 -0.92 -4.73 115.64 103.98 1mam s THR 193 Ca -0.02 -2.05 -0.03 0.00 -1.21 0.00 0.00 61.69 58.38 1mam s THR 193 Cb 0.05 -2.48 0.01 0.00 -1.51 0.00 0.00 72.50 68.58 1mam s THR 193 CO 0.16 -0.24 0.06 1.87 -2.21 0.00 0.00 174.62 174.26 1mam n TRP 194 N -0.52 -2.37 -0.29 9.09 -0.00 -1.25 -4.64 117.44 117.45 1mam n TRP 194 Ca -0.04 1.20 0.27 0.00 -0.00 0.00 0.00 57.50 58.92 1mam n TRP 194 Cb 0.64 -2.67 0.61 0.00 -0.00 0.00 0.00 31.31 29.89 1mam n TRP 194 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 1mam h PRO 195 N 3.83 0.21 0.03 5.87 0.11 -1.91 -3.45 132.00 136.69 1mam h PRO 195 Ca -0.14 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.96 1mam h PRO 195 Cb 0.57 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.63 1mam h PRO 195 CO 0.03 0.14 -0.01 0.77 -0.21 0.00 0.00 178.00 178.72 1mam h SER 196 N 0.22 -0.03 -2.06 -2.05 0.02 -1.85 -3.44 113.55 104.36 1mam h SER 196 Ca 0.54 -0.37 -0.59 0.00 -0.84 0.00 0.00 61.79 60.53 1mam h SER 196 Cb 1.70 0.01 -0.11 0.00 0.14 0.00 0.00 62.40 64.14 1mam h SER 196 CO -0.15 0.36 -0.66 0.00 -1.14 0.00 0.00 176.83 175.24 1mam s GLN 197 N -4.62 2.03 0.37 3.45 0.00 -1.26 -5.09 119.66 114.54 1mam s GLN 197 Ca -0.15 -1.68 -0.26 0.00 -0.00 0.00 0.00 55.36 53.27 1mam s GLN 197 Cb 0.02 -1.94 -0.09 0.00 0.00 0.00 0.00 33.01 31.01 1mam s GLN 197 CO 0.66 0.24 1.12 0.99 0.00 0.00 0.00 175.29 178.30 1mam s THR 198 N -2.47 3.37 -0.01 3.63 2.01 -1.26 -3.92 115.64 116.99 1mam s THR 198 Ca 0.33 1.18 0.03 0.00 0.31 0.00 0.00 61.69 63.53 1mam s THR 198 Cb -0.03 -3.67 -0.01 0.00 0.01 0.00 0.00 72.50 68.81 1mam s THR 198 CO 0.18 0.13 -0.11 0.68 -0.69 0.00 0.00 174.62 174.81 1mam s VAL 199 N -1.42 0.86 0.02 3.82 -7.23 -1.26 -5.02 120.40 110.15 1mam s VAL 199 Ca 0.54 -0.45 0.04 0.00 -1.81 0.00 0.00 61.98 60.31 1mam s VAL 199 Cb -0.29 -0.73 -0.02 0.00 0.56 0.00 0.00 36.38 35.91 1mam s VAL 199 CO 0.36 0.25 -0.12 -0.89 -0.31 0.00 0.00 175.10 174.39 1mam s THR 200 N -0.15 0.97 -0.09 5.32 2.01 -1.26 -1.85 115.64 120.59 1mam s THR 200 Ca 0.02 -0.75 -0.03 0.00 0.31 0.00 0.00 61.69 61.25 1mam s THR 200 Cb -0.05 -0.85 -0.03 0.00 0.01 0.00 0.00 72.50 71.57 1mam s THR 200 CO -0.00 0.10 0.02 0.00 -0.69 0.00 0.00 174.62 174.06 1mam s SER 202 N -0.89 3.54 -0.18 0.00 0.01 0.00 -0.74 113.70 115.45 1mam s SER 202 Ca 0.13 -0.39 0.01 0.00 1.31 0.00 0.00 55.95 57.01 1mam s SER 202 Cb -0.11 -1.03 0.04 0.00 0.21 0.00 0.00 66.02 65.12 1mam s SER 202 CO 0.03 0.25 -0.12 -0.69 0.41 0.00 0.00 173.24 173.12 1mam s VAL 203 N -0.19 1.66 -0.41 3.43 1.01 0.98 -0.63 120.40 126.25 1mam s VAL 203 Ca -0.02 -0.91 -0.09 0.00 0.00 0.00 0.00 61.98 60.96 1mam s VAL 203 Cb -0.13 -1.67 0.07 0.00 0.00 0.00 0.00 36.38 34.64 1mam s VAL 203 CO 0.03 0.27 0.24 0.00 0.00 0.00 0.00 175.10 175.64 1mam s ALA 204 N 1.41 3.27 -0.45 5.51 0.00 -0.44 -0.99 121.76 130.06 1mam s ALA 204 Ca 0.01 -2.07 -0.04 0.00 0.00 0.00 0.00 51.96 49.86 1mam s ALA 204 Cb -0.15 -2.61 0.12 0.00 0.00 0.00 0.00 23.12 20.48 1mam s ALA 204 CO -0.09 -1.59 0.27 -1.58 0.00 0.00 0.00 175.76 172.77 1mam s HIS 205 N 1.44 3.54 0.30 0.00 5.04 -0.53 -1.17 115.29 123.90 1mam s HIS 205 Ca 0.03 -2.35 0.18 0.00 -1.54 0.00 0.00 55.06 51.38 1mam s HIS 205 Cb -0.22 -3.28 0.99 0.00 0.04 0.00 0.00 32.58 30.10 1mam s HIS 205 CO 0.03 -0.96 1.49 -1.35 -2.34 0.00 0.00 174.74 171.61 1mam h PRO 206 N 7.99 0.00 -4.59 2.88 0.11 -1.81 -2.17 132.00 134.41 1mam h PRO 206 Ca -0.13 0.00 -0.71 0.00 0.11 0.00 0.00 66.00 65.27 1mam h PRO 206 Cb 1.04 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.07 1mam h PRO 206 CO 0.73 0.00 2.58 0.00 -0.21 0.00 0.00 178.00 181.10 1mam n ALA 207 N -1.67 4.77 -0.66 -0.75 0.00 -1.26 -4.70 120.51 116.24 1mam n ALA 207 Ca -0.01 -3.95 0.00 0.00 0.00 0.00 0.00 53.44 49.48 1mam n ALA 207 Cb 0.39 -3.46 0.00 0.00 0.00 0.00 0.00 19.45 16.38 1mam n ALA 207 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1mam n SER 208 N 6.53 -2.94 -4.33 0.00 7.64 -1.12 -4.75 113.62 114.65 1mam n SER 208 Ca 0.48 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 60.11 1mam n SER 208 Cb 0.41 -2.60 -0.13 0.00 -1.01 0.00 0.00 64.21 60.89 1mam n SER 208 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1mam s SER 209 N -1.64 2.85 -0.08 6.43 1.04 -0.83 -5.01 113.70 116.46 1mam s SER 209 Ca 0.00 -0.72 0.02 0.00 0.48 0.00 0.00 55.95 55.73 1mam s SER 209 Cb 0.00 -0.17 0.01 0.00 0.10 0.00 0.00 66.02 65.96 1mam s SER 209 CO 0.00 0.10 -0.14 0.42 0.98 0.00 0.00 173.24 174.61 1mam s THR 210 N -1.15 1.30 0.13 2.02 -4.23 -1.26 -1.46 115.64 111.00 1mam s THR 210 Ca 0.10 -0.56 0.09 0.00 -1.18 0.00 0.00 61.69 60.14 1mam s THR 210 Cb -0.10 -1.19 -0.04 0.00 1.34 0.00 0.00 72.50 72.51 1mam s THR 210 CO 0.05 0.40 -0.19 -0.89 -0.54 0.00 0.00 174.62 173.45 1mam s THR 211 N 0.79 2.75 -0.13 3.99 2.01 -0.16 -4.98 115.64 119.91 1mam s THR 211 Ca -0.12 -1.61 -0.04 0.00 0.31 0.00 0.00 61.69 60.24 1mam s THR 211 Cb -0.16 -2.27 0.05 0.00 0.01 0.00 0.00 72.50 70.13 1mam s THR 211 CO 0.02 0.06 0.07 0.68 -0.69 0.00 0.00 174.62 174.76 1mam s VAL 212 N -1.24 0.01 0.01 3.82 -7.23 -1.26 -0.01 120.40 114.49 1mam s VAL 212 Ca 0.18 -0.00 0.06 0.00 -1.81 0.00 0.00 61.98 60.41 1mam s VAL 212 Cb -0.10 -0.49 -0.02 0.00 0.56 0.00 0.00 36.38 36.33 1mam s VAL 212 CO 0.10 -0.09 -0.20 -0.62 -0.31 0.00 0.00 175.10 173.98 1mam s ASP 213 N 2.11 2.32 -0.01 4.85 -1.08 0.08 -4.95 116.67 119.99 1mam s ASP 213 Ca 0.03 -0.42 -0.00 0.00 -0.52 0.00 0.00 52.55 51.64 1mam s ASP 213 Cb -0.15 -0.23 -0.04 0.00 -1.46 0.00 0.00 42.92 41.05 1mam s ASP 213 CO -0.07 0.20 0.05 -0.54 0.52 0.00 0.00 175.17 175.34 1mam s LYS 214 N -0.74 2.99 -0.49 4.34 3.01 -1.26 -0.98 119.74 126.61 1mam s LYS 214 Ca 0.07 -0.50 -0.12 0.00 -1.01 0.00 0.00 55.97 54.41 1mam s LYS 214 Cb -0.08 -2.81 0.11 0.00 -1.01 0.00 0.00 37.83 34.05 1mam s LYS 214 CO 0.00 0.65 0.39 0.15 0.51 0.00 0.00 175.35 177.06 1mam s LYS 215 N -1.59 2.72 0.16 1.68 1.02 -0.77 -4.85 119.74 118.11 1mam s LYS 215 Ca 0.21 -1.67 0.08 0.00 0.02 0.00 0.00 55.97 54.62 1mam s LYS 215 Cb -0.12 -4.06 -0.04 0.00 -0.52 0.00 0.00 37.83 33.09 1mam s LYS 215 CO 0.12 -1.20 -0.10 -1.17 -0.92 0.00 0.00 175.35 172.08 1mam s LEU 216 N 1.48 2.97 0.00 3.17 0.20 -1.26 -4.46 118.68 120.78 1mam s LEU 216 Ca 0.04 -0.53 0.00 0.00 0.69 0.00 0.00 54.13 54.33 1mam s LEU 216 Cb -0.27 -1.69 0.00 0.00 -0.43 0.00 0.00 46.19 43.80 1mam s LEU 216 CO 0.02 0.13 0.00 1.21 -0.29 0.00 0.00 176.35 177.41