#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sjc s LYS 2 N 0.00 -0.01 -0.14 0.03 2.20 -1.26 -2.32 119.74 118.24 1sjc s LYS 2 Ca 0.00 0.42 -0.29 0.00 -0.36 0.00 0.00 55.97 55.73 1sjc s LYS 2 Cb 0.00 -0.35 -0.01 0.00 -1.51 0.00 0.00 37.83 35.97 1sjc s LYS 2 CO 0.00 -0.28 1.01 -1.17 -0.36 0.00 0.00 175.35 174.55 1sjc s LEU 3 N 1.93 4.21 -0.09 5.43 2.96 -1.26 -4.10 118.68 127.76 1sjc s LEU 3 Ca 0.01 1.49 0.04 0.00 -0.22 0.00 0.00 54.13 55.44 1sjc s LEU 3 Cb -0.12 -3.54 -0.24 0.00 0.50 0.00 0.00 46.19 42.78 1sjc s LEU 3 CO -0.04 -0.50 0.48 -1.20 -1.32 0.00 0.00 176.35 173.77 1sjc n SER 4 N 5.31 1.46 0.00 3.68 7.64 0.16 -4.83 113.62 127.03 1sjc n SER 4 Ca 0.09 0.29 0.00 0.00 1.01 0.00 0.00 58.87 60.27 1sjc n SER 4 Cb 0.48 -0.41 0.00 0.00 -1.01 0.00 0.00 64.21 63.27 1sjc n SER 4 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1sjc n GLY 5 N 1.78 -2.25 3.05 0.23 0.00 -1.14 -4.56 105.19 102.30 1sjc n GLY 5 Ca -0.25 -1.21 -0.13 0.00 0.00 0.00 0.00 46.02 44.43 1sjc n GLY 5 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1sjc s VAL 6 N -2.10 -0.02 -0.29 1.61 1.01 0.87 -0.63 120.40 120.84 1sjc s VAL 6 Ca 0.00 0.08 -0.08 0.00 0.00 0.00 0.00 61.98 61.98 1sjc s VAL 6 Cb 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 36.38 36.07 1sjc s VAL 6 CO 0.00 0.03 0.10 -0.70 0.00 0.00 0.00 175.10 174.53 1sjc s GLU 7 N 0.65 3.22 -0.15 2.72 2.12 -0.73 -0.07 118.70 126.47 1sjc s GLU 7 Ca -0.04 -0.77 -0.18 0.00 0.36 0.00 0.00 54.97 54.33 1sjc s GLU 7 Cb -0.06 -3.41 -0.04 0.00 0.26 0.00 0.00 34.13 30.88 1sjc s GLU 7 CO -0.04 -0.40 0.50 -1.17 -0.54 0.00 0.00 175.26 173.61 1sjc s LEU 8 N 1.54 4.22 0.11 2.70 2.96 0.37 -1.64 118.68 128.95 1sjc s LEU 8 Ca 0.04 0.76 0.10 0.00 -0.22 0.00 0.00 54.13 54.81 1sjc s LEU 8 Cb -0.17 -2.71 -0.04 0.00 0.50 0.00 0.00 46.19 43.78 1sjc s LEU 8 CO 0.03 -0.08 -0.25 -0.13 -1.32 0.00 0.00 176.35 174.61 1sjc s ARG 9 N 1.04 1.30 -0.12 1.98 0.52 -0.75 -1.06 118.95 121.87 1sjc s ARG 9 Ca 0.25 -1.26 -0.02 0.00 -0.52 0.00 0.00 55.73 54.19 1sjc s ARG 9 Cb -0.15 -1.70 -0.03 0.00 0.52 0.00 0.00 34.95 33.59 1sjc s ARG 9 CO 0.10 0.40 -0.06 1.03 0.02 0.00 0.00 175.30 176.80 1sjc s ARG 10 N -1.96 3.27 0.01 3.54 0.52 0.07 -2.02 118.95 122.38 1sjc s ARG 10 Ca 0.11 -0.54 0.06 0.00 -0.52 0.00 0.00 55.73 54.84 1sjc s ARG 10 Cb -0.10 -2.76 -0.02 0.00 0.52 0.00 0.00 34.95 32.59 1sjc s ARG 10 CO 0.05 0.42 -0.18 0.08 0.02 0.00 0.00 175.30 175.69 1sjc s VAL 11 N -0.14 1.46 -0.09 3.52 1.01 -0.13 -0.08 120.40 125.96 1sjc s VAL 11 Ca 0.02 -0.94 0.03 0.00 0.00 0.00 0.00 61.98 61.10 1sjc s VAL 11 Cb -0.13 -1.25 0.01 0.00 0.00 0.00 0.00 36.38 35.01 1sjc s VAL 11 CO 0.03 0.29 -0.20 -1.58 0.00 0.00 0.00 175.10 173.64 1sjc s GLN 12 N -0.75 2.57 -0.11 2.72 0.74 0.32 -0.09 119.66 125.06 1sjc s GLN 12 Ca 0.06 -0.71 -0.01 0.00 0.05 0.00 0.00 55.36 54.75 1sjc s GLN 12 Cb -0.08 -1.99 0.03 0.00 1.10 0.00 0.00 33.01 32.07 1sjc s GLN 12 CO 0.00 0.12 -0.02 -1.64 -0.55 0.00 0.00 175.29 173.20 1sjc s MET 13 N 0.48 0.91 0.38 1.67 -1.94 0.01 -4.73 119.30 116.08 1sjc s MET 13 Ca -0.17 -0.10 -0.26 0.00 -1.71 0.00 0.00 55.69 53.45 1sjc s MET 13 Cb -0.17 -1.36 -0.09 0.00 2.01 0.00 0.00 34.83 35.22 1sjc s MET 13 CO 0.07 -0.35 1.16 -1.25 -0.01 0.00 0.00 175.02 174.63 1sjc s PRO 14 N 1.87 4.18 0.33 2.03 0.05 -1.26 0.12 135.00 142.31 1sjc s PRO 14 Ca 0.04 1.83 -0.21 0.00 0.05 0.00 0.00 61.00 62.70 1sjc s PRO 14 Cb -0.13 -2.77 -0.10 0.00 0.05 0.00 0.00 34.50 31.55 1sjc s PRO 14 CO -0.07 -0.21 0.86 -0.51 0.05 0.00 0.00 177.00 177.13 1sjc s LEU 15 N -2.29 4.18 0.25 -3.56 1.02 0.19 -4.66 118.68 113.81 1sjc s LEU 15 Ca 0.54 1.60 -0.03 0.00 0.02 0.00 0.00 54.13 56.27 1sjc s LEU 15 Cb -0.31 -4.08 0.30 0.00 0.02 0.00 0.00 46.19 42.13 1sjc s LEU 15 CO 0.39 -0.15 1.75 0.58 0.02 0.00 0.00 176.35 178.93 1sjc h VAL 16 N 2.33 1.25 -2.80 -1.59 2.07 -0.87 -3.44 116.25 113.19 1sjc h VAL 16 Ca -0.48 -1.01 -0.14 0.00 0.82 0.00 0.00 66.70 65.89 1sjc h VAL 16 Cb 1.19 0.85 -0.26 0.00 -1.52 0.00 0.00 31.29 31.54 1sjc h VAL 16 CO 0.64 0.36 -0.34 0.00 0.02 0.00 0.00 177.57 178.25 1sjc s ALA 17 N -5.01 -0.89 0.15 1.67 0.00 -1.26 -5.10 121.76 111.31 1sjc s ALA 17 Ca -0.10 1.24 -0.34 0.00 0.00 0.00 0.00 51.96 52.76 1sjc s ALA 17 Cb 0.15 -0.75 -0.16 0.00 0.00 0.00 0.00 23.12 22.36 1sjc s ALA 17 CO 0.82 -0.22 1.26 -2.30 0.00 0.00 0.00 175.76 175.32 1sjc n PRO 18 N 3.76 1.25 -3.69 0.00 -0.02 -1.26 -4.88 135.00 130.17 1sjc n PRO 18 Ca -0.20 0.45 -0.39 0.00 -2.02 0.00 0.00 63.50 61.34 1sjc n PRO 18 Cb 0.56 -2.02 -0.11 0.00 -0.02 0.00 0.00 33.50 31.91 1sjc n PRO 18 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1sjc s PHE 19 N 0.10 3.35 -0.24 6.00 5.36 0.43 -4.85 117.98 128.12 1sjc s PHE 19 Ca 0.77 -1.64 -0.10 0.00 -0.96 0.00 0.00 56.93 55.00 1sjc s PHE 19 Cb -0.87 -2.76 -0.05 0.00 -0.34 0.00 0.00 43.02 39.01 1sjc s PHE 19 CO 0.50 -0.83 0.15 0.50 -1.46 0.00 0.00 175.22 174.08 1sjc s ARG 20 N 1.37 4.02 0.50 10.12 3.52 -1.26 -1.21 118.95 136.01 1sjc s ARG 20 Ca 0.02 -0.30 0.02 0.00 -0.13 0.00 0.00 55.73 55.34 1sjc s ARG 20 Cb -0.22 -3.53 -0.02 0.00 -1.56 0.00 0.00 34.95 29.63 1sjc s ARG 20 CO 0.01 0.01 0.03 0.95 -0.81 0.00 0.00 175.30 175.50 1sjc s THR 21 N 1.19 1.29 -0.71 4.11 -4.23 0.25 -0.68 115.64 116.85 1sjc s THR 21 Ca 0.07 -1.96 0.15 0.00 -1.18 0.00 0.00 61.69 58.76 1sjc s THR 21 Cb -0.14 -2.25 0.14 0.00 1.34 0.00 0.00 72.50 71.59 1sjc s THR 21 CO 0.05 0.00 1.45 -1.54 -0.54 0.00 0.00 174.62 174.05 1sjc n SER 22 N -1.27 0.28 -0.83 3.99 3.41 -1.26 -1.16 113.62 116.78 1sjc n SER 22 Ca -0.17 0.60 0.12 0.00 -0.26 0.00 0.00 58.87 59.16 1sjc n SER 22 Cb 0.67 -0.65 0.09 0.00 -0.26 0.00 0.00 64.21 64.06 1sjc n SER 22 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 1sjc n PHE 23 N -1.84 0.00 0.00 7.33 -1.74 -1.26 -5.05 117.46 114.90 1sjc n PHE 23 Ca 0.01 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.90 1sjc n PHE 23 Cb 0.11 -0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.11 1sjc n PHE 23 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1sjc n GLY 24 N 1.36 0.92 3.80 4.97 0.00 -0.31 -5.03 105.19 110.90 1sjc n GLY 24 Ca 0.13 -2.06 -0.26 0.00 0.00 0.00 0.00 46.02 43.83 1sjc n GLY 24 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sjc s THR 25 N -1.11 4.52 -0.17 2.61 2.01 -1.26 0.88 115.64 123.12 1sjc s THR 25 Ca 0.00 -1.05 -0.06 0.00 0.31 0.00 0.00 61.69 60.89 1sjc s THR 25 Cb 0.00 -3.30 0.08 0.00 0.01 0.00 0.00 72.50 69.29 1sjc s THR 25 CO 0.00 -0.09 0.36 -1.58 -0.69 0.00 0.00 174.62 172.61 1sjc s GLN 26 N -3.06 0.26 -0.10 4.92 0.74 -0.35 -4.92 119.66 117.14 1sjc s GLN 26 Ca 0.31 0.91 0.16 0.00 0.05 0.00 0.00 55.36 56.79 1sjc s GLN 26 Cb -0.10 0.17 -0.24 0.00 1.10 0.00 0.00 33.01 33.95 1sjc s GLN 26 CO 0.23 -0.26 0.20 0.43 -0.55 0.00 0.00 175.29 175.35 1sjc n SER 27 N 5.30 0.93 -4.35 6.67 7.64 -1.26 0.16 113.62 128.71 1sjc n SER 27 Ca -0.09 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.61 1sjc n SER 27 Cb 0.50 1.30 -0.10 0.00 -1.01 0.00 0.00 64.21 64.90 1sjc n SER 27 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1sjc s VAL 28 N -2.76 1.43 -0.24 0.44 1.01 -1.26 0.53 120.40 119.55 1sjc s VAL 28 Ca -0.07 -2.11 -0.00 0.00 0.00 0.00 0.00 61.98 59.79 1sjc s VAL 28 Cb 0.08 -2.22 0.07 0.00 0.00 0.00 0.00 36.38 34.31 1sjc s VAL 28 CO 0.70 -0.46 0.00 -0.60 0.00 0.00 0.00 175.10 174.75 1sjc s ARG 29 N -3.74 1.19 -0.13 2.72 3.52 0.12 -4.84 118.95 117.78 1sjc s ARG 29 Ca 0.25 -0.89 -0.16 0.00 -0.13 0.00 0.00 55.73 54.80 1sjc s ARG 29 Cb 0.03 -2.39 -0.04 0.00 -1.56 0.00 0.00 34.95 30.99 1sjc s ARG 29 CO 0.08 -0.69 0.41 -1.21 -0.81 0.00 0.00 175.30 173.07 1sjc s GLU 30 N 1.54 4.29 0.29 5.12 2.02 -1.26 -0.80 118.70 129.90 1sjc s GLU 30 Ca -0.01 0.32 0.02 0.00 0.02 0.00 0.00 54.97 55.32 1sjc s GLU 30 Cb -0.18 -3.42 -0.05 0.00 0.10 0.00 0.00 34.13 30.57 1sjc s GLU 30 CO -0.10 0.21 0.09 -0.51 0.02 0.00 0.00 175.26 174.97 1sjc s LEU 31 N 0.51 1.81 -0.09 1.80 1.43 0.87 -4.59 118.68 120.42 1sjc s LEU 31 Ca 0.22 -1.41 -0.00 0.00 -1.03 0.00 0.00 54.13 51.92 1sjc s LEU 31 Cb -0.14 -0.09 0.02 0.00 0.03 0.00 0.00 46.19 46.01 1sjc s LEU 31 CO 0.08 -0.71 -0.06 -0.22 0.23 0.00 0.00 176.35 175.66 1sjc s LEU 32 N -3.38 1.12 0.20 1.79 2.96 -1.26 -0.96 118.68 119.15 1sjc s LEU 32 Ca 0.37 -0.24 0.11 0.00 -0.22 0.00 0.00 54.13 54.15 1sjc s LEU 32 Cb 0.08 -0.72 -0.04 0.00 0.50 0.00 0.00 46.19 46.00 1sjc s LEU 32 CO 0.14 -0.11 -0.22 -0.76 -1.32 0.00 0.00 176.35 174.08 1sjc s LEU 33 N 1.58 2.51 -0.06 -0.68 1.43 -0.85 -1.71 118.68 120.89 1sjc s LEU 33 Ca 0.01 -0.84 0.02 0.00 -1.03 0.00 0.00 54.13 52.29 1sjc s LEU 33 Cb -0.13 -1.22 0.02 0.00 0.03 0.00 0.00 46.19 44.88 1sjc s LEU 33 CO -0.06 0.11 -0.10 -0.76 0.23 0.00 0.00 176.35 175.78 1sjc s LEU 34 N -2.74 1.56 -0.41 1.79 1.43 0.88 -1.81 118.68 119.38 1sjc s LEU 34 Ca 0.22 -0.26 -0.05 0.00 -1.03 0.00 0.00 54.13 53.00 1sjc s LEU 34 Cb -0.08 -0.74 0.10 0.00 0.03 0.00 0.00 46.19 45.50 1sjc s LEU 34 CO 0.11 0.01 0.22 -0.60 0.23 0.00 0.00 176.35 176.32 1sjc s ARG 35 N 0.75 2.28 -0.03 1.70 3.52 -0.65 -0.99 118.95 125.52 1sjc s ARG 35 Ca -0.13 -1.66 -0.30 0.00 -0.13 0.00 0.00 55.73 53.51 1sjc s ARG 35 Cb -0.15 -3.65 -0.03 0.00 -1.56 0.00 0.00 34.95 29.56 1sjc s ARG 35 CO 0.03 -1.02 1.09 0.00 -0.81 0.00 0.00 175.30 174.59 1sjc s ALA 36 N 1.26 3.36 -0.31 6.12 0.00 0.22 -1.77 121.76 130.64 1sjc s ALA 36 Ca 0.05 0.57 -0.04 0.00 0.00 0.00 0.00 51.96 52.54 1sjc s ALA 36 Cb -0.23 -3.43 0.04 0.00 0.00 0.00 0.00 23.12 19.49 1sjc s ALA 36 CO -0.02 -0.52 0.05 0.08 0.00 0.00 0.00 175.76 175.35 1sjc s VAL 37 N 1.63 3.43 0.27 0.00 1.01 0.20 -2.02 120.40 124.92 1sjc s VAL 37 Ca 0.53 -1.17 0.09 0.00 0.00 0.00 0.00 61.98 61.44 1sjc s VAL 37 Cb -0.23 -2.91 -0.04 0.00 0.00 0.00 0.00 36.38 33.20 1sjc s VAL 37 CO 0.24 -0.09 0.05 0.42 0.00 0.00 0.00 175.10 175.72 1sjc s THR 38 N 1.35 3.61 0.57 3.92 -4.23 0.29 0.37 115.64 121.51 1sjc s THR 38 Ca -0.02 -1.79 0.26 0.00 -1.18 0.00 0.00 61.69 58.95 1sjc s THR 38 Cb -0.19 -2.97 0.34 0.00 1.34 0.00 0.00 72.50 71.02 1sjc s THR 38 CO 0.01 -0.35 2.15 -0.65 -0.54 0.00 0.00 174.62 175.24 1sjc h PRO 39 N 1.77 0.00 0.00 3.99 0.11 -1.97 -2.55 132.00 133.36 1sjc h PRO 39 Ca -0.45 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.63 1sjc h PRO 39 Cb 1.25 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 1sjc h PRO 39 CO 0.61 0.00 -0.15 0.00 -0.21 0.00 0.00 178.00 178.25 1sjc h ALA 40 N 1.90 0.03 -2.96 -0.75 0.00 -1.93 -3.51 119.26 112.04 1sjc h ALA 40 Ca 0.05 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1sjc h ALA 40 Cb 0.26 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1sjc h ALA 40 CO -0.00 0.08 0.00 0.41 0.00 0.00 0.00 179.25 179.74 1sjc n GLY 41 N 1.59 1.04 3.76 0.00 0.00 -0.96 -5.11 105.19 105.51 1sjc n GLY 41 Ca -0.12 -0.62 -0.24 0.00 0.00 0.00 0.00 46.02 45.03 1sjc n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1sjc s GLU 42 N 0.94 2.72 -0.07 1.61 2.02 -1.26 -0.55 118.70 124.11 1sjc s GLU 42 Ca 0.00 -1.06 -0.07 0.00 0.02 0.00 0.00 54.97 53.86 1sjc s GLU 42 Cb 0.00 -2.49 0.02 0.00 0.10 0.00 0.00 34.13 31.76 1sjc s GLU 42 CO 0.00 0.43 0.20 0.20 0.02 0.00 0.00 175.26 176.11 1sjc s GLY 43 N -3.42 -0.14 0.02 -1.39 0.00 -0.86 -3.95 107.32 97.58 1sjc s GLY 43 Ca 0.31 0.53 0.05 0.00 0.00 0.00 0.00 44.72 45.62 1sjc s GLY 43 CO 0.22 0.45 -0.14 -0.98 0.00 0.00 0.00 173.10 172.66 1sjc s TRP 44 N 0.04 2.69 0.01 1.90 0.52 -1.25 0.70 118.94 123.55 1sjc s TRP 44 Ca -0.01 -0.17 0.01 0.00 0.02 0.00 0.00 56.10 55.95 1sjc s TRP 44 Cb -0.02 -1.53 -0.01 0.00 -1.15 0.00 0.00 33.47 30.76 1sjc s TRP 44 CO 0.00 0.29 -0.04 0.20 0.02 0.00 0.00 176.95 177.42 1sjc s GLY 45 N -1.36 0.26 -0.03 0.98 0.00 -0.16 -3.29 107.32 103.73 1sjc s GLY 45 Ca 0.15 -0.40 0.07 0.00 0.00 0.00 0.00 44.72 44.54 1sjc s GLY 45 CO 0.06 -0.42 -0.24 1.85 0.00 0.00 0.00 173.10 174.35 1sjc s GLU 46 N -0.77 2.09 -0.14 2.90 2.12 -1.26 -0.09 118.70 123.54 1sjc s GLU 46 Ca -0.06 -0.87 -0.07 0.00 0.36 0.00 0.00 54.97 54.34 1sjc s GLU 46 Cb -0.05 -1.95 -0.04 0.00 0.26 0.00 0.00 34.13 32.35 1sjc s GLU 46 CO -0.00 0.48 0.11 0.00 -0.54 0.00 0.00 175.26 175.31 1sjc n VAL 48 N 2.62 0.19 -0.71 0.00 0.24 -1.26 -4.44 118.33 114.96 1sjc n VAL 48 Ca -0.18 -0.11 -0.32 0.00 -2.04 0.00 0.00 64.34 61.69 1sjc n VAL 48 Cb 0.54 -0.28 0.15 0.00 -1.47 0.00 0.00 33.84 32.78 1sjc n VAL 48 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1sjc n THR 49 N -1.76 0.00 -4.12 3.34 -2.24 -1.26 -5.02 114.28 103.22 1sjc n THR 49 Ca 0.06 -0.08 -0.05 0.00 -2.27 0.00 0.00 64.05 61.71 1sjc n THR 49 Cb 0.37 -0.86 -0.01 0.00 -2.10 0.00 0.00 70.33 67.73 1sjc n THR 49 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1sjc n MET 50 N -3.32 1.49 0.01 -0.78 2.81 -1.26 -4.67 117.12 111.40 1sjc n MET 50 Ca 0.10 -0.62 -0.12 0.00 -1.81 0.00 0.00 57.70 55.24 1sjc n MET 50 Cb 0.53 0.22 -0.08 0.00 -0.71 0.00 0.00 33.22 33.18 1sjc n MET 50 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1sjc h ALA 51 N 1.07 -0.82 -1.85 3.04 0.00 -1.94 0.66 119.26 119.42 1sjc h ALA 51 Ca -0.07 -0.05 -0.55 0.00 0.00 0.00 0.00 54.91 54.24 1sjc h ALA 51 Cb 0.22 0.91 -0.08 0.00 0.00 0.00 0.00 17.79 18.83 1sjc h ALA 51 CO 0.11 -0.97 -0.54 0.20 0.00 0.00 0.00 179.25 178.05 1sjc s GLY 52 N -2.01 1.99 -1.47 0.00 0.00 -1.26 -3.99 107.32 100.59 1sjc s GLY 52 Ca -0.12 -1.86 -0.13 0.00 0.00 0.00 0.00 44.72 42.60 1sjc s GLY 52 CO 0.48 -1.78 2.29 -1.55 0.00 0.00 0.00 173.10 172.54 1sjc n PRO 53 N -1.14 2.99 -0.12 2.90 -0.04 -1.26 -4.59 135.00 133.74 1sjc n PRO 53 Ca -0.03 -2.61 -0.16 0.00 -0.04 0.00 0.00 63.50 60.66 1sjc n PRO 53 Cb 0.62 -3.22 -0.12 0.00 -0.04 0.00 0.00 33.50 30.74 1sjc n PRO 53 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1sjc n LEU 54 N 5.70 2.60 0.09 1.53 4.77 -1.26 -4.55 117.00 125.88 1sjc n LEU 54 Ca 0.54 -0.11 -0.22 0.00 -0.03 0.00 0.00 56.01 56.19 1sjc n LEU 54 Cb 0.37 -0.69 -0.15 0.00 -2.33 0.00 0.00 43.42 40.63 1sjc n LEU 54 CO 0.89 0.86 -0.39 0.22 -1.33 0.00 0.00 177.39 177.63 1sjc h TYR 55 N 0.00 0.72 -4.13 -1.77 5.03 -1.90 -3.48 116.97 111.43 1sjc h TYR 55 Ca -0.54 -0.52 -0.29 0.00 2.58 0.00 0.00 58.73 59.96 1sjc h TYR 55 Cb 1.89 -0.03 -0.08 0.00 1.55 0.00 0.00 36.73 40.06 1sjc h TYR 55 CO 0.02 1.56 -0.18 -1.54 -1.32 0.00 0.00 178.16 176.71 1sjc s SER 56 N -7.29 1.01 0.00 -2.11 1.04 -1.26 -5.02 113.70 100.07 1sjc s SER 56 Ca -0.12 -1.53 0.20 0.00 0.48 0.00 0.00 55.95 54.98 1sjc s SER 56 Cb 0.05 0.68 0.91 0.00 0.10 0.00 0.00 66.02 67.77 1sjc s SER 56 CO 0.88 -1.33 1.63 -1.54 0.98 0.00 0.00 173.24 173.86 1sjc n SER 57 N -1.52 0.00 -4.82 7.02 3.41 -1.26 -4.34 113.62 112.11 1sjc n SER 57 Ca 0.01 0.28 -0.37 0.00 -0.26 0.00 0.00 58.87 58.53 1sjc n SER 57 Cb 0.61 -0.41 -0.06 0.00 -0.26 0.00 0.00 64.21 64.10 1sjc n SER 57 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1sjc s GLU 58 N -2.81 4.20 0.07 4.33 2.02 -1.26 -4.74 118.70 120.50 1sjc s GLU 58 Ca 0.14 0.76 -0.08 0.00 0.02 0.00 0.00 54.97 55.81 1sjc s GLU 58 Cb 0.13 -3.08 -0.01 0.00 0.10 0.00 0.00 34.13 31.27 1sjc s GLU 58 CO 0.33 0.53 0.16 1.52 0.02 0.00 0.00 175.26 177.83 1sjc s TYR 59 N -1.30 0.17 0.12 1.61 1.13 -1.26 -4.25 117.35 113.57 1sjc s TYR 59 Ca 0.35 -0.55 -0.27 0.00 -1.41 0.00 0.00 57.07 55.19 1sjc s TYR 59 Cb -0.18 -0.09 -0.08 0.00 -1.10 0.00 0.00 41.96 40.50 1sjc s TYR 59 CO 0.20 -0.49 1.46 -0.91 -2.51 0.00 0.00 175.55 173.31 1sjc h ASN 60 N 3.03 -1.68 -0.68 -0.18 2.35 0.21 0.29 115.58 118.92 1sjc h ASN 60 Ca -0.33 0.23 0.08 0.00 -0.55 0.00 0.00 56.30 55.73 1sjc h ASN 60 Cb 1.19 0.71 -0.04 0.00 0.05 0.00 0.00 38.32 40.23 1sjc h ASN 60 CO 0.55 -0.29 0.45 0.44 -1.65 0.00 0.00 177.43 176.93 1sjc h ASP 61 N -0.21 0.53 -0.17 5.81 3.32 -1.83 0.73 116.42 124.60 1sjc h ASP 61 Ca 0.09 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 1sjc h ASP 61 Cb 0.45 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 1sjc h ASP 61 CO -0.61 0.33 -0.01 1.23 -1.72 0.00 0.00 179.24 178.46 1sjc h GLY 62 N 0.60 0.34 0.94 2.75 0.00 -1.40 -1.92 103.07 104.37 1sjc h GLY 62 Ca 0.30 -0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 1sjc h GLY 62 CO -0.10 0.23 0.14 0.00 0.00 0.00 0.00 176.54 176.81 1sjc h ALA 63 N 0.77 0.35 -0.38 3.60 0.00 0.24 -1.56 119.26 122.29 1sjc h ALA 63 Ca 0.05 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.95 1sjc h ALA 63 Cb 0.40 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 1sjc h ALA 63 CO 0.01 -0.10 -0.04 1.49 0.00 0.00 0.00 179.25 180.61 1sjc h GLU 64 N 0.32 0.05 -0.50 0.00 4.81 -0.84 0.11 114.58 118.53 1sjc h GLU 64 Ca 0.10 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 1sjc h GLU 64 Cb 0.10 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 1sjc h GLU 64 CO -0.01 0.04 0.24 1.25 -0.73 0.00 0.00 179.01 179.79 1sjc h HIS 65 N 0.05 0.72 -0.31 0.92 2.76 -1.08 -1.79 115.15 116.43 1sjc h HIS 65 Ca 0.19 -0.04 -0.14 0.00 -2.20 0.00 0.00 60.37 58.18 1sjc h HIS 65 Cb 0.27 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 29.00 1sjc h HIS 65 CO -0.30 0.57 -0.38 -0.24 -1.30 0.00 0.00 177.93 176.29 1sjc h VAL 66 N 0.66 1.29 -0.03 5.26 3.04 -0.80 -1.42 116.25 124.24 1sjc h VAL 66 Ca 0.17 -1.55 0.01 0.00 -1.01 0.00 0.00 66.70 64.33 1sjc h VAL 66 Cb 0.12 1.45 -0.02 0.00 -2.01 0.00 0.00 31.29 30.84 1sjc h VAL 66 CO -0.02 0.50 -0.05 -0.07 -1.01 0.00 0.00 177.57 176.92 1sjc h LEU 67 N 0.61 -0.15 -0.09 3.16 3.38 -0.59 0.61 115.31 122.24 1sjc h LEU 67 Ca 0.05 0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.08 1sjc h LEU 67 Cb 0.92 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.71 1sjc h LEU 67 CO 0.08 -0.07 -0.11 0.03 0.09 0.00 0.00 178.44 178.47 1sjc h ARG 68 N -0.07 -0.13 0.00 1.13 3.08 -1.27 2.20 114.38 119.31 1sjc h ARG 68 Ca 0.03 0.01 -0.19 0.00 0.07 0.00 0.00 59.98 59.90 1sjc h ARG 68 Cb 0.12 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 1sjc h ARG 68 CO -0.08 -0.09 -1.53 0.72 -1.07 0.00 0.00 179.97 177.93 1sjc n HIS 69 N -5.24 0.89 0.03 3.04 8.25 -0.54 -4.42 115.22 117.23 1sjc n HIS 69 Ca -0.04 0.30 0.00 0.00 -0.26 0.00 0.00 57.72 57.72 1sjc n HIS 69 Cb 0.17 -1.07 0.00 0.00 1.12 0.00 0.00 29.99 30.20 1sjc n HIS 69 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1sjc n TYR 70 N -2.87 -0.23 -0.02 4.41 4.02 0.19 -4.79 117.16 117.86 1sjc n TYR 70 Ca -0.12 0.04 -0.13 0.00 -0.01 0.00 0.00 57.90 57.68 1sjc n TYR 70 Cb 0.87 0.13 -0.10 0.00 -0.02 0.00 0.00 39.34 40.22 1sjc n TYR 70 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1sjc h LEU 71 N 0.00 -0.02 -0.04 7.72 3.38 -0.23 -2.52 115.31 123.61 1sjc h LEU 71 Ca 0.00 -0.58 0.01 0.00 0.09 0.00 0.00 57.88 57.40 1sjc h LEU 71 Cb 0.49 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1sjc h LEU 71 CO 0.00 0.58 -0.01 0.40 0.09 0.00 0.00 178.44 179.50 1sjc h ILE 72 N -0.62 0.96 -0.98 1.22 2.04 0.34 -2.96 117.51 117.51 1sjc h ILE 72 Ca -0.00 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.02 1sjc h ILE 72 Cb 0.60 0.96 -0.10 0.00 -0.74 0.00 0.00 36.82 37.54 1sjc h ILE 72 CO 0.00 0.00 0.59 1.55 0.00 0.00 0.00 178.15 180.29 1sjc h PRO 73 N -0.00 0.79 0.00 2.37 0.13 -1.71 -0.61 132.00 132.97 1sjc h PRO 73 Ca 0.02 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.09 1sjc h PRO 73 Cb 0.03 -0.18 -0.00 0.00 0.13 0.00 0.00 31.00 30.98 1sjc h PRO 73 CO -0.04 0.52 -0.07 0.00 -0.23 0.00 0.00 178.00 178.18 1sjc h ALA 74 N 1.60 1.05 0.07 -0.56 0.00 -1.28 -2.32 119.26 117.82 1sjc h ALA 74 Ca 0.54 -0.06 -0.19 0.00 0.00 0.00 0.00 54.91 55.20 1sjc h ALA 74 Cb 0.75 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1sjc h ALA 74 CO -0.35 0.08 -0.95 -0.07 0.00 0.00 0.00 179.25 177.97 1sjc h LEU 75 N 0.00 0.22 -1.79 0.00 3.38 -1.05 -3.27 115.31 112.81 1sjc h LEU 75 Ca -0.00 -0.83 0.21 0.00 0.09 0.00 0.00 57.88 57.35 1sjc h LEU 75 Cb 0.47 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.10 1sjc h LEU 75 CO 0.01 1.41 0.57 -0.07 0.09 0.00 0.00 178.44 180.45 1sjc h LEU 76 N -0.63 0.18 -0.92 1.67 3.38 -1.25 0.97 115.31 118.72 1sjc h LEU 76 Ca -0.22 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 1sjc h LEU 76 Cb 1.47 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 42.20 1sjc h LEU 76 CO 0.00 0.07 -0.15 0.00 0.09 0.00 0.00 178.44 178.45 1sjc h ALA 77 N 1.62 0.98 -2.69 1.53 0.00 -1.49 -3.46 119.26 115.75 1sjc h ALA 77 Ca 0.41 -0.14 -0.52 0.00 0.00 0.00 0.00 54.91 54.66 1sjc h ALA 77 Cb 1.32 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 19.10 1sjc h ALA 77 CO -0.08 0.19 0.50 0.00 0.00 0.00 0.00 179.25 179.87 1sjc s ALA 78 N -3.51 3.40 0.00 0.00 0.00 0.33 -5.01 121.76 116.97 1sjc s ALA 78 Ca 0.02 0.87 0.00 0.00 0.00 0.00 0.00 51.96 52.86 1sjc s ALA 78 Cb 0.09 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.84 1sjc s ALA 78 CO 0.63 -0.26 0.94 0.39 0.00 0.00 0.00 175.76 177.46 1sjc n GLU 79 N 2.19 0.00 -4.49 0.00 -0.58 -1.26 -4.69 120.64 111.81 1sjc n GLU 79 Ca 0.02 0.48 -0.34 0.00 -0.42 0.00 0.00 57.16 56.91 1sjc n GLU 79 Cb 0.45 -1.44 -0.10 0.00 -0.57 0.00 0.00 31.44 29.78 1sjc n GLU 79 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1sjc s ASP 80 N -2.09 4.92 -0.06 1.62 2.15 -1.26 -4.69 116.67 117.27 1sjc s ASP 80 Ca 0.00 0.05 0.04 0.00 0.43 0.00 0.00 52.55 53.07 1sjc s ASP 80 Cb 0.00 -1.30 -0.00 0.00 -0.30 0.00 0.00 42.92 41.31 1sjc s ASP 80 CO 0.00 0.36 -0.20 -0.63 -0.17 0.00 0.00 175.17 174.54 1sjc s ILE 81 N -0.86 1.64 -0.00 4.11 1.01 -0.98 -4.95 121.20 121.16 1sjc s ILE 81 Ca 0.13 -0.82 0.02 0.00 0.00 0.00 0.00 60.65 59.98 1sjc s ILE 81 Cb -0.11 -1.41 -0.01 0.00 0.01 0.00 0.00 42.46 40.94 1sjc s ILE 81 CO 0.02 0.47 -0.07 0.42 0.00 0.00 0.00 174.94 175.78 1sjc s THR 82 N 0.10 0.54 0.32 2.92 -4.23 -1.26 -2.46 115.64 111.57 1sjc s THR 82 Ca -0.07 -0.36 0.06 0.00 -1.18 0.00 0.00 61.69 60.15 1sjc s THR 82 Cb -0.13 -0.47 0.40 0.00 1.34 0.00 0.00 72.50 73.64 1sjc s THR 82 CO 0.04 0.11 1.57 0.00 -0.54 0.00 0.00 174.62 175.80 1sjc h ALA 83 N 5.85 1.42 -0.69 3.99 0.00 -1.91 1.00 119.26 128.92 1sjc h ALA 83 Ca -0.30 0.33 0.09 0.00 0.00 0.00 0.00 54.91 55.03 1sjc h ALA 83 Cb 1.19 0.54 -0.04 0.00 0.00 0.00 0.00 17.79 19.47 1sjc h ALA 83 CO 0.49 -0.67 0.46 0.00 0.00 0.00 0.00 179.25 179.53 1sjc h ALA 84 N 1.99 1.84 0.00 0.00 0.00 -1.95 -1.06 119.26 120.08 1sjc h ALA 84 Ca 0.66 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.56 1sjc h ALA 84 Cb 1.49 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1sjc h ALA 84 CO -0.89 0.03 0.00 0.87 0.00 0.00 0.00 179.25 179.25 1sjc h LYS 85 N 0.61 0.00 -0.77 0.00 1.57 0.64 -3.27 116.57 115.35 1sjc h LYS 85 Ca 0.31 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 59.21 1sjc h LYS 85 Cb 0.42 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.64 1sjc h LYS 85 CO -0.10 0.00 0.39 0.28 -0.57 0.00 0.00 179.45 179.44 1sjc h VAL 86 N 0.00 0.79 0.82 0.50 2.07 -0.67 0.20 116.25 119.95 1sjc h VAL 86 Ca 0.00 -0.21 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 1sjc h VAL 86 Cb 0.85 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 1sjc h VAL 86 CO 0.00 0.11 -0.45 0.74 0.02 0.00 0.00 177.57 177.99 1sjc h THR 87 N 0.61 0.00 -0.53 2.57 2.02 -1.70 0.48 112.91 116.36 1sjc h THR 87 Ca 0.40 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.67 1sjc h THR 87 Cb 0.49 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.87 1sjc h THR 87 CO -0.31 0.00 0.36 1.55 0.37 0.00 0.00 175.52 177.49 1sjc h PRO 88 N -1.17 0.31 -0.24 6.66 0.13 -1.71 0.91 132.00 136.89 1sjc h PRO 88 Ca -0.11 -0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 64.89 1sjc h PRO 88 Cb 0.92 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.97 1sjc h PRO 88 CO 0.14 0.21 -0.32 -0.07 -0.23 0.00 0.00 178.00 177.73 1sjc h LEU 89 N 0.32 0.52 -2.31 1.56 3.38 0.03 -3.18 115.31 115.63 1sjc h LEU 89 Ca 0.24 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1sjc h LEU 89 Cb 0.54 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1sjc h LEU 89 CO -0.06 0.81 0.00 0.18 0.09 0.00 0.00 178.44 179.47 1sjc n LEU 90 N -4.08 3.28 0.12 1.67 4.77 0.10 -4.54 117.00 118.33 1sjc n LEU 90 Ca -0.01 -1.51 0.16 0.00 -0.03 0.00 0.00 56.01 54.62 1sjc n LEU 90 Cb 0.45 -0.23 0.70 0.00 -2.33 0.00 0.00 43.42 42.02 1sjc n LEU 90 CO 0.43 0.71 1.14 0.00 -1.33 0.00 0.00 177.39 178.35 1sjc h ALA 91 N 4.01 2.22 0.00 -1.18 0.00 -0.89 -1.88 119.26 121.54 1sjc h ALA 91 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1sjc h ALA 91 Cb 0.91 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1sjc h ALA 91 CO 0.00 -0.39 -0.08 1.57 0.00 0.00 0.00 179.25 180.35 1sjc h LYS 92 N 0.00 0.00 -5.29 0.00 2.10 -1.82 -3.40 116.57 108.16 1sjc h LYS 92 Ca 0.15 0.00 -0.62 0.00 -2.00 0.00 0.00 60.65 58.18 1sjc h LYS 92 Cb 0.62 0.00 -0.13 0.00 -0.90 0.00 0.00 32.23 31.81 1sjc h LYS 92 CO -0.00 0.08 -0.10 -0.06 -2.00 0.00 0.00 179.45 177.37 1sjc s PHE 93 N -4.12 3.27 0.18 0.07 0.40 -0.71 -5.04 117.98 112.02 1sjc s PHE 93 Ca -0.03 0.56 -0.30 0.00 -0.60 0.00 0.00 56.93 56.56 1sjc s PHE 93 Cb 0.13 -2.66 -0.07 0.00 0.51 0.00 0.00 43.02 40.92 1sjc s PHE 93 CO 0.55 -0.25 1.04 0.15 0.70 0.00 0.00 175.22 177.41 1sjc s LYS 94 N 2.16 4.66 4.15 0.44 -0.14 -1.26 -4.86 119.74 124.89 1sjc s LYS 94 Ca 0.19 1.62 0.00 0.00 -1.36 0.00 0.00 55.97 56.42 1sjc s LYS 94 Cb -0.16 -3.30 0.00 0.00 -1.68 0.00 0.00 37.83 32.70 1sjc s LYS 94 CO 0.09 0.19 0.00 0.41 -0.76 0.00 0.00 175.35 175.28 1sjc n GLY 95 N 1.96 0.80 3.55 -3.33 0.00 -1.26 -4.97 105.19 101.95 1sjc n GLY 95 Ca 0.02 -0.81 -0.26 0.00 0.00 0.00 0.00 46.02 44.97 1sjc n GLY 95 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1sjc n HIS 96 N 7.23 -2.43 -0.11 1.61 8.25 -1.26 -4.91 115.22 123.60 1sjc n HIS 96 Ca 0.00 0.83 -0.08 0.00 -0.26 0.00 0.00 57.72 58.21 1sjc n HIS 96 Cb 0.00 -4.43 -0.00 0.00 1.12 0.00 0.00 29.99 26.68 1sjc n HIS 96 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1sjc h ARG 97 N -2.10 0.42 -0.42 -0.41 3.08 -1.89 0.11 114.38 113.17 1sjc h ARG 97 Ca -0.55 -0.03 0.03 0.00 0.07 0.00 0.00 59.98 59.50 1sjc h ARG 97 Cb 1.36 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 31.29 1sjc h ARG 97 CO 0.60 0.28 0.22 0.52 -1.07 0.00 0.00 179.97 180.52 1sjc h MET 98 N 0.43 0.43 0.64 0.04 0.00 -1.79 0.48 114.93 115.17 1sjc h MET 98 Ca 0.14 -0.03 -0.03 0.00 0.00 0.00 0.00 59.70 59.78 1sjc h MET 98 Cb -0.01 -0.10 0.01 0.00 0.00 0.00 0.00 31.60 31.50 1sjc h MET 98 CO -0.06 0.29 -0.31 0.00 0.00 0.00 0.00 176.91 176.83 1sjc h ALA 99 N 1.22 -0.86 -1.00 6.32 0.00 -1.81 -1.96 119.26 121.16 1sjc h ALA 99 Ca 0.18 -0.19 0.23 0.00 0.00 0.00 0.00 54.91 55.12 1sjc h ALA 99 Cb 0.07 0.33 -0.10 0.00 0.00 0.00 0.00 17.79 18.09 1sjc h ALA 99 CO -0.12 -0.98 0.62 0.87 0.00 0.00 0.00 179.25 179.65 1sjc h LYS 100 N -0.88 0.56 -0.38 0.00 1.57 -0.59 -1.60 116.57 115.25 1sjc h LYS 100 Ca -0.09 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.56 1sjc h LYS 100 Cb 0.67 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.84 1sjc h LYS 100 CO 0.15 0.37 -0.16 0.78 -0.57 0.00 0.00 179.45 180.02 1sjc h GLY 101 N 0.58 0.75 0.78 3.86 0.00 -0.40 -1.83 103.07 106.81 1sjc h GLY 101 Ca 0.59 -0.59 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1sjc h GLY 101 CO -0.36 0.54 -0.00 0.00 0.00 0.00 0.00 176.54 176.72 1sjc h ALA 102 N 1.20 0.20 -0.37 3.60 0.00 -0.56 -1.72 119.26 121.61 1sjc h ALA 102 Ca 0.10 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1sjc h ALA 102 Cb 0.62 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1sjc h ALA 102 CO 0.04 -0.10 0.13 1.25 0.00 0.00 0.00 179.25 180.57 1sjc h LEU 103 N -0.00 0.53 -1.47 0.00 5.85 -1.31 0.01 115.31 118.93 1sjc h LEU 103 Ca 0.04 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 1sjc h LEU 103 Cb 0.38 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1sjc h LEU 103 CO 0.01 0.59 0.19 -0.08 -0.34 0.00 0.00 178.44 178.81 1sjc h GLU 104 N 0.45 0.55 -0.31 1.25 4.81 -1.32 0.10 114.58 120.11 1sjc h GLU 104 Ca 0.12 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 1sjc h GLU 104 Cb 0.24 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 1sjc h GLU 104 CO -0.01 0.43 0.12 1.98 -0.73 0.00 0.00 179.01 180.80 1sjc h MET 105 N 0.56 0.48 0.04 1.92 4.05 -0.34 0.29 114.93 121.93 1sjc h MET 105 Ca 0.14 -0.09 0.01 0.00 -0.28 0.00 0.00 59.70 59.48 1sjc h MET 105 Cb 0.06 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 30.77 1sjc h MET 105 CO -0.02 0.50 -0.12 0.00 0.23 0.00 0.00 176.91 177.50 1sjc h ALA 106 N 0.96 -0.16 -0.35 0.39 0.00 0.15 0.19 119.26 120.43 1sjc h ALA 106 Ca 0.10 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.05 1sjc h ALA 106 Cb 0.21 0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1sjc h ALA 106 CO -0.01 -0.62 0.10 0.28 0.00 0.00 0.00 179.25 179.00 1sjc h VAL 107 N -0.22 0.87 -0.14 0.00 2.07 -0.71 -2.61 116.25 115.52 1sjc h VAL 107 Ca 0.03 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 1sjc h VAL 107 Cb 0.25 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1sjc h VAL 107 CO -0.09 0.04 0.06 0.25 0.02 0.00 0.00 177.57 177.85 1sjc h LEU 108 N 0.23 0.19 -0.87 2.57 5.85 -0.58 -0.96 115.31 121.75 1sjc h LEU 108 Ca 0.16 -0.15 0.11 0.00 0.84 0.00 0.00 57.88 58.84 1sjc h LEU 108 Cb 0.16 -0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.06 1sjc h LEU 108 CO -0.19 0.29 0.51 -0.78 -0.34 0.00 0.00 178.44 177.93 1sjc h ASP 109 N 0.08 0.72 0.42 1.25 3.58 -0.45 0.11 116.42 122.12 1sjc h ASP 109 Ca 0.05 0.05 -0.02 0.00 0.42 0.00 0.00 57.03 57.53 1sjc h ASP 109 Cb 0.15 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.12 1sjc h ASP 109 CO -0.00 0.39 -0.21 0.00 -2.88 0.00 0.00 179.24 176.53 1sjc h ALA 110 N 1.49 -1.13 -0.94 -0.78 0.00 -1.09 -1.22 119.26 115.59 1sjc h ALA 110 Ca 0.43 -0.12 0.28 0.00 0.00 0.00 0.00 54.91 55.49 1sjc h ALA 110 Cb 0.43 0.25 -0.16 0.00 0.00 0.00 0.00 17.79 18.31 1sjc h ALA 110 CO -0.27 -1.10 0.24 1.49 0.00 0.00 0.00 179.25 179.62 1sjc h GLU 111 N -0.57 0.12 -0.03 0.00 4.81 -0.86 -0.59 114.58 117.45 1sjc h GLU 111 Ca -0.06 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.12 1sjc h GLU 111 Cb 0.45 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.80 1sjc h GLU 111 CO 0.09 0.08 -0.17 -0.07 -0.73 0.00 0.00 179.01 178.20 1sjc h LEU 112 N 0.12 0.20 -1.78 1.64 3.38 -0.71 -2.52 115.31 115.65 1sjc h LEU 112 Ca 0.62 -0.68 0.25 0.00 0.09 0.00 0.00 57.88 58.17 1sjc h LEU 112 Cb 1.36 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.99 1sjc h LEU 112 CO -0.75 0.85 0.66 0.03 0.09 0.00 0.00 178.44 179.31 1sjc h ARG 113 N -0.43 0.16 -0.00 1.13 3.08 -0.11 0.48 114.38 118.68 1sjc h ARG 113 Ca -0.01 -0.01 -0.14 0.00 0.07 0.00 0.00 59.98 59.89 1sjc h ARG 113 Cb 0.85 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 1sjc h ARG 113 CO 0.04 0.11 -0.64 0.00 -1.07 0.00 0.00 179.97 178.40 1sjc h ALA 114 N 1.56 0.94 -0.68 0.04 0.00 -1.02 -2.68 119.26 117.43 1sjc h ALA 114 Ca 0.48 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1sjc h ALA 114 Cb 1.59 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.28 1sjc h ALA 114 CO -0.09 0.80 0.00 0.72 0.00 0.00 0.00 179.25 180.68 1sjc n HIS 115 N -3.78 1.20 -3.87 0.00 8.25 0.14 -4.92 115.22 112.25 1sjc n HIS 115 Ca -0.01 -0.56 -0.24 0.00 -0.26 0.00 0.00 57.72 56.65 1sjc n HIS 115 Cb 0.64 -0.12 -0.00 0.00 1.12 0.00 0.00 29.99 31.62 1sjc n HIS 115 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1sjc n GLU 116 N 1.34 -3.65 -4.60 -0.41 1.02 0.39 -4.97 120.64 109.75 1sjc n GLU 116 Ca 0.25 0.47 -0.23 0.00 -0.02 0.00 0.00 57.16 57.62 1sjc n GLU 116 Cb 0.75 -4.69 -0.16 0.00 -0.02 0.00 0.00 31.44 27.32 1sjc n GLU 116 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1sjc s ARG 117 N -6.36 1.32 0.65 3.49 3.52 0.39 -4.82 118.95 117.13 1sjc s ARG 117 Ca 0.02 -0.45 -0.12 0.00 -0.13 0.00 0.00 55.73 55.05 1sjc s ARG 117 Cb -0.01 -1.19 -0.02 0.00 -1.56 0.00 0.00 34.95 32.17 1sjc s ARG 117 CO 0.87 0.18 1.05 -1.54 -0.81 0.00 0.00 175.30 175.05 1sjc s SER 118 N 0.08 5.75 0.09 -2.12 1.04 -1.26 0.70 113.70 117.99 1sjc s SER 118 Ca -0.03 1.59 -0.23 0.00 0.48 0.00 0.00 55.95 57.77 1sjc s SER 118 Cb -0.10 -2.50 -0.14 0.00 0.10 0.00 0.00 66.02 63.39 1sjc s SER 118 CO 0.01 -1.19 1.73 -0.26 0.98 0.00 0.00 173.24 174.51 1sjc h PHE 119 N -0.31 -0.05 -0.57 5.02 -1.00 -1.10 -1.93 116.94 117.01 1sjc h PHE 119 Ca -0.45 0.00 0.11 0.00 2.81 0.00 0.00 57.97 60.45 1sjc h PHE 119 Cb 1.20 0.02 -0.03 0.00 3.61 0.00 0.00 35.95 40.75 1sjc h PHE 119 CO 0.63 -0.03 0.39 0.00 -1.61 0.00 0.00 178.31 177.68 1sjc h ALA 120 N 0.94 2.13 0.11 2.45 0.00 -1.86 1.00 119.26 124.03 1sjc h ALA 120 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1sjc h ALA 120 Cb 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1sjc h ALA 120 CO -0.01 -0.27 -0.05 0.00 0.00 0.00 0.00 179.25 178.92 1sjc h ALA 121 N 1.72 -0.15 -0.47 0.00 0.00 -1.75 -0.83 119.26 117.79 1sjc h ALA 121 Ca 0.27 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1sjc h ALA 121 Cb 0.65 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1sjc h ALA 121 CO -0.06 -0.41 0.31 1.49 0.00 0.00 0.00 179.25 180.57 1sjc h GLU 122 N -0.49 0.60 0.00 0.00 4.57 -0.66 -2.40 114.58 116.21 1sjc h GLU 122 Ca -0.01 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 1sjc h GLU 122 Cb 0.40 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.85 1sjc h GLU 122 CO 0.02 0.40 0.00 1.28 -1.18 0.00 0.00 179.01 179.53 1sjc n LEU 123 N -4.77 0.70 -0.17 1.64 4.77 0.27 -4.91 117.00 114.53 1sjc n LEU 123 Ca 0.02 0.68 0.00 0.00 -0.03 0.00 0.00 56.01 56.68 1sjc n LEU 123 Cb 0.03 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 40.52 1sjc n LEU 123 CO 0.34 -0.60 0.00 0.61 -1.33 0.00 0.00 177.39 176.41 1sjc n GLY 124 N -0.07 1.03 3.63 -0.72 0.00 -0.90 -4.98 105.19 103.18 1sjc n GLY 124 Ca 0.02 -0.41 -0.33 0.00 0.00 0.00 0.00 46.02 45.30 1sjc n GLY 124 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1sjc n SER 125 N 0.90 0.29 0.00 1.61 2.88 -0.35 -4.62 113.62 114.33 1sjc n SER 125 Ca 0.00 0.53 0.00 0.00 -1.33 0.00 0.00 58.87 58.07 1sjc n SER 125 Cb 0.27 -1.44 0.00 0.00 -0.75 0.00 0.00 64.21 62.29 1sjc n SER 125 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1sjc n VAL 126 N -3.41 0.00 -4.67 2.46 0.24 -1.07 -4.99 118.33 106.89 1sjc n VAL 126 Ca 0.12 -0.25 -0.30 0.00 -2.04 0.00 0.00 64.34 61.87 1sjc n VAL 126 Cb 0.51 1.05 -0.08 0.00 -1.47 0.00 0.00 33.84 33.85 1sjc n VAL 126 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1sjc s ARG 127 N -0.46 2.07 -0.00 7.34 0.52 -1.24 -5.05 118.95 122.13 1sjc s ARG 127 Ca 0.00 -2.29 0.04 0.00 -0.52 0.00 0.00 55.73 52.96 1sjc s ARG 127 Cb 0.00 -1.29 -0.05 0.00 0.52 0.00 0.00 34.95 34.13 1sjc s ARG 127 CO 0.00 -0.34 0.11 -0.40 0.02 0.00 0.00 175.30 174.69 1sjc n ASP 128 N -1.21 2.45 -3.82 0.23 5.75 -1.26 -4.95 116.55 113.74 1sjc n ASP 128 Ca -0.13 -0.25 -0.10 0.00 -0.01 0.00 0.00 54.79 54.30 1sjc n ASP 128 Cb 0.66 1.10 -0.07 0.00 -1.03 0.00 0.00 41.12 41.78 1sjc n ASP 128 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1sjc s SER 129 N -1.96 0.03 0.01 -1.12 1.04 -1.26 -0.21 113.70 110.23 1sjc s SER 129 Ca -0.00 -0.48 0.01 0.00 0.48 0.00 0.00 55.95 55.96 1sjc s SER 129 Cb 0.02 0.34 -0.01 0.00 0.10 0.00 0.00 66.02 66.48 1sjc s SER 129 CO 0.15 -0.68 -0.04 0.68 0.98 0.00 0.00 173.24 174.33 1sjc s VAL 130 N -3.33 0.26 0.03 5.02 -7.23 -0.18 -4.91 120.40 110.07 1sjc s VAL 130 Ca 0.01 -0.32 -0.30 0.00 -1.81 0.00 0.00 61.98 59.56 1sjc s VAL 130 Cb 0.02 -0.26 -0.04 0.00 0.56 0.00 0.00 36.38 36.66 1sjc s VAL 130 CO -0.08 -0.04 1.07 -2.16 -0.31 0.00 0.00 175.10 173.58 1sjc s PRO 131 N -0.38 4.51 -0.01 4.82 0.04 -1.26 -0.66 135.00 142.06 1sjc s PRO 131 Ca -0.02 1.57 -0.00 0.00 0.04 0.00 0.00 61.00 62.59 1sjc s PRO 131 Cb -0.03 -3.41 -0.04 0.00 0.04 0.00 0.00 34.50 31.06 1sjc s PRO 131 CO -0.00 -0.13 0.05 0.00 0.04 0.00 0.00 177.00 176.96 1sjc n GLY 133 N 1.35 3.07 3.01 0.00 0.00 -0.64 -1.30 105.19 110.68 1sjc n GLY 133 Ca -0.14 -2.32 -0.12 0.00 0.00 0.00 0.00 46.02 43.44 1sjc n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sjc s VAL 134 N -2.63 0.35 -0.36 1.61 0.11 0.17 -3.75 120.40 115.89 1sjc s VAL 134 Ca 0.19 -0.82 -0.13 0.00 -2.93 0.00 0.00 61.98 58.28 1sjc s VAL 134 Cb -0.01 -0.42 0.00 0.00 -1.53 0.00 0.00 36.38 34.42 1sjc s VAL 134 CO 0.12 -0.32 0.25 -0.55 -3.33 0.00 0.00 175.10 171.27 1sjc s SER 135 N -1.21 5.97 -0.21 3.54 0.15 -1.26 -0.66 113.70 120.02 1sjc s SER 135 Ca -0.09 -0.67 -0.12 0.00 0.70 0.00 0.00 55.95 55.77 1sjc s SER 135 Cb -0.08 -2.11 -0.05 0.00 -1.71 0.00 0.00 66.02 62.07 1sjc s SER 135 CO -0.00 -0.32 0.21 -0.69 1.20 0.00 0.00 173.24 173.64 1sjc s VAL 136 N 1.67 5.34 0.74 4.45 1.01 0.47 -4.97 120.40 129.11 1sjc s VAL 136 Ca 0.05 0.32 -0.12 0.00 0.00 0.00 0.00 61.98 62.23 1sjc s VAL 136 Cb -0.18 -3.55 0.18 0.00 0.00 0.00 0.00 36.38 32.83 1sjc s VAL 136 CO 0.09 0.36 0.80 0.61 0.00 0.00 0.00 175.10 176.96 1sjc n GLY 137 N 3.91 -2.05 3.73 4.51 0.00 -1.26 -0.70 105.19 113.33 1sjc n GLY 137 Ca -0.14 -1.58 -0.41 0.00 0.00 0.00 0.00 46.02 43.89 1sjc n GLY 137 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sjc s ILE 138 N -2.60 4.68 0.42 -0.61 1.01 0.14 -4.47 121.20 119.77 1sjc s ILE 138 Ca 0.48 1.91 0.08 0.00 0.00 0.00 0.00 60.65 63.12 1sjc s ILE 138 Cb -0.03 -4.25 -0.00 0.00 0.01 0.00 0.00 42.46 38.19 1sjc s ILE 138 CO 0.36 0.29 0.49 -0.04 0.00 0.00 0.00 174.94 176.04 1sjc s MET 139 N 0.26 2.68 -0.01 2.79 -1.94 -1.26 -4.59 119.30 117.23 1sjc s MET 139 Ca 0.45 -1.38 0.07 0.00 -1.71 0.00 0.00 55.69 53.12 1sjc s MET 139 Cb -0.22 -2.59 -0.24 0.00 2.01 0.00 0.00 34.83 33.80 1sjc s MET 139 CO 0.27 -0.25 0.79 -0.44 -0.01 0.00 0.00 175.02 175.37 1sjc h ASP 140 N 0.80 0.11 -4.23 3.03 3.32 -1.97 -3.47 116.42 114.01 1sjc h ASP 140 Ca -0.40 -0.19 -0.39 0.00 0.02 0.00 0.00 57.03 56.07 1sjc h ASP 140 Cb 1.27 -0.04 -0.19 0.00 0.22 0.00 0.00 39.33 40.60 1sjc h ASP 140 CO 0.50 1.16 -0.76 0.42 -1.72 0.00 0.00 179.24 178.85 1sjc s THR 141 N -2.62 1.19 0.02 0.35 -4.23 -1.26 -5.04 115.64 104.06 1sjc s THR 141 Ca -0.06 -1.60 -0.25 0.00 -1.18 0.00 0.00 61.69 58.60 1sjc s THR 141 Cb 0.08 -1.38 -0.17 0.00 1.34 0.00 0.00 72.50 72.37 1sjc s THR 141 CO 0.82 -0.40 1.40 0.40 -0.54 0.00 0.00 174.62 176.31 1sjc h ILE 142 N 3.72 0.94 -0.32 2.99 2.04 -1.99 0.24 117.51 125.15 1sjc h ILE 142 Ca -0.40 -0.56 0.07 0.00 1.00 0.00 0.00 64.86 64.98 1sjc h ILE 142 Cb 1.19 1.28 -0.08 0.00 -0.74 0.00 0.00 36.82 38.48 1sjc h ILE 142 CO 0.48 0.13 -0.21 -0.65 0.00 0.00 0.00 178.15 177.90 1sjc h PRO 143 N -0.50 -0.17 -0.81 2.37 0.11 -1.98 0.49 132.00 131.51 1sjc h PRO 143 Ca -0.02 0.01 0.15 0.00 0.11 0.00 0.00 66.00 66.25 1sjc h PRO 143 Cb 0.38 0.04 -0.15 0.00 0.11 0.00 0.00 31.00 31.38 1sjc h PRO 143 CO 0.04 -0.11 -0.28 0.37 -0.21 0.00 0.00 178.00 177.81 1sjc h GLN 144 N -0.18 -0.04 0.34 1.05 4.15 -1.90 0.12 115.11 118.65 1sjc h GLN 144 Ca 0.16 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.58 1sjc h GLN 144 Cb 0.43 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.10 1sjc h GLN 144 CO -0.42 -0.03 -0.42 1.25 -1.93 0.00 0.00 178.83 177.28 1sjc h LEU 145 N -0.04 -1.17 -0.97 -2.39 5.85 0.31 -2.77 115.31 114.13 1sjc h LEU 145 Ca 0.35 0.10 0.25 0.00 0.84 0.00 0.00 57.88 59.42 1sjc h LEU 145 Cb 0.59 0.40 -0.13 0.00 0.37 0.00 0.00 40.66 41.89 1sjc h LEU 145 CO -0.84 -0.52 0.52 -0.07 -0.34 0.00 0.00 178.44 177.19 1sjc h LEU 146 N -0.77 0.53 0.08 2.25 3.38 0.21 0.19 115.31 121.17 1sjc h LEU 146 Ca -0.04 0.15 0.01 0.00 0.09 0.00 0.00 57.88 58.09 1sjc h LEU 146 Cb 0.69 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 1sjc h LEU 146 CO -0.09 0.02 -0.10 0.44 0.09 0.00 0.00 178.44 178.80 1sjc h ASP 147 N 0.47 -0.27 -0.39 -0.43 3.32 -0.70 -1.20 116.42 117.23 1sjc h ASP 147 Ca 0.63 0.03 0.08 0.00 0.02 0.00 0.00 57.03 57.79 1sjc h ASP 147 Cb 1.25 0.10 -0.09 0.00 0.22 0.00 0.00 39.33 40.81 1sjc h ASP 147 CO -0.52 -0.15 -0.21 0.58 -1.72 0.00 0.00 179.24 177.22 1sjc h VAL 148 N -0.21 0.41 0.70 -1.35 2.07 -0.48 0.92 116.25 118.30 1sjc h VAL 148 Ca 0.01 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 1sjc h VAL 148 Cb 0.22 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 1sjc h VAL 148 CO -0.05 0.00 -0.46 0.58 0.02 0.00 0.00 177.57 177.67 1sjc h VAL 149 N -0.14 0.00 -0.86 2.57 2.07 -0.74 -1.49 116.25 117.66 1sjc h VAL 149 Ca 0.19 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.93 1sjc h VAL 149 Cb 0.43 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.06 1sjc h VAL 149 CO -0.47 0.00 0.14 1.23 0.02 0.00 0.00 177.57 178.49 1sjc h GLY 150 N -1.09 1.21 -0.20 2.17 0.00 -0.65 0.38 103.07 104.89 1sjc h GLY 150 Ca -0.09 0.03 0.07 0.00 0.00 0.00 0.00 47.33 47.34 1sjc h GLY 150 CO 0.08 -0.37 -0.40 -1.33 0.00 0.00 0.00 176.54 174.51 1sjc h GLY 151 N 0.15 -0.52 1.24 4.60 0.00 0.15 -0.41 103.07 108.28 1sjc h GLY 151 Ca 0.52 0.51 -0.03 0.00 0.00 0.00 0.00 47.33 48.33 1sjc h GLY 151 CO -0.70 -0.20 0.27 -0.97 0.00 0.00 0.00 176.54 174.95 1sjc h TYR 152 N -0.35 0.97 -0.77 5.60 -1.99 0.64 -2.42 116.97 118.66 1sjc h TYR 152 Ca 0.13 -0.06 0.10 0.00 2.00 0.00 0.00 58.73 60.91 1sjc h TYR 152 Cb 0.58 -0.30 -0.08 0.00 2.00 0.00 0.00 36.73 38.94 1sjc h TYR 152 CO -0.57 0.74 0.40 -0.07 -0.00 0.00 0.00 178.16 178.66 1sjc h LEU 153 N 0.95 0.53 -0.77 3.88 3.38 0.62 -1.56 115.31 122.34 1sjc h LEU 153 Ca 0.23 0.06 -0.12 0.00 0.09 0.00 0.00 57.88 58.13 1sjc h LEU 153 Cb 0.17 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1sjc h LEU 153 CO -0.02 0.29 -0.42 0.44 0.09 0.00 0.00 178.44 178.82 1sjc h ASP 154 N 0.66 0.46 -0.02 -0.43 3.32 -0.69 -2.74 116.42 116.98 1sjc h ASP 154 Ca 0.38 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 57.24 1sjc h ASP 154 Cb 0.42 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 1sjc h ASP 154 CO -0.28 0.82 0.03 -0.33 -1.72 0.00 0.00 179.24 177.76 1sjc h GLU 155 N 0.36 0.00 0.00 3.56 5.08 -0.89 -3.45 114.58 119.24 1sjc h GLU 155 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1sjc h GLU 155 Cb 0.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1sjc h GLU 155 CO 0.07 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.49 1sjc n GLY 156 N -1.22 1.03 3.68 -3.84 0.00 -1.03 -4.77 105.19 99.04 1sjc n GLY 156 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1sjc n GLY 156 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1sjc s TYR 157 N -2.00 1.83 0.31 1.61 1.51 -0.80 -3.61 117.35 116.19 1sjc s TYR 157 Ca 0.00 -0.20 0.07 0.00 -1.01 0.00 0.00 57.07 55.93 1sjc s TYR 157 Cb 0.00 -4.22 0.50 0.00 -0.11 0.00 0.00 41.96 38.13 1sjc s TYR 157 CO 0.00 -5.18 1.73 0.28 -1.11 0.00 0.00 175.55 171.28 1sjc h VAL 158 N 5.01 1.29 -3.52 0.71 2.07 -1.46 -3.43 116.25 116.90 1sjc h VAL 158 Ca -0.47 -1.39 -0.14 0.00 0.82 0.00 0.00 66.70 65.52 1sjc h VAL 158 Cb 1.23 1.59 -0.20 0.00 -1.52 0.00 0.00 31.29 32.38 1sjc h VAL 158 CO 0.95 0.42 -0.47 -0.60 0.02 0.00 0.00 177.57 177.88 1sjc s ARG 159 N -4.26 0.53 -0.14 1.57 3.52 -1.23 -4.47 118.95 114.47 1sjc s ARG 159 Ca -0.05 -0.46 -0.01 0.00 -0.13 0.00 0.00 55.73 55.09 1sjc s ARG 159 Cb 0.14 0.22 -0.01 0.00 -1.56 0.00 0.00 34.95 33.73 1sjc s ARG 159 CO 0.77 -0.13 -0.12 0.42 -0.81 0.00 0.00 175.30 175.43 1sjc s ILE 160 N -1.65 3.09 -0.16 4.11 1.01 0.53 -0.66 121.20 127.46 1sjc s ILE 160 Ca -0.13 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 59.90 1sjc s ILE 160 Cb -0.06 -2.31 0.02 0.00 0.01 0.00 0.00 42.46 40.11 1sjc s ILE 160 CO 0.00 0.51 -0.20 -0.75 0.00 0.00 0.00 174.94 174.50 1sjc s LYS 161 N 0.51 3.01 -0.22 2.79 2.20 0.16 -1.74 119.74 126.46 1sjc s LYS 161 Ca -0.08 -0.83 -0.08 0.00 -0.36 0.00 0.00 55.97 54.61 1sjc s LYS 161 Cb -0.16 -2.53 -0.04 0.00 -1.51 0.00 0.00 37.83 33.60 1sjc s LYS 161 CO 0.04 -0.13 0.10 -0.51 -0.36 0.00 0.00 175.35 174.49 1sjc s LEU 162 N 1.10 3.83 -0.02 5.43 1.43 -0.20 0.18 118.68 130.43 1sjc s LEU 162 Ca 0.00 0.02 -0.30 0.00 -1.03 0.00 0.00 54.13 52.83 1sjc s LEU 162 Cb -0.14 -2.00 -0.04 0.00 0.03 0.00 0.00 46.19 44.04 1sjc s LEU 162 CO -0.08 0.09 1.15 -0.54 0.23 0.00 0.00 176.35 177.19 1sjc s LYS 163 N 0.90 4.41 0.28 1.70 -0.14 0.13 -0.76 119.74 126.26 1sjc s LYS 163 Ca 0.05 1.63 0.11 0.00 -1.36 0.00 0.00 55.97 56.40 1sjc s LYS 163 Cb -0.13 -3.48 -0.05 0.00 -1.68 0.00 0.00 37.83 32.48 1sjc s LYS 163 CO 0.03 -0.32 -0.14 0.96 -0.76 0.00 0.00 175.35 175.12 1sjc s ILE 164 N 1.69 2.69 0.25 2.17 -4.36 -0.54 -4.36 121.20 118.74 1sjc s ILE 164 Ca 0.55 -2.26 -0.09 0.00 -0.26 0.00 0.00 60.65 58.59 1sjc s ILE 164 Cb -0.25 -2.47 -0.01 0.00 1.25 0.00 0.00 42.46 40.98 1sjc s ILE 164 CO 0.24 -0.37 0.41 -0.70 0.24 0.00 0.00 174.94 174.77 1sjc s GLU 165 N -3.57 1.54 0.02 0.37 2.12 -1.13 -4.37 118.70 113.68 1sjc s GLU 165 Ca 0.31 -1.39 -0.30 0.00 0.36 0.00 0.00 54.97 53.94 1sjc s GLU 165 Cb -0.05 0.43 -0.04 0.00 0.26 0.00 0.00 34.13 34.73 1sjc s GLU 165 CO 0.16 -0.62 1.14 -2.14 -0.54 0.00 0.00 175.26 173.26 1sjc s PRO 166 N -3.90 4.45 0.00 4.30 0.02 -1.26 -2.04 135.00 136.57 1sjc s PRO 166 Ca 0.27 1.65 0.00 0.00 0.02 0.00 0.00 61.00 62.93 1sjc s PRO 166 Cb 0.01 -3.43 0.00 0.00 0.02 0.00 0.00 34.50 31.10 1sjc s PRO 166 CO 0.11 -0.25 0.00 0.41 -0.33 0.00 0.00 177.00 176.94 1sjc n GLY 167 N 3.16 0.32 2.35 0.52 0.00 -1.26 -4.94 105.19 105.34 1sjc n GLY 167 Ca 0.09 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.95 1sjc n GLY 167 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1sjc n TRP 168 N -1.81 -0.60 0.00 1.61 -0.00 -0.86 -5.04 117.44 110.75 1sjc n TRP 168 Ca 0.00 -3.34 0.00 0.00 -0.00 0.00 0.00 57.50 54.16 1sjc n TRP 168 Cb 0.00 0.12 0.00 0.00 -0.00 0.00 0.00 31.31 31.43 1sjc n TRP 168 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 177.69 177.29 1sjc n ASP 169 N 0.28 0.00 -0.12 5.87 5.75 -1.24 -2.85 116.55 124.24 1sjc n ASP 169 Ca 0.19 0.00 -0.05 0.00 -0.01 0.00 0.00 54.79 54.93 1sjc n ASP 169 Cb 0.68 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.78 1sjc n ASP 169 CO 0.00 0.00 0.00 0.58 -0.11 0.00 0.00 177.20 177.67 1sjc h VAL 170 N 0.00 0.51 0.79 2.12 2.07 -1.92 -2.38 116.25 117.44 1sjc h VAL 170 Ca 0.00 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 1sjc h VAL 170 Cb 0.00 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1sjc h VAL 170 CO 0.00 0.00 -0.45 -0.33 0.02 0.00 0.00 177.57 176.81 1sjc h GLU 171 N -0.05 -1.11 -1.01 1.57 3.07 -1.96 1.23 114.58 116.32 1sjc h GLU 171 Ca 0.20 0.08 0.25 0.00 -0.50 0.00 0.00 59.36 59.39 1sjc h GLU 171 Cb 0.36 0.25 -0.08 0.00 -0.84 0.00 0.00 28.75 28.44 1sjc h GLU 171 CO -0.46 -0.74 0.66 -1.35 -1.40 0.00 0.00 179.01 175.72 1sjc h PRO 172 N -1.15 0.37 -0.02 2.33 0.10 -1.89 0.87 132.00 132.62 1sjc h PRO 172 Ca -0.11 -0.02 -0.03 0.00 0.10 0.00 0.00 66.00 65.95 1sjc h PRO 172 Cb 0.91 -0.08 0.00 0.00 0.10 0.00 0.00 31.00 31.93 1sjc h PRO 172 CO 0.13 0.25 -0.09 0.28 0.10 0.00 0.00 178.00 178.66 1sjc h VAL 173 N 0.38 1.51 -0.64 3.15 2.07 -0.86 -2.17 116.25 119.70 1sjc h VAL 173 Ca 0.56 -1.64 0.13 0.00 0.82 0.00 0.00 66.70 66.57 1sjc h VAL 173 Cb 1.44 2.56 -0.11 0.00 -1.52 0.00 0.00 31.29 33.66 1sjc h VAL 173 CO -0.24 0.44 0.01 -0.09 0.02 0.00 0.00 177.57 177.71 1sjc h ARG 174 N -0.54 0.12 0.37 1.57 9.65 0.45 -0.98 114.38 125.03 1sjc h ARG 174 Ca -0.01 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 58.86 1sjc h ARG 174 Cb 0.77 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 29.29 1sjc h ARG 174 CO 0.02 0.08 -0.48 0.00 2.80 0.00 0.00 179.97 182.39 1sjc h ALA 175 N 1.58 -1.03 -0.55 2.80 0.00 0.65 -0.95 119.26 121.76 1sjc h ALA 175 Ca 0.34 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 1sjc h ALA 175 Cb 0.55 0.74 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 1sjc h ALA 175 CO -0.54 -1.13 0.22 0.28 0.00 0.00 0.00 179.25 178.08 1sjc h VAL 176 N -0.89 1.20 0.88 0.00 2.07 -0.86 -0.01 116.25 118.63 1sjc h VAL 176 Ca -0.04 -0.64 -0.04 0.00 0.82 0.00 0.00 66.70 66.80 1sjc h VAL 176 Cb 0.81 0.55 0.01 0.00 -1.52 0.00 0.00 31.29 31.14 1sjc h VAL 176 CO -0.13 0.25 -0.42 0.03 0.02 0.00 0.00 177.57 177.32 1sjc h ARG 177 N 0.79 -1.14 -0.14 1.57 2.47 -1.10 0.21 114.38 117.04 1sjc h ARG 177 Ca 0.19 0.08 0.04 0.00 -1.26 0.00 0.00 59.98 59.03 1sjc h ARG 177 Cb 0.17 0.26 -0.07 0.00 -1.65 0.00 0.00 29.97 28.68 1sjc h ARG 177 CO -0.02 -0.76 -0.40 0.93 0.56 0.00 0.00 179.97 180.28 1sjc h GLU 178 N -1.30 -0.45 -0.27 0.04 5.08 -0.99 1.34 114.58 118.03 1sjc h GLU 178 Ca -0.12 0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.20 1sjc h GLU 178 Cb 0.91 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 1sjc h GLU 178 CO 0.20 -0.30 -0.10 -0.09 -1.00 0.00 0.00 179.01 177.71 1sjc h ARG 179 N -0.47 0.54 0.00 2.33 9.65 -1.04 -3.34 114.38 122.05 1sjc h ARG 179 Ca 0.08 -0.23 -0.03 0.00 -1.10 0.00 0.00 59.98 58.71 1sjc h ARG 179 Cb 0.61 -0.02 -0.00 0.00 -1.39 0.00 0.00 29.97 29.17 1sjc h ARG 179 CO -0.40 0.78 -1.36 1.19 2.80 0.00 0.00 179.97 182.98 1sjc n PHE 180 N -4.48 0.68 0.00 2.20 3.01 0.72 -5.08 117.46 114.51 1sjc n PHE 180 Ca -0.04 0.20 0.00 0.00 1.01 0.00 0.00 57.45 58.63 1sjc n PHE 180 Cb 0.34 -0.85 0.00 0.00 -0.01 0.00 0.00 39.48 38.96 1sjc n PHE 180 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1sjc n GLY 181 N 1.24 1.49 0.01 1.37 0.00 0.46 -4.72 105.19 105.03 1sjc n GLY 181 Ca -0.03 -2.13 0.12 0.00 0.00 0.00 0.00 46.02 43.98 1sjc n GLY 181 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sjc n ASP 182 N 0.00 0.48 -0.87 1.61 9.92 -1.26 -4.01 116.55 122.42 1sjc n ASP 182 Ca 0.00 -0.14 0.12 0.00 -0.53 0.00 0.00 54.79 54.24 1sjc n ASP 182 Cb 0.00 0.18 0.21 0.00 -0.64 0.00 0.00 41.12 40.87 1sjc n ASP 182 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1sjc n ASP 183 N -1.57 2.71 -4.77 -2.24 8.00 -1.26 -4.90 116.55 112.52 1sjc n ASP 183 Ca 0.05 -1.89 -0.38 0.00 0.71 0.00 0.00 54.79 53.28 1sjc n ASP 183 Cb 0.35 -0.03 -0.05 0.00 -0.02 0.00 0.00 41.12 41.37 1sjc n ASP 183 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1sjc s VAL 184 N -1.94 3.77 -0.60 2.53 1.01 -1.26 -4.96 120.40 118.96 1sjc s VAL 184 Ca 0.31 1.55 -0.25 0.00 0.00 0.00 0.00 61.98 63.59 1sjc s VAL 184 Cb 0.20 -3.89 0.04 0.00 0.00 0.00 0.00 36.38 32.73 1sjc s VAL 184 CO 0.31 0.20 1.03 -0.76 0.00 0.00 0.00 175.10 175.88 1sjc s LEU 185 N -2.00 3.91 -0.04 3.92 1.43 -1.26 -4.99 118.68 119.65 1sjc s LEU 185 Ca 0.50 -0.38 0.06 0.00 -1.03 0.00 0.00 54.13 53.28 1sjc s LEU 185 Cb -0.25 -2.79 -0.01 0.00 0.03 0.00 0.00 46.19 43.17 1sjc s LEU 185 CO 0.32 -1.38 -0.23 -0.22 0.23 0.00 0.00 176.35 175.06 1sjc s LEU 186 N 4.37 2.03 0.12 1.79 2.96 -1.26 0.20 118.68 128.90 1sjc s LEU 186 Ca 0.32 -0.44 -0.13 0.00 -0.22 0.00 0.00 54.13 53.65 1sjc s LEU 186 Cb -0.12 -1.23 0.02 0.00 0.50 0.00 0.00 46.19 45.36 1sjc s LEU 186 CO 0.18 0.24 0.33 0.00 -1.32 0.00 0.00 176.35 175.79 1sjc s GLN 187 N -0.28 1.03 0.32 1.98 -2.07 -0.71 0.81 119.66 120.73 1sjc s GLN 187 Ca 0.02 -0.85 0.10 0.00 -1.82 0.00 0.00 55.36 52.80 1sjc s GLN 187 Cb -0.11 0.42 -0.06 0.00 -1.09 0.00 0.00 33.01 32.17 1sjc s GLN 187 CO 0.01 -0.38 -0.12 0.14 -1.32 0.00 0.00 175.29 173.62 1sjc s VAL 188 N -3.84 2.22 -0.16 3.63 -7.23 -0.78 -1.03 120.40 113.21 1sjc s VAL 188 Ca 0.05 -2.25 -0.05 0.00 -1.81 0.00 0.00 61.98 57.93 1sjc s VAL 188 Cb 0.03 -2.52 0.06 0.00 0.56 0.00 0.00 36.38 34.50 1sjc s VAL 188 CO -0.10 -0.27 0.09 -0.62 -0.31 0.00 0.00 175.10 173.89 1sjc s ASP 189 N -3.56 2.21 0.00 4.85 -1.08 0.06 -1.98 116.67 117.17 1sjc s ASP 189 Ca 0.31 -0.54 0.26 0.00 -0.52 0.00 0.00 52.55 52.06 1sjc s ASP 189 Cb 0.01 -0.21 0.95 0.00 -1.46 0.00 0.00 42.92 42.21 1sjc s ASP 189 CO 0.15 -0.34 1.68 0.00 0.52 0.00 0.00 175.17 177.18 1sjc n ALA 190 N 5.28 2.56 -3.81 3.66 0.00 -0.21 -1.47 120.51 126.51 1sjc n ALA 190 Ca -0.07 -0.47 -0.23 0.00 0.00 0.00 0.00 53.44 52.67 1sjc n ALA 190 Cb 0.49 -1.14 -0.07 0.00 0.00 0.00 0.00 19.45 18.73 1sjc n ALA 190 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1sjc n ASN 191 N 0.23 0.53 0.00 0.00 4.13 -1.21 0.27 115.26 119.20 1sjc n ASN 191 Ca 0.18 -0.93 0.00 0.00 1.68 0.00 0.00 54.58 55.51 1sjc n ASN 191 Cb 0.35 -1.15 0.00 0.00 -1.54 0.00 0.00 39.78 37.43 1sjc n ASN 191 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1sjc n THR 192 N -3.56 0.00 0.29 3.41 -2.24 0.31 -4.88 114.28 107.61 1sjc n THR 192 Ca -0.21 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.67 1sjc n THR 192 Cb 0.49 -0.47 0.46 0.00 -2.10 0.00 0.00 70.33 68.71 1sjc n THR 192 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1sjc n ALA 193 N 1.00 1.39 -2.30 6.98 0.00 0.14 -3.87 120.51 123.85 1sjc n ALA 193 Ca 0.00 0.10 -0.24 0.00 0.00 0.00 0.00 53.44 53.30 1sjc n ALA 193 Cb 0.23 -1.31 0.01 0.00 0.00 0.00 0.00 19.45 18.38 1sjc n ALA 193 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1sjc s TYR 194 N -3.34 1.65 0.14 0.00 1.51 0.15 -4.77 117.35 112.69 1sjc s TYR 194 Ca 0.02 -0.79 0.05 0.00 -1.01 0.00 0.00 57.07 55.34 1sjc s TYR 194 Cb 0.07 -2.00 -0.04 0.00 -0.11 0.00 0.00 41.96 39.88 1sjc s TYR 194 CO 0.28 -0.61 -0.11 0.95 -1.11 0.00 0.00 175.55 174.94 1sjc s THR 195 N -2.73 1.20 0.58 -0.71 -4.23 -1.26 -4.35 115.64 104.15 1sjc s THR 195 Ca 0.42 -1.94 0.28 0.00 -1.18 0.00 0.00 61.69 59.27 1sjc s THR 195 Cb -0.03 -1.72 0.36 0.00 1.34 0.00 0.00 72.50 72.45 1sjc s THR 195 CO 0.26 -0.64 2.05 0.25 -0.54 0.00 0.00 174.62 176.00 1sjc h LEU 196 N 3.03 0.00 -0.71 4.79 5.85 -1.95 0.81 115.31 127.14 1sjc h LEU 196 Ca -0.37 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.35 1sjc h LEU 196 Cb 1.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1sjc h LEU 196 CO 0.59 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 179.30 1sjc n GLY 197 N -1.45 -1.32 1.19 3.75 0.00 -1.26 -2.83 105.19 103.27 1sjc n GLY 197 Ca 0.04 0.09 0.11 0.00 0.00 0.00 0.00 46.02 46.25 1sjc n GLY 197 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sjc n ASP 198 N -2.29 3.48 -0.30 1.61 8.00 0.28 -4.57 116.55 122.77 1sjc n ASP 198 Ca 0.02 -1.99 0.07 0.00 0.71 0.00 0.00 54.79 53.60 1sjc n ASP 198 Cb 0.24 -0.39 0.17 0.00 -0.02 0.00 0.00 41.12 41.12 1sjc n ASP 198 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1sjc h ALA 199 N 4.29 0.78 -0.33 2.24 0.00 -1.58 0.11 119.26 124.77 1sjc h ALA 199 Ca 0.00 0.30 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1sjc h ALA 199 Cb 0.90 0.56 -0.02 0.00 0.00 0.00 0.00 17.79 19.23 1sjc h ALA 199 CO 0.00 -0.44 0.12 -1.35 0.00 0.00 0.00 179.25 177.58 1sjc h PRO 200 N 0.04 0.46 0.00 0.00 0.11 -1.87 0.51 132.00 131.25 1sjc h PRO 200 Ca 0.45 -0.06 -0.15 0.00 0.11 0.00 0.00 66.00 66.36 1sjc h PRO 200 Cb 0.80 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.80 1sjc h PRO 200 CO -0.82 0.40 -0.70 0.37 -0.21 0.00 0.00 178.00 177.04 1sjc h GLN 201 N 0.46 0.00 -0.03 1.05 5.75 -1.14 -2.53 115.11 118.68 1sjc h GLN 201 Ca 0.11 0.00 -0.19 0.00 -0.15 0.00 0.00 58.65 58.43 1sjc h GLN 201 Cb 0.12 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.66 1sjc h GLN 201 CO -0.01 0.70 -0.80 -0.07 -2.65 0.00 0.00 178.83 176.00 1sjc h LEU 202 N 0.00 0.33 -1.90 -2.39 3.38 -0.45 -2.68 115.31 111.60 1sjc h LEU 202 Ca -0.01 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 1sjc h LEU 202 Cb 1.26 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 1sjc h LEU 202 CO 0.09 1.00 -0.07 0.00 0.09 0.00 0.00 178.44 179.56 1sjc h ALA 203 N 0.99 1.10 0.00 1.53 0.00 0.09 0.16 119.26 123.12 1sjc h ALA 203 Ca -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1sjc h ALA 203 Cb 1.39 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1sjc h ALA 203 CO 0.13 0.08 0.00 0.54 0.00 0.00 0.00 179.25 180.00 1sjc n ARG 204 N -3.31 0.05 0.00 0.00 1.74 -0.97 -1.40 116.66 112.77 1sjc n ARG 204 Ca -0.01 0.47 0.10 0.00 -0.77 0.00 0.00 57.85 57.64 1sjc n ARG 204 Cb 0.25 -1.63 -0.08 0.00 -1.02 0.00 0.00 32.46 29.98 1sjc n ARG 204 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1sjc n LEU 205 N -1.73 1.26 -0.34 0.55 4.77 0.04 -4.52 117.00 117.04 1sjc n LEU 205 Ca 0.01 -0.55 0.21 0.00 -0.03 0.00 0.00 56.01 55.64 1sjc n LEU 205 Cb 0.06 -0.01 0.43 0.00 -2.33 0.00 0.00 43.42 41.58 1sjc n LEU 205 CO 0.07 0.28 1.13 0.44 -1.33 0.00 0.00 177.39 177.98 1sjc h ASP 206 N 0.65 0.58 0.43 -1.43 3.32 -1.36 -2.58 116.42 116.02 1sjc h ASP 206 Ca 0.00 0.17 -0.06 0.00 0.02 0.00 0.00 57.03 57.16 1sjc h ASP 206 Cb 0.57 0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 1sjc h ASP 206 CO 0.00 -0.03 -0.27 -0.65 -1.72 0.00 0.00 179.24 176.57 1sjc h PRO 207 N 0.44 0.00 0.00 3.56 0.10 -1.80 -3.29 132.00 131.01 1sjc h PRO 207 Ca 0.69 0.00 0.00 0.00 0.10 0.00 0.00 66.00 66.79 1sjc h PRO 207 Cb 1.45 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.55 1sjc h PRO 207 CO -0.55 0.27 0.00 1.19 0.10 0.00 0.00 178.00 179.01 1sjc n PHE 208 N -3.88 0.00 -3.60 0.65 3.01 -0.97 -4.94 117.46 107.73 1sjc n PHE 208 Ca -0.02 0.00 -0.22 0.00 1.01 0.00 0.00 57.45 58.22 1sjc n PHE 208 Cb 0.35 -0.14 0.07 0.00 -0.01 0.00 0.00 39.48 39.75 1sjc n PHE 208 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1sjc n GLY 209 N 0.93 -0.44 3.79 1.37 0.00 -1.24 -4.97 105.19 104.63 1sjc n GLY 209 Ca 0.17 0.18 -0.35 0.00 0.00 0.00 0.00 46.02 46.03 1sjc n GLY 209 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sjc s LEU 210 N -6.90 3.82 0.31 0.99 1.43 -1.26 -4.81 118.68 112.25 1sjc s LEU 210 Ca 0.32 2.05 0.08 0.00 -1.03 0.00 0.00 54.13 55.55 1sjc s LEU 210 Cb -0.15 -4.55 0.49 0.00 0.03 0.00 0.00 46.19 42.02 1sjc s LEU 210 CO 0.75 -0.97 1.71 -0.07 0.23 0.00 0.00 176.35 178.01 1sjc h LEU 211 N 1.45 0.18 -7.21 1.79 3.38 0.03 -3.43 115.31 111.49 1sjc h LEU 211 Ca -0.50 -0.08 0.26 0.00 0.09 0.00 0.00 57.88 57.66 1sjc h LEU 211 Cb 1.24 -0.05 -0.14 0.00 0.09 0.00 0.00 40.66 41.80 1sjc h LEU 211 CO 0.58 0.59 0.74 -1.48 0.09 0.00 0.00 178.44 178.96 1sjc s LEU 212 N -8.17 -0.13 -0.18 1.67 0.05 -1.26 -4.41 118.68 106.25 1sjc s LEU 212 Ca -0.04 -0.13 0.01 0.00 0.05 0.00 0.00 54.13 54.02 1sjc s LEU 212 Cb 0.13 1.57 0.03 0.00 -2.05 0.00 0.00 46.19 45.87 1sjc s LEU 212 CO 0.76 -0.41 -0.13 -0.51 -0.55 0.00 0.00 176.35 175.51 1sjc s ILE 213 N -2.63 1.71 -0.27 1.48 2.07 0.11 -1.86 121.20 121.82 1sjc s ILE 213 Ca 0.12 -0.91 -0.20 0.00 -1.41 0.00 0.00 60.65 58.25 1sjc s ILE 213 Cb 0.02 -1.69 -0.02 0.00 0.13 0.00 0.00 42.46 40.90 1sjc s ILE 213 CO -0.04 0.31 0.60 -0.70 -1.91 0.00 0.00 174.94 173.20 1sjc s GLU 214 N 1.39 4.05 -1.18 3.50 2.12 -0.84 0.38 118.70 128.12 1sjc s GLU 214 Ca 0.01 0.42 -0.31 0.00 0.36 0.00 0.00 54.97 55.45 1sjc s GLU 214 Cb -0.15 -3.67 0.04 0.00 0.26 0.00 0.00 34.13 30.61 1sjc s GLU 214 CO -0.10 -0.43 0.69 0.94 -0.54 0.00 0.00 175.26 175.82 1sjc n GLN 215 N 5.70 -0.44 -0.33 4.30 -0.06 0.74 -1.05 117.38 126.25 1sjc n GLN 215 Ca -0.02 0.17 0.00 0.00 -2.00 0.00 0.00 57.00 55.15 1sjc n GLN 215 Cb 0.49 -2.68 0.17 0.00 -4.06 0.00 0.00 30.24 24.17 1sjc n GLN 215 CO 0.00 0.00 0.00 -1.00 -0.20 0.00 0.00 177.06 175.86 1sjc h PRO 216 N -2.39 1.16 -6.04 3.69 0.13 -1.82 0.91 132.00 127.63 1sjc h PRO 216 Ca -0.70 -0.07 -0.54 0.00 -0.87 0.00 0.00 66.00 63.82 1sjc h PRO 216 Cb 1.40 -0.26 -0.07 0.00 0.13 0.00 0.00 31.00 32.20 1sjc h PRO 216 CO 0.50 0.77 -0.49 -0.51 -0.23 0.00 0.00 178.00 178.04 1sjc s LEU 217 N -10.04 3.24 0.64 1.56 1.43 -1.26 0.33 118.68 114.59 1sjc s LEU 217 Ca -0.12 -0.86 -0.17 0.00 -1.03 0.00 0.00 54.13 51.94 1sjc s LEU 217 Cb 0.19 -1.70 -0.04 0.00 0.03 0.00 0.00 46.19 44.66 1sjc s LEU 217 CO 0.81 -0.44 0.85 -1.84 0.23 0.00 0.00 176.35 175.95 1sjc n GLU 218 N -1.25 0.67 -0.34 1.70 0.28 -1.25 -4.29 120.64 116.16 1sjc n GLU 218 Ca -0.01 0.27 0.05 0.00 -0.16 0.00 0.00 57.16 57.32 1sjc n GLU 218 Cb 0.62 -2.07 0.14 0.00 1.43 0.00 0.00 31.44 31.56 1sjc n GLU 218 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 1sjc h GLU 219 N 0.17 0.00 0.00 3.44 4.81 -1.92 -0.37 114.58 120.70 1sjc h GLU 219 Ca -0.48 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1sjc h GLU 219 Cb 1.36 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.74 1sjc h GLU 219 CO 0.48 0.00 0.00 0.39 -0.73 0.00 0.00 179.01 179.15 1sjc n GLU 220 N -5.60 0.15 -2.62 1.92 4.71 -1.26 -4.17 120.64 113.77 1sjc n GLU 220 Ca 0.15 0.14 -0.43 0.00 -0.01 0.00 0.00 57.16 57.01 1sjc n GLU 220 Cb 0.49 -1.68 0.00 0.00 -1.01 0.00 0.00 31.44 29.24 1sjc n GLU 220 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 1sjc n ASP 221 N -1.95 5.19 0.00 1.62 2.03 -0.15 -4.75 116.55 118.55 1sjc n ASP 221 Ca 0.06 -3.07 -0.12 0.00 0.52 0.00 0.00 54.79 52.18 1sjc n ASP 221 Cb 0.38 -1.51 -0.09 0.00 -0.72 0.00 0.00 41.12 39.18 1sjc n ASP 221 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 1sjc h VAL 222 N 4.08 1.22 0.00 5.18 2.07 -1.82 -2.47 116.25 124.52 1sjc h VAL 222 Ca 0.36 -1.41 -0.00 0.00 0.82 0.00 0.00 66.70 66.46 1sjc h VAL 222 Cb 0.73 2.08 -0.00 0.00 -1.52 0.00 0.00 31.29 32.58 1sjc h VAL 222 CO 1.46 0.33 -0.02 -0.07 0.02 0.00 0.00 177.57 179.28 1sjc h LEU 223 N -0.78 0.00 -0.14 2.57 3.38 -1.94 -0.44 115.31 117.97 1sjc h LEU 223 Ca -0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1sjc h LEU 223 Cb 0.61 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 1sjc h LEU 223 CO 0.02 0.02 -0.00 1.23 0.09 0.00 0.00 178.44 179.80 1sjc h GLY 224 N 0.09 0.26 0.80 0.83 0.00 -1.92 -0.76 103.07 102.37 1sjc h GLY 224 Ca -0.00 -0.19 0.06 0.00 0.00 0.00 0.00 47.33 47.19 1sjc h GLY 224 CO 0.00 0.18 0.65 0.45 0.00 0.00 0.00 176.54 177.82 1sjc h HIS 225 N -0.02 1.20 -0.70 5.60 3.86 -0.68 0.32 115.15 124.72 1sjc h HIS 225 Ca 0.04 0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.29 1sjc h HIS 225 Cb 0.37 -0.40 -0.04 0.00 1.06 0.00 0.00 27.41 28.41 1sjc h HIS 225 CO 0.03 0.64 0.46 0.00 0.86 0.00 0.00 177.93 179.93 1sjc h ALA 226 N 1.45 0.90 -0.41 2.45 0.00 -0.85 0.42 119.26 123.22 1sjc h ALA 226 Ca 0.42 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.26 1sjc h ALA 226 Cb 0.12 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1sjc h ALA 226 CO -0.15 0.29 0.14 0.93 0.00 0.00 0.00 179.25 180.45 1sjc h GLU 227 N 0.93 0.62 -0.24 0.00 4.39 0.06 -2.79 114.58 117.55 1sjc h GLU 227 Ca 0.26 -0.13 0.03 0.00 0.34 0.00 0.00 59.36 59.87 1sjc h GLU 227 Cb -0.08 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.45 1sjc h GLU 227 CO -0.07 0.61 0.03 1.25 -1.16 0.00 0.00 179.01 179.68 1sjc h LEU 228 N 0.51 -0.02 -1.94 1.33 5.85 0.15 -1.55 115.31 119.63 1sjc h LEU 228 Ca 0.13 0.04 0.13 0.00 0.84 0.00 0.00 57.88 59.03 1sjc h LEU 228 Cb 0.24 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1sjc h LEU 228 CO -0.01 0.02 0.48 0.00 -0.34 0.00 0.00 178.44 178.59 1sjc h ALA 229 N 1.18 2.18 -0.01 1.25 0.00 0.07 1.90 119.26 125.84 1sjc h ALA 229 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1sjc h ALA 229 Cb 0.12 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1sjc h ALA 229 CO -0.16 -0.71 -0.28 0.54 0.00 0.00 0.00 179.25 178.64 1sjc n ARG 230 N -3.73 0.65 0.00 0.00 1.74 -0.60 -4.06 116.66 110.67 1sjc n ARG 230 Ca 0.08 -0.36 0.05 0.00 -0.77 0.00 0.00 57.85 56.85 1sjc n ARG 230 Cb 0.67 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.56 1sjc n ARG 230 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1sjc n ARG 231 N -0.86 3.49 -4.35 5.56 1.74 0.64 -5.03 116.66 117.85 1sjc n ARG 231 Ca 0.11 -0.06 -0.18 0.00 -0.77 0.00 0.00 57.85 56.96 1sjc n ARG 231 Cb 0.34 -0.99 -0.10 0.00 -1.02 0.00 0.00 32.46 30.68 1sjc n ARG 231 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 1sjc s ILE 232 N -1.91 1.00 -0.08 0.55 -4.36 -0.80 -4.76 121.20 110.83 1sjc s ILE 232 Ca 0.04 -2.02 0.11 0.00 -0.26 0.00 0.00 60.65 58.52 1sjc s ILE 232 Cb 0.08 -2.47 -0.24 0.00 1.25 0.00 0.00 42.46 41.08 1sjc s ILE 232 CO 0.41 -0.22 0.50 0.00 0.24 0.00 0.00 174.94 175.87 1sjc n GLN 233 N -0.47 0.66 -1.90 0.37 6.02 -1.26 -4.87 117.38 115.93 1sjc n GLN 233 Ca -0.04 0.24 -0.42 0.00 -0.01 0.00 0.00 57.00 56.77 1sjc n GLN 233 Cb 0.65 -1.73 -0.03 0.00 1.02 0.00 0.00 30.24 30.15 1sjc n GLN 233 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1sjc s THR 234 N -2.57 3.26 0.44 5.09 2.01 -1.26 -4.94 115.64 117.66 1sjc s THR 234 Ca -0.08 0.46 -0.26 0.00 0.31 0.00 0.00 61.69 62.12 1sjc s THR 234 Cb 0.07 -3.30 -0.09 0.00 0.01 0.00 0.00 72.50 69.20 1sjc s THR 234 CO 0.81 -0.03 1.43 -2.84 -0.69 0.00 0.00 174.62 173.31 1sjc s PRO 235 N 3.67 3.77 -0.03 4.92 0.02 -1.26 -4.74 135.00 141.35 1sjc s PRO 235 Ca 0.77 2.44 -0.19 0.00 0.02 0.00 0.00 61.00 64.04 1sjc s PRO 235 Cb -0.38 -2.71 -0.05 0.00 0.02 0.00 0.00 34.50 31.38 1sjc s PRO 235 CO 0.33 -0.76 0.54 0.42 -0.33 0.00 0.00 177.00 177.20 1sjc s ILE 236 N -1.19 5.00 -0.01 2.83 -1.09 -1.26 0.05 121.20 125.53 1sjc s ILE 236 Ca 0.59 1.11 0.06 0.00 -2.23 0.00 0.00 60.65 60.18 1sjc s ILE 236 Cb -0.44 -3.87 -0.01 0.00 -1.58 0.00 0.00 42.46 36.56 1sjc s ILE 236 CO 0.57 0.42 -0.19 0.00 -1.23 0.00 0.00 174.94 174.51 1sjc s LEU 238 N -0.46 2.76 0.00 0.00 1.43 -1.20 -0.18 118.68 121.03 1sjc s LEU 238 Ca 0.07 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 52.69 1sjc s LEU 238 Cb -0.07 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.54 1sjc s LEU 238 CO -0.01 0.20 0.00 -0.67 0.23 0.00 0.00 176.35 176.10 1sjc n ASP 239 N 0.98 0.00 -0.23 2.29 -0.08 -1.26 -1.77 116.55 116.48 1sjc n ASP 239 Ca -0.15 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.12 1sjc n ASP 239 Cb 0.52 0.00 0.06 0.00 2.34 0.00 0.00 41.12 44.04 1sjc n ASP 239 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1sjc h GLU 240 N 0.00 -0.04 0.00 -0.67 3.07 -1.95 0.28 114.58 115.26 1sjc h GLU 240 Ca 0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1sjc h GLU 240 Cb 0.00 0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 27.92 1sjc h GLU 240 CO 0.00 -0.03 -0.01 0.77 -1.40 0.00 0.00 179.01 178.34 1sjc h SER 241 N -0.05 0.00 -2.12 1.42 0.02 -1.91 -3.38 113.55 107.54 1sjc h SER 241 Ca 0.31 0.00 -0.71 0.00 -0.84 0.00 0.00 61.79 60.56 1sjc h SER 241 Cb 0.53 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 62.91 1sjc h SER 241 CO -0.72 0.01 1.20 -0.63 -1.14 0.00 0.00 176.83 175.55 1sjc s ILE 242 N -4.32 4.78 -0.88 3.27 -1.09 0.97 -4.73 121.20 119.20 1sjc s ILE 242 Ca -0.05 -2.03 0.23 0.00 -2.23 0.00 0.00 60.65 56.58 1sjc s ILE 242 Cb 0.14 -4.88 -0.09 0.00 -1.58 0.00 0.00 42.46 36.04 1sjc s ILE 242 CO 0.48 -1.62 1.17 1.33 -1.23 0.00 0.00 174.94 175.07 1sjc n VAL 243 N 5.24 0.06 -3.78 2.92 0.24 -1.26 -4.55 118.33 117.19 1sjc n VAL 243 Ca 0.32 -0.08 -0.06 0.00 -2.04 0.00 0.00 64.34 62.48 1sjc n VAL 243 Cb 0.46 0.42 -0.02 0.00 -1.47 0.00 0.00 33.84 33.24 1sjc n VAL 243 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1sjc s SER 244 N -3.30 -0.25 0.28 -1.34 1.04 -1.26 -4.14 113.70 104.74 1sjc s SER 244 Ca 0.08 -0.48 -0.02 0.00 0.48 0.00 0.00 55.95 56.01 1sjc s SER 244 Cb 0.16 0.62 0.41 0.00 0.10 0.00 0.00 66.02 67.31 1sjc s SER 244 CO 0.77 -1.13 1.88 0.00 0.98 0.00 0.00 173.24 175.74 1sjc h ALA 245 N 2.00 1.28 -0.63 5.32 0.00 -1.91 0.78 119.26 126.10 1sjc h ALA 245 Ca -0.22 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.46 1sjc h ALA 245 Cb 1.25 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1sjc h ALA 245 CO 0.25 0.55 0.07 -0.09 0.00 0.00 0.00 179.25 180.03 1sjc h ARG 246 N 0.93 1.05 -0.31 0.00 2.43 -1.96 0.19 114.38 116.71 1sjc h ARG 246 Ca 0.23 -0.29 0.03 0.00 -0.81 0.00 0.00 59.98 59.14 1sjc h ARG 246 Cb 0.13 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.53 1sjc h ARG 246 CO -0.03 0.98 0.11 0.00 -1.51 0.00 0.00 179.97 179.53 1sjc h ALA 247 N 1.09 0.36 0.14 2.80 0.00 -1.59 0.10 119.26 122.16 1sjc h ALA 247 Ca 0.19 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1sjc h ALA 247 Cb 0.47 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1sjc h ALA 247 CO 0.02 -0.29 -0.24 0.00 0.00 0.00 0.00 179.25 178.74 1sjc h ALA 248 N 1.20 -0.43 -0.55 0.00 0.00 -0.47 0.69 119.26 119.70 1sjc h ALA 248 Ca 0.14 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.08 1sjc h ALA 248 Cb 0.11 0.38 -0.06 0.00 0.00 0.00 0.00 17.79 18.22 1sjc h ALA 248 CO -0.14 -0.78 0.22 0.00 0.00 0.00 0.00 179.25 178.54 1sjc h ALA 249 N 0.28 0.69 0.05 0.00 0.00 -0.29 0.71 119.26 120.71 1sjc h ALA 249 Ca 0.02 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1sjc h ALA 249 Cb 0.47 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1sjc h ALA 249 CO -0.12 -0.17 -0.06 -0.44 0.00 0.00 0.00 179.25 178.46 1sjc h ASP 250 N 0.42 -0.17 -0.64 0.00 3.32 -0.41 -1.29 116.42 117.64 1sjc h ASP 250 Ca 0.26 0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.36 1sjc h ASP 250 Cb 0.27 0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.85 1sjc h ASP 250 CO -0.25 -0.10 0.40 0.00 -1.72 0.00 0.00 179.24 177.58 1sjc h ALA 251 N 0.81 0.83 0.39 3.45 0.00 -0.44 -1.45 119.26 122.85 1sjc h ALA 251 Ca 0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1sjc h ALA 251 Cb 0.14 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1sjc h ALA 251 CO -0.03 0.16 -0.19 0.82 0.00 0.00 0.00 179.25 180.01 1sjc h ILE 252 N 0.79 0.60 -0.96 0.00 2.04 -0.70 -0.65 117.51 118.65 1sjc h ILE 252 Ca 0.25 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.35 1sjc h ILE 252 Cb 0.00 0.60 -0.07 0.00 -0.74 0.00 0.00 36.82 36.62 1sjc h ILE 252 CO -0.09 0.00 0.64 0.11 0.00 0.00 0.00 178.15 178.81 1sjc h LYS 253 N -0.54 0.30 -0.07 2.37 1.57 -1.10 -1.01 116.57 118.09 1sjc h LYS 253 Ca -0.05 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1sjc h LYS 253 Cb 0.41 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1sjc h LYS 253 CO 0.09 0.20 0.00 1.28 -0.57 0.00 0.00 179.45 180.44 1sjc n LEU 254 N -4.48 2.03 -0.48 2.94 4.77 -0.56 -4.93 117.00 116.29 1sjc n LEU 254 Ca 0.21 -0.72 -0.06 0.00 -0.03 0.00 0.00 56.01 55.41 1sjc n LEU 254 Cb 0.83 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.87 1sjc n LEU 254 CO 0.31 0.36 -0.06 0.61 -1.33 0.00 0.00 177.39 177.28 1sjc n GLY 255 N 1.23 0.70 0.04 -0.72 0.00 -0.38 -4.80 105.19 101.25 1sjc n GLY 255 Ca 0.17 -0.77 0.12 0.00 0.00 0.00 0.00 46.02 45.54 1sjc n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sjc n ALA 256 N 0.66 3.56 -3.14 4.61 0.00 -0.30 -4.30 120.51 121.61 1sjc n ALA 256 Ca -0.06 -0.38 -0.12 0.00 0.00 0.00 0.00 53.44 52.88 1sjc n ALA 256 Cb 0.26 -1.10 -0.09 0.00 0.00 0.00 0.00 19.45 18.52 1sjc n ALA 256 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1sjc s VAL 257 N -2.93 0.07 0.00 0.00 0.11 -1.25 -4.42 120.40 111.99 1sjc s VAL 257 Ca 0.13 -0.60 0.00 0.00 -2.93 0.00 0.00 61.98 58.58 1sjc s VAL 257 Cb 0.18 -0.65 0.00 0.00 -1.53 0.00 0.00 36.38 34.38 1sjc s VAL 257 CO 0.69 -0.33 0.00 0.00 -3.33 0.00 0.00 175.10 172.13 1sjc n GLN 258 N 1.16 1.15 -3.83 1.54 6.02 -0.19 -4.77 117.38 118.46 1sjc n GLN 258 Ca -0.21 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.66 1sjc n GLN 258 Cb 0.57 -0.98 -0.11 0.00 1.02 0.00 0.00 30.24 30.73 1sjc n GLN 258 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1sjc s ILE 259 N -1.95 0.03 -0.07 5.09 1.01 -1.10 -4.11 121.20 120.11 1sjc s ILE 259 Ca 0.00 -0.23 0.06 0.00 0.00 0.00 0.00 60.65 60.48 1sjc s ILE 259 Cb 0.00 -0.31 -0.01 0.00 0.01 0.00 0.00 42.46 42.15 1sjc s ILE 259 CO 0.00 -0.13 -0.24 -0.69 0.00 0.00 0.00 174.94 173.88 1sjc s VAL 260 N -0.40 2.03 -0.21 2.92 1.01 -0.78 -3.23 120.40 121.74 1sjc s VAL 260 Ca -0.05 -1.04 -0.18 0.00 0.00 0.00 0.00 61.98 60.71 1sjc s VAL 260 Cb -0.03 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.59 1sjc s VAL 260 CO 0.01 0.56 0.49 0.21 0.00 0.00 0.00 175.10 176.37 1sjc s ASN 261 N -0.02 6.51 -0.32 3.32 3.84 -0.73 -1.74 114.94 125.80 1sjc s ASN 261 Ca -0.08 0.61 -0.13 0.00 0.21 0.00 0.00 52.86 53.48 1sjc s ASN 261 Cb -0.15 -2.28 -0.03 0.00 -0.55 0.00 0.00 41.25 38.25 1sjc s ASN 261 CO 0.05 -0.18 0.25 -0.63 -2.79 0.00 0.00 177.10 173.81 1sjc s ILE 262 N 1.68 5.27 -0.32 -5.21 1.01 0.48 -4.65 121.20 119.46 1sjc s ILE 262 Ca 0.22 -0.05 0.03 0.00 0.00 0.00 0.00 60.65 60.86 1sjc s ILE 262 Cb -0.15 -3.69 0.09 0.00 0.01 0.00 0.00 42.46 38.72 1sjc s ILE 262 CO 0.09 0.05 0.02 -0.54 0.00 0.00 0.00 174.94 174.56 1sjc s LYS 263 N 1.79 1.78 0.21 2.79 1.02 -1.26 -0.66 119.74 125.41 1sjc s LYS 263 Ca 0.08 -1.70 -0.14 0.00 0.02 0.00 0.00 55.97 54.22 1sjc s LYS 263 Cb -0.17 -3.15 0.22 0.00 -0.52 0.00 0.00 37.83 34.21 1sjc s LYS 263 CO 0.11 -0.83 1.62 -1.35 -0.92 0.00 0.00 175.35 173.98 1sjc h PRO 264 N 7.71 -0.02 -0.31 -1.68 0.11 -1.90 -1.60 132.00 134.31 1sjc h PRO 264 Ca -0.10 0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.05 1sjc h PRO 264 Cb 1.03 0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 1sjc h PRO 264 CO 0.52 -0.02 0.10 0.78 -0.21 0.00 0.00 178.00 179.17 1sjc h GLY 265 N -0.03 0.39 0.49 -0.55 0.00 -1.91 0.10 103.07 101.57 1sjc h GLY 265 Ca 0.29 -0.06 0.11 0.00 0.00 0.00 0.00 47.33 47.68 1sjc h GLY 265 CO -0.65 0.02 0.59 -0.09 0.00 0.00 0.00 176.54 176.41 1sjc h ARG 266 N 0.23 0.92 -0.01 4.80 2.43 -1.74 -1.04 114.38 119.97 1sjc h ARG 266 Ca 0.14 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1sjc h ARG 266 Cb 0.12 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1sjc h ARG 266 CO -0.15 0.61 -0.01 1.33 -1.51 0.00 0.00 179.97 180.24 1sjc n VAL 267 N -4.65 0.00 -0.49 0.20 0.24 -0.65 -4.70 118.33 108.29 1sjc n VAL 267 Ca 0.17 -0.24 0.00 0.00 -2.04 0.00 0.00 64.34 62.23 1sjc n VAL 267 Cb 0.33 0.48 0.00 0.00 -1.47 0.00 0.00 33.84 33.18 1sjc n VAL 267 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1sjc n GLY 268 N 1.18 0.85 0.00 7.63 0.00 -0.41 -4.73 105.19 109.70 1sjc n GLY 268 Ca 0.19 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1sjc n GLY 268 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sjc n GLY 269 N -2.16 4.38 0.24 -0.02 0.00 0.29 -3.78 105.19 104.13 1sjc n GLY 269 Ca 0.00 -1.50 -0.07 0.00 0.00 0.00 0.00 46.02 44.46 1sjc n GLY 269 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1sjc h TYR 270 N 0.00 0.71 -0.60 1.61 -1.99 -1.83 -0.75 116.97 114.12 1sjc h TYR 270 Ca 0.00 -0.18 -0.06 0.00 2.00 0.00 0.00 58.73 60.49 1sjc h TYR 270 Cb 0.00 -0.16 -0.02 0.00 2.00 0.00 0.00 36.73 38.54 1sjc h TYR 270 CO 0.00 0.86 0.14 -0.07 -0.00 0.00 0.00 178.16 179.09 1sjc h LEU 271 N 0.52 0.92 -0.46 3.88 3.38 -1.94 -0.74 115.31 120.87 1sjc h LEU 271 Ca 0.06 -0.24 -0.16 0.00 0.09 0.00 0.00 57.88 57.63 1sjc h LEU 271 Cb 0.81 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 1sjc h LEU 271 CO 0.07 0.92 -0.51 -0.08 0.09 0.00 0.00 178.44 178.93 1sjc h GLU 272 N 0.88 0.69 -0.90 1.13 4.57 -1.84 -2.38 114.58 116.73 1sjc h GLU 272 Ca 0.19 -0.42 0.14 0.00 -1.18 0.00 0.00 59.36 58.09 1sjc h GLU 272 Cb 0.37 0.04 -0.09 0.00 -0.16 0.00 0.00 28.75 28.91 1sjc h GLU 272 CO 0.00 1.04 0.51 0.00 -1.18 0.00 0.00 179.01 179.38 1sjc h ALA 273 N 0.88 1.37 -0.42 2.92 0.00 -0.56 0.13 119.26 123.57 1sjc h ALA 273 Ca 0.02 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1sjc h ALA 273 Cb 1.08 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1sjc h ALA 273 CO 0.11 0.01 0.23 -0.09 0.00 0.00 0.00 179.25 179.50 1sjc h ARG 274 N 0.74 0.60 -0.94 0.00 2.43 -0.78 0.15 114.38 116.59 1sjc h ARG 274 Ca 0.48 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.58 1sjc h ARG 274 Cb 0.61 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 30.00 1sjc h ARG 274 CO -0.33 0.49 0.60 0.00 -1.51 0.00 0.00 179.97 179.22 1sjc h ARG 275 N 0.55 1.25 -0.48 0.20 3.08 -0.73 0.12 114.38 118.38 1sjc h ARG 275 Ca 0.15 -0.09 -0.06 0.00 0.07 0.00 0.00 59.98 60.05 1sjc h ARG 275 Cb 0.07 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 29.82 1sjc h ARG 275 CO -0.02 0.85 0.06 0.28 -1.07 0.00 0.00 179.97 180.06 1sjc h VAL 276 N 1.28 1.23 -0.40 2.04 2.07 0.41 -0.03 116.25 122.85 1sjc h VAL 276 Ca 0.34 -0.88 -0.00 0.00 0.82 0.00 0.00 66.70 66.98 1sjc h VAL 276 Cb -0.11 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1sjc h VAL 276 CO -0.07 0.31 0.23 -0.74 0.02 0.00 0.00 177.57 177.33 1sjc h HIS 277 N 0.72 0.54 -0.47 1.57 -0.00 0.01 0.45 115.15 117.97 1sjc h HIS 277 Ca 0.15 -0.01 -0.11 0.00 -0.00 0.00 0.00 60.37 60.41 1sjc h HIS 277 Cb 0.36 -0.17 -0.01 0.00 -0.00 0.00 0.00 27.41 27.58 1sjc h HIS 277 CO 0.02 0.40 -0.12 -0.44 -0.00 0.00 0.00 177.93 177.78 1sjc h ASP 278 N 0.52 0.92 -0.19 3.26 3.32 -0.09 0.44 116.42 124.60 1sjc h ASP 278 Ca 0.14 -0.37 0.00 0.00 0.02 0.00 0.00 57.03 56.83 1sjc h ASP 278 Cb 0.02 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 1sjc h ASP 278 CO -0.03 1.07 0.12 0.58 -1.72 0.00 0.00 179.24 179.27 1sjc h VAL 279 N 0.75 1.06 -0.61 -1.35 2.07 -0.87 0.40 116.25 117.70 1sjc h VAL 279 Ca 0.12 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 1sjc h VAL 279 Cb 0.68 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 1sjc h VAL 279 CO 0.05 0.06 0.36 0.00 0.02 0.00 0.00 177.57 178.06 1sjc h ALA 281 N 1.18 -0.26 -0.16 0.00 0.00 -0.39 -0.62 119.26 119.02 1sjc h ALA 281 Ca 0.22 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.14 1sjc h ALA 281 Cb -0.01 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1sjc h ALA 281 CO -0.04 -0.67 0.34 0.00 0.00 0.00 0.00 179.25 178.88 1sjc h ALA 282 N 0.56 1.64 -0.14 0.00 0.00 -0.59 0.12 119.26 120.84 1sjc h ALA 282 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1sjc h ALA 282 Cb 0.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1sjc h ALA 282 CO -0.06 -0.42 0.00 0.72 0.00 0.00 0.00 179.25 179.48 1sjc n HIS 283 N -3.28 0.16 -1.74 0.00 8.25 -0.69 -4.96 115.22 112.96 1sjc n HIS 283 Ca 0.02 -0.08 -0.04 0.00 -0.26 0.00 0.00 57.72 57.35 1sjc n HIS 283 Cb 0.44 -0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.54 1sjc n HIS 283 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1sjc n GLY 284 N 1.39 0.38 3.46 -1.41 0.00 0.41 -5.03 105.19 104.39 1sjc n GLY 284 Ca 0.16 -0.77 -0.39 0.00 0.00 0.00 0.00 46.02 45.02 1sjc n GLY 284 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sjc s ILE 285 N -2.20 4.71 0.50 -0.61 -1.09 -0.33 -5.03 121.20 117.17 1sjc s ILE 285 Ca 0.00 -0.37 -0.21 0.00 -2.23 0.00 0.00 60.65 57.84 1sjc s ILE 285 Cb 0.00 -3.40 -0.07 0.00 -1.58 0.00 0.00 42.46 37.41 1sjc s ILE 285 CO 0.00 0.06 1.15 -2.84 -1.23 0.00 0.00 174.94 172.08 1sjc s PRO 286 N 1.63 3.56 0.35 2.79 0.02 -1.26 -3.84 135.00 138.26 1sjc s PRO 286 Ca 0.05 1.70 0.05 0.00 0.02 0.00 0.00 61.00 62.81 1sjc s PRO 286 Cb -0.17 -2.21 -0.07 0.00 0.02 0.00 0.00 34.50 32.07 1sjc s PRO 286 CO 0.07 -0.70 0.04 0.14 -0.33 0.00 0.00 177.00 176.23 1sjc s VAL 287 N -1.65 1.43 -0.09 3.83 -7.23 -1.14 -1.87 120.40 113.68 1sjc s VAL 287 Ca 0.68 -2.00 -0.23 0.00 -1.81 0.00 0.00 61.98 58.62 1sjc s VAL 287 Cb -0.26 -2.85 0.05 0.00 0.56 0.00 0.00 36.38 33.88 1sjc s VAL 287 CO 0.31 0.00 0.55 -1.66 -0.31 0.00 0.00 175.10 173.99 1sjc s TRP 288 N -3.12 -0.52 -0.01 2.82 1.48 -0.71 -2.67 118.94 116.21 1sjc s TRP 288 Ca 0.36 1.03 -0.30 0.00 -1.06 0.00 0.00 56.10 56.13 1sjc s TRP 288 Cb 0.09 0.27 -0.04 0.00 -1.16 0.00 0.00 33.47 32.63 1sjc s TRP 288 CO 0.16 -0.45 1.10 0.00 -4.06 0.00 0.00 176.95 173.70 1sjc s GLY 290 N 1.14 1.74 0.08 0.00 0.00 0.17 -0.33 107.32 110.11 1sjc s GLY 290 Ca 0.54 -1.19 0.04 0.00 0.00 0.00 0.00 44.72 44.11 1sjc s GLY 290 CO 0.26 -0.93 -0.12 -0.32 0.00 0.00 0.00 173.10 171.99 1sjc s GLY 291 N -4.37 0.83 -0.38 0.20 0.00 -1.25 -4.69 107.32 97.65 1sjc s GLY 291 Ca 0.55 -1.05 0.10 0.00 0.00 0.00 0.00 44.72 44.32 1sjc s GLY 291 CO 0.39 -1.10 1.06 1.03 0.00 0.00 0.00 173.10 174.48 1sjc n MET 292 N 1.01 2.61 -4.48 2.90 2.81 -1.26 -4.95 117.12 115.76 1sjc n MET 292 Ca -0.19 -4.03 -0.41 0.00 -1.81 0.00 0.00 57.70 51.26 1sjc n MET 292 Cb 0.56 -1.89 -0.07 0.00 -0.71 0.00 0.00 33.22 31.10 1sjc n MET 292 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 1sjc n ILE 293 N -0.36 -0.25 -1.66 2.02 5.41 -1.26 -4.89 119.36 118.36 1sjc n ILE 293 Ca 0.28 -0.05 -0.30 0.00 1.00 0.00 0.00 62.75 63.68 1sjc n ILE 293 Cb 0.74 -0.72 0.09 0.00 -0.71 0.00 0.00 39.64 39.04 1sjc n ILE 293 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1sjc s GLU 294 N -7.22 2.04 1.06 0.38 8.01 -1.26 -5.08 118.70 116.63 1sjc s GLU 294 Ca 0.74 0.46 -0.17 0.00 0.01 0.00 0.00 54.97 56.02 1sjc s GLU 294 Cb -0.43 -1.93 0.23 0.00 -4.31 0.00 0.00 34.13 27.69 1sjc s GLU 294 CO 1.01 -1.61 1.19 0.95 0.01 0.00 0.00 175.26 176.81 1sjc s THR 295 N -3.28 1.82 -0.30 3.63 -4.23 -1.26 -4.55 115.64 107.48 1sjc s THR 295 Ca 0.61 0.00 0.17 0.00 -1.18 0.00 0.00 61.69 61.29 1sjc s THR 295 Cb -0.13 -2.72 0.17 0.00 1.34 0.00 0.00 72.50 71.16 1sjc s THR 295 CO 0.53 0.00 1.49 0.61 -0.54 0.00 0.00 174.62 176.71 1sjc n GLY 296 N -2.18 -0.76 0.19 3.99 0.00 -1.26 0.14 105.19 105.30 1sjc n GLY 296 Ca 0.12 0.16 -0.09 0.00 0.00 0.00 0.00 46.02 46.21 1sjc n GLY 296 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1sjc h LEU 297 N 0.00 -0.32 -0.27 0.99 3.38 -1.96 -0.76 115.31 116.37 1sjc h LEU 297 Ca 0.00 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.75 1sjc h LEU 297 Cb 0.09 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1sjc h LEU 297 CO 0.00 0.17 -0.04 1.23 0.09 0.00 0.00 178.44 179.88 1sjc h GLY 298 N -1.00 0.54 -0.38 0.83 0.00 -1.61 -3.00 103.07 98.46 1sjc h GLY 298 Ca -0.04 -0.43 0.18 0.00 0.00 0.00 0.00 47.33 47.03 1sjc h GLY 298 CO 0.06 0.40 0.02 -0.09 0.00 0.00 0.00 176.54 176.93 1sjc h ARG 299 N 0.26 0.11 0.18 4.80 2.43 -0.37 -1.48 114.38 120.31 1sjc h ARG 299 Ca 0.07 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.25 1sjc h ARG 299 Cb 0.50 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.99 1sjc h ARG 299 CO 0.02 0.07 -0.32 0.00 -1.51 0.00 0.00 179.97 178.23 1sjc h ALA 300 N 1.72 -0.60 -0.02 2.80 0.00 -0.99 -1.35 119.26 120.82 1sjc h ALA 300 Ca 0.42 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.23 1sjc h ALA 300 Cb 0.76 0.52 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1sjc h ALA 300 CO -0.67 -0.89 -0.17 0.00 0.00 0.00 0.00 179.25 177.52 1sjc h ALA 301 N 0.02 1.67 0.00 0.00 0.00 -1.38 -2.32 119.26 117.25 1sjc h ALA 301 Ca 0.02 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 1sjc h ALA 301 Cb 0.59 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1sjc h ALA 301 CO -0.15 0.25 -0.64 -0.91 0.00 0.00 0.00 179.25 177.79 1sjc h ASN 302 N 0.03 0.00 -0.06 0.00 2.35 -0.96 -2.13 115.58 114.82 1sjc h ASN 302 Ca 0.01 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.58 1sjc h ASN 302 Cb 0.33 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.70 1sjc h ASN 302 CO 0.02 0.64 -0.60 0.58 -1.65 0.00 0.00 177.43 176.42 1sjc h VAL 303 N 0.00 1.31 0.48 2.81 2.07 -0.73 0.62 116.25 122.81 1sjc h VAL 303 Ca -0.01 -1.84 -0.01 0.00 0.82 0.00 0.00 66.70 65.66 1sjc h VAL 303 Cb 1.26 1.80 -0.02 0.00 -1.52 0.00 0.00 31.29 32.80 1sjc h VAL 303 CO 0.08 0.58 -0.45 0.00 0.02 0.00 0.00 177.57 177.80 1sjc h ALA 304 N 0.83 -1.02 -0.64 1.67 0.00 -1.31 -2.44 119.26 116.36 1sjc h ALA 304 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1sjc h ALA 304 Cb 1.18 0.64 -0.03 0.00 0.00 0.00 0.00 17.79 19.57 1sjc h ALA 304 CO 0.12 -1.11 0.41 1.25 0.00 0.00 0.00 179.25 179.92 1sjc h LEU 305 N -0.93 0.75 0.00 0.00 5.85 -1.37 -1.47 115.31 118.14 1sjc h LEU 305 Ca -0.05 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1sjc h LEU 305 Cb 0.81 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.65 1sjc h LEU 305 CO -0.05 0.56 0.00 0.00 -0.34 0.00 0.00 178.44 178.61 1sjc n ALA 306 N -2.44 2.07 1.14 1.25 0.00 0.21 -1.66 120.51 121.08 1sjc n ALA 306 Ca 0.06 -0.10 0.13 0.00 0.00 0.00 0.00 53.44 53.53 1sjc n ALA 306 Cb 0.05 -1.27 0.22 0.00 0.00 0.00 0.00 19.45 18.45 1sjc n ALA 306 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1sjc n SER 307 N -1.07 2.50 -4.75 0.00 3.41 -0.55 -4.77 113.62 108.39 1sjc n SER 307 Ca 0.11 -1.82 -0.34 0.00 -0.26 0.00 0.00 58.87 56.57 1sjc n SER 307 Cb 0.07 0.02 0.05 0.00 -0.26 0.00 0.00 64.21 64.10 1sjc n SER 307 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1sjc s LEU 308 N -2.03 3.44 0.46 1.04 1.02 -0.67 -2.60 118.68 119.34 1sjc s LEU 308 Ca 0.30 2.16 0.17 0.00 0.02 0.00 0.00 54.13 56.79 1sjc s LEU 308 Cb 0.20 -4.57 1.15 0.00 0.02 0.00 0.00 46.19 42.99 1sjc s LEU 308 CO 0.33 -1.76 1.98 -0.65 0.02 0.00 0.00 176.35 176.26 1sjc h PRO 309 N 0.15 0.27 -0.00 1.29 0.11 -1.90 -2.25 132.00 129.67 1sjc h PRO 309 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1sjc h PRO 309 Cb 1.27 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1sjc h PRO 309 CO 0.53 0.18 -0.41 -1.71 -0.21 0.00 0.00 178.00 176.38 1sjc n ASN 310 N -4.45 0.47 -4.39 -2.05 5.15 -1.26 -4.52 115.26 104.21 1sjc n ASN 310 Ca 0.10 -0.20 -0.32 0.00 -0.60 0.00 0.00 54.58 53.56 1sjc n ASN 310 Cb 0.45 0.14 -0.06 0.00 -0.53 0.00 0.00 39.78 39.78 1sjc n ASN 310 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1sjc n PHE 311 N -1.43 2.67 0.63 1.20 3.01 -0.85 -2.86 117.46 119.83 1sjc n PHE 311 Ca 0.06 -1.61 0.04 0.00 1.01 0.00 0.00 57.45 56.95 1sjc n PHE 311 Cb 0.33 -2.44 0.15 0.00 -0.01 0.00 0.00 39.48 37.52 1sjc n PHE 311 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1sjc n THR 312 N 7.36 0.77 -3.86 4.37 -2.24 -1.09 -4.84 114.28 114.75 1sjc n THR 312 Ca 0.46 -0.50 -0.12 0.00 -2.27 0.00 0.00 64.05 61.63 1sjc n THR 312 Cb 0.45 -0.08 -0.12 0.00 -2.10 0.00 0.00 70.33 68.48 1sjc n THR 312 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1sjc s LEU 313 N -1.08 1.64 0.29 3.22 1.02 -1.23 -5.00 118.68 117.54 1sjc s LEU 313 Ca 0.22 0.04 -0.30 0.00 0.02 0.00 0.00 54.13 54.11 1sjc s LEU 313 Cb 0.14 0.42 -0.12 0.00 0.02 0.00 0.00 46.19 46.66 1sjc s LEU 313 CO 0.11 -0.15 1.58 -0.81 0.02 0.00 0.00 176.35 177.09 1sjc n PRO 314 N 2.47 2.64 -3.48 1.29 -0.05 -1.26 -4.56 135.00 132.05 1sjc n PRO 314 Ca -0.16 0.94 -0.23 0.00 -0.05 0.00 0.00 63.50 64.00 1sjc n PRO 314 Cb 0.58 -2.71 0.02 0.00 -0.05 0.00 0.00 33.50 31.34 1sjc n PRO 314 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 175.50 175.65 1sjc s GLY 315 N 0.47 2.07 -1.47 0.55 0.00 -1.24 -4.68 107.32 103.01 1sjc s GLY 315 Ca 0.64 -1.68 -0.12 0.00 0.00 0.00 0.00 44.72 43.56 1sjc s GLY 315 CO 0.49 -1.82 2.57 1.22 0.00 0.00 0.00 173.10 175.57 1sjc n ASP 316 N -1.98 6.31 -2.49 1.64 8.00 0.55 -1.61 116.55 126.96 1sjc n ASP 316 Ca 0.07 -2.66 -0.29 0.00 0.71 0.00 0.00 54.79 52.61 1sjc n ASP 316 Cb 0.63 -1.55 0.01 0.00 -0.02 0.00 0.00 41.12 40.19 1sjc n ASP 316 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1sjc n THR 317 N 4.33 2.58 -0.33 -3.53 -2.24 -1.26 -3.87 114.28 109.97 1sjc n THR 317 Ca 0.65 -4.74 -0.29 0.00 -2.27 0.00 0.00 64.05 57.39 1sjc n THR 317 Cb 0.29 -1.25 0.28 0.00 -2.10 0.00 0.00 70.33 67.56 1sjc n THR 317 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1sjc n SER 318 N -0.52 -3.21 -4.85 3.42 7.64 -1.25 -4.76 113.62 110.09 1sjc n SER 318 Ca 0.42 -0.58 -0.32 0.00 1.01 0.00 0.00 58.87 59.40 1sjc n SER 318 Cb 0.63 -1.11 -0.05 0.00 -1.01 0.00 0.00 64.21 62.67 1sjc n SER 318 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1sjc s ALA 319 N -2.23 3.28 0.14 -0.43 0.00 -1.26 -4.94 121.76 116.32 1sjc s ALA 319 Ca 0.68 0.04 -0.12 0.00 0.00 0.00 0.00 51.96 52.56 1sjc s ALA 319 Cb -0.18 -2.82 0.13 0.00 0.00 0.00 0.00 23.12 20.25 1sjc s ALA 319 CO 0.61 0.21 0.96 0.43 0.00 0.00 0.00 175.76 177.96 1sjc n SER 320 N -0.66 -0.42 0.10 0.00 7.64 -0.66 0.55 113.62 120.16 1sjc n SER 320 Ca 0.04 1.08 0.06 0.00 1.01 0.00 0.00 58.87 61.06 1sjc n SER 320 Cb 0.53 -0.24 0.34 0.00 -1.01 0.00 0.00 64.21 63.84 1sjc n SER 320 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1sjc n ASP 321 N -4.90 0.32 0.31 6.43 5.75 -1.22 -1.33 116.55 121.92 1sjc n ASP 321 Ca 0.06 0.63 0.20 0.00 -0.01 0.00 0.00 54.79 55.67 1sjc n ASP 321 Cb 0.24 -0.66 0.97 0.00 -1.03 0.00 0.00 41.12 40.63 1sjc n ASP 321 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 1sjc h ARG 322 N 0.00 0.00 0.00 0.11 1.12 -0.27 -3.34 114.38 112.00 1sjc h ARG 322 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1sjc h ARG 322 Cb 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.03 1sjc h ARG 322 CO 0.00 0.00 -0.52 1.19 -3.11 0.00 0.00 179.97 177.53 1sjc n PHE 323 N -3.10 0.00 -4.24 2.20 3.01 -1.02 -4.81 117.46 109.50 1sjc n PHE 323 Ca -0.01 0.00 -0.34 0.00 1.01 0.00 0.00 57.45 58.10 1sjc n PHE 323 Cb 0.18 0.03 -0.11 0.00 -0.01 0.00 0.00 39.48 39.57 1sjc n PHE 323 CO 0.00 0.00 0.00 0.71 1.01 0.00 0.00 176.76 178.48 1sjc s TYR 324 N -1.58 3.14 -0.03 1.38 4.12 -0.44 -0.22 117.35 123.73 1sjc s TYR 324 Ca 0.00 -0.06 -0.24 0.00 0.02 0.00 0.00 57.07 56.79 1sjc s TYR 324 Cb 0.00 -1.97 -0.21 0.00 -1.52 0.00 0.00 41.96 38.26 1sjc s TYR 324 CO 0.00 0.14 1.15 -0.22 0.02 0.00 0.00 175.55 176.64 1sjc h LYS 325 N 6.38 0.16 -4.54 -0.62 3.64 -1.84 -3.23 116.57 116.52 1sjc h LYS 325 Ca -0.37 -0.12 -0.59 0.00 -1.27 0.00 0.00 60.65 58.29 1sjc h LYS 325 Cb 1.18 0.02 -0.37 0.00 -0.41 0.00 0.00 32.23 32.66 1sjc h LYS 325 CO 0.64 0.76 -0.82 0.99 -2.27 0.00 0.00 179.45 178.76 1sjc s THR 326 N -3.65 1.49 0.42 1.00 2.01 -1.26 -4.87 115.64 110.78 1sjc s THR 326 Ca -0.16 -0.70 -0.05 0.00 0.31 0.00 0.00 61.69 61.09 1sjc s THR 326 Cb 0.02 -1.48 -0.04 0.00 0.01 0.00 0.00 72.50 71.00 1sjc s THR 326 CO 0.72 0.33 0.72 -0.62 -0.69 0.00 0.00 174.62 175.08 1sjc s ASP 327 N 1.50 6.34 0.01 3.53 -1.08 -1.26 -4.96 116.67 120.74 1sjc s ASP 327 Ca 0.03 0.87 0.28 0.00 -0.52 0.00 0.00 52.55 53.21 1sjc s ASP 327 Cb -0.14 -2.22 1.14 0.00 -1.46 0.00 0.00 42.92 40.25 1sjc s ASP 327 CO -0.09 -0.45 1.87 2.30 0.52 0.00 0.00 175.17 179.31 1sjc n ILE 328 N -1.84 0.02 -4.65 4.11 -5.35 -1.26 -4.81 119.36 105.58 1sjc n ILE 328 Ca -0.00 -0.01 -0.30 0.00 -0.27 0.00 0.00 62.75 62.17 1sjc n ILE 328 Cb 0.55 -0.42 -0.07 0.00 -1.74 0.00 0.00 39.64 37.95 1sjc n ILE 328 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1sjc n THR 329 N -1.53 0.00 -1.80 7.28 -2.24 -1.26 0.16 114.28 114.89 1sjc n THR 329 Ca 0.07 -2.48 -0.42 0.00 -2.27 0.00 0.00 64.05 58.95 1sjc n THR 329 Cb 0.34 0.70 -0.03 0.00 -2.10 0.00 0.00 70.33 69.24 1sjc n THR 329 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1sjc s GLU 330 N -3.75 4.16 1.01 -0.78 2.56 -1.26 -4.92 118.70 115.71 1sjc s GLU 330 Ca 0.11 2.51 -0.11 0.00 0.00 0.00 0.00 54.97 57.48 1sjc s GLU 330 Cb 0.01 -3.39 0.19 0.00 2.00 0.00 0.00 34.13 32.93 1sjc s GLU 330 CO 0.08 -0.76 1.06 -2.30 -0.56 0.00 0.00 175.26 172.78 1sjc n PRO 331 N 4.96 -1.12 -3.69 4.30 -0.02 -1.26 -4.94 135.00 133.23 1sjc n PRO 331 Ca 0.16 -0.27 -0.37 0.00 -2.02 0.00 0.00 63.50 61.00 1sjc n PRO 331 Cb 0.38 -2.28 -0.12 0.00 -0.02 0.00 0.00 33.50 31.46 1sjc n PRO 331 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1sjc s PHE 332 N -2.55 3.14 -0.14 6.00 0.40 -1.26 -4.96 117.98 118.60 1sjc s PHE 332 Ca 0.67 -0.25 0.01 0.00 -0.60 0.00 0.00 56.93 56.76 1sjc s PHE 332 Cb -0.24 -2.29 -0.00 0.00 0.51 0.00 0.00 43.02 41.00 1sjc s PHE 332 CO 0.61 -0.30 -0.16 0.08 0.70 0.00 0.00 175.22 176.14 1sjc s VAL 333 N 1.66 2.62 -0.12 -0.44 1.01 -1.26 -1.66 120.40 122.22 1sjc s VAL 333 Ca 0.06 -0.79 -0.29 0.00 0.00 0.00 0.00 61.98 60.96 1sjc s VAL 333 Cb -0.16 -2.09 -0.06 0.00 0.00 0.00 0.00 36.38 34.08 1sjc s VAL 333 CO 0.06 0.52 1.90 -0.22 0.00 0.00 0.00 175.10 177.37 1sjc s LEU 334 N 0.68 3.98 -0.52 3.92 2.96 -1.26 -4.75 118.68 123.70 1sjc s LEU 334 Ca -0.08 2.09 -0.01 0.00 -0.22 0.00 0.00 54.13 55.92 1sjc s LEU 334 Cb -0.16 -3.53 0.14 0.00 0.50 0.00 0.00 46.19 43.14 1sjc s LEU 334 CO 0.02 -1.36 0.30 -0.55 -1.32 0.00 0.00 176.35 173.44 1sjc s SER 335 N 5.36 5.00 -0.93 3.68 0.15 -0.21 -4.73 113.70 122.02 1sjc s SER 335 Ca 0.85 -2.61 -0.00 0.00 0.70 0.00 0.00 55.95 54.89 1sjc s SER 335 Cb -0.34 -1.78 -0.00 0.00 -1.71 0.00 0.00 66.02 62.19 1sjc s SER 335 CO 0.35 -0.38 0.77 0.61 1.20 0.00 0.00 173.24 175.79 1sjc n GLY 336 N 3.76 -0.18 2.42 9.45 0.00 -1.26 -2.89 105.19 116.49 1sjc n GLY 336 Ca 0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 1sjc n GLY 336 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sjc n GLY 337 N -1.10 0.36 3.43 -0.02 0.00 -1.24 -4.98 105.19 101.64 1sjc n GLY 337 Ca -0.22 -0.06 -0.21 0.00 0.00 0.00 0.00 46.02 45.53 1sjc n GLY 337 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1sjc s HIS 338 N -1.64 1.91 0.04 1.61 3.76 -1.14 -0.09 115.29 119.74 1sjc s HIS 338 Ca 0.00 -0.98 0.03 0.00 -0.15 0.00 0.00 55.06 53.96 1sjc s HIS 338 Cb 0.00 -1.23 -0.02 0.00 1.11 0.00 0.00 32.58 32.43 1sjc s HIS 338 CO 0.00 -0.03 -0.09 -0.51 -0.85 0.00 0.00 174.74 173.26 1sjc s LEU 339 N -3.46 2.22 -0.10 0.89 1.02 0.16 -1.04 118.68 118.36 1sjc s LEU 339 Ca 0.36 -0.49 -0.16 0.00 0.02 0.00 0.00 54.13 53.86 1sjc s LEU 339 Cb 0.09 -0.27 -0.05 0.00 0.02 0.00 0.00 46.19 45.98 1sjc s LEU 339 CO 0.15 -0.13 0.41 -2.16 0.02 0.00 0.00 176.35 174.65 1sjc s PRO 340 N -1.36 4.21 0.10 1.29 0.04 -1.26 -1.01 135.00 137.02 1sjc s PRO 340 Ca -0.06 0.35 -0.31 0.00 0.04 0.00 0.00 61.00 61.02 1sjc s PRO 340 Cb -0.09 -3.38 -0.07 0.00 0.04 0.00 0.00 34.50 31.00 1sjc s PRO 340 CO 0.01 0.31 1.32 0.08 0.04 0.00 0.00 177.00 178.76 1sjc s VAL 341 N 0.16 3.55 0.45 -0.36 1.01 0.70 -4.94 120.40 120.98 1sjc s VAL 341 Ca 0.23 1.12 -0.25 0.00 0.00 0.00 0.00 61.98 63.08 1sjc s VAL 341 Cb -0.15 -3.72 -0.09 0.00 0.00 0.00 0.00 36.38 32.43 1sjc s VAL 341 CO 0.09 0.09 1.34 -2.65 0.00 0.00 0.00 175.10 173.98 1sjc n PRO 342 N 3.85 2.02 -0.00 2.72 -0.02 -1.26 -4.94 135.00 137.37 1sjc n PRO 342 Ca 0.10 0.72 0.06 0.00 -2.02 0.00 0.00 63.50 62.37 1sjc n PRO 342 Cb 0.44 -2.51 -0.09 0.00 -0.02 0.00 0.00 33.50 31.32 1sjc n PRO 342 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1sjc n THR 343 N -0.33 0.00 -1.37 3.45 -2.24 -1.26 -4.81 114.28 107.72 1sjc n THR 343 Ca 0.07 -0.28 -0.29 0.00 -2.27 0.00 0.00 64.05 61.28 1sjc n THR 343 Cb 0.41 0.34 0.15 0.00 -2.10 0.00 0.00 70.33 69.13 1sjc n THR 343 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1sjc s GLY 344 N -3.23 1.58 1.11 3.38 0.00 -1.26 -4.80 107.32 104.10 1sjc s GLY 344 Ca -0.03 -0.39 -0.13 0.00 0.00 0.00 0.00 44.72 44.18 1sjc s GLY 344 CO 0.52 0.17 0.95 -1.05 0.00 0.00 0.00 173.10 173.70 1sjc n PRO 345 N -3.90 -1.91 0.00 2.90 -0.01 -1.26 -3.94 135.00 126.88 1sjc n PRO 345 Ca 0.06 -0.52 0.00 0.00 -0.01 0.00 0.00 63.50 63.03 1sjc n PRO 345 Cb 0.58 -2.17 0.00 0.00 -0.01 0.00 0.00 33.50 31.90 1sjc n PRO 345 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1sjc n GLY 346 N 0.94 2.56 0.23 -1.23 0.00 0.22 -1.06 105.19 106.85 1sjc n GLY 346 Ca 0.05 -0.19 0.02 0.00 0.00 0.00 0.00 46.02 45.89 1sjc n GLY 346 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1sjc h LEU 347 N 0.00 0.21 0.00 0.99 3.38 -1.83 0.70 115.31 118.76 1sjc h LEU 347 Ca 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1sjc h LEU 347 Cb 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1sjc h LEU 347 CO 0.00 0.42 0.00 0.61 0.09 0.00 0.00 178.44 179.56 1sjc n GLY 348 N -0.74 0.71 3.14 0.83 0.00 -0.22 -4.62 105.19 104.28 1sjc n GLY 348 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 1sjc n GLY 348 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1sjc s VAL 349 N -2.67 0.36 -0.07 1.61 1.01 -1.26 -4.54 120.40 114.83 1sjc s VAL 349 Ca 0.00 -1.88 -0.21 0.00 0.00 0.00 0.00 61.98 59.89 1sjc s VAL 349 Cb 0.00 -1.72 0.05 0.00 0.00 0.00 0.00 36.38 34.70 1sjc s VAL 349 CO 0.00 -0.81 0.48 0.00 0.00 0.00 0.00 175.10 174.77 1sjc s ALA 350 N -3.85 -1.23 0.40 5.51 0.00 -1.26 -5.04 121.76 116.30 1sjc s ALA 350 Ca 0.13 0.93 -0.26 0.00 0.00 0.00 0.00 51.96 52.76 1sjc s ALA 350 Cb 0.07 -0.17 -0.08 0.00 0.00 0.00 0.00 23.12 22.93 1sjc s ALA 350 CO -0.05 -0.29 1.21 -1.25 0.00 0.00 0.00 175.76 175.38 1sjc s PRO 351 N -0.89 4.04 -0.69 0.00 0.04 -1.26 -4.35 135.00 131.89 1sjc s PRO 351 Ca -0.09 1.94 -0.20 0.00 0.04 0.00 0.00 61.00 62.69 1sjc s PRO 351 Cb -0.03 -2.71 0.11 0.00 0.04 0.00 0.00 34.50 31.90 1sjc s PRO 351 CO 0.05 -0.36 0.86 0.42 0.04 0.00 0.00 177.00 178.01 1sjc s ILE 352 N -1.36 4.71 0.26 0.56 1.01 0.41 -4.92 121.20 121.88 1sjc s ILE 352 Ca 0.57 -1.02 0.07 0.00 0.00 0.00 0.00 60.65 60.26 1sjc s ILE 352 Cb -0.33 -4.60 0.31 0.00 0.01 0.00 0.00 42.46 37.84 1sjc s ILE 352 CO 0.42 -1.29 1.22 -0.81 0.00 0.00 0.00 174.94 174.47 1sjc n PRO 353 N 6.62 -0.06 -0.01 2.79 -0.05 -1.26 0.26 135.00 143.29 1sjc n PRO 353 Ca 0.00 1.13 -0.09 0.00 -0.05 0.00 0.00 63.50 64.48 1sjc n PRO 353 Cb 0.45 -1.87 -0.04 0.00 -0.05 0.00 0.00 33.50 31.99 1sjc n PRO 353 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 175.50 176.38 1sjc h GLU 354 N 0.00 -0.06 -0.44 0.54 5.08 -1.96 0.22 114.58 117.96 1sjc h GLU 354 Ca 0.54 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.87 1sjc h GLU 354 Cb 1.25 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.49 1sjc h GLU 354 CO -0.68 -0.04 0.14 -0.07 -1.00 0.00 0.00 179.01 177.37 1sjc h LEU 355 N -0.06 0.64 0.89 1.33 3.38 0.31 -2.81 115.31 119.00 1sjc h LEU 355 Ca 0.07 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 1sjc h LEU 355 Cb 0.17 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1sjc h LEU 355 CO -0.17 0.67 -0.49 0.25 0.09 0.00 0.00 178.44 178.79 1sjc h LEU 356 N 0.57 -1.21 -1.77 1.67 6.46 -0.42 -2.58 115.31 118.04 1sjc h LEU 356 Ca 0.14 0.06 0.11 0.00 -0.12 0.00 0.00 57.88 58.07 1sjc h LEU 356 Cb 0.25 0.34 -0.01 0.00 -0.73 0.00 0.00 40.66 40.51 1sjc h LEU 356 CO -0.01 -0.79 0.54 0.44 -0.62 0.00 0.00 178.44 178.01 1sjc h ASP 357 N -1.28 0.00 0.61 1.25 3.32 -0.60 1.13 116.42 120.85 1sjc h ASP 357 Ca -0.12 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.77 1sjc h ASP 357 Cb 1.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.54 1sjc h ASP 357 CO 0.16 0.00 -0.74 -0.33 -1.72 0.00 0.00 179.24 176.61 1sjc h GLU 358 N 0.00 0.10 -0.02 3.56 5.08 -1.18 -3.33 114.58 118.79 1sjc h GLU 358 Ca 0.18 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1sjc h GLU 358 Cb 1.26 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1sjc h GLU 358 CO -0.00 0.79 -0.08 1.33 -1.00 0.00 0.00 179.01 180.05 1sjc n VAL 359 N -3.72 0.00 -2.80 3.13 0.24 0.38 -4.98 118.33 110.58 1sjc n VAL 359 Ca -0.02 -0.46 -0.42 0.00 -2.04 0.00 0.00 64.34 61.41 1sjc n VAL 359 Cb 0.71 1.31 -0.03 0.00 -1.47 0.00 0.00 33.84 34.36 1sjc n VAL 359 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1sjc s THR 360 N -1.53 4.87 -0.19 3.34 2.01 -0.38 -0.53 115.64 123.24 1sjc s THR 360 Ca 0.18 1.86 0.04 0.00 0.31 0.00 0.00 61.69 64.08 1sjc s THR 360 Cb 0.14 -4.23 -0.22 0.00 0.01 0.00 0.00 72.50 68.20 1sjc s THR 360 CO 0.26 0.09 0.09 0.35 -0.69 0.00 0.00 174.62 174.72 1sjc n THR 361 N 4.29 1.57 -4.02 -0.82 -2.24 0.89 -4.97 114.28 108.98 1sjc n THR 361 Ca 0.05 -0.67 -0.09 0.00 -2.27 0.00 0.00 64.05 61.07 1sjc n THR 361 Cb 0.50 -1.28 -0.08 0.00 -2.10 0.00 0.00 70.33 67.36 1sjc n THR 361 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1sjc s ALA 362 N -2.53 0.29 0.04 6.98 0.00 -1.22 -4.95 121.76 120.36 1sjc s ALA 362 Ca -0.23 -1.06 -0.19 0.00 0.00 0.00 0.00 51.96 50.47 1sjc s ALA 362 Cb 0.08 0.77 0.04 0.00 0.00 0.00 0.00 23.12 24.01 1sjc s ALA 362 CO 0.71 -0.56 0.44 0.15 0.00 0.00 0.00 175.76 176.51 1sjc s LYS 363 N -3.98 0.95 -0.27 0.00 1.02 -1.25 -0.75 119.74 115.45 1sjc s LYS 363 Ca 0.17 -0.33 -0.25 0.00 0.02 0.00 0.00 55.97 55.58 1sjc s LYS 363 Cb 0.05 0.43 0.10 0.00 -0.52 0.00 0.00 37.83 37.89 1sjc s LYS 363 CO -0.02 -0.33 0.92 0.54 -0.92 0.00 0.00 175.35 175.54 1sjc s VAL 364 N -2.45 0.00 -0.17 3.17 0.11 -0.23 -4.98 120.40 115.85 1sjc s VAL 364 Ca -0.05 0.00 -0.06 0.00 -2.93 0.00 0.00 61.98 58.93 1sjc s VAL 364 Cb -0.01 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.80 1sjc s VAL 364 CO -0.02 0.00 0.05 0.86 -3.33 0.00 0.00 175.10 172.66 1sjc s TRP 365 N 0.24 3.23 -0.33 1.54 -0.11 -1.26 -0.48 118.94 121.77 1sjc s TRP 365 Ca 0.02 0.05 0.03 0.00 1.22 0.00 0.00 56.10 57.42 1sjc s TRP 365 Cb -0.05 -2.04 0.10 0.00 -1.50 0.00 0.00 33.47 29.98 1sjc s TRP 365 CO -0.03 0.18 0.05 0.42 -4.62 0.00 0.00 176.95 172.94 1sjc s ILE 366 N 0.22 2.06 0.00 5.86 1.01 0.90 -4.99 121.20 126.26 1sjc s ILE 366 Ca 0.03 -2.17 0.00 0.00 0.00 0.00 0.00 60.65 58.51 1sjc s ILE 366 Cb -0.12 -2.51 0.00 0.00 0.01 0.00 0.00 42.46 39.83 1sjc s ILE 366 CO 0.01 -0.59 0.00 0.61 0.00 0.00 0.00 174.94 174.97