#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cly s VAL 2 N 0.00 3.41 -0.07 6.31 0.11 -1.26 -4.14 120.40 124.76 1cly s VAL 2 Ca 0.00 1.22 -0.29 0.00 -2.93 0.00 0.00 61.98 59.97 1cly s VAL 2 Cb 0.00 -3.78 0.10 0.00 -1.53 0.00 0.00 36.38 31.18 1cly s VAL 2 CO 0.00 0.21 0.87 0.54 -3.33 0.00 0.00 175.10 173.39 1cly s ASN 3 N 0.00 -0.44 0.02 3.54 2.20 -0.25 -4.97 114.94 115.04 1cly s ASN 3 Ca 0.52 0.31 0.08 0.00 -0.94 0.00 0.00 52.86 52.84 1cly s ASN 3 Cb -0.34 0.40 -0.02 0.00 -2.00 0.00 0.00 41.25 39.28 1cly s ASN 3 CO 0.39 -0.53 -0.23 -0.76 -2.94 0.00 0.00 177.10 173.03 1cly s LEU 4 N -1.67 2.12 -0.18 3.54 1.02 -1.26 -2.14 118.68 120.11 1cly s LEU 4 Ca -0.01 -0.50 -0.01 0.00 0.02 0.00 0.00 54.13 53.62 1cly s LEU 4 Cb -0.01 -1.16 0.05 0.00 0.02 0.00 0.00 46.19 45.10 1cly s LEU 4 CO -0.01 0.24 -0.02 -0.69 0.02 0.00 0.00 176.35 175.89 1cly s VAL 5 N -0.70 0.88 0.24 -1.59 1.01 -0.78 -4.02 120.40 115.43 1cly s VAL 5 Ca 0.09 -0.61 -0.08 0.00 0.00 0.00 0.00 61.98 61.39 1cly s VAL 5 Cb -0.09 -1.19 -0.06 0.00 0.00 0.00 0.00 36.38 35.03 1cly s VAL 5 CO 0.01 -0.01 0.53 -1.61 0.00 0.00 0.00 175.10 174.02 1cly s GLU 6 N 1.72 3.74 -0.11 2.72 8.01 -1.26 -0.54 118.70 132.97 1cly s GLU 6 Ca -0.00 0.17 -0.30 0.00 0.01 0.00 0.00 54.97 54.84 1cly s GLU 6 Cb -0.16 -2.67 0.11 0.00 -4.31 0.00 0.00 34.13 27.10 1cly s GLU 6 CO -0.07 0.30 0.89 -1.54 0.01 0.00 0.00 175.26 174.85 1cly s SER 7 N -2.58 -0.45 0.00 -0.19 1.04 -0.38 -4.74 113.70 106.39 1cly s SER 7 Ca 0.46 0.45 0.00 0.00 0.48 0.00 0.00 55.95 57.34 1cly s SER 7 Cb -0.11 0.38 0.00 0.00 0.10 0.00 0.00 66.02 66.39 1cly s SER 7 CO 0.24 -0.45 0.00 0.61 0.98 0.00 0.00 173.24 174.62 1cly n GLY 8 N 0.69 1.63 3.64 7.32 0.00 -1.26 -1.37 105.19 115.84 1cly n GLY 8 Ca -0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.66 1cly n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1cly s GLY 9 N -2.00 1.66 0.00 -0.02 0.00 -1.26 -4.54 107.32 101.16 1cly s GLY 9 Ca 0.00 -1.61 0.00 0.00 0.00 0.00 0.00 44.72 43.11 1cly s GLY 9 CO 0.00 -1.66 0.00 0.61 0.00 0.00 0.00 173.10 172.05 1cly n GLY 10 N -0.74 1.64 3.70 0.20 0.00 -1.22 -4.83 105.19 103.94 1cly n GLY 10 Ca -0.07 0.08 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1cly n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1cly s LEU 11 N 0.00 4.19 0.02 0.99 2.96 -1.26 -1.29 118.68 124.29 1cly s LEU 11 Ca 0.00 0.33 0.01 0.00 -0.22 0.00 0.00 54.13 54.25 1cly s LEU 11 Cb 0.00 -2.25 -0.01 0.00 0.50 0.00 0.00 46.19 44.43 1cly s LEU 11 CO 0.00 0.09 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.38 1cly s VAL 12 N 0.72 0.26 0.40 1.68 1.01 -0.97 -5.00 120.40 118.50 1cly s VAL 12 Ca 0.12 -0.68 -0.04 0.00 0.00 0.00 0.00 61.98 61.38 1cly s VAL 12 Cb -0.13 -0.33 -0.04 0.00 0.00 0.00 0.00 36.38 35.88 1cly s VAL 12 CO 0.03 -0.27 0.67 0.00 0.00 0.00 0.00 175.10 175.52 1cly s GLN 13 N -1.01 3.56 0.18 2.72 -2.07 -1.25 -2.40 119.66 119.38 1cly s GLN 13 Ca -0.08 0.02 -0.33 0.00 -1.82 0.00 0.00 55.36 53.14 1cly s GLN 13 Cb -0.07 -2.51 -0.15 0.00 -1.09 0.00 0.00 33.01 29.19 1cly s GLN 13 CO -0.00 -0.01 1.29 -2.30 -1.32 0.00 0.00 175.29 172.95 1cly n PRO 14 N -1.81 1.51 -0.08 9.60 -0.02 -1.26 -0.85 135.00 142.08 1cly n PRO 14 Ca -0.01 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1cly n PRO 14 Cb 0.55 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 1cly n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1cly n GLY 15 N 2.23 1.71 0.00 -1.23 0.00 0.73 -4.95 105.19 103.69 1cly n GLY 15 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1cly n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cly n GLY 16 N -2.00 -1.08 3.27 -0.02 0.00 -0.03 -4.04 105.19 101.28 1cly n GLY 16 Ca 0.00 -1.53 -0.13 0.00 0.00 0.00 0.00 46.02 44.35 1cly n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1cly s SER 17 N -1.18 -0.31 0.03 1.61 0.01 -1.26 -1.10 113.70 111.51 1cly s SER 17 Ca 0.00 0.42 -0.12 0.00 1.31 0.00 0.00 55.95 57.57 1cly s SER 17 Cb 0.00 0.53 0.01 0.00 0.21 0.00 0.00 66.02 66.77 1cly s SER 17 CO 0.00 -0.31 0.25 -0.22 0.41 0.00 0.00 173.24 173.37 1cly s LEU 18 N -0.63 1.13 -0.23 2.44 2.96 -0.04 -5.01 118.68 119.30 1cly s LEU 18 Ca -0.07 -0.24 -0.02 0.00 -0.22 0.00 0.00 54.13 53.58 1cly s LEU 18 Cb -0.04 1.13 0.07 0.00 0.50 0.00 0.00 46.19 47.86 1cly s LEU 18 CO 0.03 -0.56 0.04 -0.75 -1.32 0.00 0.00 176.35 173.79 1cly s LYS 19 N -2.37 0.76 0.22 1.98 2.20 -1.26 0.21 119.74 121.47 1cly s LYS 19 Ca -0.06 -0.64 -0.10 0.00 -0.36 0.00 0.00 55.97 54.81 1cly s LYS 19 Cb -0.02 -2.10 -0.07 0.00 -1.51 0.00 0.00 37.83 34.13 1cly s LYS 19 CO -0.03 -0.73 0.55 0.08 -0.36 0.00 0.00 175.35 174.86 1cly s VAL 20 N 1.76 4.93 0.27 4.02 1.01 -0.48 -4.79 120.40 127.12 1cly s VAL 20 Ca 0.01 0.48 0.03 0.00 0.00 0.00 0.00 61.98 62.50 1cly s VAL 20 Cb -0.17 -3.62 -0.06 0.00 0.00 0.00 0.00 36.38 32.53 1cly s VAL 20 CO -0.13 -0.06 0.04 -0.94 0.00 0.00 0.00 175.10 174.02 1cly s SER 21 N -2.33 1.85 -0.10 3.32 1.04 -0.47 -0.63 113.70 116.37 1cly s SER 21 Ca 0.47 -1.31 -0.05 0.00 0.48 0.00 0.00 55.95 55.54 1cly s SER 21 Cb -0.11 0.02 0.05 0.00 0.10 0.00 0.00 66.02 66.07 1cly s SER 21 CO 0.21 -0.60 0.23 0.00 0.98 0.00 0.00 173.24 174.06 1cly s VAL 23 N 1.49 4.16 0.26 0.00 1.01 0.30 -0.21 120.40 127.41 1cly s VAL 23 Ca -0.07 -0.24 -0.22 0.00 0.00 0.00 0.00 61.98 61.45 1cly s VAL 23 Cb -0.11 -2.90 -0.09 0.00 0.00 0.00 0.00 36.38 33.28 1cly s VAL 23 CO -0.08 0.41 0.81 -0.89 0.00 0.00 0.00 175.10 175.35 1cly s THR 24 N 1.10 4.43 -0.21 3.92 2.01 -0.10 -1.86 115.64 124.92 1cly s THR 24 Ca 0.03 1.50 -0.20 0.00 0.31 0.00 0.00 61.69 63.34 1cly s THR 24 Cb -0.14 -3.92 0.05 0.00 0.01 0.00 0.00 72.50 68.50 1cly s THR 24 CO 0.02 0.19 0.56 -0.44 -0.69 0.00 0.00 174.62 174.26 1cly s SER 25 N -1.63 -0.59 0.00 3.53 0.01 -0.91 -4.93 113.70 109.18 1cly s SER 25 Ca 0.46 1.14 0.00 0.00 1.31 0.00 0.00 55.95 58.85 1cly s SER 25 Cb -0.17 1.15 0.00 0.00 0.21 0.00 0.00 66.02 67.21 1cly s SER 25 CO 0.22 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.28 1cly n GLY 26 N 2.79 0.77 3.62 3.44 0.00 -1.26 -1.09 105.19 113.46 1cly n GLY 26 Ca -0.14 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.81 1cly n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1cly s PHE 27 N -2.24 -0.28 -1.00 1.61 -0.71 -1.26 -4.31 117.98 109.78 1cly s PHE 27 Ca 0.00 0.03 -0.23 0.00 -1.04 0.00 0.00 56.93 55.69 1cly s PHE 27 Cb 0.00 0.60 0.01 0.00 -1.21 0.00 0.00 43.02 42.42 1cly s PHE 27 CO 0.00 -0.78 1.66 0.99 -1.34 0.00 0.00 175.22 175.75 1cly s THR 28 N -3.38 3.75 0.27 -4.49 2.01 -1.26 -4.86 115.64 107.67 1cly s THR 28 Ca 0.08 -0.69 -0.06 0.00 0.31 0.00 0.00 61.69 61.32 1cly s THR 28 Cb -0.02 -4.68 0.37 0.00 0.01 0.00 0.00 72.50 68.19 1cly s THR 28 CO -0.04 -1.56 1.59 0.15 -0.69 0.00 0.00 174.62 174.08 1cly h PHE 29 N 10.20 -0.27 0.00 4.92 3.57 -1.96 -0.52 116.94 132.87 1cly h PHE 29 Ca 0.18 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.75 1cly h PHE 29 Cb 1.00 0.26 0.00 0.00 2.79 0.00 0.00 35.95 40.00 1cly h PHE 29 CO 1.26 -0.36 0.00 -1.13 -2.23 0.00 0.00 178.31 175.85 1cly n SER 30 N -5.50 0.20 0.02 0.41 3.41 -1.26 -2.40 113.62 108.50 1cly n SER 30 Ca 0.16 0.57 0.12 0.00 -0.26 0.00 0.00 58.87 59.46 1cly n SER 30 Cb 0.53 -0.60 0.25 0.00 -0.26 0.00 0.00 64.21 64.13 1cly n SER 30 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1cly n ASP 31 N -1.74 0.52 -4.48 4.04 9.92 -0.20 -4.72 116.55 119.88 1cly n ASP 31 Ca 0.01 -0.08 -0.30 0.00 -0.53 0.00 0.00 54.79 53.89 1cly n ASP 31 Cb 0.10 0.17 -0.12 0.00 -0.64 0.00 0.00 41.12 40.63 1cly n ASP 31 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1cly s TYR 32 N -3.05 2.59 0.30 1.24 1.51 -1.01 -4.93 117.35 113.99 1cly s TYR 32 Ca 0.10 -0.24 -0.28 0.00 -1.01 0.00 0.00 57.07 55.64 1cly s TYR 32 Cb 0.16 -1.44 -0.09 0.00 -0.11 0.00 0.00 41.96 40.48 1cly s TYR 32 CO 0.69 0.31 1.06 0.71 -1.11 0.00 0.00 175.55 177.21 1cly s TYR 33 N -1.01 3.58 0.21 2.71 1.51 -1.26 -4.34 117.35 118.74 1cly s TYR 33 Ca 0.16 1.73 0.10 0.00 -1.01 0.00 0.00 57.07 58.04 1cly s TYR 33 Cb -0.11 -3.19 -0.04 0.00 -0.11 0.00 0.00 41.96 38.51 1cly s TYR 33 CO 0.07 -0.38 -0.11 -1.64 -1.11 0.00 0.00 175.55 172.38 1cly s MET 34 N -1.65 2.00 0.15 -0.62 -1.94 -0.90 -4.21 119.30 112.13 1cly s MET 34 Ca 0.47 -1.37 0.05 0.00 -1.71 0.00 0.00 55.69 53.12 1cly s MET 34 Cb -0.28 -2.08 -0.04 0.00 2.01 0.00 0.00 34.83 34.43 1cly s MET 34 CO 0.36 0.41 -0.10 0.71 -0.01 0.00 0.00 175.02 176.39 1cly s TYR 35 N -1.88 1.29 -0.15 -0.03 2.02 -0.71 -1.87 117.35 116.01 1cly s TYR 35 Ca 0.26 -0.76 -0.00 0.00 -0.37 0.00 0.00 57.07 56.20 1cly s TYR 35 Cb -0.08 -0.66 0.03 0.00 -0.40 0.00 0.00 41.96 40.86 1cly s TYR 35 CO 0.15 0.09 -0.08 -1.58 -1.57 0.00 0.00 175.55 172.56 1cly s TRP 36 N -3.32 1.79 0.09 2.71 0.52 -0.28 -1.71 118.94 118.74 1cly s TRP 36 Ca 0.17 -1.05 0.10 0.00 0.02 0.00 0.00 56.10 55.34 1cly s TRP 36 Cb 0.03 -1.37 -0.03 0.00 -1.15 0.00 0.00 33.47 30.94 1cly s TRP 36 CO 0.01 -0.61 -0.26 0.08 0.02 0.00 0.00 176.95 176.20 1cly s VAL 37 N 1.61 2.10 0.08 4.03 1.01 0.10 -0.53 120.40 128.80 1cly s VAL 37 Ca 0.03 -1.54 0.05 0.00 0.00 0.00 0.00 61.98 60.51 1cly s VAL 37 Cb -0.14 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 1cly s VAL 37 CO -0.08 0.19 -0.13 0.00 0.00 0.00 0.00 175.10 175.08 1cly s ARG 38 N -1.64 0.81 -0.14 2.72 1.70 0.38 0.31 118.95 123.09 1cly s ARG 38 Ca 0.12 -1.00 0.01 0.00 -0.47 0.00 0.00 55.73 54.38 1cly s ARG 38 Cb -0.10 -0.71 0.02 0.00 -0.57 0.00 0.00 34.95 33.59 1cly s ARG 38 CO 0.04 0.14 -0.14 -1.14 -1.08 0.00 0.00 175.30 173.12 1cly s GLN 39 N -2.04 2.28 0.85 3.89 0.74 -0.38 -0.24 119.66 124.76 1cly s GLN 39 Ca -0.00 -0.56 -0.12 0.00 0.05 0.00 0.00 55.36 54.73 1cly s GLN 39 Cb -0.08 -2.06 0.10 0.00 1.10 0.00 0.00 33.01 32.08 1cly s GLN 39 CO 0.02 -0.20 1.15 0.95 -0.55 0.00 0.00 175.29 176.66 1cly s THR 40 N 1.38 2.17 0.32 -0.34 -4.23 0.25 -1.48 115.64 113.71 1cly s THR 40 Ca 0.02 0.06 0.05 0.00 -1.18 0.00 0.00 61.69 60.64 1cly s THR 40 Cb -0.13 -2.92 0.30 0.00 1.34 0.00 0.00 72.50 71.09 1cly s THR 40 CO -0.09 -0.07 1.86 -0.65 -0.54 0.00 0.00 174.62 175.13 1cly h PRO 41 N -1.24 0.81 -0.47 3.99 0.11 -1.90 0.17 132.00 133.47 1cly h PRO 41 Ca -0.48 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1cly h PRO 41 Cb 1.32 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1cly h PRO 41 CO 0.64 0.53 0.00 -0.85 -0.21 0.00 0.00 178.00 178.11 1cly n GLU 42 N -4.58 0.79 -1.70 1.05 0.00 -1.26 -4.79 120.64 110.15 1cly n GLU 42 Ca 0.17 0.00 -0.15 0.00 0.00 0.00 0.00 57.16 57.18 1cly n GLU 42 Cb 0.40 -1.24 -0.05 0.00 0.00 0.00 0.00 31.44 30.56 1cly n GLU 42 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1cly n LYS 43 N -0.13 -1.09 -2.71 3.44 4.76 0.60 -4.99 118.16 118.04 1cly n LYS 43 Ca 0.00 0.93 -0.40 0.00 -2.87 0.00 0.00 58.31 55.97 1cly n LYS 43 Cb 0.12 -5.13 -0.06 0.00 -1.84 0.00 0.00 35.03 28.12 1cly n LYS 43 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1cly s ARG 44 N -3.73 4.81 -0.14 1.97 6.06 -1.25 -4.81 118.95 121.86 1cly s ARG 44 Ca 0.00 1.52 -0.04 0.00 -2.50 0.00 0.00 55.73 54.71 1cly s ARG 44 Cb 0.00 -3.29 -0.03 0.00 0.06 0.00 0.00 34.95 31.69 1cly s ARG 44 CO 0.00 0.43 -0.01 -1.17 -2.50 0.00 0.00 175.30 172.05 1cly s LEU 45 N -0.99 3.42 0.00 -0.88 2.96 -1.26 -0.58 118.68 121.36 1cly s LEU 45 Ca 0.43 -0.02 0.00 0.00 -0.22 0.00 0.00 54.13 54.32 1cly s LEU 45 Cb -0.26 -1.82 -0.00 0.00 0.50 0.00 0.00 46.19 44.60 1cly s LEU 45 CO 0.33 0.23 -0.02 -1.61 -1.32 0.00 0.00 176.35 173.95 1cly s GLU 46 N 0.03 0.13 0.14 1.98 2.02 0.67 -5.00 118.70 118.67 1cly s GLU 46 Ca 0.02 -0.11 -0.27 0.00 0.02 0.00 0.00 54.97 54.62 1cly s GLU 46 Cb -0.13 -0.09 -0.07 0.00 0.10 0.00 0.00 34.13 33.94 1cly s GLU 46 CO 0.02 0.02 0.84 -0.46 0.02 0.00 0.00 175.26 175.71 1cly s TRP 47 N -0.18 3.86 -0.15 1.61 -0.00 -1.26 -0.47 118.94 122.35 1cly s TRP 47 Ca -0.01 1.68 0.01 0.00 -0.00 0.00 0.00 56.10 57.78 1cly s TRP 47 Cb -0.02 -2.88 -0.10 0.00 -0.00 0.00 0.00 33.47 30.48 1cly s TRP 47 CO -0.00 0.38 -0.13 0.28 -0.00 0.00 0.00 176.95 177.48 1cly n VAL 48 N 2.13 0.85 -3.60 5.86 0.31 0.31 -4.64 118.33 119.55 1cly n VAL 48 Ca -0.03 -0.32 -0.00 0.00 -0.01 0.00 0.00 64.34 63.98 1cly n VAL 48 Cb 0.49 -1.04 -0.01 0.00 -0.91 0.00 0.00 33.84 32.37 1cly n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1cly s ALA 49 N -2.30 -2.25 0.07 3.52 0.00 -1.02 -3.99 121.76 115.79 1cly s ALA 49 Ca -0.20 1.23 -0.07 0.00 0.00 0.00 0.00 51.96 52.92 1cly s ALA 49 Cb 0.05 0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.22 1cly s ALA 49 CO 0.34 -0.84 0.13 1.52 0.00 0.00 0.00 175.76 176.92 1cly s TYR 50 N -2.25 0.22 -0.12 0.00 -0.85 -1.13 -1.12 117.35 112.08 1cly s TYR 50 Ca 0.13 -0.62 -0.08 0.00 -0.52 0.00 0.00 57.07 55.97 1cly s TYR 50 Cb 0.03 -0.13 0.04 0.00 0.38 0.00 0.00 41.96 42.28 1cly s TYR 50 CO -0.04 -0.47 0.31 -1.50 -1.52 0.00 0.00 175.55 172.33 1cly s ILE 51 N -3.48 -0.02 1.31 -3.49 2.07 -0.78 -2.89 121.20 113.91 1cly s ILE 51 Ca 0.02 0.07 -0.20 0.00 -1.41 0.00 0.00 60.65 59.13 1cly s ILE 51 Cb 0.04 -0.46 0.33 0.00 0.13 0.00 0.00 42.46 42.50 1cly s ILE 51 CO -0.09 0.03 1.00 -0.94 -1.91 0.00 0.00 174.94 173.03 1cly s SER 52 N 0.82 -0.08 0.19 4.50 1.04 0.83 -2.11 113.70 118.89 1cly s SER 52 Ca -0.05 0.88 -0.06 0.00 0.48 0.00 0.00 55.95 57.19 1cly s SER 52 Cb -0.06 -1.28 0.10 0.00 0.10 0.00 0.00 66.02 64.88 1cly s SER 52 CO -0.06 -4.76 1.56 1.56 0.98 0.00 0.00 173.24 172.52 1cly h GLN 52 N -3.01 0.80 -0.13 4.02 7.50 -1.85 -3.10 115.11 119.34 1cly h GLN 52 Ca -0.47 -0.38 -0.18 0.00 0.50 0.00 0.00 58.65 58.12 1cly h GLN 52 Cb 1.33 -0.01 -0.00 0.00 0.05 0.00 0.00 27.48 28.84 1cly h GLN 52 CO 0.34 1.00 -0.67 0.78 -1.50 0.00 0.00 178.83 178.79 1cly h GLY 53 N 0.92 0.58 0.00 3.46 0.00 -1.92 -3.47 103.07 102.63 1cly h GLY 53 Ca 0.07 -0.76 0.00 0.00 0.00 0.00 0.00 47.33 46.65 1cly h GLY 53 CO 0.08 0.68 0.00 0.61 0.00 0.00 0.00 176.54 177.90 1cly n GLY 54 N 0.46 0.74 0.16 4.60 0.00 -1.17 -4.98 105.19 105.00 1cly n GLY 54 Ca -0.04 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.06 1cly n GLY 54 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1cly h ASP 55 N 0.00 0.00 -3.48 1.61 3.58 -1.91 -3.45 116.42 112.77 1cly h ASP 55 Ca 0.00 0.00 -0.66 0.00 0.42 0.00 0.00 57.03 56.79 1cly h ASP 55 Cb 0.00 0.00 -0.28 0.00 1.72 0.00 0.00 39.33 40.77 1cly h ASP 55 CO 0.00 0.19 -0.70 -0.63 -2.88 0.00 0.00 179.24 175.22 1cly s ILE 56 N -3.15 3.48 0.11 2.25 1.01 -1.26 -5.01 121.20 118.64 1cly s ILE 56 Ca 0.04 -0.59 -0.05 0.00 0.00 0.00 0.00 60.65 60.04 1cly s ILE 56 Cb 0.07 -2.66 -0.02 0.00 0.01 0.00 0.00 42.46 39.86 1cly s ILE 56 CO 0.73 0.31 0.14 0.42 0.00 0.00 0.00 174.94 176.54 1cly s THR 57 N 1.47 0.12 0.09 2.92 -4.23 -1.26 -0.12 115.64 114.63 1cly s THR 57 Ca 0.04 -1.56 -0.24 0.00 -1.18 0.00 0.00 61.69 58.75 1cly s THR 57 Cb -0.15 -1.71 0.07 0.00 1.34 0.00 0.00 72.50 72.04 1cly s THR 57 CO -0.02 -0.56 0.60 -0.62 -0.54 0.00 0.00 174.62 173.48 1cly s ASP 58 N -2.95 -0.56 0.07 3.99 -1.08 -1.14 -5.01 116.67 109.99 1cly s ASP 58 Ca 0.14 0.18 -0.10 0.00 -0.52 0.00 0.00 52.55 52.25 1cly s ASP 58 Cb 0.06 0.56 0.01 0.00 -1.46 0.00 0.00 42.92 42.09 1cly s ASP 58 CO -0.04 -0.84 0.22 -0.31 0.52 0.00 0.00 175.17 174.71 1cly s TYR 59 N -2.97 0.06 0.43 -5.34 1.51 -1.26 -2.86 117.35 106.92 1cly s TYR 59 Ca -0.03 -0.38 -0.23 0.00 -1.01 0.00 0.00 57.07 55.43 1cly s TYR 59 Cb -0.01 -0.01 -0.09 0.00 -0.11 0.00 0.00 41.96 41.75 1cly s TYR 59 CO -0.06 -0.51 1.05 -1.25 -1.11 0.00 0.00 175.55 173.67 1cly s PRO 60 N -3.27 4.04 0.40 -1.71 0.04 -1.26 -4.74 135.00 128.51 1cly s PRO 60 Ca 0.00 1.48 0.23 0.00 0.04 0.00 0.00 61.00 62.75 1cly s PRO 60 Cb 0.02 -2.41 1.25 0.00 0.04 0.00 0.00 34.50 33.40 1cly s PRO 60 CO -0.08 -0.24 1.67 -0.44 0.04 0.00 0.00 177.00 177.95 1cly h ASP 61 N 2.21 0.37 -0.06 6.66 5.19 -1.97 0.90 116.42 129.71 1cly h ASP 61 Ca -0.49 0.14 0.02 0.00 -0.62 0.00 0.00 57.03 56.08 1cly h ASP 61 Cb 1.22 0.10 -0.00 0.00 0.18 0.00 0.00 39.33 40.83 1cly h ASP 61 CO 0.61 -0.11 0.13 0.71 -3.12 0.00 0.00 179.24 177.46 1cly h THR 62 N 0.23 0.25 0.00 0.35 1.35 -1.99 -2.22 112.91 110.87 1cly h THR 62 Ca 0.74 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.60 1cly h THR 62 Cb 2.05 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 69.35 1cly h THR 62 CO -0.45 0.00 0.00 0.52 -0.25 0.00 0.00 175.52 175.34 1cly n VAL 63 N -3.42 0.02 -2.05 6.82 0.31 0.18 -5.01 118.33 115.19 1cly n VAL 63 Ca -0.01 -0.33 -0.43 0.00 -0.01 0.00 0.00 64.34 63.56 1cly n VAL 63 Cb 0.21 1.34 -0.03 0.00 -0.91 0.00 0.00 33.84 34.46 1cly n VAL 63 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1cly s LYS 64 N -0.02 4.01 0.00 5.55 2.20 -0.44 -2.11 119.74 128.94 1cly s LYS 64 Ca 0.00 1.98 0.00 0.00 -0.36 0.00 0.00 55.97 57.59 1cly s LYS 64 Cb 0.00 -4.01 0.00 0.00 -1.51 0.00 0.00 37.83 32.31 1cly s LYS 64 CO 0.00 -1.04 0.00 0.41 -0.36 0.00 0.00 175.35 174.36 1cly n GLY 65 N 4.35 2.57 0.08 5.54 0.00 -1.26 -4.82 105.19 111.65 1cly n GLY 65 Ca 0.18 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.14 1cly n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cly n ARG 66 N -0.34 0.67 -4.09 1.61 1.74 -1.09 -4.95 116.66 110.22 1cly n ARG 66 Ca 0.00 0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.81 1cly n ARG 66 Cb 0.00 -1.56 -0.06 0.00 -1.02 0.00 0.00 32.46 29.81 1cly n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1cly s PHE 67 N -2.70 3.11 -0.11 -1.55 0.40 -0.90 -1.10 117.98 115.14 1cly s PHE 67 Ca -0.09 -0.01 -0.04 0.00 -0.60 0.00 0.00 56.93 56.19 1cly s PHE 67 Cb 0.08 -1.52 0.05 0.00 0.51 0.00 0.00 43.02 42.14 1cly s PHE 67 CO 0.84 0.52 0.23 0.99 0.70 0.00 0.00 175.22 178.49 1cly s THR 68 N -1.64 -0.24 -0.07 0.64 2.01 0.04 -4.88 115.64 111.50 1cly s THR 68 Ca 0.30 0.25 -0.08 0.00 0.31 0.00 0.00 61.69 62.47 1cly s THR 68 Cb -0.11 -0.37 -0.04 0.00 0.01 0.00 0.00 72.50 71.99 1cly s THR 68 CO 0.22 0.10 0.21 -0.51 -0.69 0.00 0.00 174.62 173.95 1cly s ILE 69 N 1.95 5.39 0.15 1.82 2.07 -1.26 0.26 121.20 131.59 1cly s ILE 69 Ca -0.02 0.28 -0.09 0.00 -1.41 0.00 0.00 60.65 59.41 1cly s ILE 69 Cb -0.12 -3.49 -0.01 0.00 0.13 0.00 0.00 42.46 38.98 1cly s ILE 69 CO -0.08 0.55 0.27 -0.94 -1.91 0.00 0.00 174.94 172.84 1cly s SER 70 N -1.20 0.05 -0.03 4.50 1.04 -0.08 -4.98 113.70 113.00 1cly s SER 70 Ca 0.19 -0.83 -0.12 0.00 0.48 0.00 0.00 55.95 55.67 1cly s SER 70 Cb -0.13 0.42 0.02 0.00 0.10 0.00 0.00 66.02 66.43 1cly s SER 70 CO 0.08 -0.87 0.27 0.00 0.98 0.00 0.00 173.24 173.70 1cly s ARG 71 N -3.95 0.57 -0.49 4.02 1.70 -1.26 0.70 118.95 120.24 1cly s ARG 71 Ca 0.15 -0.14 0.04 0.00 -0.47 0.00 0.00 55.73 55.31 1cly s ARG 71 Cb 0.03 0.25 0.13 0.00 -0.57 0.00 0.00 34.95 34.79 1cly s ARG 71 CO -0.02 -0.14 0.23 0.34 -1.08 0.00 0.00 175.30 174.63 1cly s ASP 72 N -1.08 4.32 0.53 -2.89 2.15 -0.02 -4.94 116.67 114.72 1cly s ASP 72 Ca -0.11 -2.86 0.26 0.00 0.43 0.00 0.00 52.55 50.27 1cly s ASP 72 Cb -0.05 -1.58 1.39 0.00 -0.30 0.00 0.00 42.92 42.38 1cly s ASP 72 CO 0.03 -0.26 1.98 0.78 -0.17 0.00 0.00 175.17 177.53 1cly h ASN 73 N 6.68 0.02 -0.35 -0.34 2.35 -1.94 -0.30 115.58 121.70 1cly h ASN 73 Ca -0.07 0.00 0.01 0.00 -0.55 0.00 0.00 56.30 55.69 1cly h ASN 73 Cb 0.91 -0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.26 1cly h ASN 73 CO 0.65 0.01 0.22 0.00 -1.65 0.00 0.00 177.43 176.66 1cly h ALA 74 N 1.70 0.45 -0.58 -0.83 0.00 -1.94 -2.94 119.26 115.12 1cly h ALA 74 Ca 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1cly h ALA 74 Cb 1.10 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1cly h ALA 74 CO -0.01 -0.12 0.00 1.63 0.00 0.00 0.00 179.25 180.75 1cly n LYS 75 N -4.87 3.23 -4.03 0.00 5.02 -0.64 -4.97 118.16 111.90 1cly n LYS 75 Ca -0.00 -2.66 -0.33 0.00 -2.02 0.00 0.00 58.31 53.30 1cly n LYS 75 Cb 0.04 -1.68 0.01 0.00 -0.02 0.00 0.00 35.03 33.38 1cly n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1cly n ASN 76 N 1.01 -4.21 -4.48 4.39 3.02 -0.22 -4.81 115.26 109.97 1cly n ASN 76 Ca 0.22 -0.87 -0.25 0.00 -0.03 0.00 0.00 54.58 53.65 1cly n ASN 76 Cb 0.73 -3.46 -0.10 0.00 -0.61 0.00 0.00 39.78 36.34 1cly n ASN 76 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1cly s SER 77 N -3.32 3.71 -0.02 6.41 0.01 -1.06 -0.92 113.70 118.52 1cly s SER 77 Ca 0.69 -0.88 0.04 0.00 1.31 0.00 0.00 55.95 57.11 1cly s SER 77 Cb -0.36 -0.39 -0.01 0.00 0.21 0.00 0.00 66.02 65.48 1cly s SER 77 CO 0.87 0.07 -0.14 -0.22 0.41 0.00 0.00 173.24 174.23 1cly s LEU 78 N -3.15 1.96 0.16 2.44 2.96 0.71 -0.84 118.68 122.91 1cly s LEU 78 Ca 0.26 -0.27 0.09 0.00 -0.22 0.00 0.00 54.13 53.99 1cly s LEU 78 Cb -0.07 -0.77 -0.04 0.00 0.50 0.00 0.00 46.19 45.81 1cly s LEU 78 CO 0.14 0.16 -0.19 -0.31 -1.32 0.00 0.00 176.35 174.82 1cly s TYR 79 N -0.17 1.85 -0.21 5.38 2.02 0.22 0.38 117.35 126.81 1cly s TYR 79 Ca 0.02 -0.45 -0.02 0.00 -0.37 0.00 0.00 57.07 56.25 1cly s TYR 79 Cb -0.07 -0.94 0.07 0.00 -0.40 0.00 0.00 41.96 40.61 1cly s TYR 79 CO 0.00 0.32 0.04 -1.17 -1.57 0.00 0.00 175.55 173.17 1cly s LEU 80 N -2.52 1.40 -0.15 -1.29 2.96 0.20 -0.90 118.68 118.38 1cly s LEU 80 Ca 0.14 -0.96 -0.22 0.00 -0.22 0.00 0.00 54.13 52.88 1cly s LEU 80 Cb -0.07 -0.67 -0.03 0.00 0.50 0.00 0.00 46.19 45.93 1cly s LEU 80 CO 0.06 -0.32 0.64 -1.58 -1.32 0.00 0.00 176.35 173.84 1cly s GLN 81 N 1.80 4.30 -0.11 1.98 2.00 0.14 -1.39 119.66 128.39 1cly s GLN 81 Ca 0.00 0.70 0.03 0.00 -2.00 0.00 0.00 55.36 54.09 1cly s GLN 81 Cb -0.17 -3.52 -0.00 0.00 0.80 0.00 0.00 33.01 30.12 1cly s GLN 81 CO -0.10 -0.10 -0.22 -1.64 -0.50 0.00 0.00 175.29 172.72 1cly s MET 82 N 1.41 3.10 0.07 1.67 -1.94 0.13 -0.78 119.30 122.96 1cly s MET 82 Ca 0.32 -0.85 0.02 0.00 -1.71 0.00 0.00 55.69 53.47 1cly s MET 82 Cb -0.16 -2.36 -0.03 0.00 2.01 0.00 0.00 34.83 34.29 1cly s MET 82 CO 0.13 0.17 -0.08 -1.12 -0.01 0.00 0.00 175.02 174.11 1cly s SER 82 N 0.37 1.08 -1.46 3.03 0.01 -0.26 -0.86 113.70 115.61 1cly s SER 82 Ca -0.17 -0.73 -0.08 0.00 1.31 0.00 0.00 55.95 56.27 1cly s SER 82 Cb -0.18 0.04 0.03 0.00 0.21 0.00 0.00 66.02 66.13 1cly s SER 82 CO 0.08 -0.29 0.85 0.54 0.41 0.00 0.00 173.24 174.84 1cly n ARG 82 N 0.85 -5.87 -1.55 12.44 1.74 -0.26 -4.63 116.66 119.37 1cly n ARG 82 Ca -0.18 0.78 -0.44 0.00 -0.77 0.00 0.00 57.85 57.24 1cly n ARG 82 Cb 0.57 -5.70 -0.01 0.00 -1.02 0.00 0.00 32.46 26.30 1cly n ARG 82 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1cly n LEU 82 N -4.44 1.37 -4.63 0.55 4.77 -1.01 -4.48 117.00 109.13 1cly n LEU 82 Ca -0.03 1.11 -0.24 0.00 -0.03 0.00 0.00 56.01 56.82 1cly n LEU 82 Cb 0.58 -1.24 -0.08 0.00 -2.33 0.00 0.00 43.42 40.34 1cly n LEU 82 CO 0.58 -1.79 -0.31 -0.54 -1.33 0.00 0.00 177.39 174.01 1cly s LYS 83 N -1.58 2.13 0.35 3.23 1.02 -1.26 -0.19 119.74 123.44 1cly s LYS 83 Ca 0.60 -1.65 0.07 0.00 0.02 0.00 0.00 55.97 55.02 1cly s LYS 83 Cb -0.68 -2.00 0.65 0.00 -0.52 0.00 0.00 37.83 35.28 1cly s LYS 83 CO 0.59 0.20 1.85 0.66 -0.92 0.00 0.00 175.35 177.73 1cly h SER 84 N 1.83 0.31 0.20 2.83 4.64 -1.95 -1.83 113.55 119.58 1cly h SER 84 Ca -0.43 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 60.80 1cly h SER 84 Cb 1.25 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1cly h SER 84 CO 0.64 0.50 -0.07 1.05 -0.87 0.00 0.00 176.83 178.08 1cly h GLU 85 N 0.29 0.00 0.00 4.77 4.11 -1.95 -0.83 114.58 120.97 1cly h GLU 85 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.48 1cly h GLU 85 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1cly h GLU 85 CO 0.03 0.07 0.00 -0.25 0.07 0.00 0.00 179.01 178.93 1cly n ASP 86 N -3.75 0.00 -4.64 3.06 8.00 -0.69 -4.74 116.55 113.79 1cly n ASP 86 Ca -0.02 -0.49 -0.43 0.00 0.71 0.00 0.00 54.79 54.56 1cly n ASP 86 Cb 0.17 -0.05 -0.03 0.00 -0.02 0.00 0.00 41.12 41.20 1cly n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1cly s THR 87 N -2.09 3.56 0.00 -3.53 2.01 -0.32 -4.89 115.64 110.38 1cly s THR 87 Ca 0.26 0.65 -0.18 0.00 0.31 0.00 0.00 61.69 62.74 1cly s THR 87 Cb 0.13 -3.51 0.06 0.00 0.01 0.00 0.00 72.50 69.19 1cly s THR 87 CO 0.23 -0.16 0.81 0.00 -0.69 0.00 0.00 174.62 174.80 1cly n ALA 88 N 8.09 -2.26 -2.58 7.40 0.00 -0.58 -4.37 120.51 126.22 1cly n ALA 88 Ca 0.19 -0.54 -0.38 0.00 0.00 0.00 0.00 53.44 52.71 1cly n ALA 88 Cb 0.44 0.13 -0.11 0.00 0.00 0.00 0.00 19.45 19.91 1cly n ALA 88 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1cly s MET 89 N -2.01 3.88 -0.27 0.00 -2.45 -0.55 -0.94 119.30 116.95 1cly s MET 89 Ca 0.19 -0.36 -0.10 0.00 -1.25 0.00 0.00 55.69 54.17 1cly s MET 89 Cb -0.01 -3.68 -0.04 0.00 1.25 0.00 0.00 34.83 32.35 1cly s MET 89 CO 0.00 -0.23 0.15 0.71 1.05 0.00 0.00 175.02 176.71 1cly s TYR 90 N 1.76 3.18 0.10 4.11 1.51 -0.78 -1.25 117.35 125.98 1cly s TYR 90 Ca 0.07 -0.07 0.06 0.00 -1.01 0.00 0.00 57.07 56.12 1cly s TYR 90 Cb -0.16 -2.34 -0.04 0.00 -0.11 0.00 0.00 41.96 39.31 1cly s TYR 90 CO 0.11 -0.23 -0.05 0.71 -1.11 0.00 0.00 175.55 174.98 1cly s TYR 91 N 1.71 2.86 0.07 2.71 1.51 0.15 -2.13 117.35 124.22 1cly s TYR 91 Ca 0.07 -0.10 0.06 0.00 -1.01 0.00 0.00 57.07 56.09 1cly s TYR 91 Cb -0.16 -1.47 -0.04 0.00 -0.11 0.00 0.00 41.96 40.18 1cly s TYR 91 CO 0.09 0.46 -0.12 0.00 -1.11 0.00 0.00 175.55 174.86 1cly s ALA 93 N -1.10 0.17 0.04 0.00 0.00 -0.69 -1.43 121.76 118.76 1cly s ALA 93 Ca 0.19 -0.86 0.06 0.00 0.00 0.00 0.00 51.96 51.35 1cly s ALA 93 Cb -0.11 0.30 -0.02 0.00 0.00 0.00 0.00 23.12 23.28 1cly s ALA 93 CO 0.10 -0.37 -0.18 0.50 0.00 0.00 0.00 175.76 175.82 1cly s ARG 94 N -3.34 1.18 0.00 0.00 3.00 0.00 -1.73 118.95 118.05 1cly s ARG 94 Ca 0.01 -0.87 0.00 0.00 -1.00 0.00 0.00 55.73 53.87 1cly s ARG 94 Cb 0.03 -1.25 0.00 0.00 0.00 0.00 0.00 34.95 33.73 1cly s ARG 94 CO -0.08 0.31 0.00 0.41 0.00 0.00 0.00 175.30 175.94 1cly n GLY 95 N 1.83 2.21 3.01 8.12 0.00 -1.03 -1.08 105.19 118.25 1cly n GLY 95 Ca -0.18 -1.89 -0.19 0.00 0.00 0.00 0.00 46.02 43.77 1cly n GLY 95 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1cly s LEU 96 N 0.00 1.94 0.46 0.99 1.43 -0.60 -4.63 118.68 118.28 1cly s LEU 96 Ca 0.00 -0.17 0.17 0.00 -1.03 0.00 0.00 54.13 53.11 1cly s LEU 96 Cb 0.00 -0.48 1.14 0.00 0.03 0.00 0.00 46.19 46.88 1cly s LEU 96 CO 0.00 0.10 1.97 -2.24 0.23 0.00 0.00 176.35 176.41 1cly h ASP 97 N 6.06 0.27 -0.13 2.29 2.03 -1.98 -2.19 116.42 122.76 1cly h ASP 97 Ca -0.31 0.01 0.04 0.00 -0.73 0.00 0.00 57.03 56.03 1cly h ASP 97 Cb 1.18 -0.04 -0.01 0.00 -0.83 0.00 0.00 39.33 39.63 1cly h ASP 97 CO 0.49 0.15 0.11 -0.78 -1.03 0.00 0.00 179.24 178.18 1cly h ASP 98 N 0.29 0.00 0.00 4.15 3.58 -2.05 -3.45 116.42 118.94 1cly h ASP 98 Ca 0.29 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.74 1cly h ASP 98 Cb 0.75 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.80 1cly h ASP 98 CO -0.07 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.90 1cly n GLY 99 N -1.49 0.75 3.04 -0.78 0.00 -0.83 -5.15 105.19 100.73 1cly n GLY 99 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1cly n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cly s ALA 100 N -0.71 0.81 -0.02 4.61 0.00 -1.20 -4.99 121.76 120.26 1cly s ALA 100 Ca 0.00 -0.43 -0.00 0.00 0.00 0.00 0.00 51.96 51.53 1cly s ALA 100 Cb 0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 23.12 22.92 1cly s ALA 100 CO 0.00 0.19 -0.00 -1.49 0.00 0.00 0.00 175.76 174.46 1cly h TRP 100 N 5.85 0.00 -2.68 0.00 6.55 -1.91 -1.58 115.95 122.18 1cly h TRP 100 Ca -0.31 0.00 -0.68 0.00 0.95 0.00 0.00 58.89 58.85 1cly h TRP 100 Cb 1.18 0.00 -0.37 0.00 -0.86 0.00 0.00 29.16 29.11 1cly h TRP 100 CO 0.41 0.00 -0.11 1.19 -1.05 0.00 0.00 178.44 178.88 1cly n PHE 100 N -2.50 3.38 0.08 0.49 3.72 -1.26 -2.48 117.46 118.89 1cly n PHE 100 Ca -0.00 -3.73 -0.06 0.00 -0.05 0.00 0.00 57.45 53.61 1cly n PHE 100 Cb 0.00 -0.88 -0.04 0.00 -0.94 0.00 0.00 39.48 37.62 1cly n PHE 100 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1cly h ALA 101 N 4.97 0.51 -3.14 4.37 0.00 -1.36 -3.44 119.26 121.18 1cly h ALA 101 Ca 0.19 -0.82 -0.58 0.00 0.00 0.00 0.00 54.91 53.70 1cly h ALA 101 Cb 0.68 -0.14 -0.36 0.00 0.00 0.00 0.00 17.79 17.97 1cly h ALA 101 CO 0.97 1.13 -0.82 0.71 0.00 0.00 0.00 179.25 181.24 1cly s TYR 102 N -2.94 1.93 0.12 0.00 2.02 -0.41 -4.98 117.35 113.09 1cly s TYR 102 Ca 0.00 -1.05 0.06 0.00 -0.37 0.00 0.00 57.07 55.72 1cly s TYR 102 Cb 0.11 -1.47 -0.04 0.00 -0.40 0.00 0.00 41.96 40.16 1cly s TYR 102 CO 0.81 -0.61 -0.03 -1.58 -1.57 0.00 0.00 175.55 172.56 1cly s TRP 103 N 1.55 2.87 0.00 2.71 0.52 -1.26 -0.82 118.94 124.52 1cly s TRP 103 Ca 0.05 -0.10 0.00 0.00 0.02 0.00 0.00 56.10 56.07 1cly s TRP 103 Cb -0.13 -1.46 0.00 0.00 -1.15 0.00 0.00 33.47 30.74 1cly s TRP 103 CO -0.10 0.48 0.00 0.41 0.02 0.00 0.00 176.95 177.76 1cly n GLY 104 N 0.38 0.33 0.10 0.98 0.00 -0.51 -4.56 105.19 101.91 1cly n GLY 104 Ca -0.11 -1.59 -0.11 0.00 0.00 0.00 0.00 46.02 44.21 1cly n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cly n GLN 105 N 0.00 0.68 0.00 1.61 10.64 -1.26 -4.94 117.38 124.11 1cly n GLN 105 Ca 0.00 0.05 0.00 0.00 -1.83 0.00 0.00 57.00 55.22 1cly n GLN 105 Cb 0.00 -1.56 0.00 0.00 -0.86 0.00 0.00 30.24 27.82 1cly n GLN 105 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1cly n GLY 106 N 1.78 1.48 2.71 2.61 0.00 -1.26 -5.01 105.19 107.50 1cly n GLY 106 Ca -0.32 -1.75 -0.20 0.00 0.00 0.00 0.00 46.02 43.75 1cly n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1cly s THR 107 N -2.63 -0.01 -0.24 2.61 -1.32 -0.91 -4.78 115.64 108.36 1cly s THR 107 Ca 0.00 0.34 -0.29 0.00 -1.21 0.00 0.00 61.69 60.53 1cly s THR 107 Cb 0.00 -0.20 0.01 0.00 -1.51 0.00 0.00 72.50 70.80 1cly s THR 107 CO 0.00 0.18 1.04 -0.22 -2.21 0.00 0.00 174.62 173.41 1cly s LEU 108 N 1.93 4.08 -0.32 9.08 2.96 -1.26 -1.87 118.68 133.28 1cly s LEU 108 Ca 0.02 1.33 -0.08 0.00 -0.22 0.00 0.00 54.13 55.19 1cly s LEU 108 Cb -0.12 -3.53 0.01 0.00 0.50 0.00 0.00 46.19 43.05 1cly s LEU 108 CO -0.03 -0.69 0.12 -0.69 -1.32 0.00 0.00 176.35 173.73 1cly s VAL 109 N 3.25 4.16 -0.18 1.68 1.01 -0.12 -3.39 120.40 126.81 1cly s VAL 109 Ca 0.44 -0.73 -0.12 0.00 0.00 0.00 0.00 61.98 61.58 1cly s VAL 109 Cb -0.15 -3.20 -0.05 0.00 0.00 0.00 0.00 36.38 32.99 1cly s VAL 109 CO 0.07 -0.01 0.20 -0.89 0.00 0.00 0.00 175.10 174.47 1cly s THR 110 N 1.52 5.37 -0.54 3.92 2.01 -0.41 -1.52 115.64 125.99 1cly s THR 110 Ca 0.02 0.34 0.01 0.00 0.31 0.00 0.00 61.69 62.38 1cly s THR 110 Cb -0.18 -3.54 0.14 0.00 0.01 0.00 0.00 72.50 68.93 1cly s THR 110 CO 0.04 0.42 0.30 -0.69 -0.69 0.00 0.00 174.62 174.00 1cly s VAL 111 N 0.42 2.99 0.24 3.82 1.01 -1.26 -2.30 120.40 125.32 1cly s VAL 111 Ca 0.12 -3.06 -0.10 0.00 0.00 0.00 0.00 61.98 58.93 1cly s VAL 111 Cb -0.12 -3.03 -0.01 0.00 0.00 0.00 0.00 36.38 33.22 1cly s VAL 111 CO 0.01 -0.81 0.40 -0.94 0.00 0.00 0.00 175.10 173.76 1cly s SER 112 N 0.24 -0.04 0.00 3.32 1.04 -1.01 -4.36 113.70 112.90 1cly s SER 112 Ca 0.16 -1.02 0.18 0.00 0.48 0.00 0.00 55.95 55.74 1cly s SER 112 Cb -0.23 0.54 0.55 0.00 0.10 0.00 0.00 66.02 66.98 1cly s SER 112 CO -0.02 -1.07 1.43 1.33 0.98 0.00 0.00 173.24 175.88 1cly n VAL 113 N -0.36 0.39 -0.94 5.02 0.24 -1.26 -3.90 118.33 117.53 1cly n VAL 113 Ca -0.01 -0.48 -0.30 0.00 -2.04 0.00 0.00 64.34 61.51 1cly n VAL 113 Cb 0.63 0.40 0.24 0.00 -1.47 0.00 0.00 33.84 33.63 1cly n VAL 113 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1cly s ALA 114 N -1.61 0.35 -0.08 2.33 0.00 -1.26 -5.06 121.76 116.43 1cly s ALA 114 Ca 0.31 -0.77 0.04 0.00 0.00 0.00 0.00 51.96 51.55 1cly s ALA 114 Cb 0.17 -2.96 -0.01 0.00 0.00 0.00 0.00 23.12 20.31 1cly s ALA 114 CO 0.24 -3.65 -0.22 -1.12 0.00 0.00 0.00 175.76 171.01 1cly s SER 115 N -3.59 3.34 0.19 0.00 0.01 -1.26 -5.05 113.70 107.35 1cly s SER 115 Ca 0.69 -0.45 -0.32 0.00 1.31 0.00 0.00 55.95 57.18 1cly s SER 115 Cb -0.13 -1.06 -0.12 0.00 0.21 0.00 0.00 66.02 64.92 1cly s SER 115 CO 0.57 0.23 1.75 -0.89 0.41 0.00 0.00 173.24 175.31 1cly s THR 116 N -0.07 2.10 -0.02 1.44 2.01 -1.26 -4.73 115.64 115.11 1cly s THR 116 Ca -0.06 0.01 -0.01 0.00 0.31 0.00 0.00 61.69 61.94 1cly s THR 116 Cb -0.14 -3.00 0.02 0.00 0.01 0.00 0.00 72.50 69.38 1cly s THR 116 CO 0.04 0.00 0.05 -0.75 -0.69 0.00 0.00 174.62 173.27 1cly s LYS 117 N 1.47 0.01 0.72 4.92 2.20 0.30 -4.97 119.74 124.39 1cly s LYS 117 Ca 0.76 0.16 -0.11 0.00 -0.36 0.00 0.00 55.97 56.42 1cly s LYS 117 Cb -0.49 -0.13 0.02 0.00 -1.51 0.00 0.00 37.83 35.71 1cly s LYS 117 CO 0.33 -0.10 1.07 0.20 -0.36 0.00 0.00 175.35 176.48 1cly s GLY 118 N 0.68 1.66 0.18 5.54 0.00 -1.26 -2.11 107.32 112.01 1cly s GLY 118 Ca -0.05 0.01 -0.06 0.00 0.00 0.00 0.00 44.72 44.62 1cly s GLY 118 CO -0.02 0.34 0.44 2.56 0.00 0.00 0.00 173.10 176.42 1cly s PRO 119 N -5.08 3.66 -0.49 2.90 0.04 -1.24 -4.40 135.00 130.39 1cly s PRO 119 Ca 0.59 -0.01 -0.15 0.00 0.04 0.00 0.00 61.00 61.46 1cly s PRO 119 Cb -0.14 -2.78 0.09 0.00 0.04 0.00 0.00 34.50 31.71 1cly s PRO 119 CO 0.55 0.40 0.42 -1.12 0.04 0.00 0.00 177.00 177.29 1cly s SER 120 N -2.54 6.11 -0.79 6.66 0.01 0.14 -4.91 113.70 118.37 1cly s SER 120 Ca 0.43 -1.50 -0.25 0.00 1.31 0.00 0.00 55.95 55.93 1cly s SER 120 Cb -0.12 -2.17 -0.01 0.00 0.21 0.00 0.00 66.02 63.94 1cly s SER 120 CO 0.25 -0.71 1.69 -0.69 0.41 0.00 0.00 173.24 174.19 1cly s VAL 121 N 1.60 3.56 0.32 3.43 1.01 -1.26 -2.16 120.40 126.90 1cly s VAL 121 Ca 0.04 -0.08 -0.00 0.00 0.00 0.00 0.00 61.98 61.93 1cly s VAL 121 Cb -0.26 -4.36 -0.04 0.00 0.00 0.00 0.00 36.38 31.72 1cly s VAL 121 CO 0.05 -1.30 0.53 -0.36 0.00 0.00 0.00 175.10 174.02 1cly s PHE 122 N 7.94 3.50 0.49 5.22 0.08 0.45 -4.91 117.98 130.74 1cly s PHE 122 Ca 0.57 0.39 0.07 0.00 0.12 0.00 0.00 56.93 58.08 1cly s PHE 122 Cb -0.08 -1.92 0.04 0.00 -0.57 0.00 0.00 43.02 40.49 1cly s PHE 122 CO 0.08 0.16 0.67 -2.14 -0.10 0.00 0.00 175.22 173.89 1cly s PRO 123 N -4.10 2.61 -0.27 0.24 0.02 -1.26 0.36 135.00 132.61 1cly s PRO 123 Ca 0.40 -1.22 -0.01 0.00 0.02 0.00 0.00 61.00 60.19 1cly s PRO 123 Cb -0.10 -2.66 0.08 0.00 0.02 0.00 0.00 34.50 31.84 1cly s PRO 123 CO 0.34 -0.53 0.05 -0.51 -0.33 0.00 0.00 177.00 176.02 1cly s LEU 124 N -4.53 2.19 -0.22 -5.54 1.43 -0.08 -4.59 118.68 107.34 1cly s LEU 124 Ca 0.57 -1.36 -0.24 0.00 -1.03 0.00 0.00 54.13 52.07 1cly s LEU 124 Cb -0.09 -0.91 -0.01 0.00 0.03 0.00 0.00 46.19 45.21 1cly s LEU 124 CO 0.36 -0.35 0.80 0.00 0.23 0.00 0.00 176.35 177.39 1cly s ALA 125 N 1.59 3.61 -0.33 4.21 0.00 -1.26 -3.93 121.76 125.65 1cly s ALA 125 Ca 0.04 -0.13 -0.05 0.00 0.00 0.00 0.00 51.96 51.83 1cly s ALA 125 Cb -0.18 -3.23 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 1cly s ALA 125 CO -0.16 -0.83 3.04 -0.35 0.00 0.00 0.00 175.76 177.46 1cly n PRO 126 N 5.75 2.32 -0.21 0.00 -0.04 -1.26 -4.78 135.00 136.78 1cly n PRO 126 Ca 0.04 -1.94 -0.05 0.00 -0.04 0.00 0.00 63.50 61.52 1cly n PRO 126 Cb 0.48 -2.11 0.01 0.00 -0.04 0.00 0.00 33.50 31.84 1cly n PRO 126 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1cly h SER 127 N 3.04 -1.10 0.00 3.54 4.64 -1.90 -3.44 113.55 118.32 1cly h SER 127 Ca 0.34 0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.88 1cly h SER 127 Cb 0.96 0.56 0.00 0.00 -0.31 0.00 0.00 62.40 63.61 1cly h SER 127 CO 0.69 -0.30 0.00 -1.54 -0.87 0.00 0.00 176.83 174.81 1cly n SER 128 N -5.44 0.00 -3.31 4.97 3.41 -1.26 -4.97 113.62 107.03 1cly n SER 128 Ca 0.05 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.33 1cly n SER 128 Cb 0.36 0.15 -0.02 0.00 -0.26 0.00 0.00 64.21 64.43 1cly n SER 128 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1cly n LYS 129 N -1.74 2.81 0.00 4.33 4.76 -1.26 -2.10 118.16 124.95 1cly n LYS 129 Ca 0.00 -1.89 0.00 0.00 -2.87 0.00 0.00 58.31 53.55 1cly n LYS 129 Cb 0.00 -2.70 0.00 0.00 -1.84 0.00 0.00 35.03 30.49 1cly n LYS 129 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1cly n SER 130 N 4.30 0.00 -4.58 4.39 3.41 -1.26 -5.05 113.62 114.84 1cly n SER 130 Ca 0.60 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.83 1cly n SER 130 Cb 0.21 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.14 1cly n SER 130 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1cly s THR 133 N -0.06 3.93 -2.00 6.66 -4.23 -0.89 -4.49 115.64 114.55 1cly s THR 133 Ca 0.00 -1.58 0.18 0.00 -1.18 0.00 0.00 61.69 59.11 1cly s THR 133 Cb 0.00 -4.99 0.51 0.00 1.34 0.00 0.00 72.50 69.35 1cly s THR 133 CO 0.00 -1.69 1.48 -1.20 -0.54 0.00 0.00 174.62 172.67 1cly n SER 134 N 10.37 0.00 0.00 3.99 7.64 -1.24 -4.92 113.62 129.46 1cly n SER 134 Ca 0.47 -0.73 0.00 0.00 1.01 0.00 0.00 58.87 59.62 1cly n SER 134 Cb 0.46 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.66 1cly n SER 134 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1cly n GLY 135 N 0.27 -0.00 1.95 0.23 0.00 -1.26 -4.91 105.19 101.47 1cly n GLY 135 Ca 0.13 -0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 1cly n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cly n GLY 136 N 0.00 5.70 3.65 -0.02 0.00 -1.26 -4.61 105.19 108.65 1cly n GLY 136 Ca 0.00 -2.06 -0.04 0.00 0.00 0.00 0.00 46.02 43.91 1cly n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cly s THR 137 N -4.25 0.00 0.14 2.61 2.01 -1.26 -2.83 115.64 112.06 1cly s THR 137 Ca 0.55 0.00 -0.09 0.00 0.31 0.00 0.00 61.69 62.47 1cly s THR 137 Cb 0.45 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.95 1cly s THR 137 CO 0.02 0.00 0.25 0.00 -0.69 0.00 0.00 174.62 174.19 1cly s ALA 138 N 0.26 -0.03 0.14 7.40 0.00 -0.21 -3.59 121.76 125.73 1cly s ALA 138 Ca 0.04 -0.83 0.06 0.00 0.00 0.00 0.00 51.96 51.23 1cly s ALA 138 Cb -0.05 0.75 -0.04 0.00 0.00 0.00 0.00 23.12 23.78 1cly s ALA 138 CO -0.12 -0.60 0.03 0.00 0.00 0.00 0.00 175.76 175.07 1cly s ALA 139 N -3.94 3.32 0.19 0.00 0.00 -1.26 -0.31 121.76 119.76 1cly s ALA 139 Ca 0.14 -1.24 -0.23 0.00 0.00 0.00 0.00 51.96 50.63 1cly s ALA 139 Cb 0.04 -1.15 0.05 0.00 0.00 0.00 0.00 23.12 22.06 1cly s ALA 139 CO -0.03 0.57 0.70 -0.48 0.00 0.00 0.00 175.76 176.52 1cly s LEU 140 N -2.75 -0.40 0.00 0.00 0.05 0.15 -4.66 118.68 111.08 1cly s LEU 140 Ca 0.28 -0.27 -0.02 0.00 0.05 0.00 0.00 54.13 54.17 1cly s LEU 140 Cb -0.10 2.56 0.01 0.00 -2.05 0.00 0.00 46.19 46.60 1cly s LEU 140 CO 0.20 -1.08 0.09 0.61 -0.55 0.00 0.00 176.35 175.62 1cly n GLY 141 N -0.41 0.51 3.16 -3.48 0.00 -1.25 -0.22 105.19 103.51 1cly n GLY 141 Ca -0.10 -0.83 -0.29 0.00 0.00 0.00 0.00 46.02 44.79 1cly n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cly s LEU 143 N 0.32 4.60 -0.86 0.00 2.96 0.16 -2.68 118.68 123.18 1cly s LEU 143 Ca -0.14 -0.39 -0.21 0.00 -0.22 0.00 0.00 54.13 53.17 1cly s LEU 143 Cb -0.16 -2.52 0.09 0.00 0.50 0.00 0.00 46.19 44.10 1cly s LEU 143 CO 0.06 -0.59 1.14 -0.69 -1.32 0.00 0.00 176.35 174.96 1cly s VAL 144 N 2.37 4.42 0.15 1.68 1.01 -0.65 -0.42 120.40 128.96 1cly s VAL 144 Ca 0.16 -0.99 -0.04 0.00 0.00 0.00 0.00 61.98 61.12 1cly s VAL 144 Cb -0.16 -4.81 -0.05 0.00 0.00 0.00 0.00 36.38 31.36 1cly s VAL 144 CO 0.15 -1.59 0.36 -0.75 0.00 0.00 0.00 175.10 173.28 1cly s LYS 145 N 3.63 3.59 -0.04 2.72 2.47 -0.92 -2.17 119.74 129.02 1cly s LYS 145 Ca 0.32 -0.16 -0.02 0.00 -1.56 0.00 0.00 55.97 54.56 1cly s LYS 145 Cb -0.08 -2.86 0.01 0.00 -1.46 0.00 0.00 37.83 33.44 1cly s LYS 145 CO -0.03 0.47 0.03 -0.25 0.16 0.00 0.00 175.35 175.73 1cly n ASP 146 N -0.02 -6.49 -3.55 1.43 8.00 -1.08 -0.69 116.55 114.15 1cly n ASP 146 Ca -0.03 0.94 -0.11 0.00 0.71 0.00 0.00 54.79 56.30 1cly n ASP 146 Cb 0.52 -2.18 -0.03 0.00 -0.02 0.00 0.00 41.12 39.40 1cly n ASP 146 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1cly s TYR 147 N -0.31 -0.34 -0.29 1.24 -0.85 -1.03 -3.60 117.35 112.18 1cly s TYR 147 Ca -0.04 0.06 -0.25 0.00 -0.52 0.00 0.00 57.07 56.32 1cly s TYR 147 Cb 0.00 0.40 0.16 0.00 0.38 0.00 0.00 41.96 42.90 1cly s TYR 147 CO 0.14 -0.78 1.23 0.12 -1.52 0.00 0.00 175.55 174.74 1cly s PHE 148 N -3.79 -0.27 0.37 -3.49 2.19 -0.90 -0.74 117.98 111.36 1cly s PHE 148 Ca 0.03 0.65 -0.04 0.00 0.33 0.00 0.00 56.93 57.90 1cly s PHE 148 Cb 0.00 0.41 0.08 0.00 -1.31 0.00 0.00 43.02 42.21 1cly s PHE 148 CO -0.12 -0.13 0.51 -0.35 1.83 0.00 0.00 175.22 176.96 1cly n PRO 149 N 1.96 -0.15 -1.70 10.12 -0.04 -1.26 -0.54 135.00 143.39 1cly n PRO 149 Ca -0.12 -1.02 -0.31 0.00 -0.04 0.00 0.00 63.50 62.02 1cly n PRO 149 Cb 0.56 -0.45 0.05 0.00 -0.04 0.00 0.00 33.50 33.62 1cly n PRO 149 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1cly s GLN 150 N -3.92 2.96 0.42 0.54 -1.52 -1.26 -4.80 119.66 112.08 1cly s GLN 150 Ca 0.31 0.77 0.08 0.00 -1.95 0.00 0.00 55.36 54.56 1cly s GLN 150 Cb -0.01 -2.01 -0.02 0.00 -0.22 0.00 0.00 33.01 30.75 1cly s GLN 150 CO 0.21 -1.03 0.35 -1.25 -0.25 0.00 0.00 175.29 173.32 1cly s PRO 151 N -5.15 2.49 -0.06 2.91 0.04 -1.26 -4.93 135.00 129.04 1cly s PRO 151 Ca 0.58 -1.58 0.02 0.00 0.04 0.00 0.00 61.00 60.05 1cly s PRO 151 Cb -0.13 -2.32 0.02 0.00 0.04 0.00 0.00 34.50 32.11 1cly s PRO 151 CO 0.54 -0.19 -0.10 0.08 0.04 0.00 0.00 177.00 177.37 1cly s VAL 152 N -2.49 0.98 -0.13 -0.36 1.01 -1.26 -4.52 120.40 113.63 1cly s VAL 152 Ca 0.47 -0.37 -0.06 0.00 0.00 0.00 0.00 61.98 62.01 1cly s VAL 152 Cb -0.02 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 1cly s VAL 152 CO 0.27 0.32 0.10 -0.89 0.00 0.00 0.00 175.10 174.91 1cly s THR 153 N 0.80 5.20 0.02 3.92 2.01 -0.31 -4.95 115.64 122.35 1cly s THR 153 Ca -0.12 0.10 0.06 0.00 0.31 0.00 0.00 61.69 62.03 1cly s THR 153 Cb -0.15 -3.27 -0.02 0.00 0.01 0.00 0.00 72.50 69.07 1cly s THR 153 CO 0.02 0.58 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.67 1cly s VAL 154 N -0.71 1.37 0.10 3.82 1.01 -1.26 -0.58 120.40 124.15 1cly s VAL 154 Ca 0.13 -0.98 -0.01 0.00 0.00 0.00 0.00 61.98 61.12 1cly s VAL 154 Cb -0.12 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 1cly s VAL 154 CO 0.03 0.19 0.03 -0.55 0.00 0.00 0.00 175.10 174.80 1cly s SER 156 N -0.92 0.36 -0.08 3.32 0.15 -0.78 -4.95 113.70 110.81 1cly s SER 156 Ca 0.05 -1.13 0.03 0.00 0.70 0.00 0.00 55.95 55.60 1cly s SER 156 Cb -0.08 0.27 0.01 0.00 -1.71 0.00 0.00 66.02 64.51 1cly s SER 156 CO 0.01 -0.69 -0.16 0.26 1.20 0.00 0.00 173.24 173.86 1cly s TRP 157 N -4.00 1.84 -1.65 3.44 0.52 -1.26 -0.56 118.94 117.26 1cly s TRP 157 Ca 0.18 -0.72 -0.16 0.00 0.02 0.00 0.00 56.10 55.42 1cly s TRP 157 Cb 0.08 -1.29 0.13 0.00 -1.15 0.00 0.00 33.47 31.23 1cly s TRP 157 CO -0.02 -0.34 0.79 0.09 0.02 0.00 0.00 176.95 177.49 1cly n ASN 162 N 3.76 -3.30 -4.06 2.95 3.02 0.30 -0.98 115.26 116.93 1cly n ASN 162 Ca -0.21 -0.97 -0.30 0.00 -0.03 0.00 0.00 54.58 53.07 1cly n ASN 162 Cb 0.52 -2.98 -0.02 0.00 -0.61 0.00 0.00 39.78 36.69 1cly n ASN 162 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1cly n SER 163 N -2.72 -1.68 0.00 6.41 7.64 -1.26 -0.62 113.62 121.39 1cly n SER 163 Ca 0.04 -1.00 0.00 0.00 1.01 0.00 0.00 58.87 58.92 1cly n SER 163 Cb 0.51 -2.96 0.00 0.00 -1.01 0.00 0.00 64.21 60.75 1cly n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1cly n GLY 164 N -1.77 0.73 2.25 0.23 0.00 -0.16 -4.94 105.19 101.53 1cly n GLY 164 Ca -0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 1cly n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cly n ALA 165 N -0.99 5.95 -2.72 4.61 0.00 0.21 -4.35 120.51 123.21 1cly n ALA 165 Ca 0.00 -2.88 -0.02 0.00 0.00 0.00 0.00 53.44 50.54 1cly n ALA 165 Cb 0.00 -1.69 0.02 0.00 0.00 0.00 0.00 19.45 17.79 1cly n ALA 165 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1cly s LEU 166 N -3.03 -0.53 0.00 0.00 2.96 -1.20 -4.76 118.68 112.12 1cly s LEU 166 Ca 0.52 -0.56 0.00 0.00 -0.22 0.00 0.00 54.13 53.86 1cly s LEU 166 Cb 0.40 0.70 0.00 0.00 0.50 0.00 0.00 46.19 47.79 1cly s LEU 166 CO -0.06 -0.03 0.00 0.35 -1.32 0.00 0.00 176.35 175.29 1cly n THR 167 N 2.90 0.00 -1.88 3.68 -2.24 -1.26 -4.49 114.28 110.99 1cly n THR 167 Ca 0.12 0.38 -0.42 0.00 -2.27 0.00 0.00 64.05 61.86 1cly n THR 167 Cb 0.63 -1.28 -0.03 0.00 -2.10 0.00 0.00 70.33 67.55 1cly n THR 167 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1cly s SER 168 N -2.95 6.53 0.00 3.42 0.01 -1.26 -2.39 113.70 117.07 1cly s SER 168 Ca 0.00 2.67 0.00 0.00 1.31 0.00 0.00 55.95 59.93 1cly s SER 168 Cb 0.00 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.64 1cly s SER 168 CO 0.00 -0.87 0.00 0.61 0.41 0.00 0.00 173.24 173.39 1cly n GLY 169 N 3.84 2.45 3.70 3.44 0.00 -1.26 -4.99 105.19 112.37 1cly n GLY 169 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1cly n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cly s VAL 171 N -2.29 3.43 -0.47 1.61 1.01 -1.00 -3.43 120.40 119.24 1cly s VAL 171 Ca 0.00 0.92 0.03 0.00 0.00 0.00 0.00 61.98 62.93 1cly s VAL 171 Cb 0.00 -3.59 0.13 0.00 0.00 0.00 0.00 36.38 32.92 1cly s VAL 171 CO 0.00 0.03 0.25 -1.00 0.00 0.00 0.00 175.10 174.38 1cly s HIS 172 N 1.96 2.45 -0.34 5.22 3.76 0.29 -4.99 115.29 123.64 1cly s HIS 172 Ca 0.66 -2.72 -0.16 0.00 -0.15 0.00 0.00 55.06 52.69 1cly s HIS 172 Cb -0.35 -2.24 -0.01 0.00 1.11 0.00 0.00 32.58 31.09 1cly s HIS 172 CO 0.29 -0.76 0.40 -0.08 -0.85 0.00 0.00 174.74 173.74 1cly s THR 173 N 0.07 5.13 0.46 1.30 -1.32 -1.26 0.36 115.64 120.37 1cly s THR 173 Ca 0.18 0.15 -0.20 0.00 -1.21 0.00 0.00 61.69 60.61 1cly s THR 173 Cb -0.24 -3.85 -0.10 0.00 -1.51 0.00 0.00 72.50 66.79 1cly s THR 173 CO -0.00 -0.11 0.97 -0.36 -2.21 0.00 0.00 174.62 172.90 1cly s PHE 174 N 2.12 3.29 0.49 9.09 0.40 0.71 -4.98 117.98 129.10 1cly s PHE 174 Ca 0.14 1.58 -0.21 0.00 -0.60 0.00 0.00 56.93 57.84 1cly s PHE 174 Cb -0.16 -2.87 -0.07 0.00 0.51 0.00 0.00 43.02 40.43 1cly s PHE 174 CO 0.12 -0.26 1.10 -1.25 0.70 0.00 0.00 175.22 175.62 1cly s PRO 175 N -3.37 3.68 0.63 0.24 0.04 -1.26 -4.42 135.00 130.54 1cly s PRO 175 Ca 0.62 1.54 -0.19 0.00 0.04 0.00 0.00 61.00 63.02 1cly s PRO 175 Cb -0.10 -2.17 -0.02 0.00 0.04 0.00 0.00 34.50 32.24 1cly s PRO 175 CO 0.18 -0.56 1.27 0.00 0.04 0.00 0.00 177.00 177.92 1cly n ALA 176 N -0.88 1.12 -3.53 8.56 0.00 -1.26 -4.82 120.51 119.70 1cly n ALA 176 Ca 0.09 0.02 -0.31 0.00 0.00 0.00 0.00 53.44 53.25 1cly n ALA 176 Cb 0.51 -2.31 -0.17 0.00 0.00 0.00 0.00 19.45 17.48 1cly n ALA 176 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1cly s VAL 177 N -1.38 1.83 -0.79 0.00 1.01 -0.41 -4.94 120.40 115.72 1cly s VAL 177 Ca 0.80 -0.86 -0.26 0.00 0.00 0.00 0.00 61.98 61.66 1cly s VAL 177 Cb -0.39 -1.63 0.03 0.00 0.00 0.00 0.00 36.38 34.39 1cly s VAL 177 CO 0.42 0.51 1.39 -0.22 0.00 0.00 0.00 175.10 177.21 1cly s LEU 178 N 0.72 3.24 0.00 3.92 2.96 -1.26 -2.22 118.68 126.04 1cly s LEU 178 Ca -0.11 -0.57 -0.22 0.00 -0.22 0.00 0.00 54.13 53.01 1cly s LEU 178 Cb -0.16 -2.56 0.34 0.00 0.50 0.00 0.00 46.19 44.31 1cly s LEU 178 CO 0.02 -1.86 0.76 0.00 -1.32 0.00 0.00 176.35 173.95 1cly n GLN 179 N 9.25 -4.32 -0.17 1.98 6.02 0.11 -4.88 117.38 125.37 1cly n GLN 179 Ca 0.12 -1.28 -0.10 0.00 -0.01 0.00 0.00 57.00 55.73 1cly n GLN 179 Cb 0.50 -1.72 0.03 0.00 1.02 0.00 0.00 30.24 30.06 1cly n GLN 179 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1cly h SER 180 N -3.45 1.00 0.01 1.08 4.64 -1.94 -2.89 113.55 112.01 1cly h SER 180 Ca -0.35 -0.34 0.00 0.00 -0.47 0.00 0.00 61.79 60.63 1cly h SER 180 Cb 1.17 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.98 1cly h SER 180 CO 0.21 1.13 0.00 -1.20 -0.87 0.00 0.00 176.83 176.10 1cly n SER 182 N -4.14 0.17 0.00 4.97 7.64 -1.26 -4.72 113.62 116.28 1cly n SER 182 Ca 0.01 0.58 0.00 0.00 1.01 0.00 0.00 58.87 60.47 1cly n SER 182 Cb 0.41 -0.60 0.00 0.00 -1.01 0.00 0.00 64.21 63.01 1cly n SER 182 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1cly n GLY 183 N -1.41 0.71 3.71 0.23 0.00 -1.09 -5.04 105.19 102.29 1cly n GLY 183 Ca -0.00 -0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 1cly n GLY 183 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1cly s LEU 184 N 0.00 3.62 0.52 0.99 2.01 -1.26 -4.90 118.68 119.67 1cly s LEU 184 Ca 0.00 0.05 -0.04 0.00 0.01 0.00 0.00 54.13 54.15 1cly s LEU 184 Cb 0.00 -2.05 -0.01 0.00 0.01 0.00 0.00 46.19 44.14 1cly s LEU 184 CO 0.00 0.29 0.81 -0.31 1.01 0.00 0.00 176.35 178.15 1cly s TYR 185 N -1.09 3.36 -0.22 0.29 2.02 0.08 0.09 117.35 121.88 1cly s TYR 185 Ca 0.20 0.62 -0.26 0.00 -0.37 0.00 0.00 57.07 57.25 1cly s TYR 185 Cb -0.12 -2.50 0.07 0.00 -0.40 0.00 0.00 41.96 39.02 1cly s TYR 185 CO 0.10 -0.54 0.72 -1.54 -1.57 0.00 0.00 175.55 172.72 1cly s SER 186 N -4.22 -0.72 0.10 2.29 1.04 -0.94 -2.46 113.70 108.79 1cly s SER 186 Ca 0.50 1.27 -0.20 0.00 0.48 0.00 0.00 55.95 58.00 1cly s SER 186 Cb -0.10 1.24 0.05 0.00 0.10 0.00 0.00 66.02 67.31 1cly s SER 186 CO 0.44 -0.33 0.49 -1.48 0.98 0.00 0.00 173.24 173.33 1cly s LEU 187 N 0.01 0.01 0.07 2.42 0.05 -0.92 -1.29 118.68 119.02 1cly s LEU 187 Ca -0.02 -0.06 0.09 0.00 0.05 0.00 0.00 54.13 54.18 1cly s LEU 187 Cb -0.04 2.11 -0.03 0.00 -2.05 0.00 0.00 46.19 46.19 1cly s LEU 187 CO 0.03 -0.83 -0.24 -0.44 -0.55 0.00 0.00 176.35 174.32 1cly s SER 188 N -2.47 2.93 -0.29 1.48 0.01 -1.26 -1.63 113.70 112.46 1cly s SER 188 Ca -0.01 -0.61 0.02 0.00 1.31 0.00 0.00 55.95 56.67 1cly s SER 188 Cb 0.00 -0.24 0.08 0.00 0.21 0.00 0.00 66.02 66.08 1cly s SER 188 CO -0.08 0.20 0.00 -0.55 0.41 0.00 0.00 173.24 173.21 1cly s SER 189 N -1.43 4.35 0.20 2.44 0.15 -1.09 -0.21 113.70 118.10 1cly s SER 189 Ca 0.10 -1.68 0.06 0.00 0.70 0.00 0.00 55.95 55.14 1cly s SER 189 Cb -0.10 -1.37 -0.04 0.00 -1.71 0.00 0.00 66.02 62.80 1cly s SER 189 CO 0.03 -0.31 0.18 -0.69 1.20 0.00 0.00 173.24 173.65 1cly s VAL 190 N 1.18 4.57 -0.02 4.45 1.01 0.16 -2.66 120.40 129.09 1cly s VAL 190 Ca 0.03 -1.18 -0.11 0.00 0.00 0.00 0.00 61.98 60.72 1cly s VAL 190 Cb -0.19 -3.40 0.02 0.00 0.00 0.00 0.00 36.38 32.81 1cly s VAL 190 CO -0.10 -0.22 0.24 0.54 0.00 0.00 0.00 175.10 175.57 1cly s VAL 191 N -1.91 0.06 -0.14 2.92 0.11 0.70 0.10 120.40 122.24 1cly s VAL 191 Ca 0.32 -0.47 -0.02 0.00 -2.93 0.00 0.00 61.98 58.88 1cly s VAL 191 Cb -0.09 -0.51 -0.02 0.00 -1.53 0.00 0.00 36.38 34.23 1cly s VAL 191 CO 0.25 -0.26 -0.08 0.42 -3.33 0.00 0.00 175.10 172.10 1cly s THR 192 N -1.10 3.56 0.01 5.04 -4.23 -1.22 -0.67 115.64 117.03 1cly s THR 192 Ca -0.12 -0.48 -0.00 0.00 -1.18 0.00 0.00 61.69 59.91 1cly s THR 192 Cb -0.06 -2.53 -0.01 0.00 1.34 0.00 0.00 72.50 71.24 1cly s THR 192 CO 0.03 0.51 -0.02 0.68 -0.54 0.00 0.00 174.62 175.28 1cly s VAL 193 N 0.25 0.08 0.01 2.29 -7.23 0.58 -4.88 120.40 111.50 1cly s VAL 193 Ca -0.05 -0.65 -0.35 0.00 -1.81 0.00 0.00 61.98 59.12 1cly s VAL 193 Cb -0.15 -0.19 -0.14 0.00 0.56 0.00 0.00 36.38 36.47 1cly s VAL 193 CO 0.04 -0.36 1.68 -2.65 -0.31 0.00 0.00 175.10 173.50 1cly n PRO 194 N 2.02 1.94 -0.23 4.82 -0.02 -1.26 -1.05 135.00 141.23 1cly n PRO 194 Ca -0.21 0.71 0.31 0.00 -2.02 0.00 0.00 63.50 62.30 1cly n PRO 194 Cb 0.56 -2.48 0.72 0.00 -0.02 0.00 0.00 33.50 32.28 1cly n PRO 194 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1cly h SER 195 N 7.15 0.00 0.54 2.55 0.02 -1.78 0.31 113.55 122.35 1cly h SER 195 Ca -0.47 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.41 1cly h SER 195 Cb 1.28 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.81 1cly h SER 195 CO 0.91 0.00 -0.35 0.28 -1.14 0.00 0.00 176.83 176.52 1cly h SER 196 N 0.00 0.00 0.11 3.07 0.02 -1.87 -3.09 113.55 111.79 1cly h SER 196 Ca 0.48 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.36 1cly h SER 196 Cb 2.09 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.61 1cly h SER 196 CO -0.01 0.35 -0.25 0.28 -1.14 0.00 0.00 176.83 176.06 1cly h SER 197 N 0.00 0.24 -1.95 3.07 0.02 -0.73 -3.46 113.55 110.74 1cly h SER 197 Ca -0.00 -0.07 -0.63 0.00 -0.84 0.00 0.00 61.79 60.25 1cly h SER 197 Cb 0.72 -0.06 0.12 0.00 0.14 0.00 0.00 62.40 63.31 1cly h SER 197 CO 0.05 0.50 -0.28 0.18 -1.14 0.00 0.00 176.83 176.14 1cly n LEU 198 N -4.16 0.11 0.00 5.07 4.77 -1.17 -0.99 117.00 120.63 1cly n LEU 198 Ca -0.01 1.07 0.00 0.00 -0.03 0.00 0.00 56.01 57.04 1cly n LEU 198 Cb 0.36 -1.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.34 1cly n LEU 198 CO 0.40 -2.46 0.00 0.61 -1.33 0.00 0.00 177.39 174.61 1cly n GLY 199 N 1.68 1.80 0.26 -0.72 0.00 -1.26 -4.54 105.19 102.41 1cly n GLY 199 Ca 0.13 -0.50 -0.14 0.00 0.00 0.00 0.00 46.02 45.52 1cly n GLY 199 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1cly h THR 200 N 0.00 0.52 -2.08 2.61 2.02 -1.89 -3.34 112.91 110.74 1cly h THR 200 Ca 0.00 0.00 -0.51 0.00 0.77 0.00 0.00 66.41 66.67 1cly h THR 200 Cb 0.00 0.52 -0.05 0.00 -1.74 0.00 0.00 68.15 66.88 1cly h THR 200 CO 0.00 0.00 1.25 -1.10 0.37 0.00 0.00 175.52 176.04 1cly s GLN 203 N -6.09 2.81 -0.24 6.66 -1.52 -0.16 -4.93 119.66 116.20 1cly s GLN 203 Ca -0.16 0.31 -0.29 0.00 -1.95 0.00 0.00 55.36 53.28 1cly s GLN 203 Cb 0.07 -4.33 0.00 0.00 -0.22 0.00 0.00 33.01 28.52 1cly s GLN 203 CO 0.65 -2.55 1.17 0.95 -0.25 0.00 0.00 175.29 175.26 1cly s THR 205 N 7.99 4.41 -0.23 -0.19 -4.23 -1.26 -4.65 115.64 117.48 1cly s THR 205 Ca 0.57 1.67 -0.06 0.00 -1.18 0.00 0.00 61.69 62.69 1cly s THR 205 Cb -0.11 -4.19 -0.02 0.00 1.34 0.00 0.00 72.50 69.52 1cly s THR 205 CO 0.18 -0.27 0.01 -0.31 -0.54 0.00 0.00 174.62 173.69 1cly s TYR 206 N 3.61 3.03 -0.02 3.99 2.02 -1.25 -4.89 117.35 123.84 1cly s TYR 206 Ca 0.50 -0.61 0.02 0.00 -0.37 0.00 0.00 57.07 56.61 1cly s TYR 206 Cb -0.17 -2.15 0.01 0.00 -0.40 0.00 0.00 41.96 39.24 1cly s TYR 206 CO 0.14 -0.40 -0.06 0.96 -1.57 0.00 0.00 175.55 174.63 1cly s ILE 207 N 1.41 0.51 -0.18 2.71 -4.36 -1.26 0.93 121.20 120.97 1cly s ILE 207 Ca 0.05 -0.21 -0.06 0.00 -0.26 0.00 0.00 60.65 60.17 1cly s ILE 207 Cb -0.15 -0.47 -0.03 0.00 1.25 0.00 0.00 42.46 43.05 1cly s ILE 207 CO 0.01 0.17 0.03 0.00 0.24 0.00 0.00 174.94 175.39 1cly s ASN 209 N 0.44 5.74 0.36 0.00 0.02 0.27 -0.76 114.94 121.01 1cly s ASN 209 Ca 0.01 -1.83 -0.14 0.00 -1.02 0.00 0.00 52.86 49.87 1cly s ASN 209 Cb -0.13 -2.03 -0.08 0.00 0.02 0.00 0.00 41.25 39.03 1cly s ASN 209 CO 0.01 -0.68 0.77 -0.69 0.02 0.00 0.00 177.10 176.53 1cly s VAL 210 N 1.39 4.68 -0.22 1.60 1.01 0.14 -1.86 120.40 127.15 1cly s VAL 210 Ca 0.05 0.90 -0.04 0.00 0.00 0.00 0.00 61.98 62.89 1cly s VAL 210 Cb -0.26 -3.65 0.11 0.00 0.00 0.00 0.00 36.38 32.58 1cly s VAL 210 CO 0.00 -0.31 0.38 0.21 0.00 0.00 0.00 175.10 175.38 1cly s ASN 211 N -2.55 0.08 -0.75 3.32 3.04 0.25 -1.82 114.94 116.51 1cly s ASN 211 Ca 0.54 0.53 0.04 0.00 0.04 0.00 0.00 52.86 54.01 1cly s ASN 211 Cb -0.10 1.16 0.20 0.00 -1.54 0.00 0.00 41.25 40.96 1cly s ASN 211 CO 0.22 -0.27 0.62 1.57 -3.04 0.00 0.00 177.10 176.19 1cly n HIS 212 N 5.37 3.52 -0.32 0.43 -0.00 -0.25 -1.16 115.22 122.82 1cly n HIS 212 Ca -0.06 -4.22 0.19 0.00 -0.00 0.00 0.00 57.72 53.64 1cly n HIS 212 Cb 0.50 -0.74 0.40 0.00 -0.00 0.00 0.00 29.99 30.14 1cly n HIS 212 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.34 177.21 1cly h LYS 213 N 5.33 0.22 0.00 1.57 1.57 -1.79 -0.98 116.57 122.49 1cly h LYS 213 Ca 0.16 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1cly h LYS 213 Cb 0.75 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.01 1cly h LYS 213 CO 0.78 0.15 0.05 -2.30 -0.57 0.00 0.00 179.45 177.56 1cly n PRO 214 N -5.17 0.00 -0.35 3.15 -0.02 -1.26 -0.98 135.00 130.37 1cly n PRO 214 Ca 0.27 0.30 0.01 0.00 -2.02 0.00 0.00 63.50 62.07 1cly n PRO 214 Cb 0.87 -1.55 0.01 0.00 -0.02 0.00 0.00 33.50 32.81 1cly n PRO 214 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1cly n SER 215 N -1.28 0.19 -2.10 2.55 3.41 -0.40 -4.92 113.62 111.06 1cly n SER 215 Ca 0.00 -1.83 -0.12 0.00 -0.26 0.00 0.00 58.87 56.66 1cly n SER 215 Cb 0.05 -0.16 -0.02 0.00 -0.26 0.00 0.00 64.21 63.81 1cly n SER 215 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1cly n ASN 216 N -0.10 -3.56 -4.64 4.04 5.15 -0.16 -4.92 115.26 111.08 1cly n ASN 216 Ca 0.01 0.23 -0.41 0.00 -0.60 0.00 0.00 54.58 53.81 1cly n ASN 216 Cb 0.64 -3.13 -0.05 0.00 -0.53 0.00 0.00 39.78 36.71 1cly n ASN 216 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1cly s THR 217 N -2.40 4.87 -0.35 -0.44 2.01 -1.08 -4.99 115.64 113.25 1cly s THR 217 Ca 0.00 1.43 0.01 0.00 0.31 0.00 0.00 61.69 63.44 1cly s THR 217 Cb 0.00 -4.08 0.11 0.00 0.01 0.00 0.00 72.50 68.54 1cly s THR 217 CO 0.00 -0.07 0.12 -0.54 -0.69 0.00 0.00 174.62 173.45 1cly s LYS 218 N 2.78 1.04 -0.02 4.92 1.02 -1.26 -1.09 119.74 127.12 1cly s LYS 218 Ca 0.33 -1.50 0.04 0.00 0.02 0.00 0.00 55.97 54.86 1cly s LYS 218 Cb -0.15 -2.37 -0.03 0.00 -0.52 0.00 0.00 37.83 34.76 1cly s LYS 218 CO 0.08 -1.02 -0.12 0.14 -0.92 0.00 0.00 175.35 173.51 1cly s VAL 219 N 1.13 3.25 0.14 3.17 -7.23 -0.76 -5.01 120.40 115.09 1cly s VAL 219 Ca 0.12 -0.78 0.10 0.00 -1.81 0.00 0.00 61.98 59.61 1cly s VAL 219 Cb -0.19 -2.33 -0.04 0.00 0.56 0.00 0.00 36.38 34.37 1cly s VAL 219 CO -0.15 0.50 -0.23 -1.81 -0.31 0.00 0.00 175.10 173.10 1cly s ASP 220 N -1.03 3.03 -0.17 4.85 1.11 -1.26 0.26 116.67 123.46 1cly s ASP 220 Ca 0.13 -0.77 -0.08 0.00 0.18 0.00 0.00 52.55 52.01 1cly s ASP 220 Cb -0.11 -0.20 0.06 0.00 1.07 0.00 0.00 42.92 43.75 1cly s ASP 220 CO 0.03 0.10 0.38 -0.75 1.18 0.00 0.00 175.17 176.12 1cly s LYS 221 N -2.25 0.34 -0.24 8.23 2.47 0.06 -4.97 119.74 123.39 1cly s LYS 221 Ca 0.13 0.81 -0.18 0.00 -1.56 0.00 0.00 55.97 55.17 1cly s LYS 221 Cb -0.09 0.04 -0.03 0.00 -1.46 0.00 0.00 37.83 36.29 1cly s LYS 221 CO 0.06 -0.19 0.51 0.50 0.16 0.00 0.00 175.35 176.39 1cly s ARG 222 N 1.71 4.11 0.02 4.03 3.52 -1.26 0.06 118.95 131.14 1cly s ARG 222 Ca -0.07 0.34 -0.06 0.00 -0.13 0.00 0.00 55.73 55.80 1cly s ARG 222 Cb -0.10 -3.62 -0.05 0.00 -1.56 0.00 0.00 34.95 29.63 1cly s ARG 222 CO -0.12 -0.27 0.27 0.14 -0.81 0.00 0.00 175.30 174.52 1cly s VAL 223 N 2.03 5.29 0.30 7.11 -7.23 0.26 -4.96 120.40 123.21 1cly s VAL 223 Ca 0.22 0.14 -0.16 0.00 -1.81 0.00 0.00 61.98 60.36 1cly s VAL 223 Cb -0.15 -3.57 0.02 0.00 0.56 0.00 0.00 36.38 33.23 1cly s VAL 223 CO 0.09 0.33 0.66 -1.83 -0.31 0.00 0.00 175.10 174.05 1cly s GLU 226 N -1.85 1.85 0.00 4.82 -1.05 -1.26 -3.88 118.70 117.32 1cly s GLU 226 Ca 0.29 -1.22 0.00 0.00 -0.15 0.00 0.00 54.97 53.89 1cly s GLU 226 Cb -0.13 0.57 0.00 0.00 -0.44 0.00 0.00 34.13 34.13 1cly s GLU 226 CO 0.17 -0.83 0.38 -2.30 0.95 0.00 0.00 175.26 173.64