#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x50 s SER 2 N 0.00 6.67 0.48 1.61 0.01 -1.26 -5.04 113.70 116.17 1x50 s SER 2 Ca 0.00 -2.38 -0.22 0.00 1.31 0.00 0.00 55.95 54.66 1x50 s SER 2 Cb 0.00 -2.28 -0.07 0.00 0.21 0.00 0.00 66.02 63.88 1x50 s SER 2 CO 0.00 -0.78 1.13 -0.55 0.41 0.00 0.00 173.24 173.45 1x50 s SER 3 N 2.77 6.14 0.00 2.44 0.15 -1.26 -4.93 113.70 119.02 1x50 s SER 3 Ca 0.22 2.20 0.00 0.00 0.70 0.00 0.00 55.95 59.07 1x50 s SER 3 Cb -0.10 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.62 1x50 s SER 3 CO -0.08 -0.93 0.00 0.61 1.20 0.00 0.00 173.24 174.04 1x50 n GLY 4 N 0.29 3.29 3.58 9.45 0.00 -1.26 -4.98 105.19 115.56 1x50 n GLY 4 Ca 0.08 -1.81 -0.41 0.00 0.00 0.00 0.00 46.02 43.88 1x50 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x50 s SER 5 N 0.00 5.32 -0.04 1.61 1.04 -1.26 -4.92 113.70 115.45 1x50 s SER 5 Ca 0.00 1.31 -0.26 0.00 0.48 0.00 0.00 55.95 57.49 1x50 s SER 5 Cb 0.00 -2.52 0.05 0.00 0.10 0.00 0.00 66.02 63.66 1x50 s SER 5 CO 0.00 -2.16 0.56 -0.94 0.98 0.00 0.00 173.24 171.68 1x50 s SER 6 N 8.51 -0.51 0.00 7.02 1.04 -1.26 -5.12 113.70 123.38 1x50 s SER 6 Ca 0.89 0.54 0.00 0.00 0.48 0.00 0.00 55.95 57.86 1x50 s SER 6 Cb -0.23 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.38 1x50 s SER 6 CO 0.31 -0.55 0.00 0.61 0.98 0.00 0.00 173.24 174.59 1x50 n GLY 7 N 1.09 0.17 3.12 7.32 0.00 -1.26 -5.06 105.19 110.57 1x50 n GLY 7 Ca -0.20 -1.46 -0.10 0.00 0.00 0.00 0.00 46.02 44.26 1x50 n GLY 7 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1x50 s HIS 8 N -0.05 0.12 -0.59 1.61 3.76 -1.26 -5.06 115.29 113.83 1x50 s HIS 8 Ca 0.00 -0.33 0.01 0.00 -0.15 0.00 0.00 55.06 54.58 1x50 s HIS 8 Cb 0.00 -0.09 0.44 0.00 1.11 0.00 0.00 32.58 34.04 1x50 s HIS 8 CO 0.00 -0.35 1.78 0.94 -0.85 0.00 0.00 174.74 176.26 1x50 n GLN 9 N 1.00 2.96 -0.71 1.40 7.27 -1.26 -4.78 117.38 123.27 1x50 n GLN 9 Ca -0.20 -3.60 -0.05 0.00 0.07 0.00 0.00 57.00 53.21 1x50 n GLN 9 Cb 0.57 -2.28 -0.05 0.00 2.41 0.00 0.00 30.24 30.89 1x50 n GLN 9 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 1x50 n GLN 10 N -0.80 1.40 -3.76 3.69 6.02 -1.26 -4.80 117.38 117.88 1x50 n GLN 10 Ca 0.56 -0.47 -0.10 0.00 -0.01 0.00 0.00 57.00 56.99 1x50 n GLN 10 Cb 0.68 -1.38 -0.05 0.00 1.02 0.00 0.00 30.24 30.50 1x50 n GLN 10 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1x50 s LEU 11 N -0.16 0.67 -0.09 1.08 1.43 -1.26 -5.16 118.68 115.18 1x50 s LEU 11 Ca 0.24 -0.52 0.04 0.00 -1.03 0.00 0.00 54.13 52.87 1x50 s LEU 11 Cb 0.13 1.60 0.00 0.00 0.03 0.00 0.00 46.19 47.95 1x50 s LEU 11 CO -0.01 -0.87 -0.22 0.21 0.23 0.00 0.00 176.35 175.69 1x50 s ASN 12 N -2.86 2.89 0.07 2.29 2.47 -1.26 -5.12 114.94 113.43 1x50 s ASN 12 Ca 0.07 -0.52 -0.25 0.00 0.42 0.00 0.00 52.86 52.58 1x50 s ASN 12 Cb 0.02 -1.28 0.06 0.00 -1.45 0.00 0.00 41.25 38.61 1x50 s ASN 12 CO -0.08 0.15 0.60 -0.44 -3.72 0.00 0.00 177.10 173.60 1x50 s SER 13 N 0.35 -0.55 0.44 -4.21 0.01 -1.26 -5.17 113.70 103.31 1x50 s SER 13 Ca -0.17 0.23 -0.14 0.00 1.31 0.00 0.00 55.95 57.18 1x50 s SER 13 Cb -0.17 0.55 -0.08 0.00 0.21 0.00 0.00 66.02 66.54 1x50 s SER 13 CO 0.08 -0.81 0.86 -1.48 0.41 0.00 0.00 173.24 172.30 1x50 s LEU 14 N -2.14 3.78 1.15 2.44 0.05 -1.26 -5.07 118.68 117.64 1x50 s LEU 14 Ca -0.04 1.36 -0.17 0.00 0.05 0.00 0.00 54.13 55.32 1x50 s LEU 14 Cb -0.01 -4.25 0.26 0.00 -2.05 0.00 0.00 46.19 40.15 1x50 s LEU 14 CO -0.04 -0.45 1.10 -2.16 -0.55 0.00 0.00 176.35 174.26 1x50 s PRO 15 N -3.80 -0.84 1.05 1.48 0.04 -1.26 -5.01 135.00 126.67 1x50 s PRO 15 Ca 0.55 0.08 -0.14 0.00 0.04 0.00 0.00 61.00 61.53 1x50 s PRO 15 Cb -0.10 -1.63 0.20 0.00 0.04 0.00 0.00 34.50 33.01 1x50 s PRO 15 CO 0.29 -3.48 0.42 -2.37 0.04 0.00 0.00 177.00 171.89 1x50 n THR 16 N -4.63 0.00 -0.00 1.26 5.66 -1.26 -4.94 114.28 110.38 1x50 n THR 16 Ca 0.11 -0.03 0.01 0.00 -3.05 0.00 0.00 64.05 61.09 1x50 n THR 16 Cb 0.59 -0.55 0.02 0.00 -1.55 0.00 0.00 70.33 68.85 1x50 n THR 16 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 175.07 172.25 1x50 n MET 17 N -2.26 2.01 -0.28 1.09 0.00 -1.26 -5.05 117.12 111.37 1x50 n MET 17 Ca 0.07 -1.35 -0.10 0.00 0.00 0.00 0.00 57.70 56.31 1x50 n MET 17 Cb 0.37 -1.05 0.10 0.00 0.00 0.00 0.00 33.22 32.64 1x50 n MET 17 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 175.97 175.12 1x50 n GLU 18 N -0.19 -1.19 0.00 0.03 0.28 -1.26 -4.78 120.64 113.54 1x50 n GLU 18 Ca 0.02 -0.49 0.00 0.00 -0.16 0.00 0.00 57.16 56.53 1x50 n GLU 18 Cb 0.22 -0.92 0.00 0.00 1.43 0.00 0.00 31.44 32.18 1x50 n GLU 18 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1x50 n GLY 19 N -1.14 -0.73 3.70 -1.84 0.00 -1.26 -4.89 105.19 99.03 1x50 n GLY 19 Ca 0.05 -1.15 -0.29 0.00 0.00 0.00 0.00 46.02 44.62 1x50 n GLY 19 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x50 s PRO 20 N 0.00 1.01 1.22 1.61 0.04 -1.26 -5.05 135.00 132.56 1x50 s PRO 20 Ca 0.00 0.74 -0.20 0.00 0.04 0.00 0.00 61.00 61.58 1x50 s PRO 20 Cb 0.00 -1.79 0.29 0.00 0.04 0.00 0.00 34.50 33.05 1x50 s PRO 20 CO 0.00 -2.39 1.11 -1.25 0.04 0.00 0.00 177.00 174.51 1x50 s PRO 21 N -4.94 -1.34 0.34 0.56 0.04 -1.26 -5.05 135.00 123.35 1x50 s PRO 21 Ca 0.64 -0.11 -0.03 0.00 0.04 0.00 0.00 61.00 61.54 1x50 s PRO 21 Cb -0.18 -1.59 -0.04 0.00 0.04 0.00 0.00 34.50 32.73 1x50 s PRO 21 CO 0.57 -3.78 0.59 0.99 0.04 0.00 0.00 177.00 175.41 1x50 s THR 22 N -3.01 5.03 -0.09 1.26 2.01 -0.90 -5.02 115.64 114.93 1x50 s THR 22 Ca 0.71 -0.09 -0.10 0.00 0.31 0.00 0.00 61.69 62.52 1x50 s THR 22 Cb -0.09 -3.80 0.03 0.00 0.01 0.00 0.00 72.50 68.65 1x50 s THR 22 CO 0.56 -0.48 0.27 -0.36 -0.69 0.00 0.00 174.62 173.92 1x50 s PHE 23 N -2.27 -0.27 -1.12 4.92 0.40 -1.26 -3.52 117.98 114.86 1x50 s PHE 23 Ca 0.43 0.64 -0.05 0.00 -0.60 0.00 0.00 56.93 57.35 1x50 s PHE 23 Cb -0.10 0.09 0.01 0.00 0.51 0.00 0.00 43.02 43.53 1x50 s PHE 23 CO 0.34 -0.18 0.10 0.09 0.70 0.00 0.00 175.22 176.27 1x50 n ASN 24 N 2.67 -0.02 -4.77 1.36 4.13 -0.74 -4.84 115.26 113.05 1x50 n ASN 24 Ca -0.14 -0.97 -0.37 0.00 1.68 0.00 0.00 54.58 54.77 1x50 n ASN 24 Cb 0.58 -1.20 -0.01 0.00 -1.54 0.00 0.00 39.78 37.60 1x50 n ASN 24 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1x50 s PRO 25 N -6.44 3.83 1.04 3.52 0.04 -1.26 -5.02 135.00 130.72 1x50 s PRO 25 Ca 0.07 1.80 -0.17 0.00 0.04 0.00 0.00 61.00 62.74 1x50 s PRO 25 Cb -0.04 -2.48 0.26 0.00 0.04 0.00 0.00 34.50 32.28 1x50 s PRO 25 CO 0.75 -0.50 0.92 -0.35 0.04 0.00 0.00 177.00 177.87 1x50 n PRO 26 N -0.35 -2.81 -3.82 0.56 -0.04 -1.26 -4.57 135.00 122.71 1x50 n PRO 26 Ca 0.06 -1.47 -0.13 0.00 -0.04 0.00 0.00 63.50 61.93 1x50 n PRO 26 Cb 0.48 -1.38 -0.13 0.00 -0.04 0.00 0.00 33.50 32.42 1x50 n PRO 26 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1x50 s VAL 27 N -2.67 -0.01 0.42 0.52 1.01 -1.26 -3.11 120.40 115.30 1x50 s VAL 27 Ca 0.60 0.04 -0.25 0.00 0.00 0.00 0.00 61.98 62.37 1x50 s VAL 27 Cb -0.06 -0.16 -0.08 0.00 0.00 0.00 0.00 36.38 36.08 1x50 s VAL 27 CO 0.46 0.02 1.18 -2.16 0.00 0.00 0.00 175.10 174.60 1x50 s PRO 28 N 0.28 3.96 -0.31 2.72 0.04 -1.26 -5.06 135.00 135.38 1x50 s PRO 28 Ca -0.02 1.85 -0.15 0.00 0.04 0.00 0.00 61.00 62.73 1x50 s PRO 28 Cb -0.03 -2.61 -0.02 0.00 0.04 0.00 0.00 34.50 31.87 1x50 s PRO 28 CO -0.01 -0.40 0.38 -0.47 0.04 0.00 0.00 177.00 176.54 1x50 s TYR 29 N -1.43 3.22 -0.48 0.56 6.14 -0.60 -4.89 117.35 119.87 1x50 s TYR 29 Ca 0.59 0.21 -0.15 0.00 0.64 0.00 0.00 57.07 58.35 1x50 s TYR 29 Cb -0.31 -2.64 0.08 0.00 0.42 0.00 0.00 41.96 39.52 1x50 s TYR 29 CO 0.39 -0.34 0.41 -0.06 0.64 0.00 0.00 175.55 176.58 1x50 s PHE 30 N 2.07 3.25 -0.35 4.97 0.08 -1.26 -1.81 117.98 124.93 1x50 s PHE 30 Ca 0.14 -1.05 -0.07 0.00 0.12 0.00 0.00 56.93 56.07 1x50 s PHE 30 Cb -0.16 -3.28 0.04 0.00 -0.57 0.00 0.00 43.02 39.05 1x50 s PHE 30 CO 0.11 -0.85 0.13 0.20 -0.10 0.00 0.00 175.22 174.71 1x50 s GLY 31 N 2.77 1.87 -0.22 4.36 0.00 0.37 -4.99 107.32 111.46 1x50 s GLY 31 Ca 0.04 -1.81 -0.29 0.00 0.00 0.00 0.00 44.72 42.66 1x50 s GLY 31 CO 0.06 0.80 1.42 0.50 0.00 0.00 0.00 173.10 175.88 1x50 s ARG 32 N 1.41 3.97 -0.84 2.90 1.81 -1.26 -0.95 118.95 125.99 1x50 s ARG 32 Ca -0.01 1.55 -0.25 0.00 -1.72 0.00 0.00 55.73 55.31 1x50 s ARG 32 Cb -0.20 -3.91 0.01 0.00 -0.45 0.00 0.00 34.95 30.40 1x50 s ARG 32 CO 0.03 -1.06 1.60 -0.51 -0.68 0.00 0.00 175.30 174.68 1x50 s LEU 33 N 4.41 3.29 -0.80 2.53 1.43 -0.48 -4.76 118.68 124.30 1x50 s LEU 33 Ca 0.62 -0.66 -0.25 0.00 -1.03 0.00 0.00 54.13 52.81 1x50 s LEU 33 Cb -0.22 -2.56 -0.06 0.00 0.03 0.00 0.00 46.19 43.38 1x50 s LEU 33 CO 0.24 -2.05 2.05 -1.10 0.23 0.00 0.00 176.35 175.72 1x50 s GLN 34 N 6.04 2.35 0.00 1.70 -1.52 -1.26 -2.32 119.66 124.65 1x50 s GLN 34 Ca 0.53 0.15 0.00 0.00 -1.95 0.00 0.00 55.36 54.08 1x50 s GLN 34 Cb -0.06 -4.85 0.00 0.00 -0.22 0.00 0.00 33.01 27.88 1x50 s GLN 34 CO 0.05 -3.47 0.00 0.41 -0.25 0.00 0.00 175.29 172.03 1x50 n GLY 35 N 6.57 3.88 0.00 3.09 0.00 -1.26 -3.77 105.19 113.71 1x50 n GLY 35 Ca 0.38 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1x50 n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x50 n GLY 36 N 0.00 -0.48 3.53 -0.02 0.00 -0.98 -4.77 105.19 102.46 1x50 n GLY 36 Ca 0.00 -1.61 -0.29 0.00 0.00 0.00 0.00 46.02 44.12 1x50 n GLY 36 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x50 n LEU 37 N -1.04 0.96 -4.48 0.99 4.77 -0.92 -4.89 117.00 112.40 1x50 n LEU 37 Ca 0.00 -0.58 -0.30 0.00 -0.03 0.00 0.00 56.01 55.11 1x50 n LEU 37 Cb 0.00 -1.24 -0.12 0.00 -2.33 0.00 0.00 43.42 39.74 1x50 n LEU 37 CO 0.00 -1.59 -0.49 0.42 -1.33 0.00 0.00 177.39 174.40 1x50 s THR 38 N 9.75 2.83 0.65 -5.08 -4.23 -1.26 -4.00 115.64 114.30 1x50 s THR 38 Ca 1.13 -1.41 0.25 0.00 -1.18 0.00 0.00 61.69 60.48 1x50 s THR 38 Cb -0.57 -2.27 0.27 0.00 1.34 0.00 0.00 72.50 71.28 1x50 s THR 38 CO 0.34 0.17 1.75 0.00 -0.54 0.00 0.00 174.62 176.33 1x50 h ALA 39 N 3.96 1.65 -0.77 3.99 0.00 -1.64 0.54 119.26 127.00 1x50 h ALA 39 Ca -0.49 -0.00 -0.47 0.00 0.00 0.00 0.00 54.91 53.95 1x50 h ALA 39 Cb 1.16 0.01 -0.26 0.00 0.00 0.00 0.00 17.79 18.70 1x50 h ALA 39 CO 0.46 -0.56 0.28 0.54 0.00 0.00 0.00 179.25 179.97 1x50 n ARG 40 N -2.99 2.45 -4.88 0.00 5.12 -1.26 -4.62 116.66 110.47 1x50 n ARG 40 Ca 0.01 -3.32 -0.25 0.00 -1.93 0.00 0.00 57.85 52.36 1x50 n ARG 40 Cb 0.57 -2.12 -0.15 0.00 -1.16 0.00 0.00 32.46 29.60 1x50 n ARG 40 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 1x50 s ARG 41 N -3.48 1.49 -0.05 5.56 3.52 0.19 -4.48 118.95 121.70 1x50 s ARG 41 Ca 0.55 -0.66 -0.02 0.00 -0.13 0.00 0.00 55.73 55.47 1x50 s ARG 41 Cb 0.46 -1.44 0.03 0.00 -1.56 0.00 0.00 34.95 32.44 1x50 s ARG 41 CO 0.03 0.39 0.05 0.99 -0.81 0.00 0.00 175.30 175.96 1x50 s THR 42 N -0.43 -0.04 0.09 4.11 2.01 -1.26 -1.98 115.64 118.13 1x50 s THR 42 Ca 0.07 0.38 -0.16 0.00 0.31 0.00 0.00 61.69 62.28 1x50 s THR 42 Cb -0.07 -0.21 -0.07 0.00 0.01 0.00 0.00 72.50 72.16 1x50 s THR 42 CO -0.01 0.18 0.53 -0.63 -0.69 0.00 0.00 174.62 174.00 1x50 s ILE 43 N 2.14 4.85 -0.13 1.82 1.09 0.23 -0.38 121.20 130.82 1x50 s ILE 43 Ca 0.05 0.96 -0.02 0.00 -1.10 0.00 0.00 60.65 60.55 1x50 s ILE 43 Cb -0.12 -3.79 0.04 0.00 -1.06 0.00 0.00 42.46 37.53 1x50 s ILE 43 CO -0.03 0.42 -0.00 -0.63 -0.10 0.00 0.00 174.94 174.60 1x50 s ILE 44 N -1.26 0.59 -0.32 2.92 1.01 -1.13 0.24 121.20 123.25 1x50 s ILE 44 Ca 0.32 -0.27 -0.01 0.00 0.00 0.00 0.00 60.65 60.68 1x50 s ILE 44 Cb -0.17 -0.87 0.06 0.00 0.01 0.00 0.00 42.46 41.50 1x50 s ILE 44 CO 0.18 0.08 0.04 -0.63 0.00 0.00 0.00 174.94 174.60 1x50 s ILE 45 N 1.86 2.97 -0.34 2.92 1.01 0.25 -3.09 121.20 126.78 1x50 s ILE 45 Ca 0.02 -1.57 -0.06 0.00 0.00 0.00 0.00 60.65 59.04 1x50 s ILE 45 Cb -0.14 -2.80 0.05 0.00 0.01 0.00 0.00 42.46 39.57 1x50 s ILE 45 CO -0.07 -0.24 0.10 -0.54 0.00 0.00 0.00 174.94 174.20 1x50 s LYS 46 N 1.21 2.57 0.00 2.79 1.02 -0.36 -1.08 119.74 125.88 1x50 s LYS 46 Ca -0.02 -1.23 0.00 0.00 0.02 0.00 0.00 55.97 54.74 1x50 s LYS 46 Cb -0.20 -3.45 0.00 0.00 -0.52 0.00 0.00 37.83 33.66 1x50 s LYS 46 CO -0.02 -0.69 0.00 0.41 -0.92 0.00 0.00 175.35 174.13 1x50 n GLY 47 N 4.79 5.45 3.59 -3.33 0.00 -1.22 -0.02 105.19 114.45 1x50 n GLY 47 Ca -0.12 -1.06 -0.02 0.00 0.00 0.00 0.00 46.02 44.82 1x50 n GLY 47 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1x50 s TYR 48 N 1.19 -0.68 -0.29 1.61 6.14 0.14 -3.11 117.35 122.35 1x50 s TYR 48 Ca 0.00 1.30 -0.29 0.00 0.64 0.00 0.00 57.07 58.72 1x50 s TYR 48 Cb 0.00 0.41 0.00 0.00 0.42 0.00 0.00 41.96 42.79 1x50 s TYR 48 CO 0.00 -0.34 1.29 0.08 0.64 0.00 0.00 175.55 177.22 1x50 s VAL 49 N 1.71 4.16 0.67 3.14 1.01 -1.15 -1.36 120.40 128.58 1x50 s VAL 49 Ca -0.07 1.32 -0.15 0.00 0.00 0.00 0.00 61.98 63.08 1x50 s VAL 49 Cb -0.05 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 32.18 1x50 s VAL 49 CO -0.16 -0.45 1.11 -2.16 0.00 0.00 0.00 175.10 173.43 1x50 s PRO 50 N 4.10 2.75 0.27 2.72 0.04 -1.26 -1.20 135.00 142.42 1x50 s PRO 50 Ca 0.56 1.37 0.24 0.00 0.04 0.00 0.00 61.00 63.21 1x50 s PRO 50 Cb -0.17 -1.95 1.00 0.00 0.04 0.00 0.00 34.50 33.43 1x50 s PRO 50 CO 0.22 -1.29 1.72 -0.35 0.04 0.00 0.00 177.00 177.35 1x50 n PRO 51 N -2.51 0.20 -0.37 0.56 -0.04 -1.26 -2.26 135.00 129.33 1x50 n PRO 51 Ca 0.10 0.43 0.08 0.00 -0.04 0.00 0.00 63.50 64.08 1x50 n PRO 51 Cb 0.52 -1.89 0.23 0.00 -0.04 0.00 0.00 33.50 32.32 1x50 n PRO 51 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1x50 n THR 52 N -2.27 2.01 -4.27 0.52 -2.24 -1.26 -4.96 114.28 101.81 1x50 n THR 52 Ca 0.02 -1.72 -0.34 0.00 -2.27 0.00 0.00 64.05 59.74 1x50 n THR 52 Cb 0.23 -0.10 -0.14 0.00 -2.10 0.00 0.00 70.33 68.21 1x50 n THR 52 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1x50 s GLY 53 N -1.79 1.57 0.02 3.38 0.00 -0.96 -5.03 107.32 104.50 1x50 s GLY 53 Ca 0.37 -1.05 -0.21 0.00 0.00 0.00 0.00 44.72 43.83 1x50 s GLY 53 CO 0.10 0.16 1.07 0.50 0.00 0.00 0.00 173.10 174.93 1x50 h LYS 54 N 7.51 -0.74 -1.72 2.90 1.57 -1.87 -3.45 116.57 120.77 1x50 h LYS 54 Ca -0.36 0.05 0.18 0.00 -1.87 0.00 0.00 60.65 58.65 1x50 h LYS 54 Cb 1.18 0.17 -0.19 0.00 0.08 0.00 0.00 32.23 33.47 1x50 h LYS 54 CO 0.59 -0.49 0.67 -1.54 -0.57 0.00 0.00 179.45 178.11 1x50 s SER 55 N -3.82 -0.24 0.13 0.86 1.04 -1.26 -4.30 113.70 106.10 1x50 s SER 55 Ca -0.11 0.07 0.01 0.00 0.48 0.00 0.00 55.95 56.40 1x50 s SER 55 Cb 0.01 0.24 0.01 0.00 0.10 0.00 0.00 66.02 66.38 1x50 s SER 55 CO 0.34 -0.36 0.07 2.22 0.98 0.00 0.00 173.24 176.48 1x50 n PHE 56 N 0.05 -0.80 -3.69 5.02 -1.74 -1.25 -2.11 117.46 112.94 1x50 n PHE 56 Ca -0.04 -0.56 -0.13 0.00 -0.56 0.00 0.00 57.45 56.16 1x50 n PHE 56 Cb 0.59 -0.10 -0.09 0.00 1.52 0.00 0.00 39.48 41.41 1x50 n PHE 56 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1x50 s ALA 57 N -2.19 -1.36 -0.37 1.98 0.00 -0.26 -3.77 121.76 115.79 1x50 s ALA 57 Ca 0.05 1.58 0.03 0.00 0.00 0.00 0.00 51.96 53.61 1x50 s ALA 57 Cb -0.00 -0.92 0.10 0.00 0.00 0.00 0.00 23.12 22.30 1x50 s ALA 57 CO 0.03 -0.26 0.09 0.42 0.00 0.00 0.00 175.76 176.04 1x50 s ILE 58 N 0.40 2.46 -0.08 0.00 1.09 0.74 -2.41 121.20 123.40 1x50 s ILE 58 Ca -0.01 -2.40 -0.05 0.00 -1.10 0.00 0.00 60.65 57.09 1x50 s ILE 58 Cb -0.04 -2.79 -0.04 0.00 -1.06 0.00 0.00 42.46 38.53 1x50 s ILE 58 CO -0.01 -0.63 0.13 0.20 -0.10 0.00 0.00 174.94 174.53 1x50 s ASN 59 N 0.92 6.18 -0.43 3.58 0.01 -1.11 -2.00 114.94 122.09 1x50 s ASN 59 Ca 0.11 0.38 -0.00 0.00 -0.71 0.00 0.00 52.86 52.64 1x50 s ASN 59 Cb -0.20 -1.95 0.12 0.00 0.41 0.00 0.00 41.25 39.63 1x50 s ASN 59 CO -0.07 0.37 0.20 -0.36 -1.51 0.00 0.00 177.10 175.73 1x50 s PHE 60 N -1.08 3.58 0.50 2.20 0.40 0.42 -2.17 117.98 121.83 1x50 s PHE 60 Ca 0.18 -2.68 0.04 0.00 -0.60 0.00 0.00 56.93 53.86 1x50 s PHE 60 Cb -0.12 -3.11 0.02 0.00 0.51 0.00 0.00 43.02 40.33 1x50 s PHE 60 CO 0.08 -0.93 0.70 0.21 0.70 0.00 0.00 175.22 175.98 1x50 s LYS 61 N 0.80 2.65 -0.25 0.44 2.20 0.16 -0.90 119.74 124.83 1x50 s LYS 61 Ca 0.11 -0.94 -0.11 0.00 -0.36 0.00 0.00 55.97 54.67 1x50 s LYS 61 Cb -0.22 -2.58 -0.05 0.00 -1.51 0.00 0.00 37.83 33.47 1x50 s LYS 61 CO -0.05 -0.56 0.20 0.08 -0.36 0.00 0.00 175.35 174.66 1x50 s VAL 62 N -2.62 5.32 0.58 4.02 1.01 -0.90 -1.06 120.40 126.76 1x50 s VAL 62 Ca 0.56 0.24 0.36 0.00 0.00 0.00 0.00 61.98 63.14 1x50 s VAL 62 Cb -0.10 -3.54 0.39 0.00 0.00 0.00 0.00 36.38 33.13 1x50 s VAL 62 CO 0.37 0.30 2.27 1.23 0.00 0.00 0.00 175.10 179.27 1x50 h GLY 63 N 7.83 0.00 0.00 4.51 0.00 -1.77 -2.14 103.07 111.50 1x50 h GLY 63 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.96 1x50 h GLY 63 CO 0.63 0.00 0.00 -1.26 0.00 0.00 0.00 176.54 175.91 1x50 n SER 64 N -3.48 0.00 0.00 0.19 2.88 -1.26 -4.82 113.62 107.12 1x50 n SER 64 Ca -0.03 0.33 0.00 0.00 -1.33 0.00 0.00 58.87 57.84 1x50 n SER 64 Cb 0.11 -0.36 0.00 0.00 -0.75 0.00 0.00 64.21 63.21 1x50 n SER 64 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1x50 n SER 65 N -1.64 0.00 0.00 -3.46 2.88 -1.23 -5.05 113.62 105.12 1x50 n SER 65 Ca 0.00 0.35 0.00 0.00 -1.33 0.00 0.00 58.87 57.89 1x50 n SER 65 Cb 0.00 -0.36 0.00 0.00 -0.75 0.00 0.00 64.21 63.10 1x50 n SER 65 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x50 n GLY 66 N 2.13 0.32 3.56 0.46 0.00 -0.80 -4.95 105.19 105.90 1x50 n GLY 66 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1x50 n GLY 66 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x50 s ASP 67 N -0.59 4.66 -0.41 1.61 1.01 -1.26 -4.69 116.67 117.00 1x50 s ASP 67 Ca 0.00 -0.05 -0.25 0.00 0.71 0.00 0.00 52.55 52.96 1x50 s ASP 67 Cb 0.00 -1.32 0.02 0.00 1.01 0.00 0.00 42.92 42.63 1x50 s ASP 67 CO 0.00 0.32 0.87 -0.63 0.21 0.00 0.00 175.17 175.94 1x50 s ILE 68 N -0.53 4.60 0.07 0.77 1.01 0.14 -2.12 121.20 125.14 1x50 s ILE 68 Ca 0.08 0.87 -0.03 0.00 0.00 0.00 0.00 60.65 61.57 1x50 s ILE 68 Cb -0.12 -4.33 -0.28 0.00 0.01 0.00 0.00 42.46 37.74 1x50 s ILE 68 CO 0.02 -0.63 1.11 0.00 0.00 0.00 0.00 174.94 175.44 1x50 h ALA 69 N 8.73 0.14 -3.51 9.38 0.00 -1.24 -1.46 119.26 131.30 1x50 h ALA 69 Ca -0.24 -0.92 -0.27 0.00 0.00 0.00 0.00 54.91 53.47 1x50 h ALA 69 Cb 1.08 0.04 -0.32 0.00 0.00 0.00 0.00 17.79 18.59 1x50 h ALA 69 CO 0.97 1.02 -0.70 -1.17 0.00 0.00 0.00 179.25 179.37 1x50 s LEU 70 N -7.08 1.20 -0.37 0.00 2.96 -1.25 -4.59 118.68 109.54 1x50 s LEU 70 Ca -0.04 0.08 0.00 0.00 -0.22 0.00 0.00 54.13 53.95 1x50 s LEU 70 Cb 0.07 0.03 0.13 0.00 0.50 0.00 0.00 46.19 46.92 1x50 s LEU 70 CO 0.88 -0.11 0.20 -2.28 -1.32 0.00 0.00 176.35 173.71 1x50 s HIS 71 N 0.86 1.30 -0.11 5.38 5.65 0.46 -0.44 115.29 128.40 1x50 s HIS 71 Ca -0.07 -1.87 -0.13 0.00 0.25 0.00 0.00 55.06 53.24 1x50 s HIS 71 Cb -0.10 -1.39 -0.05 0.00 -1.18 0.00 0.00 32.58 29.86 1x50 s HIS 71 CO -0.03 -0.82 0.29 0.42 -0.65 0.00 0.00 174.74 173.96 1x50 s ILE 72 N 0.98 5.27 -0.22 0.89 1.01 -0.85 -0.34 121.20 127.94 1x50 s ILE 72 Ca 0.16 0.56 -0.05 0.00 0.00 0.00 0.00 60.65 61.32 1x50 s ILE 72 Cb -0.22 -3.61 0.08 0.00 0.01 0.00 0.00 42.46 38.72 1x50 s ILE 72 CO -0.06 0.49 0.11 0.21 0.00 0.00 0.00 174.94 175.68 1x50 s ASN 73 N -0.25 2.82 0.66 3.58 3.04 -0.21 -0.18 114.94 124.39 1x50 s ASN 73 Ca 0.18 -0.89 -0.15 0.00 0.04 0.00 0.00 52.86 52.05 1x50 s ASN 73 Cb -0.14 -0.28 -0.00 0.00 -1.54 0.00 0.00 41.25 39.29 1x50 s ASN 73 CO 0.06 -0.39 1.11 -2.16 -3.04 0.00 0.00 177.10 172.69 1x50 s PRO 74 N 2.13 2.80 -0.37 0.43 0.04 -1.25 -2.14 135.00 136.64 1x50 s PRO 74 Ca 0.05 1.39 0.01 0.00 0.04 0.00 0.00 61.00 62.49 1x50 s PRO 74 Cb -0.16 -1.95 0.12 0.00 0.04 0.00 0.00 34.50 32.55 1x50 s PRO 74 CO -0.21 -1.25 0.17 1.03 0.04 0.00 0.00 177.00 176.78 1x50 s ARG 75 N -4.09 0.93 0.60 4.56 0.52 -1.09 -4.48 118.95 115.91 1x50 s ARG 75 Ca 0.67 -1.49 -0.19 0.00 -0.52 0.00 0.00 55.73 54.20 1x50 s ARG 75 Cb -0.21 -2.06 -0.03 0.00 0.52 0.00 0.00 34.95 33.18 1x50 s ARG 75 CO 0.41 -1.08 1.29 -1.64 0.02 0.00 0.00 175.30 174.30 1x50 s MET 76 N 1.03 2.82 0.00 3.54 -1.94 -1.26 -2.10 119.30 121.39 1x50 s MET 76 Ca 0.14 2.06 0.00 0.00 -1.71 0.00 0.00 55.69 56.18 1x50 s MET 76 Cb -0.21 -1.99 0.00 0.00 2.01 0.00 0.00 34.83 34.64 1x50 s MET 76 CO -0.12 -1.39 0.00 0.41 -0.01 0.00 0.00 175.02 173.92 1x50 n GLY 77 N 0.77 2.00 0.07 -0.03 0.00 -1.26 -4.63 105.19 102.10 1x50 n GLY 77 Ca 0.14 -0.62 -0.12 0.00 0.00 0.00 0.00 46.02 45.42 1x50 n GLY 77 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1x50 h ASN 78 N 0.00 -0.01 0.00 1.61 -0.73 -2.00 -3.49 115.58 110.95 1x50 h ASN 78 Ca 0.00 -0.82 0.00 0.00 1.87 0.00 0.00 56.30 57.35 1x50 h ASN 78 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.59 1x50 h ASN 78 CO 0.00 0.87 0.00 0.61 -0.37 0.00 0.00 177.43 178.54 1x50 n GLY 79 N 1.47 0.76 2.84 1.57 0.00 -0.89 -5.13 105.19 105.80 1x50 n GLY 79 Ca -0.09 -0.58 -0.17 0.00 0.00 0.00 0.00 46.02 45.19 1x50 n GLY 79 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x50 s THR 80 N -1.50 -0.29 -0.38 2.61 -4.23 -1.24 -4.92 115.64 105.70 1x50 s THR 80 Ca 0.00 0.24 -0.11 0.00 -1.18 0.00 0.00 61.69 60.64 1x50 s THR 80 Cb 0.00 -0.39 0.03 0.00 1.34 0.00 0.00 72.50 73.48 1x50 s THR 80 CO 0.00 0.06 0.22 -0.69 -0.54 0.00 0.00 174.62 173.67 1x50 s VAL 81 N 2.31 4.57 0.13 2.29 1.01 -1.26 -2.66 120.40 126.80 1x50 s VAL 81 Ca 0.03 -0.92 -0.30 0.00 0.00 0.00 0.00 61.98 60.79 1x50 s VAL 81 Cb -0.13 -3.59 -0.06 0.00 0.00 0.00 0.00 36.38 32.60 1x50 s VAL 81 CO -0.07 -0.28 0.96 -0.69 0.00 0.00 0.00 175.10 175.02 1x50 s VAL 82 N 1.55 4.43 -0.21 2.92 1.01 -0.91 -4.43 120.40 124.76 1x50 s VAL 82 Ca 0.02 2.08 0.02 0.00 0.00 0.00 0.00 61.98 64.09 1x50 s VAL 82 Cb -0.20 -4.33 0.04 0.00 0.00 0.00 0.00 36.38 31.90 1x50 s VAL 82 CO 0.06 0.35 -0.14 -0.13 0.00 0.00 0.00 175.10 175.24 1x50 s ARG 83 N -0.20 2.49 0.33 2.72 3.00 0.16 -1.05 118.95 126.40 1x50 s ARG 83 Ca 0.46 -1.02 0.01 0.00 0.00 0.00 0.00 55.73 55.19 1x50 s ARG 83 Cb -0.24 -2.64 -0.00 0.00 0.00 0.00 0.00 34.95 32.07 1x50 s ARG 83 CO 0.30 -0.39 0.05 -1.71 0.00 0.00 0.00 175.30 173.55 1x50 n ASN 84 N 4.57 2.16 -3.15 0.23 2.85 0.54 -1.73 115.26 120.73 1x50 n ASN 84 Ca -0.17 -2.57 0.04 0.00 -0.11 0.00 0.00 54.58 51.77 1x50 n ASN 84 Cb 0.46 0.47 -0.01 0.00 1.24 0.00 0.00 39.78 41.95 1x50 n ASN 84 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1x50 s SER 85 N -2.90 -1.39 -0.33 1.20 0.15 -1.26 0.17 113.70 109.34 1x50 s SER 85 Ca 0.07 0.60 -0.29 0.00 0.70 0.00 0.00 55.95 57.03 1x50 s SER 85 Cb 0.00 2.06 0.01 0.00 -1.71 0.00 0.00 66.02 66.39 1x50 s SER 85 CO 0.05 -0.26 1.14 -0.22 1.20 0.00 0.00 173.24 175.15 1x50 s LEU 86 N 2.86 3.89 0.41 3.45 2.96 -0.55 -0.12 118.68 131.58 1x50 s LEU 86 Ca 0.16 1.03 -0.00 0.00 -0.22 0.00 0.00 54.13 55.10 1x50 s LEU 86 Cb -0.13 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.00 1x50 s LEU 86 CO -0.22 -0.97 0.64 -0.76 -1.32 0.00 0.00 176.35 173.71 1x50 s LEU 87 N 3.93 3.79 -0.90 -0.68 1.43 0.71 0.23 118.68 127.18 1x50 s LEU 87 Ca 0.49 0.43 -0.33 0.00 -1.03 0.00 0.00 54.13 53.68 1x50 s LEU 87 Cb -0.13 -3.31 -0.21 0.00 0.03 0.00 0.00 46.19 42.58 1x50 s LEU 87 CO 0.19 -0.53 2.60 0.59 0.23 0.00 0.00 176.35 179.43 1x50 n ASN 88 N -1.99 0.44 0.00 2.29 3.02 -1.26 0.21 115.26 117.96 1x50 n ASN 88 Ca -0.01 0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.78 1x50 n ASN 88 Cb 0.57 -0.94 0.00 0.00 -0.61 0.00 0.00 39.78 38.80 1x50 n ASN 88 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1x50 n GLY 89 N 6.64 0.50 3.57 7.41 0.00 -1.26 -4.91 105.19 117.13 1x50 n GLY 89 Ca 0.63 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.39 1x50 n GLY 89 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x50 s SER 90 N -2.39 3.34 0.19 1.61 0.15 0.56 -5.17 113.70 111.99 1x50 s SER 90 Ca 0.00 -1.41 0.06 0.00 0.70 0.00 0.00 55.95 55.31 1x50 s SER 90 Cb 0.00 -0.18 -0.05 0.00 -1.71 0.00 0.00 66.02 64.08 1x50 s SER 90 CO 0.00 -0.55 -0.12 0.26 1.20 0.00 0.00 173.24 174.03 1x50 s TRP 91 N -2.94 1.57 0.00 3.44 0.52 -1.26 0.26 118.94 120.52 1x50 s TRP 91 Ca 0.33 -0.66 0.00 0.00 0.02 0.00 0.00 56.10 55.79 1x50 s TRP 91 Cb 0.09 -0.77 0.00 0.00 -1.15 0.00 0.00 33.47 31.64 1x50 s TRP 91 CO 0.16 0.24 0.00 0.41 0.02 0.00 0.00 176.95 177.78 1x50 n GLY 92 N -0.34 0.92 3.79 0.98 0.00 0.83 -4.72 105.19 106.66 1x50 n GLY 92 Ca -0.08 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.88 1x50 n GLY 92 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x50 s SER 93 N -1.00 -0.23 -0.28 1.61 0.01 -1.26 -4.95 113.70 107.59 1x50 s SER 93 Ca 0.00 -0.49 -0.17 0.00 1.31 0.00 0.00 55.95 56.60 1x50 s SER 93 Cb 0.00 0.61 -0.03 0.00 0.21 0.00 0.00 66.02 66.82 1x50 s SER 93 CO 0.00 -1.13 0.47 -1.61 0.41 0.00 0.00 173.24 171.38 1x50 s GLU 94 N -3.62 3.98 -0.12 12.44 2.02 -1.26 -3.92 118.70 128.22 1x50 s GLU 94 Ca 0.11 0.16 0.02 0.00 0.02 0.00 0.00 54.97 55.28 1x50 s GLU 94 Cb -0.04 -3.68 0.01 0.00 0.10 0.00 0.00 34.13 30.53 1x50 s GLU 94 CO 0.04 -0.38 -0.18 -1.21 0.02 0.00 0.00 175.26 173.55 1x50 s GLU 95 N 2.25 2.58 -0.12 1.61 0.41 -0.70 -4.91 118.70 119.81 1x50 s GLU 95 Ca 0.19 -0.69 0.01 0.00 -0.41 0.00 0.00 54.97 54.07 1x50 s GLU 95 Cb -0.16 -2.14 0.02 0.00 -1.78 0.00 0.00 34.13 30.07 1x50 s GLU 95 CO 0.10 -0.05 -0.13 0.15 -0.49 0.00 0.00 175.26 174.84 1x50 s LYS 96 N 0.94 2.00 -0.30 1.61 1.02 -1.26 -0.67 119.74 123.08 1x50 s LYS 96 Ca -0.06 -0.46 -0.08 0.00 0.02 0.00 0.00 55.97 55.39 1x50 s LYS 96 Cb -0.15 -1.83 0.18 0.00 -0.52 0.00 0.00 37.83 35.52 1x50 s LYS 96 CO -0.02 -0.16 0.90 0.21 -0.92 0.00 0.00 175.35 175.36 1x50 s LYS 97 N 1.30 0.30 -0.01 1.68 2.20 -1.26 -5.07 119.74 118.89 1x50 s LYS 97 Ca -0.01 0.43 -0.12 0.00 -0.36 0.00 0.00 55.97 55.91 1x50 s LYS 97 Cb -0.14 0.23 0.01 0.00 -1.51 0.00 0.00 37.83 36.42 1x50 s LYS 97 CO -0.06 -0.42 0.24 -1.50 -0.36 0.00 0.00 175.35 173.26 1x50 s ILE 98 N 2.92 0.07 -0.11 5.43 2.07 -1.26 -4.77 121.20 125.55 1x50 s ILE 98 Ca 0.12 -0.57 -0.15 0.00 -1.41 0.00 0.00 60.65 58.64 1x50 s ILE 98 Cb -0.09 -0.56 -0.27 0.00 0.13 0.00 0.00 42.46 41.67 1x50 s ILE 98 CO -0.18 -0.31 0.53 0.00 -1.91 0.00 0.00 174.94 173.07 1x50 h THR 99 N 3.98 0.99 -2.76 4.00 1.03 -1.88 -3.47 112.91 114.80 1x50 h THR 99 Ca -0.30 -2.39 -0.15 0.00 -0.01 0.00 0.00 66.41 63.56 1x50 h THR 99 Cb 1.18 2.68 -0.28 0.00 -1.07 0.00 0.00 68.15 70.66 1x50 h THR 99 CO 0.41 0.71 -0.39 -1.38 -0.01 0.00 0.00 175.52 174.86 1x50 s HIS 100 N -2.48 -0.53 -0.53 0.00 0.00 -1.26 -5.12 115.29 105.36 1x50 s HIS 100 Ca -0.20 1.15 -0.16 0.00 -3.00 0.00 0.00 55.06 52.84 1x50 s HIS 100 Cb 0.05 0.17 0.12 0.00 -4.00 0.00 0.00 32.58 28.92 1x50 s HIS 100 CO 0.76 -0.34 0.50 1.21 -1.00 0.00 0.00 174.74 175.88 1x50 s ASN 101 N 1.68 6.18 0.29 7.38 3.84 -1.26 -4.92 114.94 128.13 1x50 s ASN 101 Ca -0.07 -1.67 0.08 0.00 0.21 0.00 0.00 52.86 51.41 1x50 s ASN 101 Cb -0.10 -2.21 0.44 0.00 -0.55 0.00 0.00 41.25 38.83 1x50 s ASN 101 CO -0.11 -0.84 1.68 1.55 -2.79 0.00 0.00 177.10 176.59 1x50 h PRO 102 N 8.89 0.17 -5.34 0.43 0.13 -1.99 -3.44 132.00 130.85 1x50 h PRO 102 Ca -0.30 -0.09 -0.55 0.00 -0.87 0.00 0.00 66.00 64.19 1x50 h PRO 102 Cb 1.10 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.17 1x50 h PRO 102 CO 1.01 0.61 1.64 1.19 -0.23 0.00 0.00 178.00 182.23 1x50 n PHE 103 N -3.98 0.89 -4.40 1.56 3.72 -1.26 -4.89 117.46 109.11 1x50 n PHE 103 Ca -0.02 0.39 -0.21 0.00 -0.05 0.00 0.00 57.45 57.57 1x50 n PHE 103 Cb 0.51 -2.42 -0.16 0.00 -0.94 0.00 0.00 39.48 36.48 1x50 n PHE 103 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1x50 s GLY 104 N 8.90 0.54 -0.66 1.37 0.00 -1.26 -4.72 107.32 111.49 1x50 s GLY 104 Ca 1.25 -0.33 -0.26 0.00 0.00 0.00 0.00 44.72 45.38 1x50 s GLY 104 CO 0.48 -0.05 1.88 2.56 0.00 0.00 0.00 173.10 177.97 1x50 s PRO 105 N 0.25 2.61 0.00 2.90 0.04 -1.26 -2.33 135.00 137.21 1x50 s PRO 105 Ca -0.04 0.46 0.00 0.00 0.04 0.00 0.00 61.00 61.45 1x50 s PRO 105 Cb -0.09 -4.51 0.00 0.00 0.04 0.00 0.00 34.50 29.94 1x50 s PRO 105 CO 0.01 -2.85 0.00 0.41 0.04 0.00 0.00 177.00 174.60 1x50 n GLY 106 N 5.90 0.53 3.17 0.56 0.00 -0.34 -4.69 105.19 110.33 1x50 n GLY 106 Ca 0.24 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.15 1x50 n GLY 106 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1x50 s GLN 107 N 0.00 0.85 0.95 1.61 -2.07 -0.99 -4.99 119.66 115.02 1x50 s GLN 107 Ca 0.00 -1.33 -0.15 0.00 -1.82 0.00 0.00 55.36 52.06 1x50 s GLN 107 Cb 0.00 -0.24 0.17 0.00 -1.09 0.00 0.00 33.01 31.85 1x50 s GLN 107 CO 0.00 -0.01 1.23 -0.06 -1.32 0.00 0.00 175.29 175.13 1x50 s PHE 108 N -3.56 1.94 -0.30 9.60 0.40 -1.26 -2.93 117.98 121.87 1x50 s PHE 108 Ca 0.12 0.55 -0.09 0.00 -0.60 0.00 0.00 56.93 56.90 1x50 s PHE 108 Cb 0.05 -3.75 0.15 0.00 0.51 0.00 0.00 43.02 39.98 1x50 s PHE 108 CO -0.04 -2.56 0.69 -0.59 0.70 0.00 0.00 175.22 173.42 1x50 s PHE 109 N -3.58 -1.30 -0.49 0.36 -0.12 -1.18 -4.80 117.98 106.88 1x50 s PHE 109 Ca 0.69 2.06 -0.20 0.00 -0.05 0.00 0.00 56.93 59.42 1x50 s PHE 109 Cb -0.08 0.71 0.04 0.00 -0.63 0.00 0.00 43.02 43.06 1x50 s PHE 109 CO 0.53 -0.66 0.67 0.34 -0.05 0.00 0.00 175.22 176.05 1x50 s ASP 110 N 2.84 6.27 -0.10 1.98 2.15 -1.26 -3.37 116.67 125.17 1x50 s ASP 110 Ca -0.01 -0.67 -0.02 0.00 0.43 0.00 0.00 52.55 52.28 1x50 s ASP 110 Cb -0.12 -2.32 -0.03 0.00 -0.30 0.00 0.00 42.92 40.15 1x50 s ASP 110 CO -0.19 -0.90 0.00 -0.22 -0.17 0.00 0.00 175.17 173.70 1x50 s LEU 111 N 2.86 3.58 -0.19 -1.34 1.98 -0.24 -1.43 118.68 123.90 1x50 s LEU 111 Ca 0.19 0.12 -0.04 0.00 -2.89 0.00 0.00 54.13 51.51 1x50 s LEU 111 Cb -0.17 -1.83 0.09 0.00 0.66 0.00 0.00 46.19 44.94 1x50 s LEU 111 CO 0.15 0.35 0.23 -0.44 -1.89 0.00 0.00 176.35 174.74 1x50 s SER 112 N -0.69 1.17 -0.09 3.68 0.01 -0.88 0.85 113.70 117.75 1x50 s SER 112 Ca 0.11 -0.07 -0.15 0.00 1.31 0.00 0.00 55.95 57.16 1x50 s SER 112 Cb -0.12 0.43 -0.05 0.00 0.21 0.00 0.00 66.02 66.50 1x50 s SER 112 CO 0.02 -0.31 0.36 -0.63 0.41 0.00 0.00 173.24 173.09 1x50 s ILE 113 N 2.34 5.20 -0.19 1.44 1.09 0.14 -0.76 121.20 130.45 1x50 s ILE 113 Ca 0.06 0.71 -0.03 0.00 -1.10 0.00 0.00 60.65 60.29 1x50 s ILE 113 Cb -0.15 -3.68 -0.01 0.00 -1.06 0.00 0.00 42.46 37.56 1x50 s ILE 113 CO -0.11 0.46 -0.06 -0.13 -0.10 0.00 0.00 174.94 175.00 1x50 s ARG 114 N -0.13 3.43 -0.59 2.79 0.52 0.69 0.76 118.95 126.43 1x50 s ARG 114 Ca 0.21 -0.62 -0.19 0.00 -0.52 0.00 0.00 55.73 54.61 1x50 s ARG 114 Cb -0.15 -2.93 0.09 0.00 0.52 0.00 0.00 34.95 32.49 1x50 s ARG 114 CO 0.08 -0.05 0.72 0.00 0.02 0.00 0.00 175.30 176.07 1x50 n GLY 116 N 5.27 0.62 0.52 0.00 0.00 -1.23 -3.69 105.19 106.68 1x50 n GLY 116 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1x50 n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x50 n LEU 117 N 0.00 0.74 0.02 0.99 4.77 -1.26 -3.70 117.00 118.56 1x50 n LEU 117 Ca 0.00 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.91 1x50 n LEU 117 Cb 0.00 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 40.97 1x50 n LEU 117 CO 0.00 0.02 -0.21 0.44 -1.33 0.00 0.00 177.39 176.31 1x50 h ASP 118 N 0.00 0.00 -4.60 -1.43 5.19 -1.99 -3.49 116.42 110.10 1x50 h ASP 118 Ca 0.00 0.00 0.27 0.00 -0.62 0.00 0.00 57.03 56.68 1x50 h ASP 118 Cb 0.36 0.00 -0.17 0.00 0.18 0.00 0.00 39.33 39.70 1x50 h ASP 118 CO 0.00 0.93 0.81 0.00 -3.12 0.00 0.00 179.24 177.86 1x50 s ARG 119 N -2.69 0.34 0.17 3.56 1.70 -1.26 -4.34 118.95 116.43 1x50 s ARG 119 Ca -0.02 -0.14 -0.23 0.00 -0.47 0.00 0.00 55.73 54.87 1x50 s ARG 119 Cb 0.09 0.14 -0.08 0.00 -0.57 0.00 0.00 34.95 34.53 1x50 s ARG 119 CO 0.82 -0.15 0.73 -0.06 -1.08 0.00 0.00 175.30 175.55 1x50 s PHE 120 N -2.43 3.81 -0.36 5.89 0.40 -1.08 -3.56 117.98 120.66 1x50 s PHE 120 Ca 0.10 1.50 -0.03 0.00 -0.60 0.00 0.00 56.93 57.91 1x50 s PHE 120 Cb 0.00 -2.68 0.08 0.00 0.51 0.00 0.00 43.02 40.94 1x50 s PHE 120 CO -0.04 0.47 0.11 0.15 0.70 0.00 0.00 175.22 176.60 1x50 s LYS 121 N -1.40 2.21 -0.11 0.44 -0.14 0.54 -2.43 119.74 118.84 1x50 s LYS 121 Ca 0.37 -1.54 -0.14 0.00 -1.36 0.00 0.00 55.97 53.30 1x50 s LYS 121 Cb -0.20 -3.39 -0.05 0.00 -1.68 0.00 0.00 37.83 32.50 1x50 s LYS 121 CO 0.23 -0.84 0.33 0.08 -0.76 0.00 0.00 175.35 174.39 1x50 s VAL 122 N 1.20 5.24 0.27 3.17 1.01 0.68 -0.22 120.40 131.75 1x50 s VAL 122 Ca 0.02 0.65 0.12 0.00 0.00 0.00 0.00 61.98 62.77 1x50 s VAL 122 Cb -0.21 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 1x50 s VAL 122 CO -0.02 0.44 -0.20 -0.31 0.00 0.00 0.00 175.10 175.00 1x50 s TYR 123 N 0.01 2.28 -0.10 5.22 1.51 0.06 -0.09 117.35 126.23 1x50 s TYR 123 Ca 0.19 -0.34 -0.03 0.00 -1.01 0.00 0.00 57.07 55.88 1x50 s TYR 123 Cb -0.14 -1.00 0.05 0.00 -0.11 0.00 0.00 41.96 40.75 1x50 s TYR 123 CO 0.07 0.68 0.11 0.00 -1.11 0.00 0.00 175.55 175.30 1x50 s ALA 124 N -2.41 0.13 -1.23 3.71 0.00 0.20 -2.08 121.76 120.08 1x50 s ALA 124 Ca 0.29 0.16 -0.12 0.00 0.00 0.00 0.00 51.96 52.28 1x50 s ALA 124 Cb -0.05 -0.85 0.11 0.00 0.00 0.00 0.00 23.12 22.32 1x50 s ALA 124 CO 0.14 -0.77 0.45 0.09 0.00 0.00 0.00 175.76 175.67 1x50 n ASN 125 N 5.30 -2.69 0.00 0.00 3.02 -0.51 0.68 115.26 121.06 1x50 n ASN 125 Ca -0.05 -0.49 0.00 0.00 -0.03 0.00 0.00 54.58 54.02 1x50 n ASN 125 Cb 0.50 -2.28 0.00 0.00 -0.61 0.00 0.00 39.78 37.38 1x50 n ASN 125 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1x50 n GLY 126 N -1.03 0.71 2.69 7.41 0.00 -1.26 -5.06 105.19 108.64 1x50 n GLY 126 Ca 0.03 -0.71 -0.21 0.00 0.00 0.00 0.00 46.02 45.13 1x50 n GLY 126 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1x50 s GLN 127 N -3.24 0.00 -0.53 1.61 -1.52 0.21 -5.09 119.66 111.11 1x50 s GLN 127 Ca 0.00 0.25 -0.32 0.00 -1.95 0.00 0.00 55.36 53.35 1x50 s GLN 127 Cb 0.00 -0.94 -0.12 0.00 -0.22 0.00 0.00 33.01 31.73 1x50 s GLN 127 CO 0.00 -0.46 2.37 1.58 -0.25 0.00 0.00 175.29 178.53 1x50 n HIS 128 N 5.30 1.33 0.05 0.91 -0.00 -1.26 0.60 115.22 122.15 1x50 n HIS 128 Ca -0.05 0.25 -0.02 0.00 -0.00 0.00 0.00 57.72 57.90 1x50 n HIS 128 Cb 0.50 -2.53 -0.01 0.00 -0.00 0.00 0.00 29.99 27.94 1x50 n HIS 128 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 1x50 h LEU 129 N 14.40 -0.11 -7.99 0.27 5.85 -0.78 -3.46 115.31 123.49 1x50 h LEU 129 Ca -0.22 0.00 0.11 0.00 0.84 0.00 0.00 57.88 58.62 1x50 h LEU 129 Cb 1.30 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.34 1x50 h LEU 129 CO 1.14 -0.01 0.52 0.72 -0.34 0.00 0.00 178.44 180.47 1x50 s PHE 130 N -2.16 0.10 0.20 1.25 -0.12 -1.13 -4.02 117.98 112.10 1x50 s PHE 130 Ca -0.02 -0.59 0.08 0.00 -0.05 0.00 0.00 56.93 56.35 1x50 s PHE 130 Cb 0.00 0.74 -0.05 0.00 -0.63 0.00 0.00 43.02 43.09 1x50 s PHE 130 CO 0.06 -1.10 -0.15 0.16 -0.05 0.00 0.00 175.22 174.14 1x50 s ASP 131 N -3.37 2.59 -0.29 1.98 1.47 -1.26 -0.23 116.67 117.56 1x50 s ASP 131 Ca 0.21 -0.98 -0.01 0.00 1.18 0.00 0.00 52.55 52.95 1x50 s ASP 131 Cb -0.03 -0.14 0.05 0.00 -0.34 0.00 0.00 42.92 42.46 1x50 s ASP 131 CO 0.07 -0.14 -0.02 0.12 0.68 0.00 0.00 175.17 175.88 1x50 s PHE 132 N -2.76 3.25 0.31 2.11 5.36 -1.02 -4.91 117.98 120.32 1x50 s PHE 132 Ca 0.21 -1.91 -0.29 0.00 -0.96 0.00 0.00 56.93 53.98 1x50 s PHE 132 Cb -0.02 -2.08 -0.13 0.00 -0.34 0.00 0.00 43.02 40.45 1x50 s PHE 132 CO 0.07 -0.81 1.27 0.00 -1.46 0.00 0.00 175.22 174.29 1x50 n ALA 133 N 4.60 1.00 -1.58 11.12 0.00 -1.26 -2.63 120.51 131.75 1x50 n ALA 133 Ca -0.13 0.38 -0.42 0.00 0.00 0.00 0.00 53.44 53.27 1x50 n ALA 133 Cb 0.43 -2.22 -0.01 0.00 0.00 0.00 0.00 19.45 17.65 1x50 n ALA 133 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1x50 n HIS 134 N 0.70 3.13 -0.13 0.00 -0.00 -1.26 -4.66 115.22 113.01 1x50 n HIS 134 Ca 0.07 -2.76 -0.07 0.00 -0.00 0.00 0.00 57.72 54.97 1x50 n HIS 134 Cb 0.34 -2.39 0.10 0.00 -0.00 0.00 0.00 29.99 28.05 1x50 n HIS 134 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.34 176.41 1x50 h ARG 135 N 6.28 0.85 -4.61 -0.41 0.11 -1.89 -3.39 114.38 111.32 1x50 h ARG 135 Ca 0.56 -0.28 -0.71 0.00 0.10 0.00 0.00 59.98 59.65 1x50 h ARG 135 Cb 0.61 -0.07 -0.20 0.00 1.11 0.00 0.00 29.97 31.42 1x50 h ARG 135 CO 1.89 0.90 -0.27 -1.17 0.10 0.00 0.00 179.97 181.43 1x50 s LEU 136 N -9.11 5.18 0.59 0.08 2.96 -1.26 -4.92 118.68 112.19 1x50 s LEU 136 Ca -0.10 -0.97 0.30 0.00 -0.22 0.00 0.00 54.13 53.14 1x50 s LEU 136 Cb 0.14 -2.27 1.76 0.00 0.50 0.00 0.00 46.19 46.31 1x50 s LEU 136 CO 0.83 -0.61 2.17 0.77 -1.32 0.00 0.00 176.35 178.19 1x50 h SER 137 N 8.75 0.00 -0.55 3.68 4.64 -2.01 -1.68 113.55 126.38 1x50 h SER 137 Ca -0.27 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.67 1x50 h SER 137 Cb 1.11 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.04 1x50 h SER 137 CO 0.83 0.00 0.48 0.00 -0.87 0.00 0.00 176.83 177.27 1x50 n ALA 138 N -2.31 5.27 0.17 5.18 0.00 -1.26 -4.47 120.51 123.09 1x50 n ALA 138 Ca -0.01 -1.92 0.03 0.00 0.00 0.00 0.00 53.44 51.55 1x50 n ALA 138 Cb 0.22 -1.43 0.40 0.00 0.00 0.00 0.00 19.45 18.64 1x50 n ALA 138 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1x50 h PHE 139 N 1.52 0.10 -0.18 0.00 -0.00 -1.67 -2.42 116.94 114.30 1x50 h PHE 139 Ca 0.34 -0.02 0.02 0.00 -0.00 0.00 0.00 57.97 58.31 1x50 h PHE 139 Cb 0.93 -0.03 -0.01 0.00 -0.00 0.00 0.00 35.95 36.84 1x50 h PHE 139 CO 0.90 0.34 0.12 -0.56 -0.00 0.00 0.00 178.31 179.11 1x50 h GLN 140 N 0.09 0.15 -0.73 6.09 3.07 -1.78 -1.76 115.11 120.23 1x50 h GLN 140 Ca 0.01 -0.01 -0.06 0.00 0.09 0.00 0.00 58.65 58.68 1x50 h GLN 140 Cb 0.48 -0.03 -0.03 0.00 0.08 0.00 0.00 27.48 27.98 1x50 h GLN 140 CO 0.03 0.10 0.21 0.00 0.09 0.00 0.00 178.83 179.26 1x50 h ARG 141 N 0.15 1.15 -5.70 0.06 3.08 -1.75 -3.23 114.38 108.14 1x50 h ARG 141 Ca 0.07 -0.26 -0.61 0.00 0.07 0.00 0.00 59.98 59.26 1x50 h ARG 141 Cb 0.11 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 29.97 1x50 h ARG 141 CO -0.01 0.99 1.52 0.28 -1.07 0.00 0.00 179.97 181.68 1x50 n VAL 142 N -4.25 0.07 -2.22 2.04 0.31 -0.66 -4.39 118.33 109.24 1x50 n VAL 142 Ca 0.06 -0.27 -0.01 0.00 -0.01 0.00 0.00 64.34 64.11 1x50 n VAL 142 Cb 0.24 -1.47 0.08 0.00 -0.91 0.00 0.00 33.84 31.79 1x50 n VAL 142 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1x50 n ASP 143 N 10.82 1.93 -3.57 4.52 9.92 -1.20 -2.16 116.55 136.82 1x50 n ASP 143 Ca 0.48 -2.85 -0.19 0.00 -0.53 0.00 0.00 54.79 51.69 1x50 n ASP 143 Cb 0.21 -0.41 -0.14 0.00 -0.64 0.00 0.00 41.12 40.14 1x50 n ASP 143 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1x50 s THR 144 N -2.40 -0.27 -0.36 -3.53 2.01 -0.22 -1.39 115.64 109.49 1x50 s THR 144 Ca 0.37 0.04 -0.05 0.00 0.31 0.00 0.00 61.69 62.35 1x50 s THR 144 Cb 0.37 -0.53 0.06 0.00 0.01 0.00 0.00 72.50 72.42 1x50 s THR 144 CO -0.08 -0.10 0.12 -0.22 -0.69 0.00 0.00 174.62 173.65 1x50 s LEU 145 N 2.29 4.55 0.16 4.42 2.96 -0.13 -0.67 118.68 132.25 1x50 s LEU 145 Ca 0.05 -1.43 0.06 0.00 -0.22 0.00 0.00 54.13 52.59 1x50 s LEU 145 Cb -0.14 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.67 1x50 s LEU 145 CO -0.09 -0.39 0.05 -1.83 -1.32 0.00 0.00 176.35 172.76 1x50 s GLU 146 N 1.31 2.61 -0.09 1.98 -1.05 -0.92 -0.48 118.70 122.05 1x50 s GLU 146 Ca 0.00 -0.97 -0.03 0.00 -0.15 0.00 0.00 54.97 53.82 1x50 s GLU 146 Cb -0.21 -2.50 0.04 0.00 -0.44 0.00 0.00 34.13 31.03 1x50 s GLU 146 CO 0.00 0.48 0.09 0.42 0.95 0.00 0.00 175.26 177.21 1x50 s ILE 147 N -1.67 -0.14 0.37 1.83 1.01 -0.75 -2.77 121.20 119.08 1x50 s ILE 147 Ca 0.28 0.21 0.04 0.00 0.00 0.00 0.00 60.65 61.19 1x50 s ILE 147 Cb -0.10 -0.32 -0.06 0.00 0.01 0.00 0.00 42.46 41.99 1x50 s ILE 147 CO 0.20 0.02 0.05 0.00 0.00 0.00 0.00 174.94 175.22 1x50 s GLN 148 N 2.19 1.79 0.00 2.79 0.00 -1.01 -1.56 119.66 123.85 1x50 s GLN 148 Ca 0.04 -2.03 0.00 0.00 -0.00 0.00 0.00 55.36 53.37 1x50 s GLN 148 Cb -0.13 -1.03 0.00 0.00 0.00 0.00 0.00 33.01 31.85 1x50 s GLN 148 CO -0.06 -0.22 0.00 0.41 0.00 0.00 0.00 175.29 175.43 1x50 n GLY 149 N -0.82 -0.93 3.34 2.60 0.00 -1.26 -1.10 105.19 107.02 1x50 n GLY 149 Ca -0.05 -2.02 -0.46 0.00 0.00 0.00 0.00 46.02 43.49 1x50 n GLY 149 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x50 s ASP 150 N -4.00 6.51 -0.13 1.61 1.01 -0.90 -4.90 116.67 115.87 1x50 s ASP 150 Ca 0.00 -2.22 -0.14 0.00 0.71 0.00 0.00 52.55 50.90 1x50 s ASP 150 Cb 0.00 -2.23 0.04 0.00 1.01 0.00 0.00 42.92 41.73 1x50 s ASP 150 CO 0.00 -0.76 0.39 0.54 0.21 0.00 0.00 175.17 175.55 1x50 s VAL 151 N 1.09 0.01 -0.67 -1.27 0.11 -1.26 -3.81 120.40 114.59 1x50 s VAL 151 Ca 0.14 -0.06 -0.09 0.00 -2.93 0.00 0.00 61.98 59.03 1x50 s VAL 151 Cb -0.18 -0.57 0.18 0.00 -1.53 0.00 0.00 36.38 34.27 1x50 s VAL 151 CO -0.03 -0.03 0.56 -0.89 -3.33 0.00 0.00 175.10 171.37 1x50 s THR 152 N -0.02 4.68 0.16 5.04 2.01 -0.46 -4.94 115.64 122.11 1x50 s THR 152 Ca -0.02 -2.45 -0.30 0.00 0.31 0.00 0.00 61.69 59.23 1x50 s THR 152 Cb -0.03 -3.98 -0.08 0.00 0.01 0.00 0.00 72.50 68.42 1x50 s THR 152 CO 0.01 -0.92 1.25 -0.76 -0.69 0.00 0.00 174.62 173.51 1x50 s LEU 153 N 0.40 4.42 -0.06 4.42 1.43 -1.26 0.26 118.68 128.29 1x50 s LEU 153 Ca 0.14 2.26 0.02 0.00 -1.03 0.00 0.00 54.13 55.52 1x50 s LEU 153 Cb -0.18 -3.60 -0.06 0.00 0.03 0.00 0.00 46.19 42.39 1x50 s LEU 153 CO -0.05 -0.45 -0.03 -1.20 0.23 0.00 0.00 176.35 174.85 1x50 n SER 154 N 2.88 3.54 -3.66 2.29 7.64 0.97 -4.01 113.62 123.28 1x50 n SER 154 Ca 0.06 -0.02 -0.09 0.00 1.01 0.00 0.00 58.87 59.83 1x50 n SER 154 Cb 0.44 0.21 -0.08 0.00 -1.01 0.00 0.00 64.21 63.77 1x50 n SER 154 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1x50 s TYR 155 N -2.14 -0.86 -0.02 1.43 6.14 -0.25 -1.79 117.35 119.86 1x50 s TYR 155 Ca -0.07 1.81 -0.00 0.00 0.64 0.00 0.00 57.07 59.45 1x50 s TYR 155 Cb 0.02 0.45 0.02 0.00 0.42 0.00 0.00 41.96 42.87 1x50 s TYR 155 CO 0.19 -0.43 0.03 0.08 0.64 0.00 0.00 175.55 176.06 1x50 s VAL 156 N 1.26 -0.04 -0.23 3.14 1.01 -1.23 -1.23 120.40 123.09 1x50 s VAL 156 Ca -0.07 0.13 -0.20 0.00 0.00 0.00 0.00 61.98 61.84 1x50 s VAL 156 Cb -0.06 -0.08 0.06 0.00 0.00 0.00 0.00 36.38 36.31 1x50 s VAL 156 CO -0.13 0.05 0.59 -1.58 0.00 0.00 0.00 175.10 174.04 1x50 s GLN 157 N 0.68 0.68 -0.66 2.72 0.74 -1.18 -2.12 119.66 120.53 1x50 s GLN 157 Ca -0.06 0.86 -0.17 0.00 0.05 0.00 0.00 55.36 56.05 1x50 s GLN 157 Cb -0.08 0.30 0.14 0.00 1.10 0.00 0.00 33.01 34.47 1x50 s GLN 157 CO -0.02 -0.09 0.69 0.42 -0.55 0.00 0.00 175.29 175.73 1x50 s ILE 158 N 0.50 5.13 0.22 -2.34 1.09 -1.26 -2.83 121.20 121.71 1x50 s ILE 158 Ca -0.02 -1.56 0.03 0.00 -1.10 0.00 0.00 60.65 58.00 1x50 s ILE 158 Cb -0.04 -4.46 0.28 0.00 -1.06 0.00 0.00 42.46 37.18 1x50 s ILE 158 CO -0.02 -1.05 1.07 -1.20 -0.10 0.00 0.00 174.94 173.64 1x50 n SER 159 N 5.44 -0.04 -3.14 3.58 7.64 0.49 -4.55 113.62 123.04 1x50 n SER 159 Ca -0.03 1.15 -0.33 0.00 1.01 0.00 0.00 58.87 60.68 1x50 n SER 159 Cb 0.43 -0.44 -0.01 0.00 -1.01 0.00 0.00 64.21 63.18 1x50 n SER 159 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x50 n GLY 160 N -1.32 -1.52 3.77 0.23 0.00 -1.26 -4.83 105.19 100.26 1x50 n GLY 160 Ca 0.17 0.15 -0.33 0.00 0.00 0.00 0.00 46.02 46.01 1x50 n GLY 160 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x50 s PRO 161 N -0.72 2.82 -0.35 1.61 0.04 -1.26 -4.94 135.00 132.20 1x50 s PRO 161 Ca 0.45 1.40 -0.28 0.00 0.04 0.00 0.00 61.00 62.60 1x50 s PRO 161 Cb -0.59 -1.95 -0.01 0.00 0.04 0.00 0.00 34.50 31.98 1x50 s PRO 161 CO 0.42 -1.24 1.71 -1.54 0.04 0.00 0.00 177.00 176.40 1x50 s SER 162 N -2.56 5.99 -0.51 6.66 1.04 -1.26 -4.74 113.70 118.32 1x50 s SER 162 Ca 0.67 1.20 -0.18 0.00 0.48 0.00 0.00 55.95 58.13 1x50 s SER 162 Cb -0.21 -2.53 0.08 0.00 0.10 0.00 0.00 66.02 63.46 1x50 s SER 162 CO 0.41 -1.65 0.55 -0.55 0.98 0.00 0.00 173.24 172.98 1x50 s SER 163 N 5.61 6.19 0.00 7.02 0.15 -1.25 -5.09 113.70 126.34 1x50 s SER 163 Ca 0.76 -1.20 0.00 0.00 0.70 0.00 0.00 55.95 56.21 1x50 s SER 163 Cb -0.21 -2.25 0.00 0.00 -1.71 0.00 0.00 66.02 61.85 1x50 s SER 163 CO 0.33 -0.84 0.00 0.61 1.20 0.00 0.00 173.24 174.54