#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yue n SER 2 N 0.00 -7.91 -1.20 1.61 7.64 -1.26 -4.98 113.62 107.52 2yue n SER 2 Ca 0.00 0.71 0.12 0.00 1.01 0.00 0.00 58.87 60.71 2yue n SER 2 Cb 0.00 -4.13 -0.03 0.00 -1.01 0.00 0.00 64.21 59.04 2yue n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2yue n SER 3 N -4.06 -7.13 0.00 6.43 7.64 -1.26 -5.05 113.62 110.19 2yue n SER 3 Ca -0.01 0.94 0.00 0.00 1.01 0.00 0.00 58.87 60.81 2yue n SER 3 Cb 0.61 -2.68 0.00 0.00 -1.01 0.00 0.00 64.21 61.13 2yue n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yue n GLY 4 N -2.59 2.30 3.24 0.23 0.00 -1.26 -5.05 105.19 102.05 2yue n GLY 4 Ca 0.01 0.15 -0.15 0.00 0.00 0.00 0.00 46.02 46.03 2yue n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2yue n SER 5 N 0.00 -5.95 -4.77 1.61 7.64 -1.26 -4.95 113.62 105.94 2yue n SER 5 Ca 0.00 -0.68 -0.39 0.00 1.01 0.00 0.00 58.87 58.81 2yue n SER 5 Cb 0.00 -5.12 -0.01 0.00 -1.01 0.00 0.00 64.21 58.07 2yue n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yue s SER 6 N -3.51 6.41 0.00 6.43 0.01 -1.26 -4.27 113.70 117.51 2yue s SER 6 Ca 0.39 2.46 0.00 0.00 1.31 0.00 0.00 55.95 60.11 2yue s SER 6 Cb -0.05 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.56 2yue s SER 6 CO 0.72 -0.76 0.00 0.61 0.41 0.00 0.00 173.24 174.22 2yue n GLY 7 N 0.65 2.58 3.69 3.44 0.00 -1.26 -5.12 105.19 109.17 2yue n GLY 7 Ca 0.04 -0.52 -0.29 0.00 0.00 0.00 0.00 46.02 45.25 2yue n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yue s PRO 8 N 0.00 0.65 0.01 1.61 0.04 -1.26 -5.02 135.00 131.03 2yue s PRO 8 Ca 0.00 0.60 -0.19 0.00 0.04 0.00 0.00 61.00 61.45 2yue s PRO 8 Cb 0.00 -1.76 -0.06 0.00 0.04 0.00 0.00 34.50 32.73 2yue s PRO 8 CO 0.00 -2.60 0.55 -1.17 0.04 0.00 0.00 177.00 173.82 2yue s LEU 9 N -6.39 4.45 0.00 -3.56 2.96 -1.26 -4.98 118.68 109.90 2yue s LEU 9 Ca 0.65 1.14 0.03 0.00 -0.22 0.00 0.00 54.13 55.73 2yue s LEU 9 Cb -0.18 -2.84 -0.01 0.00 0.50 0.00 0.00 46.19 43.65 2yue s LEU 9 CO 0.57 0.19 0.20 0.00 -1.32 0.00 0.00 176.35 175.99 2yue n GLN 10 N 2.31 0.29 -2.85 1.98 6.02 -1.26 -4.77 117.38 119.10 2yue n GLN 10 Ca -0.09 -1.89 -0.32 0.00 -0.01 0.00 0.00 57.00 54.69 2yue n GLN 10 Cb 0.51 1.62 -0.05 0.00 1.02 0.00 0.00 30.24 33.34 2yue n GLN 10 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2yue s PHE 11 N -3.05 3.40 0.29 1.08 0.08 -1.26 -1.33 117.98 117.20 2yue s PHE 11 Ca 0.22 1.31 -0.04 0.00 0.12 0.00 0.00 56.93 58.54 2yue s PHE 11 Cb 0.01 -2.63 -0.05 0.00 -0.57 0.00 0.00 43.02 39.78 2yue s PHE 11 CO 0.16 -0.09 0.55 -1.58 -0.10 0.00 0.00 175.22 174.15 2yue s HIS 12 N -2.25 3.48 0.24 0.36 2.46 -1.17 -4.32 115.29 114.09 2yue s HIS 12 Ca 0.56 0.59 -0.05 0.00 0.47 0.00 0.00 55.06 56.63 2yue s HIS 12 Cb -0.10 -2.06 0.44 0.00 -0.13 0.00 0.00 32.58 30.72 2yue s HIS 12 CO 0.22 0.17 1.74 0.77 -2.47 0.00 0.00 174.74 175.17 2yue h SER 13 N 1.56 0.32 -2.43 9.88 0.02 -1.93 -3.40 113.55 117.57 2yue h SER 13 Ca -0.48 0.10 -0.53 0.00 -0.84 0.00 0.00 61.79 60.04 2yue h SER 13 Cb 1.19 0.07 0.02 0.00 0.14 0.00 0.00 62.40 63.82 2yue h SER 13 CO 0.66 0.13 1.20 0.54 -1.14 0.00 0.00 176.83 178.21 2yue s VAL 14 N -6.02 2.99 0.15 2.27 0.11 -1.26 -4.96 120.40 113.68 2yue s VAL 14 Ca -0.12 0.10 -0.18 0.00 -2.93 0.00 0.00 61.98 58.85 2yue s VAL 14 Cb 0.20 -3.07 0.04 0.00 -1.53 0.00 0.00 36.38 32.02 2yue s VAL 14 CO 0.76 -0.01 0.47 -1.38 -3.33 0.00 0.00 175.10 171.62 2yue s HIS 15 N 4.10 -0.22 0.99 1.54 -0.00 -1.26 -4.00 115.29 116.44 2yue s HIS 15 Ca 0.85 -0.09 -0.14 0.00 -0.00 0.00 0.00 55.06 55.69 2yue s HIS 15 Cb -0.42 0.34 0.05 0.00 -0.00 0.00 0.00 32.58 32.55 2yue s HIS 15 CO 0.39 -0.79 0.30 0.41 -0.00 0.00 0.00 174.74 175.05 2yue n GLY 16 N -0.29 -2.17 0.18 -1.38 0.00 0.82 -4.80 105.19 97.55 2yue n GLY 16 Ca -0.14 -0.76 -0.04 0.00 0.00 0.00 0.00 46.02 45.08 2yue n GLY 16 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2yue h ASP 17 N -1.66 -0.30 -2.46 1.61 3.58 -1.91 -2.78 116.42 112.50 2yue h ASP 17 Ca -0.46 0.12 -0.79 0.00 0.42 0.00 0.00 57.03 56.32 2yue h ASP 17 Cb 1.30 0.23 -0.29 0.00 1.72 0.00 0.00 39.33 42.29 2yue h ASP 17 CO 0.35 -0.10 0.81 0.59 -2.88 0.00 0.00 179.24 178.01 2yue n ASN 18 N -5.27 6.80 -3.73 2.28 3.02 -1.24 -4.93 115.26 112.19 2yue n ASN 18 Ca 0.04 -3.60 -0.26 0.00 -0.03 0.00 0.00 54.58 50.73 2yue n ASN 18 Cb 0.24 -1.15 -0.17 0.00 -0.61 0.00 0.00 39.78 38.09 2yue n ASN 18 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2yue s ILE 19 N -3.81 0.38 -0.43 2.41 -1.09 -1.05 -2.81 121.20 114.79 2yue s ILE 19 Ca 0.37 -0.25 -0.11 0.00 -2.23 0.00 0.00 60.65 58.43 2yue s ILE 19 Cb 0.15 -0.78 0.08 0.00 -1.58 0.00 0.00 42.46 40.33 2yue s ILE 19 CO -0.05 -0.05 0.30 -0.60 -1.23 0.00 0.00 174.94 173.30 2yue s ARG 20 N 1.94 2.71 -0.51 2.79 6.06 0.84 -4.82 118.95 127.95 2yue s ARG 20 Ca 0.02 -1.43 -0.12 0.00 -2.50 0.00 0.00 55.73 51.70 2yue s ARG 20 Cb -0.15 -3.87 0.13 0.00 0.06 0.00 0.00 34.95 31.11 2yue s ARG 20 CO -0.07 -0.97 0.43 0.42 -2.50 0.00 0.00 175.30 172.60 2yue s ILE 21 N 1.48 4.67 -0.29 4.11 1.01 -1.26 -1.16 121.20 129.76 2yue s ILE 21 Ca 0.03 -1.71 -0.16 0.00 0.00 0.00 0.00 60.65 58.81 2yue s ILE 21 Cb -0.23 -4.03 0.12 0.00 0.01 0.00 0.00 42.46 38.33 2yue s ILE 21 CO 0.03 -0.83 0.88 -0.94 0.00 0.00 0.00 174.94 174.08 2yue s SER 22 N 3.01 -0.66 0.30 3.58 1.04 -0.89 -4.96 113.70 115.13 2yue s SER 22 Ca 0.05 1.05 -0.18 0.00 0.48 0.00 0.00 55.95 57.35 2yue s SER 22 Cb -0.27 1.28 0.02 0.00 0.10 0.00 0.00 66.02 67.15 2yue s SER 22 CO 0.00 -0.17 0.68 -0.60 0.98 0.00 0.00 173.24 174.14 2yue s ARG 23 N 1.46 1.83 0.58 4.02 6.06 -1.26 -4.73 118.95 126.91 2yue s ARG 23 Ca -0.09 -1.15 0.28 0.00 -2.50 0.00 0.00 55.73 52.27 2yue s ARG 23 Cb -0.04 0.58 1.63 0.00 0.06 0.00 0.00 34.95 37.18 2yue s ARG 23 CO -0.17 -0.83 2.10 0.22 -2.50 0.00 0.00 175.30 174.13 2yue h ASP 24 N 2.05 0.00 0.00 -2.12 1.82 -2.03 -3.37 116.42 112.78 2yue h ASP 24 Ca -0.23 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.41 2yue h ASP 24 Cb 1.25 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.26 2yue h ASP 24 CO 0.29 0.00 -0.14 0.61 -1.61 0.00 0.00 179.24 178.39 2yue n GLY 25 N -1.42 -0.14 0.00 -0.78 0.00 -1.26 -5.12 105.19 96.47 2yue n GLY 25 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2yue n GLY 25 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2yue n THR 26 N -3.17 0.00 -3.53 2.61 5.66 -1.26 -5.08 114.28 109.50 2yue n THR 26 Ca 0.00 0.00 -0.16 0.00 -3.05 0.00 0.00 64.05 60.84 2yue n THR 26 Cb 0.07 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 68.79 2yue n THR 26 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 2yue s LEU 27 N 0.00 -0.58 -0.18 1.09 0.20 -1.26 -4.19 118.68 113.76 2yue s LEU 27 Ca 0.00 0.62 0.01 0.00 0.69 0.00 0.00 54.13 55.44 2yue s LEU 27 Cb 0.00 2.35 0.03 0.00 -0.43 0.00 0.00 46.19 48.14 2yue s LEU 27 CO 0.00 -0.54 -0.15 0.00 -0.29 0.00 0.00 176.35 175.37 2yue s ALA 28 N -1.22 2.09 0.16 5.97 0.00 0.64 -2.09 121.76 127.31 2yue s ALA 28 Ca -0.08 -1.12 0.09 0.00 0.00 0.00 0.00 51.96 50.84 2yue s ALA 28 Cb -0.00 -1.18 -0.04 0.00 0.00 0.00 0.00 23.12 21.90 2yue s ALA 28 CO 0.07 -0.51 -0.20 -0.98 0.00 0.00 0.00 175.76 174.14 2yue s ARG 29 N 1.38 1.29 0.30 0.00 1.70 -0.31 -0.15 118.95 123.15 2yue s ARG 29 Ca 0.03 -1.38 -0.25 0.00 -0.47 0.00 0.00 55.73 53.66 2yue s ARG 29 Cb -0.14 -1.44 -0.09 0.00 -0.57 0.00 0.00 34.95 32.70 2yue s ARG 29 CO -0.11 0.31 0.90 -0.98 -1.08 0.00 0.00 175.30 174.34 2yue s ARG 30 N -2.58 4.53 -0.17 3.89 1.04 -1.20 -0.11 118.95 124.34 2yue s ARG 30 Ca 0.15 1.24 -0.16 0.00 -1.04 0.00 0.00 55.73 55.91 2yue s ARG 30 Cb -0.07 -2.84 -0.12 0.00 -2.04 0.00 0.00 34.95 29.87 2yue s ARG 30 CO 0.07 0.32 0.10 0.35 -0.04 0.00 0.00 175.30 176.09 2yue h PHE 31 N 3.28 0.00 -1.52 5.89 3.57 -1.86 -3.44 116.94 122.87 2yue h PHE 31 Ca -0.47 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.03 2yue h PHE 31 Cb 1.19 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.93 2yue h PHE 31 CO 0.62 0.79 0.01 -0.85 -2.23 0.00 0.00 178.31 176.65 2yue n GLU 32 N -4.54 0.01 -0.18 1.11 0.28 -1.26 -5.07 120.64 110.99 2yue n GLU 32 Ca -0.19 -0.02 0.03 0.00 -0.16 0.00 0.00 57.16 56.82 2yue n GLU 32 Cb 0.46 0.03 -0.01 0.00 1.43 0.00 0.00 31.44 33.35 2yue n GLU 32 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2yue n SER 33 N -0.51 -5.45 0.03 -1.84 2.88 -1.26 -4.73 113.62 102.74 2yue n SER 33 Ca -0.00 0.20 0.00 0.00 -1.33 0.00 0.00 58.87 57.74 2yue n SER 33 Cb 0.01 -0.56 0.00 0.00 -0.75 0.00 0.00 64.21 62.91 2yue n SER 33 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2yue n PHE 34 N -2.01 -0.06 -0.83 0.66 3.72 -1.26 -5.09 117.46 112.59 2yue n PHE 34 Ca 0.00 0.01 -0.30 0.00 -0.05 0.00 0.00 57.45 57.11 2yue n PHE 34 Cb 0.08 0.02 0.26 0.00 -0.94 0.00 0.00 39.48 38.91 2yue n PHE 34 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2yue n ARG 36 N -5.14 -2.83 -2.71 0.00 1.74 -1.12 -4.74 116.66 101.86 2yue n ARG 36 Ca 0.14 2.37 -0.08 0.00 -0.77 0.00 0.00 57.85 59.52 2yue n ARG 36 Cb 0.60 -4.39 0.10 0.00 -1.02 0.00 0.00 32.46 27.75 2yue n ARG 36 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2yue n ALA 37 N 0.88 -0.36 -2.83 7.54 0.00 -1.26 -3.66 120.51 120.82 2yue n ALA 37 Ca -0.01 -1.30 -0.33 0.00 0.00 0.00 0.00 53.44 51.80 2yue n ALA 37 Cb 0.13 -1.23 -0.06 0.00 0.00 0.00 0.00 19.45 18.29 2yue n ALA 37 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2yue s ILE 38 N 0.22 5.01 0.02 0.00 1.01 -1.26 -0.53 121.20 125.67 2yue s ILE 38 Ca 0.21 -0.34 -0.02 0.00 0.00 0.00 0.00 60.65 60.50 2yue s ILE 38 Cb 0.32 -3.32 -0.02 0.00 0.01 0.00 0.00 42.46 39.44 2yue s ILE 38 CO -0.07 0.32 0.02 0.42 0.00 0.00 0.00 174.94 175.62 2yue s THR 39 N -1.27 0.12 0.30 2.92 -4.23 0.89 -0.13 115.64 114.24 2yue s THR 39 Ca 0.25 -1.03 0.02 0.00 -1.18 0.00 0.00 61.69 59.75 2yue s THR 39 Cb -0.12 -0.56 -0.01 0.00 1.34 0.00 0.00 72.50 73.15 2yue s THR 39 CO 0.17 -0.56 0.06 0.49 -0.54 0.00 0.00 174.62 174.23 2yue n PHE 40 N 1.24 0.38 -3.26 3.99 3.01 -1.26 -0.28 117.46 121.29 2yue n PHE 40 Ca -0.22 -1.69 -0.37 0.00 1.01 0.00 0.00 57.45 56.18 2yue n PHE 40 Cb 0.56 -0.10 -0.06 0.00 -0.01 0.00 0.00 39.48 39.88 2yue n PHE 40 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2yue s SER 41 N -2.73 7.00 0.17 4.37 1.04 -0.91 -3.05 113.70 119.59 2yue s SER 41 Ca 0.08 1.25 -0.09 0.00 0.48 0.00 0.00 55.95 57.67 2yue s SER 41 Cb 0.00 -2.35 0.03 0.00 0.10 0.00 0.00 66.02 63.81 2yue s SER 41 CO 0.06 0.18 1.55 0.00 0.98 0.00 0.00 173.24 176.00 2yue h ALA 42 N 4.02 0.70 -2.89 5.32 0.00 -1.40 -3.39 119.26 121.62 2yue h ALA 42 Ca -0.49 -0.41 -0.38 0.00 0.00 0.00 0.00 54.91 53.64 2yue h ALA 42 Cb 1.20 -0.15 -0.18 0.00 0.00 0.00 0.00 17.79 18.66 2yue h ALA 42 CO 0.65 0.67 -0.75 -0.98 0.00 0.00 0.00 179.25 178.83 2yue s ARG 43 N -4.58 0.93 -0.17 0.00 1.70 -1.26 -4.87 118.95 110.70 2yue s ARG 43 Ca -0.11 -1.17 -0.29 0.00 -0.47 0.00 0.00 55.73 53.69 2yue s ARG 43 Cb 0.12 -0.75 -0.03 0.00 -0.57 0.00 0.00 34.95 33.72 2yue s ARG 43 CO 0.87 0.14 1.58 -1.25 -1.08 0.00 0.00 175.30 175.55 2yue s PRO 44 N -2.61 3.94 0.26 3.89 0.04 -1.26 -4.82 135.00 134.44 2yue s PRO 44 Ca 0.06 1.78 -0.11 0.00 0.04 0.00 0.00 61.00 62.78 2yue s PRO 44 Cb -0.05 -3.99 -0.08 0.00 0.04 0.00 0.00 34.50 30.43 2yue s PRO 44 CO 0.02 -1.11 0.60 0.14 0.04 0.00 0.00 177.00 176.69 2yue s VAL 45 N 4.69 4.86 0.72 -0.36 -7.23 -1.13 -4.93 120.40 117.03 2yue s VAL 45 Ca 0.70 0.59 -0.09 0.00 -1.81 0.00 0.00 61.98 61.36 2yue s VAL 45 Cb -0.26 -3.62 0.05 0.00 0.56 0.00 0.00 36.38 33.11 2yue s VAL 45 CO 0.27 -0.12 1.07 -0.60 -0.31 0.00 0.00 175.10 175.41 2yue s ARG 46 N -2.92 2.34 0.03 4.82 3.52 -1.26 -4.41 118.95 121.07 2yue s ARG 46 Ca 0.49 0.03 -0.11 0.00 -0.13 0.00 0.00 55.73 56.02 2yue s ARG 46 Cb -0.11 -2.08 -0.05 0.00 -1.56 0.00 0.00 34.95 31.15 2yue s ARG 46 CO 0.21 -1.25 1.17 0.82 -0.81 0.00 0.00 175.30 175.44 2yue h ILE 47 N -0.71 0.00 0.00 4.11 1.08 -1.94 -2.11 117.51 117.94 2yue h ILE 47 Ca -0.45 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.02 2yue h ILE 47 Cb 1.30 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.05 2yue h ILE 47 CO 0.63 0.00 0.00 0.78 -0.69 0.00 0.00 178.15 178.87 2yue h ASN 48 N -0.29 0.00 -1.12 1.72 -0.26 -1.89 -3.06 115.58 110.69 2yue h ASN 48 Ca -0.02 0.00 -0.61 0.00 -0.56 0.00 0.00 56.30 55.11 2yue h ASN 48 Cb 0.26 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.50 2yue h ASN 48 CO -0.03 0.00 1.50 1.21 -1.06 0.00 0.00 177.43 179.04 2yue n GLU 49 N -3.05 1.02 -2.79 0.81 2.13 -0.80 -4.81 120.64 113.15 2yue n GLU 49 Ca -0.02 0.23 -0.40 0.00 0.66 0.00 0.00 57.16 57.63 2yue n GLU 49 Cb 0.15 -2.57 -0.05 0.00 0.27 0.00 0.00 31.44 29.24 2yue n GLU 49 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 2yue s ARG 50 N 6.85 4.75 0.02 5.31 6.06 -1.26 -4.66 118.95 136.01 2yue s ARG 50 Ca 1.10 1.40 0.09 0.00 -2.50 0.00 0.00 55.73 55.82 2yue s ARG 50 Cb -0.76 -3.31 -0.03 0.00 0.06 0.00 0.00 34.95 30.92 2yue s ARG 50 CO 0.44 0.43 -0.26 0.42 -2.50 0.00 0.00 175.30 173.83 2yue s ILE 51 N -0.77 2.16 0.04 4.11 1.01 -1.06 -4.45 121.20 122.23 2yue s ILE 51 Ca 0.42 -1.25 0.05 0.00 0.00 0.00 0.00 60.65 59.87 2yue s ILE 51 Cb -0.24 -1.80 -0.02 0.00 0.01 0.00 0.00 42.46 40.40 2yue s ILE 51 CO 0.30 0.46 -0.15 0.00 0.00 0.00 0.00 174.94 175.55 2yue s VAL 53 N -0.87 -0.32 -0.13 0.00 1.01 0.92 -0.84 120.40 120.17 2yue s VAL 53 Ca 0.02 0.07 -0.23 0.00 0.00 0.00 0.00 61.98 61.84 2yue s VAL 53 Cb -0.08 -0.54 -0.03 0.00 0.00 0.00 0.00 36.38 35.73 2yue s VAL 53 CO 0.01 -0.06 0.69 -0.75 0.00 0.00 0.00 175.10 174.99 2yue s LYS 54 N 2.33 4.34 -0.84 2.72 2.20 0.78 -0.08 119.74 131.19 2yue s LYS 54 Ca 0.05 0.80 -0.25 0.00 -0.36 0.00 0.00 55.97 56.21 2yue s LYS 54 Cb -0.14 -3.51 -0.02 0.00 -1.51 0.00 0.00 37.83 32.65 2yue s LYS 54 CO -0.10 -0.10 1.80 -0.06 -0.36 0.00 0.00 175.35 176.53 2yue s PHE 55 N 1.39 1.92 0.01 4.03 0.08 -0.47 -1.40 117.98 123.54 2yue s PHE 55 Ca 0.34 0.39 -0.26 0.00 0.12 0.00 0.00 56.93 57.52 2yue s PHE 55 Cb -0.17 -4.20 -0.14 0.00 -0.57 0.00 0.00 43.02 37.94 2yue s PHE 55 CO 0.14 -1.94 1.08 0.00 -0.10 0.00 0.00 175.22 174.41 2yue h ALA 56 N 11.87 -0.87 -4.10 5.36 0.00 -1.80 -2.69 119.26 127.02 2yue h ALA 56 Ca -0.00 -0.20 -0.69 0.00 0.00 0.00 0.00 54.91 54.02 2yue h ALA 56 Cb 1.05 0.34 -0.24 0.00 0.00 0.00 0.00 17.79 18.94 2yue h ALA 56 CO 1.25 -0.83 -0.83 -1.21 0.00 0.00 0.00 179.25 177.64 2yue s GLU 57 N -4.57 2.05 0.02 0.00 8.01 -0.74 -4.71 118.70 118.75 2yue s GLU 57 Ca -0.14 -0.98 0.03 0.00 0.01 0.00 0.00 54.97 53.89 2yue s GLU 57 Cb 0.01 -2.15 -0.01 0.00 -4.31 0.00 0.00 34.13 27.67 2yue s GLU 57 CO 0.42 0.54 -0.10 0.42 0.01 0.00 0.00 175.26 176.56 2yue s ILE 58 N -0.86 0.75 -0.23 -1.63 -1.09 -1.26 -1.23 121.20 115.65 2yue s ILE 58 Ca 0.13 -0.66 -0.08 0.00 -2.23 0.00 0.00 60.65 57.81 2yue s ILE 58 Cb -0.10 -0.68 -0.04 0.00 -1.58 0.00 0.00 42.46 40.06 2yue s ILE 58 CO 0.04 0.03 0.09 -0.94 -1.23 0.00 0.00 174.94 172.92 2yue s SER 59 N -0.71 5.49 -0.68 3.58 1.04 -1.26 -4.71 113.70 116.45 2yue s SER 59 Ca 0.00 -0.06 0.05 0.00 0.48 0.00 0.00 55.95 56.42 2yue s SER 59 Cb -0.06 -1.98 0.21 0.00 0.10 0.00 0.00 66.02 64.30 2yue s SER 59 CO 0.00 0.04 0.63 0.59 0.98 0.00 0.00 173.24 175.48 2yue n ASN 60 N 4.45 3.45 0.00 7.02 3.02 -1.26 -4.18 115.26 127.75 2yue n ASN 60 Ca -0.16 -3.34 0.00 0.00 -0.03 0.00 0.00 54.58 51.06 2yue n ASN 60 Cb 0.52 -0.72 0.00 0.00 -0.61 0.00 0.00 39.78 38.97 2yue n ASN 60 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2yue n ASN 61 N 1.38 0.00 -3.26 6.41 2.85 -1.26 -5.15 115.26 116.23 2yue n ASN 61 Ca 0.25 0.00 -0.22 0.00 -0.11 0.00 0.00 54.58 54.50 2yue n ASN 61 Cb 0.38 0.01 0.19 0.00 1.24 0.00 0.00 39.78 41.60 2yue n ASN 61 CO 0.00 0.00 0.00 0.79 -2.11 0.00 0.00 177.26 175.94 2yue n TRP 62 N -0.92 -3.61 -4.69 1.20 5.03 -1.26 -5.07 117.44 108.13 2yue n TRP 62 Ca 0.00 -0.72 -0.28 0.00 3.03 0.00 0.00 57.50 59.53 2yue n TRP 62 Cb 0.00 -0.87 -0.14 0.00 -1.03 0.00 0.00 31.31 29.27 2yue n TRP 62 CO 0.00 0.00 0.00 1.21 -0.03 0.00 0.00 177.69 178.87 2yue s ASN 63 N -3.53 2.95 0.00 -0.99 2.47 -1.26 -4.92 114.94 109.65 2yue s ASN 63 Ca 0.53 -0.61 0.00 0.00 0.42 0.00 0.00 52.86 53.20 2yue s ASN 63 Cb -0.06 -0.24 0.00 0.00 -1.45 0.00 0.00 41.25 39.50 2yue s ASN 63 CO 0.41 0.20 0.00 0.61 -3.72 0.00 0.00 177.10 174.60 2yue n GLY 64 N 1.58 -0.57 0.00 1.21 0.00 -1.26 -4.62 105.19 101.53 2yue n GLY 64 Ca -0.17 -2.02 -0.00 0.00 0.00 0.00 0.00 46.02 43.83 2yue n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yue n GLY 65 N 0.00 2.30 4.02 -0.02 0.00 -1.25 -4.04 105.19 106.20 2yue n GLY 65 Ca 0.00 -1.11 -0.19 0.00 0.00 0.00 0.00 46.02 44.72 2yue n GLY 65 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2yue s ILE 66 N -2.84 2.39 -0.00 -0.61 -4.36 -1.26 -4.16 121.20 110.35 2yue s ILE 66 Ca 0.00 -1.02 -0.03 0.00 -0.26 0.00 0.00 60.65 59.34 2yue s ILE 66 Cb -0.00 -2.41 -0.00 0.00 1.25 0.00 0.00 42.46 41.29 2yue s ILE 66 CO 0.00 0.00 0.05 0.00 0.24 0.00 0.00 174.94 175.23 2yue s ARG 67 N -4.55 0.27 -0.10 0.37 1.04 -1.12 -3.99 118.95 110.86 2yue s ARG 67 Ca 0.59 -0.29 -0.08 0.00 -1.04 0.00 0.00 55.73 54.91 2yue s ARG 67 Cb -0.07 0.11 0.03 0.00 -2.04 0.00 0.00 34.95 32.98 2yue s ARG 67 CO 0.36 -0.05 0.26 -0.59 -0.04 0.00 0.00 175.30 175.24 2yue s PHE 68 N -0.88 -0.32 0.00 5.89 -0.71 0.86 -1.34 117.98 121.48 2yue s PHE 68 Ca -0.10 0.76 0.00 0.00 -1.04 0.00 0.00 56.93 56.55 2yue s PHE 68 Cb -0.06 0.09 0.00 0.00 -1.21 0.00 0.00 43.02 41.84 2yue s PHE 68 CO 0.00 -0.18 0.00 0.41 -1.34 0.00 0.00 175.22 174.11 2yue n GLY 69 N 3.47 2.01 3.55 1.99 0.00 -0.43 -0.79 105.19 115.00 2yue n GLY 69 Ca -0.18 -0.57 -0.26 0.00 0.00 0.00 0.00 46.02 45.02 2yue n GLY 69 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2yue s PHE 70 N -2.00 1.99 0.26 1.61 0.08 -0.61 -0.79 117.98 118.53 2yue s PHE 70 Ca 0.00 -1.00 -0.09 0.00 0.12 0.00 0.00 56.93 55.96 2yue s PHE 70 Cb 0.00 -1.39 -0.01 0.00 -0.57 0.00 0.00 43.02 41.06 2yue s PHE 70 CO 0.00 0.04 0.44 -0.08 -0.10 0.00 0.00 175.22 175.51 2yue s THR 71 N -3.11 0.00 -0.15 0.64 -1.32 0.48 -0.19 115.64 111.98 2yue s THR 71 Ca 0.28 -1.51 -0.09 0.00 -1.21 0.00 0.00 61.69 59.15 2yue s THR 71 Cb 0.06 -2.34 -0.07 0.00 -1.51 0.00 0.00 72.50 68.64 2yue s THR 71 CO 0.14 0.00 -0.22 -0.24 -2.21 0.00 0.00 174.62 172.09 2yue n SER 72 N -0.57 1.26 -4.65 8.08 2.88 0.89 -2.90 113.62 118.61 2yue n SER 72 Ca -0.01 0.21 -0.31 0.00 -1.33 0.00 0.00 58.87 57.44 2yue n SER 72 Cb 0.62 -0.51 0.18 0.00 -0.75 0.00 0.00 64.21 63.75 2yue n SER 72 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 2yue s ASN 73 N -6.43 2.64 0.37 -3.46 0.01 -1.26 -4.78 114.94 102.03 2yue s ASN 73 Ca -0.23 2.07 -0.24 0.00 -0.71 0.00 0.00 52.86 53.75 2yue s ASN 73 Cb 0.08 -2.52 -0.10 0.00 0.41 0.00 0.00 41.25 39.11 2yue s ASN 73 CO 0.29 -3.26 0.95 -1.81 -1.51 0.00 0.00 177.10 171.76 2yue s ASP 74 N -2.67 7.14 0.55 -1.22 1.01 -1.26 -4.80 116.67 115.43 2yue s ASP 74 Ca 0.67 1.77 0.34 0.00 0.71 0.00 0.00 52.55 56.04 2yue s ASP 74 Cb -0.23 -2.56 1.41 0.00 1.01 0.00 0.00 42.92 42.55 2yue s ASP 74 CO 0.59 -0.21 2.00 1.55 0.21 0.00 0.00 175.17 179.31 2yue h PRO 75 N 2.57 0.00 0.00 8.23 0.13 -1.94 -2.72 132.00 138.27 2yue h PRO 75 Ca -0.48 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.57 2yue h PRO 75 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 2yue h PRO 75 CO 0.63 0.00 -0.41 -0.39 -0.23 0.00 0.00 178.00 177.60 2yue h VAL 76 N 0.00 0.83 -0.10 1.56 -1.51 -1.95 -2.87 116.25 112.21 2yue h VAL 76 Ca 0.00 -1.76 0.00 0.00 -1.23 0.00 0.00 66.70 63.71 2yue h VAL 76 Cb 0.49 2.11 0.00 0.00 -2.13 0.00 0.00 31.29 31.76 2yue h VAL 76 CO 0.00 0.40 0.00 0.35 -1.23 0.00 0.00 177.57 177.09 2yue n THR 77 N -3.38 0.13 0.03 7.19 -2.24 -1.03 -3.44 114.28 111.54 2yue n THR 77 Ca 0.01 -0.20 0.02 0.00 -2.27 0.00 0.00 64.05 61.61 2yue n THR 77 Cb 0.59 0.08 -0.03 0.00 -2.10 0.00 0.00 70.33 68.87 2yue n THR 77 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2yue n LEU 78 N -0.15 0.03 -4.63 3.22 4.77 -1.10 -4.91 117.00 114.24 2yue n LEU 78 Ca 0.14 -0.07 -0.48 0.00 -0.03 0.00 0.00 56.01 55.57 2yue n LEU 78 Cb 0.20 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.25 2yue n LEU 78 CO 0.11 0.01 0.95 1.21 -1.33 0.00 0.00 177.39 178.34 2yue n GLU 79 N -1.57 1.64 -1.48 3.23 2.13 -1.14 -0.10 120.64 123.35 2yue n GLU 79 Ca -0.01 0.59 -0.17 0.00 0.66 0.00 0.00 57.16 58.23 2yue n GLU 79 Cb 0.11 -2.22 -0.07 0.00 0.27 0.00 0.00 31.44 29.53 2yue n GLU 79 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2yue n GLY 80 N 2.47 1.59 2.51 8.31 0.00 -1.26 -4.82 105.19 113.98 2yue n GLY 80 Ca 0.15 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 46.04 2yue n GLY 80 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2yue n THR 81 N -2.32 -0.03 -4.33 2.61 -2.24 0.86 -5.13 114.28 103.70 2yue n THR 81 Ca -0.17 -2.77 -0.28 0.00 -2.27 0.00 0.00 64.05 58.57 2yue n THR 81 Cb 0.65 0.76 -0.11 0.00 -2.10 0.00 0.00 70.33 69.53 2yue n THR 81 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2yue s LEU 82 N -2.40 2.75 0.00 3.22 1.43 -1.21 -4.75 118.68 117.71 2yue s LEU 82 Ca 0.29 -0.64 -0.02 0.00 -1.03 0.00 0.00 54.13 52.73 2yue s LEU 82 Cb 0.32 -1.50 0.03 0.00 0.03 0.00 0.00 46.19 45.07 2yue s LEU 82 CO -0.06 0.13 0.10 -0.81 0.23 0.00 0.00 176.35 175.94 2yue n PRO 83 N 0.36 -1.21 0.08 1.29 -0.04 -1.26 -4.99 135.00 129.23 2yue n PRO 83 Ca -0.13 -0.16 -0.17 0.00 -0.04 0.00 0.00 63.50 63.00 2yue n PRO 83 Cb 0.55 -0.15 -0.14 0.00 -0.04 0.00 0.00 33.50 33.72 2yue n PRO 83 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2yue h LYS 84 N 0.00 0.28 0.00 0.54 1.79 -2.01 -3.46 116.57 113.71 2yue h LYS 84 Ca -0.04 -0.48 -0.42 0.00 -2.18 0.00 0.00 60.65 57.54 2yue h LYS 84 Cb 0.11 0.18 -0.09 0.00 -1.58 0.00 0.00 32.23 30.85 2yue h LYS 84 CO 0.02 1.17 -0.33 2.48 -1.08 0.00 0.00 179.45 181.71 2yue n TYR 85 N -3.50 0.28 -0.19 -1.35 0.18 -1.26 -2.79 117.16 108.53 2yue n TYR 85 Ca -0.14 -1.85 0.12 0.00 1.88 0.00 0.00 57.90 57.90 2yue n TYR 85 Cb 1.04 -0.06 0.30 0.00 -0.38 0.00 0.00 39.34 40.24 2yue n TYR 85 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2yue n ALA 86 N -1.67 2.39 0.00 -3.48 0.00 -1.26 -4.46 120.51 112.03 2yue n ALA 86 Ca -0.12 -1.22 0.00 0.00 0.00 0.00 0.00 53.44 52.10 2yue n ALA 86 Cb 0.44 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.96 2yue n ALA 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yue n PRO 88 N -0.02 0.07 0.00 0.00 -0.04 -1.26 -4.81 135.00 128.94 2yue n PRO 88 Ca 0.00 0.22 0.00 0.00 -0.04 0.00 0.00 63.50 63.68 2yue n PRO 88 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 2yue n PRO 88 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2yue n ASP 89 N -1.43 0.00 -3.66 3.54 9.92 -1.26 -1.25 116.55 122.41 2yue n ASP 89 Ca 0.05 0.81 -0.42 0.00 -0.53 0.00 0.00 54.79 54.70 2yue n ASP 89 Cb 0.15 -0.31 -0.03 0.00 -0.64 0.00 0.00 41.12 40.29 2yue n ASP 89 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2yue n LEU 90 N -2.03 5.60 0.01 0.64 4.77 -1.18 -3.47 117.00 121.34 2yue n LEU 90 Ca 0.00 -3.54 0.00 0.00 -0.03 0.00 0.00 56.01 52.44 2yue n LEU 90 Cb 0.00 -1.39 0.00 0.00 -2.33 0.00 0.00 43.42 39.70 2yue n LEU 90 CO 0.00 0.45 0.00 0.35 -1.33 0.00 0.00 177.39 176.86 2yue n THR 91 N 5.45 0.00 0.24 -5.08 -2.24 -1.09 -4.40 114.28 107.16 2yue n THR 91 Ca 0.51 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 62.37 2yue n THR 91 Cb 0.39 0.00 0.59 0.00 -2.10 0.00 0.00 70.33 69.21 2yue n THR 91 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2yue h ASN 92 N 0.00 0.00 -3.67 3.42 7.08 -1.21 -3.40 115.58 117.80 2yue h ASN 92 Ca 0.00 0.00 -0.55 0.00 -3.08 0.00 0.00 56.30 52.67 2yue h ASN 92 Cb 0.00 0.00 0.18 0.00 -2.08 0.00 0.00 38.32 36.42 2yue h ASN 92 CO 0.00 0.12 -0.02 0.54 -2.08 0.00 0.00 177.43 175.99 2yue n ARG 93 N -4.25 0.38 -2.09 4.14 1.74 -1.24 -4.86 116.66 110.47 2yue n ARG 93 Ca -0.03 0.18 -0.43 0.00 -0.77 0.00 0.00 57.85 56.81 2yue n ARG 93 Cb 0.20 -2.14 -0.03 0.00 -1.02 0.00 0.00 32.46 29.47 2yue n ARG 93 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2yue s PRO 94 N -3.31 3.45 0.00 5.56 0.04 -1.26 -3.23 135.00 136.25 2yue s PRO 94 Ca 0.71 1.35 0.00 0.00 0.04 0.00 0.00 61.00 63.10 2yue s PRO 94 Cb -0.33 -4.14 0.00 0.00 0.04 0.00 0.00 34.50 30.07 2yue s PRO 94 CO 0.53 -1.72 0.00 0.41 0.04 0.00 0.00 177.00 176.26 2yue n GLY 95 N 5.26 0.74 2.93 0.56 0.00 -1.26 -4.85 105.19 108.57 2yue n GLY 95 Ca 0.21 -0.21 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 2yue n GLY 95 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2yue s PHE 96 N -2.06 -0.22 0.03 1.61 0.40 -1.20 -0.08 117.98 116.46 2yue s PHE 96 Ca 0.00 0.61 0.05 0.00 -0.60 0.00 0.00 56.93 56.99 2yue s PHE 96 Cb 0.00 -0.10 -0.02 0.00 0.51 0.00 0.00 43.02 43.41 2yue s PHE 96 CO 0.00 -0.22 -0.15 -1.58 0.70 0.00 0.00 175.22 173.97 2yue s TRP 97 N 1.56 1.32 -0.22 0.36 0.51 0.73 -4.59 118.94 118.61 2yue s TRP 97 Ca -0.05 -0.32 -0.23 0.00 -2.12 0.00 0.00 56.10 53.37 2yue s TRP 97 Cb -0.12 -0.80 0.06 0.00 -0.81 0.00 0.00 33.47 31.80 2yue s TRP 97 CO -0.07 0.03 0.64 0.00 -0.51 0.00 0.00 176.95 177.04 2yue s ALA 98 N -0.69 -1.60 0.06 0.98 0.00 -1.26 -1.57 121.76 117.68 2yue s ALA 98 Ca 0.04 1.75 -0.00 0.00 0.00 0.00 0.00 51.96 53.74 2yue s ALA 98 Cb -0.07 -0.94 -0.04 0.00 0.00 0.00 0.00 23.12 22.07 2yue s ALA 98 CO 0.01 -0.31 -0.04 0.21 0.00 0.00 0.00 175.76 175.63 2yue s LYS 99 N 0.16 0.66 0.20 0.00 2.47 0.03 -4.91 119.74 118.36 2yue s LYS 99 Ca -0.01 -1.23 0.05 0.00 -1.56 0.00 0.00 55.97 53.22 2yue s LYS 99 Cb -0.04 0.09 -0.04 0.00 -1.46 0.00 0.00 37.83 36.39 2yue s LYS 99 CO 0.02 -0.08 0.20 0.00 0.16 0.00 0.00 175.35 175.65 2yue s ALA 100 N -3.77 3.67 0.13 3.13 0.00 -1.26 -0.10 121.76 123.56 2yue s ALA 100 Ca 0.08 -1.27 0.06 0.00 0.00 0.00 0.00 51.96 50.82 2yue s ALA 100 Cb 0.07 -1.44 -0.04 0.00 0.00 0.00 0.00 23.12 21.71 2yue s ALA 100 CO -0.08 0.38 0.03 -1.17 0.00 0.00 0.00 175.76 174.92 2yue s LEU 101 N -3.50 3.50 0.86 0.00 0.20 -1.26 -4.97 118.68 113.51 2yue s LEU 101 Ca 0.32 -0.23 -0.11 0.00 0.69 0.00 0.00 54.13 54.80 2yue s LEU 101 Cb -0.09 -2.18 0.11 0.00 -0.43 0.00 0.00 46.19 43.60 2yue s LEU 101 CO 0.25 0.12 1.10 -2.28 -0.29 0.00 0.00 176.35 175.25 2yue s HIS 102 N -1.55 2.26 0.05 5.38 5.65 -1.26 -4.85 115.29 120.97 2yue s HIS 102 Ca 0.28 1.45 0.16 0.00 0.25 0.00 0.00 55.06 57.20 2yue s HIS 102 Cb -0.11 -3.14 0.38 0.00 -1.18 0.00 0.00 32.58 28.54 2yue s HIS 102 CO 0.20 -2.30 1.59 1.05 -0.65 0.00 0.00 174.74 174.63 2yue h GLU 103 N -1.49 0.00 0.00 2.88 4.11 -1.99 -3.08 114.58 115.01 2yue h GLU 103 Ca -0.47 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 58.94 2yue h GLU 103 Cb 1.26 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.51 2yue h GLU 103 CO 0.51 0.48 -0.10 -0.56 0.07 0.00 0.00 179.01 179.41 2yue h GLN 104 N 0.00 0.00 -0.44 1.06 3.07 -2.05 -1.90 115.11 114.85 2yue h GLN 104 Ca -0.00 0.00 -0.20 0.00 0.09 0.00 0.00 58.65 58.54 2yue h GLN 104 Cb 1.15 0.00 -0.12 0.00 0.08 0.00 0.00 27.48 28.59 2yue h GLN 104 CO 0.06 0.10 0.05 0.66 0.09 0.00 0.00 178.83 179.80 2yue n TYR 105 N -3.86 1.40 -2.88 0.06 4.01 -1.16 -4.71 117.16 110.01 2yue n TYR 105 Ca -0.02 -1.48 -0.30 0.00 -0.16 0.00 0.00 57.90 55.93 2yue n TYR 105 Cb 0.20 -0.53 -0.03 0.00 -0.31 0.00 0.00 39.34 38.67 2yue n TYR 105 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2yue n GLU 107 N -0.20 0.93 -3.41 0.00 -0.58 -1.26 -5.00 120.64 111.13 2yue n GLU 107 Ca 0.34 -3.12 -0.25 0.00 -0.42 0.00 0.00 57.16 53.72 2yue n GLU 107 Cb 0.36 0.91 -0.02 0.00 -0.57 0.00 0.00 31.44 32.13 2yue n GLU 107 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 2yue s LYS 108 N -3.53 3.50 -1.63 3.49 2.36 -1.26 -4.25 119.74 118.42 2yue s LYS 108 Ca 0.02 -0.30 0.00 0.00 -2.55 0.00 0.00 55.97 53.13 2yue s LYS 108 Cb 0.00 -2.68 0.00 0.00 -1.05 0.00 0.00 37.83 34.10 2yue s LYS 108 CO 0.01 0.18 0.00 -3.47 1.55 0.00 0.00 175.35 173.62 2yue n ASP 109 N -1.59 -5.12 -4.48 1.43 2.03 -1.02 -4.98 116.55 102.82 2yue n ASP 109 Ca -0.04 0.16 -0.33 0.00 0.52 0.00 0.00 54.79 55.09 2yue n ASP 109 Cb 0.56 -4.18 -0.13 0.00 -0.72 0.00 0.00 41.12 36.65 2yue n ASP 109 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 2yue s ASN 110 N -2.44 4.52 -0.46 1.67 -0.87 -1.26 -4.94 114.94 111.16 2yue s ASN 110 Ca 0.00 -0.16 -0.21 0.00 -1.57 0.00 0.00 52.86 50.92 2yue s ASN 110 Cb 0.00 -1.55 0.03 0.00 -0.02 0.00 0.00 41.25 39.71 2yue s ASN 110 CO 0.00 0.22 0.69 -0.63 -2.57 0.00 0.00 177.10 174.82 2yue s ILE 111 N 0.02 4.76 -0.47 0.60 1.09 -1.26 -1.37 121.20 124.57 2yue s ILE 111 Ca -0.01 0.10 -0.17 0.00 -1.10 0.00 0.00 60.65 59.47 2yue s ILE 111 Cb -0.14 -4.27 0.06 0.00 -1.06 0.00 0.00 42.46 37.05 2yue s ILE 111 CO 0.03 -0.69 0.48 -0.22 -0.10 0.00 0.00 174.94 174.45 2yue s LEU 112 N 2.98 5.24 0.09 2.97 2.96 0.89 -2.91 118.68 130.90 2yue s LEU 112 Ca 0.24 -1.05 0.09 0.00 -0.22 0.00 0.00 54.13 53.19 2yue s LEU 112 Cb -0.14 -2.31 -0.04 0.00 0.50 0.00 0.00 46.19 44.20 2yue s LEU 112 CO 0.19 -0.72 -0.22 -0.72 -1.32 0.00 0.00 176.35 173.56 2yue s TYR 113 N 2.09 2.44 -0.09 5.38 -0.85 -0.75 -0.06 117.35 125.51 2yue s TYR 113 Ca 0.09 -0.32 -0.30 0.00 -0.52 0.00 0.00 57.07 56.03 2yue s TYR 113 Cb -0.21 -1.35 0.08 0.00 0.38 0.00 0.00 41.96 40.86 2yue s TYR 113 CO 0.10 0.30 0.74 1.52 -1.52 0.00 0.00 175.55 176.69 2yue s TYR 114 N -1.02 -0.63 0.00 -3.49 1.13 -0.13 -0.12 117.35 113.08 2yue s TYR 114 Ca 0.15 1.15 0.00 0.00 -1.41 0.00 0.00 57.07 56.96 2yue s TYR 114 Cb -0.10 0.40 -0.00 0.00 -1.10 0.00 0.00 41.96 41.16 2yue s TYR 114 CO 0.07 -0.54 0.00 2.48 -2.51 0.00 0.00 175.55 175.05 2yue n TYR 115 N 1.10 -0.26 -3.88 -3.49 4.11 0.33 -2.57 117.16 112.50 2yue n TYR 115 Ca -0.17 -0.01 -0.11 0.00 -0.00 0.00 0.00 57.90 57.60 2yue n TYR 115 Cb 0.57 0.00 -0.12 0.00 -0.00 0.00 0.00 39.34 39.79 2yue n TYR 115 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 2yue s VAL 116 N -2.26 0.04 0.38 -3.48 0.11 -1.16 -0.12 120.40 113.91 2yue s VAL 116 Ca 0.00 -0.34 0.02 0.00 -2.93 0.00 0.00 61.98 58.72 2yue s VAL 116 Cb 0.00 -0.21 0.07 0.00 -1.53 0.00 0.00 36.38 34.71 2yue s VAL 116 CO 0.00 -0.19 0.52 -0.46 -3.33 0.00 0.00 175.10 171.64 2yue n ASN 117 N 2.39 0.90 0.00 3.54 0.23 -0.45 -3.20 115.26 118.67 2yue n ASN 117 Ca -0.17 -1.71 0.11 0.00 -0.53 0.00 0.00 54.58 52.28 2yue n ASN 117 Cb 0.58 -0.32 0.55 0.00 -2.08 0.00 0.00 39.78 38.51 2yue n ASN 117 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2yue n GLY 118 N 0.85 -0.98 2.16 4.83 0.00 -1.26 -2.89 105.19 107.89 2yue n GLY 118 Ca 0.09 -0.10 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 2yue n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yue n ALA 119 N -1.27 5.33 -2.23 4.61 0.00 -1.26 -4.89 120.51 120.81 2yue n ALA 119 Ca 0.11 -2.77 -0.13 0.00 0.00 0.00 0.00 53.44 50.65 2yue n ALA 119 Cb 0.17 -1.39 -0.02 0.00 0.00 0.00 0.00 19.45 18.21 2yue n ALA 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2yue n GLY 120 N -0.90 -0.16 3.42 0.00 0.00 -1.14 -4.87 105.19 101.53 2yue n GLY 120 Ca 0.55 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.20 2yue n GLY 120 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2yue s ASP 121 N -2.04 5.08 -0.27 1.61 1.01 -1.26 -2.94 116.67 117.86 2yue s ASP 121 Ca 0.00 -0.32 -0.16 0.00 0.71 0.00 0.00 52.55 52.78 2yue s ASP 121 Cb 0.00 -1.90 -0.03 0.00 1.01 0.00 0.00 42.92 41.99 2yue s ASP 121 CO 0.00 -0.07 0.45 -0.69 0.21 0.00 0.00 175.17 175.07 2yue s VAL 122 N 1.59 5.12 -0.11 -1.27 1.01 0.86 -1.33 120.40 126.26 2yue s VAL 122 Ca 0.06 0.72 0.01 0.00 0.00 0.00 0.00 61.98 62.77 2yue s VAL 122 Cb -0.15 -3.77 -0.02 0.00 0.00 0.00 0.00 36.38 32.44 2yue s VAL 122 CO 0.03 0.11 -0.14 -0.63 0.00 0.00 0.00 175.10 174.47 2yue s ILE 123 N 2.20 2.98 0.50 2.22 1.09 0.83 -1.35 121.20 129.68 2yue s ILE 123 Ca 0.18 -0.70 0.06 0.00 -1.10 0.00 0.00 60.65 59.09 2yue s ILE 123 Cb -0.16 -2.23 0.01 0.00 -1.06 0.00 0.00 42.46 39.03 2yue s ILE 123 CO 0.10 0.54 0.32 -0.72 -0.10 0.00 0.00 174.94 175.08 2yue s TYR 124 N 0.13 1.93 -0.25 3.97 1.13 -1.20 -0.51 117.35 122.55 2yue s TYR 124 Ca -0.07 -0.77 -0.29 0.00 -1.41 0.00 0.00 57.07 54.53 2yue s TYR 124 Cb -0.15 -1.92 0.17 0.00 -1.10 0.00 0.00 41.96 38.96 2yue s TYR 124 CO 0.05 -0.26 1.24 0.20 -2.51 0.00 0.00 175.55 174.27 2yue s GLY 125 N -4.16 -0.02 0.03 5.49 0.00 0.82 -0.11 107.32 109.37 2yue s GLY 125 Ca 0.34 2.60 0.09 0.00 0.00 0.00 0.00 44.72 47.75 2yue s GLY 125 CO 0.20 1.13 -0.25 -0.42 0.00 0.00 0.00 173.10 173.76 2yue s ILE 126 N -0.99 2.01 -1.42 0.90 -1.09 -0.59 -1.82 121.20 118.20 2yue s ILE 126 Ca 0.05 -1.28 -0.07 0.00 -2.23 0.00 0.00 60.65 57.13 2yue s ILE 126 Cb -0.01 -1.71 0.04 0.00 -1.58 0.00 0.00 42.46 39.20 2yue s ILE 126 CO -0.05 0.38 0.83 0.59 -1.23 0.00 0.00 174.94 175.45 2yue n ASN 127 N 1.95 -2.88 -3.60 3.58 3.02 -1.14 -1.33 115.26 114.85 2yue n ASN 127 Ca -0.17 -0.81 -0.23 0.00 -0.03 0.00 0.00 54.58 53.34 2yue n ASN 127 Cb 0.52 -3.95 0.08 0.00 -0.61 0.00 0.00 39.78 35.82 2yue n ASN 127 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2yue n ASN 128 N -2.95 -5.48 -3.51 6.41 3.02 -1.26 -4.98 115.26 106.50 2yue n ASN 128 Ca -0.14 -0.58 -0.26 0.00 -0.03 0.00 0.00 54.58 53.57 2yue n ASN 128 Cb 0.61 -4.95 -0.14 0.00 -0.61 0.00 0.00 39.78 34.69 2yue n ASN 128 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2yue s GLU 129 N -6.18 0.22 0.79 3.52 2.02 -0.45 -5.14 118.70 113.49 2yue s GLU 129 Ca 0.49 -0.44 -0.14 0.00 0.02 0.00 0.00 54.97 54.90 2yue s GLU 129 Cb -0.22 -1.04 0.07 0.00 0.10 0.00 0.00 34.13 33.04 2yue s GLU 129 CO 0.74 -1.02 1.22 -1.83 0.02 0.00 0.00 175.26 174.39 2yue s GLU 130 N 2.16 1.73 -0.03 1.61 1.03 -1.26 -1.55 118.70 122.39 2yue s GLU 130 Ca 0.09 1.82 0.04 0.00 0.03 0.00 0.00 54.97 56.95 2yue s GLU 130 Cb -0.16 -1.78 -0.06 0.00 -0.80 0.00 0.00 34.13 31.33 2yue s GLU 130 CO -0.36 -2.16 0.05 1.63 -1.33 0.00 0.00 175.26 173.09 2yue n LYS 131 N -3.12 1.98 0.00 -4.83 4.76 0.84 -4.88 118.16 112.91 2yue n LYS 131 Ca 0.14 -0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 2yue n LYS 131 Cb 0.50 -1.11 0.00 0.00 -1.84 0.00 0.00 35.03 32.58 2yue n LYS 131 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2yue n GLY 132 N 2.52 0.60 3.59 0.72 0.00 -1.25 -5.00 105.19 106.39 2yue n GLY 132 Ca -0.05 -2.24 -0.43 0.00 0.00 0.00 0.00 46.02 43.31 2yue n GLY 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2yue s VAL 133 N -0.66 3.70 -0.20 1.61 1.01 -1.26 -3.21 120.40 121.38 2yue s VAL 133 Ca 0.00 0.69 0.14 0.00 0.00 0.00 0.00 61.98 62.81 2yue s VAL 133 Cb 0.00 -4.00 -0.22 0.00 0.00 0.00 0.00 36.38 32.16 2yue s VAL 133 CO 0.00 -0.68 0.01 0.00 0.00 0.00 0.00 175.10 174.43 2yue n ILE 134 N 7.20 1.35 -4.55 2.22 3.06 -0.46 -4.98 119.36 123.21 2yue n ILE 134 Ca 0.19 -0.77 -0.22 0.00 -2.50 0.00 0.00 62.75 59.45 2yue n ILE 134 Cb 0.48 -0.67 -0.14 0.00 0.54 0.00 0.00 39.64 39.85 2yue n ILE 134 CO 0.00 0.00 0.00 -0.22 -2.50 0.00 0.00 176.55 173.83 2yue s LEU 135 N -5.64 2.11 0.00 9.51 2.96 -1.15 -5.03 118.68 121.44 2yue s LEU 135 Ca -0.15 -0.39 0.06 0.00 -0.22 0.00 0.00 54.13 53.43 2yue s LEU 135 Cb 0.06 -0.74 -0.02 0.00 0.50 0.00 0.00 46.19 45.99 2yue s LEU 135 CO 0.75 0.12 0.21 0.35 -1.32 0.00 0.00 176.35 176.46 2yue n THR 136 N 2.23 0.00 -0.73 3.68 -2.24 -1.26 -0.10 114.28 115.85 2yue n THR 136 Ca -0.16 -2.04 0.00 0.00 -2.27 0.00 0.00 64.05 59.57 2yue n THR 136 Cb 0.54 0.95 0.00 0.00 -2.10 0.00 0.00 70.33 69.73 2yue n THR 136 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yue n GLY 137 N -0.49 0.60 3.65 3.38 0.00 -1.15 -4.99 105.19 106.20 2yue n GLY 137 Ca 0.04 -0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.36 2yue n GLY 137 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2yue s ILE 138 N -2.00 4.98 0.61 -0.61 1.09 -1.18 -5.05 121.20 119.04 2yue s ILE 138 Ca 0.00 1.26 -0.13 0.00 -1.10 0.00 0.00 60.65 60.68 2yue s ILE 138 Cb 0.00 -3.98 -0.03 0.00 -1.06 0.00 0.00 42.46 37.38 2yue s ILE 138 CO 0.00 0.07 1.03 -0.62 -0.10 0.00 0.00 174.94 175.32 2yue s ASP 139 N 1.26 5.97 -0.33 3.58 2.15 -1.26 -3.87 116.67 124.17 2yue s ASP 139 Ca 0.30 1.61 0.16 0.00 0.43 0.00 0.00 52.55 55.05 2yue s ASP 139 Cb -0.16 -2.50 0.46 0.00 -0.30 0.00 0.00 42.92 40.42 2yue s ASP 139 CO 0.10 -1.04 1.04 0.35 -0.17 0.00 0.00 175.17 175.44 2yue n THR 140 N -2.41 1.44 -0.06 1.71 -2.24 -1.26 -4.86 114.28 106.59 2yue n THR 140 Ca 0.07 -3.47 -0.12 0.00 -2.27 0.00 0.00 64.05 58.27 2yue n THR 140 Cb 0.54 0.31 -0.04 0.00 -2.10 0.00 0.00 70.33 69.03 2yue n THR 140 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2yue n ARG 141 N -0.31 0.30 -3.84 -0.78 5.12 -1.26 -5.07 116.66 110.81 2yue n ARG 141 Ca 0.17 0.13 -0.26 0.00 -1.93 0.00 0.00 57.85 55.95 2yue n ARG 141 Cb 0.80 -1.01 0.01 0.00 -1.16 0.00 0.00 32.46 31.09 2yue n ARG 141 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2yue s SER 142 N -6.20 4.63 1.01 0.55 0.15 -1.26 -5.10 113.70 107.48 2yue s SER 142 Ca -0.19 -1.28 -0.15 0.00 0.70 0.00 0.00 55.95 55.03 2yue s SER 142 Cb 0.06 0.56 0.05 0.00 -1.71 0.00 0.00 66.02 64.99 2yue s SER 142 CO 0.25 -1.20 0.22 0.18 1.20 0.00 0.00 173.24 173.89 2yue n LEU 143 N -1.85 -1.12 -3.75 3.45 4.77 -1.26 -5.04 117.00 112.20 2yue n LEU 143 Ca -0.01 0.17 -0.13 0.00 -0.03 0.00 0.00 56.01 56.00 2yue n LEU 143 Cb 0.64 -1.10 -0.08 0.00 -2.33 0.00 0.00 43.42 40.55 2yue n LEU 143 CO 0.38 -3.50 0.04 -0.76 -1.33 0.00 0.00 177.39 172.22 2yue s LEU 144 N -0.87 0.81 0.09 2.23 1.43 -1.26 -4.91 118.68 116.20 2yue s LEU 144 Ca 0.56 0.07 0.05 0.00 -1.03 0.00 0.00 54.13 53.78 2yue s LEU 144 Cb -0.18 1.32 -0.03 0.00 0.03 0.00 0.00 46.19 47.33 2yue s LEU 144 CO 0.67 -0.47 -0.14 0.26 0.23 0.00 0.00 176.35 176.90 2yue s TRP 145 N -1.49 1.28 0.39 0.29 0.51 -1.14 -2.86 118.94 115.93 2yue s TRP 145 Ca -0.12 -0.51 -0.00 0.00 -2.12 0.00 0.00 56.10 53.34 2yue s TRP 145 Cb -0.04 -0.70 -0.03 0.00 -0.81 0.00 0.00 33.47 31.89 2yue s TRP 145 CO 0.03 0.09 0.61 0.95 -0.51 0.00 0.00 176.95 178.12 2yue s THR 146 N -1.69 4.77 -0.03 2.01 -4.23 -1.26 -0.39 115.64 114.83 2yue s THR 146 Ca 0.03 -0.39 -0.03 0.00 -1.18 0.00 0.00 61.69 60.12 2yue s THR 146 Cb -0.08 -3.76 0.01 0.00 1.34 0.00 0.00 72.50 70.02 2yue s THR 146 CO 0.02 -0.53 0.07 0.68 -0.54 0.00 0.00 174.62 174.32 2yue s VAL 147 N -2.44 0.00 -0.12 2.29 -7.23 0.03 -2.14 120.40 110.80 2yue s VAL 147 Ca 0.43 -0.01 -0.06 0.00 -1.81 0.00 0.00 61.98 60.53 2yue s VAL 147 Cb -0.10 -0.11 0.05 0.00 0.56 0.00 0.00 36.38 36.78 2yue s VAL 147 CO 0.38 -0.00 0.29 -0.63 -0.31 0.00 0.00 175.10 174.83 2yue s ILE 148 N 0.03 -0.06 -0.15 -0.62 1.01 0.62 -1.31 121.20 120.71 2yue s ILE 148 Ca -0.00 0.14 -0.01 0.00 0.00 0.00 0.00 60.65 60.78 2yue s ILE 148 Cb -0.01 -0.45 -0.01 0.00 0.01 0.00 0.00 42.46 42.00 2yue s ILE 148 CO 0.00 0.06 -0.10 -0.62 0.00 0.00 0.00 174.94 174.28 2yue s ASP 149 N 1.37 4.15 -0.73 3.58 -1.08 -0.45 -0.08 116.67 123.44 2yue s ASP 149 Ca -0.09 -0.32 -0.10 0.00 -0.52 0.00 0.00 52.55 51.52 2yue s ASP 149 Cb -0.10 -1.66 0.19 0.00 -1.46 0.00 0.00 42.92 39.89 2yue s ASP 149 CO -0.10 0.12 0.62 0.27 0.52 0.00 0.00 175.17 176.60 2yue s ILE 150 N 0.63 4.82 -0.40 4.11 -0.00 0.31 -2.79 121.20 127.89 2yue s ILE 150 Ca -0.06 -2.61 0.05 0.00 -0.00 0.00 0.00 60.65 58.03 2yue s ILE 150 Cb -0.15 -4.04 0.17 0.00 -0.00 0.00 0.00 42.46 38.44 2yue s ILE 150 CO 0.03 -0.96 0.49 -0.47 -0.00 0.00 0.00 174.94 174.03 2yue s TYR 151 N 0.16 -0.89 0.00 1.37 5.04 -1.26 -4.69 117.35 117.08 2yue s TYR 151 Ca 0.17 -0.43 0.00 0.00 -2.44 0.00 0.00 57.07 54.36 2yue s TYR 151 Cb -0.15 -0.10 0.00 0.00 0.35 0.00 0.00 41.96 42.06 2yue s TYR 151 CO -0.06 -1.06 0.00 0.41 -1.34 0.00 0.00 175.55 173.49 2yue n GLY 152 N 4.20 -0.20 2.89 8.97 0.00 -1.26 -3.84 105.19 115.95 2yue n GLY 152 Ca 0.12 0.07 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 2yue n GLY 152 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2yue n ASN 153 N 0.00 7.48 -3.64 1.61 4.13 -1.26 -4.56 115.26 119.02 2yue n ASN 153 Ca 0.00 -3.80 -0.06 0.00 1.68 0.00 0.00 54.58 52.40 2yue n ASN 153 Cb 0.00 -1.08 -0.07 0.00 -1.54 0.00 0.00 39.78 37.09 2yue n ASN 153 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2yue n THR 155 N 1.75 0.86 -4.59 0.00 -2.24 -0.62 -4.35 114.28 105.08 2yue n THR 155 Ca -0.11 0.28 -0.32 0.00 -2.27 0.00 0.00 64.05 61.64 2yue n THR 155 Cb 0.57 -1.44 -0.11 0.00 -2.10 0.00 0.00 70.33 67.24 2yue n THR 155 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2yue s GLY 156 N -4.31 1.67 -0.03 3.38 0.00 -0.36 -3.25 107.32 104.42 2yue s GLY 156 Ca 0.00 -1.04 -0.01 0.00 0.00 0.00 0.00 44.72 43.67 2yue s GLY 156 CO 0.00 -0.89 0.05 -0.26 0.00 0.00 0.00 173.10 172.00 2yue s ILE 157 N -0.92 -0.05 -0.17 0.90 -4.36 0.79 -1.80 121.20 115.59 2yue s ILE 157 Ca 0.15 0.19 0.00 0.00 -0.26 0.00 0.00 60.65 60.74 2yue s ILE 157 Cb -0.11 -0.11 0.01 0.00 1.25 0.00 0.00 42.46 43.50 2yue s ILE 157 CO 0.05 0.08 -0.17 -0.70 0.24 0.00 0.00 174.94 174.44 2yue s GLU 158 N 1.01 3.10 0.01 0.37 2.12 -0.49 -0.26 118.70 124.56 2yue s GLU 158 Ca -0.08 -0.79 -0.30 0.00 0.36 0.00 0.00 54.97 54.16 2yue s GLU 158 Cb -0.12 -2.62 -0.04 0.00 0.26 0.00 0.00 34.13 31.61 2yue s GLU 158 CO -0.03 -0.12 1.09 -0.06 -0.54 0.00 0.00 175.26 175.59 2yue s PHE 159 N 1.13 3.52 0.33 5.30 0.40 -1.26 -0.16 117.98 127.23 2yue s PHE 159 Ca 0.01 1.49 0.07 0.00 -0.60 0.00 0.00 56.93 57.90 2yue s PHE 159 Cb -0.14 -3.27 -0.03 0.00 0.51 0.00 0.00 43.02 40.09 2yue s PHE 159 CO -0.07 -0.65 0.31 -0.51 0.70 0.00 0.00 175.22 175.01 2yue s LEU 160 N 1.23 3.68 -0.49 -0.37 1.43 -0.02 -4.92 118.68 119.22 2yue s LEU 160 Ca 0.55 -0.42 -0.20 0.00 -1.03 0.00 0.00 54.13 53.02 2yue s LEU 160 Cb -0.24 -2.31 0.04 0.00 0.03 0.00 0.00 46.19 43.71 2yue s LEU 160 CO 0.27 -0.34 0.68 -1.81 0.23 0.00 0.00 176.35 175.39 2yue s ASP 161 N -4.01 6.27 0.56 2.29 1.01 -1.26 -4.01 116.67 117.53 2yue s ASP 161 Ca 0.41 -0.63 0.27 0.00 0.71 0.00 0.00 52.55 53.31 2yue s ASP 161 Cb -0.07 -2.32 1.49 0.00 1.01 0.00 0.00 42.92 43.04 2yue s ASP 161 CO 0.27 -0.91 1.99 0.77 0.21 0.00 0.00 175.17 177.50 2yue h SER 162 N 9.01 0.00 0.12 0.27 4.64 -1.91 0.21 113.55 125.89 2yue h SER 162 Ca -0.27 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.04 2yue h SER 162 Cb 1.09 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2yue h SER 162 CO 0.96 0.00 -0.06 -0.09 -0.87 0.00 0.00 176.83 176.77 2yue h ARG 163 N 0.00 0.00 0.13 4.77 2.43 -1.88 0.15 114.38 119.98 2yue h ARG 163 Ca 0.20 0.00 -0.29 0.00 -0.81 0.00 0.00 59.98 59.08 2yue h ARG 163 Cb 0.93 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 30.50 2yue h ARG 163 CO -0.00 0.06 -1.23 0.82 -1.51 0.00 0.00 179.97 178.10 2yue h ILE 164 N 0.00 1.37 0.00 1.20 2.04 -0.98 -3.41 117.51 117.73 2yue h ILE 164 Ca -0.00 -2.70 0.00 0.00 1.00 0.00 0.00 64.86 63.16 2yue h ILE 164 Cb 0.14 2.79 0.00 0.00 -0.74 0.00 0.00 36.82 39.01 2yue h ILE 164 CO 0.01 0.80 0.00 -1.22 0.00 0.00 0.00 178.15 177.74 2yue n TYR 165 N -3.69 0.00 -0.54 1.37 4.02 -0.82 -4.97 117.16 112.54 2yue n TYR 165 Ca -0.11 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.48 2yue n TYR 165 Cb 0.99 -0.16 0.22 0.00 -0.02 0.00 0.00 39.34 40.37 2yue n TYR 165 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 176.86 174.52 2yue n MET 166 N -1.47 -2.39 0.00 -0.72 2.81 0.47 -4.97 117.12 110.86 2yue n MET 166 Ca 0.00 -0.68 0.00 0.00 -1.81 0.00 0.00 57.70 55.21 2yue n MET 166 Cb 0.00 -1.87 0.00 0.00 -0.71 0.00 0.00 33.22 30.64 2yue n MET 166 CO 0.00 0.00 0.00 2.48 1.51 0.00 0.00 175.97 179.96 2yue n TYR 167 N -4.81 -0.32 0.45 2.03 4.11 -1.26 -4.69 117.16 112.66 2yue n TYR 167 Ca 0.03 0.00 0.04 0.00 -0.00 0.00 0.00 57.90 57.96 2yue n TYR 167 Cb 0.57 0.08 0.21 0.00 -0.00 0.00 0.00 39.34 40.20 2yue n TYR 167 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.86 177.80