#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jty h ALA 2 N 0.00 1.24 -0.35 0.00 0.00 -1.99 -3.49 119.26 114.68 2jty h ALA 2 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2jty h ALA 2 Cb 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.53 2jty h ALA 2 CO 0.00 0.55 0.00 -2.37 0.00 0.00 0.00 179.25 177.43 2jty n THR 3 N -4.31 0.00 -1.41 0.00 5.66 -1.26 -4.84 114.28 108.12 2jty n THR 3 Ca 0.05 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 60.99 2jty n THR 3 Cb 0.17 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 68.96 2jty n THR 3 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2jty n THR 4 N 0.00 -0.71 -3.66 1.09 -2.24 -1.26 -4.93 114.28 102.58 2jty n THR 4 Ca 0.00 0.04 -0.05 0.00 -2.27 0.00 0.00 64.05 61.76 2jty n THR 4 Cb 0.00 -0.71 -0.07 0.00 -2.10 0.00 0.00 70.33 67.45 2jty n THR 4 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2jty s VAL 5 N -0.28 -0.71 -0.06 2.28 0.11 -1.26 -5.07 120.40 115.41 2jty s VAL 5 Ca 0.06 0.08 -0.05 0.00 -2.93 0.00 0.00 61.98 59.14 2jty s VAL 5 Cb -0.01 -0.82 0.01 0.00 -1.53 0.00 0.00 36.38 34.03 2jty s VAL 5 CO 0.14 0.04 0.09 0.59 -3.33 0.00 0.00 175.10 172.62 2jty n ASN 6 N 5.27 -1.34 0.00 3.54 3.02 -1.26 -1.75 115.26 122.74 2jty n ASN 6 Ca -0.12 0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.45 2jty n ASN 6 Cb 0.50 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 39.31 2jty n ASN 6 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jty n GLY 7 N 0.26 1.56 2.70 7.41 0.00 -1.26 -4.01 105.19 111.85 2jty n GLY 7 Ca -0.01 0.08 -0.07 0.00 0.00 0.00 0.00 46.02 46.02 2jty n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jty n GLY 8 N 0.00 -0.31 2.92 -0.02 0.00 -0.72 -4.85 105.19 102.20 2jty n GLY 8 Ca 0.00 0.38 -0.02 0.00 0.00 0.00 0.00 46.02 46.39 2jty n GLY 8 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2jty n THR 9 N 0.53 -4.33 -1.55 2.61 5.66 -1.00 -3.70 114.28 112.49 2jty n THR 9 Ca 0.02 0.79 -0.15 0.00 -3.05 0.00 0.00 64.05 61.66 2jty n THR 9 Cb 0.72 -3.61 -0.06 0.00 -1.55 0.00 0.00 70.33 65.83 2jty n THR 9 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 175.07 173.35 2jty n VAL 10 N 2.30 -0.08 -4.01 1.08 0.24 -1.26 -0.85 118.33 115.75 2jty n VAL 10 Ca -0.12 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.76 2jty n VAL 10 Cb 0.18 -1.53 0.02 0.00 -1.47 0.00 0.00 33.84 31.03 2jty n VAL 10 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jty n HIS 11 N -2.18 -1.53 -3.40 6.34 1.44 -1.26 -5.00 115.22 109.63 2jty n HIS 11 Ca -0.16 0.22 -0.25 0.00 -2.01 0.00 0.00 57.72 55.53 2jty n HIS 11 Cb 0.52 -2.80 -0.10 0.00 0.12 0.00 0.00 29.99 27.73 2jty n HIS 11 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 2jty s PHE 12 N -3.42 0.46 -0.33 -1.40 0.40 -0.03 -5.06 117.98 108.60 2jty s PHE 12 Ca 0.40 -1.52 -0.01 0.00 -0.60 0.00 0.00 56.93 55.20 2jty s PHE 12 Cb -0.22 -0.74 0.11 0.00 0.51 0.00 0.00 43.02 42.67 2jty s PHE 12 CO 0.96 -0.88 0.13 0.15 0.70 0.00 0.00 175.22 176.28 2jty s LYS 13 N 0.97 0.69 0.00 0.44 1.02 -1.26 -4.84 119.74 116.76 2jty s LYS 13 Ca 0.21 -1.12 0.00 0.00 0.02 0.00 0.00 55.97 55.08 2jty s LYS 13 Cb -0.16 -1.85 0.00 0.00 -0.52 0.00 0.00 37.83 35.30 2jty s LYS 13 CO -0.04 -1.03 0.00 0.41 -0.92 0.00 0.00 175.35 173.77 2jty n GLY 14 N 4.69 0.67 0.00 -3.33 0.00 -1.26 -5.13 105.19 100.84 2jty n GLY 14 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2jty n GLY 14 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2jty n GLU 15 N 0.00 0.00 -0.37 1.61 2.13 -1.26 -4.98 120.64 117.77 2jty n GLU 15 Ca 0.00 0.00 0.05 0.00 0.66 0.00 0.00 57.16 57.87 2jty n GLU 15 Cb 0.30 0.00 0.20 0.00 0.27 0.00 0.00 31.44 32.22 2jty n GLU 15 CO 0.00 0.00 0.00 -0.24 -0.41 0.00 0.00 177.13 176.48 2jty h VAL 16 N 0.00 1.02 -6.79 6.31 3.04 -2.00 -3.46 116.25 114.36 2jty h VAL 16 Ca 0.00 -0.38 -0.53 0.00 -1.01 0.00 0.00 66.70 64.78 2jty h VAL 16 Cb 0.00 -0.18 -0.19 0.00 -2.01 0.00 0.00 31.29 28.91 2jty h VAL 16 CO 0.00 0.20 -0.83 1.33 -1.01 0.00 0.00 177.57 177.26 2jty n VAL 17 N -4.55 -0.82 -3.95 1.51 0.24 -1.26 -4.97 118.33 104.52 2jty n VAL 17 Ca 0.17 -0.41 -0.12 0.00 -2.04 0.00 0.00 64.34 61.94 2jty n VAL 17 Cb 0.26 -0.84 -0.13 0.00 -1.47 0.00 0.00 33.84 31.66 2jty n VAL 17 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2jty s ASN 18 N -4.14 0.21 -0.29 -1.34 -0.87 -1.26 -5.03 114.94 102.21 2jty s ASN 18 Ca 0.03 -0.21 -0.23 0.00 -1.57 0.00 0.00 52.86 50.88 2jty s ASN 18 Cb -0.02 0.03 0.16 0.00 -0.02 0.00 0.00 41.25 41.40 2jty s ASN 18 CO 0.86 -0.11 1.21 0.00 -2.57 0.00 0.00 177.10 176.49 2jty s ALA 19 N -0.59 -2.18 -0.27 0.60 0.00 -1.26 -4.95 121.76 113.11 2jty s ALA 19 Ca -0.06 1.85 0.28 0.00 0.00 0.00 0.00 51.96 54.03 2jty s ALA 19 Cb -0.04 -1.66 0.97 0.00 0.00 0.00 0.00 23.12 22.39 2jty s ALA 19 CO -0.00 -0.20 1.81 0.00 0.00 0.00 0.00 175.76 177.36 2jty h ALA 20 N 4.11 1.00 -2.23 0.00 0.00 -1.93 -3.45 119.26 116.76 2jty h ALA 20 Ca -0.28 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.36 2jty h ALA 20 Cb 1.18 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.83 2jty h ALA 20 CO 0.16 0.00 -0.70 0.00 0.00 0.00 0.00 179.25 178.70 2jty s ALA 22 N -3.48 3.28 -0.03 0.00 0.00 0.70 -4.92 121.76 117.30 2jty s ALA 22 Ca 0.14 -1.03 -0.37 0.00 0.00 0.00 0.00 51.96 50.70 2jty s ALA 22 Cb 0.04 -3.51 -0.15 0.00 0.00 0.00 0.00 23.12 19.50 2jty s ALA 22 CO -0.02 -1.99 1.57 0.28 0.00 0.00 0.00 175.76 175.60 2jty n VAL 23 N 6.15 0.16 -1.75 0.00 0.31 -1.26 -0.35 118.33 121.60 2jty n VAL 23 Ca 0.02 -0.03 -0.35 0.00 -0.01 0.00 0.00 64.34 63.97 2jty n VAL 23 Cb 0.48 -1.19 0.06 0.00 -0.91 0.00 0.00 33.84 32.29 2jty n VAL 23 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2jty s ASP 24 N 1.90 4.73 0.54 4.52 -1.08 -0.30 -4.82 116.67 122.17 2jty s ASP 24 Ca 0.89 2.39 0.26 0.00 -0.52 0.00 0.00 52.55 55.57 2jty s ASP 24 Cb -0.91 -2.60 1.43 0.00 -1.46 0.00 0.00 42.92 39.38 2jty s ASP 24 CO 0.52 -1.90 2.00 0.00 0.52 0.00 0.00 175.17 176.30 2jty h ALA 25 N 0.36 2.41 0.05 3.66 0.00 -1.93 -0.42 119.26 123.38 2jty h ALA 25 Ca -0.49 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 2jty h ALA 25 Cb 1.30 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2jty h ALA 25 CO 0.53 -0.62 -0.02 0.78 0.00 0.00 0.00 179.25 179.92 2jty h GLY 26 N 0.00 -0.06 2.00 0.00 0.00 -1.96 -3.11 103.07 99.94 2jty h GLY 26 Ca 0.23 0.02 -0.09 0.00 0.00 0.00 0.00 47.33 47.50 2jty h GLY 26 CO -0.00 -0.02 -0.42 1.76 0.00 0.00 0.00 176.54 177.85 2jty h SER 27 N -0.13 0.00 0.05 0.19 0.02 -1.46 -2.81 113.55 109.41 2jty h SER 27 Ca -0.01 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2jty h SER 27 Cb 0.11 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.65 2jty h SER 27 CO 0.01 0.42 -0.02 0.58 -1.14 0.00 0.00 176.83 176.68 2jty h VAL 28 N 0.00 0.60 -0.02 2.27 2.07 -1.10 -3.28 116.25 116.80 2jty h VAL 28 Ca -0.00 -0.09 -0.17 0.00 0.82 0.00 0.00 66.70 67.26 2jty h VAL 28 Cb 0.93 1.06 -0.32 0.00 -1.52 0.00 0.00 31.29 31.43 2jty h VAL 28 CO 0.06 0.02 -0.84 -0.67 0.02 0.00 0.00 177.57 176.16 2jty n ASP 29 N -3.91 0.47 -4.72 0.57 2.03 -1.20 -0.61 116.55 109.18 2jty n ASP 29 Ca -0.03 -2.00 -0.41 0.00 0.52 0.00 0.00 54.79 52.86 2jty n ASP 29 Cb 0.11 -0.14 -0.04 0.00 -0.72 0.00 0.00 41.12 40.33 2jty n ASP 29 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jty s GLN 30 N -0.17 4.60 -0.49 -0.67 -2.07 -1.07 -4.81 119.66 114.98 2jty s GLN 30 Ca 0.25 1.57 -0.15 0.00 -1.82 0.00 0.00 55.36 55.20 2jty s GLN 30 Cb 0.29 -3.36 0.10 0.00 -1.09 0.00 0.00 33.01 28.94 2jty s GLN 30 CO -0.12 0.05 0.42 0.99 -1.32 0.00 0.00 175.29 175.31 2jty s THR 31 N 0.31 5.09 -0.83 3.63 2.01 -1.26 -0.85 115.64 123.74 2jty s THR 31 Ca 0.50 -1.28 -0.24 0.00 0.31 0.00 0.00 61.69 60.98 2jty s THR 31 Cb -0.25 -4.14 0.06 0.00 0.01 0.00 0.00 72.50 68.17 2jty s THR 31 CO 0.31 -0.69 1.25 -0.69 -0.69 0.00 0.00 174.62 174.11 2jty s VAL 32 N 1.60 4.03 -0.84 3.82 1.01 -0.10 -4.89 120.40 125.02 2jty s VAL 32 Ca 0.04 -0.35 -0.25 0.00 0.00 0.00 0.00 61.98 61.42 2jty s VAL 32 Cb -0.26 -4.90 0.02 0.00 0.00 0.00 0.00 36.38 31.24 2jty s VAL 32 CO 0.05 -1.76 1.47 -1.10 0.00 0.00 0.00 175.10 173.76 2jty s GLN 33 N 4.79 3.20 0.12 2.72 -0.21 -1.26 -0.70 119.66 128.34 2jty s GLN 33 Ca 0.35 -0.46 0.20 0.00 0.02 0.00 0.00 55.36 55.48 2jty s GLN 33 Cb -0.07 -4.71 0.83 0.00 1.00 0.00 0.00 33.01 30.07 2jty s GLN 33 CO 0.03 -2.36 1.63 1.28 -2.12 0.00 0.00 175.29 173.75 2jty n LEU 34 N 10.04 0.34 0.00 2.90 4.77 0.91 -4.94 117.00 131.02 2jty n LEU 34 Ca 0.19 0.58 0.08 0.00 -0.03 0.00 0.00 56.01 56.82 2jty n LEU 34 Cb 0.50 -0.52 -0.02 0.00 -2.33 0.00 0.00 43.42 41.05 2jty n LEU 34 CO 0.68 -0.36 -0.10 0.61 -1.33 0.00 0.00 177.39 176.89 2jty n GLY 35 N 0.20 -1.97 3.67 -0.72 0.00 -1.25 -4.70 105.19 100.42 2jty n GLY 35 Ca 0.03 -1.32 -0.42 0.00 0.00 0.00 0.00 46.02 44.31 2jty n GLY 35 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jty s GLN 36 N -1.27 4.20 0.05 1.61 -0.21 -1.26 -1.55 119.66 121.24 2jty s GLN 36 Ca 0.00 2.13 -0.01 0.00 0.02 0.00 0.00 55.36 57.51 2jty s GLN 36 Cb 0.00 -3.89 -0.04 0.00 1.00 0.00 0.00 33.01 30.08 2jty s GLN 36 CO 0.00 -0.80 0.21 0.08 -2.12 0.00 0.00 175.29 172.67 2jty s VAL 37 N 3.69 5.39 0.05 1.09 1.01 -0.23 -4.91 120.40 126.49 2jty s VAL 37 Ca 0.71 -0.33 -0.27 0.00 0.00 0.00 0.00 61.98 62.09 2jty s VAL 37 Cb -0.33 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.39 2jty s VAL 37 CO 0.28 0.17 0.84 -0.13 0.00 0.00 0.00 175.10 176.27 2jty s ARG 38 N -2.41 4.56 0.63 2.72 0.52 -1.26 -0.50 118.95 123.21 2jty s ARG 38 Ca 0.34 1.21 0.40 0.00 -0.52 0.00 0.00 55.73 57.15 2jty s ARG 38 Cb -0.13 -3.38 2.16 0.00 0.52 0.00 0.00 34.95 34.11 2jty s ARG 38 CO 0.26 0.22 2.21 1.79 0.02 0.00 0.00 175.30 179.80 2jty h THR 39 N 4.20 0.00 -0.40 0.02 1.35 -1.22 -0.83 112.91 116.04 2jty h THR 39 Ca -0.43 0.00 0.08 0.00 -0.55 0.00 0.00 66.41 65.51 2jty h THR 39 Cb 1.21 0.88 -0.08 0.00 -1.73 0.00 0.00 68.15 68.43 2jty h THR 39 CO 0.72 0.00 -0.11 0.00 -0.25 0.00 0.00 175.52 175.88 2jty h ALA 40 N 1.88 0.25 0.00 6.62 0.00 -1.86 -0.74 119.26 125.41 2jty h ALA 40 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2jty h ALA 40 Cb 0.12 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2jty h ALA 40 CO 0.00 -0.46 0.00 0.43 0.00 0.00 0.00 179.25 179.22 2jty n SER 41 N -5.31 0.00 -3.34 0.00 7.64 -0.32 -4.29 113.62 108.00 2jty n SER 41 Ca 0.02 -0.39 -0.25 0.00 1.01 0.00 0.00 58.87 59.26 2jty n SER 41 Cb 0.22 -0.12 -0.09 0.00 -1.01 0.00 0.00 64.21 63.22 2jty n SER 41 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2jty n LEU 42 N -1.12 -0.63 0.00 -3.43 4.77 -0.29 -3.26 117.00 113.05 2jty n LEU 42 Ca 0.13 -4.31 0.00 0.00 -0.03 0.00 0.00 56.01 51.80 2jty n LEU 42 Cb 0.11 0.57 0.00 0.00 -2.33 0.00 0.00 43.42 41.77 2jty n LEU 42 CO 0.13 1.88 0.00 0.00 -1.33 0.00 0.00 177.39 178.07 2jty n ALA 43 N 2.73 0.00 -2.70 -1.18 0.00 -1.22 -2.42 120.51 115.72 2jty n ALA 43 Ca 0.29 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.63 2jty n ALA 43 Cb 0.49 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.87 2jty n ALA 43 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 2jty s GLN 44 N 0.00 0.89 -0.04 0.00 0.00 -0.75 -3.31 119.66 116.46 2jty s GLN 44 Ca 0.00 -0.86 -0.30 0.00 -0.00 0.00 0.00 55.36 54.21 2jty s GLN 44 Cb 0.00 0.37 -0.07 0.00 0.00 0.00 0.00 33.01 33.31 2jty s GLN 44 CO 0.00 -0.30 1.92 -2.00 0.00 0.00 0.00 175.29 174.91 2jty s GLU 45 N -3.70 3.98 0.00 9.60 2.12 -1.26 -1.85 118.70 127.59 2jty s GLU 45 Ca 0.03 2.38 0.00 0.00 0.36 0.00 0.00 54.97 57.74 2jty s GLU 45 Cb 0.04 -4.15 0.00 0.00 0.26 0.00 0.00 34.13 30.27 2jty s GLU 45 CO -0.10 -1.13 0.00 0.41 -0.54 0.00 0.00 175.26 173.90 2jty n GLY 46 N 4.65 0.76 3.68 -1.50 0.00 0.16 -4.88 105.19 108.07 2jty n GLY 46 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 2jty n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jty n ALA 47 N -0.67 0.82 -2.84 4.61 0.00 -0.77 -4.89 120.51 116.77 2jty n ALA 47 Ca 0.00 0.03 -0.10 0.00 0.00 0.00 0.00 53.44 53.37 2jty n ALA 47 Cb 0.00 -2.24 -0.09 0.00 0.00 0.00 0.00 19.45 17.12 2jty n ALA 47 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2jty s THR 48 N -1.41 0.12 1.05 0.00 -4.23 -1.20 -0.66 115.64 109.29 2jty s THR 48 Ca 0.78 -0.96 -0.14 0.00 -1.18 0.00 0.00 61.69 60.18 2jty s THR 48 Cb -0.41 -0.77 0.21 0.00 1.34 0.00 0.00 72.50 72.87 2jty s THR 48 CO 0.45 -0.53 1.10 -0.94 -0.54 0.00 0.00 174.62 174.16 2jty s SER 49 N -1.93 2.24 0.04 3.99 1.04 -0.21 -4.77 113.70 114.09 2jty s SER 49 Ca -0.08 1.02 -0.11 0.00 0.48 0.00 0.00 55.95 57.26 2jty s SER 49 Cb -0.03 -1.57 -0.04 0.00 0.10 0.00 0.00 66.02 64.48 2jty s SER 49 CO -0.03 -3.35 1.18 0.28 0.98 0.00 0.00 173.24 172.30 2jty h SER 50 N -2.05 -0.58 0.00 7.02 0.02 -1.94 -3.44 113.55 112.58 2jty h SER 50 Ca -0.52 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 2jty h SER 50 Cb 1.32 0.23 0.00 0.00 0.14 0.00 0.00 62.40 64.09 2jty h SER 50 CO 0.53 -0.15 0.00 0.00 -1.14 0.00 0.00 176.83 176.07 2jty n ALA 51 N -2.76 0.00 -2.95 3.77 0.00 -1.26 -5.07 120.51 112.24 2jty n ALA 51 Ca -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.28 2jty n ALA 51 Cb 0.12 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.42 2jty n ALA 51 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2jty s VAL 52 N -0.67 0.23 -0.20 0.00 1.01 -0.37 -5.02 120.40 115.37 2jty s VAL 52 Ca 0.00 -0.09 -0.13 0.00 0.00 0.00 0.00 61.98 61.76 2jty s VAL 52 Cb 0.00 -0.22 -0.05 0.00 0.00 0.00 0.00 36.38 36.12 2jty s VAL 52 CO 0.00 0.08 0.25 -0.83 0.00 0.00 0.00 175.10 174.60 2jty s GLY 53 N 0.10 2.08 -0.44 4.51 0.00 -1.26 -0.18 107.32 112.13 2jty s GLY 53 Ca -0.01 -0.65 0.02 0.00 0.00 0.00 0.00 44.72 44.09 2jty s GLY 53 CO -0.00 0.45 0.26 -0.11 0.00 0.00 0.00 173.10 173.71 2jty s PHE 54 N 0.82 1.71 0.61 1.90 -0.71 -1.03 -4.92 117.98 116.37 2jty s PHE 54 Ca 0.13 -2.31 -0.10 0.00 -1.04 0.00 0.00 56.93 53.61 2jty s PHE 54 Cb -0.13 -1.62 -0.03 0.00 -1.21 0.00 0.00 43.02 40.03 2jty s PHE 54 CO 0.04 -0.78 1.00 0.54 -1.34 0.00 0.00 175.22 174.68 2jty s ASN 55 N 0.34 6.11 -0.33 1.98 2.20 -1.26 -3.98 114.94 119.99 2jty s ASN 55 Ca 0.20 1.30 -0.04 0.00 -0.94 0.00 0.00 52.86 53.38 2jty s ASN 55 Cb -0.19 -2.34 0.05 0.00 -2.00 0.00 0.00 41.25 36.77 2jty s ASN 55 CO -0.03 -0.90 0.08 -0.63 -2.94 0.00 0.00 177.10 172.67 2jty s ILE 56 N -3.14 3.41 -0.41 0.54 -1.09 -1.02 -4.93 121.20 114.55 2jty s ILE 56 Ca 0.54 -1.35 -0.29 0.00 -2.23 0.00 0.00 60.65 57.33 2jty s ILE 56 Cb -0.11 -2.99 0.01 0.00 -1.58 0.00 0.00 42.46 37.79 2jty s ILE 56 CO 0.52 -0.21 1.33 -1.58 -1.23 0.00 0.00 174.94 173.77 2jty s GLN 57 N 1.31 3.66 -0.34 2.79 0.74 -1.26 -2.71 119.66 123.85 2jty s GLN 57 Ca -0.02 0.89 -0.05 0.00 0.05 0.00 0.00 55.36 56.24 2jty s GLN 57 Cb -0.20 -3.98 0.05 0.00 1.10 0.00 0.00 33.01 29.99 2jty s GLN 57 CO 0.00 -1.46 0.09 -0.51 -0.55 0.00 0.00 175.29 172.86 2jty s LEU 58 N 5.05 4.32 0.51 3.68 1.02 -0.53 -1.15 118.68 131.58 2jty s LEU 58 Ca 0.57 -1.30 0.02 0.00 0.02 0.00 0.00 54.13 53.44 2jty s LEU 58 Cb -0.12 -1.82 0.02 0.00 0.02 0.00 0.00 46.19 44.29 2jty s LEU 58 CO 0.31 -0.34 0.72 0.54 0.02 0.00 0.00 176.35 177.60 2jty s ASN 59 N 1.44 5.46 -1.38 2.29 2.20 0.52 -0.67 114.94 124.81 2jty s ASN 59 Ca -0.02 0.02 -0.10 0.00 -0.94 0.00 0.00 52.86 51.83 2jty s ASN 59 Cb -0.20 -1.03 0.07 0.00 -2.00 0.00 0.00 41.25 38.09 2jty s ASN 59 CO 0.01 -0.98 0.59 -0.67 -2.94 0.00 0.00 177.10 173.10 2jty n ASP 60 N -2.22 -4.22 -4.57 3.54 2.03 -0.95 -0.22 116.55 109.94 2jty n ASP 60 Ca 0.06 -0.45 -0.27 0.00 0.52 0.00 0.00 54.79 54.64 2jty n ASP 60 Cb 0.59 -3.46 -0.05 0.00 -0.72 0.00 0.00 41.12 37.48 2jty n ASP 60 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jty s ASP 62 N 7.31 6.33 0.18 0.00 2.15 -0.28 -3.45 116.67 128.91 2jty s ASP 62 Ca 0.69 1.12 0.15 0.00 0.43 0.00 0.00 52.55 54.94 2jty s ASP 62 Cb -0.04 -2.54 0.74 0.00 -0.30 0.00 0.00 42.92 40.78 2jty s ASP 62 CO 0.05 -1.39 1.45 0.35 -0.17 0.00 0.00 175.17 175.47 2jty n THR 63 N 6.86 1.29 -0.14 1.71 -2.24 -1.25 -1.44 114.28 119.07 2jty n THR 63 Ca 0.18 0.54 -0.07 0.00 -2.27 0.00 0.00 64.05 62.43 2jty n THR 63 Cb 0.47 -1.51 0.09 0.00 -2.10 0.00 0.00 70.33 67.28 2jty n THR 63 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 2jty h ASN 64 N 0.00 0.89 0.23 3.42 2.35 -1.98 -3.29 115.58 117.20 2jty h ASN 64 Ca 0.00 -0.26 -0.01 0.00 -0.55 0.00 0.00 56.30 55.48 2jty h ASN 64 Cb 0.08 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.21 2jty h ASN 64 CO 0.00 0.99 -0.11 0.58 -1.65 0.00 0.00 177.43 177.24 2jty h VAL 65 N 0.82 0.29 -2.33 2.81 2.07 -1.62 -3.48 116.25 114.80 2jty h VAL 65 Ca 0.14 -0.91 -0.08 0.00 0.82 0.00 0.00 66.70 66.68 2jty h VAL 65 Cb 0.58 0.51 -0.21 0.00 -1.52 0.00 0.00 31.29 30.65 2jty h VAL 65 CO 0.04 0.08 -0.00 0.00 0.02 0.00 0.00 177.57 177.70 2jty s ALA 66 N -3.45 -1.45 -0.80 1.67 0.00 -1.16 -4.49 121.76 112.09 2jty s ALA 66 Ca -0.08 1.40 0.25 0.00 0.00 0.00 0.00 51.96 53.53 2jty s ALA 66 Cb 0.00 -0.59 0.48 0.00 0.00 0.00 0.00 23.12 23.01 2jty s ALA 66 CO 0.26 -0.30 1.41 -1.13 0.00 0.00 0.00 175.76 176.00 2jty n SER 67 N 2.10 0.58 -4.02 0.00 3.41 -0.44 -3.97 113.62 111.27 2jty n SER 67 Ca -0.16 0.03 -0.08 0.00 -0.26 0.00 0.00 58.87 58.40 2jty n SER 67 Cb 0.56 0.13 -0.10 0.00 -0.26 0.00 0.00 64.21 64.54 2jty n SER 67 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2jty s LYS 68 N -3.09 0.52 -0.43 4.33 1.02 -0.21 -0.17 119.74 121.71 2jty s LYS 68 Ca 0.09 -0.95 0.06 0.00 0.02 0.00 0.00 55.97 55.18 2jty s LYS 68 Cb 0.15 0.19 0.17 0.00 -0.52 0.00 0.00 37.83 37.82 2jty s LYS 68 CO 0.70 -0.10 0.54 0.00 -0.92 0.00 0.00 175.35 175.56 2jty s ALA 69 N -2.96 -1.18 0.96 5.17 0.00 -1.21 -1.88 121.76 120.66 2jty s ALA 69 Ca -0.02 -0.70 -0.14 0.00 0.00 0.00 0.00 51.96 51.10 2jty s ALA 69 Cb 0.01 -2.37 0.17 0.00 0.00 0.00 0.00 23.12 20.94 2jty s ALA 69 CO -0.06 -2.17 1.19 0.00 0.00 0.00 0.00 175.76 174.71 2jty s ALA 70 N 1.20 1.81 -0.24 0.00 0.00 0.12 -4.71 121.76 119.94 2jty s ALA 70 Ca 0.22 -0.80 -0.02 0.00 0.00 0.00 0.00 51.96 51.36 2jty s ALA 70 Cb -0.05 -2.93 0.12 0.00 0.00 0.00 0.00 23.12 20.26 2jty s ALA 70 CO -0.07 -2.47 0.30 0.54 0.00 0.00 0.00 175.76 174.07 2jty s VAL 71 N -3.44 -0.46 0.41 0.00 0.11 -1.26 -0.95 120.40 114.81 2jty s VAL 71 Ca 0.68 -0.20 0.02 0.00 -2.93 0.00 0.00 61.98 59.54 2jty s VAL 71 Cb -0.10 -0.82 -0.01 0.00 -1.53 0.00 0.00 36.38 33.92 2jty s VAL 71 CO 0.53 -0.25 0.61 0.00 -3.33 0.00 0.00 175.10 172.67 2jty s ALA 72 N 2.42 3.83 0.04 1.54 0.00 -0.83 -3.94 121.76 124.82 2jty s ALA 72 Ca 0.10 -1.11 0.02 0.00 0.00 0.00 0.00 51.96 50.97 2jty s ALA 72 Cb -0.15 -2.05 -0.02 0.00 0.00 0.00 0.00 23.12 20.90 2jty s ALA 72 CO -0.19 -0.25 -0.08 -0.06 0.00 0.00 0.00 175.76 175.17 2jty s PHE 73 N -2.44 0.71 -0.11 0.00 0.08 -1.26 -0.71 117.98 114.25 2jty s PHE 73 Ca 0.46 -0.44 -0.06 0.00 0.12 0.00 0.00 56.93 57.01 2jty s PHE 73 Cb -0.10 -0.42 0.04 0.00 -0.57 0.00 0.00 43.02 41.97 2jty s PHE 73 CO 0.36 -0.06 0.26 -1.17 -0.10 0.00 0.00 175.22 174.51 2jty s LEU 74 N -1.40 0.56 0.27 -0.37 2.96 -0.64 -0.93 118.68 119.13 2jty s LEU 74 Ca -0.07 0.54 -0.20 0.00 -0.22 0.00 0.00 54.13 54.17 2jty s LEU 74 Cb -0.09 0.80 0.06 0.00 0.50 0.00 0.00 46.19 47.46 2jty s LEU 74 CO 0.01 -0.15 0.87 -0.83 -1.32 0.00 0.00 176.35 174.93 2jty s GLY 75 N 0.96 0.11 0.28 7.98 0.00 -1.26 -1.72 107.32 113.67 2jty s GLY 75 Ca -0.07 -0.40 -0.30 0.00 0.00 0.00 0.00 44.72 43.94 2jty s GLY 75 CO -0.06 0.47 1.63 -1.59 0.00 0.00 0.00 173.10 173.55 2jty s THR 76 N -2.76 2.02 0.02 0.90 2.01 -1.26 -4.92 115.64 111.65 2jty s THR 76 Ca 0.16 0.02 -0.27 0.00 0.31 0.00 0.00 61.69 61.91 2jty s THR 76 Cb -0.04 -3.01 -0.04 0.00 0.01 0.00 0.00 72.50 69.41 2jty s THR 76 CO 0.07 0.00 0.85 0.00 -0.69 0.00 0.00 174.62 174.86 2jty s ALA 77 N 0.25 3.27 0.40 7.40 0.00 -1.26 -0.84 121.76 130.97 2jty s ALA 77 Ca 0.66 0.38 0.06 0.00 0.00 0.00 0.00 51.96 53.07 2jty s ALA 77 Cb -0.49 -3.15 0.81 0.00 0.00 0.00 0.00 23.12 20.30 2jty s ALA 77 CO 0.45 -0.08 2.03 0.97 0.00 0.00 0.00 175.76 179.13 2jty h ILE 78 N 4.47 1.12 -3.47 0.00 2.10 -1.07 -3.42 117.51 117.23 2jty h ILE 78 Ca -0.42 -0.27 -0.04 0.00 1.08 0.00 0.00 64.86 65.20 2jty h ILE 78 Cb 1.21 0.54 -0.11 0.00 -1.09 0.00 0.00 36.82 37.37 2jty h ILE 78 CO 0.73 0.13 -0.07 -0.62 -1.08 0.00 0.00 178.15 177.24 2jty s ASP 79 N -6.68 -0.17 0.51 2.19 2.15 -1.26 -4.94 116.67 108.47 2jty s ASP 79 Ca -0.08 -0.59 0.24 0.00 0.43 0.00 0.00 52.55 52.55 2jty s ASP 79 Cb 0.17 0.53 1.34 0.00 -0.30 0.00 0.00 42.92 44.66 2jty s ASP 79 CO 0.74 -1.00 1.95 0.00 -0.17 0.00 0.00 175.17 176.69 2jty h ALA 80 N 2.30 2.49 0.14 3.66 0.00 -2.00 -2.09 119.26 123.77 2jty h ALA 80 Ca -0.30 -0.02 -0.36 0.00 0.00 0.00 0.00 54.91 54.24 2jty h ALA 80 Cb 1.25 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 2jty h ALA 80 CO 0.41 -0.68 -1.92 0.78 0.00 0.00 0.00 179.25 177.84 2jty h GLY 81 N 0.10 0.34 -3.70 0.00 0.00 -1.99 -3.39 103.07 94.44 2jty h GLY 81 Ca 0.32 -0.87 -0.28 0.00 0.00 0.00 0.00 47.33 46.49 2jty h GLY 81 CO -0.03 0.76 0.23 1.42 0.00 0.00 0.00 176.54 178.92 2jty n HIS 82 N -3.53 1.06 0.23 5.60 8.25 -0.82 -4.48 115.22 121.52 2jty n HIS 82 Ca -0.30 -1.72 0.08 0.00 -0.26 0.00 0.00 57.72 55.52 2jty n HIS 82 Cb 1.05 -1.05 0.38 0.00 1.12 0.00 0.00 29.99 31.49 2jty n HIS 82 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2jty n THR 83 N 0.97 1.22 1.05 1.59 -2.24 -0.98 -0.77 114.28 115.12 2jty n THR 83 Ca 0.30 0.49 0.14 0.00 -2.27 0.00 0.00 64.05 62.71 2jty n THR 83 Cb 0.60 -1.44 0.56 0.00 -2.10 0.00 0.00 70.33 67.96 2jty n THR 83 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2jty n ASN 84 N -1.96 0.12 -4.11 3.42 2.85 -1.26 -3.28 115.26 111.04 2jty n ASN 84 Ca 0.00 0.26 -0.24 0.00 -0.11 0.00 0.00 54.58 54.49 2jty n ASN 84 Cb 0.09 -0.32 -0.16 0.00 1.24 0.00 0.00 39.78 40.63 2jty n ASN 84 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2jty s VAL 85 N -2.94 1.23 0.40 3.44 1.01 0.05 -4.57 120.40 119.01 2jty s VAL 85 Ca 0.15 -0.63 -0.21 0.00 0.00 0.00 0.00 61.98 61.30 2jty s VAL 85 Cb 0.19 -1.05 -0.11 0.00 0.00 0.00 0.00 36.38 35.42 2jty s VAL 85 CO 0.55 0.36 0.91 -0.22 0.00 0.00 0.00 175.10 176.70 2jty s LEU 86 N -0.09 4.02 -0.07 3.92 0.20 0.03 -0.81 118.68 125.87 2jty s LEU 86 Ca 0.00 1.64 0.14 0.00 0.69 0.00 0.00 54.13 56.61 2jty s LEU 86 Cb -0.09 -4.39 0.54 0.00 -0.43 0.00 0.00 46.19 41.82 2jty s LEU 86 CO 0.01 -0.29 1.41 0.00 -0.29 0.00 0.00 176.35 177.19 2jty n ALA 87 N -0.42 2.86 -0.58 5.97 0.00 -0.02 -2.68 120.51 125.65 2jty n ALA 87 Ca 0.06 -1.15 0.00 0.00 0.00 0.00 0.00 53.44 52.35 2jty n ALA 87 Cb 0.53 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.97 2jty n ALA 87 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2jty n LEU 88 N 0.85 0.00 -4.24 0.00 4.77 -1.26 -4.86 117.00 112.26 2jty n LEU 88 Ca 0.19 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 56.02 2jty n LEU 88 Cb 0.66 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.66 2jty n LEU 88 CO 0.17 -0.82 -0.16 0.00 -1.33 0.00 0.00 177.39 175.25 2jty s GLN 89 N 0.00 1.50 1.96 3.23 -2.07 0.78 -4.78 119.66 120.28 2jty s GLN 89 Ca 0.00 -1.82 0.00 0.00 -1.82 0.00 0.00 55.36 51.72 2jty s GLN 89 Cb 0.00 0.30 0.00 0.00 -1.09 0.00 0.00 33.01 32.22 2jty s GLN 89 CO 0.00 -0.53 0.00 -1.13 -1.32 0.00 0.00 175.29 172.31 2jty n SER 90 N -0.93 -5.91 -2.63 12.60 3.41 -1.26 -4.68 113.62 114.21 2jty n SER 90 Ca 0.05 0.01 -0.06 0.00 -0.26 0.00 0.00 58.87 58.60 2jty n SER 90 Cb 0.64 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 2jty n SER 90 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2jty n SER 91 N -3.02 -1.16 -0.39 4.04 7.64 -1.26 -4.76 113.62 114.71 2jty n SER 91 Ca 0.00 -0.21 0.32 0.00 1.01 0.00 0.00 58.87 59.99 2jty n SER 91 Cb 0.00 -0.38 0.62 0.00 -1.01 0.00 0.00 64.21 63.45 2jty n SER 91 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jty h ALA 92 N 0.99 2.67 0.00 -0.43 0.00 -1.95 0.13 119.26 120.67 2jty h ALA 92 Ca -0.15 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2jty h ALA 92 Cb 0.34 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2jty h ALA 92 CO 0.08 -1.15 -0.23 0.00 0.00 0.00 0.00 179.25 177.95 2jty n ALA 93 N -2.57 1.85 -0.04 0.00 0.00 -1.26 -4.77 120.51 113.72 2jty n ALA 93 Ca 0.30 -1.27 -0.02 0.00 0.00 0.00 0.00 53.44 52.46 2jty n ALA 93 Cb 1.20 -0.32 -0.08 0.00 0.00 0.00 0.00 19.45 20.25 2jty n ALA 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jty n GLY 94 N -0.38 -0.50 3.63 0.00 0.00 -0.16 -4.95 105.19 102.82 2jty n GLY 94 Ca 0.04 -0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 2jty n GLY 94 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jty s SER 95 N -3.99 2.43 0.50 1.61 0.01 -0.15 -3.18 113.70 110.94 2jty s SER 95 Ca -0.05 1.99 -0.23 0.00 1.31 0.00 0.00 55.95 58.97 2jty s SER 95 Cb 0.04 -2.49 -0.07 0.00 0.21 0.00 0.00 66.02 63.71 2jty s SER 95 CO 0.43 -3.38 1.24 0.00 0.41 0.00 0.00 173.24 171.94 2jty n ALA 96 N -4.40 1.16 -2.52 1.44 0.00 0.22 -4.61 120.51 111.80 2jty n ALA 96 Ca 0.09 0.16 -0.24 0.00 0.00 0.00 0.00 53.44 53.46 2jty n ALA 96 Cb 0.53 -2.26 -0.09 0.00 0.00 0.00 0.00 19.45 17.62 2jty n ALA 96 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2jty s THR 97 N -1.29 2.67 -1.91 0.00 -4.23 -1.26 -4.62 115.64 105.00 2jty s THR 97 Ca 0.68 -2.25 0.00 0.00 -1.18 0.00 0.00 61.69 58.93 2jty s THR 97 Cb -0.46 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 70.89 2jty s THR 97 CO 0.53 -0.36 0.00 0.59 -0.54 0.00 0.00 174.62 174.84 2jty n ASN 98 N -0.72 -5.79 -3.86 3.99 3.02 -1.26 -2.93 115.26 107.71 2jty n ASN 98 Ca -0.05 0.14 -0.11 0.00 -0.03 0.00 0.00 54.58 54.52 2jty n ASN 98 Cb 0.60 -4.90 -0.11 0.00 -0.61 0.00 0.00 39.78 34.76 2jty n ASN 98 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2jty s VAL 99 N -2.96 0.05 0.27 2.41 0.11 -1.26 -0.51 120.40 118.50 2jty s VAL 99 Ca 0.00 -0.40 -0.00 0.00 -2.93 0.00 0.00 61.98 58.64 2jty s VAL 99 Cb 0.00 -0.31 -0.03 0.00 -1.53 0.00 0.00 36.38 34.52 2jty s VAL 99 CO 0.00 -0.22 0.28 -0.83 -3.33 0.00 0.00 175.10 170.99 2jty s GLY 100 N -0.74 1.59 0.26 6.54 0.00 -0.25 -4.64 107.32 110.08 2jty s GLY 100 Ca -0.08 -1.67 -0.17 0.00 0.00 0.00 0.00 44.72 42.80 2jty s GLY 100 CO 0.01 -1.25 0.70 0.14 0.00 0.00 0.00 173.10 172.70 2jty s VAL 101 N -3.75 4.66 -0.00 1.40 1.01 -1.09 -0.26 120.40 122.37 2jty s VAL 101 Ca 0.36 1.05 0.04 0.00 0.00 0.00 0.00 61.98 63.43 2jty s VAL 101 Cb 0.03 -3.73 -0.01 0.00 0.00 0.00 0.00 36.38 32.68 2jty s VAL 101 CO 0.18 0.03 -0.13 -1.58 0.00 0.00 0.00 175.10 173.59 2jty s GLN 102 N -2.45 1.04 -0.12 2.72 0.74 0.23 -0.79 119.66 121.03 2jty s GLN 102 Ca 0.48 -0.51 -0.02 0.00 0.05 0.00 0.00 55.36 55.35 2jty s GLN 102 Cb -0.13 -1.01 -0.03 0.00 1.10 0.00 0.00 33.01 32.93 2jty s GLN 102 CO 0.19 0.27 -0.02 0.42 -0.55 0.00 0.00 175.29 175.60 2jty s ILE 103 N -0.38 4.05 -0.03 -2.34 1.09 -1.26 -2.36 121.20 119.96 2jty s ILE 103 Ca 0.05 -0.32 0.02 0.00 -1.10 0.00 0.00 60.65 59.29 2jty s ILE 103 Cb -0.05 -2.73 0.01 0.00 -1.06 0.00 0.00 42.46 38.63 2jty s ILE 103 CO -0.00 0.55 -0.06 -0.76 -0.10 0.00 0.00 174.94 174.57 2jty s LEU 104 N -0.25 1.55 0.00 2.97 1.43 -0.00 -1.31 118.68 123.07 2jty s LEU 104 Ca 0.05 -0.14 -0.02 0.00 -1.03 0.00 0.00 54.13 52.99 2jty s LEU 104 Cb -0.13 -0.45 0.02 0.00 0.03 0.00 0.00 46.19 45.67 2jty s LEU 104 CO 0.02 -0.01 0.10 -0.67 0.23 0.00 0.00 176.35 176.03 2jty n ASP 105 N 3.69 -0.75 -0.33 2.29 -0.08 -1.12 -0.54 116.55 119.71 2jty n ASP 105 Ca -0.22 -0.71 0.22 0.00 -1.51 0.00 0.00 54.79 52.57 2jty n ASP 105 Cb 0.53 -0.09 0.49 0.00 2.34 0.00 0.00 41.12 44.39 2jty n ASP 105 CO 0.00 0.00 0.00 0.08 0.12 0.00 0.00 177.20 177.40 2jty h ARG 106 N 0.00 0.41 0.00 -0.67 0.11 -1.90 -0.09 114.38 112.24 2jty h ARG 106 Ca -0.04 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.02 2jty h ARG 106 Cb 0.11 -0.09 0.00 0.00 1.11 0.00 0.00 29.97 31.09 2jty h ARG 106 CO 0.02 0.27 0.00 0.25 0.10 0.00 0.00 179.97 180.62 2jty n THR 107 N -4.68 0.13 -1.98 0.08 -2.24 -1.26 -4.92 114.28 99.40 2jty n THR 107 Ca 0.26 0.03 -0.18 0.00 -2.27 0.00 0.00 64.05 61.89 2jty n THR 107 Cb 0.87 -0.59 -0.04 0.00 -2.10 0.00 0.00 70.33 68.47 2jty n THR 107 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jty n GLY 108 N 1.01 0.59 3.77 3.38 0.00 -0.05 -4.99 105.19 108.90 2jty n GLY 108 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 2jty n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jty s ALA 109 N -2.72 3.43 0.60 4.61 0.00 -1.26 -4.84 121.76 121.58 2jty s ALA 109 Ca 0.00 0.34 -0.16 0.00 0.00 0.00 0.00 51.96 52.14 2jty s ALA 109 Cb 0.00 -2.96 -0.03 0.00 0.00 0.00 0.00 23.12 20.13 2jty s ALA 109 CO 0.00 0.24 1.08 0.00 0.00 0.00 0.00 175.76 177.08 2jty s ALA 110 N -0.90 2.67 -0.13 0.00 0.00 -1.26 -2.81 121.76 119.33 2jty s ALA 110 Ca 0.36 0.48 -0.00 0.00 0.00 0.00 0.00 51.96 52.80 2jty s ALA 110 Cb -0.23 -3.27 0.02 0.00 0.00 0.00 0.00 23.12 19.65 2jty s ALA 110 CO 0.25 -0.91 -0.11 -0.51 0.00 0.00 0.00 175.76 174.49 2jty s LEU 111 N -4.50 1.42 0.64 0.00 1.43 -0.43 -4.96 118.68 112.28 2jty s LEU 111 Ca 0.65 -0.39 -0.14 0.00 -1.03 0.00 0.00 54.13 53.23 2jty s LEU 111 Cb -0.18 -1.00 -0.01 0.00 0.03 0.00 0.00 46.19 45.03 2jty s LEU 111 CO 0.37 -0.09 1.06 -0.89 0.23 0.00 0.00 176.35 177.03 2jty s THR 112 N 1.61 3.84 -1.10 5.49 2.01 -1.26 -4.56 115.64 121.66 2jty s THR 112 Ca 0.05 0.75 -0.05 0.00 0.31 0.00 0.00 61.69 62.75 2jty s THR 112 Cb -0.13 -3.35 0.30 0.00 0.01 0.00 0.00 72.50 69.33 2jty s THR 112 CO -0.09 -0.63 1.46 0.18 -0.69 0.00 0.00 174.62 174.84 2jty n LEU 113 N -2.53 6.31 0.00 4.42 4.77 -1.21 -4.28 117.00 124.49 2jty n LEU 113 Ca 0.08 -5.15 0.00 0.00 -0.03 0.00 0.00 56.01 50.91 2jty n LEU 113 Cb 0.53 -1.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.30 2jty n LEU 113 CO 0.51 1.62 -0.48 0.47 -1.33 0.00 0.00 177.39 178.17 2jty n ASP 114 N 1.69 4.82 0.00 -1.43 8.00 -0.96 -4.52 116.55 124.14 2jty n ASP 114 Ca 0.27 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.77 2jty n ASP 114 Cb 0.34 0.92 0.00 0.00 -0.02 0.00 0.00 41.12 42.36 2jty n ASP 114 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jty n GLY 115 N 2.46 2.98 0.13 0.44 0.00 -0.10 -4.66 105.19 106.44 2jty n GLY 115 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2jty n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jty n ALA 116 N -0.32 1.12 -1.54 4.61 0.00 -1.26 -4.52 120.51 118.59 2jty n ALA 116 Ca 0.00 -0.81 -0.36 0.00 0.00 0.00 0.00 53.44 52.26 2jty n ALA 116 Cb 0.00 -0.41 -0.06 0.00 0.00 0.00 0.00 19.45 18.98 2jty n ALA 116 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2jty n THR 117 N -3.46 -0.07 -1.23 0.00 -1.04 -1.26 -4.82 114.28 102.40 2jty n THR 117 Ca -0.38 -0.64 -0.29 0.00 -2.04 0.00 0.00 64.05 60.69 2jty n THR 117 Cb 1.00 -2.33 0.20 0.00 -1.82 0.00 0.00 70.33 67.38 2jty n THR 117 CO 0.00 0.00 0.00 0.72 -0.64 0.00 0.00 175.07 175.15 2jty s PHE 118 N 11.64 1.44 0.00 -1.42 -0.71 -1.26 -4.41 117.98 123.27 2jty s PHE 118 Ca 1.06 0.71 0.00 0.00 -1.04 0.00 0.00 56.93 57.66 2jty s PHE 118 Cb -0.39 -3.42 0.00 0.00 -1.21 0.00 0.00 43.02 38.01 2jty s PHE 118 CO 0.30 -3.24 0.00 -1.13 -1.34 0.00 0.00 175.22 169.81 2jty n SER 119 N -4.36 1.55 -4.76 1.98 3.41 -1.25 -4.92 113.62 105.28 2jty n SER 119 Ca 0.09 -0.07 -0.37 0.00 -0.26 0.00 0.00 58.87 58.26 2jty n SER 119 Cb 0.59 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.55 2jty n SER 119 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2jty s SER 120 N 0.44 5.63 0.09 4.04 0.15 -1.26 -4.87 113.70 117.91 2jty s SER 120 Ca 0.00 2.47 -0.18 0.00 0.70 0.00 0.00 55.95 58.94 2jty s SER 120 Cb 0.00 -2.61 -0.07 0.00 -1.71 0.00 0.00 66.02 61.63 2jty s SER 120 CO 0.00 -1.30 0.56 -1.61 1.20 0.00 0.00 173.24 172.08 2jty s GLU 121 N -2.94 4.12 -0.25 5.44 2.02 -1.26 -4.67 118.70 121.16 2jty s GLU 121 Ca 0.70 0.66 0.02 0.00 0.02 0.00 0.00 54.97 56.37 2jty s GLU 121 Cb -0.33 -3.15 0.06 0.00 0.10 0.00 0.00 34.13 30.82 2jty s GLU 121 CO 0.38 0.59 -0.10 0.99 0.02 0.00 0.00 175.26 177.15 2jty s THR 122 N -1.21 2.02 -0.15 3.63 2.01 -1.26 -5.04 115.64 115.64 2jty s THR 122 Ca 0.31 -1.52 -0.29 0.00 0.31 0.00 0.00 61.69 60.50 2jty s THR 122 Cb -0.18 -2.16 -0.04 0.00 0.01 0.00 0.00 72.50 70.14 2jty s THR 122 CO 0.19 -0.03 1.63 -0.89 -0.69 0.00 0.00 174.62 174.83 2jty s THR 123 N 1.17 3.66 1.21 -0.82 2.01 -1.26 -3.28 115.64 118.33 2jty s THR 123 Ca -0.08 0.76 -0.17 0.00 0.31 0.00 0.00 61.69 62.52 2jty s THR 123 Cb -0.20 -3.60 0.29 0.00 0.01 0.00 0.00 72.50 69.01 2jty s THR 123 CO -0.05 -0.18 1.03 -0.76 -0.69 0.00 0.00 174.62 173.96 2jty s LEU 124 N 4.76 0.39 0.13 4.42 1.43 0.76 -4.98 118.68 125.60 2jty s LEU 124 Ca 0.72 1.09 0.04 0.00 -1.03 0.00 0.00 54.13 54.95 2jty s LEU 124 Cb -0.28 -2.88 -0.04 0.00 0.03 0.00 0.00 46.19 43.02 2jty s LEU 124 CO 0.29 -4.32 -0.10 0.54 0.23 0.00 0.00 176.35 172.99 2jty s ASN 125 N -3.14 1.65 0.18 2.29 4.22 -1.26 -4.93 114.94 113.95 2jty s ASN 125 Ca 0.68 -0.97 -0.33 0.00 -2.14 0.00 0.00 52.86 50.10 2jty s ASN 125 Cb -0.18 0.01 -0.13 0.00 1.28 0.00 0.00 41.25 42.23 2jty s ASN 125 CO 0.60 -0.34 1.69 0.59 -2.04 0.00 0.00 177.10 177.60 2jty n ASN 126 N -0.04 3.70 0.00 3.54 3.02 -1.22 -4.43 115.26 119.83 2jty n ASN 126 Ca -0.12 1.06 0.00 0.00 -0.03 0.00 0.00 54.58 55.50 2jty n ASN 126 Cb 0.60 -1.52 0.00 0.00 -0.61 0.00 0.00 39.78 38.25 2jty n ASN 126 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jty n GLY 127 N 3.81 0.58 3.68 7.41 0.00 -1.25 -4.93 105.19 114.49 2jty n GLY 127 Ca 0.17 -1.74 -0.34 0.00 0.00 0.00 0.00 46.02 44.11 2jty n GLY 127 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jty s THR 128 N 0.00 4.21 0.26 2.61 2.01 -1.26 0.03 115.64 123.50 2jty s THR 128 Ca 0.00 -0.45 -0.01 0.00 0.31 0.00 0.00 61.69 61.54 2jty s THR 128 Cb 0.00 -2.83 -0.03 0.00 0.01 0.00 0.00 72.50 69.65 2jty s THR 128 CO 0.00 0.47 0.28 0.20 -0.69 0.00 0.00 174.62 174.88 2jty s ASN 129 N -1.27 0.59 -0.21 3.53 0.01 0.16 -4.82 114.94 112.94 2jty s ASN 129 Ca 0.17 -1.42 -0.22 0.00 -0.71 0.00 0.00 52.86 50.68 2jty s ASN 129 Cb -0.11 0.50 0.06 0.00 0.41 0.00 0.00 41.25 42.11 2jty s ASN 129 CO 0.07 -1.01 0.61 -0.89 -1.51 0.00 0.00 177.10 174.37 2jty s THR 130 N -3.79 0.00 -0.33 1.60 2.01 -1.26 -1.45 115.64 112.42 2jty s THR 130 Ca 0.35 -0.02 -0.19 0.00 0.31 0.00 0.00 61.69 62.15 2jty s THR 130 Cb 0.04 -0.86 -0.01 0.00 0.01 0.00 0.00 72.50 71.67 2jty s THR 130 CO 0.17 -0.01 0.56 -0.63 -0.69 0.00 0.00 174.62 174.02 2jty s ILE 131 N 0.13 4.98 -1.26 1.82 1.09 -1.10 -4.93 121.20 121.93 2jty s ILE 131 Ca -0.01 0.56 -0.14 0.00 -1.10 0.00 0.00 60.65 59.95 2jty s ILE 131 Cb -0.04 -3.97 0.13 0.00 -1.06 0.00 0.00 42.46 37.52 2jty s ILE 131 CO 0.02 -0.18 1.62 -0.81 -0.10 0.00 0.00 174.94 175.49 2jty n PRO 132 N 5.81 3.32 -1.00 2.79 -0.04 -1.26 -2.44 135.00 142.17 2jty n PRO 132 Ca -0.03 -3.57 -0.30 0.00 -0.04 0.00 0.00 63.50 59.55 2jty n PRO 132 Cb 0.49 -3.18 0.15 0.00 -0.04 0.00 0.00 33.50 30.92 2jty n PRO 132 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2jty s PHE 133 N 2.30 2.09 -0.02 0.54 0.08 -1.26 -3.11 117.98 118.60 2jty s PHE 133 Ca 0.46 1.48 0.05 0.00 0.12 0.00 0.00 56.93 59.04 2jty s PHE 133 Cb 0.02 -3.17 -0.03 0.00 -0.57 0.00 0.00 43.02 39.27 2jty s PHE 133 CO 0.02 -2.51 -0.17 -0.65 -0.10 0.00 0.00 175.22 171.81 2jty s GLN 134 N -4.79 2.35 -0.02 0.44 -0.21 0.30 -2.47 119.66 115.26 2jty s GLN 134 Ca 0.64 -0.80 -0.02 0.00 0.02 0.00 0.00 55.36 55.20 2jty s GLN 134 Cb -0.20 -2.29 -0.04 0.00 1.00 0.00 0.00 33.01 31.49 2jty s GLN 134 CO 0.58 0.59 0.14 0.00 -2.12 0.00 0.00 175.29 174.49 2jty s ALA 135 N -0.76 3.82 0.02 6.09 0.00 0.75 -0.82 121.76 130.85 2jty s ALA 135 Ca 0.12 -0.79 -0.14 0.00 0.00 0.00 0.00 51.96 51.15 2jty s ALA 135 Cb -0.10 -1.78 0.02 0.00 0.00 0.00 0.00 23.12 21.25 2jty s ALA 135 CO 0.02 0.72 0.30 -0.98 0.00 0.00 0.00 175.76 175.81 2jty s ARG 136 N -1.78 0.74 0.57 0.00 1.70 -1.00 -1.24 118.95 117.94 2jty s ARG 136 Ca 0.25 -0.36 -0.18 0.00 -0.47 0.00 0.00 55.73 54.96 2jty s ARG 136 Cb -0.12 0.32 -0.05 0.00 -0.57 0.00 0.00 34.95 34.53 2jty s ARG 136 CO 0.16 -0.22 1.12 0.71 -1.08 0.00 0.00 175.30 175.99 2jty s TYR 137 N -1.97 2.68 -0.16 5.89 2.02 -1.26 -0.60 117.35 123.95 2jty s TYR 137 Ca -0.09 1.55 -0.00 0.00 -0.37 0.00 0.00 57.07 58.15 2jty s TYR 137 Cb -0.03 -3.25 0.04 0.00 -0.40 0.00 0.00 41.96 38.32 2jty s TYR 137 CO 0.00 -1.57 -0.06 0.12 -1.57 0.00 0.00 175.55 172.48 2jty s PHE 138 N -1.92 1.66 0.34 2.71 2.19 0.64 -1.05 117.98 122.55 2jty s PHE 138 Ca 0.71 -1.02 -0.22 0.00 0.33 0.00 0.00 56.93 56.73 2jty s PHE 138 Cb -0.23 -1.30 -0.10 0.00 -1.31 0.00 0.00 43.02 40.09 2jty s PHE 138 CO 0.30 -0.60 0.88 0.00 1.83 0.00 0.00 175.22 177.63 2jty s ALA 139 N 1.65 3.21 -0.66 11.12 0.00 0.16 -1.09 121.76 136.15 2jty s ALA 139 Ca 0.02 0.36 0.07 0.00 0.00 0.00 0.00 51.96 52.41 2jty s ALA 139 Cb -0.15 -3.06 0.15 0.00 0.00 0.00 0.00 23.12 20.06 2jty s ALA 139 CO -0.08 0.21 1.03 0.25 0.00 0.00 0.00 175.76 177.17 2jty n THR 140 N 0.13 0.70 -0.15 0.00 -2.24 0.33 -0.66 114.28 112.39 2jty n THR 140 Ca 0.03 -0.85 0.00 0.00 -2.27 0.00 0.00 64.05 60.96 2jty n THR 140 Cb 0.52 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 2jty n THR 140 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jty n GLY 141 N 0.20 -0.63 3.56 3.38 0.00 -1.25 -4.10 105.19 106.35 2jty n GLY 141 Ca 0.06 -0.56 -0.24 0.00 0.00 0.00 0.00 46.02 45.28 2jty n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jty s ALA 142 N -1.00 1.14 -0.02 4.61 0.00 -1.21 -1.80 121.76 123.48 2jty s ALA 142 Ca 0.00 -0.45 -0.30 0.00 0.00 0.00 0.00 51.96 51.21 2jty s ALA 142 Cb 0.00 -4.47 -0.03 0.00 0.00 0.00 0.00 23.12 18.62 2jty s ALA 142 CO 0.00 -5.24 1.01 0.00 0.00 0.00 0.00 175.76 171.53 2jty s ALA 143 N 13.52 3.23 0.63 0.00 0.00 -1.01 -4.70 121.76 133.42 2jty s ALA 143 Ca 0.94 0.53 -0.01 0.00 0.00 0.00 0.00 51.96 53.42 2jty s ALA 143 Cb -0.15 -3.37 0.06 0.00 0.00 0.00 0.00 23.12 19.66 2jty s ALA 143 CO 0.16 -0.33 0.88 0.95 0.00 0.00 0.00 175.76 177.42 2jty s THR 144 N 1.24 2.46 0.71 0.00 -4.23 -1.15 -4.69 115.64 109.97 2jty s THR 144 Ca 0.52 -0.54 -0.05 0.00 -1.18 0.00 0.00 61.69 60.44 2jty s THR 144 Cb -0.21 -2.91 0.09 0.00 1.34 0.00 0.00 72.50 70.80 2jty s THR 144 CO 0.26 0.00 0.99 -2.16 -0.54 0.00 0.00 174.62 173.17 2jty s PRO 145 N -4.97 1.96 0.00 3.99 0.04 -1.26 -4.52 135.00 130.23 2jty s PRO 145 Ca 0.60 -0.61 0.00 0.00 0.04 0.00 0.00 61.00 61.03 2jty s PRO 145 Cb -0.09 -2.24 0.00 0.00 0.04 0.00 0.00 34.50 32.21 2jty s PRO 145 CO 0.41 -1.32 0.00 0.41 0.04 0.00 0.00 177.00 176.54 2jty n GLY 146 N -2.87 -1.03 3.13 0.56 0.00 -0.04 -3.99 105.19 100.94 2jty n GLY 146 Ca 0.11 0.38 -0.09 0.00 0.00 0.00 0.00 46.02 46.41 2jty n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jty s ALA 147 N -1.00 -0.07 -0.35 4.61 0.00 -1.19 -4.55 121.76 119.21 2jty s ALA 147 Ca 0.00 -0.58 0.01 0.00 0.00 0.00 0.00 51.96 51.39 2jty s ALA 147 Cb 0.00 0.28 0.14 0.00 0.00 0.00 0.00 23.12 23.54 2jty s ALA 147 CO 0.00 -0.34 0.27 0.00 0.00 0.00 0.00 175.76 175.68 2jty s ALA 148 N -2.82 0.29 0.04 0.00 0.00 -1.06 -0.61 121.76 117.60 2jty s ALA 148 Ca -0.03 -1.33 0.07 0.00 0.00 0.00 0.00 51.96 50.67 2jty s ALA 148 Cb 0.00 -1.75 -0.02 0.00 0.00 0.00 0.00 23.12 21.34 2jty s ALA 148 CO -0.06 -2.03 -0.19 -0.80 0.00 0.00 0.00 175.76 172.68 2jty s ASN 149 N 1.43 2.25 0.02 0.00 0.02 -1.26 -1.56 114.94 115.84 2jty s ASN 149 Ca 0.16 -0.51 -0.16 0.00 -1.02 0.00 0.00 52.86 51.33 2jty s ASN 149 Cb -0.19 -0.17 0.03 0.00 0.02 0.00 0.00 41.25 40.94 2jty s ASN 149 CO -0.08 0.12 0.36 0.00 0.02 0.00 0.00 177.10 177.52 2jty s ALA 150 N -0.83 -0.86 -0.34 0.60 0.00 0.59 -0.15 121.76 120.77 2jty s ALA 150 Ca 0.06 0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.28 2jty s ALA 150 Cb -0.09 0.24 0.11 0.00 0.00 0.00 0.00 23.12 23.38 2jty s ALA 150 CO 0.02 -0.38 0.12 0.16 0.00 0.00 0.00 175.76 175.68 2jty s ASP 151 N -1.79 4.03 0.67 0.00 1.47 -1.26 -0.43 116.67 119.36 2jty s ASP 151 Ca -0.08 -1.87 -0.11 0.00 1.18 0.00 0.00 52.55 51.68 2jty s ASP 151 Cb -0.02 -0.97 0.00 0.00 -0.34 0.00 0.00 42.92 41.59 2jty s ASP 151 CO -0.00 -0.39 1.06 0.00 0.68 0.00 0.00 175.17 176.52 2jty s ALA 152 N 1.32 2.99 0.28 2.11 0.00 -0.47 -4.87 121.76 123.12 2jty s ALA 152 Ca 0.11 -0.33 0.05 0.00 0.00 0.00 0.00 51.96 51.80 2jty s ALA 152 Cb -0.19 -2.98 -0.02 0.00 0.00 0.00 0.00 23.12 19.93 2jty s ALA 152 CO -0.19 -0.99 0.41 0.95 0.00 0.00 0.00 175.76 175.94 2jty s THR 153 N -3.27 4.81 0.16 0.00 -4.23 -0.70 -0.90 115.64 111.51 2jty s THR 153 Ca 0.57 -0.97 0.10 0.00 -1.18 0.00 0.00 61.69 60.20 2jty s THR 153 Cb -0.11 -3.69 -0.04 0.00 1.34 0.00 0.00 72.50 70.00 2jty s THR 153 CO 0.51 -0.27 -0.21 0.72 -0.54 0.00 0.00 174.62 174.83 2jty s PHE 154 N -2.07 2.01 0.39 3.99 -0.71 -0.25 -1.62 117.98 119.73 2jty s PHE 154 Ca 0.38 -0.42 0.08 0.00 -1.04 0.00 0.00 56.93 55.94 2jty s PHE 154 Cb -0.09 -1.02 -0.05 0.00 -1.21 0.00 0.00 43.02 40.64 2jty s PHE 154 CO 0.30 0.37 0.15 0.15 -1.34 0.00 0.00 175.22 174.85 2jty s LYS 155 N -2.55 2.23 -0.06 1.99 1.02 0.11 -1.22 119.74 121.27 2jty s LYS 155 Ca 0.16 -1.77 0.05 0.00 0.02 0.00 0.00 55.97 54.43 2jty s LYS 155 Cb -0.07 -2.02 -0.01 0.00 -0.52 0.00 0.00 37.83 35.21 2jty s LYS 155 CO 0.07 -0.03 -0.23 0.08 -0.92 0.00 0.00 175.35 174.32 2jty s VAL 156 N -2.55 1.88 -0.55 3.17 1.01 -0.11 -1.97 120.40 121.28 2jty s VAL 156 Ca 0.39 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 61.45 2jty s VAL 156 Cb 0.02 -1.60 0.14 0.00 0.00 0.00 0.00 36.38 34.94 2jty s VAL 156 CO 0.22 0.53 0.31 -1.58 0.00 0.00 0.00 175.10 174.58 2jty s GLN 157 N -0.05 1.95 0.62 2.72 0.74 -0.13 -0.23 119.66 125.28 2jty s GLN 157 Ca -0.05 -2.68 -0.18 0.00 0.05 0.00 0.00 55.36 52.50 2jty s GLN 157 Cb -0.14 -3.14 -0.03 0.00 1.10 0.00 0.00 33.01 30.81 2jty s GLN 157 CO 0.04 -1.16 1.10 0.66 -0.55 0.00 0.00 175.29 175.38 2jty n TYR 158 N 2.91 1.29 -3.60 1.67 4.01 -0.74 -0.70 117.16 121.99 2jty n TYR 158 Ca 0.09 0.43 -0.07 0.00 -0.16 0.00 0.00 57.90 58.19 2jty n TYR 158 Cb 0.33 -2.19 -0.02 0.00 -0.31 0.00 0.00 39.34 37.15 2jty n TYR 158 CO 0.00 0.00 0.00 1.14 -0.46 0.00 0.00 176.86 177.54 2jty s GLN 159 N -3.00 1.07 0.00 -0.72 -2.07 -0.78 -0.86 119.66 113.30 2jty s GLN 159 Ca 0.78 -0.49 0.00 0.00 -1.82 0.00 0.00 55.36 53.83 2jty s GLN 159 Cb -0.40 0.43 0.00 0.00 -1.09 0.00 0.00 33.01 31.95 2jty s GLN 159 CO 0.44 -0.48 0.00 0.41 -1.32 0.00 0.00 175.29 174.34 2jty n GLY 160 N -0.35 0.49 0.00 2.60 0.00 -1.25 -1.04 105.19 105.63 2jty n GLY 160 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2jty n GLY 160 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jty n GLY 161 N 0.00 -2.03 0.01 -0.02 0.00 -1.26 -4.12 105.19 97.76 2jty n GLY 161 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 2jty n GLY 161 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jty n GLY 162 N -0.33 -1.39 5.41 -0.02 0.00 -1.26 -4.96 105.19 102.64 2jty n GLY 162 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2jty n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jty n GLY 163 N 1.49 2.20 0.00 -0.02 0.00 -1.26 -4.50 105.19 103.10 2jty n GLY 163 Ca 0.07 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2jty n GLY 163 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jty n GLY 164 N 0.00 -2.98 2.43 -0.02 0.00 -1.26 -4.67 105.19 98.68 2jty n GLY 164 Ca 0.00 0.16 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 2jty n GLY 164 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jty s GLY 165 N -0.26 1.09 -0.25 -0.02 0.00 -1.26 -5.07 107.32 101.54 2jty s GLY 165 Ca 0.00 -2.24 -0.10 0.00 0.00 0.00 0.00 44.72 42.38 2jty s GLY 165 CO 0.00 2.10 0.57 0.00 0.00 0.00 0.00 173.10 175.76 2jty s ALA 166 N 0.43 -1.65 0.24 3.20 0.00 -1.26 -4.93 121.76 117.79 2jty s ALA 166 Ca 0.27 2.03 -0.15 0.00 0.00 0.00 0.00 51.96 54.11 2jty s ALA 166 Cb -0.07 -1.49 0.01 0.00 0.00 0.00 0.00 23.12 21.57 2jty s ALA 166 CO -0.12 -0.70 0.53 0.00 0.00 0.00 0.00 175.76 175.47 2jty s ALA 167 N 2.41 -0.56 -0.35 0.00 0.00 -1.26 -3.85 121.76 118.15 2jty s ALA 167 Ca -0.06 -0.64 -0.00 0.00 0.00 0.00 0.00 51.96 51.25 2jty s ALA 167 Cb -0.10 0.97 0.12 0.00 0.00 0.00 0.00 23.12 24.11 2jty s ALA 167 CO -0.17 -0.87 0.16 0.99 0.00 0.00 0.00 175.76 175.87 2jty s THR 168 N -3.97 0.71 0.11 0.00 2.01 -0.04 -4.97 115.64 109.50 2jty s THR 168 Ca 0.17 -1.64 -0.30 0.00 0.31 0.00 0.00 61.69 60.23 2jty s THR 168 Cb -0.02 -1.53 -0.06 0.00 0.01 0.00 0.00 72.50 70.90 2jty s THR 168 CO 0.06 -0.80 1.07 -0.89 -0.69 0.00 0.00 174.62 173.37 2jty s THR 169 N 1.28 4.19 0.26 -0.82 2.01 -1.26 -1.80 115.64 119.49 2jty s THR 169 Ca 0.13 1.75 -0.09 0.00 0.31 0.00 0.00 61.69 63.80 2jty s THR 169 Cb -0.20 -4.12 -0.01 0.00 0.01 0.00 0.00 72.50 68.18 2jty s THR 169 CO -0.16 0.24 0.42 0.68 -0.69 0.00 0.00 174.62 175.11 2jty s VAL 170 N 0.24 0.00 1.06 3.82 -7.23 0.68 -4.98 120.40 114.00 2jty s VAL 170 Ca 0.51 -1.55 -0.13 0.00 -1.81 0.00 0.00 61.98 59.00 2jty s VAL 170 Cb -0.27 -2.34 0.22 0.00 0.56 0.00 0.00 36.38 34.56 2jty s VAL 170 CO 0.32 0.00 1.08 0.20 -0.31 0.00 0.00 175.10 176.38 2jty s ASN 171 N -3.08 2.02 0.06 4.85 0.02 -1.26 -0.93 114.94 116.61 2jty s ASN 171 Ca 0.27 1.17 0.00 0.00 -1.02 0.00 0.00 52.86 53.28 2jty s ASN 171 Cb 0.01 -1.83 0.00 0.00 0.02 0.00 0.00 41.25 39.45 2jty s ASN 171 CO 0.11 -3.50 0.00 0.61 0.02 0.00 0.00 177.10 174.34 2jty n GLY 172 N -0.68 -0.06 0.00 0.66 0.00 -0.35 -3.72 105.19 101.03 2jty n GLY 172 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2jty n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jty n GLY 173 N 1.83 -0.68 2.92 -0.02 0.00 -0.94 -4.66 105.19 103.63 2jty n GLY 173 Ca 0.00 -1.12 -0.29 0.00 0.00 0.00 0.00 46.02 44.61 2jty n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jty s THR 174 N -3.00 1.34 -0.41 2.61 2.01 0.22 -1.08 115.64 117.33 2jty s THR 174 Ca 0.00 -0.92 -0.11 0.00 0.31 0.00 0.00 61.69 60.98 2jty s THR 174 Cb 0.00 -1.54 0.06 0.00 0.01 0.00 0.00 72.50 71.03 2jty s THR 174 CO 0.00 0.04 0.26 -0.69 -0.69 0.00 0.00 174.62 173.53 2jty s VAL 175 N 1.51 4.46 -0.93 3.82 1.01 -0.08 -2.60 120.40 127.60 2jty s VAL 175 Ca -0.02 -1.18 -0.14 0.00 0.00 0.00 0.00 61.98 60.64 2jty s VAL 175 Cb -0.17 -3.64 0.20 0.00 0.00 0.00 0.00 36.38 32.78 2jty s VAL 175 CO -0.07 -0.42 0.96 -1.00 0.00 0.00 0.00 175.10 174.56 2jty s HIS 176 N 1.49 3.67 -0.25 5.22 3.76 -0.03 -1.37 115.29 127.79 2jty s HIS 176 Ca 0.03 -1.97 -0.29 0.00 -0.15 0.00 0.00 55.06 52.68 2jty s HIS 176 Cb -0.22 -3.97 -0.03 0.00 1.11 0.00 0.00 32.58 29.48 2jty s HIS 176 CO 0.04 -1.13 1.72 -0.06 -0.85 0.00 0.00 174.74 174.46 2jty s PHE 177 N 0.64 1.93 0.36 1.40 0.08 0.43 -0.92 117.98 121.89 2jty s PHE 177 Ca 0.25 0.53 0.09 0.00 0.12 0.00 0.00 56.93 57.92 2jty s PHE 177 Cb -0.08 -4.05 -0.07 0.00 -0.57 0.00 0.00 43.02 38.25 2jty s PHE 177 CO -0.08 -3.09 -0.07 0.15 -0.10 0.00 0.00 175.22 172.03 2jty s LYS 178 N 5.08 1.85 0.00 0.44 -0.14 0.13 -0.30 119.74 126.80 2jty s LYS 178 Ca 0.76 -1.98 0.00 0.00 -1.36 0.00 0.00 55.97 53.39 2jty s LYS 178 Cb -0.25 -1.68 0.00 0.00 -1.68 0.00 0.00 37.83 34.22 2jty s LYS 178 CO 0.32 0.09 0.00 0.41 -0.76 0.00 0.00 175.35 175.40 2jty n GLY 179 N -0.84 0.67 3.79 -3.33 0.00 -0.60 -0.07 105.19 104.83 2jty n GLY 179 Ca -0.05 -1.74 -0.04 0.00 0.00 0.00 0.00 46.02 44.19 2jty n GLY 179 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jty s GLU 180 N -2.00 1.36 -0.05 1.61 2.12 -0.59 -2.57 118.70 118.57 2jty s GLU 180 Ca 0.00 -0.79 0.06 0.00 0.36 0.00 0.00 54.97 54.60 2jty s GLU 180 Cb 0.00 0.44 -0.01 0.00 0.26 0.00 0.00 34.13 34.82 2jty s GLU 180 CO 0.00 -0.63 -0.24 0.08 -0.54 0.00 0.00 175.26 173.93 2jty s VAL 181 N -3.04 1.99 0.15 3.70 1.01 -1.26 -1.07 120.40 121.88 2jty s VAL 181 Ca 0.14 -1.03 0.10 0.00 0.00 0.00 0.00 61.98 61.19 2jty s VAL 181 Cb -0.02 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 2jty s VAL 181 CO 0.04 0.56 -0.21 0.68 0.00 0.00 0.00 175.10 176.17 2jty s VAL 182 N -0.16 2.63 -0.54 2.92 -7.23 0.35 -0.86 120.40 117.50 2jty s VAL 182 Ca -0.03 -1.72 0.00 0.00 -1.81 0.00 0.00 61.98 58.42 2jty s VAL 182 Cb -0.13 -2.22 0.00 0.00 0.56 0.00 0.00 36.38 34.58 2jty s VAL 182 CO 0.03 0.01 0.51 -3.20 -0.31 0.00 0.00 175.10 172.15 2jty n ASN 183 N 0.59 1.35 0.00 4.85 2.85 -1.26 -0.74 115.26 122.90 2jty n ASN 183 Ca -0.15 -1.40 0.00 0.00 -0.11 0.00 0.00 54.58 52.92 2jty n ASN 183 Cb 0.54 -0.35 0.00 0.00 1.24 0.00 0.00 39.78 41.21 2jty n ASN 183 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15