#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jty n ALA 2 N 0.00 3.00 -0.52 0.00 0.00 -1.26 -5.16 120.51 116.58 2jty n ALA 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2jty n ALA 2 Cb 0.00 0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.59 2jty n ALA 2 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2jty n THR 3 N -2.95 0.00 -1.04 0.00 5.66 -1.26 -4.83 114.28 109.85 2jty n THR 3 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2jty n THR 3 Cb 0.11 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.89 2jty n THR 3 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 2jty n THR 4 N -0.98 0.00 -2.07 1.09 5.66 -1.26 -5.09 114.28 111.63 2jty n THR 4 Ca 0.00 0.00 -0.43 0.00 -3.05 0.00 0.00 64.05 60.57 2jty n THR 4 Cb 0.00 1.83 -0.03 0.00 -1.55 0.00 0.00 70.33 70.59 2jty n THR 4 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2jty s VAL 5 N 0.00 3.62 0.27 1.08 0.11 -1.26 -4.86 120.40 119.37 2jty s VAL 5 Ca 0.00 0.69 -0.00 0.00 -2.93 0.00 0.00 61.98 59.74 2jty s VAL 5 Cb 0.00 -3.66 0.26 0.00 -1.53 0.00 0.00 36.38 31.45 2jty s VAL 5 CO 0.00 -0.30 1.82 -1.13 -3.33 0.00 0.00 175.10 172.16 2jty h ASN 6 N 11.16 0.83 0.00 3.54 -1.24 -2.00 -3.46 115.58 124.42 2jty h ASN 6 Ca -0.34 0.05 0.00 0.00 0.71 0.00 0.00 56.30 56.72 2jty h ASN 6 Cb 1.16 -0.11 0.00 0.00 0.73 0.00 0.00 38.32 40.10 2jty h ASN 6 CO 1.00 0.44 0.00 0.61 -1.29 0.00 0.00 177.43 178.19 2jty n GLY 7 N -1.34 2.74 0.00 1.57 0.00 -1.26 -5.16 105.19 101.74 2jty n GLY 7 Ca 0.18 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 -0.27 -1.47 2.82 -0.02 0.00 -1.26 -4.97 105.19 100.03 2jty n GLY 8 Ca 0.00 0.55 -0.14 0.00 0.00 0.00 0.00 46.02 46.43 2jty n GLY 8 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2jty s THR 9 N 0.00 -0.47 -0.09 2.61 -1.32 -1.26 -5.09 115.64 110.03 2jty s THR 9 Ca 0.00 -0.20 -0.02 0.00 -1.21 0.00 0.00 61.69 60.26 2jty s THR 9 Cb 0.00 -0.82 0.00 0.00 -1.51 0.00 0.00 72.50 70.17 2jty s THR 9 CO 0.00 -0.24 0.08 0.55 -2.21 0.00 0.00 174.62 172.80 2jty n VAL 10 N 5.34 -0.47 -0.87 5.08 3.14 -1.26 -4.77 118.33 124.52 2jty n VAL 10 Ca -0.04 0.00 -0.10 0.00 -2.96 0.00 0.00 64.34 61.25 2jty n VAL 10 Cb 0.49 -0.42 -0.07 0.00 -1.06 0.00 0.00 33.84 32.78 2jty n VAL 10 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2jty n HIS 11 N -0.43 0.39 -2.70 1.45 1.44 -1.26 -4.20 115.22 109.90 2jty n HIS 11 Ca -0.03 -1.44 -0.07 0.00 -2.01 0.00 0.00 57.72 54.17 2jty n HIS 11 Cb 0.09 -1.11 0.11 0.00 0.12 0.00 0.00 29.99 29.21 2jty n HIS 11 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 2jty n PHE 12 N 1.68 -2.41 -3.60 -1.40 3.72 -1.26 -5.06 117.46 109.12 2jty n PHE 12 Ca 0.27 -1.98 -0.29 0.00 -0.05 0.00 0.00 57.45 55.40 2jty n PHE 12 Cb 0.68 1.55 -0.12 0.00 -0.94 0.00 0.00 39.48 40.65 2jty n PHE 12 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2jty s LYS 13 N 0.10 1.09 0.00 -1.08 -0.14 -1.26 -4.88 119.74 113.57 2jty s LYS 13 Ca 0.22 -1.91 0.00 0.00 -1.36 0.00 0.00 55.97 52.92 2jty s LYS 13 Cb 0.39 -1.97 0.00 0.00 -1.68 0.00 0.00 37.83 34.57 2jty s LYS 13 CO -0.08 -1.22 0.06 0.41 -0.76 0.00 0.00 175.35 173.76 2jty n GLY 14 N 3.48 0.54 0.00 -3.33 0.00 -1.26 -5.15 105.19 99.47 2jty n GLY 14 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 -0.21 1.61 2.13 -1.26 -5.05 120.64 117.86 2jty n GLU 15 Ca 0.00 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 57.77 2jty n GLU 15 Cb 0.38 0.00 0.05 0.00 0.27 0.00 0.00 31.44 32.15 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 1.08 -6.66 6.31 3.04 -1.99 -3.47 116.25 114.56 2jty h VAL 16 Ca 0.00 -0.25 -0.53 0.00 -1.01 0.00 0.00 66.70 64.91 2jty h VAL 16 Cb 0.00 0.29 0.01 0.00 -2.01 0.00 0.00 31.29 29.58 2jty h VAL 16 CO 0.00 0.13 -0.98 0.52 -1.01 0.00 0.00 177.57 176.23 2jty n VAL 17 N -4.73 -3.87 -3.38 1.51 0.31 -1.26 -4.99 118.33 101.92 2jty n VAL 17 Ca 0.05 -0.73 -0.13 0.00 -0.01 0.00 0.00 64.34 63.52 2jty n VAL 17 Cb 0.07 -3.04 -0.09 0.00 -0.91 0.00 0.00 33.84 29.87 2jty n VAL 17 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2jty s ASN 18 N -3.58 0.79 0.00 4.52 0.01 -1.26 -5.13 114.94 110.29 2jty s ASN 18 Ca 0.45 -0.19 0.06 0.00 -0.71 0.00 0.00 52.86 52.47 2jty s ASN 18 Cb -0.21 0.85 -0.02 0.00 0.41 0.00 0.00 41.25 42.28 2jty s ASN 18 CO 0.93 -0.33 -0.18 0.00 -1.51 0.00 0.00 177.10 176.01 2jty s ALA 19 N 2.46 1.49 -2.28 0.60 0.00 -1.26 -4.78 121.76 117.99 2jty s ALA 19 Ca 0.10 -0.82 0.25 0.00 0.00 0.00 0.00 51.96 51.49 2jty s ALA 19 Cb -0.15 -0.35 1.11 0.00 0.00 0.00 0.00 23.12 23.74 2jty s ALA 19 CO -0.22 0.35 1.76 0.00 0.00 0.00 0.00 175.76 177.66 2jty n ALA 20 N 2.42 2.58 -2.23 0.00 0.00 -1.26 -4.86 120.51 117.16 2jty n ALA 20 Ca -0.15 -0.39 -0.09 0.00 0.00 0.00 0.00 53.44 52.81 2jty n ALA 20 Cb 0.54 -1.22 -0.09 0.00 0.00 0.00 0.00 19.45 18.67 2jty n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jty h ALA 22 N 2.87 0.62 -4.17 0.00 0.00 -0.82 -3.48 119.26 114.28 2jty h ALA 22 Ca -0.34 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 53.95 2jty h ALA 22 Cb 1.19 0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.18 2jty h ALA 22 CO 0.59 0.67 -0.93 0.28 0.00 0.00 0.00 179.25 179.86 2jty n VAL 23 N -2.85 -5.53 -2.15 0.00 0.31 -1.26 -4.90 118.33 101.96 2jty n VAL 23 Ca -0.07 2.56 -0.32 0.00 -0.01 0.00 0.00 64.34 66.50 2jty n VAL 23 Cb 0.76 -3.33 -0.01 0.00 -0.91 0.00 0.00 33.84 30.36 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 -2.16 6.27 0.48 4.52 2.15 -1.07 -4.81 116.67 122.05 2jty s ASP 24 Ca 0.00 1.59 0.18 0.00 0.43 0.00 0.00 52.55 54.75 2jty s ASP 24 Cb 0.00 -2.50 1.18 0.00 -0.30 0.00 0.00 42.92 41.29 2jty s ASP 24 CO 0.00 -0.83 2.01 0.00 -0.17 0.00 0.00 175.17 176.18 2jty h ALA 25 N 0.43 2.16 0.00 3.66 0.00 -1.94 -0.76 119.26 122.80 2jty h ALA 25 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2jty h ALA 25 Cb 1.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2jty h ALA 25 CO 0.60 -0.28 0.00 0.41 0.00 0.00 0.00 179.25 179.99 2jty n GLY 26 N -1.56 -0.93 0.00 0.00 0.00 -1.26 -3.97 105.19 97.47 2jty n GLY 26 Ca 0.08 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2jty n GLY 26 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jty n SER 27 N -1.11 3.70 -0.31 1.61 3.41 -0.42 -4.71 113.62 115.79 2jty n SER 27 Ca 0.17 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.77 2jty n SER 27 Cb 0.13 0.37 0.17 0.00 -0.26 0.00 0.00 64.21 64.62 2jty n SER 27 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 2jty h VAL 28 N 0.00 1.23 -0.98 -3.33 3.04 -1.34 -3.31 116.25 111.57 2jty h VAL 28 Ca 0.00 -0.42 -0.42 0.00 -1.01 0.00 0.00 66.70 64.86 2jty h VAL 28 Cb 0.74 -0.09 -0.41 0.00 -2.01 0.00 0.00 31.29 29.52 2jty h VAL 28 CO 0.00 0.22 -1.02 -0.67 -1.01 0.00 0.00 177.57 175.09 2jty n ASP 29 N -4.40 2.70 -4.75 3.17 -0.08 -1.25 -0.04 116.55 111.91 2jty n ASP 29 Ca 0.10 -2.94 -0.38 0.00 -1.51 0.00 0.00 54.79 50.07 2jty n ASP 29 Cb 0.02 -0.48 -0.06 0.00 2.34 0.00 0.00 41.12 42.94 2jty n ASP 29 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jty s GLN 30 N -3.43 4.23 -0.68 -0.67 -2.07 -1.06 -4.92 119.66 111.06 2jty s GLN 30 Ca 0.35 0.36 -0.01 0.00 -1.82 0.00 0.00 55.36 54.25 2jty s GLN 30 Cb 0.41 -3.39 0.17 0.00 -1.09 0.00 0.00 33.01 29.11 2jty s GLN 30 CO -0.03 0.29 0.50 0.99 -1.32 0.00 0.00 175.29 175.72 2jty s THR 31 N 0.22 3.61 -0.69 3.63 2.01 -1.26 -0.74 115.64 122.42 2jty s THR 31 Ca 0.23 -3.39 -0.27 0.00 0.31 0.00 0.00 61.69 58.58 2jty s THR 31 Cb -0.15 -3.34 0.01 0.00 0.01 0.00 0.00 72.50 69.03 2jty s THR 31 CO 0.09 -0.93 1.52 -0.69 -0.69 0.00 0.00 174.62 173.93 2jty s VAL 32 N -0.57 3.57 -0.63 3.82 1.01 -0.79 -4.88 120.40 121.92 2jty s VAL 32 Ca 0.20 0.31 -0.25 0.00 0.00 0.00 0.00 61.98 62.25 2jty s VAL 32 Cb -0.16 -4.51 0.05 0.00 0.00 0.00 0.00 36.38 31.75 2jty s VAL 32 CO -0.06 -1.46 1.06 -1.10 0.00 0.00 0.00 175.10 173.53 2jty s GLN 33 N 6.28 3.27 0.00 2.72 -0.21 -1.26 -3.04 119.66 127.41 2jty s GLN 33 Ca 0.48 -0.34 0.25 0.00 0.02 0.00 0.00 55.36 55.77 2jty s GLN 33 Cb -0.10 -4.12 1.18 0.00 1.00 0.00 0.00 33.01 30.96 2jty s GLN 33 CO 0.17 -1.75 1.82 1.28 -2.12 0.00 0.00 175.29 174.69 2jty n LEU 34 N 8.10 0.00 0.00 2.90 4.77 0.30 -4.97 117.00 128.10 2jty n LEU 34 Ca 0.01 0.38 0.05 0.00 -0.03 0.00 0.00 56.01 56.42 2jty n LEU 34 Cb 0.47 -0.38 -0.01 0.00 -2.33 0.00 0.00 43.42 41.17 2jty n LEU 34 CO 0.67 -0.06 -0.06 0.61 -1.33 0.00 0.00 177.39 177.21 2jty n GLY 35 N 0.94 -1.57 3.77 -0.72 0.00 -1.25 -4.80 105.19 101.55 2jty n GLY 35 Ca 0.09 -1.19 -0.34 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.64 2.85 0.02 1.61 -0.21 -1.26 -1.30 119.66 120.72 2jty s GLN 36 Ca 0.00 1.48 0.00 0.00 0.02 0.00 0.00 55.36 56.86 2jty s GLN 36 Cb 0.00 -1.95 -0.02 0.00 1.00 0.00 0.00 33.01 32.04 2jty s GLN 36 CO 0.00 -1.23 -0.03 0.08 -2.12 0.00 0.00 175.29 171.99 2jty s VAL 37 N -2.18 0.12 0.09 1.09 1.01 -0.65 -4.88 120.40 115.00 2jty s VAL 37 Ca 0.69 -0.75 -0.29 0.00 0.00 0.00 0.00 61.98 61.63 2jty s VAL 37 Cb -0.22 -0.24 -0.06 0.00 0.00 0.00 0.00 36.38 35.86 2jty s VAL 37 CO 0.39 -0.40 0.91 -0.13 0.00 0.00 0.00 175.10 175.87 2jty s ARG 38 N -1.20 4.64 0.60 2.72 0.52 -1.26 0.01 118.95 124.99 2jty s ARG 38 Ca -0.13 1.35 0.33 0.00 -0.52 0.00 0.00 55.73 56.77 2jty s ARG 38 Cb -0.08 -3.38 1.91 0.00 0.52 0.00 0.00 34.95 33.92 2jty s ARG 38 CO -0.01 0.22 2.26 1.79 0.02 0.00 0.00 175.30 179.58 2jty h THR 39 N 4.08 0.41 -0.60 0.02 1.35 -1.33 0.10 112.91 116.95 2jty h THR 39 Ca -0.43 -0.06 0.11 0.00 -0.55 0.00 0.00 66.41 65.47 2jty h THR 39 Cb 1.21 1.04 -0.08 0.00 -1.73 0.00 0.00 68.15 68.59 2jty h THR 39 CO 0.72 0.01 0.16 0.00 -0.25 0.00 0.00 175.52 176.16 2jty h ALA 40 N 1.99 0.74 0.00 6.62 0.00 -1.88 0.10 119.26 126.83 2jty h ALA 40 Ca -0.00 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2jty h ALA 40 Cb 0.04 0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2jty h ALA 40 CO 0.00 -0.27 0.00 0.45 0.00 0.00 0.00 179.25 179.43 2jty n SER 41 N -5.09 0.00 -3.12 0.00 2.88 0.02 -4.12 113.62 104.19 2jty n SER 41 Ca 0.09 -0.33 -0.19 0.00 -1.33 0.00 0.00 58.87 57.10 2jty n SER 41 Cb 0.31 -0.12 -0.03 0.00 -0.75 0.00 0.00 64.21 63.62 2jty n SER 41 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2jty n LEU 42 N -1.12 0.05 0.00 2.46 4.77 0.02 -2.94 117.00 120.23 2jty n LEU 42 Ca 0.12 -4.66 0.00 0.00 -0.03 0.00 0.00 56.01 51.44 2jty n LEU 42 Cb 0.10 0.71 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 2jty n LEU 42 CO 0.12 2.16 0.16 0.00 -1.33 0.00 0.00 177.39 178.50 2jty n ALA 43 N 0.85 1.51 -3.31 -1.18 0.00 -1.20 -0.92 120.51 116.26 2jty n ALA 43 Ca 0.21 -0.31 -0.12 0.00 0.00 0.00 0.00 53.44 53.22 2jty n ALA 43 Cb 0.61 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.03 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 -0.01 1.22 -0.08 0.00 0.00 -0.89 -3.36 119.66 116.53 2jty s GLN 44 Ca 0.00 -0.51 -0.29 0.00 -0.00 0.00 0.00 55.36 54.56 2jty s GLN 44 Cb 0.00 0.55 -0.06 0.00 0.00 0.00 0.00 33.01 33.51 2jty s GLN 44 CO 0.00 -0.51 1.77 -2.00 0.00 0.00 0.00 175.29 174.54 2jty s GLU 45 N -3.67 4.01 0.00 9.60 2.12 -1.26 -1.00 118.70 128.50 2jty s GLU 45 Ca 0.01 2.17 0.00 0.00 0.36 0.00 0.00 54.97 57.51 2jty s GLU 45 Cb -0.00 -4.07 0.00 0.00 0.26 0.00 0.00 34.13 30.32 2jty s GLU 45 CO -0.12 -1.07 0.00 0.41 -0.54 0.00 0.00 175.26 173.94 2jty n GLY 46 N 4.47 1.27 3.77 -1.50 0.00 -0.06 -4.89 105.19 108.24 2jty n GLY 46 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 2jty n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jty s ALA 47 N -2.20 3.30 0.09 4.61 0.00 -0.17 -4.82 121.76 122.57 2jty s ALA 47 Ca 0.00 1.44 0.01 0.00 0.00 0.00 0.00 51.96 53.41 2jty s ALA 47 Cb 0.00 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.51 2jty s ALA 47 CO 0.00 -1.09 -0.06 0.95 0.00 0.00 0.00 175.76 175.56 2jty s THR 48 N -1.20 0.59 0.58 0.00 -4.23 -1.15 -0.50 115.64 109.73 2jty s THR 48 Ca 0.59 -1.86 -0.10 0.00 -1.18 0.00 0.00 61.69 59.14 2jty s THR 48 Cb -0.43 -1.59 0.14 0.00 1.34 0.00 0.00 72.50 71.96 2jty s THR 48 CO 0.56 -0.87 0.62 -1.54 -0.54 0.00 0.00 174.62 172.85 2jty n SER 49 N 0.07 -0.83 0.23 3.99 3.41 -0.50 -4.70 113.62 115.29 2jty n SER 49 Ca -0.13 -1.03 0.18 0.00 -0.26 0.00 0.00 58.87 57.63 2jty n SER 49 Cb 0.60 -0.52 0.86 0.00 -0.26 0.00 0.00 64.21 64.89 2jty n SER 49 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2jty h SER 50 N -1.44 0.00 -3.83 4.04 0.02 -1.94 -3.48 113.55 106.92 2jty h SER 50 Ca -0.22 0.00 0.16 0.00 -0.84 0.00 0.00 61.79 60.89 2jty h SER 50 Cb 0.63 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.08 2jty h SER 50 CO 0.15 0.00 -0.64 0.00 -1.14 0.00 0.00 176.83 175.20 2jty n ALA 51 N -2.23 -1.87 -3.08 3.77 0.00 -1.26 -5.08 120.51 110.76 2jty n ALA 51 Ca 0.01 0.46 -0.13 0.00 0.00 0.00 0.00 53.44 53.79 2jty n ALA 51 Cb 0.34 -0.83 -0.12 0.00 0.00 0.00 0.00 19.45 18.84 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 -3.79 0.00 -0.00 0.00 1.01 -0.83 -5.04 120.40 111.75 2jty s VAL 52 Ca 0.00 -0.03 -0.12 0.00 0.00 0.00 0.00 61.98 61.83 2jty s VAL 52 Cb 0.00 -0.29 -0.05 0.00 0.00 0.00 0.00 36.38 36.03 2jty s VAL 52 CO 0.00 -0.02 0.36 -0.83 0.00 0.00 0.00 175.10 174.61 2jty s GLY 53 N 0.03 2.39 0.04 4.51 0.00 -1.26 -0.76 107.32 112.27 2jty s GLY 53 Ca -0.01 -0.33 0.02 0.00 0.00 0.00 0.00 44.72 44.40 2jty s GLY 53 CO 0.00 -0.02 -0.07 -0.11 0.00 0.00 0.00 173.10 172.91 2jty s PHE 54 N -1.15 0.57 -0.13 1.90 -0.71 -0.69 -4.93 117.98 112.83 2jty s PHE 54 Ca 0.24 -0.49 -0.04 0.00 -1.04 0.00 0.00 56.93 55.61 2jty s PHE 54 Cb -0.15 -0.35 0.07 0.00 -1.21 0.00 0.00 43.02 41.37 2jty s PHE 54 CO 0.13 -0.10 0.22 0.54 -1.34 0.00 0.00 175.22 174.67 2jty s ASN 55 N -1.49 0.73 -0.68 1.98 4.22 -1.26 -0.31 114.94 118.12 2jty s ASN 55 Ca -0.11 0.31 -0.27 0.00 -2.14 0.00 0.00 52.86 50.65 2jty s ASN 55 Cb -0.10 0.49 0.02 0.00 1.28 0.00 0.00 41.25 42.94 2jty s ASN 55 CO 0.00 -0.26 1.38 -0.63 -2.04 0.00 0.00 177.10 175.55 2jty s ILE 56 N 2.36 3.69 -0.01 0.54 -1.09 -0.26 -4.81 121.20 121.62 2jty s ILE 56 Ca 0.03 0.45 -0.30 0.00 -2.23 0.00 0.00 60.65 58.60 2jty s ILE 56 Cb -0.13 -4.69 -0.07 0.00 -1.58 0.00 0.00 42.46 36.00 2jty s ILE 56 CO -0.09 -1.58 1.70 -1.58 -1.23 0.00 0.00 174.94 172.16 2jty s GLN 57 N 5.86 4.18 -0.26 2.79 0.74 -1.26 -2.92 119.66 128.79 2jty s GLN 57 Ca 0.43 2.29 0.01 0.00 0.05 0.00 0.00 55.36 58.14 2jty s GLN 57 Cb -0.09 -3.91 0.07 0.00 1.10 0.00 0.00 33.01 30.19 2jty s GLN 57 CO 0.18 -0.83 -0.02 -0.51 -0.55 0.00 0.00 175.29 173.56 2jty s LEU 58 N 3.70 2.83 0.20 3.68 1.02 -0.47 -2.58 118.68 127.06 2jty s LEU 58 Ca 0.76 -1.38 0.04 0.00 0.02 0.00 0.00 54.13 53.57 2jty s LEU 58 Cb -0.36 -1.20 -0.03 0.00 0.02 0.00 0.00 46.19 44.62 2jty s LEU 58 CO 0.32 -0.28 0.27 0.20 0.02 0.00 0.00 176.35 176.88 2jty s ASN 59 N 1.36 6.07 -1.35 2.29 0.01 -1.26 -0.97 114.94 121.09 2jty s ASN 59 Ca -0.01 0.02 -0.01 0.00 -0.71 0.00 0.00 52.86 52.15 2jty s ASN 59 Cb -0.19 -1.74 -0.00 0.00 0.41 0.00 0.00 41.25 39.74 2jty s ASN 59 CO -0.09 -0.00 0.56 -0.67 -1.51 0.00 0.00 177.10 175.39 2jty n ASP 60 N -0.90 -0.95 -4.79 -1.22 2.03 -1.07 -0.34 116.55 109.31 2jty n ASP 60 Ca -0.08 -0.93 -0.34 0.00 0.52 0.00 0.00 54.79 53.97 2jty n ASP 60 Cb 0.56 -3.52 -0.01 0.00 -0.72 0.00 0.00 41.12 37.43 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 -2.14 2.97 0.57 0.00 2.15 -0.44 -2.81 116.67 116.98 2jty s ASP 62 Ca 0.68 -0.92 0.38 0.00 0.43 0.00 0.00 52.55 53.12 2jty s ASP 62 Cb -0.18 -0.50 2.06 0.00 -0.30 0.00 0.00 42.92 44.00 2jty s ASP 62 CO 0.26 -0.35 2.16 0.71 -0.17 0.00 0.00 175.17 177.79 2jty h THR 63 N 6.47 0.00 -0.81 1.71 1.35 -1.87 -1.25 112.91 118.51 2jty h THR 63 Ca -0.16 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.69 2jty h THR 63 Cb 1.10 0.86 -0.04 0.00 -1.73 0.00 0.00 68.15 68.34 2jty h THR 63 CO 0.35 0.00 0.51 0.78 -0.25 0.00 0.00 175.52 176.91 2jty h ASN 64 N 0.00 0.95 0.03 5.36 2.35 -1.97 -3.17 115.58 119.13 2jty h ASN 64 Ca 0.00 -0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.71 2jty h ASN 64 Cb 0.01 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.14 2jty h ASN 64 CO 0.00 0.71 -0.01 0.58 -1.65 0.00 0.00 177.43 177.06 2jty h VAL 65 N 1.11 0.72 -2.24 2.81 2.07 -1.60 -3.47 116.25 115.65 2jty h VAL 65 Ca 0.29 -1.48 -0.07 0.00 0.82 0.00 0.00 66.70 66.26 2jty h VAL 65 Cb -0.08 1.35 -0.21 0.00 -1.52 0.00 0.00 31.29 30.83 2jty h VAL 65 CO -0.06 0.24 0.04 0.00 0.02 0.00 0.00 177.57 177.81 2jty s ALA 66 N -2.59 -1.53 -0.65 1.67 0.00 -1.17 -4.20 121.76 113.28 2jty s ALA 66 Ca -0.08 1.46 0.25 0.00 0.00 0.00 0.00 51.96 53.58 2jty s ALA 66 Cb -0.01 -0.57 0.45 0.00 0.00 0.00 0.00 23.12 23.00 2jty s ALA 66 CO 0.30 -0.32 1.43 0.77 0.00 0.00 0.00 175.76 177.95 2jty h SER 67 N 4.31 0.00 -4.56 0.00 0.02 -1.53 -3.34 113.55 108.44 2jty h SER 67 Ca -0.28 -0.15 -0.24 0.00 -0.84 0.00 0.00 61.79 60.27 2jty h SER 67 Cb 1.16 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.55 2jty h SER 67 CO 0.23 0.08 -0.69 -0.54 -1.14 0.00 0.00 176.83 174.77 2jty s LYS 68 N -3.15 0.90 0.03 3.45 1.02 0.37 -0.19 119.74 122.16 2jty s LYS 68 Ca 0.07 -1.38 -0.12 0.00 0.02 0.00 0.00 55.97 54.56 2jty s LYS 68 Cb 0.13 -0.23 0.01 0.00 -0.52 0.00 0.00 37.83 37.22 2jty s LYS 68 CO 0.69 -0.04 0.26 0.00 -0.92 0.00 0.00 175.35 175.34 2jty s ALA 69 N -3.62 -0.58 0.33 5.17 0.00 -0.40 -1.64 121.76 121.02 2jty s ALA 69 Ca 0.15 -0.04 0.03 0.00 0.00 0.00 0.00 51.96 52.09 2jty s ALA 69 Cb 0.05 0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.39 2jty s ALA 69 CO -0.03 -0.36 0.12 0.00 0.00 0.00 0.00 175.76 175.49 2jty s ALA 70 N -2.32 2.26 -0.06 0.00 0.00 -0.83 -1.25 121.76 119.57 2jty s ALA 70 Ca -0.07 -1.71 -0.01 0.00 0.00 0.00 0.00 51.96 50.17 2jty s ALA 70 Cb -0.02 0.91 0.03 0.00 0.00 0.00 0.00 23.12 24.04 2jty s ALA 70 CO -0.02 -0.41 -0.01 0.08 0.00 0.00 0.00 175.76 175.41 2jty s VAL 71 N -3.46 0.35 -2.13 0.00 1.01 -1.26 -0.69 120.40 114.22 2jty s VAL 71 Ca 0.33 0.08 0.17 0.00 0.00 0.00 0.00 61.98 62.57 2jty s VAL 71 Cb 0.06 -0.48 0.15 0.00 0.00 0.00 0.00 36.38 36.11 2jty s VAL 71 CO 0.15 0.23 1.07 0.00 0.00 0.00 0.00 175.10 176.55 2jty n ALA 72 N 4.77 2.46 0.00 5.51 0.00 -0.62 -4.20 120.51 128.44 2jty n ALA 72 Ca -0.14 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.64 2jty n ALA 72 Cb 0.50 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.36 2jty n ALA 72 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2jty n PHE 73 N 0.98 -1.54 -3.58 0.00 3.01 -1.26 -2.18 117.46 112.88 2jty n PHE 73 Ca 0.10 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.55 2jty n PHE 73 Cb 0.44 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.85 2jty n PHE 73 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 2jty s LEU 74 N 0.00 -0.60 0.16 4.37 2.96 0.17 -0.10 118.68 125.64 2jty s LEU 74 Ca 0.00 0.92 -0.24 0.00 -0.22 0.00 0.00 54.13 54.59 2jty s LEU 74 Cb 0.00 1.81 0.07 0.00 0.50 0.00 0.00 46.19 48.58 2jty s LEU 74 CO 0.00 -0.14 1.01 -0.83 -1.32 0.00 0.00 176.35 175.07 2jty s GLY 75 N 1.74 -0.10 0.11 7.98 0.00 -1.23 -0.40 107.32 115.41 2jty s GLY 75 Ca -0.07 -0.03 -0.31 0.00 0.00 0.00 0.00 44.72 44.31 2jty s GLY 75 CO -0.16 0.89 1.41 -1.59 0.00 0.00 0.00 173.10 173.65 2jty s THR 76 N -2.79 3.29 -0.03 0.90 2.01 -1.26 -4.96 115.64 112.78 2jty s THR 76 Ca 0.16 0.90 -0.24 0.00 0.31 0.00 0.00 61.69 62.82 2jty s THR 76 Cb -0.01 -3.58 -0.04 0.00 0.01 0.00 0.00 72.50 68.88 2jty s THR 76 CO 0.03 0.06 0.71 0.00 -0.69 0.00 0.00 174.62 174.73 2jty s ALA 77 N 1.29 3.36 0.36 7.40 0.00 -1.26 -0.48 121.76 132.43 2jty s ALA 77 Ca 0.65 0.16 0.08 0.00 0.00 0.00 0.00 51.96 52.86 2jty s ALA 77 Cb -0.37 -2.95 0.68 0.00 0.00 0.00 0.00 23.12 20.49 2jty s ALA 77 CO 0.30 -0.04 1.86 0.97 0.00 0.00 0.00 175.76 178.85 2jty h ILE 78 N 4.55 1.21 -3.51 0.00 2.10 -1.10 -3.38 117.51 117.38 2jty h ILE 78 Ca -0.42 -0.98 -0.05 0.00 1.08 0.00 0.00 64.86 64.49 2jty h ILE 78 Cb 1.20 1.32 -0.11 0.00 -1.09 0.00 0.00 36.82 38.15 2jty h ILE 78 CO 0.74 0.30 -0.09 -0.62 -1.08 0.00 0.00 178.15 177.40 2jty s ASP 79 N -6.87 -0.15 0.27 2.19 2.15 -1.26 -4.89 116.67 108.11 2jty s ASP 79 Ca -0.05 -0.64 -0.00 0.00 0.43 0.00 0.00 52.55 52.29 2jty s ASP 79 Cb 0.15 0.54 0.59 0.00 -0.30 0.00 0.00 42.92 43.89 2jty s ASP 79 CO 0.74 -1.01 1.71 0.00 -0.17 0.00 0.00 175.17 176.45 2jty h ALA 80 N 2.31 1.25 -0.01 3.66 0.00 -2.00 -0.25 119.26 124.23 2jty h ALA 80 Ca -0.29 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2jty h ALA 80 Cb 1.25 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2jty h ALA 80 CO 0.40 -0.26 0.00 0.41 0.00 0.00 0.00 179.25 179.80 2jty n GLY 81 N -1.34 -0.77 2.81 0.00 0.00 -1.26 -3.99 105.19 100.65 2jty n GLY 81 Ca 0.18 -0.24 -0.01 0.00 0.00 0.00 0.00 46.02 45.95 2jty n GLY 81 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2jty n HIS 82 N -0.70 0.91 0.27 1.61 8.25 -0.18 -4.92 115.22 120.46 2jty n HIS 82 Ca 0.21 -2.14 0.13 0.00 -0.26 0.00 0.00 57.72 55.67 2jty n HIS 82 Cb 0.16 -0.06 0.64 0.00 1.12 0.00 0.00 29.99 31.85 2jty n HIS 82 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 2jty h THR 83 N 5.29 0.00 0.00 1.59 1.35 -1.49 -0.23 112.91 119.42 2jty h THR 83 Ca -0.17 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 2jty h THR 83 Cb 1.27 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 2jty h THR 83 CO 0.16 0.00 0.00 0.59 -0.25 0.00 0.00 175.52 176.02 2jty n ASN 84 N -2.42 0.31 -4.06 5.36 4.13 -1.26 -4.33 115.26 112.98 2jty n ASN 84 Ca -0.00 0.56 -0.17 0.00 1.68 0.00 0.00 54.58 56.64 2jty n ASN 84 Cb 0.13 -0.63 -0.14 0.00 -1.54 0.00 0.00 39.78 37.60 2jty n ASN 84 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2jty s VAL 85 N -3.11 0.76 0.15 2.41 1.01 -0.10 -4.41 120.40 117.11 2jty s VAL 85 Ca 0.08 -0.69 -0.29 0.00 0.00 0.00 0.00 61.98 61.07 2jty s VAL 85 Cb 0.12 -0.69 -0.07 0.00 0.00 0.00 0.00 36.38 35.74 2jty s VAL 85 CO 0.40 0.01 0.93 -0.76 0.00 0.00 0.00 175.10 175.68 2jty s LEU 86 N -0.77 4.54 0.00 3.92 2.01 -0.18 -0.84 118.68 127.37 2jty s LEU 86 Ca -0.00 1.81 0.00 0.00 0.01 0.00 0.00 54.13 55.95 2jty s LEU 86 Cb -0.06 -3.55 0.00 0.00 0.01 0.00 0.00 46.19 42.59 2jty s LEU 86 CO 0.00 0.02 0.39 0.00 1.01 0.00 0.00 176.35 177.77 2jty n ALA 87 N 2.35 1.89 -0.41 4.21 0.00 0.37 -3.84 120.51 125.08 2jty n ALA 87 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2jty n ALA 87 Cb 0.49 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.94 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 -0.18 0.00 0.00 0.00 4.77 -1.26 -4.89 117.00 115.43 2jty n LEU 88 Ca 0.00 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 2jty n LEU 88 Cb 0.05 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.09 2jty n LEU 88 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.06 2jty n GLN 89 N 2.92 0.43 -1.71 3.23 10.64 0.28 -4.66 117.38 128.50 2jty n GLN 89 Ca 0.00 -2.54 -0.38 0.00 -1.83 0.00 0.00 57.00 52.25 2jty n GLN 89 Cb 0.00 2.21 0.05 0.00 -0.86 0.00 0.00 30.24 31.65 2jty n GLN 89 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 2jty n SER 90 N -1.85 2.10 -3.36 2.61 7.64 -1.26 -4.41 113.62 115.09 2jty n SER 90 Ca 0.04 0.90 -0.05 0.00 1.01 0.00 0.00 58.87 60.77 2jty n SER 90 Cb 0.49 -1.53 0.01 0.00 -1.01 0.00 0.00 64.21 62.16 2jty n SER 90 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2jty s SER 91 N -1.13 -0.06 0.50 6.43 0.01 -1.26 -4.80 113.70 113.39 2jty s SER 91 Ca 0.76 -0.76 0.33 0.00 1.31 0.00 0.00 55.95 57.60 2jty s SER 91 Cb -0.41 0.63 1.54 0.00 0.21 0.00 0.00 66.02 67.99 2jty s SER 91 CO 0.46 -1.22 1.99 0.00 0.41 0.00 0.00 173.24 174.88 2jty h ALA 92 N 2.00 1.00 -0.01 1.44 0.00 -1.96 0.06 119.26 121.78 2jty h ALA 92 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2jty h ALA 92 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2jty h ALA 92 CO 0.34 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.59 2jty n ALA 93 N -1.99 2.20 -2.14 0.00 0.00 -1.26 -4.97 120.51 112.35 2jty n ALA 93 Ca -0.00 -2.10 -0.09 0.00 0.00 0.00 0.00 53.44 51.25 2jty n ALA 93 Cb 0.20 -0.28 -0.01 0.00 0.00 0.00 0.00 19.45 19.37 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 -1.09 0.03 3.16 0.00 0.00 0.01 -4.82 105.19 102.48 2jty n GLY 94 Ca 0.11 -0.51 0.12 0.00 0.00 0.00 0.00 46.02 45.74 2jty n GLY 94 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jty n SER 95 N 0.27 -6.90 -4.76 1.61 7.64 -1.26 -4.72 113.62 105.50 2jty n SER 95 Ca -0.11 0.94 -0.39 0.00 1.01 0.00 0.00 58.87 60.32 2jty n SER 95 Cb 0.57 -2.63 0.01 0.00 -1.01 0.00 0.00 64.21 61.16 2jty n SER 95 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jty s ALA 96 N -2.02 3.10 0.55 -0.43 0.00 -0.08 -4.64 121.76 118.24 2jty s ALA 96 Ca 0.00 1.31 -0.00 0.00 0.00 0.00 0.00 51.96 53.26 2jty s ALA 96 Cb 0.00 -3.53 0.03 0.00 0.00 0.00 0.00 23.12 19.62 2jty s ALA 96 CO 0.00 -1.08 0.79 0.95 0.00 0.00 0.00 175.76 176.42 2jty s THR 97 N -1.28 2.92 -1.55 0.00 -4.23 -1.26 -4.55 115.64 105.68 2jty s THR 97 Ca 0.63 -0.55 0.00 0.00 -1.18 0.00 0.00 61.69 60.59 2jty s THR 97 Cb -0.40 -3.11 0.00 0.00 1.34 0.00 0.00 72.50 70.33 2jty s THR 97 CO 0.49 -0.09 0.00 0.59 -0.54 0.00 0.00 174.62 175.08 2jty n ASN 98 N -2.38 -4.43 -3.81 3.99 3.02 -1.26 -2.82 115.26 107.57 2jty n ASN 98 Ca 0.07 0.36 -0.12 0.00 -0.03 0.00 0.00 54.58 54.85 2jty n ASN 98 Cb 0.59 -3.84 -0.11 0.00 -0.61 0.00 0.00 39.78 35.81 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 -2.21 0.02 0.15 2.41 0.11 -1.26 -0.61 120.40 119.01 2jty s VAL 99 Ca 0.00 -0.18 -0.06 0.00 -2.93 0.00 0.00 61.98 58.81 2jty s VAL 99 Cb 0.00 -0.37 -0.02 0.00 -1.53 0.00 0.00 36.38 34.45 2jty s VAL 99 CO 0.00 -0.10 0.19 -0.83 -3.33 0.00 0.00 175.10 171.03 2jty s GLY 100 N -0.32 0.70 0.53 6.54 0.00 -0.51 -4.77 107.32 109.50 2jty s GLY 100 Ca -0.04 -1.14 -0.20 0.00 0.00 0.00 0.00 44.72 43.35 2jty s GLY 100 CO 0.01 -1.06 1.11 -1.34 0.00 0.00 0.00 173.10 171.82 2jty s VAL 101 N -4.00 3.29 0.07 1.40 -7.23 -1.25 -0.05 120.40 112.63 2jty s VAL 101 Ca 0.20 0.80 0.07 0.00 -1.81 0.00 0.00 61.98 61.25 2jty s VAL 101 Cb 0.05 -3.32 -0.03 0.00 0.56 0.00 0.00 36.38 33.64 2jty s VAL 101 CO 0.01 -0.18 -0.20 -1.58 -0.31 0.00 0.00 175.10 172.84 2jty s GLN 102 N -3.28 1.22 0.00 4.82 0.74 0.20 -1.01 119.66 122.36 2jty s GLN 102 Ca 0.72 -1.00 0.08 0.00 0.05 0.00 0.00 55.36 55.20 2jty s GLN 102 Cb -0.22 -1.38 -0.02 0.00 1.10 0.00 0.00 33.01 32.48 2jty s GLN 102 CO 0.26 0.34 -0.24 0.42 -0.55 0.00 0.00 175.29 175.51 2jty s ILE 103 N -0.95 2.26 0.03 -2.34 1.09 -1.26 -1.37 121.20 118.65 2jty s ILE 103 Ca 0.06 -1.16 0.01 0.00 -1.10 0.00 0.00 60.65 58.46 2jty s ILE 103 Cb -0.09 -1.84 -0.02 0.00 -1.06 0.00 0.00 42.46 39.45 2jty s ILE 103 CO 0.03 0.49 -0.06 -0.76 -0.10 0.00 0.00 174.94 174.54 2jty s LEU 104 N -0.90 2.23 0.00 2.97 1.43 0.70 -0.54 118.68 124.57 2jty s LEU 104 Ca 0.11 -0.49 -0.04 0.00 -1.03 0.00 0.00 54.13 52.68 2jty s LEU 104 Cb -0.10 -0.08 0.06 0.00 0.03 0.00 0.00 46.19 46.10 2jty s LEU 104 CO 0.01 -0.21 0.26 -0.90 0.23 0.00 0.00 176.35 175.74 2jty n ASP 105 N 1.65 -0.85 -0.23 2.29 5.75 -0.63 -1.04 116.55 123.48 2jty n ASP 105 Ca -0.22 -0.79 0.03 0.00 -0.01 0.00 0.00 54.79 53.79 2jty n ASP 105 Cb 0.55 -0.23 0.12 0.00 -1.03 0.00 0.00 41.12 40.53 2jty n ASP 105 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 2jty h ARG 106 N 0.00 0.08 0.00 0.11 9.65 -1.89 -2.37 114.38 119.96 2jty h ARG 106 Ca -0.09 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.78 2jty h ARG 106 Cb 0.28 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.84 2jty h ARG 106 CO 0.06 0.06 -0.09 0.25 2.80 0.00 0.00 179.97 183.05 2jty n THR 107 N -5.34 0.51 -0.83 0.20 -2.24 -1.26 -4.91 114.28 100.40 2jty n THR 107 Ca 0.11 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2jty n THR 107 Cb 0.41 -0.50 0.00 0.00 -2.10 0.00 0.00 70.33 68.13 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 1.33 0.69 3.73 3.38 0.00 -0.89 -5.07 105.19 108.35 2jty n GLY 108 Ca 0.05 -0.68 -0.41 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.00 3.36 0.65 4.61 0.00 -1.26 -4.86 121.76 122.26 2jty s ALA 109 Ca 0.00 0.80 -0.17 0.00 0.00 0.00 0.00 51.96 52.59 2jty s ALA 109 Cb 0.00 -3.38 -0.00 0.00 0.00 0.00 0.00 23.12 19.74 2jty s ALA 109 CO 0.00 -0.28 1.20 0.00 0.00 0.00 0.00 175.76 176.68 2jty s ALA 110 N 0.28 2.38 0.15 0.00 0.00 -1.26 -1.61 121.76 121.69 2jty s ALA 110 Ca 0.52 0.93 0.10 0.00 0.00 0.00 0.00 51.96 53.51 2jty s ALA 110 Cb -0.29 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 19.34 2jty s ALA 110 CO 0.32 -1.45 -0.19 -0.51 0.00 0.00 0.00 175.76 173.93 2jty s LEU 111 N -4.55 2.65 0.72 0.00 1.43 0.30 -4.83 118.68 114.40 2jty s LEU 111 Ca 0.76 -0.65 -0.11 0.00 -1.03 0.00 0.00 54.13 53.09 2jty s LEU 111 Cb -0.29 -1.45 0.02 0.00 0.03 0.00 0.00 46.19 44.50 2jty s LEU 111 CO 0.39 0.15 1.09 -0.89 0.23 0.00 0.00 176.35 177.32 2jty s THR 112 N -1.34 3.52 -0.57 5.49 2.01 -1.26 -4.61 115.64 118.88 2jty s THR 112 Ca 0.19 0.50 0.06 0.00 0.31 0.00 0.00 61.69 62.75 2jty s THR 112 Cb -0.10 -3.42 0.26 0.00 0.01 0.00 0.00 72.50 69.25 2jty s THR 112 CO 0.10 -0.65 0.72 0.18 -0.69 0.00 0.00 174.62 174.29 2jty n LEU 113 N -3.08 3.03 -0.19 4.42 4.77 -1.23 -4.12 117.00 120.59 2jty n LEU 113 Ca 0.07 -5.31 0.08 0.00 -0.03 0.00 0.00 56.01 50.82 2jty n LEU 113 Cb 0.57 -0.35 -0.05 0.00 -2.33 0.00 0.00 43.42 41.26 2jty n LEU 113 CO 0.57 2.10 0.11 -0.67 -1.33 0.00 0.00 177.39 178.18 2jty n ASP 114 N 0.83 1.21 -1.71 -1.43 -0.08 -0.93 -3.55 116.55 110.89 2jty n ASP 114 Ca 0.28 -1.11 -0.14 0.00 -1.51 0.00 0.00 54.79 52.31 2jty n ASP 114 Cb 0.44 0.73 0.00 0.00 2.34 0.00 0.00 41.12 44.64 2jty n ASP 114 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2jty n GLY 115 N 1.28 -0.18 2.14 0.27 0.00 0.86 -4.69 105.19 104.87 2jty n GLY 115 Ca 0.05 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.01 0.16 -1.52 4.61 0.00 -1.26 -5.00 120.51 115.49 2jty n ALA 116 Ca -0.14 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.91 2jty n ALA 116 Cb 0.61 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.97 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 -3.10 -0.04 -1.34 0.00 -1.04 -1.26 -4.81 114.28 102.69 2jty n THR 117 Ca 0.00 -0.39 -0.29 0.00 -2.04 0.00 0.00 64.05 61.33 2jty n THR 117 Cb 0.00 -1.62 0.17 0.00 -1.82 0.00 0.00 70.33 67.07 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 10.58 1.94 0.00 -1.42 -0.71 -1.26 -4.20 117.98 122.91 2jty s PHE 118 Ca 1.18 0.80 0.00 0.00 -1.04 0.00 0.00 56.93 57.87 2jty s PHE 118 Cb -0.73 -3.40 0.00 0.00 -1.21 0.00 0.00 43.02 37.68 2jty s PHE 118 CO 0.38 -2.87 0.00 -1.13 -1.34 0.00 0.00 175.22 170.26 2jty n SER 119 N -4.11 0.00 -4.68 1.98 3.41 -1.26 -4.93 113.62 104.02 2jty n SER 119 Ca 0.08 0.00 -0.44 0.00 -0.26 0.00 0.00 58.87 58.25 2jty n SER 119 Cb 0.59 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.50 2jty n SER 119 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2jty n SER 120 N 0.00 3.83 -4.57 4.04 2.88 -1.26 -4.85 113.62 113.70 2jty n SER 120 Ca 0.00 0.99 -0.43 0.00 -1.33 0.00 0.00 58.87 58.10 2jty n SER 120 Cb 0.00 -1.50 -0.04 0.00 -0.75 0.00 0.00 64.21 61.92 2jty n SER 120 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2jty s GLU 121 N 2.84 3.55 -0.18 -1.46 2.02 -1.26 -4.21 118.70 120.00 2jty s GLU 121 Ca 0.84 0.18 -0.29 0.00 0.02 0.00 0.00 54.97 55.71 2jty s GLU 121 Cb -0.54 -3.91 -0.00 0.00 0.10 0.00 0.00 34.13 29.78 2jty s GLU 121 CO 0.40 -1.18 1.06 0.99 0.02 0.00 0.00 175.26 176.55 2jty s THR 122 N 3.68 4.65 -0.28 3.63 2.01 -0.38 -4.91 115.64 124.04 2jty s THR 122 Ca 0.36 1.97 -0.28 0.00 0.31 0.00 0.00 61.69 64.05 2jty s THR 122 Cb -0.10 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.11 2jty s THR 122 CO 0.25 -0.11 1.86 -0.89 -0.69 0.00 0.00 174.62 175.04 2jty s THR 123 N 2.83 3.40 1.09 -0.82 2.01 -1.26 -1.27 115.64 121.62 2jty s THR 123 Ca 0.47 0.42 -0.18 0.00 0.31 0.00 0.00 61.69 62.70 2jty s THR 123 Cb -0.17 -3.50 0.26 0.00 0.01 0.00 0.00 72.50 69.10 2jty s THR 123 CO 0.11 -0.30 1.14 0.18 -0.69 0.00 0.00 174.62 175.06 2jty n LEU 124 N 10.18 0.00 -3.86 4.42 4.77 0.73 -4.96 117.00 128.27 2jty n LEU 124 Ca 0.24 -1.22 -0.09 0.00 -0.03 0.00 0.00 56.01 54.90 2jty n LEU 124 Cb 0.46 -0.97 -0.05 0.00 -2.33 0.00 0.00 43.42 40.53 2jty n LEU 124 CO 0.67 -1.85 0.16 0.54 -1.33 0.00 0.00 177.39 175.58 2jty s ASN 125 N -4.84 -0.13 0.34 -1.43 4.22 -1.26 -4.85 114.94 107.00 2jty s ASN 125 Ca 0.70 -0.69 -0.29 0.00 -2.14 0.00 0.00 52.86 50.44 2jty s ASN 125 Cb -0.05 0.53 -0.11 0.00 1.28 0.00 0.00 41.25 42.90 2jty s ASN 125 CO 0.52 -1.02 1.51 0.59 -2.04 0.00 0.00 177.10 176.67 2jty n ASN 126 N -0.30 3.74 0.00 3.54 4.13 -1.26 -4.44 115.26 120.67 2jty n ASN 126 Ca -0.08 1.20 0.00 0.00 1.68 0.00 0.00 54.58 57.38 2jty n ASN 126 Cb 0.62 -1.60 0.00 0.00 -1.54 0.00 0.00 39.78 37.26 2jty n ASN 126 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2jty n GLY 127 N 1.12 0.68 3.59 7.41 0.00 -1.12 -4.92 105.19 111.95 2jty n GLY 127 Ca 0.04 -1.25 -0.31 0.00 0.00 0.00 0.00 46.02 44.50 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 3.56 0.28 2.61 2.01 -1.26 -0.19 115.64 122.65 2jty s THR 128 Ca 0.00 -0.95 -0.02 0.00 0.31 0.00 0.00 61.69 61.03 2jty s THR 128 Cb 0.00 -2.59 -0.02 0.00 0.01 0.00 0.00 72.50 69.90 2jty s THR 128 CO 0.00 0.29 0.34 0.20 -0.69 0.00 0.00 174.62 174.76 2jty s ASN 129 N -1.72 0.62 -0.07 3.53 0.01 -0.14 -4.85 114.94 112.32 2jty s ASN 129 Ca 0.19 -1.39 -0.25 0.00 -0.71 0.00 0.00 52.86 50.69 2jty s ASN 129 Cb -0.11 0.54 0.06 0.00 0.41 0.00 0.00 41.25 42.15 2jty s ASN 129 CO 0.10 -1.09 0.58 -0.89 -1.51 0.00 0.00 177.10 174.30 2jty s THR 130 N -3.65 0.01 -0.31 1.60 2.01 -1.26 -1.37 115.64 112.68 2jty s THR 130 Ca 0.33 -0.11 -0.06 0.00 0.31 0.00 0.00 61.69 62.16 2jty s THR 130 Cb 0.02 -0.88 0.03 0.00 0.01 0.00 0.00 72.50 71.68 2jty s THR 130 CO 0.17 -0.06 0.07 -0.63 -0.69 0.00 0.00 174.62 173.48 2jty s ILE 131 N -0.95 3.70 0.21 1.82 1.01 -1.15 -4.89 121.20 120.94 2jty s ILE 131 Ca -0.10 -0.95 -0.30 0.00 0.00 0.00 0.00 60.65 59.30 2jty s ILE 131 Cb -0.02 -2.99 -0.08 0.00 0.01 0.00 0.00 42.46 39.38 2jty s ILE 131 CO 0.07 -0.02 1.08 -2.16 0.00 0.00 0.00 174.94 173.91 2jty s PRO 132 N 1.42 4.63 0.37 2.79 0.04 -1.26 -1.10 135.00 141.89 2jty s PRO 132 Ca 0.00 1.71 0.04 0.00 0.04 0.00 0.00 61.00 62.79 2jty s PRO 132 Cb -0.18 -3.26 -0.05 0.00 0.04 0.00 0.00 34.50 31.05 2jty s PRO 132 CO 0.02 0.15 0.07 -0.06 0.04 0.00 0.00 177.00 177.22 2jty s PHE 133 N -0.54 1.95 0.02 0.56 0.08 0.57 -3.12 117.98 117.51 2jty s PHE 133 Ca 0.47 -1.02 0.05 0.00 0.12 0.00 0.00 56.93 56.56 2jty s PHE 133 Cb -0.29 -1.31 -0.02 0.00 -0.57 0.00 0.00 43.02 40.82 2jty s PHE 133 CO 0.36 -0.02 -0.15 -0.65 -0.10 0.00 0.00 175.22 174.66 2jty s GLN 134 N -3.84 1.08 -0.02 0.44 -0.21 -0.21 -1.71 119.66 115.19 2jty s GLN 134 Ca 0.31 -0.70 0.05 0.00 0.02 0.00 0.00 55.36 55.04 2jty s GLN 134 Cb 0.07 -1.09 -0.01 0.00 1.00 0.00 0.00 33.01 32.98 2jty s GLN 134 CO 0.14 0.28 -0.17 0.00 -2.12 0.00 0.00 175.29 173.43 2jty s ALA 135 N -0.67 1.42 0.15 6.09 0.00 0.06 -0.22 121.76 128.59 2jty s ALA 135 Ca 0.04 -0.72 -0.23 0.00 0.00 0.00 0.00 51.96 51.05 2jty s ALA 135 Cb -0.07 -0.39 0.07 0.00 0.00 0.00 0.00 23.12 22.73 2jty s ALA 135 CO 0.01 0.33 0.61 -0.98 0.00 0.00 0.00 175.76 175.73 2jty s ARG 136 N -0.31 1.26 -0.01 0.00 1.70 -0.47 -1.96 118.95 119.15 2jty s ARG 136 Ca 0.05 -0.46 -0.30 0.00 -0.47 0.00 0.00 55.73 54.55 2jty s ARG 136 Cb -0.07 0.58 -0.05 0.00 -0.57 0.00 0.00 34.95 34.84 2jty s ARG 136 CO -0.00 -0.55 1.26 0.71 -1.08 0.00 0.00 175.30 175.64 2jty s TYR 137 N -3.70 3.14 -0.22 5.89 2.02 -1.26 0.59 117.35 123.81 2jty s TYR 137 Ca 0.01 1.11 -0.04 0.00 -0.37 0.00 0.00 57.07 57.78 2jty s TYR 137 Cb -0.01 -3.50 -0.01 0.00 -0.40 0.00 0.00 41.96 38.04 2jty s TYR 137 CO -0.13 -1.67 -0.04 0.12 -1.57 0.00 0.00 175.55 172.26 2jty s PHE 138 N 2.01 2.96 0.13 2.71 2.19 0.93 -1.41 117.98 127.51 2jty s PHE 138 Ca 0.59 -0.87 -0.26 0.00 0.33 0.00 0.00 56.93 56.72 2jty s PHE 138 Cb -0.28 -2.10 -0.07 0.00 -1.31 0.00 0.00 43.02 39.26 2jty s PHE 138 CO 0.25 -0.50 0.82 0.00 1.83 0.00 0.00 175.22 177.61 2jty s ALA 139 N 1.40 3.39 -2.26 11.12 0.00 0.34 -1.42 121.76 134.32 2jty s ALA 139 Ca 0.05 0.40 0.21 0.00 0.00 0.00 0.00 51.96 52.62 2jty s ALA 139 Cb -0.14 -3.04 0.53 0.00 0.00 0.00 0.00 23.12 20.46 2jty s ALA 139 CO -0.02 0.18 1.45 0.25 0.00 0.00 0.00 175.76 177.62 2jty n THR 140 N 2.07 0.59 -2.13 0.00 -2.24 0.22 -0.89 114.28 111.91 2jty n THR 140 Ca -0.03 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 2jty n THR 140 Cb 0.49 0.67 0.00 0.00 -2.10 0.00 0.00 70.33 69.39 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 1.45 -0.55 3.56 3.38 0.00 -1.21 -4.06 105.19 107.76 2jty n GLY 141 Ca 0.20 -0.80 -0.28 0.00 0.00 0.00 0.00 46.02 45.14 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 1.68 0.89 4.61 0.00 -1.21 -2.10 121.76 124.63 2jty s ALA 142 Ca 0.00 -1.30 -0.12 0.00 0.00 0.00 0.00 51.96 50.54 2jty s ALA 142 Cb 0.00 -4.51 0.08 0.00 0.00 0.00 0.00 23.12 18.69 2jty s ALA 142 CO 0.00 -4.73 0.89 0.00 0.00 0.00 0.00 175.76 171.92 2jty n ALA 143 N 14.09 -1.23 -2.56 0.00 0.00 -0.09 -4.74 120.51 125.98 2jty n ALA 143 Ca 0.37 -0.49 -0.24 0.00 0.00 0.00 0.00 53.44 53.07 2jty n ALA 143 Cb 0.48 -2.06 -0.09 0.00 0.00 0.00 0.00 19.45 17.78 2jty n ALA 143 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2jty s THR 144 N -2.38 3.04 0.69 0.00 -4.23 -1.13 -4.89 115.64 106.73 2jty s THR 144 Ca 0.65 -2.01 -0.11 0.00 -1.18 0.00 0.00 61.69 59.05 2jty s THR 144 Cb -0.25 -2.58 0.01 0.00 1.34 0.00 0.00 72.50 71.03 2jty s THR 144 CO 0.59 -0.31 1.07 -2.16 -0.54 0.00 0.00 174.62 173.27 2jty s PRO 145 N -3.37 2.87 0.00 3.99 0.04 -1.26 -4.45 135.00 132.82 2jty s PRO 145 Ca 0.29 0.39 0.00 0.00 0.04 0.00 0.00 61.00 61.72 2jty s PRO 145 Cb -0.07 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.41 2jty s PRO 145 CO 0.17 -0.99 0.00 0.41 0.04 0.00 0.00 177.00 176.63 2jty n GLY 146 N -2.94 -1.37 3.36 0.56 0.00 -0.37 -4.48 105.19 99.94 2jty n GLY 146 Ca 0.07 0.47 -0.14 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 -1.15 -0.41 4.61 0.00 -1.26 -4.67 121.76 117.88 2jty s ALA 147 Ca 0.00 1.09 0.03 0.00 0.00 0.00 0.00 51.96 53.08 2jty s ALA 147 Cb 0.00 -0.48 0.16 0.00 0.00 0.00 0.00 23.12 22.80 2jty s ALA 147 CO 0.00 -0.25 0.30 0.00 0.00 0.00 0.00 175.76 175.81 2jty s ALA 148 N -0.30 1.44 0.14 0.00 0.00 0.16 -0.90 121.76 122.30 2jty s ALA 148 Ca -0.05 -2.35 0.07 0.00 0.00 0.00 0.00 51.96 49.64 2jty s ALA 148 Cb -0.03 -1.65 -0.04 0.00 0.00 0.00 0.00 23.12 21.39 2jty s ALA 148 CO 0.03 -2.03 -0.17 -0.80 0.00 0.00 0.00 175.76 172.79 2jty s ASN 149 N 0.33 2.38 0.32 0.00 0.01 -1.26 -2.62 114.94 114.11 2jty s ASN 149 Ca 0.26 -0.82 -0.09 0.00 -0.71 0.00 0.00 52.86 51.50 2jty s ASN 149 Cb -0.08 -0.12 0.04 0.00 0.41 0.00 0.00 41.25 41.50 2jty s ASN 149 CO -0.11 -0.07 0.58 0.00 -1.51 0.00 0.00 177.10 175.99 2jty n ALA 150 N 0.48 -1.09 -3.35 0.60 0.00 0.10 -0.56 120.51 116.70 2jty n ALA 150 Ca -0.15 -1.16 -0.09 0.00 0.00 0.00 0.00 53.44 52.04 2jty n ALA 150 Cb 0.57 0.93 -0.08 0.00 0.00 0.00 0.00 19.45 20.87 2jty n ALA 150 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2jty s ASP 151 N -2.76 0.22 0.32 0.00 -4.77 -1.26 -3.19 116.67 105.22 2jty s ASP 151 Ca 0.17 0.25 0.07 0.00 -3.30 0.00 0.00 52.55 49.74 2jty s ASP 151 Cb -0.03 1.13 -0.02 0.00 -1.09 0.00 0.00 42.92 42.90 2jty s ASP 151 CO 0.12 -0.30 0.33 0.00 0.70 0.00 0.00 175.17 176.02 2jty s ALA 152 N 2.55 3.91 0.14 2.11 0.00 -0.43 -4.47 121.76 125.57 2jty s ALA 152 Ca 0.13 -1.54 0.06 0.00 0.00 0.00 0.00 51.96 50.60 2jty s ALA 152 Cb -0.15 -1.36 -0.04 0.00 0.00 0.00 0.00 23.12 21.57 2jty s ALA 152 CO -0.16 0.05 0.02 0.95 0.00 0.00 0.00 175.76 176.63 2jty s THR 153 N -2.22 3.99 -0.30 0.00 -4.23 0.46 -0.33 115.64 113.01 2jty s THR 153 Ca 0.40 -1.17 -0.10 0.00 -1.18 0.00 0.00 61.69 59.63 2jty s THR 153 Cb -0.07 -2.97 -0.02 0.00 1.34 0.00 0.00 72.50 70.78 2jty s THR 153 CO 0.28 -0.01 0.17 0.72 -0.54 0.00 0.00 174.62 175.24 2jty s PHE 154 N -1.55 3.19 0.28 3.99 -0.12 0.52 -0.66 117.98 123.63 2jty s PHE 154 Ca 0.27 -0.32 -0.04 0.00 -0.05 0.00 0.00 56.93 56.79 2jty s PHE 154 Cb -0.10 -2.37 -0.05 0.00 -0.63 0.00 0.00 43.02 39.86 2jty s PHE 154 CO 0.19 -0.36 0.54 0.15 -0.05 0.00 0.00 175.22 175.70 2jty s LYS 155 N 1.67 3.62 -0.13 1.99 1.02 -1.26 -0.67 119.74 125.98 2jty s LYS 155 Ca 0.06 -0.03 0.02 0.00 0.02 0.00 0.00 55.97 56.04 2jty s LYS 155 Cb -0.17 -2.66 0.00 0.00 -0.52 0.00 0.00 37.83 34.48 2jty s LYS 155 CO 0.08 0.23 -0.21 0.08 -0.92 0.00 0.00 175.35 174.61 2jty s VAL 156 N -2.07 2.20 -0.79 3.17 1.01 0.50 -1.58 120.40 122.85 2jty s VAL 156 Ca 0.43 -0.94 -0.11 0.00 0.00 0.00 0.00 61.98 61.37 2jty s VAL 156 Cb -0.11 -1.88 0.21 0.00 0.00 0.00 0.00 36.38 34.60 2jty s VAL 156 CO 0.30 0.55 0.69 -1.58 0.00 0.00 0.00 175.10 175.06 2jty s GLN 157 N 0.66 3.35 0.30 2.72 0.74 0.14 -0.81 119.66 126.75 2jty s GLN 157 Ca -0.10 -2.53 -0.29 0.00 0.05 0.00 0.00 55.36 52.48 2jty s GLN 157 Cb -0.16 -4.24 -0.10 0.00 1.10 0.00 0.00 33.01 29.61 2jty s GLN 157 CO 0.02 -1.26 1.23 0.71 -0.55 0.00 0.00 175.29 175.44 2jty s TYR 158 N 0.00 3.26 0.27 1.67 2.02 -0.67 -1.96 117.35 121.94 2jty s TYR 158 Ca 0.18 1.51 -0.16 0.00 -0.37 0.00 0.00 57.07 58.23 2jty s TYR 158 Cb -0.13 -3.53 0.01 0.00 -0.40 0.00 0.00 41.96 37.91 2jty s TYR 158 CO -0.07 -1.38 0.58 1.14 -1.57 0.00 0.00 175.55 174.24 2jty s GLN 159 N -1.55 1.68 0.00 -0.62 -2.07 -0.65 -1.25 119.66 115.20 2jty s GLN 159 Ca 0.48 -1.18 0.00 0.00 -1.82 0.00 0.00 55.36 52.84 2jty s GLN 159 Cb -0.37 0.53 0.00 0.00 -1.09 0.00 0.00 33.01 32.08 2jty s GLN 159 CO 0.48 -0.73 0.00 0.41 -1.32 0.00 0.00 175.29 174.13 2jty n GLY 160 N -0.42 4.10 3.54 2.60 0.00 -1.26 -0.48 105.19 113.26 2jty n GLY 160 Ca -0.03 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 44.96 2jty n GLY 160 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jty s GLY 161 N 0.00 1.54 0.00 -0.02 0.00 -1.26 -4.82 107.32 102.76 2jty s GLY 161 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 44.72 43.96 2jty s GLY 161 CO 0.00 0.09 0.00 0.61 0.00 0.00 0.00 173.10 173.80 2jty n GLY 162 N -0.35 5.46 7.00 0.20 0.00 -1.26 -4.62 105.19 111.63 2jty n GLY 162 Ca 0.11 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.78 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 0.83 1.25 1.56 -0.02 0.00 -1.26 -4.28 105.19 103.28 2jty n GLY 163 Ca 0.00 0.25 0.03 0.00 0.00 0.00 0.00 46.02 46.30 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 1.71 0.00 -0.02 0.00 -1.26 -4.91 105.19 100.71 2jty n GLY 164 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.05 2jty n GLY 164 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jty n GLY 165 N 0.14 0.75 1.19 -0.02 0.00 -1.26 -5.16 105.19 100.82 2jty n GLY 165 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2jty n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jty n ALA 166 N -3.00 -2.52 -2.85 4.61 0.00 -1.26 -4.97 120.51 110.52 2jty n ALA 166 Ca 0.00 0.24 -0.04 0.00 0.00 0.00 0.00 53.44 53.64 2jty n ALA 166 Cb 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2jty n ALA 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jty n ALA 167 N 0.71 -2.74 -2.36 0.00 0.00 -1.24 -4.95 120.51 109.92 2jty n ALA 167 Ca 0.00 0.59 -0.40 0.00 0.00 0.00 0.00 53.44 53.63 2jty n ALA 167 Cb 0.00 -2.54 -0.03 0.00 0.00 0.00 0.00 19.45 16.88 2jty n ALA 167 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2jty s THR 168 N -2.73 3.60 0.31 0.00 2.01 -0.38 -4.92 115.64 113.53 2jty s THR 168 Ca 0.12 0.24 -0.29 0.00 0.31 0.00 0.00 61.69 62.08 2jty s THR 168 Cb -0.03 -4.57 -0.10 0.00 0.01 0.00 0.00 72.50 67.81 2jty s THR 168 CO 0.71 -1.51 1.36 -0.89 -0.69 0.00 0.00 174.62 173.59 2jty s THR 169 N 6.98 2.67 -0.09 -0.82 2.01 -1.26 -1.66 115.64 123.47 2jty s THR 169 Ca 0.48 0.63 -0.07 0.00 0.31 0.00 0.00 61.69 63.04 2jty s THR 169 Cb -0.09 -3.40 0.03 0.00 0.01 0.00 0.00 72.50 69.04 2jty s THR 169 CO 0.15 0.14 0.22 0.68 -0.69 0.00 0.00 174.62 175.11 2jty s VAL 170 N -0.77 -0.01 -0.00 3.82 -7.23 0.01 -4.98 120.40 111.24 2jty s VAL 170 Ca 0.52 0.04 -0.32 0.00 -1.81 0.00 0.00 61.98 60.41 2jty s VAL 170 Cb -0.41 -0.32 -0.11 0.00 0.56 0.00 0.00 36.38 36.10 2jty s VAL 170 CO 0.50 0.02 1.88 0.59 -0.31 0.00 0.00 175.10 177.78 2jty n ASN 171 N 3.31 3.73 0.00 4.85 4.13 -1.26 -0.37 115.26 129.65 2jty n ASN 171 Ca -0.16 0.96 0.00 0.00 1.68 0.00 0.00 54.58 57.06 2jty n ASN 171 Cb 0.57 -1.45 0.00 0.00 -1.54 0.00 0.00 39.78 37.36 2jty n ASN 171 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2jty n GLY 172 N 4.35 0.90 2.47 7.41 0.00 0.15 -4.86 105.19 115.61 2jty n GLY 172 Ca 0.21 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.11 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 2.84 2.55 3.86 -0.02 0.00 -1.03 -4.99 105.19 108.41 2jty n GLY 173 Ca 0.00 -1.61 -0.35 0.00 0.00 0.00 0.00 46.02 44.06 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 -2.77 5.08 -0.12 2.61 2.01 0.94 -0.35 115.64 123.02 2jty s THR 174 Ca 0.23 0.51 0.02 0.00 0.31 0.00 0.00 61.69 62.76 2jty s THR 174 Cb -0.00 -3.66 0.01 0.00 0.01 0.00 0.00 72.50 68.87 2jty s THR 174 CO 0.17 0.32 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.55 2jty s VAL 175 N -1.37 1.70 -0.44 3.82 1.01 0.55 -2.55 120.40 123.12 2jty s VAL 175 Ca 0.32 -0.75 -0.05 0.00 0.00 0.00 0.00 61.98 61.50 2jty s VAL 175 Cb -0.14 -1.53 0.12 0.00 0.00 0.00 0.00 36.38 34.82 2jty s VAL 175 CO 0.18 0.48 0.27 -1.00 0.00 0.00 0.00 175.10 175.02 2jty s HIS 176 N 0.99 3.53 -0.55 5.22 0.09 0.08 -1.31 115.29 123.35 2jty s HIS 176 Ca -0.05 -2.25 -0.28 0.00 -0.00 0.00 0.00 55.06 52.47 2jty s HIS 176 Cb -0.15 -3.32 0.03 0.00 -0.00 0.00 0.00 32.58 29.14 2jty s HIS 176 CO -0.03 -0.97 1.22 -0.06 -0.00 0.00 0.00 174.74 174.89 2jty s PHE 177 N 1.15 2.61 0.23 1.40 0.08 -1.19 -1.89 117.98 120.36 2jty s PHE 177 Ca 0.08 0.50 0.09 0.00 0.12 0.00 0.00 56.93 57.72 2jty s PHE 177 Cb -0.24 -4.48 -0.04 0.00 -0.57 0.00 0.00 43.02 37.69 2jty s PHE 177 CO -0.03 -1.58 -0.02 0.15 -0.10 0.00 0.00 175.22 173.64 2jty s LYS 178 N 4.90 2.29 0.00 0.44 -0.14 -1.17 0.03 119.74 126.09 2jty s LYS 178 Ca 0.46 -1.31 0.00 0.00 -1.36 0.00 0.00 55.97 53.76 2jty s LYS 178 Cb -0.08 -2.21 0.00 0.00 -1.68 0.00 0.00 37.83 33.86 2jty s LYS 178 CO 0.27 0.40 0.00 0.41 -0.76 0.00 0.00 175.35 175.67 2jty n GLY 179 N -0.56 0.64 3.82 -3.33 0.00 -1.08 -0.54 105.19 104.14 2jty n GLY 179 Ca -0.08 -1.74 -0.04 0.00 0.00 0.00 0.00 46.02 44.16 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 1.44 -0.02 1.61 2.12 -0.42 -0.67 118.70 120.77 2jty s GLU 180 Ca 0.00 -0.87 0.04 0.00 0.36 0.00 0.00 54.97 54.50 2jty s GLU 180 Cb 0.00 0.44 -0.01 0.00 0.26 0.00 0.00 34.13 34.83 2jty s GLU 180 CO 0.00 -0.67 -0.13 0.08 -0.54 0.00 0.00 175.26 174.00 2jty s VAL 181 N -2.80 1.05 0.15 3.70 1.01 -1.26 -1.64 120.40 120.60 2jty s VAL 181 Ca 0.16 -0.54 0.11 0.00 0.00 0.00 0.00 61.98 61.71 2jty s VAL 181 Cb -0.03 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.42 2jty s VAL 181 CO 0.05 0.30 -0.26 0.68 0.00 0.00 0.00 175.10 175.87 2jty s VAL 182 N -0.12 2.29 -0.39 2.92 -7.23 0.10 -1.24 120.40 116.73 2jty s VAL 182 Ca 0.02 -1.83 0.00 0.00 -1.81 0.00 0.00 61.98 58.35 2jty s VAL 182 Cb -0.07 -2.04 0.00 0.00 0.56 0.00 0.00 36.38 34.83 2jty s VAL 182 CO 0.00 0.03 0.59 -3.20 -0.31 0.00 0.00 175.10 172.22 2jty n ASN 183 N 0.74 1.63 0.00 4.85 4.05 -1.26 -0.94 115.26 124.32 2jty n ASN 183 Ca -0.17 -1.47 0.00 0.00 0.45 0.00 0.00 54.58 53.39 2jty n ASN 183 Cb 0.54 -0.37 0.00 0.00 1.23 0.00 0.00 39.78 41.18 2jty n ASN 183 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21