#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 -2.37 -2.93 0.00 0.00 -1.26 -5.02 120.51 108.93 2jty n ALA 2 Ca 0.00 -0.29 -0.10 0.00 0.00 0.00 0.00 53.44 53.06 2jty n ALA 2 Cb 0.00 -3.06 -0.10 0.00 0.00 0.00 0.00 19.45 16.29 2jty n ALA 2 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2jty s THR 3 N -3.64 0.11 0.80 0.00 -4.23 -1.26 -5.16 115.64 102.27 2jty s THR 3 Ca 0.31 -0.91 -0.14 0.00 -1.18 0.00 0.00 61.69 59.77 2jty s THR 3 Cb -0.12 -0.52 0.07 0.00 1.34 0.00 0.00 72.50 73.27 2jty s THR 3 CO 0.88 -0.50 1.09 0.41 -0.54 0.00 0.00 174.62 175.96 2jty n THR 4 N 1.30 1.98 -3.96 3.99 -1.04 -1.26 -5.07 114.28 110.22 2jty n THR 4 Ca -0.22 -0.23 -0.10 0.00 -2.04 0.00 0.00 64.05 61.46 2jty n THR 4 Cb 0.56 -1.13 -0.06 0.00 -1.82 0.00 0.00 70.33 67.88 2jty n THR 4 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2jty s VAL 5 N -2.10 0.04 0.35 12.58 0.11 -1.26 -5.06 120.40 125.05 2jty s VAL 5 Ca 0.72 -1.35 -0.07 0.00 -2.93 0.00 0.00 61.98 58.35 2jty s VAL 5 Cb -0.30 -1.95 0.02 0.00 -1.53 0.00 0.00 36.38 32.62 2jty s VAL 5 CO 0.52 -0.16 0.56 0.21 -3.33 0.00 0.00 175.10 172.90 2jty s ASN 6 N -2.98 0.57 0.00 3.54 2.47 -1.26 -5.02 114.94 112.25 2jty s ASN 6 Ca 0.19 -1.33 0.00 0.00 0.42 0.00 0.00 52.86 52.14 2jty s ASN 6 Cb 0.02 0.71 0.00 0.00 -1.45 0.00 0.00 41.25 40.53 2jty s ASN 6 CO 0.03 -1.39 0.00 0.61 -3.72 0.00 0.00 177.10 172.63 2jty n GLY 7 N -0.54 0.61 0.00 1.21 0.00 -1.26 -4.98 105.19 100.24 2jty n GLY 7 Ca -0.02 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.64 -0.78 0.00 -0.02 0.00 -1.26 -4.98 105.19 95.51 2jty n GLY 8 Ca 0.00 -1.06 0.01 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.23 0.00 -0.64 2.61 5.66 -1.26 -4.95 114.28 115.46 2jty n THR 9 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2jty n THR 9 Cb 0.00 -0.10 0.00 0.00 -1.55 0.00 0.00 70.33 68.68 2jty n THR 9 CO 0.00 0.00 0.00 0.55 -3.05 0.00 0.00 175.07 172.57 2jty n VAL 10 N -0.53 0.00 -3.35 1.08 3.14 -1.26 -5.06 118.33 112.35 2jty n VAL 10 Ca 0.01 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.38 2jty n VAL 10 Cb 0.00 0.00 -0.04 0.00 -1.06 0.00 0.00 33.84 32.74 2jty n VAL 10 CO 0.00 0.00 0.00 -1.38 -6.46 0.00 0.00 176.83 168.99 2jty s HIS 11 N -0.23 -1.30 0.00 1.45 -3.43 -1.26 -5.09 115.29 105.43 2jty s HIS 11 Ca 0.00 1.63 0.00 0.00 -0.80 0.00 0.00 55.06 55.89 2jty s HIS 11 Cb 0.00 0.47 0.00 0.00 -1.43 0.00 0.00 32.58 31.62 2jty s HIS 11 CO 0.00 -0.76 0.00 1.19 -2.00 0.00 0.00 174.74 173.17 2jty n PHE 12 N 5.42 0.00 0.00 0.38 3.72 -1.26 -5.14 117.46 120.57 2jty n PHE 12 Ca -0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 2jty n PHE 12 Cb 0.50 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.04 2jty n PHE 12 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 2jty n LYS 13 N 0.00 0.00 0.00 -1.08 2.85 -1.26 -5.07 118.16 113.60 2jty n LYS 13 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2jty n LYS 13 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 2jty n LYS 13 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2jty n GLY 14 N 0.00 3.91 0.00 2.58 0.00 -1.26 -5.08 105.19 105.34 2jty n GLY 14 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.35 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 0.93 -0.21 1.61 2.13 -1.26 -5.04 120.64 118.80 2jty n GLU 15 Ca 0.00 0.00 0.27 0.00 0.66 0.00 0.00 57.16 58.09 2jty n GLU 15 Cb 0.00 0.00 0.67 0.00 0.27 0.00 0.00 31.44 32.38 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 0.98 0.57 -5.24 6.31 3.04 -1.98 -3.45 116.25 116.48 2jty h VAL 16 Ca 0.00 -0.04 -0.24 0.00 -1.01 0.00 0.00 66.70 65.42 2jty h VAL 16 Cb 0.00 0.45 -0.15 0.00 -2.01 0.00 0.00 31.29 29.59 2jty h VAL 16 CO 0.00 0.02 -0.34 1.33 -1.01 0.00 0.00 177.57 177.57 2jty n VAL 17 N -4.34 0.00 -3.69 1.51 0.24 -1.26 -4.88 118.33 105.91 2jty n VAL 17 Ca 0.19 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 62.20 2jty n VAL 17 Cb 0.92 -0.19 -0.14 0.00 -1.47 0.00 0.00 33.84 32.96 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 -2.17 3.75 -0.21 -1.34 0.02 -1.26 -5.04 114.94 108.69 2jty s ASN 18 Ca 0.32 -2.10 -0.04 0.00 -1.02 0.00 0.00 52.86 50.02 2jty s ASN 18 Cb -0.18 -0.88 0.09 0.00 0.02 0.00 0.00 41.25 40.30 2jty s ASN 18 CO 0.39 -0.34 0.21 0.00 0.02 0.00 0.00 177.10 177.38 2jty s ALA 19 N 1.04 -0.18 0.57 0.60 0.00 -1.26 -4.83 121.76 117.71 2jty s ALA 19 Ca 0.14 0.08 0.28 0.00 0.00 0.00 0.00 51.96 52.46 2jty s ALA 19 Cb -0.21 -1.34 1.51 0.00 0.00 0.00 0.00 23.12 23.08 2jty s ALA 19 CO -0.12 -1.27 1.98 0.00 0.00 0.00 0.00 175.76 176.35 2jty h ALA 20 N 8.32 2.16 -2.96 0.00 0.00 -1.94 -3.41 119.26 121.44 2jty h ALA 20 Ca -0.17 -0.01 -0.39 0.00 0.00 0.00 0.00 54.91 54.34 2jty h ALA 20 Cb 1.14 0.03 -0.19 0.00 0.00 0.00 0.00 17.79 18.77 2jty h ALA 20 CO 0.30 -0.58 -0.76 0.00 0.00 0.00 0.00 179.25 178.21 2jty s ALA 22 N -2.04 2.77 -0.52 0.00 0.00 0.11 -4.83 121.76 117.24 2jty s ALA 22 Ca 0.06 -1.95 -0.34 0.00 0.00 0.00 0.00 51.96 49.73 2jty s ALA 22 Cb -0.05 -4.39 -0.14 0.00 0.00 0.00 0.00 23.12 18.54 2jty s ALA 22 CO 0.02 -3.44 2.32 1.55 0.00 0.00 0.00 175.76 176.21 2jty n VAL 23 N 6.61 0.08 -1.16 0.00 3.14 -1.26 -0.39 118.33 125.35 2jty n VAL 23 Ca 0.20 -0.25 -0.29 0.00 -2.96 0.00 0.00 64.34 61.04 2jty n VAL 23 Cb 0.50 -1.42 0.15 0.00 -1.06 0.00 0.00 33.84 32.02 2jty n VAL 23 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2jty s ASP 24 N 8.22 3.14 0.47 6.55 2.15 -0.59 -4.59 116.67 132.01 2jty s ASP 24 Ca 1.15 1.43 0.15 0.00 0.43 0.00 0.00 52.55 55.71 2jty s ASP 24 Cb -0.93 -2.10 1.12 0.00 -0.30 0.00 0.00 42.92 40.71 2jty s ASP 24 CO 0.48 -2.84 2.03 0.00 -0.17 0.00 0.00 175.17 174.67 2jty h ALA 25 N -1.69 2.06 0.00 3.66 0.00 -1.91 0.91 119.26 122.29 2jty h ALA 25 Ca -0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2jty h ALA 25 Cb 1.30 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2jty h ALA 25 CO 0.55 -0.15 0.00 0.41 0.00 0.00 0.00 179.25 180.06 2jty n GLY 26 N -1.54 -0.94 0.63 0.00 0.00 -1.26 -3.89 105.19 98.19 2jty n GLY 26 Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2jty n GLY 26 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jty n SER 27 N -0.60 1.37 0.21 1.61 2.88 -0.03 -4.79 113.62 114.28 2jty n SER 27 Ca 0.05 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.64 2jty n SER 27 Cb 0.02 0.00 0.46 0.00 -0.75 0.00 0.00 64.21 63.94 2jty n SER 27 CO 0.00 0.00 0.00 1.62 -1.23 0.00 0.00 175.04 175.43 2jty h VAL 28 N 0.00 1.01 -1.06 2.46 3.04 -1.03 -3.35 116.25 117.32 2jty h VAL 28 Ca 0.00 -1.09 -0.37 0.00 -1.01 0.00 0.00 66.70 64.23 2jty h VAL 28 Cb 0.64 1.62 -0.28 0.00 -2.01 0.00 0.00 31.29 31.26 2jty h VAL 28 CO 0.00 0.29 -0.84 -0.67 -1.01 0.00 0.00 177.57 175.34 2jty n ASP 29 N -3.90 -0.77 -4.70 3.17 2.03 -1.25 -0.29 116.55 110.84 2jty n ASP 29 Ca -0.02 -3.28 -0.35 0.00 0.52 0.00 0.00 54.79 51.66 2jty n ASP 29 Cb 0.37 0.57 -0.09 0.00 -0.72 0.00 0.00 41.12 41.25 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 -1.02 3.31 -0.63 -0.67 -2.07 -1.04 -4.99 119.66 112.55 2jty s GLN 30 Ca 0.32 -0.34 -0.07 0.00 -1.82 0.00 0.00 55.36 53.45 2jty s GLN 30 Cb 0.30 -2.96 0.16 0.00 -1.09 0.00 0.00 33.01 29.42 2jty s GLN 30 CO -0.08 0.61 0.49 0.99 -1.32 0.00 0.00 175.29 175.98 2jty s THR 31 N -0.61 4.26 -0.51 3.63 2.01 -1.26 -1.10 115.64 122.06 2jty s THR 31 Ca 0.11 -2.56 -0.29 0.00 0.31 0.00 0.00 61.69 59.27 2jty s THR 31 Cb -0.12 -3.74 0.02 0.00 0.01 0.00 0.00 72.50 68.68 2jty s THR 31 CO 0.02 -0.88 1.23 -0.69 -0.69 0.00 0.00 174.62 173.61 2jty s VAL 32 N 0.34 4.05 -0.22 3.82 1.01 -0.24 -4.85 120.40 124.31 2jty s VAL 32 Ca 0.14 1.02 -0.19 0.00 0.00 0.00 0.00 61.98 62.95 2jty s VAL 32 Cb -0.19 -4.55 -0.03 0.00 0.00 0.00 0.00 36.38 31.61 2jty s VAL 32 CO -0.04 -1.08 0.53 -1.10 0.00 0.00 0.00 175.10 173.40 2jty s GLN 33 N 4.81 4.15 0.00 2.72 -0.21 -1.26 -0.87 119.66 129.01 2jty s GLN 33 Ca 0.49 0.41 0.24 0.00 0.02 0.00 0.00 55.36 56.52 2jty s GLN 33 Cb -0.09 -3.59 0.24 0.00 1.00 0.00 0.00 33.01 30.57 2jty s GLN 33 CO 0.29 -0.22 1.28 1.28 -2.12 0.00 0.00 175.29 175.80 2jty n LEU 34 N 5.05 2.64 0.00 2.90 4.77 0.21 -4.96 117.00 127.62 2jty n LEU 34 Ca -0.04 -0.89 0.07 0.00 -0.03 0.00 0.00 56.01 55.12 2jty n LEU 34 Cb 0.50 -0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.57 2jty n LEU 34 CO 0.42 0.45 -0.10 0.61 -1.33 0.00 0.00 177.39 177.44 2jty n GLY 35 N 1.35 -1.98 3.76 -0.72 0.00 -1.26 -4.70 105.19 101.64 2jty n GLY 35 Ca 0.13 -1.33 -0.41 0.00 0.00 0.00 0.00 46.02 44.42 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 -1.24 4.46 0.05 1.61 -0.21 -1.25 -2.02 119.66 121.06 2jty s GLN 36 Ca 0.00 2.02 0.06 0.00 0.02 0.00 0.00 55.36 57.46 2jty s GLN 36 Cb 0.00 -3.15 -0.02 0.00 1.00 0.00 0.00 33.01 30.83 2jty s GLN 36 CO 0.00 -0.08 -0.16 0.08 -2.12 0.00 0.00 175.29 173.01 2jty s VAL 37 N -0.73 1.30 -0.02 1.09 1.01 -0.57 -4.92 120.40 117.56 2jty s VAL 37 Ca 0.50 -1.13 -0.30 0.00 0.00 0.00 0.00 61.98 61.05 2jty s VAL 37 Cb -0.36 -1.17 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 2jty s VAL 37 CO 0.44 0.02 1.17 -0.13 0.00 0.00 0.00 175.10 176.60 2jty s ARG 38 N -1.29 4.40 0.54 2.72 1.81 -1.26 -0.17 118.95 125.70 2jty s ARG 38 Ca 0.03 1.66 0.25 0.00 -1.72 0.00 0.00 55.73 55.95 2jty s ARG 38 Cb -0.08 -3.49 1.43 0.00 -0.45 0.00 0.00 34.95 32.36 2jty s ARG 38 CO 0.02 -0.34 2.03 1.79 -0.68 0.00 0.00 175.30 178.11 2jty h THR 39 N 4.85 0.70 -1.00 0.02 1.35 -1.34 -1.88 112.91 115.62 2jty h THR 39 Ca -0.37 0.00 0.09 0.00 -0.55 0.00 0.00 66.41 65.58 2jty h THR 39 Cb 1.18 0.78 -0.07 0.00 -1.73 0.00 0.00 68.15 68.30 2jty h THR 39 CO 0.85 0.00 0.64 0.00 -0.25 0.00 0.00 175.52 176.76 2jty h ALA 40 N 1.76 1.47 0.00 6.62 0.00 -1.88 -0.14 119.26 127.09 2jty h ALA 40 Ca 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2jty h ALA 40 Cb 0.81 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2jty h ALA 40 CO -0.00 0.33 0.00 0.43 0.00 0.00 0.00 179.25 180.01 2jty n SER 41 N -4.55 0.00 -1.45 0.00 7.64 -0.70 -4.09 113.62 110.46 2jty n SER 41 Ca 0.17 -0.61 0.03 0.00 1.01 0.00 0.00 58.87 59.46 2jty n SER 41 Cb 0.27 -0.04 0.07 0.00 -1.01 0.00 0.00 64.21 63.50 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 -1.04 1.65 -0.15 -3.43 4.77 -0.07 -1.95 117.00 116.78 2jty n LEU 42 Ca 0.16 -2.69 0.04 0.00 -0.03 0.00 0.00 56.01 53.49 2jty n LEU 42 Cb 0.09 -0.09 0.08 0.00 -2.33 0.00 0.00 43.42 41.17 2jty n LEU 42 CO 0.13 0.85 0.55 0.00 -1.33 0.00 0.00 177.39 177.59 2jty n ALA 43 N -0.07 2.17 -2.80 -1.18 0.00 -1.23 -0.45 120.51 116.95 2jty n ALA 43 Ca 0.11 -1.63 -0.09 0.00 0.00 0.00 0.00 53.44 51.82 2jty n ALA 43 Cb 0.99 -0.21 -0.06 0.00 0.00 0.00 0.00 19.45 20.17 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 -1.73 1.08 0.06 0.00 0.00 -1.01 -4.15 119.66 113.91 2jty s GLN 44 Ca 0.16 -0.99 -0.30 0.00 -0.00 0.00 0.00 55.36 54.23 2jty s GLN 44 Cb 0.13 0.40 -0.09 0.00 0.00 0.00 0.00 33.01 33.45 2jty s GLN 44 CO 0.03 -0.40 1.93 -2.00 0.00 0.00 0.00 175.29 174.86 2jty s GLU 45 N -3.89 4.14 0.00 9.60 2.12 -1.26 -1.03 118.70 128.38 2jty s GLU 45 Ca 0.10 2.61 0.00 0.00 0.36 0.00 0.00 54.97 58.04 2jty s GLU 45 Cb 0.03 -4.03 0.00 0.00 0.26 0.00 0.00 34.13 30.39 2jty s GLU 45 CO -0.06 -0.93 0.00 0.41 -0.54 0.00 0.00 175.26 174.14 2jty n GLY 46 N 4.47 0.14 3.76 -1.50 0.00 0.06 -4.87 105.19 107.25 2jty n GLY 46 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.00 2.38 0.07 4.61 0.00 -0.20 -4.82 121.76 121.80 2jty s ALA 47 Ca 0.00 0.65 -0.10 0.00 0.00 0.00 0.00 51.96 52.50 2jty s ALA 47 Cb 0.00 -3.36 0.01 0.00 0.00 0.00 0.00 23.12 19.77 2jty s ALA 47 CO 0.00 -1.41 0.23 0.95 0.00 0.00 0.00 175.76 175.53 2jty s THR 48 N -2.22 0.11 1.09 0.00 -4.23 -0.82 -0.35 115.64 109.22 2jty s THR 48 Ca 0.69 -0.94 -0.16 0.00 -1.18 0.00 0.00 61.69 60.10 2jty s THR 48 Cb -0.23 -1.10 0.23 0.00 1.34 0.00 0.00 72.50 72.74 2jty s THR 48 CO 0.42 -0.52 1.14 -0.94 -0.54 0.00 0.00 174.62 174.18 2jty s SER 49 N -2.44 1.94 0.58 3.99 1.04 0.09 -4.58 113.70 114.31 2jty s SER 49 Ca -0.01 0.73 0.32 0.00 0.48 0.00 0.00 55.95 57.47 2jty s SER 49 Cb 0.02 -1.07 1.41 0.00 0.10 0.00 0.00 66.02 66.47 2jty s SER 49 CO -0.07 -3.50 1.72 0.28 0.98 0.00 0.00 173.24 172.65 2jty h SER 50 N -2.16 0.00 -3.93 7.02 0.02 -1.94 -3.46 113.55 109.11 2jty h SER 50 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2jty h SER 50 Cb 1.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.84 2jty h SER 50 CO 0.43 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 176.12 2jty n ALA 51 N -2.51 -0.85 -3.71 3.77 0.00 -1.26 -5.09 120.51 110.87 2jty n ALA 51 Ca 0.20 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.49 2jty n ALA 51 Cb 1.13 -0.47 -0.15 0.00 0.00 0.00 0.00 19.45 19.96 2jty n ALA 51 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2jty s VAL 52 N -3.08 -0.05 -0.25 0.00 -7.23 0.72 -5.00 120.40 105.51 2jty s VAL 52 Ca 0.00 0.19 -0.15 0.00 -1.81 0.00 0.00 61.98 60.21 2jty s VAL 52 Cb 0.00 -0.16 -0.04 0.00 0.56 0.00 0.00 36.38 36.74 2jty s VAL 52 CO 0.00 0.08 0.38 -0.83 -0.31 0.00 0.00 175.10 174.42 2jty s GLY 53 N 1.06 1.92 -0.29 2.32 0.00 -1.26 -0.44 107.32 110.63 2jty s GLY 53 Ca -0.09 -0.74 -0.01 0.00 0.00 0.00 0.00 44.72 43.89 2jty s GLY 53 CO -0.04 0.95 0.07 -0.11 0.00 0.00 0.00 173.10 173.97 2jty s PHE 54 N 1.89 1.83 0.19 1.90 -0.71 -0.33 -4.97 117.98 117.78 2jty s PHE 54 Ca 0.16 -1.70 -0.06 0.00 -1.04 0.00 0.00 56.93 54.29 2jty s PHE 54 Cb -0.15 -1.68 -0.06 0.00 -1.21 0.00 0.00 43.02 39.91 2jty s PHE 54 CO 0.09 -0.83 0.44 0.54 -1.34 0.00 0.00 175.22 174.12 2jty s ASN 55 N 1.58 6.52 -0.65 1.98 6.03 -1.26 -2.48 114.94 126.66 2jty s ASN 55 Ca 0.07 0.68 -0.18 0.00 -1.03 0.00 0.00 52.86 52.39 2jty s ASN 55 Cb -0.17 -2.13 0.12 0.00 -3.03 0.00 0.00 41.25 36.03 2jty s ASN 55 CO -0.19 -0.02 0.75 -0.63 -2.03 0.00 0.00 177.10 174.98 2jty s ILE 56 N -1.77 4.88 0.09 0.54 -1.09 -0.02 -4.91 121.20 118.92 2jty s ILE 56 Ca 0.43 -1.19 -0.31 0.00 -2.23 0.00 0.00 60.65 57.36 2jty s ILE 56 Cb -0.12 -4.52 -0.08 0.00 -1.58 0.00 0.00 42.46 36.16 2jty s ILE 56 CO 0.25 -1.16 1.57 -1.58 -1.23 0.00 0.00 174.94 172.79 2jty s GLN 57 N 2.47 4.23 -0.07 2.79 0.74 -1.26 -3.00 119.66 125.55 2jty s GLN 57 Ca 0.14 2.27 -0.00 0.00 0.05 0.00 0.00 55.36 57.81 2jty s GLN 57 Cb -0.21 -3.44 0.02 0.00 1.10 0.00 0.00 33.01 30.48 2jty s GLN 57 CO 0.03 -0.65 -0.03 -0.51 -0.55 0.00 0.00 175.29 173.58 2jty s LEU 58 N 2.06 0.96 0.19 3.68 1.02 -1.13 -1.55 118.68 123.92 2jty s LEU 58 Ca 0.71 -0.15 0.11 0.00 0.02 0.00 0.00 54.13 54.81 2jty s LEU 58 Cb -0.39 -0.54 -0.04 0.00 0.02 0.00 0.00 46.19 45.23 2jty s LEU 58 CO 0.31 -0.13 -0.19 0.54 0.02 0.00 0.00 176.35 176.90 2jty s ASN 59 N 1.57 3.72 -1.04 2.29 2.20 0.47 -1.78 114.94 122.38 2jty s ASN 59 Ca -0.00 -0.77 -0.05 0.00 -0.94 0.00 0.00 52.86 51.10 2jty s ASN 59 Cb -0.13 -0.42 0.01 0.00 -2.00 0.00 0.00 41.25 38.71 2jty s ASN 59 CO -0.04 0.11 0.62 -0.67 -2.94 0.00 0.00 177.10 174.18 2jty n ASP 60 N 0.17 -4.95 -4.57 3.54 2.03 -1.24 0.07 116.55 111.61 2jty n ASP 60 Ca -0.12 -0.29 -0.40 0.00 0.52 0.00 0.00 54.79 54.50 2jty n ASP 60 Cb 0.56 -3.68 -0.03 0.00 -0.72 0.00 0.00 41.12 37.25 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 7.27 7.46 0.29 0.00 2.15 -0.74 -2.57 116.67 130.54 2jty s ASP 62 Ca 0.73 1.73 0.24 0.00 0.43 0.00 0.00 52.55 55.68 2jty s ASP 62 Cb -0.17 -2.55 0.40 0.00 -0.30 0.00 0.00 42.92 40.31 2jty s ASP 62 CO 0.27 0.07 1.51 0.71 -0.17 0.00 0.00 175.17 177.56 2jty h THR 63 N 3.67 0.00 -0.49 1.71 1.35 -1.85 -3.36 112.91 113.94 2jty h THR 63 Ca -0.45 -0.79 -0.06 0.00 -0.55 0.00 0.00 66.41 64.57 2jty h THR 63 Cb 1.21 1.64 -0.02 0.00 -1.73 0.00 0.00 68.15 69.24 2jty h THR 63 CO 0.69 0.00 0.06 0.78 -0.25 0.00 0.00 175.52 176.80 2jty h ASN 64 N 0.00 0.79 0.28 5.36 2.35 -1.99 -3.18 115.58 119.20 2jty h ASN 64 Ca 0.00 -0.27 -0.01 0.00 -0.55 0.00 0.00 56.30 55.46 2jty h ASN 64 Cb 0.89 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 39.05 2jty h ASN 64 CO 0.00 0.87 -0.13 1.62 -1.65 0.00 0.00 177.43 178.13 2jty h VAL 65 N 0.69 0.72 -3.44 2.81 3.04 -1.98 -3.47 116.25 114.63 2jty h VAL 65 Ca 0.15 -0.70 -0.07 0.00 -1.01 0.00 0.00 66.70 65.07 2jty h VAL 65 Cb 0.42 1.07 -0.14 0.00 -2.01 0.00 0.00 31.29 30.63 2jty h VAL 65 CO 0.01 0.13 -0.18 0.00 -1.01 0.00 0.00 177.57 176.52 2jty s ALA 66 N -4.60 -0.71 -0.63 3.17 0.00 -1.20 -4.51 121.76 113.26 2jty s ALA 66 Ca -0.14 -0.14 0.06 0.00 0.00 0.00 0.00 51.96 51.74 2jty s ALA 66 Cb 0.02 0.53 0.09 0.00 0.00 0.00 0.00 23.12 23.76 2jty s ALA 66 CO 0.53 -0.55 0.84 0.43 0.00 0.00 0.00 175.76 177.02 2jty n SER 67 N 0.05 1.84 -4.20 0.00 7.64 -0.72 -3.93 113.62 114.29 2jty n SER 67 Ca -0.17 -1.51 -0.20 0.00 1.01 0.00 0.00 58.87 58.00 2jty n SER 67 Cb 0.62 -0.04 -0.12 0.00 -1.01 0.00 0.00 64.21 63.66 2jty n SER 67 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2jty s LYS 68 N -0.67 0.93 0.17 1.43 1.02 0.69 -0.73 119.74 122.59 2jty s LYS 68 Ca 0.09 -0.99 0.10 0.00 0.02 0.00 0.00 55.97 55.19 2jty s LYS 68 Cb 0.05 -1.02 -0.04 0.00 -0.52 0.00 0.00 37.83 36.30 2jty s LYS 68 CO 0.08 0.23 -0.19 0.00 -0.92 0.00 0.00 175.35 174.55 2jty s ALA 69 N -1.18 2.67 0.29 5.17 0.00 0.07 -1.15 121.76 127.64 2jty s ALA 69 Ca 0.01 -1.52 0.06 0.00 0.00 0.00 0.00 51.96 50.51 2jty s ALA 69 Cb -0.10 -0.52 -0.02 0.00 0.00 0.00 0.00 23.12 22.49 2jty s ALA 69 CO 0.03 0.48 0.21 0.00 0.00 0.00 0.00 175.76 176.48 2jty n ALA 70 N 0.35 0.58 -3.39 0.00 0.00 -0.39 -0.62 120.51 117.04 2jty n ALA 70 Ca -0.13 -1.67 -0.14 0.00 0.00 0.00 0.00 53.44 51.51 2jty n ALA 70 Cb 0.55 1.30 -0.09 0.00 0.00 0.00 0.00 19.45 21.21 2jty n ALA 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2jty s VAL 71 N -3.08 0.00 0.08 0.00 0.11 -1.26 -0.56 120.40 115.70 2jty s VAL 71 Ca 0.30 -0.03 0.04 0.00 -2.93 0.00 0.00 61.98 59.36 2jty s VAL 71 Cb 0.01 -0.70 -0.03 0.00 -1.53 0.00 0.00 36.38 34.13 2jty s VAL 71 CO 0.21 -0.02 -0.12 0.00 -3.33 0.00 0.00 175.10 171.85 2jty s ALA 72 N 0.11 1.10 0.17 1.54 0.00 -0.92 -0.65 121.76 123.10 2jty s ALA 72 Ca -0.01 -1.07 0.09 0.00 0.00 0.00 0.00 51.96 50.96 2jty s ALA 72 Cb -0.03 -0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 2jty s ALA 72 CO 0.01 0.05 -0.11 -0.06 0.00 0.00 0.00 175.76 175.66 2jty s PHE 73 N -1.85 2.63 -0.08 0.00 0.40 -1.26 -0.41 117.98 117.40 2jty s PHE 73 Ca 0.01 -0.22 -0.11 0.00 -0.60 0.00 0.00 56.93 56.01 2jty s PHE 73 Cb -0.07 -1.30 0.03 0.00 0.51 0.00 0.00 43.02 42.19 2jty s PHE 73 CO 0.01 0.49 0.29 -1.17 0.70 0.00 0.00 175.22 175.54 2jty s LEU 74 N -2.71 0.91 0.00 -0.37 2.96 -0.66 -0.30 118.68 118.51 2jty s LEU 74 Ca 0.24 0.42 0.00 0.00 -0.22 0.00 0.00 54.13 54.57 2jty s LEU 74 Cb -0.09 1.05 0.00 0.00 0.50 0.00 0.00 46.19 47.65 2jty s LEU 74 CO 0.14 -0.20 0.00 0.61 -1.32 0.00 0.00 176.35 175.58 2jty n GLY 75 N 2.43 0.64 3.67 7.98 0.00 -1.26 -1.97 105.19 116.67 2jty n GLY 75 Ca -0.16 -1.08 -0.42 0.00 0.00 0.00 0.00 46.02 44.36 2jty n GLY 75 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2jty n THR 76 N -0.66 0.63 -2.25 2.61 -1.04 -1.26 -4.90 114.28 107.41 2jty n THR 76 Ca 0.00 -0.11 -0.41 0.00 -2.04 0.00 0.00 64.05 61.49 2jty n THR 76 Cb 0.00 -2.26 -0.03 0.00 -1.82 0.00 0.00 70.33 66.22 2jty n THR 76 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jty s ALA 77 N 3.85 3.48 0.41 2.41 0.00 -1.26 -1.00 121.76 129.65 2jty s ALA 77 Ca 0.86 1.11 0.12 0.00 0.00 0.00 0.00 51.96 54.05 2jty s ALA 77 Cb -0.45 -3.44 0.86 0.00 0.00 0.00 0.00 23.12 20.09 2jty s ALA 77 CO 0.40 -0.47 1.93 0.97 0.00 0.00 0.00 175.76 178.59 2jty h ILE 78 N 3.25 1.17 -2.93 0.00 2.10 -1.09 -3.41 117.51 116.60 2jty h ILE 78 Ca -0.47 -0.77 0.07 0.00 1.08 0.00 0.00 64.86 64.77 2jty h ILE 78 Cb 1.22 1.30 -0.06 0.00 -1.09 0.00 0.00 36.82 38.19 2jty h ILE 78 CO 0.69 0.23 0.25 -0.62 -1.08 0.00 0.00 178.15 177.63 2jty s ASP 79 N -6.93 -0.29 0.37 2.19 2.15 -1.26 -4.91 116.67 107.99 2jty s ASP 79 Ca -0.05 -0.51 0.09 0.00 0.43 0.00 0.00 52.55 52.52 2jty s ASP 79 Cb 0.15 0.69 0.84 0.00 -0.30 0.00 0.00 42.92 44.30 2jty s ASP 79 CO 0.72 -1.25 1.91 0.00 -0.17 0.00 0.00 175.17 176.38 2jty h ALA 80 N 2.00 1.85 0.00 3.66 0.00 -1.99 -0.79 119.26 123.98 2jty h ALA 80 Ca -0.21 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2jty h ALA 80 Cb 1.26 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2jty h ALA 80 CO 0.25 -0.03 0.00 0.41 0.00 0.00 0.00 179.25 179.88 2jty n GLY 81 N -1.46 -0.86 2.56 0.00 0.00 -1.26 -3.94 105.19 100.23 2jty n GLY 81 Ca 0.14 -0.12 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.15 -1.03 0.62 1.61 8.25 -0.33 -4.92 115.22 118.28 2jty n HIS 82 Ca 0.14 -2.70 0.07 0.00 -0.26 0.00 0.00 57.72 54.97 2jty n HIS 82 Cb 0.13 0.61 0.34 0.00 1.12 0.00 0.00 29.99 32.18 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 0.03 0.72 1.56 1.59 -2.24 -1.07 -1.46 114.28 113.41 2jty n THR 83 Ca 0.10 0.18 0.11 0.00 -2.27 0.00 0.00 64.05 62.17 2jty n THR 83 Cb 0.75 -0.94 0.49 0.00 -2.10 0.00 0.00 70.33 68.52 2jty n THR 83 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2jty n ASN 84 N -1.34 0.99 -3.89 3.42 6.94 -1.26 -1.26 115.26 118.85 2jty n ASN 84 Ca 0.06 -1.54 -0.11 0.00 -0.02 0.00 0.00 54.58 52.96 2jty n ASN 84 Cb 0.13 -0.05 -0.13 0.00 -2.36 0.00 0.00 39.78 37.37 2jty n ASN 84 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2jty s VAL 85 N -1.90 0.03 0.44 3.53 1.01 -0.54 -4.48 120.40 118.49 2jty s VAL 85 Ca 0.32 -0.27 -0.19 0.00 0.00 0.00 0.00 61.98 61.85 2jty s VAL 85 Cb 0.17 -0.12 -0.10 0.00 0.00 0.00 0.00 36.38 36.33 2jty s VAL 85 CO 0.26 -0.15 0.92 -0.22 0.00 0.00 0.00 175.10 175.92 2jty s LEU 86 N -0.43 3.88 -0.05 3.92 0.20 -0.00 -0.88 118.68 125.31 2jty s LEU 86 Ca -0.05 1.58 0.09 0.00 0.69 0.00 0.00 54.13 56.44 2jty s LEU 86 Cb -0.03 -4.45 0.34 0.00 -0.43 0.00 0.00 46.19 41.62 2jty s LEU 86 CO -0.00 -0.40 1.17 0.00 -0.29 0.00 0.00 176.35 176.83 2jty n ALA 87 N -0.86 2.77 -0.76 5.97 0.00 -0.17 -2.63 120.51 124.83 2jty n ALA 87 Ca 0.06 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.77 2jty n ALA 87 Cb 0.54 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.98 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 0.40 0.00 0.00 0.00 4.77 -1.26 -4.92 117.00 115.99 2jty n LEU 88 Ca 0.12 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 56.06 2jty n LEU 88 Cb 0.48 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.59 2jty n LEU 88 CO 0.11 -0.29 0.60 0.00 -1.33 0.00 0.00 177.39 176.48 2jty n GLN 89 N 0.00 0.71 -0.62 3.23 10.64 0.20 -4.48 117.38 127.07 2jty n GLN 89 Ca 0.00 -1.49 0.07 0.00 -1.83 0.00 0.00 57.00 53.75 2jty n GLN 89 Cb 0.00 1.95 -0.04 0.00 -0.86 0.00 0.00 30.24 31.29 2jty n GLN 89 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2jty n SER 90 N -1.29 -3.35 -3.58 2.61 2.88 -1.26 -4.43 113.62 105.19 2jty n SER 90 Ca -0.04 0.62 -0.24 0.00 -1.33 0.00 0.00 58.87 57.89 2jty n SER 90 Cb 0.50 -2.12 -0.04 0.00 -0.75 0.00 0.00 64.21 61.80 2jty n SER 90 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2jty n SER 91 N -3.01 -1.82 0.00 -3.46 7.64 -1.26 -2.30 113.62 109.41 2jty n SER 91 Ca -0.04 -0.45 0.00 0.00 1.01 0.00 0.00 58.87 59.39 2jty n SER 91 Cb 0.29 -1.61 0.00 0.00 -1.01 0.00 0.00 64.21 61.88 2jty n SER 91 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jty n ALA 92 N -3.38 0.00 -2.04 -0.43 0.00 -1.26 -1.15 120.51 112.24 2jty n ALA 92 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2jty n ALA 92 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 2jty n ALA 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jty n ALA 93 N 0.03 2.05 0.44 0.00 0.00 -0.97 -4.68 120.51 117.38 2jty n ALA 93 Ca 0.00 -1.01 0.12 0.00 0.00 0.00 0.00 53.44 52.55 2jty n ALA 93 Cb 0.00 -0.47 0.47 0.00 0.00 0.00 0.00 19.45 19.45 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 0.04 -1.31 1.74 0.00 0.00 -0.30 -4.70 105.19 100.66 2jty n GLY 94 Ca 0.00 0.06 -0.21 0.00 0.00 0.00 0.00 46.02 45.87 2jty n GLY 94 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jty n SER 95 N -2.17 -3.28 -4.67 1.61 3.41 -1.24 -4.50 113.62 102.77 2jty n SER 95 Ca 0.03 0.09 -0.46 0.00 -0.26 0.00 0.00 58.87 58.27 2jty n SER 95 Cb 0.25 -0.42 -0.04 0.00 -0.26 0.00 0.00 64.21 63.74 2jty n SER 95 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jty n ALA 96 N -1.53 1.23 -1.94 7.33 0.00 0.02 -4.72 120.51 120.90 2jty n ALA 96 Ca -0.01 0.44 -0.26 0.00 0.00 0.00 0.00 53.44 53.61 2jty n ALA 96 Cb 0.34 -2.32 0.06 0.00 0.00 0.00 0.00 19.45 17.54 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 0.58 2.42 -0.96 0.00 -4.23 -1.26 -4.28 115.64 107.91 2jty s THR 97 Ca 0.75 -0.23 0.00 0.00 -1.18 0.00 0.00 61.69 61.03 2jty s THR 97 Cb -0.68 -3.05 0.00 0.00 1.34 0.00 0.00 72.50 70.11 2jty s THR 97 CO 0.42 -0.05 0.00 0.59 -0.54 0.00 0.00 174.62 175.04 2jty n ASN 98 N -2.89 -5.35 -4.05 3.99 3.02 -1.26 -2.87 115.26 105.85 2jty n ASN 98 Ca 0.08 0.22 -0.08 0.00 -0.03 0.00 0.00 54.58 54.77 2jty n ASN 98 Cb 0.60 -3.87 -0.10 0.00 -0.61 0.00 0.00 39.78 35.80 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 -1.73 0.18 0.16 2.41 0.11 -1.26 -0.29 120.40 119.98 2jty s VAL 99 Ca 0.00 -1.49 -0.25 0.00 -2.93 0.00 0.00 61.98 57.31 2jty s VAL 99 Cb 0.00 -1.10 0.06 0.00 -1.53 0.00 0.00 36.38 33.81 2jty s VAL 99 CO 0.00 -0.82 0.89 -0.83 -3.33 0.00 0.00 175.10 171.01 2jty s GLY 100 N -2.43 -0.26 -0.39 6.54 0.00 -0.23 -4.62 107.32 105.93 2jty s GLY 100 Ca -0.01 0.18 -0.21 0.00 0.00 0.00 0.00 44.72 44.68 2jty s GLY 100 CO -0.07 0.04 0.67 0.14 0.00 0.00 0.00 173.10 173.87 2jty s VAL 101 N -3.40 4.83 0.46 1.40 1.01 -1.08 -0.73 120.40 122.88 2jty s VAL 101 Ca 0.11 0.45 -0.15 0.00 0.00 0.00 0.00 61.98 62.38 2jty s VAL 101 Cb -0.02 -4.16 -0.08 0.00 0.00 0.00 0.00 36.38 32.12 2jty s VAL 101 CO 0.01 -0.46 0.91 -1.10 0.00 0.00 0.00 175.10 174.46 2jty s GLN 102 N 2.85 3.93 -0.04 2.72 -0.21 0.09 -0.82 119.66 128.18 2jty s GLN 102 Ca 0.25 0.82 0.05 0.00 0.02 0.00 0.00 55.36 56.50 2jty s GLN 102 Cb -0.14 -2.23 -0.01 0.00 1.00 0.00 0.00 33.01 31.64 2jty s GLN 102 CO 0.17 -0.16 -0.18 0.42 -2.12 0.00 0.00 175.29 173.43 2jty s ILE 103 N -2.47 1.48 0.01 1.08 1.09 -1.26 -2.30 121.20 118.83 2jty s ILE 103 Ca 0.57 -0.76 0.02 0.00 -1.10 0.00 0.00 60.65 59.38 2jty s ILE 103 Cb -0.10 -1.26 -0.01 0.00 -1.06 0.00 0.00 42.46 40.03 2jty s ILE 103 CO 0.29 0.42 -0.06 -0.76 -0.10 0.00 0.00 174.94 174.73 2jty s LEU 104 N -0.08 2.10 0.00 2.97 1.43 -0.53 -2.84 118.68 121.73 2jty s LEU 104 Ca -0.01 -0.26 0.00 0.00 -1.03 0.00 0.00 54.13 52.82 2jty s LEU 104 Cb -0.11 -0.19 0.00 0.00 0.03 0.00 0.00 46.19 45.92 2jty s LEU 104 CO 0.02 -0.05 0.75 -0.90 0.23 0.00 0.00 176.35 176.40 2jty n ASP 105 N 2.38 0.00 0.00 2.29 5.75 -0.90 -0.76 116.55 125.32 2jty n ASP 105 Ca -0.17 0.75 0.00 0.00 -0.01 0.00 0.00 54.79 55.37 2jty n ASP 105 Cb 0.57 -0.25 0.00 0.00 -1.03 0.00 0.00 41.12 40.41 2jty n ASP 105 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 2jty n ARG 106 N -1.49 0.00 0.19 0.11 1.85 -1.26 -3.85 116.66 112.21 2jty n ARG 106 Ca 0.00 0.00 0.03 0.00 -1.00 0.00 0.00 57.85 56.88 2jty n ARG 106 Cb 0.00 0.00 0.38 0.00 -1.05 0.00 0.00 32.46 31.79 2jty n ARG 106 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 2jty h THR 107 N 0.00 1.18 0.00 8.89 1.35 -2.00 -3.47 112.91 118.86 2jty h THR 107 Ca 0.00 -1.29 0.00 0.00 -0.55 0.00 0.00 66.41 64.57 2jty h THR 107 Cb 0.00 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.13 2jty h THR 107 CO 0.00 0.36 0.00 0.61 -0.25 0.00 0.00 175.52 176.24 2jty n GLY 108 N -0.36 1.19 3.57 5.82 0.00 -1.26 -5.07 105.19 109.07 2jty n GLY 108 Ca -0.02 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.55 2jty n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jty n ALA 109 N -1.22 1.59 -2.69 4.61 0.00 -1.26 -4.87 120.51 116.67 2jty n ALA 109 Ca 0.00 -0.18 -0.41 0.00 0.00 0.00 0.00 53.44 52.85 2jty n ALA 109 Cb 0.00 -2.82 -0.04 0.00 0.00 0.00 0.00 19.45 16.59 2jty n ALA 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jty s ALA 110 N 7.86 3.44 0.27 0.00 0.00 -1.26 -2.11 121.76 129.95 2jty s ALA 110 Ca 1.02 0.09 -0.12 0.00 0.00 0.00 0.00 51.96 52.95 2jty s ALA 110 Cb -0.47 -3.15 -0.08 0.00 0.00 0.00 0.00 23.12 19.42 2jty s ALA 110 CO 0.39 -0.46 0.63 -0.51 0.00 0.00 0.00 175.76 175.81 2jty s LEU 111 N 1.67 4.11 0.32 0.00 2.01 -1.13 -4.97 118.68 120.71 2jty s LEU 111 Ca 0.39 1.06 -0.22 0.00 0.01 0.00 0.00 54.13 55.37 2jty s LEU 111 Cb -0.17 -3.85 -0.10 0.00 0.01 0.00 0.00 46.19 42.09 2jty s LEU 111 CO 0.15 -0.14 0.86 -0.89 1.01 0.00 0.00 176.35 177.34 2jty s THR 112 N -1.90 4.41 -1.37 5.49 2.01 -1.26 -4.49 115.64 118.53 2jty s THR 112 Ca 0.50 1.48 -0.07 0.00 0.31 0.00 0.00 61.69 63.91 2jty s THR 112 Cb -0.11 -3.81 0.09 0.00 0.01 0.00 0.00 72.50 68.68 2jty s THR 112 CO 0.20 -0.00 2.40 0.18 -0.69 0.00 0.00 174.62 176.71 2jty n LEU 113 N 0.17 7.93 -0.00 4.42 4.77 -0.39 -4.33 117.00 129.56 2jty n LEU 113 Ca 0.02 -4.75 0.06 0.00 -0.03 0.00 0.00 56.01 51.32 2jty n LEU 113 Cb 0.52 -1.42 -0.09 0.00 -2.33 0.00 0.00 43.42 40.10 2jty n LEU 113 CO 0.42 1.93 -0.35 -0.67 -1.33 0.00 0.00 177.39 177.39 2jty n ASP 114 N 2.48 1.35 0.00 -1.43 2.03 -0.92 -4.21 116.55 115.84 2jty n ASP 114 Ca 0.61 -0.38 0.00 0.00 0.52 0.00 0.00 54.79 55.54 2jty n ASP 114 Cb 0.27 1.30 0.00 0.00 -0.72 0.00 0.00 41.12 41.97 2jty n ASP 114 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jty n GLY 115 N 1.54 2.34 0.00 0.27 0.00 0.58 -4.72 105.19 105.20 2jty n GLY 115 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.13 1.37 -1.81 4.61 0.00 -1.26 -4.63 120.51 118.92 2jty n ALA 116 Ca 0.00 -0.11 -0.28 0.00 0.00 0.00 0.00 53.44 53.05 2jty n ALA 116 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 2jty n ALA 116 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2jty s THR 117 N -0.40 3.21 0.16 0.00 2.01 -1.26 -4.93 115.64 114.44 2jty s THR 117 Ca 0.00 -0.06 -0.31 0.00 0.31 0.00 0.00 61.69 61.63 2jty s THR 117 Cb 0.00 -3.51 -0.09 0.00 0.01 0.00 0.00 72.50 68.91 2jty s THR 117 CO 0.00 -0.49 1.42 0.72 -0.69 0.00 0.00 174.62 175.58 2jty s PHE 118 N 11.60 3.17 0.93 4.92 -0.71 -1.26 -4.31 117.98 132.32 2jty s PHE 118 Ca 0.81 0.94 -0.12 0.00 -1.04 0.00 0.00 56.93 57.52 2jty s PHE 118 Cb -0.12 -3.74 0.15 0.00 -1.21 0.00 0.00 43.02 38.09 2jty s PHE 118 CO 0.12 -2.56 1.11 -1.54 -1.34 0.00 0.00 175.22 171.00 2jty s SER 119 N 0.85 3.29 -0.16 1.98 1.04 0.17 -4.94 113.70 115.93 2jty s SER 119 Ca 0.63 1.18 -0.14 0.00 0.48 0.00 0.00 55.95 58.10 2jty s SER 119 Cb -0.39 -1.83 -0.06 0.00 0.10 0.00 0.00 66.02 63.84 2jty s SER 119 CO 0.34 -2.71 0.62 -1.20 0.98 0.00 0.00 173.24 171.27 2jty n SER 120 N -3.90 0.30 -4.75 7.02 7.64 -1.26 -4.57 113.62 114.10 2jty n SER 120 Ca 0.06 0.28 -0.33 0.00 1.01 0.00 0.00 58.87 59.89 2jty n SER 120 Cb 0.57 -0.28 0.07 0.00 -1.01 0.00 0.00 64.21 63.56 2jty n SER 120 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2jty s GLU 121 N 1.54 2.43 -0.20 1.43 2.02 -1.26 -4.80 118.70 119.86 2jty s GLU 121 Ca 0.36 1.53 0.00 0.00 0.02 0.00 0.00 54.97 56.89 2jty s GLU 121 Cb -0.48 -1.89 0.05 0.00 0.10 0.00 0.00 34.13 31.91 2jty s GLU 121 CO 0.23 -1.56 -0.06 0.99 0.02 0.00 0.00 175.26 174.88 2jty s THR 122 N -2.24 1.34 0.11 3.63 2.01 0.21 -4.97 115.64 115.73 2jty s THR 122 Ca 0.70 -0.92 -0.32 0.00 0.31 0.00 0.00 61.69 61.46 2jty s THR 122 Cb -0.24 -1.55 -0.12 0.00 0.01 0.00 0.00 72.50 70.61 2jty s THR 122 CO 0.44 0.04 1.77 0.41 -0.69 0.00 0.00 174.62 176.59 2jty n THR 123 N 4.77 0.26 -2.95 -0.82 -1.04 -1.26 -0.75 114.28 112.50 2jty n THR 123 Ca -0.12 -0.05 -0.16 0.00 -2.04 0.00 0.00 64.05 61.68 2jty n THR 123 Cb 0.46 -1.94 0.06 0.00 -1.82 0.00 0.00 70.33 67.10 2jty n THR 123 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2jty n LEU 124 N 5.05 0.00 -4.06 -4.42 4.77 0.09 -4.92 117.00 113.51 2jty n LEU 124 Ca 0.18 -1.99 -0.10 0.00 -0.03 0.00 0.00 56.01 54.07 2jty n LEU 124 Cb 0.34 -0.38 -0.07 0.00 -2.33 0.00 0.00 43.42 40.98 2jty n LEU 124 CO 0.66 -0.71 0.02 0.54 -1.33 0.00 0.00 177.39 176.57 2jty s ASN 125 N -3.99 -0.00 -0.44 -1.43 2.20 -1.26 -4.88 114.94 105.14 2jty s ASN 125 Ca 0.50 -1.08 -0.27 0.00 -0.94 0.00 0.00 52.86 51.07 2jty s ASN 125 Cb -0.04 0.51 -0.04 0.00 -2.00 0.00 0.00 41.25 39.68 2jty s ASN 125 CO 0.32 -1.02 2.04 0.20 -2.94 0.00 0.00 177.10 175.70 2jty s ASN 126 N -3.06 5.26 0.00 3.54 0.01 -1.24 -4.57 114.94 114.88 2jty s ASN 126 Ca 0.28 1.06 0.00 0.00 -0.71 0.00 0.00 52.86 53.49 2jty s ASN 126 Cb 0.02 -2.52 0.00 0.00 0.41 0.00 0.00 41.25 39.16 2jty s ASN 126 CO 0.09 -2.25 0.00 0.61 -1.51 0.00 0.00 177.10 174.04 2jty n GLY 127 N 5.71 0.90 3.76 0.66 0.00 -1.06 -4.98 105.19 110.17 2jty n GLY 127 Ca 0.27 -1.84 -0.38 0.00 0.00 0.00 0.00 46.02 44.06 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 -2.92 5.02 0.04 2.61 2.01 -1.26 -0.79 115.64 120.34 2jty s THR 128 Ca 0.00 1.09 -0.09 0.00 0.31 0.00 0.00 61.69 63.00 2jty s THR 128 Cb 0.00 -3.86 0.00 0.00 0.01 0.00 0.00 72.50 68.65 2jty s THR 128 CO 0.00 0.41 0.18 0.20 -0.69 0.00 0.00 174.62 174.72 2jty s ASN 129 N -0.05 0.05 0.01 3.53 0.01 -0.73 -5.00 114.94 112.76 2jty s ASN 129 Ca 0.28 -0.38 0.01 0.00 -0.71 0.00 0.00 52.86 52.06 2jty s ASN 129 Cb -0.17 0.28 -0.01 0.00 0.41 0.00 0.00 41.25 41.76 2jty s ASN 129 CO 0.14 -0.54 -0.04 -0.89 -1.51 0.00 0.00 177.10 174.26 2jty s THR 130 N -2.51 0.31 -0.28 1.60 2.01 -1.26 -2.82 115.64 112.69 2jty s THR 130 Ca -0.06 -0.51 -0.09 0.00 0.31 0.00 0.00 61.69 61.35 2jty s THR 130 Cb -0.01 -0.33 -0.02 0.00 0.01 0.00 0.00 72.50 72.14 2jty s THR 130 CO -0.04 -0.14 0.12 -0.63 -0.69 0.00 0.00 174.62 173.24 2jty s ILE 131 N -0.64 4.54 0.77 1.82 1.01 -1.16 -4.95 121.20 122.58 2jty s ILE 131 Ca -0.04 -0.22 -0.13 0.00 0.00 0.00 0.00 60.65 60.25 2jty s ILE 131 Cb -0.05 -3.20 0.06 0.00 0.01 0.00 0.00 42.46 39.28 2jty s ILE 131 CO -0.00 0.23 1.15 -2.16 0.00 0.00 0.00 174.94 174.15 2jty s PRO 132 N 1.63 2.03 0.08 2.79 0.04 -1.26 -0.84 135.00 139.47 2jty s PRO 132 Ca 0.06 1.50 0.01 0.00 0.04 0.00 0.00 61.00 62.61 2jty s PRO 132 Cb -0.16 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 2jty s PRO 132 CO 0.06 -1.86 -0.06 -0.06 0.04 0.00 0.00 177.00 175.11 2jty s PHE 133 N -2.42 0.77 -0.44 0.56 0.40 -1.03 -4.73 117.98 111.08 2jty s PHE 133 Ca 0.68 -0.82 0.04 0.00 -0.60 0.00 0.00 56.93 56.23 2jty s PHE 133 Cb -0.23 -0.46 0.12 0.00 0.51 0.00 0.00 43.02 42.96 2jty s PHE 133 CO 0.50 -0.16 0.17 -0.65 0.70 0.00 0.00 175.22 175.77 2jty s GLN 134 N -3.20 1.76 0.56 0.44 -0.21 0.07 -1.19 119.66 117.90 2jty s GLN 134 Ca 0.05 -2.28 -0.15 0.00 0.02 0.00 0.00 55.36 53.00 2jty s GLN 134 Cb 0.01 -3.28 -0.06 0.00 1.00 0.00 0.00 33.01 30.68 2jty s GLN 134 CO -0.04 -1.03 1.01 0.00 -2.12 0.00 0.00 175.29 173.11 2jty s ALA 135 N 0.27 3.02 -0.00 6.09 0.00 0.41 -1.46 121.76 130.09 2jty s ALA 135 Ca 0.14 0.13 -0.28 0.00 0.00 0.00 0.00 51.96 51.95 2jty s ALA 135 Cb -0.23 -3.12 0.08 0.00 0.00 0.00 0.00 23.12 19.85 2jty s ALA 135 CO -0.04 -0.47 0.72 -0.98 0.00 0.00 0.00 175.76 175.00 2jty s ARG 136 N -4.41 1.03 0.18 0.00 1.70 -0.97 -0.20 118.95 116.28 2jty s ARG 136 Ca 0.58 -0.01 -0.31 0.00 -0.47 0.00 0.00 55.73 55.52 2jty s ARG 136 Cb -0.11 0.48 -0.10 0.00 -0.57 0.00 0.00 34.95 34.65 2jty s ARG 136 CO 0.39 -0.38 1.58 0.71 -1.08 0.00 0.00 175.30 176.52 2jty s TYR 137 N -2.08 3.03 0.10 5.89 2.02 -1.26 -0.73 117.35 124.32 2jty s TYR 137 Ca -0.05 0.62 0.02 0.00 -0.37 0.00 0.00 57.07 57.30 2jty s TYR 137 Cb -0.00 -3.95 -0.04 0.00 -0.40 0.00 0.00 41.96 37.56 2jty s TYR 137 CO 0.01 -3.49 0.15 0.12 -1.57 0.00 0.00 175.55 170.77 2jty s PHE 138 N 1.03 3.32 -0.06 2.71 2.19 0.09 -0.73 117.98 126.53 2jty s PHE 138 Ca 0.70 0.12 0.04 0.00 0.33 0.00 0.00 56.93 58.11 2jty s PHE 138 Cb -0.45 -1.65 -0.02 0.00 -1.31 0.00 0.00 43.02 39.60 2jty s PHE 138 CO 0.33 0.54 -0.17 0.00 1.83 0.00 0.00 175.22 177.75 2jty s ALA 139 N -1.53 2.53 -1.33 11.12 0.00 0.53 -1.06 121.76 132.00 2jty s ALA 139 Ca 0.32 -0.99 0.16 0.00 0.00 0.00 0.00 51.96 51.45 2jty s ALA 139 Cb -0.12 -0.91 0.61 0.00 0.00 0.00 0.00 23.12 22.70 2jty s ALA 139 CO 0.25 0.49 1.50 0.25 0.00 0.00 0.00 175.76 178.25 2jty n THR 140 N 2.60 1.46 -1.37 0.00 -2.24 0.60 -0.76 114.28 114.57 2jty n THR 140 Ca -0.17 -0.98 0.00 0.00 -2.27 0.00 0.00 64.05 60.62 2jty n THR 140 Cb 0.52 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 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 1.11 -0.60 3.56 3.38 0.00 -1.22 -4.06 105.19 107.36 2jty n GLY 141 Ca 0.22 -0.66 -0.29 0.00 0.00 0.00 0.00 46.02 45.29 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 1.70 -0.09 4.61 0.00 -1.26 -2.40 121.76 123.33 2jty s ALA 142 Ca 0.00 -1.15 -0.33 0.00 0.00 0.00 0.00 51.96 50.48 2jty s ALA 142 Cb 0.00 -4.48 -0.11 0.00 0.00 0.00 0.00 23.12 18.53 2jty s ALA 142 CO 0.00 -4.66 1.93 0.00 0.00 0.00 0.00 175.76 173.03 2jty n ALA 143 N 14.17 1.06 -1.66 0.00 0.00 0.40 -4.66 120.51 129.82 2jty n ALA 143 Ca 0.35 0.23 -0.30 0.00 0.00 0.00 0.00 53.44 53.72 2jty n ALA 143 Cb 0.48 -2.56 0.07 0.00 0.00 0.00 0.00 19.45 17.44 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 4.53 3.44 0.97 0.00 -4.23 -1.14 -4.84 115.64 114.38 2jty s THR 144 Ca 0.93 0.47 -0.14 0.00 -1.18 0.00 0.00 61.69 61.77 2jty s THR 144 Cb -0.63 -3.29 0.18 0.00 1.34 0.00 0.00 72.50 70.09 2jty s THR 144 CO 0.49 -0.61 1.16 -2.16 -0.54 0.00 0.00 174.62 172.96 2jty s PRO 145 N -5.19 0.61 0.00 3.99 0.05 -1.26 -4.35 135.00 128.85 2jty s PRO 145 Ca 0.59 0.12 0.00 0.00 0.05 0.00 0.00 61.00 61.76 2jty s PRO 145 Cb -0.13 -1.79 0.00 0.00 0.05 0.00 0.00 34.50 32.62 2jty s PRO 145 CO 0.54 -2.52 0.00 0.41 0.05 0.00 0.00 177.00 175.48 2jty n GLY 146 N -2.21 1.02 3.77 0.56 0.00 -0.13 -4.15 105.19 104.05 2jty n GLY 146 Ca 0.09 -2.12 -0.41 0.00 0.00 0.00 0.00 46.02 43.58 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 -1.03 3.48 -0.49 4.61 0.00 -1.26 -1.12 121.76 125.95 2jty s ALA 147 Ca 0.00 1.48 0.06 0.00 0.00 0.00 0.00 51.96 53.51 2jty s ALA 147 Cb 0.00 -3.58 0.22 0.00 0.00 0.00 0.00 23.12 19.77 2jty s ALA 147 CO 0.00 -1.00 0.53 0.00 0.00 0.00 0.00 175.76 175.29 2jty n ALA 148 N 0.37 3.03 -2.57 0.00 0.00 -0.77 -0.80 120.51 119.77 2jty n ALA 148 Ca 0.02 -3.80 -0.24 0.00 0.00 0.00 0.00 53.44 49.42 2jty n ALA 148 Cb 0.40 -0.84 -0.09 0.00 0.00 0.00 0.00 19.45 18.92 2jty n ALA 148 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2jty s ASN 149 N -1.26 4.18 0.15 0.00 0.01 -1.26 -2.72 114.94 114.04 2jty s ASN 149 Ca 0.35 -0.75 -0.21 0.00 -0.71 0.00 0.00 52.86 51.54 2jty s ASN 149 Cb 0.11 -0.65 0.06 0.00 0.41 0.00 0.00 41.25 41.18 2jty s ASN 149 CO -0.11 0.04 0.54 0.00 -1.51 0.00 0.00 177.10 176.06 2jty s ALA 150 N -2.23 -1.37 -0.13 0.60 0.00 0.31 -0.63 121.76 118.31 2jty s ALA 150 Ca 0.29 0.28 -0.02 0.00 0.00 0.00 0.00 51.96 52.52 2jty s ALA 150 Cb -0.07 0.83 0.04 0.00 0.00 0.00 0.00 23.12 23.92 2jty s ALA 150 CO 0.17 -0.74 -0.01 0.16 0.00 0.00 0.00 175.76 175.34 2jty s ASP 151 N -2.78 2.27 0.29 0.00 -4.77 -1.26 -0.72 116.67 109.70 2jty s ASP 151 Ca 0.02 -0.43 0.07 0.00 -3.30 0.00 0.00 52.55 48.91 2jty s ASP 151 Cb -0.00 -0.62 -0.06 0.00 -1.09 0.00 0.00 42.92 41.15 2jty s ASP 151 CO -0.12 -0.22 -0.06 0.00 0.70 0.00 0.00 175.17 175.47 2jty s ALA 152 N 1.85 2.41 0.23 2.11 0.00 -0.59 -4.52 121.76 123.25 2jty s ALA 152 Ca 0.02 -1.92 0.11 0.00 0.00 0.00 0.00 51.96 50.18 2jty s ALA 152 Cb -0.14 0.16 -0.05 0.00 0.00 0.00 0.00 23.12 23.09 2jty s ALA 152 CO -0.07 -0.05 -0.20 0.95 0.00 0.00 0.00 175.76 176.39 2jty s THR 153 N -2.96 2.53 0.06 0.00 -4.23 -0.83 -0.66 115.64 109.54 2jty s THR 153 Ca 0.30 -2.17 0.07 0.00 -1.18 0.00 0.00 61.69 58.72 2jty s THR 153 Cb 0.03 -2.27 -0.03 0.00 1.34 0.00 0.00 72.50 71.56 2jty s THR 153 CO 0.12 -0.25 -0.17 0.72 -0.54 0.00 0.00 174.62 174.50 2jty s PHE 154 N -2.08 2.57 0.44 3.99 -0.71 0.42 -1.66 117.98 120.95 2jty s PHE 154 Ca 0.26 -0.25 0.08 0.00 -1.04 0.00 0.00 56.93 55.98 2jty s PHE 154 Cb -0.07 -1.43 0.00 0.00 -1.21 0.00 0.00 43.02 40.31 2jty s PHE 154 CO 0.13 0.30 0.47 0.15 -1.34 0.00 0.00 175.22 174.93 2jty s LYS 155 N -1.67 2.58 -0.07 1.99 1.02 0.45 -1.16 119.74 122.88 2jty s LYS 155 Ca 0.16 -1.50 0.02 0.00 0.02 0.00 0.00 55.97 54.67 2jty s LYS 155 Cb -0.11 -2.49 0.02 0.00 -0.52 0.00 0.00 37.83 34.73 2jty s LYS 155 CO 0.07 -0.30 -0.11 0.08 -0.92 0.00 0.00 175.35 174.17 2jty s VAL 156 N -2.47 1.08 -0.50 3.17 1.01 0.54 -2.16 120.40 121.07 2jty s VAL 156 Ca 0.50 -0.42 0.03 0.00 0.00 0.00 0.00 61.98 62.09 2jty s VAL 156 Cb -0.05 -1.01 0.15 0.00 0.00 0.00 0.00 36.38 35.47 2jty s VAL 156 CO 0.30 0.35 0.33 -1.58 0.00 0.00 0.00 175.10 174.50 2jty s GLN 157 N 0.86 1.46 0.58 2.72 0.74 0.28 -0.35 119.66 125.95 2jty s GLN 157 Ca -0.11 -2.36 -0.18 0.00 0.05 0.00 0.00 55.36 52.76 2jty s GLN 157 Cb -0.15 -2.32 -0.04 0.00 1.10 0.00 0.00 33.01 31.61 2jty s GLN 157 CO 0.01 -1.26 1.12 0.71 -0.55 0.00 0.00 175.29 175.32 2jty s TYR 158 N -0.18 2.68 0.30 1.67 2.02 -0.86 -1.26 117.35 121.71 2jty s TYR 158 Ca 0.24 1.55 -0.20 0.00 -0.37 0.00 0.00 57.07 58.29 2jty s TYR 158 Cb -0.11 -3.23 0.04 0.00 -0.40 0.00 0.00 41.96 38.27 2jty s TYR 158 CO -0.10 -1.57 0.81 1.14 -1.57 0.00 0.00 175.55 174.26 2jty s GLN 159 N -3.60 1.84 0.00 -0.62 -2.07 -0.30 -0.92 119.66 113.99 2jty s GLN 159 Ca 0.70 -1.11 0.00 0.00 -1.82 0.00 0.00 55.36 53.13 2jty s GLN 159 Cb -0.22 0.57 0.00 0.00 -1.09 0.00 0.00 33.01 32.27 2jty s GLN 159 CO 0.32 -0.86 0.00 0.41 -1.32 0.00 0.00 175.29 173.85 2jty n GLY 160 N -0.51 2.10 3.37 2.60 0.00 -1.26 -0.22 105.19 111.27 2jty n GLY 160 Ca -0.06 -0.21 -0.45 0.00 0.00 0.00 0.00 46.02 45.31 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 1.83 0.00 -0.02 0.00 -1.26 -4.83 107.32 103.03 2jty s GLY 161 Ca 0.00 -2.31 0.00 0.00 0.00 0.00 0.00 44.72 42.41 2jty s GLY 161 CO 0.00 1.58 0.00 0.61 0.00 0.00 0.00 173.10 175.29 2jty n GLY 162 N 5.23 1.88 0.22 0.20 0.00 -1.26 -4.91 105.19 106.56 2jty n GLY 162 Ca -0.07 -0.92 0.11 0.00 0.00 0.00 0.00 46.02 45.14 2jty n GLY 162 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2jty h GLY 163 N 0.00 0.00 0.00 -0.02 0.00 -1.96 -3.48 103.07 97.61 2jty h GLY 163 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2jty h GLY 163 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2jty n GLY 164 N 0.45 3.51 0.00 4.60 0.00 -1.26 -5.09 105.19 107.41 2jty n GLY 164 Ca 0.01 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.20 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 0.00 0.67 3.15 -0.02 0.00 -1.26 -5.13 105.19 102.60 2jty n GLY 165 Ca 0.00 -0.69 0.05 0.00 0.00 0.00 0.00 46.02 45.38 2jty n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jty s ALA 166 N -0.99 -3.40 0.19 4.61 0.00 -1.26 -5.13 121.76 115.77 2jty s ALA 166 Ca 0.00 1.45 -0.16 0.00 0.00 0.00 0.00 51.96 53.25 2jty s ALA 166 Cb 0.00 -2.51 0.02 0.00 0.00 0.00 0.00 23.12 20.63 2jty s ALA 166 CO 0.00 -1.52 0.47 0.00 0.00 0.00 0.00 175.76 174.71 2jty s ALA 167 N 2.95 -0.73 -0.49 0.00 0.00 -1.26 -4.61 121.76 117.62 2jty s ALA 167 Ca 0.03 -0.37 0.04 0.00 0.00 0.00 0.00 51.96 51.65 2jty s ALA 167 Cb -0.10 0.85 0.13 0.00 0.00 0.00 0.00 23.12 24.01 2jty s ALA 167 CO -0.13 -0.77 0.24 0.99 0.00 0.00 0.00 175.76 176.09 2jty s THR 168 N -3.90 2.30 -0.22 0.00 2.01 -0.10 -4.97 115.64 110.77 2jty s THR 168 Ca 0.11 -3.08 -0.27 0.00 0.31 0.00 0.00 61.69 58.76 2jty s THR 168 Cb -0.00 -2.61 0.00 0.00 0.01 0.00 0.00 72.50 69.90 2jty s THR 168 CO -0.02 -0.80 0.94 -0.89 -0.69 0.00 0.00 174.62 173.15 2jty s THR 169 N -0.06 4.76 0.14 -0.82 2.01 -1.26 -2.02 115.64 118.40 2jty s THR 169 Ca 0.17 1.81 0.05 0.00 0.31 0.00 0.00 61.69 64.03 2jty s THR 169 Cb -0.25 -4.22 -0.04 0.00 0.01 0.00 0.00 72.50 68.00 2jty s THR 169 CO -0.01 -0.11 -0.12 0.68 -0.69 0.00 0.00 174.62 174.37 2jty s VAL 170 N 2.92 1.27 0.30 3.82 -7.23 0.53 -4.99 120.40 117.02 2jty s VAL 170 Ca 0.40 -1.96 -0.27 0.00 -1.81 0.00 0.00 61.98 58.33 2jty s VAL 170 Cb -0.15 -1.76 -0.10 0.00 0.56 0.00 0.00 36.38 34.93 2jty s VAL 170 CO 0.08 -0.63 0.96 0.20 -0.31 0.00 0.00 175.10 175.40 2jty s ASN 171 N -2.96 7.38 0.00 4.85 0.01 -1.26 -0.34 114.94 122.62 2jty s ASN 171 Ca 0.15 1.91 0.00 0.00 -0.71 0.00 0.00 52.86 54.21 2jty s ASN 171 Cb -0.00 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 39.07 2jty s ASN 171 CO 0.02 -0.04 0.00 0.61 -1.51 0.00 0.00 177.10 176.18 2jty n GLY 172 N 0.84 -0.30 1.68 0.66 0.00 -0.31 -4.70 105.19 103.06 2jty n GLY 172 Ca 0.01 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.04 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 2.28 0.53 3.86 -0.02 0.00 -0.68 -4.82 105.19 106.35 2jty n GLY 173 Ca 0.00 -0.94 -0.36 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.13 5.34 -0.28 2.61 2.01 0.60 -0.43 115.64 123.35 2jty s THR 174 Ca 0.12 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.17 2jty s THR 174 Cb -0.00 -3.37 0.08 0.00 0.01 0.00 0.00 72.50 69.22 2jty s THR 174 CO 0.00 0.53 0.03 -0.69 -0.69 0.00 0.00 174.62 173.80 2jty s VAL 175 N -1.10 1.35 -0.67 3.82 1.01 0.16 -2.51 120.40 122.47 2jty s VAL 175 Ca 0.18 -1.45 -0.17 0.00 0.00 0.00 0.00 61.98 60.54 2jty s VAL 175 Cb -0.12 -1.85 0.13 0.00 0.00 0.00 0.00 36.38 34.54 2jty s VAL 175 CO 0.08 -0.42 0.73 -1.00 0.00 0.00 0.00 175.10 174.49 2jty s HIS 176 N 1.42 3.20 0.01 5.22 0.09 -0.26 -1.54 115.29 123.43 2jty s HIS 176 Ca 0.04 -1.27 -0.30 0.00 -0.00 0.00 0.00 55.06 53.52 2jty s HIS 176 Cb -0.18 -3.97 -0.05 0.00 -0.00 0.00 0.00 32.58 28.38 2jty s HIS 176 CO -0.14 -1.21 1.27 -0.06 -0.00 0.00 0.00 174.74 174.61 2jty s PHE 177 N 2.00 3.18 0.15 1.40 0.08 0.10 -1.07 117.98 123.81 2jty s PHE 177 Ca 0.13 1.11 0.06 0.00 0.12 0.00 0.00 56.93 58.36 2jty s PHE 177 Cb -0.20 -3.51 -0.04 0.00 -0.57 0.00 0.00 43.02 38.69 2jty s PHE 177 CO 0.01 -1.71 -0.14 0.15 -0.10 0.00 0.00 175.22 173.43 2jty s LYS 178 N 1.81 1.12 0.00 0.44 -0.14 -0.05 -0.53 119.74 122.39 2jty s LYS 178 Ca 0.60 -1.36 0.00 0.00 -1.36 0.00 0.00 55.97 53.85 2jty s LYS 178 Cb -0.29 -0.95 0.00 0.00 -1.68 0.00 0.00 37.83 34.91 2jty s LYS 178 CO 0.26 0.17 0.00 0.41 -0.76 0.00 0.00 175.35 175.43 2jty n GLY 179 N 0.22 0.81 3.78 -3.33 0.00 -1.10 -0.62 105.19 104.94 2jty n GLY 179 Ca -0.13 -1.79 -0.05 0.00 0.00 0.00 0.00 46.02 44.05 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 1.42 -0.16 1.61 2.12 -0.85 -1.86 118.70 118.98 2jty s GLU 180 Ca 0.00 -0.77 0.00 0.00 0.36 0.00 0.00 54.97 54.56 2jty s GLU 180 Cb 0.00 0.50 0.00 0.00 0.26 0.00 0.00 34.13 34.89 2jty s GLU 180 CO 0.00 -0.65 -0.16 0.08 -0.54 0.00 0.00 175.26 173.99 2jty s VAL 181 N -3.55 2.59 0.13 3.70 1.01 -0.27 -1.52 120.40 122.49 2jty s VAL 181 Ca 0.11 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.33 2jty s VAL 181 Cb -0.03 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 2jty s VAL 181 CO 0.03 0.51 0.17 0.68 0.00 0.00 0.00 175.10 176.50 2jty s VAL 182 N 0.90 4.81 -0.43 2.92 -7.23 0.76 -0.95 120.40 121.17 2jty s VAL 182 Ca -0.04 -0.84 0.00 0.00 -1.81 0.00 0.00 61.98 59.29 2jty s VAL 182 Cb -0.15 -3.42 0.00 0.00 0.56 0.00 0.00 36.38 33.37 2jty s VAL 182 CO -0.02 -0.03 0.59 -3.20 -0.31 0.00 0.00 175.10 172.13 2jty n ASN 183 N -0.16 1.60 0.00 4.85 4.05 -1.26 -0.99 115.26 123.36 2jty n ASN 183 Ca -0.08 -1.50 0.00 0.00 0.45 0.00 0.00 54.58 53.45 2jty n ASN 183 Cb 0.53 -0.38 0.00 0.00 1.23 0.00 0.00 39.78 41.17 2jty n ASN 183 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21