#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 -0.85 -2.74 0.00 0.00 -1.26 -5.19 120.51 110.48 2jty n ALA 2 Ca 0.00 -1.25 -0.08 0.00 0.00 0.00 0.00 53.44 52.10 2jty n ALA 2 Cb 0.00 1.00 -0.11 0.00 0.00 0.00 0.00 19.45 20.35 2jty n ALA 2 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2jty s THR 3 N -2.52 0.14 -0.04 0.00 -1.32 -1.26 -5.03 115.64 105.62 2jty s THR 3 Ca 0.20 -1.15 0.06 0.00 -1.21 0.00 0.00 61.69 59.58 2jty s THR 3 Cb -0.02 -0.61 0.09 0.00 -1.51 0.00 0.00 72.50 70.44 2jty s THR 3 CO 0.14 -0.64 1.04 0.41 -2.21 0.00 0.00 174.62 173.37 2jty n THR 4 N 1.18 0.54 -1.71 5.08 -1.04 -1.26 -5.10 114.28 111.97 2jty n THR 4 Ca -0.21 -0.66 -0.40 0.00 -2.04 0.00 0.00 64.05 60.74 2jty n THR 4 Cb 0.57 0.29 0.02 0.00 -1.82 0.00 0.00 70.33 69.40 2jty n THR 4 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 2jty n VAL 5 N -0.40 3.03 -3.85 12.58 3.14 -1.26 -5.04 118.33 126.53 2jty n VAL 5 Ca 0.05 -0.50 -0.09 0.00 -2.96 0.00 0.00 64.34 60.84 2jty n VAL 5 Cb 0.69 -1.60 -0.07 0.00 -1.06 0.00 0.00 33.84 31.79 2jty n VAL 5 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 2jty s ASN 6 N -0.68 0.10 0.00 6.55 3.84 -1.26 -5.11 114.94 118.38 2jty s ASN 6 Ca 0.65 -0.62 0.00 0.00 0.21 0.00 0.00 52.86 53.10 2jty s ASN 6 Cb -0.47 0.34 0.00 0.00 -0.55 0.00 0.00 41.25 40.58 2jty s ASN 6 CO 0.55 -0.72 0.00 0.61 -2.79 0.00 0.00 177.10 174.74 2jty n GLY 7 N -0.02 0.53 0.00 1.21 0.00 -1.26 -4.75 105.19 100.91 2jty n GLY 7 Ca -0.15 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.42 2jty n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jty n GLY 8 N 0.00 1.31 2.73 -0.02 0.00 -1.26 -4.97 105.19 102.98 2jty n GLY 8 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 0.26 0.00 2.61 -1.32 -1.26 -5.10 115.64 110.83 2jty s THR 9 Ca 0.00 0.04 0.00 0.00 -1.21 0.00 0.00 61.69 60.52 2jty s THR 9 Cb 0.00 -0.55 0.00 0.00 -1.51 0.00 0.00 72.50 70.44 2jty s THR 9 CO 0.00 0.11 0.00 0.55 -2.21 0.00 0.00 174.62 173.07 2jty n VAL 10 N 5.18 -0.18 0.00 5.08 3.14 -1.26 -4.95 118.33 125.34 2jty n VAL 10 Ca -0.07 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.32 2jty n VAL 10 Cb 0.49 -0.42 0.00 0.00 -1.06 0.00 0.00 33.84 32.85 2jty n VAL 10 CO 0.00 0.00 0.00 1.41 -6.46 0.00 0.00 176.83 171.78 2jty n HIS 11 N 1.23 0.00 -2.19 1.45 8.25 -1.26 -5.02 115.22 117.68 2jty n HIS 11 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2jty n HIS 11 Cb 0.00 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.11 2jty n HIS 11 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2jty n PHE 12 N 0.00 0.00 0.00 4.41 7.35 -1.26 -5.09 117.46 122.87 2jty n PHE 12 Ca 0.00 -0.28 0.00 0.00 -0.76 0.00 0.00 57.45 56.41 2jty n PHE 12 Cb 0.00 0.06 0.00 0.00 0.35 0.00 0.00 39.48 39.89 2jty n PHE 12 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 2jty n LYS 13 N 0.19 0.00 -2.70 -4.13 5.02 -1.26 -1.75 118.16 113.53 2jty n LYS 13 Ca -0.03 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.19 2jty n LYS 13 Cb 0.84 0.00 0.11 0.00 -0.02 0.00 0.00 35.03 35.96 2jty n LYS 13 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jty n GLY 14 N 0.00 1.34 0.00 0.72 0.00 -1.26 -5.14 105.19 100.86 2jty n GLY 14 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2jty n GLY 14 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2jty n GLU 15 N -0.52 0.00 -2.59 1.61 0.28 -0.72 -5.02 120.64 113.68 2jty n GLU 15 Ca -0.01 0.00 -0.05 0.00 -0.16 0.00 0.00 57.16 56.94 2jty n GLU 15 Cb 0.84 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.71 2jty n GLU 15 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 2jty n VAL 16 N 1.10 -0.62 0.21 3.84 0.31 -1.26 -4.73 118.33 117.18 2jty n VAL 16 Ca 0.00 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2jty n VAL 16 Cb 0.00 -0.56 0.00 0.00 -0.91 0.00 0.00 33.84 32.37 2jty n VAL 16 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2jty n VAL 17 N -0.80 1.20 -3.50 2.52 0.31 -1.26 -4.40 118.33 112.40 2jty n VAL 17 Ca -0.06 -0.20 -0.16 0.00 -0.01 0.00 0.00 64.34 63.92 2jty n VAL 17 Cb 0.13 -1.15 -0.12 0.00 -0.91 0.00 0.00 33.84 31.79 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 1.50 0.98 0.00 4.52 0.01 -1.26 -5.02 114.94 115.66 2jty s ASN 18 Ca 0.00 0.02 0.21 0.00 -0.71 0.00 0.00 52.86 52.38 2jty s ASN 18 Cb 0.00 0.57 0.35 0.00 0.41 0.00 0.00 41.25 42.58 2jty s ASN 18 CO 0.00 -0.30 1.14 0.00 -1.51 0.00 0.00 177.10 176.42 2jty n ALA 19 N 5.33 2.46 0.00 0.60 0.00 -1.26 -4.81 120.51 122.83 2jty n ALA 19 Ca -0.05 -2.07 0.00 0.00 0.00 0.00 0.00 53.44 51.31 2jty n ALA 19 Cb 0.50 -0.68 0.00 0.00 0.00 0.00 0.00 19.45 19.27 2jty n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jty n ALA 20 N 0.41 0.00 -2.17 0.00 0.00 -1.26 -4.58 120.51 112.91 2jty n ALA 20 Ca 0.02 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.25 2jty n ALA 20 Cb 1.07 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.53 2jty n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jty s ALA 22 N -2.57 3.30 0.20 0.00 0.00 0.75 -4.92 121.76 118.51 2jty s ALA 22 Ca 0.50 -2.31 -0.32 0.00 0.00 0.00 0.00 51.96 49.82 2jty s ALA 22 Cb -0.05 -2.67 -0.13 0.00 0.00 0.00 0.00 23.12 20.28 2jty s ALA 22 CO 0.30 -1.74 1.64 1.55 0.00 0.00 0.00 175.76 177.51 2jty n VAL 23 N 4.87 0.17 -1.75 0.00 3.14 -1.26 -0.44 118.33 123.06 2jty n VAL 23 Ca -0.09 -0.04 -0.34 0.00 -2.96 0.00 0.00 64.34 60.91 2jty n VAL 23 Cb 0.42 -1.81 0.05 0.00 -1.06 0.00 0.00 33.84 31.45 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 0.96 4.94 0.47 6.55 -1.08 -0.44 -4.82 116.67 123.25 2jty s ASP 24 Ca 0.75 2.15 0.19 0.00 -0.52 0.00 0.00 52.55 55.12 2jty s ASP 24 Cb -0.57 -2.57 1.19 0.00 -1.46 0.00 0.00 42.92 39.51 2jty s ASP 24 CO 0.37 -1.75 1.97 0.00 0.52 0.00 0.00 175.17 176.28 2jty h ALA 25 N 0.16 2.24 0.00 3.66 0.00 -1.92 -1.14 119.26 122.26 2jty h ALA 25 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2jty h ALA 25 Cb 1.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2jty h ALA 25 CO 0.53 -0.40 0.00 0.41 0.00 0.00 0.00 179.25 179.79 2jty n GLY 26 N -1.57 -0.39 0.00 0.00 0.00 -1.26 -3.53 105.19 98.44 2jty n GLY 26 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2jty n GLY 26 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jty n SER 27 N -0.77 0.00 -0.35 1.61 7.64 -0.54 -4.85 113.62 116.37 2jty n SER 27 Ca 0.05 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.91 2jty n SER 27 Cb 0.02 0.00 0.12 0.00 -1.01 0.00 0.00 64.21 63.34 2jty n SER 27 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 2jty h VAL 28 N 0.00 1.25 -2.04 0.44 3.04 -1.32 -3.35 116.25 114.27 2jty h VAL 28 Ca 0.00 -0.52 -0.55 0.00 -1.01 0.00 0.00 66.70 64.62 2jty h VAL 28 Cb 0.00 -0.10 -0.40 0.00 -2.01 0.00 0.00 31.29 28.78 2jty h VAL 28 CO 0.00 0.26 -1.04 -0.67 -1.01 0.00 0.00 177.57 175.11 2jty n ASP 29 N -4.37 1.05 -4.60 3.17 2.03 -1.25 -0.62 116.55 111.96 2jty n ASP 29 Ca 0.11 -2.92 -0.34 0.00 0.52 0.00 0.00 54.79 52.16 2jty n ASP 29 Cb 0.04 -0.63 -0.11 0.00 -0.72 0.00 0.00 41.12 39.70 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 -1.78 2.78 -0.44 -0.67 -2.07 -1.01 -4.99 119.66 111.48 2jty s GLN 30 Ca 0.38 -0.53 -0.06 0.00 -1.82 0.00 0.00 55.36 53.32 2jty s GLN 30 Cb 0.22 -2.62 0.11 0.00 -1.09 0.00 0.00 33.01 29.63 2jty s GLN 30 CO -0.09 0.67 0.27 0.99 -1.32 0.00 0.00 175.29 175.81 2jty s THR 31 N -0.83 3.76 -0.63 3.63 2.01 -1.26 -1.05 115.64 121.27 2jty s THR 31 Ca 0.13 -1.91 -0.27 0.00 0.31 0.00 0.00 61.69 59.95 2jty s THR 31 Cb -0.11 -3.52 0.01 0.00 0.01 0.00 0.00 72.50 68.90 2jty s THR 31 CO 0.02 -0.73 1.46 -0.69 -0.69 0.00 0.00 174.62 173.99 2jty s VAL 32 N 1.26 3.67 -0.89 3.82 1.01 -0.50 -4.91 120.40 123.86 2jty s VAL 32 Ca 0.07 0.48 -0.22 0.00 0.00 0.00 0.00 61.98 62.31 2jty s VAL 32 Cb -0.24 -4.50 0.08 0.00 0.00 0.00 0.00 36.38 31.71 2jty s VAL 32 CO -0.02 -1.36 1.23 -1.10 0.00 0.00 0.00 175.10 173.84 2jty s GLN 33 N 5.91 3.45 0.36 2.72 -0.21 -1.26 -0.90 119.66 129.73 2jty s GLN 33 Ca 0.49 -1.17 0.27 0.00 0.02 0.00 0.00 55.36 54.97 2jty s GLN 33 Cb -0.10 -4.84 1.14 0.00 1.00 0.00 0.00 33.01 30.20 2jty s GLN 33 CO 0.21 -1.98 1.81 -0.07 -2.12 0.00 0.00 175.29 173.14 2jty h LEU 34 N 11.74 0.00 0.00 2.90 3.38 -0.88 -3.48 115.31 128.97 2jty h LEU 34 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2jty h LEU 34 Cb 1.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.78 2jty h LEU 34 CO 1.25 0.00 0.00 0.61 0.09 0.00 0.00 178.44 180.39 2jty n GLY 35 N -0.05 -1.27 3.79 0.83 0.00 -1.24 -4.85 105.19 102.41 2jty n GLY 35 Ca 0.01 -1.16 -0.34 0.00 0.00 0.00 0.00 46.02 44.53 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 0.00 3.48 0.03 1.61 -0.21 -1.26 -1.84 119.66 121.47 2jty s GLN 36 Ca 0.00 1.33 0.02 0.00 0.02 0.00 0.00 55.36 56.73 2jty s GLN 36 Cb 0.00 -2.05 -0.02 0.00 1.00 0.00 0.00 33.01 31.94 2jty s GLN 36 CO 0.00 -0.70 -0.08 0.08 -2.12 0.00 0.00 175.29 172.48 2jty s VAL 37 N -2.17 0.56 0.00 1.09 1.01 -0.67 -4.90 120.40 115.33 2jty s VAL 37 Ca 0.66 -0.87 -0.27 0.00 0.00 0.00 0.00 61.98 61.50 2jty s VAL 37 Cb -0.17 -0.58 -0.04 0.00 0.00 0.00 0.00 36.38 35.58 2jty s VAL 37 CO 0.29 -0.23 0.86 -0.13 0.00 0.00 0.00 175.10 175.89 2jty s ARG 38 N -1.20 4.53 0.56 2.72 0.52 -1.26 -0.33 118.95 124.50 2jty s ARG 38 Ca -0.06 1.21 0.25 0.00 -0.52 0.00 0.00 55.73 56.61 2jty s ARG 38 Cb -0.08 -3.43 1.52 0.00 0.52 0.00 0.00 34.95 33.48 2jty s ARG 38 CO 0.00 0.07 2.09 1.79 0.02 0.00 0.00 175.30 179.28 2jty h THR 39 N 4.57 0.65 -0.74 0.02 1.35 -1.33 -1.22 112.91 116.22 2jty h THR 39 Ca -0.42 0.00 0.11 0.00 -0.55 0.00 0.00 66.41 65.55 2jty h THR 39 Cb 1.21 0.86 -0.05 0.00 -1.73 0.00 0.00 68.15 68.44 2jty h THR 39 CO 0.74 0.00 0.49 0.00 -0.25 0.00 0.00 175.52 176.50 2jty h ALA 40 N 1.82 1.91 0.00 6.62 0.00 -1.85 0.12 119.26 127.88 2jty h ALA 40 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2jty h ALA 40 Cb 0.49 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2jty h ALA 40 CO -0.00 -0.08 0.00 0.43 0.00 0.00 0.00 179.25 179.60 2jty n SER 41 N -4.49 0.00 -3.18 0.00 7.64 -0.46 -4.49 113.62 108.64 2jty n SER 41 Ca 0.13 -0.65 -0.22 0.00 1.01 0.00 0.00 58.87 59.14 2jty n SER 41 Cb 0.39 -0.08 -0.06 0.00 -1.01 0.00 0.00 64.21 63.45 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 -1.08 -0.67 0.00 -3.43 4.77 0.41 -2.94 117.00 114.07 2jty n LEU 42 Ca 0.18 -4.30 0.00 0.00 -0.03 0.00 0.00 56.01 51.87 2jty n LEU 42 Cb 0.12 0.64 0.00 0.00 -2.33 0.00 0.00 43.42 41.86 2jty n LEU 42 CO 0.17 1.98 0.05 0.00 -1.33 0.00 0.00 177.39 178.26 2jty n ALA 43 N 2.03 1.17 -3.00 -1.18 0.00 -1.25 -1.32 120.51 116.97 2jty n ALA 43 Ca 0.22 -0.10 -0.10 0.00 0.00 0.00 0.00 53.44 53.47 2jty n ALA 43 Cb 0.53 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.92 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 -0.35 1.22 0.30 0.00 0.00 -0.98 -3.00 119.66 116.85 2jty s GLN 44 Ca 0.00 -0.95 -0.30 0.00 -0.00 0.00 0.00 55.36 54.11 2jty s GLN 44 Cb 0.00 0.45 -0.11 0.00 0.00 0.00 0.00 33.01 33.35 2jty s GLN 44 CO 0.00 -0.48 1.54 -2.00 0.00 0.00 0.00 175.29 174.35 2jty s GLU 45 N -3.89 4.15 0.00 9.60 2.12 -1.25 -1.89 118.70 127.53 2jty s GLU 45 Ca 0.11 2.53 0.00 0.00 0.36 0.00 0.00 54.97 57.96 2jty s GLU 45 Cb 0.01 -3.03 0.00 0.00 0.26 0.00 0.00 34.13 31.38 2jty s GLU 45 CO -0.04 -0.57 0.00 0.41 -0.54 0.00 0.00 175.26 174.52 2jty n GLY 46 N 1.80 1.51 3.68 -1.50 0.00 0.45 -4.85 105.19 106.27 2jty n GLY 46 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 2jty n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jty n ALA 47 N 0.25 0.52 -2.73 4.61 0.00 -0.79 -4.84 120.51 117.53 2jty n ALA 47 Ca 0.00 -0.08 -0.09 0.00 0.00 0.00 0.00 53.44 53.27 2jty n ALA 47 Cb 0.00 -2.23 -0.09 0.00 0.00 0.00 0.00 19.45 17.13 2jty n ALA 47 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2jty s THR 48 N -1.58 0.13 1.26 0.00 -4.23 -1.15 -0.56 115.64 109.51 2jty s THR 48 Ca 0.79 -1.09 -0.19 0.00 -1.18 0.00 0.00 61.69 60.02 2jty s THR 48 Cb -0.37 -0.85 0.31 0.00 1.34 0.00 0.00 72.50 72.93 2jty s THR 48 CO 0.45 -0.60 1.03 -0.55 -0.54 0.00 0.00 174.62 174.40 2jty s SER 49 N -2.07 0.35 0.00 3.99 0.15 -0.04 -4.67 113.70 111.41 2jty s SER 49 Ca -0.06 0.92 0.00 0.00 0.70 0.00 0.00 55.95 57.51 2jty s SER 49 Cb -0.02 -1.35 0.00 0.00 -1.71 0.00 0.00 66.02 62.94 2jty s SER 49 CO -0.04 -4.51 0.39 -0.24 1.20 0.00 0.00 173.24 170.04 2jty n SER 50 N -5.06 0.00 0.00 5.45 2.88 -1.26 -4.86 113.62 110.77 2jty n SER 50 Ca 0.10 0.39 0.00 0.00 -1.33 0.00 0.00 58.87 58.03 2jty n SER 50 Cb 0.59 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.05 2jty n SER 50 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jty n ALA 51 N -1.23 0.00 -2.97 -1.46 0.00 -1.26 -5.05 120.51 108.53 2jty n ALA 51 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 2jty n ALA 51 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 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 -2.00 0.10 -0.00 0.00 1.01 0.33 -4.99 120.40 114.84 2jty s VAL 52 Ca 0.00 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.18 2jty s VAL 52 Cb 0.00 -0.64 -0.03 0.00 0.00 0.00 0.00 36.38 35.70 2jty s VAL 52 CO 0.00 -0.45 -0.04 -0.83 0.00 0.00 0.00 175.10 173.78 2jty s GLY 53 N -1.70 1.81 0.05 4.51 0.00 -1.26 -0.29 107.32 110.43 2jty s GLY 53 Ca -0.11 -0.98 -0.02 0.00 0.00 0.00 0.00 44.72 43.62 2jty s GLY 53 CO -0.01 -0.84 0.00 -0.11 0.00 0.00 0.00 173.10 172.15 2jty s PHE 54 N -1.02 0.41 0.19 1.90 -0.71 -0.81 -4.92 117.98 113.01 2jty s PHE 54 Ca 0.18 -0.87 -0.03 0.00 -1.04 0.00 0.00 56.93 55.17 2jty s PHE 54 Cb -0.11 -0.30 -0.03 0.00 -1.21 0.00 0.00 43.02 41.36 2jty s PHE 54 CO 0.08 -0.36 0.16 0.54 -1.34 0.00 0.00 175.22 174.30 2jty s ASN 55 N -2.58 0.15 -0.59 1.98 2.20 -1.26 -0.07 114.94 114.77 2jty s ASN 55 Ca 0.02 -1.28 -0.04 0.00 -0.94 0.00 0.00 52.86 50.61 2jty s ASN 55 Cb 0.04 0.39 0.15 0.00 -2.00 0.00 0.00 41.25 39.83 2jty s ASN 55 CO -0.08 -0.85 0.42 -0.63 -2.94 0.00 0.00 177.10 173.02 2jty s ILE 56 N -4.11 3.80 -0.13 0.54 -1.09 -0.53 -4.85 121.20 114.82 2jty s ILE 56 Ca 0.33 -2.71 -0.29 0.00 -2.23 0.00 0.00 60.65 55.75 2jty s ILE 56 Cb 0.06 -3.49 -0.03 0.00 -1.58 0.00 0.00 42.46 37.42 2jty s ILE 56 CO 0.09 -0.85 1.52 -1.58 -1.23 0.00 0.00 174.94 172.89 2jty s GLN 57 N 0.24 4.10 -0.09 2.79 0.74 -1.26 -2.59 119.66 123.58 2jty s GLN 57 Ca 0.15 1.88 0.04 0.00 0.05 0.00 0.00 55.36 57.48 2jty s GLN 57 Cb -0.20 -3.93 -0.01 0.00 1.10 0.00 0.00 33.01 29.97 2jty s GLN 57 CO -0.04 -0.92 -0.22 -0.51 -0.55 0.00 0.00 175.29 173.05 2jty s LEU 58 N 4.16 2.21 0.34 3.68 1.43 0.05 -1.32 118.68 129.23 2jty s LEU 58 Ca 0.67 -0.49 0.09 0.00 -1.03 0.00 0.00 54.13 53.37 2jty s LEU 58 Cb -0.27 -1.44 -0.05 0.00 0.03 0.00 0.00 46.19 44.46 2jty s LEU 58 CO 0.25 0.20 -0.00 0.20 0.23 0.00 0.00 176.35 177.22 2jty s ASN 59 N 0.13 4.13 -1.28 2.29 0.01 0.41 -1.66 114.94 118.97 2jty s ASN 59 Ca -0.11 -1.01 -0.02 0.00 -0.71 0.00 0.00 52.86 51.00 2jty s ASN 59 Cb -0.16 -0.51 0.01 0.00 0.41 0.00 0.00 41.25 41.00 2jty s ASN 59 CO 0.06 -0.23 0.17 -0.67 -1.51 0.00 0.00 177.10 174.93 2jty n ASP 60 N -0.93 -4.49 -4.81 -1.22 2.03 -1.25 -0.18 116.55 105.71 2jty n ASP 60 Ca -0.04 -0.01 -0.33 0.00 0.52 0.00 0.00 54.79 54.93 2jty n ASP 60 Cb 0.62 -3.75 -0.00 0.00 -0.72 0.00 0.00 41.12 37.27 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 -2.63 2.28 0.36 0.00 -1.08 -0.97 -2.09 116.67 112.54 2jty s ASP 62 Ca 0.64 -0.39 0.27 0.00 -0.52 0.00 0.00 52.55 52.55 2jty s ASP 62 Cb -0.15 -1.01 0.96 0.00 -1.46 0.00 0.00 42.92 41.25 2jty s ASP 62 CO 0.32 0.01 1.79 0.71 0.52 0.00 0.00 175.17 178.52 2jty h THR 63 N 5.98 0.00 -0.46 1.71 1.35 -1.81 -2.95 112.91 116.73 2jty h THR 63 Ca -0.31 -0.49 0.02 0.00 -0.55 0.00 0.00 66.41 65.09 2jty h THR 63 Cb 1.17 1.40 -0.03 0.00 -1.73 0.00 0.00 68.15 68.96 2jty h THR 63 CO 0.48 0.00 0.27 0.78 -0.25 0.00 0.00 175.52 176.80 2jty h ASN 64 N 0.00 0.44 -0.08 5.36 2.35 -1.97 -3.06 115.58 118.62 2jty h ASN 64 Ca 0.00 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.67 2jty h ASN 64 Cb 0.59 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.87 2jty h ASN 64 CO 0.00 0.32 -0.27 0.58 -1.65 0.00 0.00 177.43 176.41 2jty h VAL 65 N 0.55 1.41 -1.71 2.81 2.07 -1.89 -3.46 116.25 116.04 2jty h VAL 65 Ca 0.18 -1.63 0.07 0.00 0.82 0.00 0.00 66.70 66.15 2jty h VAL 65 Cb 0.01 2.24 -0.25 0.00 -1.52 0.00 0.00 31.29 31.78 2jty h VAL 65 CO -0.08 0.47 0.26 0.00 0.02 0.00 0.00 177.57 178.23 2jty s ALA 66 N -3.78 -2.11 0.01 1.67 0.00 -1.16 -4.70 121.76 111.69 2jty s ALA 66 Ca -0.14 2.26 0.23 0.00 0.00 0.00 0.00 51.96 54.31 2jty s ALA 66 Cb 0.04 -1.58 0.75 0.00 0.00 0.00 0.00 23.12 22.33 2jty s ALA 66 CO 0.77 -0.35 1.75 0.77 0.00 0.00 0.00 175.76 178.70 2jty h SER 67 N 6.23 0.00 -2.02 0.00 0.02 -1.43 -3.37 113.55 112.99 2jty h SER 67 Ca -0.29 0.00 -0.61 0.00 -0.84 0.00 0.00 61.79 60.06 2jty h SER 67 Cb 1.20 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 63.61 2jty h SER 67 CO 0.18 0.22 -0.66 -0.54 -1.14 0.00 0.00 176.83 174.88 2jty s LYS 68 N -3.48 1.82 0.08 3.45 1.02 0.64 -0.75 119.74 122.51 2jty s LYS 68 Ca 0.02 -1.96 0.04 0.00 0.02 0.00 0.00 55.97 54.10 2jty s LYS 68 Cb 0.09 -1.61 -0.03 0.00 -0.52 0.00 0.00 37.83 35.75 2jty s LYS 68 CO 0.65 0.08 -0.12 0.00 -0.92 0.00 0.00 175.35 175.04 2jty s ALA 69 N -2.69 1.11 0.37 5.17 0.00 -0.07 -2.80 121.76 122.85 2jty s ALA 69 Ca 0.33 -1.04 0.05 0.00 0.00 0.00 0.00 51.96 51.30 2jty s ALA 69 Cb 0.04 -0.05 -0.07 0.00 0.00 0.00 0.00 23.12 23.05 2jty s ALA 69 CO 0.16 0.09 0.04 0.00 0.00 0.00 0.00 175.76 176.05 2jty s ALA 70 N -1.63 2.77 0.11 0.00 0.00 -0.61 -1.01 121.76 121.39 2jty s ALA 70 Ca -0.00 -2.03 0.03 0.00 0.00 0.00 0.00 51.96 49.95 2jty s ALA 70 Cb -0.08 0.45 -0.04 0.00 0.00 0.00 0.00 23.12 23.45 2jty s ALA 70 CO 0.02 -0.23 -0.08 0.54 0.00 0.00 0.00 175.76 176.01 2jty s VAL 71 N -3.05 0.85 0.16 0.00 0.11 -1.26 -0.33 120.40 116.88 2jty s VAL 71 Ca 0.34 -1.96 -0.03 0.00 -2.93 0.00 0.00 61.98 57.41 2jty s VAL 71 Cb 0.09 -1.71 -0.03 0.00 -1.53 0.00 0.00 36.38 33.19 2jty s VAL 71 CO 0.16 -0.82 0.13 0.00 -3.33 0.00 0.00 175.10 171.24 2jty s ALA 72 N -3.47 0.80 0.16 1.54 0.00 0.02 -0.03 121.76 120.78 2jty s ALA 72 Ca 0.13 -1.44 0.08 0.00 0.00 0.00 0.00 51.96 50.73 2jty s ALA 72 Cb 0.04 1.05 -0.04 0.00 0.00 0.00 0.00 23.12 24.17 2jty s ALA 72 CO -0.03 -0.56 -0.18 -0.06 0.00 0.00 0.00 175.76 174.93 2jty s PHE 73 N -4.07 1.79 -0.16 0.00 0.40 -1.26 -1.02 117.98 113.66 2jty s PHE 73 Ca 0.28 -0.47 -0.07 0.00 -0.60 0.00 0.00 56.93 56.07 2jty s PHE 73 Cb 0.06 -0.90 0.07 0.00 0.51 0.00 0.00 43.02 42.76 2jty s PHE 73 CO 0.05 0.31 0.36 -1.17 0.70 0.00 0.00 175.22 175.47 2jty s LEU 74 N -2.61 -0.27 0.00 -0.37 2.96 -0.31 -0.68 118.68 117.39 2jty s LEU 74 Ca 0.15 0.81 -0.22 0.00 -0.22 0.00 0.00 54.13 54.65 2jty s LEU 74 Cb -0.06 1.12 0.08 0.00 0.50 0.00 0.00 46.19 47.83 2jty s LEU 74 CO 0.06 -0.21 1.03 0.61 -1.32 0.00 0.00 176.35 176.52 2jty n GLY 75 N 4.90 0.48 3.73 7.98 0.00 -1.19 -1.15 105.19 119.94 2jty n GLY 75 Ca -0.15 -1.08 -0.41 0.00 0.00 0.00 0.00 46.02 44.38 2jty n GLY 75 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jty s THR 76 N -2.07 3.34 0.31 2.61 2.01 -1.26 -4.85 115.64 115.73 2jty s THR 76 Ca 0.24 1.07 -0.28 0.00 0.31 0.00 0.00 61.69 63.03 2jty s THR 76 Cb -0.02 -3.69 -0.09 0.00 0.01 0.00 0.00 72.50 68.71 2jty s THR 76 CO 0.03 0.15 1.13 0.00 -0.69 0.00 0.00 174.62 175.24 2jty s ALA 77 N 0.27 3.36 0.28 7.40 0.00 -1.26 -1.56 121.76 130.23 2jty s ALA 77 Ca 0.57 0.94 -0.02 0.00 0.00 0.00 0.00 51.96 53.45 2jty s ALA 77 Cb -0.35 -3.35 0.38 0.00 0.00 0.00 0.00 23.12 19.80 2jty s ALA 77 CO 0.36 -0.28 1.85 0.97 0.00 0.00 0.00 175.76 178.66 2jty h ILE 78 N 2.90 1.23 -3.01 0.00 2.10 -1.11 -3.41 117.51 116.20 2jty h ILE 78 Ca -0.47 -0.74 0.03 0.00 1.08 0.00 0.00 64.86 64.76 2jty h ILE 78 Cb 1.22 0.51 -0.08 0.00 -1.09 0.00 0.00 36.82 37.38 2jty h ILE 78 CO 0.66 0.29 0.21 -0.62 -1.08 0.00 0.00 178.15 177.61 2jty s ASP 79 N -6.51 -0.39 0.44 2.19 -1.08 -1.26 -4.93 116.67 105.14 2jty s ASP 79 Ca -0.10 -0.36 0.11 0.00 -0.52 0.00 0.00 52.55 51.68 2jty s ASP 79 Cb 0.16 0.67 1.00 0.00 -1.46 0.00 0.00 42.92 43.29 2jty s ASP 79 CO 0.80 -1.19 2.04 0.00 0.52 0.00 0.00 175.17 177.35 2jty h ALA 80 N 2.01 1.89 -0.00 3.66 0.00 -2.00 -1.13 119.26 123.69 2jty h ALA 80 Ca -0.25 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2jty h ALA 80 Cb 1.27 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2jty h ALA 80 CO 0.30 0.05 -0.01 0.41 0.00 0.00 0.00 179.25 179.99 2jty n GLY 81 N -1.51 -1.13 2.67 0.00 0.00 -1.26 -4.21 105.19 99.75 2jty n GLY 81 Ca 0.05 -0.18 -0.08 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.13 0.09 0.29 1.61 8.25 -0.44 -4.95 115.22 118.94 2jty n HIS 82 Ca 0.18 -2.55 0.16 0.00 -0.26 0.00 0.00 57.72 55.26 2jty n HIS 82 Cb 0.20 0.19 0.77 0.00 1.12 0.00 0.00 29.99 32.27 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 2.70 0.00 0.00 1.59 1.35 -1.68 -0.38 112.91 116.49 2jty h THR 83 Ca -0.15 -0.17 -0.10 0.00 -0.55 0.00 0.00 66.41 65.45 2jty h THR 83 Cb 1.21 0.97 -0.01 0.00 -1.73 0.00 0.00 68.15 68.59 2jty h THR 83 CO 0.34 0.00 -0.46 -1.13 -0.25 0.00 0.00 175.52 174.02 2jty h ASN 84 N 0.00 0.00 -2.94 5.36 -0.73 -1.90 -3.36 115.58 112.01 2jty h ASN 84 Ca 0.00 0.00 -0.63 0.00 1.87 0.00 0.00 56.30 57.54 2jty h ASN 84 Cb 0.20 0.00 -0.07 0.00 0.27 0.00 0.00 38.32 38.72 2jty h ASN 84 CO 0.00 0.46 -0.33 -0.69 -0.37 0.00 0.00 177.43 176.50 2jty s VAL 85 N -3.29 5.26 0.36 2.57 1.01 -0.15 -4.54 120.40 121.61 2jty s VAL 85 Ca 0.02 0.56 -0.24 0.00 0.00 0.00 0.00 61.98 62.31 2jty s VAL 85 Cb 0.09 -3.59 -0.10 0.00 0.00 0.00 0.00 36.38 32.79 2jty s VAL 85 CO 0.72 0.55 0.95 -0.22 0.00 0.00 0.00 175.10 177.10 2jty s LEU 86 N -0.73 4.21 -0.10 3.92 0.20 0.01 -0.86 118.68 125.33 2jty s LEU 86 Ca 0.19 1.80 0.08 0.00 0.69 0.00 0.00 54.13 56.89 2jty s LEU 86 Cb -0.14 -4.19 0.41 0.00 -0.43 0.00 0.00 46.19 41.85 2jty s LEU 86 CO 0.08 -0.18 1.18 0.00 -0.29 0.00 0.00 176.35 177.14 2jty n ALA 87 N 0.16 3.08 -0.57 5.97 0.00 -0.60 -2.97 120.51 125.57 2jty n ALA 87 Ca 0.04 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.54 2jty n ALA 87 Cb 0.51 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.91 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 0.38 0.00 0.00 0.00 4.77 -1.26 -4.91 117.00 115.98 2jty n LEU 88 Ca 0.14 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 56.09 2jty n LEU 88 Cb 0.67 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.77 2jty n LEU 88 CO 0.16 -0.18 0.16 0.00 -1.33 0.00 0.00 177.39 176.20 2jty n GLN 89 N 0.00 0.36 -0.28 3.23 10.64 0.27 -4.52 117.38 127.08 2jty n GLN 89 Ca 0.00 -0.83 0.03 0.00 -1.83 0.00 0.00 57.00 54.37 2jty n GLN 89 Cb 0.00 0.97 -0.02 0.00 -0.86 0.00 0.00 30.24 30.33 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 -1.36 -1.53 -2.14 2.61 2.88 -1.26 -4.21 113.62 108.61 2jty n SER 90 Ca -0.02 0.30 -0.07 0.00 -1.33 0.00 0.00 58.87 57.75 2jty n SER 90 Cb 0.21 -0.83 -0.01 0.00 -0.75 0.00 0.00 64.21 62.82 2jty n SER 90 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2jty n SER 91 N -2.33 -2.39 0.00 -3.46 2.88 -1.26 -2.68 113.62 104.38 2jty n SER 91 Ca -0.02 0.29 0.00 0.00 -1.33 0.00 0.00 58.87 57.81 2jty n SER 91 Cb 0.13 -2.18 0.00 0.00 -0.75 0.00 0.00 64.21 61.40 2jty n SER 91 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jty n ALA 92 N -1.79 0.00 -1.62 -1.46 0.00 -1.26 -2.93 120.51 111.44 2jty n ALA 92 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2jty n ALA 92 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 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 0.00 1.13 0.72 0.00 0.00 -1.09 -4.97 120.51 116.29 2jty n ALA 93 Ca 0.00 -0.24 0.11 0.00 0.00 0.00 0.00 53.44 53.31 2jty n ALA 93 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.43 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 0.00 -1.14 3.36 0.00 0.00 -1.15 -4.87 105.19 101.39 2jty n GLY 94 Ca 0.00 -0.46 -0.33 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.77 -2.33 -4.51 1.61 3.41 -1.25 -4.24 113.62 104.54 2jty n SER 95 Ca 0.03 0.20 -0.44 0.00 -0.26 0.00 0.00 58.87 58.39 2jty n SER 95 Cb 0.40 -1.11 -0.01 0.00 -0.26 0.00 0.00 64.21 63.23 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 -3.78 -1.16 -2.45 7.33 0.00 -0.05 -4.81 120.51 115.59 2jty n ALA 96 Ca 0.05 0.30 -0.22 0.00 0.00 0.00 0.00 53.44 53.57 2jty n ALA 96 Cb 0.56 -1.86 0.00 0.00 0.00 0.00 0.00 19.45 18.16 2jty n ALA 96 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2jty s THR 97 N -1.22 4.31 -1.66 0.00 -4.23 -1.26 -4.41 115.64 107.17 2jty s THR 97 Ca 0.62 -0.59 0.00 0.00 -1.18 0.00 0.00 61.69 60.53 2jty s THR 97 Cb -0.70 -3.57 0.00 0.00 1.34 0.00 0.00 72.50 69.58 2jty s THR 97 CO 0.58 -0.35 0.00 0.59 -0.54 0.00 0.00 174.62 174.90 2jty n ASN 98 N -1.91 -4.65 -3.92 3.99 3.02 -1.26 -2.52 115.26 108.02 2jty n ASN 98 Ca -0.01 0.29 -0.09 0.00 -0.03 0.00 0.00 54.58 54.74 2jty n ASN 98 Cb 0.57 -4.08 -0.09 0.00 -0.61 0.00 0.00 39.78 35.57 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 -2.59 0.13 0.00 2.41 0.11 -1.26 -0.52 120.40 118.69 2jty s VAL 99 Ca 0.00 -1.07 0.00 0.00 -2.93 0.00 0.00 61.98 57.98 2jty s VAL 99 Cb 0.00 -0.92 0.00 0.00 -1.53 0.00 0.00 36.38 33.93 2jty s VAL 99 CO 0.00 -0.59 0.00 0.61 -3.33 0.00 0.00 175.10 171.79 2jty n GLY 100 N 0.73 3.41 3.79 6.54 0.00 -1.09 -4.75 105.19 113.82 2jty n GLY 100 Ca -0.19 -1.35 -0.36 0.00 0.00 0.00 0.00 46.02 44.13 2jty n GLY 100 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jty s VAL 101 N -2.29 5.24 0.25 1.61 1.01 -1.16 -3.24 120.40 121.82 2jty s VAL 101 Ca 0.00 0.11 0.10 0.00 0.00 0.00 0.00 61.98 62.19 2jty s VAL 101 Cb 0.00 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.03 2jty s VAL 101 CO 0.00 0.57 -0.07 -1.10 0.00 0.00 0.00 175.10 174.49 2jty s GLN 102 N -0.58 2.08 -0.07 2.72 -1.52 -1.01 -0.81 119.66 120.47 2jty s GLN 102 Ca 0.12 -1.47 -0.00 0.00 -1.95 0.00 0.00 55.36 52.05 2jty s GLN 102 Cb -0.12 -2.06 0.02 0.00 -0.22 0.00 0.00 33.01 30.64 2jty s GLN 102 CO 0.02 0.37 -0.04 0.42 -0.25 0.00 0.00 175.29 175.82 2jty s ILE 103 N -2.23 0.61 0.17 1.08 1.09 -1.26 -3.40 121.20 117.25 2jty s ILE 103 Ca 0.29 -0.08 0.09 0.00 -1.10 0.00 0.00 60.65 59.85 2jty s ILE 103 Cb -0.07 -0.68 -0.04 0.00 -1.06 0.00 0.00 42.46 40.61 2jty s ILE 103 CO 0.18 0.28 -0.10 -0.76 -0.10 0.00 0.00 174.94 174.43 2jty s LEU 104 N 1.51 2.95 0.00 2.97 1.43 0.19 -0.76 118.68 126.98 2jty s LEU 104 Ca -0.01 -0.55 0.00 0.00 -1.03 0.00 0.00 54.13 52.53 2jty s LEU 104 Cb -0.13 -1.67 0.00 0.00 0.03 0.00 0.00 46.19 44.42 2jty s LEU 104 CO -0.04 0.12 0.00 -0.67 0.23 0.00 0.00 176.35 175.99 2jty n ASP 105 N 0.19 0.00 -0.11 2.29 -0.08 -1.24 -0.48 116.55 117.12 2jty n ASP 105 Ca -0.12 0.00 -0.20 0.00 -1.51 0.00 0.00 54.79 52.96 2jty n ASP 105 Cb 0.55 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 43.92 2jty n ASP 105 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 2jty n ARG 106 N 0.00 0.50 0.00 -0.67 0.63 -1.26 -3.32 116.66 112.54 2jty n ARG 106 Ca 0.00 0.17 0.15 0.00 -0.92 0.00 0.00 57.85 57.25 2jty n ARG 106 Cb 0.00 -1.35 0.87 0.00 0.45 0.00 0.00 32.46 32.43 2jty n ARG 106 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 2jty n THR 107 N -3.63 0.00 -1.19 5.15 -2.24 -1.26 -4.86 114.28 106.24 2jty n THR 107 Ca -0.41 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.30 2jty n THR 107 Cb 0.85 -0.54 -0.03 0.00 -2.10 0.00 0.00 70.33 68.51 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 0.84 0.74 3.77 3.38 0.00 -1.26 -4.99 105.19 107.67 2jty n GLY 108 Ca 0.22 -0.11 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.80 3.28 -0.09 4.61 0.00 -1.26 -4.96 121.76 121.54 2jty s ALA 109 Ca 0.00 1.10 -0.13 0.00 0.00 0.00 0.00 51.96 52.93 2jty s ALA 109 Cb 0.00 -3.43 -0.05 0.00 0.00 0.00 0.00 23.12 19.64 2jty s ALA 109 CO 0.00 -0.60 0.31 0.00 0.00 0.00 0.00 175.76 175.46 2jty s ALA 110 N -1.28 3.69 -0.25 0.00 0.00 -1.26 -3.63 121.76 119.03 2jty s ALA 110 Ca 0.54 -0.40 -0.07 0.00 0.00 0.00 0.00 51.96 52.02 2jty s ALA 110 Cb -0.35 -2.31 -0.03 0.00 0.00 0.00 0.00 23.12 20.43 2jty s ALA 110 CO 0.45 0.34 0.07 -0.51 0.00 0.00 0.00 175.76 176.11 2jty s LEU 111 N -0.38 3.48 0.72 0.00 1.43 0.07 -5.01 118.68 118.99 2jty s LEU 111 Ca 0.19 -0.19 -0.11 0.00 -1.03 0.00 0.00 54.13 53.00 2jty s LEU 111 Cb -0.14 -1.93 0.02 0.00 0.03 0.00 0.00 46.19 44.17 2jty s LEU 111 CO 0.07 -0.02 1.07 -0.89 0.23 0.00 0.00 176.35 176.81 2jty s THR 112 N 1.56 3.78 -0.50 5.49 2.01 -1.26 -4.63 115.64 122.09 2jty s THR 112 Ca 0.06 0.58 0.02 0.00 0.31 0.00 0.00 61.69 62.66 2jty s THR 112 Cb -0.15 -3.24 0.45 0.00 0.01 0.00 0.00 72.50 69.57 2jty s THR 112 CO 0.04 -0.76 1.64 0.18 -0.69 0.00 0.00 174.62 175.03 2jty n LEU 113 N -3.27 6.40 -0.64 4.42 4.77 -1.26 -4.17 117.00 123.25 2jty n LEU 113 Ca 0.08 -4.54 0.08 0.00 -0.03 0.00 0.00 56.01 51.60 2jty n LEU 113 Cb 0.53 -0.69 0.07 0.00 -2.33 0.00 0.00 43.42 41.01 2jty n LEU 113 CO 0.55 1.78 0.51 0.47 -1.33 0.00 0.00 177.39 179.37 2jty n ASP 114 N -0.80 2.35 0.00 -1.43 8.00 -1.14 -3.20 116.55 120.33 2jty n ASP 114 Ca 0.54 -1.67 0.00 0.00 0.71 0.00 0.00 54.79 54.36 2jty n ASP 114 Cb 0.78 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.87 2jty n ASP 114 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jty n GLY 115 N 0.90 2.93 0.08 0.44 0.00 0.14 -4.68 105.19 104.99 2jty n GLY 115 Ca 0.09 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.53 2.62 -2.00 4.61 0.00 -1.26 -4.65 120.51 119.30 2jty n ALA 116 Ca 0.00 -0.28 -0.37 0.00 0.00 0.00 0.00 53.44 52.79 2jty n ALA 116 Cb 0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 19.45 19.23 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 -1.16 3.33 0.20 0.00 2.01 -1.26 -4.95 115.64 113.80 2jty s THR 117 Ca 0.04 0.15 -0.32 0.00 0.31 0.00 0.00 61.69 61.87 2jty s THR 117 Cb 0.04 -3.86 -0.11 0.00 0.01 0.00 0.00 72.50 68.58 2jty s THR 117 CO 0.17 -0.83 1.68 0.72 -0.69 0.00 0.00 174.62 175.67 2jty s PHE 118 N 9.43 2.94 0.00 4.92 -0.71 -1.26 -4.21 117.98 129.10 2jty s PHE 118 Ca 0.70 0.42 0.00 0.00 -1.04 0.00 0.00 56.93 57.01 2jty s PHE 118 Cb -0.13 -4.09 0.00 0.00 -1.21 0.00 0.00 43.02 37.60 2jty s PHE 118 CO 0.20 -4.09 0.00 0.43 -1.34 0.00 0.00 175.22 170.42 2jty n SER 119 N 3.95 0.00 -4.71 1.98 7.64 0.96 -4.93 113.62 118.51 2jty n SER 119 Ca 0.15 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.61 2jty n SER 119 Cb 0.36 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.53 2jty n SER 119 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2jty s SER 120 N -1.00 7.04 -0.35 6.43 0.15 -1.26 -4.71 113.70 119.99 2jty s SER 120 Ca 0.00 2.05 -0.25 0.00 0.70 0.00 0.00 55.95 58.45 2jty s SER 120 Cb 0.00 -2.58 0.01 0.00 -1.71 0.00 0.00 66.02 61.74 2jty s SER 120 CO 0.00 -0.51 0.90 -1.61 1.20 0.00 0.00 173.24 173.22 2jty s GLU 121 N 1.16 3.88 -0.42 5.44 2.02 -1.26 -4.64 118.70 124.88 2jty s GLU 121 Ca 0.60 0.60 -0.17 0.00 0.02 0.00 0.00 54.97 56.01 2jty s GLU 121 Cb -0.30 -3.78 0.02 0.00 0.10 0.00 0.00 34.13 30.17 2jty s GLU 121 CO 0.29 -0.87 0.44 0.99 0.02 0.00 0.00 175.26 176.12 2jty s THR 122 N 3.34 5.08 0.20 3.63 2.01 -0.18 -4.94 115.64 124.77 2jty s THR 122 Ca 0.37 -0.33 -0.32 0.00 0.31 0.00 0.00 61.69 61.72 2jty s THR 122 Cb -0.13 -4.04 -0.11 0.00 0.01 0.00 0.00 72.50 68.23 2jty s THR 122 CO 0.17 -0.42 1.65 -0.89 -0.69 0.00 0.00 174.62 174.44 2jty s THR 123 N 2.14 2.26 0.00 -0.82 2.01 -1.26 -0.89 115.64 119.08 2jty s THR 123 Ca 0.12 0.19 0.00 0.00 0.31 0.00 0.00 61.69 62.31 2jty s THR 123 Cb -0.17 -3.12 0.00 0.00 0.01 0.00 0.00 72.50 69.22 2jty s THR 123 CO 0.14 0.02 0.00 0.18 -0.69 0.00 0.00 174.62 174.26 2jty n LEU 124 N 3.86 0.00 -4.03 4.42 4.77 0.07 -4.94 117.00 121.15 2jty n LEU 124 Ca 0.15 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.01 2jty n LEU 124 Cb 0.37 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.41 2jty n LEU 124 CO 0.63 0.00 0.17 0.54 -1.33 0.00 0.00 177.39 177.40 2jty s ASN 125 N -1.00 0.30 -0.26 -1.43 2.20 -1.26 -5.00 114.94 108.48 2jty s ASN 125 Ca 0.00 -1.18 -0.29 0.00 -0.94 0.00 0.00 52.86 50.45 2jty s ASN 125 Cb 0.00 0.62 -0.01 0.00 -2.00 0.00 0.00 41.25 39.86 2jty s ASN 125 CO 0.00 -1.22 1.41 0.54 -2.94 0.00 0.00 177.10 174.89 2jty s ASN 126 N -3.11 6.58 0.00 3.54 2.20 -1.26 -4.46 114.94 118.43 2jty s ASN 126 Ca 0.26 1.38 0.00 0.00 -0.94 0.00 0.00 52.86 53.56 2jty s ASN 126 Cb -0.00 -2.54 0.00 0.00 -2.00 0.00 0.00 41.25 36.71 2jty s ASN 126 CO 0.14 -1.13 0.00 0.61 -2.94 0.00 0.00 177.10 173.78 2jty n GLY 127 N 4.40 0.26 3.74 0.45 0.00 -0.89 -4.93 105.19 108.22 2jty n GLY 127 Ca 0.16 -2.07 -0.41 0.00 0.00 0.00 0.00 46.02 43.70 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 3.87 0.25 2.61 2.01 -1.26 -1.99 115.64 121.14 2jty s THR 128 Ca 0.00 1.59 -0.18 0.00 0.31 0.00 0.00 61.69 63.41 2jty s THR 128 Cb 0.00 -4.01 0.01 0.00 0.01 0.00 0.00 72.50 68.51 2jty s THR 128 CO 0.00 0.26 0.61 0.54 -0.69 0.00 0.00 174.62 175.34 2jty s ASN 129 N 0.01 -0.21 -0.03 3.53 2.20 -0.66 -4.77 114.94 115.01 2jty s ASN 129 Ca 0.50 -0.68 -0.19 0.00 -0.94 0.00 0.00 52.86 51.55 2jty s ASN 129 Cb -0.29 0.66 0.04 0.00 -2.00 0.00 0.00 41.25 39.65 2jty s ASN 129 CO 0.35 -1.23 0.41 -0.89 -2.94 0.00 0.00 177.10 172.79 2jty s THR 130 N -3.94 0.04 -0.41 0.54 2.01 -1.26 -0.77 115.64 111.85 2jty s THR 130 Ca 0.14 -0.35 -0.11 0.00 0.31 0.00 0.00 61.69 61.69 2jty s THR 130 Cb -0.03 -0.71 0.06 0.00 0.01 0.00 0.00 72.50 71.82 2jty s THR 130 CO 0.06 -0.19 0.26 -0.63 -0.69 0.00 0.00 174.62 173.43 2jty s ILE 131 N -1.27 4.52 -0.29 1.82 1.09 -1.07 -4.97 121.20 121.04 2jty s ILE 131 Ca -0.13 -1.14 -0.29 0.00 -1.10 0.00 0.00 60.65 57.99 2jty s ILE 131 Cb -0.04 -3.66 0.01 0.00 -1.06 0.00 0.00 42.46 37.71 2jty s ILE 131 CO 0.06 -0.41 1.08 -2.16 -0.10 0.00 0.00 174.94 173.41 2jty s PRO 132 N 1.51 4.11 0.56 2.79 0.04 -1.26 -1.46 135.00 141.30 2jty s PRO 132 Ca 0.03 1.17 0.01 0.00 0.04 0.00 0.00 61.00 62.25 2jty s PRO 132 Cb -0.22 -3.72 0.04 0.00 0.04 0.00 0.00 34.50 30.64 2jty s PRO 132 CO 0.05 -0.84 0.79 -0.06 0.04 0.00 0.00 177.00 176.98 2jty s PHE 133 N 3.57 2.79 -0.15 0.56 0.08 0.91 -4.00 117.98 121.74 2jty s PHE 133 Ca 0.46 -0.02 -0.02 0.00 0.12 0.00 0.00 56.93 57.47 2jty s PHE 133 Cb -0.13 -2.77 0.05 0.00 -0.57 0.00 0.00 43.02 39.59 2jty s PHE 133 CO 0.13 -0.93 0.02 -0.65 -0.10 0.00 0.00 175.22 173.69 2jty s GLN 134 N -4.79 0.67 -0.15 0.44 -0.21 0.37 -1.93 119.66 114.06 2jty s GLN 134 Ca 0.58 -0.23 -0.06 0.00 0.02 0.00 0.00 55.36 55.67 2jty s GLN 134 Cb -0.10 -1.71 -0.04 0.00 1.00 0.00 0.00 33.01 32.16 2jty s GLN 134 CO 0.39 -0.51 0.05 0.00 -2.12 0.00 0.00 175.29 173.10 2jty s ALA 135 N 1.89 3.42 -0.05 6.09 0.00 0.60 -0.64 121.76 133.08 2jty s ALA 135 Ca 0.01 -0.75 -0.07 0.00 0.00 0.00 0.00 51.96 51.16 2jty s ALA 135 Cb -0.15 -1.79 0.01 0.00 0.00 0.00 0.00 23.12 21.19 2jty s ALA 135 CO -0.07 0.35 0.17 -0.98 0.00 0.00 0.00 175.76 175.23 2jty s ARG 136 N -0.15 0.31 -0.19 0.00 1.70 -1.22 -0.51 118.95 118.89 2jty s ARG 136 Ca 0.07 0.04 -0.29 0.00 -0.47 0.00 0.00 55.73 55.08 2jty s ARG 136 Cb -0.12 0.14 -0.03 0.00 -0.57 0.00 0.00 34.95 34.37 2jty s ARG 136 CO 0.01 -0.06 1.55 0.71 -1.08 0.00 0.00 175.30 176.43 2jty s TYR 137 N -0.40 2.23 -0.19 5.89 2.02 -1.26 -2.40 117.35 123.24 2jty s TYR 137 Ca -0.05 0.57 -0.09 0.00 -0.37 0.00 0.00 57.07 57.13 2jty s TYR 137 Cb -0.03 -3.90 -0.05 0.00 -0.40 0.00 0.00 41.96 37.58 2jty s TYR 137 CO 0.01 -2.83 0.10 0.12 -1.57 0.00 0.00 175.55 171.38 2jty s PHE 138 N 4.71 3.35 0.21 2.71 2.19 -1.20 -0.86 117.98 129.09 2jty s PHE 138 Ca 0.68 0.23 -0.18 0.00 0.33 0.00 0.00 56.93 57.99 2jty s PHE 138 Cb -0.25 -2.11 -0.08 0.00 -1.31 0.00 0.00 43.02 39.27 2jty s PHE 138 CO 0.27 0.26 0.69 0.00 1.83 0.00 0.00 175.22 178.26 2jty s ALA 139 N 0.28 3.45 -2.28 11.12 0.00 0.28 -2.68 121.76 131.93 2jty s ALA 139 Ca 0.06 0.09 0.22 0.00 0.00 0.00 0.00 51.96 52.34 2jty s ALA 139 Cb -0.12 -2.75 0.52 0.00 0.00 0.00 0.00 23.12 20.77 2jty s ALA 139 CO -0.01 0.36 1.46 0.25 0.00 0.00 0.00 175.76 177.81 2jty n THR 140 N 0.69 0.65 -1.05 0.00 -2.24 0.33 -0.41 114.28 112.25 2jty n THR 140 Ca -0.03 -0.79 0.00 0.00 -2.27 0.00 0.00 64.05 60.96 2jty n THR 140 Cb 0.51 0.74 0.00 0.00 -2.10 0.00 0.00 70.33 69.48 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 1.53 -0.49 3.56 3.38 0.00 -1.22 -3.88 105.19 108.07 2jty n GLY 141 Ca 0.21 -0.86 -0.19 0.00 0.00 0.00 0.00 46.02 45.18 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 1.05 0.33 4.61 0.00 -1.16 -2.32 121.76 123.27 2jty s ALA 142 Ca 0.00 -1.12 -0.28 0.00 0.00 0.00 0.00 51.96 50.56 2jty s ALA 142 Cb 0.00 -4.58 -0.09 0.00 0.00 0.00 0.00 23.12 18.45 2jty s ALA 142 CO 0.00 -5.57 1.15 0.00 0.00 0.00 0.00 175.76 171.35 2jty s ALA 143 N 13.14 3.33 0.15 0.00 0.00 -0.43 -4.65 121.76 133.30 2jty s ALA 143 Ca 0.83 0.96 0.08 0.00 0.00 0.00 0.00 51.96 53.83 2jty s ALA 143 Cb -0.10 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.62 2jty s ALA 143 CO 0.05 -0.35 -0.06 0.95 0.00 0.00 0.00 175.76 176.36 2jty s THR 144 N -1.27 3.48 0.72 0.00 -4.23 -1.05 -4.84 115.64 108.45 2jty s THR 144 Ca 0.50 -1.43 -0.11 0.00 -1.18 0.00 0.00 61.69 59.47 2jty s THR 144 Cb -0.32 -2.70 0.02 0.00 1.34 0.00 0.00 72.50 70.83 2jty s THR 144 CO 0.41 -0.04 1.07 -2.16 -0.54 0.00 0.00 174.62 173.37 2jty s PRO 145 N -2.67 2.77 0.00 3.99 0.04 -1.26 -4.38 135.00 133.49 2jty s PRO 145 Ca 0.25 0.72 0.00 0.00 0.04 0.00 0.00 61.00 62.01 2jty s PRO 145 Cb -0.10 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.45 2jty s PRO 145 CO 0.16 -1.16 0.00 0.41 0.04 0.00 0.00 177.00 176.45 2jty n GLY 146 N -2.36 -0.33 3.90 0.56 0.00 -0.64 -4.62 105.19 101.71 2jty n GLY 146 Ca 0.07 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 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 3.72 -0.44 4.61 0.00 -1.26 -3.78 121.76 123.61 2jty s ALA 147 Ca 0.00 -0.56 0.03 0.00 0.00 0.00 0.00 51.96 51.43 2jty s ALA 147 Cb 0.00 -2.20 0.16 0.00 0.00 0.00 0.00 23.12 21.08 2jty s ALA 147 CO 0.00 0.48 0.33 0.00 0.00 0.00 0.00 175.76 176.57 2jty s ALA 148 N -1.84 1.65 0.15 0.00 0.00 -1.09 -0.87 121.76 119.77 2jty s ALA 148 Ca 0.42 -2.53 0.11 0.00 0.00 0.00 0.00 51.96 49.96 2jty s ALA 148 Cb -0.11 -1.68 -0.04 0.00 0.00 0.00 0.00 23.12 21.29 2jty s ALA 148 CO 0.26 -2.01 -0.24 -0.80 0.00 0.00 0.00 175.76 172.97 2jty s ASN 149 N 0.06 3.21 0.30 0.00 0.02 -1.26 -2.52 114.94 114.75 2jty s ASN 149 Ca 0.29 -0.80 -0.02 0.00 -1.02 0.00 0.00 52.86 51.31 2jty s ASN 149 Cb -0.03 -0.22 -0.01 0.00 0.02 0.00 0.00 41.25 41.01 2jty s ASN 149 CO -0.15 0.12 0.36 0.00 0.02 0.00 0.00 177.10 177.46 2jty s ALA 150 N -1.40 0.92 -0.11 0.60 0.00 0.33 -0.56 121.76 121.54 2jty s ALA 150 Ca 0.16 -1.57 -0.03 0.00 0.00 0.00 0.00 51.96 50.52 2jty s ALA 150 Cb -0.09 1.26 0.04 0.00 0.00 0.00 0.00 23.12 24.33 2jty s ALA 150 CO 0.07 -0.73 0.06 0.16 0.00 0.00 0.00 175.76 175.32 2jty s ASP 151 N -3.21 1.84 0.20 0.00 -4.77 -1.26 -3.14 116.67 106.32 2jty s ASP 151 Ca 0.33 -0.30 0.07 0.00 -3.30 0.00 0.00 52.55 49.35 2jty s ASP 151 Cb 0.02 -0.27 -0.04 0.00 -1.09 0.00 0.00 42.92 41.54 2jty s ASP 151 CO 0.18 -0.29 0.08 0.00 0.70 0.00 0.00 175.17 175.85 2jty s ALA 152 N 2.10 3.38 0.23 2.11 0.00 -0.73 -4.67 121.76 124.18 2jty s ALA 152 Ca 0.03 -1.38 0.04 0.00 0.00 0.00 0.00 51.96 50.66 2jty s ALA 152 Cb -0.14 -1.13 -0.03 0.00 0.00 0.00 0.00 23.12 21.82 2jty s ALA 152 CO -0.06 0.41 0.36 0.95 0.00 0.00 0.00 175.76 177.42 2jty s THR 153 N -1.91 5.26 0.09 0.00 -4.23 -0.30 -0.59 115.64 113.96 2jty s THR 153 Ca 0.30 -0.87 0.09 0.00 -1.18 0.00 0.00 61.69 60.03 2jty s THR 153 Cb -0.09 -3.83 -0.04 0.00 1.34 0.00 0.00 72.50 69.88 2jty s THR 153 CO 0.21 -0.30 -0.22 0.72 -0.54 0.00 0.00 174.62 174.49 2jty s PHE 154 N -1.96 2.44 0.38 3.99 -0.71 -0.05 -1.17 117.98 120.90 2jty s PHE 154 Ca 0.35 -0.32 0.08 0.00 -1.04 0.00 0.00 56.93 56.00 2jty s PHE 154 Cb -0.09 -1.35 -0.07 0.00 -1.21 0.00 0.00 43.02 40.29 2jty s PHE 154 CO 0.30 0.30 -0.04 0.15 -1.34 0.00 0.00 175.22 174.59 2jty s LYS 155 N -1.81 1.89 -0.22 1.99 1.02 -0.19 -1.23 119.74 121.20 2jty s LYS 155 Ca 0.15 -2.03 -0.04 0.00 0.02 0.00 0.00 55.97 54.07 2jty s LYS 155 Cb -0.10 -1.65 0.07 0.00 -0.52 0.00 0.00 37.83 35.63 2jty s LYS 155 CO 0.06 0.03 0.10 0.08 -0.92 0.00 0.00 175.35 174.71 2jty s VAL 156 N -2.68 0.04 -0.94 3.17 1.01 -0.19 -0.80 120.40 120.02 2jty s VAL 156 Ca 0.34 -0.46 -0.15 0.00 0.00 0.00 0.00 61.98 61.71 2jty s VAL 156 Cb 0.07 -0.81 0.19 0.00 0.00 0.00 0.00 36.38 35.83 2jty s VAL 156 CO 0.17 -0.43 1.00 -1.58 0.00 0.00 0.00 175.10 174.26 2jty s GLN 157 N 2.07 3.72 0.53 2.72 0.74 0.55 -1.31 119.66 128.68 2jty s GLN 157 Ca 0.04 -2.31 -0.20 0.00 0.05 0.00 0.00 55.36 52.95 2jty s GLN 157 Cb -0.16 -4.69 -0.06 0.00 1.10 0.00 0.00 33.01 29.21 2jty s GLN 157 CO -0.18 -1.51 1.16 0.71 -0.55 0.00 0.00 175.29 174.92 2jty s TYR 158 N 1.06 2.65 0.06 1.67 2.02 -0.30 -1.57 117.35 122.93 2jty s TYR 158 Ca 0.27 1.53 -0.27 0.00 -0.37 0.00 0.00 57.07 58.23 2jty s TYR 158 Cb -0.07 -3.36 0.09 0.00 -0.40 0.00 0.00 41.96 38.22 2jty s TYR 158 CO -0.08 -1.73 1.18 1.14 -1.57 0.00 0.00 175.55 174.49 2jty s GLN 159 N -3.15 0.73 0.00 -0.62 -2.07 -1.12 -1.07 119.66 112.36 2jty s GLN 159 Ca 0.72 -0.45 0.00 0.00 -1.82 0.00 0.00 55.36 53.81 2jty s GLN 159 Cb -0.27 0.22 0.00 0.00 -1.09 0.00 0.00 33.01 31.88 2jty s GLN 159 CO 0.30 -0.34 0.00 0.41 -1.32 0.00 0.00 175.29 174.34 2jty n GLY 160 N -0.66 0.51 3.73 2.60 0.00 -1.26 -0.26 105.19 109.86 2jty n GLY 160 Ca -0.03 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 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 1.61 0.00 -0.02 0.00 -1.26 -4.88 107.32 102.77 2jty s GLY 161 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 44.72 44.56 2jty s GLY 161 CO 0.00 0.34 0.00 0.61 0.00 0.00 0.00 173.10 174.05 2jty n GLY 162 N -1.37 3.55 0.34 0.20 0.00 -1.26 -4.69 105.19 101.95 2jty n GLY 162 Ca 0.07 -1.80 0.01 0.00 0.00 0.00 0.00 46.02 44.30 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 1.37 0.00 -0.02 0.00 -1.96 -3.42 103.07 99.04 2jty h GLY 163 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.91 2jty h GLY 163 CO 0.00 0.29 0.00 0.61 0.00 0.00 0.00 176.54 177.44 2jty n GLY 164 N -1.34 0.00 0.00 4.60 0.00 -1.26 -5.09 105.19 102.10 2jty n GLY 164 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 0.16 3.62 -0.02 0.00 -1.26 -5.18 105.19 102.51 2jty n GLY 165 Ca 0.00 0.53 -0.02 0.00 0.00 0.00 0.00 46.02 46.52 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 0.00 -2.27 0.28 4.61 0.00 -1.26 -5.00 121.76 118.11 2jty s ALA 166 Ca 0.00 2.22 -0.18 0.00 0.00 0.00 0.00 51.96 53.99 2jty s ALA 166 Cb 0.00 -1.72 0.01 0.00 0.00 0.00 0.00 23.12 21.42 2jty s ALA 166 CO 0.00 -0.43 0.66 0.00 0.00 0.00 0.00 175.76 175.99 2jty s ALA 167 N 1.53 -0.92 -0.28 0.00 0.00 -1.26 -4.49 121.76 116.34 2jty s ALA 167 Ca -0.08 -0.49 -0.03 0.00 0.00 0.00 0.00 51.96 51.36 2jty s ALA 167 Cb -0.04 0.90 0.09 0.00 0.00 0.00 0.00 23.12 24.07 2jty s ALA 167 CO -0.16 -0.99 0.10 0.99 0.00 0.00 0.00 175.76 175.71 2jty s THR 168 N -3.87 0.42 -0.60 0.00 2.01 -0.23 -4.98 115.64 108.38 2jty s THR 168 Ca 0.14 -0.97 -0.28 0.00 0.31 0.00 0.00 61.69 60.89 2jty s THR 168 Cb -0.05 -1.26 0.03 0.00 0.01 0.00 0.00 72.50 71.23 2jty s THR 168 CO 0.08 -0.61 1.26 -0.89 -0.69 0.00 0.00 174.62 173.77 2jty s THR 169 N 1.86 3.91 0.37 -0.82 2.01 -1.25 -1.15 115.64 120.56 2jty s THR 169 Ca 0.08 0.76 -0.05 0.00 0.31 0.00 0.00 61.69 62.79 2jty s THR 169 Cb -0.17 -4.69 -0.05 0.00 0.01 0.00 0.00 72.50 67.60 2jty s THR 169 CO -0.26 -1.39 0.65 0.68 -0.69 0.00 0.00 174.62 173.61 2jty s VAL 170 N 5.36 4.96 0.14 3.82 -7.23 -0.43 -4.93 120.40 122.09 2jty s VAL 170 Ca 0.44 0.13 -0.31 0.00 -1.81 0.00 0.00 61.98 60.42 2jty s VAL 170 Cb -0.08 -3.78 -0.09 0.00 0.56 0.00 0.00 36.38 32.98 2jty s VAL 170 CO 0.24 -0.52 1.55 0.20 -0.31 0.00 0.00 175.10 176.25 2jty s ASN 171 N -3.52 6.63 -0.10 4.85 -0.87 -1.26 -1.02 114.94 119.65 2jty s ASN 171 Ca 0.46 2.54 -0.04 0.00 -1.57 0.00 0.00 52.86 54.24 2jty s ASN 171 Cb -0.10 -2.59 -0.01 0.00 -0.02 0.00 0.00 41.25 38.53 2jty s ASN 171 CO 0.35 -0.81 -0.08 1.23 -2.57 0.00 0.00 177.10 175.22 2jty h GLY 172 N 7.14 0.00 0.00 0.66 0.00 -1.44 -3.45 103.07 105.98 2jty h GLY 172 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.91 2jty h GLY 172 CO 0.91 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.06 2jty n GLY 173 N 1.72 -0.54 3.36 4.60 0.00 -0.82 -4.81 105.19 108.70 2jty n GLY 173 Ca -0.03 -0.85 -0.32 0.00 0.00 0.00 0.00 46.02 44.81 2jty n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jty s THR 174 N -3.25 2.59 -0.32 2.61 2.01 0.21 -0.88 115.64 118.61 2jty s THR 174 Ca 0.00 -0.87 -0.02 0.00 0.31 0.00 0.00 61.69 61.11 2jty s THR 174 Cb 0.00 -2.00 0.06 0.00 0.01 0.00 0.00 72.50 70.57 2jty s THR 174 CO 0.00 0.57 0.05 -0.69 -0.69 0.00 0.00 174.62 173.85 2jty s VAL 175 N -0.24 3.06 -0.90 3.82 1.01 0.24 -2.40 120.40 124.98 2jty s VAL 175 Ca -0.00 -1.54 -0.20 0.00 0.00 0.00 0.00 61.98 60.25 2jty s VAL 175 Cb -0.13 -2.84 0.11 0.00 0.00 0.00 0.00 36.38 33.52 2jty s VAL 175 CO 0.03 -0.24 1.14 -1.00 0.00 0.00 0.00 175.10 175.03 2jty s HIS 176 N 1.23 3.00 -0.23 5.22 3.76 -0.21 -1.78 115.29 126.27 2jty s HIS 176 Ca -0.02 -1.23 -0.29 0.00 -0.15 0.00 0.00 55.06 53.38 2jty s HIS 176 Cb -0.20 -4.33 -0.02 0.00 1.11 0.00 0.00 32.58 29.14 2jty s HIS 176 CO -0.02 -1.56 1.53 -0.06 -0.85 0.00 0.00 174.74 173.79 2jty s PHE 177 N 3.10 2.26 0.24 1.40 0.08 -1.19 -1.41 117.98 122.45 2jty s PHE 177 Ca 0.33 0.62 0.10 0.00 0.12 0.00 0.00 56.93 58.10 2jty s PHE 177 Cb -0.06 -3.95 -0.05 0.00 -0.57 0.00 0.00 43.02 38.39 2jty s PHE 177 CO -0.07 -2.64 -0.18 0.15 -0.10 0.00 0.00 175.22 172.38 2jty s LYS 178 N 4.51 1.49 0.00 0.44 -0.14 -0.08 -0.51 119.74 125.44 2jty s LYS 178 Ca 0.67 -1.66 0.00 0.00 -1.36 0.00 0.00 55.97 53.63 2jty s LYS 178 Cb -0.23 -1.45 0.00 0.00 -1.68 0.00 0.00 37.83 34.47 2jty s LYS 178 CO 0.27 0.26 0.00 0.41 -0.76 0.00 0.00 175.35 175.54 2jty n GLY 179 N -0.42 0.39 3.83 -3.33 0.00 -1.05 -0.12 105.19 104.48 2jty n GLY 179 Ca -0.07 -1.69 -0.07 0.00 0.00 0.00 0.00 46.02 44.20 2jty n GLY 179 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2jty s GLU 180 N -2.00 1.84 -0.09 1.61 -1.05 -0.77 -2.66 118.70 115.58 2jty s GLU 180 Ca 0.00 -1.14 0.04 0.00 -0.15 0.00 0.00 54.97 53.72 2jty s GLU 180 Cb 0.00 0.54 0.00 0.00 -0.44 0.00 0.00 34.13 34.24 2jty s GLU 180 CO 0.00 -0.86 -0.21 0.08 0.95 0.00 0.00 175.26 175.22 2jty s VAL 181 N -2.68 1.82 0.12 1.83 1.01 -1.25 -1.67 120.40 119.58 2jty s VAL 181 Ca 0.16 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.30 2jty s VAL 181 Cb -0.04 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 2jty s VAL 181 CO 0.08 0.51 0.10 0.68 0.00 0.00 0.00 175.10 176.47 2jty s VAL 182 N 0.41 4.50 -0.51 2.92 -7.23 0.55 -1.61 120.40 119.43 2jty s VAL 182 Ca -0.17 -0.92 0.00 0.00 -1.81 0.00 0.00 61.98 59.08 2jty s VAL 182 Cb -0.17 -3.23 0.00 0.00 0.56 0.00 0.00 36.38 33.54 2jty s VAL 182 CO 0.07 0.02 0.53 -3.20 -0.31 0.00 0.00 175.10 172.21 2jty n ASN 183 N 0.09 1.41 0.00 4.85 4.05 -1.26 -0.99 115.26 123.41 2jty n ASN 183 Ca -0.08 -1.42 0.00 0.00 0.45 0.00 0.00 54.58 53.52 2jty n ASN 183 Cb 0.53 -0.36 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