#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jdm n THR 2 N 0.00 1.88 -4.17 0.00 -1.04 -1.26 -5.02 114.28 104.67 2jdm n THR 2 Ca 0.00 -0.47 -0.12 0.00 -2.04 0.00 0.00 64.05 61.42 2jdm n THR 2 Cb 0.00 -1.85 -0.10 0.00 -1.82 0.00 0.00 70.33 66.56 2jdm n THR 2 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2jdm s GLN 3 N -1.84 0.82 -0.02 -2.82 -1.52 -1.26 -4.85 119.66 108.17 2jdm s GLN 3 Ca 0.55 -1.21 0.00 0.00 -1.95 0.00 0.00 55.36 52.75 2jdm s GLN 3 Cb -0.51 -0.36 0.00 0.00 -0.22 0.00 0.00 33.01 31.92 2jdm s GLN 3 CO 0.62 0.03 0.00 0.41 -0.25 0.00 0.00 175.29 176.10 2jdm n GLY 4 N 0.33 0.45 3.15 3.09 0.00 -1.26 -4.90 105.19 106.05 2jdm n GLY 4 Ca -0.15 -0.49 -0.31 0.00 0.00 0.00 0.00 46.02 45.08 2jdm n GLY 4 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jdm s VAL 5 N -2.00 1.84 0.01 1.61 1.01 -1.26 -0.52 120.40 121.09 2jdm s VAL 5 Ca 0.00 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.14 2jdm s VAL 5 Cb 0.00 -1.62 -0.01 0.00 0.00 0.00 0.00 36.38 34.75 2jdm s VAL 5 CO 0.00 0.51 -0.07 -0.36 0.00 0.00 0.00 175.10 175.18 2jdm s PHE 6 N 0.68 0.59 -0.40 5.22 0.08 -0.06 -5.01 117.98 119.07 2jdm s PHE 6 Ca -0.12 -0.24 -0.14 0.00 0.12 0.00 0.00 56.93 56.55 2jdm s PHE 6 Cb -0.16 -0.37 0.02 0.00 -0.57 0.00 0.00 43.02 41.94 2jdm s PHE 6 CO 0.02 -0.03 0.29 0.99 -0.10 0.00 0.00 175.22 176.39 2jdm s THR 7 N -0.56 5.22 0.37 0.64 2.01 -1.26 -1.21 115.64 120.86 2jdm s THR 7 Ca -0.02 -0.61 0.03 0.00 0.31 0.00 0.00 61.69 61.41 2jdm s THR 7 Cb -0.05 -3.88 -0.01 0.00 0.01 0.00 0.00 72.50 68.57 2jdm s THR 7 CO 0.00 -0.26 0.55 -0.76 -0.69 0.00 0.00 174.62 173.45 2jdm s LEU 8 N 1.68 3.88 0.46 4.42 1.02 0.80 -5.02 118.68 125.91 2jdm s LEU 8 Ca 0.05 0.07 -0.24 0.00 0.02 0.00 0.00 54.13 54.03 2jdm s LEU 8 Cb -0.19 -2.97 -0.08 0.00 0.02 0.00 0.00 46.19 42.97 2jdm s LEU 8 CO 0.10 -0.50 1.31 -2.65 0.02 0.00 0.00 176.35 174.63 2jdm n PRO 9 N -1.81 1.91 -2.11 1.29 -0.02 -1.26 -4.43 135.00 128.57 2jdm n PRO 9 Ca -0.01 0.68 -0.38 0.00 -2.02 0.00 0.00 63.50 61.77 2jdm n PRO 9 Cb 0.58 -2.46 -0.00 0.00 -0.02 0.00 0.00 33.50 31.59 2jdm n PRO 9 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jdm s ALA 10 N -1.23 3.08 -1.58 3.55 0.00 -1.26 -3.73 121.76 120.59 2jdm s ALA 10 Ca 0.64 1.12 0.00 0.00 0.00 0.00 0.00 51.96 53.71 2jdm s ALA 10 Cb -0.47 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.20 2jdm s ALA 10 CO 0.56 -0.82 0.00 0.09 0.00 0.00 0.00 175.76 175.59 2jdm n ASN 11 N -0.25 -5.10 -4.32 0.00 3.02 0.72 -4.92 115.26 104.42 2jdm n ASN 11 Ca 0.06 0.10 -0.32 0.00 -0.03 0.00 0.00 54.58 54.39 2jdm n ASN 11 Cb 0.46 -4.17 -0.15 0.00 -0.61 0.00 0.00 39.78 35.30 2jdm n ASN 11 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2jdm s THR 12 N -2.81 2.55 0.44 3.41 2.01 -1.24 -4.82 115.64 115.18 2jdm s THR 12 Ca 0.00 -0.86 -0.24 0.00 0.31 0.00 0.00 61.69 60.90 2jdm s THR 12 Cb 0.00 -2.01 -0.08 0.00 0.01 0.00 0.00 72.50 70.43 2jdm s THR 12 CO 0.00 0.55 1.20 -0.13 -0.69 0.00 0.00 174.62 175.55 2jdm s ARG 13 N 0.08 3.82 0.04 4.92 0.52 -1.26 -0.90 118.95 126.18 2jdm s ARG 13 Ca -0.08 1.88 -0.03 0.00 -0.52 0.00 0.00 55.73 56.98 2jdm s ARG 13 Cb -0.15 -2.52 -0.02 0.00 0.52 0.00 0.00 34.95 32.77 2jdm s ARG 13 CO 0.05 -0.53 0.04 -0.59 0.02 0.00 0.00 175.30 174.30 2jdm s PHE 14 N -1.45 0.31 0.02 -0.53 -0.71 0.87 -4.36 117.98 112.13 2jdm s PHE 14 Ca 0.61 -0.70 -0.11 0.00 -1.04 0.00 0.00 56.93 55.70 2jdm s PHE 14 Cb -0.31 -0.22 -0.05 0.00 -1.21 0.00 0.00 43.02 41.22 2jdm s PHE 14 CO 0.39 -0.35 0.37 0.20 -1.34 0.00 0.00 175.22 174.48 2jdm s GLY 15 N -2.32 2.37 -0.04 1.99 0.00 -0.11 -1.12 107.32 108.08 2jdm s GLY 15 Ca -0.02 -0.36 0.02 0.00 0.00 0.00 0.00 44.72 44.36 2jdm s GLY 15 CO -0.06 -0.08 -0.09 0.54 0.00 0.00 0.00 173.10 173.40 2jdm s VAL 16 N -1.23 0.85 -0.03 1.40 0.11 -0.30 -0.89 120.40 120.31 2jdm s VAL 16 Ca 0.27 -0.35 -0.01 0.00 -2.93 0.00 0.00 61.98 58.96 2jdm s VAL 16 Cb -0.15 -0.78 0.02 0.00 -1.53 0.00 0.00 36.38 33.94 2jdm s VAL 16 CO 0.15 0.28 0.07 -0.89 -3.33 0.00 0.00 175.10 171.37 2jdm s THR 17 N 0.49 -0.03 -0.01 5.04 2.01 -0.17 -1.25 115.64 121.72 2jdm s THR 17 Ca -0.09 0.12 0.08 0.00 0.31 0.00 0.00 61.69 62.11 2jdm s THR 17 Cb -0.12 -0.12 -0.02 0.00 0.01 0.00 0.00 72.50 72.24 2jdm s THR 17 CO 0.01 0.05 -0.25 0.00 -0.69 0.00 0.00 174.62 173.74 2jdm s ALA 18 N 0.68 2.22 0.05 7.40 0.00 -0.14 -1.06 121.76 130.91 2jdm s ALA 18 Ca -0.05 -1.13 0.08 0.00 0.00 0.00 0.00 51.96 50.85 2jdm s ALA 18 Cb -0.08 -0.57 -0.03 0.00 0.00 0.00 0.00 23.12 22.45 2jdm s ALA 18 CO -0.03 0.53 -0.22 -0.06 0.00 0.00 0.00 175.76 175.99 2jdm s PHE 19 N -0.66 1.95 -0.08 0.00 0.40 0.77 -1.64 117.98 118.73 2jdm s PHE 19 Ca 0.10 -0.38 0.02 0.00 -0.60 0.00 0.00 56.93 56.07 2jdm s PHE 19 Cb -0.10 -1.16 -0.02 0.00 0.51 0.00 0.00 43.02 42.25 2jdm s PHE 19 CO -0.00 0.10 -0.14 0.00 0.70 0.00 0.00 175.22 175.89 2jdm s ALA 20 N -0.81 2.66 -0.43 5.36 0.00 -0.70 -0.98 121.76 126.87 2jdm s ALA 20 Ca 0.09 -0.94 0.07 0.00 0.00 0.00 0.00 51.96 51.17 2jdm s ALA 20 Cb -0.09 -1.06 0.23 0.00 0.00 0.00 0.00 23.12 22.20 2jdm s ALA 20 CO 0.02 0.45 0.59 0.09 0.00 0.00 0.00 175.76 176.91 2jdm n ASN 21 N 2.72 -1.02 -3.47 0.00 3.02 -0.50 -1.45 115.26 114.55 2jdm n ASN 21 Ca -0.18 -2.79 -0.10 0.00 -0.03 0.00 0.00 54.58 51.48 2jdm n ASN 21 Cb 0.52 0.18 -0.02 0.00 -0.61 0.00 0.00 39.78 39.86 2jdm n ASN 21 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jdm s ALA 22 N -0.31 -1.73 0.09 5.41 0.00 0.19 -4.04 121.76 121.38 2jdm s ALA 22 Ca 0.33 0.79 0.22 0.00 0.00 0.00 0.00 51.96 53.31 2jdm s ALA 22 Cb 0.14 0.61 0.77 0.00 0.00 0.00 0.00 23.12 24.65 2jdm s ALA 22 CO -0.15 -0.72 1.76 0.66 0.00 0.00 0.00 175.76 177.31 2jdm h SER 23 N 2.01 0.00 -3.05 0.00 4.64 -1.97 -3.34 113.55 111.84 2jdm h SER 23 Ca -0.27 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.48 2jdm h SER 23 Cb 1.27 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.33 2jdm h SER 23 CO 0.34 0.27 -0.32 -0.83 -0.87 0.00 0.00 176.83 175.43 2jdm s GLY 24 N -4.31 2.06 0.05 -0.77 0.00 -1.26 -4.91 107.32 98.18 2jdm s GLY 24 Ca 0.01 -0.66 -0.31 0.00 0.00 0.00 0.00 44.72 43.76 2jdm s GLY 24 CO 0.66 -0.59 1.59 -1.59 0.00 0.00 0.00 173.10 173.17 2jdm s THR 25 N -1.75 3.20 0.18 0.90 2.01 -1.26 -4.76 115.64 114.15 2jdm s THR 25 Ca 0.40 0.63 -0.12 0.00 0.31 0.00 0.00 61.69 62.91 2jdm s THR 25 Cb -0.12 -3.40 -0.07 0.00 0.01 0.00 0.00 72.50 68.92 2jdm s THR 25 CO 0.27 -0.00 0.53 -1.10 -0.69 0.00 0.00 174.62 173.63 2jdm s GLN 26 N 2.59 3.88 -0.11 4.92 -1.52 -0.11 -4.30 119.66 125.01 2jdm s GLN 26 Ca 0.71 0.36 -0.01 0.00 -1.95 0.00 0.00 55.36 54.48 2jdm s GLN 26 Cb -0.38 -2.81 0.03 0.00 -0.22 0.00 0.00 33.01 29.62 2jdm s GLN 26 CO 0.31 0.42 -0.07 0.99 -0.25 0.00 0.00 175.29 176.69 2jdm s THR 27 N -1.61 0.97 -0.18 -0.19 2.01 -0.26 -2.56 115.64 113.83 2jdm s THR 27 Ca 0.41 -0.27 -0.03 0.00 0.31 0.00 0.00 61.69 62.12 2jdm s THR 27 Cb -0.13 -1.01 -0.02 0.00 0.01 0.00 0.00 72.50 71.35 2jdm s THR 27 CO 0.20 0.35 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.73 2jdm s VAL 28 N 1.73 3.51 -0.11 3.82 1.01 0.75 -0.87 120.40 130.24 2jdm s VAL 28 Ca 0.05 -0.48 0.02 0.00 0.00 0.00 0.00 61.98 61.57 2jdm s VAL 28 Cb -0.13 -2.55 -0.01 0.00 0.00 0.00 0.00 36.38 33.70 2jdm s VAL 28 CO -0.08 0.47 -0.18 0.20 0.00 0.00 0.00 175.10 175.52 2jdm s ASN 29 N 0.80 3.65 -0.22 3.32 0.01 0.07 -0.47 114.94 122.10 2jdm s ASN 29 Ca -0.02 -0.41 -0.02 0.00 -0.71 0.00 0.00 52.86 51.70 2jdm s ASN 29 Cb -0.15 -1.46 0.00 0.00 0.41 0.00 0.00 41.25 40.06 2jdm s ASN 29 CO 0.02 0.18 -0.08 -0.69 -1.51 0.00 0.00 177.10 175.01 2jdm s VAL 30 N 0.26 2.99 -0.15 1.60 1.01 0.35 -1.06 120.40 125.39 2jdm s VAL 30 Ca -0.12 -0.69 -0.05 0.00 0.00 0.00 0.00 61.98 61.11 2jdm s VAL 30 Cb -0.16 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 2jdm s VAL 30 CO 0.06 0.40 0.02 -0.76 0.00 0.00 0.00 175.10 174.83 2jdm s LEU 31 N 1.41 3.62 -0.17 3.92 1.02 0.57 -0.09 118.68 128.96 2jdm s LEU 31 Ca 0.05 0.05 0.01 0.00 0.02 0.00 0.00 54.13 54.26 2jdm s LEU 31 Cb -0.14 -1.88 0.02 0.00 0.02 0.00 0.00 46.19 44.20 2jdm s LEU 31 CO -0.06 0.23 -0.20 -0.69 0.02 0.00 0.00 176.35 175.65 2jdm s VAL 32 N 0.04 2.03 -1.41 -1.59 1.01 0.11 -1.07 120.40 119.51 2jdm s VAL 32 Ca 0.03 -0.93 -0.01 0.00 0.00 0.00 0.00 61.98 61.08 2jdm s VAL 32 Cb -0.13 -1.83 0.00 0.00 0.00 0.00 0.00 36.38 34.43 2jdm s VAL 32 CO 0.02 0.54 0.43 -3.20 0.00 0.00 0.00 175.10 172.88 2jdm n ASN 33 N 4.54 -0.40 -0.61 3.32 5.15 -0.40 -2.38 115.26 124.48 2jdm n ASN 33 Ca -0.21 -1.00 -0.08 0.00 -0.60 0.00 0.00 54.58 52.69 2jdm n ASN 33 Cb 0.50 -3.08 -0.03 0.00 -0.53 0.00 0.00 39.78 36.64 2jdm n ASN 33 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2jdm n ASN 34 N -2.98 -4.71 -4.15 1.20 3.02 -1.26 -5.01 115.26 101.37 2jdm n ASN 34 Ca -0.30 0.20 -0.27 0.00 -0.03 0.00 0.00 54.58 54.18 2jdm n ASN 34 Cb 0.68 -2.91 -0.16 0.00 -0.61 0.00 0.00 39.78 36.78 2jdm n ASN 34 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2jdm s GLU 35 N -2.38 1.92 0.04 3.52 0.41 -1.00 -5.07 118.70 116.14 2jdm s GLU 35 Ca 0.00 -0.66 -0.33 0.00 -0.41 0.00 0.00 54.97 53.57 2jdm s GLU 35 Cb 0.00 -1.65 -0.12 0.00 -1.78 0.00 0.00 34.13 30.58 2jdm s GLU 35 CO 0.00 0.26 1.79 2.41 -0.49 0.00 0.00 175.26 179.23 2jdm n THR 36 N 3.13 0.38 -0.01 3.63 -1.04 -1.26 -0.72 114.28 118.38 2jdm n THR 36 Ca -0.18 -0.07 0.02 0.00 -2.04 0.00 0.00 64.05 61.78 2jdm n THR 36 Cb 0.53 -1.88 -0.06 0.00 -1.82 0.00 0.00 70.33 67.10 2jdm n THR 36 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jdm n ALA 37 N 5.55 2.14 -3.43 2.41 0.00 0.88 -4.87 120.51 123.19 2jdm n ALA 37 Ca 0.20 -0.29 -0.16 0.00 0.00 0.00 0.00 53.44 53.19 2jdm n ALA 37 Cb 0.32 -0.16 -0.07 0.00 0.00 0.00 0.00 19.45 19.54 2jdm n ALA 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jdm s ALA 38 N -2.44 -1.41 -0.04 0.00 0.00 -1.06 -5.01 121.76 111.80 2jdm s ALA 38 Ca -0.03 1.12 -0.00 0.00 0.00 0.00 0.00 51.96 53.04 2jdm s ALA 38 Cb 0.04 -0.21 0.03 0.00 0.00 0.00 0.00 23.12 22.98 2jdm s ALA 38 CO 0.32 -0.32 0.00 0.99 0.00 0.00 0.00 175.76 176.76 2jdm s THR 39 N -0.86 0.23 0.13 0.00 2.01 -1.26 -0.49 115.64 115.39 2jdm s THR 39 Ca -0.09 0.10 0.10 0.00 0.31 0.00 0.00 61.69 62.11 2jdm s THR 39 Cb -0.02 -0.34 -0.04 0.00 0.01 0.00 0.00 72.50 72.10 2jdm s THR 39 CO 0.06 0.18 -0.24 -0.36 -0.69 0.00 0.00 174.62 173.57 2jdm s PHE 40 N 1.30 2.38 -0.06 4.92 0.08 0.38 -4.97 117.98 122.01 2jdm s PHE 40 Ca -0.06 -0.34 -0.22 0.00 0.12 0.00 0.00 56.93 56.43 2jdm s PHE 40 Cb -0.13 -1.28 0.05 0.00 -0.57 0.00 0.00 43.02 41.09 2jdm s PHE 40 CO -0.02 0.36 0.50 0.45 -0.10 0.00 0.00 175.22 176.40 2jdm s SER 41 N -2.11 -0.44 0.00 1.36 0.15 -1.26 -0.18 113.70 111.22 2jdm s SER 41 Ca 0.15 0.52 0.00 0.00 0.70 0.00 0.00 55.95 57.33 2jdm s SER 41 Cb -0.10 0.55 0.00 0.00 -1.71 0.00 0.00 66.02 64.76 2jdm s SER 41 CO 0.07 -0.46 0.00 0.61 1.20 0.00 0.00 173.24 174.66 2jdm n GLY 42 N 1.43 -1.52 2.70 9.45 0.00 -1.06 -4.87 105.19 111.32 2jdm n GLY 42 Ca -0.19 -1.06 -0.20 0.00 0.00 0.00 0.00 46.02 44.57 2jdm n GLY 42 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jdm s GLN 43 N -1.75 0.07 -0.23 1.61 -0.44 -1.26 -0.93 119.66 116.73 2jdm s GLN 43 Ca 0.00 0.30 -0.25 0.00 -2.50 0.00 0.00 55.36 52.91 2jdm s GLN 43 Cb 0.00 -0.57 0.07 0.00 -1.64 0.00 0.00 33.01 30.86 2jdm s GLN 43 CO 0.00 -0.30 0.70 0.45 0.50 0.00 0.00 175.29 176.63 2jdm s SER 44 N 1.99 -0.72 -0.31 6.67 0.15 -1.25 -5.01 113.70 115.22 2jdm s SER 44 Ca 0.03 1.29 0.09 0.00 0.70 0.00 0.00 55.95 58.07 2jdm s SER 44 Cb -0.12 1.28 0.56 0.00 -1.71 0.00 0.00 66.02 66.03 2jdm s SER 44 CO -0.03 -0.30 1.57 0.35 1.20 0.00 0.00 173.24 176.03 2jdm n THR 45 N 2.41 2.67 -2.61 6.45 -2.24 -1.26 -0.64 114.28 119.06 2jdm n THR 45 Ca -0.15 -2.37 0.00 0.00 -2.27 0.00 0.00 64.05 59.26 2jdm n THR 45 Cb 0.55 -0.34 0.04 0.00 -2.10 0.00 0.00 70.33 68.48 2jdm n THR 45 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2jdm n ASN 46 N -0.96 0.63 -1.94 3.42 5.15 -1.25 -4.88 115.26 115.44 2jdm n ASN 46 Ca 0.37 -2.04 -0.16 0.00 -0.60 0.00 0.00 54.58 52.15 2jdm n ASN 46 Cb 1.17 -0.16 -0.00 0.00 -0.53 0.00 0.00 39.78 40.26 2jdm n ASN 46 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2jdm n ASN 47 N -0.33 -4.86 -4.72 1.20 5.15 -0.53 -4.94 115.26 106.23 2jdm n ASN 47 Ca -0.01 -0.05 -0.42 0.00 -0.60 0.00 0.00 54.58 53.50 2jdm n ASN 47 Cb 0.91 -3.94 -0.00 0.00 -0.53 0.00 0.00 39.78 36.22 2jdm n ASN 47 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jdm n ALA 48 N -2.02 1.54 -2.75 5.20 0.00 -1.22 -4.55 120.51 116.71 2jdm n ALA 48 Ca -0.17 0.35 -0.43 0.00 0.00 0.00 0.00 53.44 53.19 2jdm n ALA 48 Cb 0.64 -2.29 -0.02 0.00 0.00 0.00 0.00 19.45 17.77 2jdm n ALA 48 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2jdm s VAL 49 N -1.11 4.37 0.05 0.00 1.01 -1.26 -1.72 120.40 121.75 2jdm s VAL 49 Ca 0.55 -1.37 0.33 0.00 0.00 0.00 0.00 61.98 61.49 2jdm s VAL 49 Cb -0.54 -4.94 0.37 0.00 0.00 0.00 0.00 36.38 31.27 2jdm s VAL 49 CO 0.62 -1.74 1.97 0.16 0.00 0.00 0.00 175.10 176.11 2jdm h ILE 50 N 6.09 0.00 -1.70 2.22 3.07 -1.64 -3.45 117.51 122.10 2jdm h ILE 50 Ca 0.22 -0.43 0.09 0.00 1.55 0.00 0.00 64.86 66.28 2jdm h ILE 50 Cb 0.99 1.39 -0.21 0.00 -0.27 0.00 0.00 36.82 38.71 2jdm h ILE 50 CO 1.28 0.00 0.54 -0.83 -1.05 0.00 0.00 178.15 178.09 2jdm s GLY 51 N -4.08 -0.31 -0.07 0.16 0.00 -1.23 -4.26 107.32 97.54 2jdm s GLY 51 Ca 0.01 1.81 -0.12 0.00 0.00 0.00 0.00 44.72 46.42 2jdm s GLY 51 CO 0.51 0.88 0.29 -1.08 0.00 0.00 0.00 173.10 173.70 2jdm s THR 52 N -1.53 0.03 -0.03 0.90 -1.32 -1.26 -0.97 115.64 111.46 2jdm s THR 52 Ca -0.00 -0.23 -0.29 0.00 -1.21 0.00 0.00 61.69 59.95 2jdm s THR 52 Cb -0.01 -0.49 0.08 0.00 -1.51 0.00 0.00 72.50 70.57 2jdm s THR 52 CO -0.00 -0.13 0.71 -1.58 -2.21 0.00 0.00 174.62 171.41 2jdm s GLN 53 N -0.50 1.03 -0.18 7.08 0.74 -0.38 -5.01 119.66 122.45 2jdm s GLN 53 Ca -0.06 0.10 -0.05 0.00 0.05 0.00 0.00 55.36 55.40 2jdm s GLN 53 Cb -0.04 0.48 -0.03 0.00 1.10 0.00 0.00 33.01 34.53 2jdm s GLN 53 CO 0.02 -0.35 0.00 0.08 -0.55 0.00 0.00 175.29 174.49 2jdm s VAL 54 N -1.69 4.19 0.23 1.34 1.01 -1.26 -1.15 120.40 123.07 2jdm s VAL 54 Ca -0.07 -0.25 0.06 0.00 0.00 0.00 0.00 61.98 61.72 2jdm s VAL 54 Cb -0.00 -2.87 -0.05 0.00 0.00 0.00 0.00 36.38 33.46 2jdm s VAL 54 CO 0.04 0.47 -0.08 -0.76 0.00 0.00 0.00 175.10 174.77 2jdm s LEU 55 N 0.53 2.45 -0.17 3.92 1.43 -0.28 -4.96 118.68 121.60 2jdm s LEU 55 Ca -0.01 -1.12 -0.06 0.00 -1.03 0.00 0.00 54.13 51.91 2jdm s LEU 55 Cb -0.14 -0.52 -0.04 0.00 0.03 0.00 0.00 46.19 45.52 2jdm s LEU 55 CO 0.02 -0.33 0.04 0.21 0.23 0.00 0.00 176.35 176.53 2jdm s ASN 56 N -3.33 5.50 0.26 2.29 3.84 -1.26 -0.09 114.94 122.14 2jdm s ASN 56 Ca 0.25 0.07 0.20 0.00 0.21 0.00 0.00 52.86 53.59 2jdm s ASN 56 Cb 0.03 -1.90 0.98 0.00 -0.55 0.00 0.00 41.25 39.81 2jdm s ASN 56 CO 0.08 0.20 1.61 -1.54 -2.79 0.00 0.00 177.10 174.66 2jdm n SER 57 N 3.37 0.53 -0.47 -4.21 3.41 -0.08 -4.89 113.62 111.27 2jdm n SER 57 Ca -0.17 0.70 0.05 0.00 -0.26 0.00 0.00 58.87 59.19 2jdm n SER 57 Cb 0.52 -0.78 -0.01 0.00 -0.26 0.00 0.00 64.21 63.68 2jdm n SER 57 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jdm n GLY 58 N -0.80 -2.02 0.34 5.00 0.00 -1.26 -2.41 105.19 104.03 2jdm n GLY 58 Ca 0.00 -1.37 0.04 0.00 0.00 0.00 0.00 46.02 44.70 2jdm n GLY 58 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2jdm h SER 59 N -0.35 0.65 0.89 1.61 4.64 -1.94 0.21 113.55 119.26 2jdm h SER 59 Ca 0.01 -0.01 -0.19 0.00 -0.47 0.00 0.00 61.79 61.13 2jdm h SER 59 Cb 0.35 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.25 2jdm h SER 59 CO 0.00 0.45 -1.20 0.77 -0.87 0.00 0.00 176.83 175.98 2jdm h SER 60 N 0.75 0.00 -0.02 4.97 4.64 -1.97 -3.43 113.55 118.49 2jdm h SER 60 Ca 0.25 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.56 2jdm h SER 60 Cb 0.07 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2jdm h SER 60 CO -0.07 0.73 -0.01 0.61 -0.87 0.00 0.00 176.83 177.23 2jdm n GLY 61 N 1.38 0.23 3.69 -0.77 0.00 -1.01 -4.80 105.19 103.92 2jdm n GLY 61 Ca -0.07 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 2jdm n GLY 61 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jdm s LYS 62 N -1.29 4.42 -0.06 1.61 2.20 -1.26 -0.14 119.74 125.21 2jdm s LYS 62 Ca 0.00 1.53 0.02 0.00 -0.36 0.00 0.00 55.97 57.15 2jdm s LYS 62 Cb 0.00 -3.52 0.02 0.00 -1.51 0.00 0.00 37.83 32.82 2jdm s LYS 62 CO 0.00 -0.32 -0.09 0.08 -0.36 0.00 0.00 175.35 174.66 2jdm s VAL 63 N 1.86 0.91 -0.01 4.02 1.01 -0.35 -1.28 120.40 126.57 2jdm s VAL 63 Ca 0.52 -0.33 0.04 0.00 0.00 0.00 0.00 61.98 62.22 2jdm s VAL 63 Cb -0.22 -0.87 -0.01 0.00 0.00 0.00 0.00 36.38 35.28 2jdm s VAL 63 CO 0.22 0.31 -0.13 -1.58 0.00 0.00 0.00 175.10 173.92 2jdm s GLN 64 N 0.88 1.07 -0.11 2.72 0.74 -0.24 -0.89 119.66 123.84 2jdm s GLN 64 Ca -0.11 -0.47 0.00 0.00 0.05 0.00 0.00 55.36 54.83 2jdm s GLN 64 Cb -0.15 -1.04 -0.02 0.00 1.10 0.00 0.00 33.01 32.91 2jdm s GLN 64 CO 0.01 0.28 -0.12 0.08 -0.55 0.00 0.00 175.29 174.99 2jdm s VAL 65 N -0.30 3.19 -0.01 1.34 1.01 0.33 -0.32 120.40 125.64 2jdm s VAL 65 Ca 0.05 -0.63 0.04 0.00 0.00 0.00 0.00 61.98 61.44 2jdm s VAL 65 Cb -0.05 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 34.00 2jdm s VAL 65 CO -0.00 0.54 -0.13 -1.10 0.00 0.00 0.00 175.10 174.41 2jdm s GLN 66 N 0.03 1.03 -0.01 2.72 -0.21 -0.23 -4.76 119.66 118.23 2jdm s GLN 66 Ca -0.04 -0.45 0.05 0.00 0.02 0.00 0.00 55.36 54.94 2jdm s GLN 66 Cb -0.14 -1.00 -0.01 0.00 1.00 0.00 0.00 33.01 32.86 2jdm s GLN 66 CO 0.04 0.27 -0.16 0.08 -2.12 0.00 0.00 175.29 173.40 2jdm s VAL 67 N -0.30 1.27 0.04 1.09 1.01 -1.26 -0.75 120.40 121.50 2jdm s VAL 67 Ca 0.05 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.35 2jdm s VAL 67 Cb -0.05 -1.06 -0.03 0.00 0.00 0.00 0.00 36.38 35.24 2jdm s VAL 67 CO -0.00 0.36 -0.04 -0.94 0.00 0.00 0.00 175.10 174.47 2jdm s SER 68 N -0.35 0.50 -0.03 3.32 1.04 -0.05 -0.97 113.70 117.17 2jdm s SER 68 Ca 0.06 -0.63 0.01 0.00 0.48 0.00 0.00 55.95 55.86 2jdm s SER 68 Cb -0.06 0.10 0.02 0.00 0.10 0.00 0.00 66.02 66.17 2jdm s SER 68 CO -0.00 -0.34 -0.02 -0.69 0.98 0.00 0.00 173.24 173.16 2jdm s VAL 69 N -2.01 0.32 -1.46 5.02 1.01 -0.15 -1.10 120.40 122.03 2jdm s VAL 69 Ca -0.09 -0.05 -0.07 0.00 0.00 0.00 0.00 61.98 61.77 2jdm s VAL 69 Cb -0.06 -0.36 0.07 0.00 0.00 0.00 0.00 36.38 36.04 2jdm s VAL 69 CO -0.02 0.15 0.19 -0.46 0.00 0.00 0.00 175.10 174.95 2jdm n ASN 70 N 3.78 -0.02 -0.86 3.32 0.23 -1.26 -0.58 115.26 119.86 2jdm n ASN 70 Ca -0.23 -1.11 -0.11 0.00 -0.53 0.00 0.00 54.58 52.61 2jdm n ASN 70 Cb 0.53 -1.40 -0.04 0.00 -2.08 0.00 0.00 39.78 36.79 2jdm n ASN 70 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2jdm n GLY 71 N -1.90 1.02 3.14 4.83 0.00 -1.26 -5.01 105.19 106.02 2jdm n GLY 71 Ca -0.15 -0.54 -0.28 0.00 0.00 0.00 0.00 46.02 45.05 2jdm n GLY 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jdm s ARG 72 N -3.11 2.26 0.13 1.61 0.52 0.25 -5.10 118.95 115.51 2jdm s ARG 72 Ca 0.00 -0.67 -0.31 0.00 -0.52 0.00 0.00 55.73 54.23 2jdm s ARG 72 Cb 0.00 -1.82 -0.08 0.00 0.52 0.00 0.00 34.95 33.57 2jdm s ARG 72 CO 0.00 0.17 1.38 -2.14 0.02 0.00 0.00 175.30 174.74 2jdm s PRO 73 N 0.30 4.33 0.46 3.54 0.02 -1.26 -0.98 135.00 141.41 2jdm s PRO 73 Ca -0.12 2.08 -0.17 0.00 0.02 0.00 0.00 61.00 62.81 2jdm s PRO 73 Cb -0.15 -3.23 -0.09 0.00 0.02 0.00 0.00 34.50 31.05 2jdm s PRO 73 CO 0.05 -0.41 0.94 -1.12 -0.33 0.00 0.00 177.00 176.13 2jdm s SER 74 N 0.97 6.73 0.24 2.53 0.01 -0.15 -4.93 113.70 119.11 2jdm s SER 74 Ca 0.63 1.55 -0.30 0.00 1.31 0.00 0.00 55.95 59.15 2jdm s SER 74 Cb -0.37 -2.49 -0.09 0.00 0.21 0.00 0.00 66.02 63.28 2jdm s SER 74 CO 0.32 -0.47 0.99 -0.62 0.41 0.00 0.00 173.24 173.87 2jdm s ASP 75 N -2.72 7.52 0.09 2.44 2.15 -0.70 -4.76 116.67 120.69 2jdm s ASP 75 Ca 0.59 2.04 0.07 0.00 0.43 0.00 0.00 52.55 55.68 2jdm s ASP 75 Cb -0.10 -2.61 -0.04 0.00 -0.30 0.00 0.00 42.92 39.87 2jdm s ASP 75 CO 0.24 0.05 -0.15 -0.76 -0.17 0.00 0.00 175.17 174.38 2jdm s LEU 76 N -1.16 2.81 0.03 -1.34 1.43 -1.26 -0.38 118.68 118.81 2jdm s LEU 76 Ca 0.43 -0.44 0.04 0.00 -1.03 0.00 0.00 54.13 53.12 2jdm s LEU 76 Cb -0.28 -1.65 -0.02 0.00 0.03 0.00 0.00 46.19 44.28 2jdm s LEU 76 CO 0.34 0.21 -0.12 0.68 0.23 0.00 0.00 176.35 177.69 2jdm s VAL 77 N -1.10 0.97 0.16 -1.59 -7.23 -0.42 -4.85 120.40 106.35 2jdm s VAL 77 Ca 0.18 -0.84 -0.17 0.00 -1.81 0.00 0.00 61.98 59.34 2jdm s VAL 77 Cb -0.11 -0.88 0.03 0.00 0.56 0.00 0.00 36.38 35.99 2jdm s VAL 77 CO 0.10 0.04 0.47 -0.94 -0.31 0.00 0.00 175.10 174.46 2jdm s SER 78 N -0.91 -0.26 0.09 4.85 1.04 -1.26 -0.88 113.70 116.37 2jdm s SER 78 Ca 0.01 -0.40 -0.26 0.00 0.48 0.00 0.00 55.95 55.79 2jdm s SER 78 Cb -0.07 0.53 0.08 0.00 0.10 0.00 0.00 66.02 66.66 2jdm s SER 78 CO 0.01 -0.96 0.85 0.00 0.98 0.00 0.00 173.24 174.12 2jdm s ALA 79 N -3.84 -1.69 -0.04 5.32 0.00 -0.92 -4.94 121.76 115.65 2jdm s ALA 79 Ca 0.07 0.54 0.06 0.00 0.00 0.00 0.00 51.96 52.63 2jdm s ALA 79 Cb 0.00 0.60 -0.02 0.00 0.00 0.00 0.00 23.12 23.70 2jdm s ALA 79 CO -0.07 -0.84 -0.23 -1.14 0.00 0.00 0.00 175.76 173.48 2jdm s GLN 80 N -3.34 2.33 -0.05 0.00 0.74 -1.26 -0.71 119.66 117.38 2jdm s GLN 80 Ca 0.07 -0.87 0.04 0.00 0.05 0.00 0.00 55.36 54.65 2jdm s GLN 80 Cb -0.02 -2.15 -0.00 0.00 1.10 0.00 0.00 33.01 31.94 2jdm s GLN 80 CO -0.05 0.52 -0.17 0.08 -0.55 0.00 0.00 175.29 175.12 2jdm s VAL 81 N -0.50 1.43 -0.15 1.34 1.01 0.03 -5.00 120.40 118.56 2jdm s VAL 81 Ca 0.06 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.36 2jdm s VAL 81 Cb -0.11 -1.24 0.01 0.00 0.00 0.00 0.00 36.38 35.04 2jdm s VAL 81 CO 0.01 0.41 -0.20 -0.63 0.00 0.00 0.00 175.10 174.69 2jdm s ILE 82 N 0.15 2.23 -0.11 2.22 1.01 -1.26 -1.53 121.20 123.91 2jdm s ILE 82 Ca -0.06 -0.91 -0.05 0.00 0.00 0.00 0.00 60.65 59.62 2jdm s ILE 82 Cb -0.13 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 2jdm s ILE 82 CO 0.03 0.54 0.10 -0.76 0.00 0.00 0.00 174.94 174.84 2jdm s LEU 83 N 0.92 4.15 -1.79 2.97 1.43 0.18 -4.57 118.68 121.98 2jdm s LEU 83 Ca -0.04 0.37 -0.19 0.00 -1.03 0.00 0.00 54.13 53.24 2jdm s LEU 83 Cb -0.15 -2.00 0.18 0.00 0.03 0.00 0.00 46.19 44.25 2jdm s LEU 83 CO -0.04 0.40 0.57 1.07 0.23 0.00 0.00 176.35 178.58 2jdm n THR 84 N 2.02 -0.47 -1.41 5.49 5.66 -1.26 -1.21 114.28 123.09 2jdm n THR 84 Ca -0.20 -0.08 -0.15 0.00 -3.05 0.00 0.00 64.05 60.58 2jdm n THR 84 Cb 0.55 -0.92 -0.06 0.00 -1.55 0.00 0.00 70.33 68.34 2jdm n THR 84 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2jdm n ASN 85 N -2.58 -4.01 0.00 1.09 5.15 -1.26 -4.59 115.26 109.06 2jdm n ASN 85 Ca 0.04 0.36 0.00 0.00 -0.60 0.00 0.00 54.58 54.38 2jdm n ASN 85 Cb 0.50 -3.63 0.00 0.00 -0.53 0.00 0.00 39.78 36.12 2jdm n ASN 85 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2jdm n GLU 86 N -1.89 0.00 -3.66 1.20 -0.58 -0.46 -5.08 120.64 110.18 2jdm n GLU 86 Ca -0.15 0.00 -0.38 0.00 -0.42 0.00 0.00 57.16 56.22 2jdm n GLU 86 Cb 0.49 -0.35 -0.12 0.00 -0.57 0.00 0.00 31.44 30.90 2jdm n GLU 86 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2jdm s LEU 87 N -1.80 3.85 -0.06 -4.62 2.96 -0.35 -4.49 118.68 114.17 2jdm s LEU 87 Ca 0.00 -0.18 0.01 0.00 -0.22 0.00 0.00 54.13 53.74 2jdm s LEU 87 Cb 0.00 -2.03 -0.03 0.00 0.50 0.00 0.00 46.19 44.63 2jdm s LEU 87 CO 0.00 -0.08 -0.07 0.20 -1.32 0.00 0.00 176.35 175.09 2jdm s ASN 88 N 1.68 4.65 -0.05 3.68 -0.87 0.07 -0.64 114.94 123.46 2jdm s ASN 88 Ca 0.06 -0.04 0.02 0.00 -1.57 0.00 0.00 52.86 51.33 2jdm s ASN 88 Cb -0.16 -1.15 0.02 0.00 -0.02 0.00 0.00 41.25 39.93 2jdm s ASN 88 CO 0.08 0.35 -0.08 -0.36 -2.57 0.00 0.00 177.10 174.52 2jdm s PHE 89 N -0.85 1.02 -0.15 2.20 0.40 -0.58 -2.30 117.98 117.72 2jdm s PHE 89 Ca 0.13 -0.33 -0.02 0.00 -0.60 0.00 0.00 56.93 56.12 2jdm s PHE 89 Cb -0.11 -0.81 -0.02 0.00 0.51 0.00 0.00 43.02 42.59 2jdm s PHE 89 CO 0.03 -0.21 -0.08 0.00 0.70 0.00 0.00 175.22 175.65 2jdm s ALA 90 N 0.74 2.80 -0.06 5.36 0.00 -0.20 -0.79 121.76 129.61 2jdm s ALA 90 Ca -0.12 -0.89 0.06 0.00 0.00 0.00 0.00 51.96 51.00 2jdm s ALA 90 Cb -0.14 -1.41 -0.01 0.00 0.00 0.00 0.00 23.12 21.55 2jdm s ALA 90 CO 0.02 0.16 -0.24 -0.51 0.00 0.00 0.00 175.76 175.19 2jdm s LEU 91 N 0.48 2.04 -0.04 0.00 1.43 0.12 -0.45 118.68 122.26 2jdm s LEU 91 Ca -0.06 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 52.56 2jdm s LEU 91 Cb -0.15 -1.31 0.02 0.00 0.03 0.00 0.00 46.19 44.77 2jdm s LEU 91 CO 0.04 0.22 -0.06 -0.69 0.23 0.00 0.00 176.35 176.09 2jdm s VAL 92 N -0.09 0.65 0.23 -1.59 1.01 0.24 -2.17 120.40 118.68 2jdm s VAL 92 Ca -0.05 -0.21 0.10 0.00 0.00 0.00 0.00 61.98 61.82 2jdm s VAL 92 Cb -0.14 -0.64 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 2jdm s VAL 92 CO 0.04 0.24 -0.13 -0.83 0.00 0.00 0.00 175.10 174.42 2jdm s GLY 93 N 0.73 1.75 -0.02 4.51 0.00 -0.06 -0.87 107.32 113.36 2jdm s GLY 93 Ca -0.11 -1.66 -0.08 0.00 0.00 0.00 0.00 44.72 42.88 2jdm s GLY 93 CO 0.01 -1.71 0.17 -1.35 0.00 0.00 0.00 173.10 170.22 2jdm s SER 94 N -3.19 -0.07 -0.13 1.64 1.04 -0.88 -1.30 113.70 110.81 2jdm s SER 94 Ca 0.27 0.01 0.03 0.00 0.48 0.00 0.00 55.95 56.74 2jdm s SER 94 Cb -0.07 0.27 0.01 0.00 0.10 0.00 0.00 66.02 66.33 2jdm s SER 94 CO 0.15 -0.28 -0.22 -0.70 0.98 0.00 0.00 173.24 173.17 2jdm s GLU 95 N -0.90 3.05 0.00 4.02 2.56 0.49 -2.01 118.70 125.90 2jdm s GLU 95 Ca -0.10 -0.85 0.16 0.00 0.00 0.00 0.00 54.97 54.18 2jdm s GLU 95 Cb -0.05 -2.41 -0.08 0.00 2.00 0.00 0.00 34.13 33.58 2jdm s GLU 95 CO 0.01 0.05 0.79 -0.40 -0.56 0.00 0.00 175.26 175.15 2jdm n ASP 96 N 3.90 1.25 0.00 -1.70 5.68 -1.26 -1.72 116.55 122.70 2jdm n ASP 96 Ca -0.20 -1.13 0.00 0.00 -0.50 0.00 0.00 54.79 52.97 2jdm n ASP 96 Cb 0.52 0.71 0.00 0.00 -1.14 0.00 0.00 41.12 41.21 2jdm n ASP 96 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jdm n GLY 97 N 1.27 5.03 0.00 6.12 0.00 -1.26 -5.04 105.19 111.30 2jdm n GLY 97 Ca 0.05 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.37 2jdm n GLY 97 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jdm n THR 98 N 0.00 0.00 0.73 2.61 -2.24 -1.26 -4.71 114.28 109.41 2jdm n THR 98 Ca 0.00 -0.08 0.13 0.00 -2.27 0.00 0.00 64.05 61.83 2jdm n THR 98 Cb 0.00 0.57 0.49 0.00 -2.10 0.00 0.00 70.33 69.29 2jdm n THR 98 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2jdm n ASP 99 N -1.37 0.43 -3.30 3.42 5.75 -1.26 -4.93 116.55 115.29 2jdm n ASP 99 Ca 0.00 0.55 -0.24 0.00 -0.01 0.00 0.00 54.79 55.10 2jdm n ASP 99 Cb 0.00 -0.66 0.01 0.00 -1.03 0.00 0.00 41.12 39.44 2jdm n ASP 99 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2jdm n ASN 100 N -1.92 -4.57 0.19 -1.12 3.02 -1.26 -4.88 115.26 104.72 2jdm n ASN 100 Ca 0.06 -0.39 0.13 0.00 -0.03 0.00 0.00 54.58 54.35 2jdm n ASN 100 Cb 0.36 -3.73 0.37 0.00 -0.61 0.00 0.00 39.78 36.17 2jdm n ASN 100 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 2jdm h ASP 101 N -1.20 0.00 -2.53 6.41 2.03 -1.94 -3.48 116.42 115.71 2jdm h ASP 101 Ca -0.47 0.00 -0.28 0.00 -0.73 0.00 0.00 57.03 55.55 2jdm h ASP 101 Cb 1.32 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 39.76 2jdm h ASP 101 CO 0.55 0.00 -0.31 -1.22 -1.03 0.00 0.00 179.24 177.24 2jdm n TYR 102 N -2.76 -0.85 -0.31 4.15 4.01 -1.26 -4.80 117.16 115.33 2jdm n TYR 102 Ca 0.04 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.82 2jdm n TYR 102 Cb 0.42 -2.80 0.12 0.00 -0.31 0.00 0.00 39.34 36.77 2jdm n TYR 102 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2jdm n ASN 103 N -1.21 2.75 -0.10 7.72 6.94 -1.19 -2.08 115.26 128.09 2jdm n ASN 103 Ca -0.15 -2.23 -0.11 0.00 -0.02 0.00 0.00 54.58 52.07 2jdm n ASN 103 Cb 0.54 -0.23 -0.03 0.00 -2.36 0.00 0.00 39.78 37.70 2jdm n ASN 103 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 2jdm h ASP 104 N 1.25 0.47 -3.62 0.53 3.32 -1.54 -3.23 116.42 113.59 2jdm h ASP 104 Ca 0.00 -0.27 -0.58 0.00 0.02 0.00 0.00 57.03 56.20 2jdm h ASP 104 Cb 0.79 -0.12 -0.32 0.00 0.22 0.00 0.00 39.33 39.89 2jdm h ASP 104 CO 0.03 0.62 -0.84 0.00 -1.72 0.00 0.00 179.24 177.33 2jdm s ALA 105 N -5.14 1.60 -0.10 3.45 0.00 -1.25 -1.41 121.76 118.90 2jdm s ALA 105 Ca -0.13 -0.67 0.02 0.00 0.00 0.00 0.00 51.96 51.17 2jdm s ALA 105 Cb 0.08 -0.60 -0.01 0.00 0.00 0.00 0.00 23.12 22.59 2jdm s ALA 105 CO 0.75 0.23 -0.16 0.08 0.00 0.00 0.00 175.76 176.66 2jdm s VAL 106 N 0.30 2.78 -0.07 0.00 1.01 -0.15 -2.38 120.40 121.89 2jdm s VAL 106 Ca -0.11 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.13 2jdm s VAL 106 Cb -0.14 -2.12 0.01 0.00 0.00 0.00 0.00 36.38 34.12 2jdm s VAL 106 CO 0.04 0.55 -0.16 -0.69 0.00 0.00 0.00 175.10 174.84 2jdm s VAL 107 N 0.10 1.41 -0.11 2.92 1.01 -0.05 -0.16 120.40 125.52 2jdm s VAL 107 Ca -0.08 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.28 2jdm s VAL 107 Cb -0.15 -1.25 0.00 0.00 0.00 0.00 0.00 36.38 34.98 2jdm s VAL 107 CO 0.05 0.42 -0.22 -0.69 0.00 0.00 0.00 175.10 174.65 2jdm s VAL 108 N 0.47 1.98 -0.09 2.92 1.01 -0.22 -0.59 120.40 125.88 2jdm s VAL 108 Ca -0.14 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 60.90 2jdm s VAL 108 Cb -0.16 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.47 2jdm s VAL 108 CO 0.05 0.54 -0.12 -0.63 0.00 0.00 0.00 175.10 174.94 2jdm s ILE 109 N 0.52 3.23 -0.01 2.22 1.01 0.41 -1.00 121.20 127.57 2jdm s ILE 109 Ca -0.15 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 59.87 2jdm s ILE 109 Cb -0.17 -2.32 0.01 0.00 0.01 0.00 0.00 42.46 40.00 2jdm s ILE 109 CO 0.05 0.56 -0.01 0.54 0.00 0.00 0.00 174.94 176.08 2jdm s ASN 110 N -0.31 0.36 0.11 3.58 4.22 -0.07 -1.04 114.94 121.79 2jdm s ASN 110 Ca 0.03 -0.04 -0.14 0.00 -2.14 0.00 0.00 52.86 50.57 2jdm s ASN 110 Cb -0.13 -0.12 0.02 0.00 1.28 0.00 0.00 41.25 42.31 2jdm s ASN 110 CO 0.03 -0.03 0.33 -1.66 -2.04 0.00 0.00 177.10 173.73 2jdm s TRP 111 N 0.41 -0.09 0.75 1.54 -2.14 -0.97 -0.93 118.94 117.51 2jdm s TRP 111 Ca -0.04 -0.25 -0.10 0.00 2.66 0.00 0.00 56.10 58.37 2jdm s TRP 111 Cb -0.07 0.15 0.07 0.00 -3.10 0.00 0.00 33.47 30.52 2jdm s TRP 111 CO -0.01 -0.64 1.10 -1.25 -2.66 0.00 0.00 176.95 173.49 2jdm s PRO 112 N -3.75 2.15 0.49 3.25 0.04 -1.26 -0.75 135.00 135.17 2jdm s PRO 112 Ca 0.03 0.00 0.07 0.00 0.04 0.00 0.00 61.00 61.14 2jdm s PRO 112 Cb 0.03 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 32.53 2jdm s PRO 112 CO -0.11 -1.39 0.40 -0.51 0.04 0.00 0.00 177.00 175.43 2jdm s LEU 113 N -5.42 3.01 0.00 -3.56 1.43 -1.26 -4.98 118.68 107.90 2jdm s LEU 113 Ca 0.61 -1.03 0.00 0.00 -1.03 0.00 0.00 54.13 52.68 2jdm s LEU 113 Cb -0.11 -1.55 0.00 0.00 0.03 0.00 0.00 46.19 44.57 2jdm s LEU 113 CO 0.47 -0.91 0.00 0.61 0.23 0.00 0.00 176.35 176.76