#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jdm s THR 2 N 0.00 2.09 0.11 0.00 2.01 -1.26 -5.01 115.64 113.58 2jdm s THR 2 Ca 0.00 0.09 0.04 0.00 0.31 0.00 0.00 61.69 62.13 2jdm s THR 2 Cb 0.00 -3.06 -0.04 0.00 0.01 0.00 0.00 72.50 69.42 2jdm s THR 2 CO 0.00 0.02 -0.11 -1.10 -0.69 0.00 0.00 174.62 172.74 2jdm s GLN 3 N -1.58 0.92 -0.46 4.92 -1.52 -1.26 -4.84 119.66 115.85 2jdm s GLN 3 Ca 0.56 -1.22 0.00 0.00 -1.95 0.00 0.00 55.36 52.75 2jdm s GLN 3 Cb -0.47 -0.63 0.00 0.00 -0.22 0.00 0.00 33.01 31.69 2jdm s GLN 3 CO 0.58 0.10 0.00 0.41 -0.25 0.00 0.00 175.29 176.13 2jdm n GLY 4 N 0.44 0.70 3.30 3.09 0.00 -1.26 -4.89 105.19 106.57 2jdm n GLY 4 Ca -0.15 -0.87 -0.33 0.00 0.00 0.00 0.00 46.02 44.67 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 -2.16 2.81 -0.02 1.61 1.01 -1.26 -0.74 120.40 121.65 2jdm s VAL 5 Ca 0.00 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.28 2jdm s VAL 5 Cb 0.00 -2.19 0.00 0.00 0.00 0.00 0.00 36.38 34.19 2jdm s VAL 5 CO 0.00 0.51 -0.08 -0.36 0.00 0.00 0.00 175.10 175.17 2jdm s PHE 6 N 0.71 0.85 -0.36 5.22 0.08 0.74 -5.01 117.98 120.21 2jdm s PHE 6 Ca -0.06 -0.19 -0.17 0.00 0.12 0.00 0.00 56.93 56.63 2jdm s PHE 6 Cb -0.15 -0.59 -0.00 0.00 -0.57 0.00 0.00 43.02 41.70 2jdm s PHE 6 CO 0.02 -0.07 0.43 0.99 -0.10 0.00 0.00 175.22 176.49 2jdm s THR 7 N 0.06 5.09 0.31 0.64 2.01 -1.26 -0.96 115.64 121.54 2jdm s THR 7 Ca -0.01 0.07 0.06 0.00 0.31 0.00 0.00 61.69 62.12 2jdm s THR 7 Cb -0.07 -3.92 -0.02 0.00 0.01 0.00 0.00 72.50 68.51 2jdm s THR 7 CO 0.00 -0.21 0.45 -0.76 -0.69 0.00 0.00 174.62 173.41 2jdm s LEU 8 N 2.18 4.07 0.55 4.42 1.02 0.81 -5.01 118.68 126.72 2jdm s LEU 8 Ca 0.14 -0.06 -0.21 0.00 0.02 0.00 0.00 54.13 54.02 2jdm s LEU 8 Cb -0.16 -2.83 -0.05 0.00 0.02 0.00 0.00 46.19 43.17 2jdm s LEU 8 CO 0.13 -0.33 1.20 -0.81 0.02 0.00 0.00 176.35 176.56 2jdm n PRO 9 N -1.60 1.40 -1.91 1.29 -0.04 -1.26 -4.40 135.00 128.48 2jdm n PRO 9 Ca -0.03 0.52 -0.39 0.00 -0.04 0.00 0.00 63.50 63.56 2jdm n PRO 9 Cb 0.58 -2.39 0.02 0.00 -0.04 0.00 0.00 33.50 31.66 2jdm n PRO 9 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jdm s ALA 10 N -1.35 3.08 -1.40 0.55 0.00 -1.26 -3.78 121.76 117.61 2jdm s ALA 10 Ca 0.72 1.31 -0.07 0.00 0.00 0.00 0.00 51.96 53.92 2jdm s ALA 10 Cb -0.43 -3.53 0.04 0.00 0.00 0.00 0.00 23.12 19.19 2jdm s ALA 10 CO 0.49 -1.10 0.90 0.09 0.00 0.00 0.00 175.76 176.14 2jdm n ASN 11 N -0.41 -3.38 -4.13 0.00 3.02 0.14 -4.90 115.26 105.61 2jdm n ASN 11 Ca 0.07 -0.75 -0.28 0.00 -0.03 0.00 0.00 54.58 53.59 2jdm n ASN 11 Cb 0.44 -4.20 -0.17 0.00 -0.61 0.00 0.00 39.78 35.24 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 -3.45 1.55 0.44 3.41 2.01 -1.25 -4.85 115.64 113.50 2jdm s THR 12 Ca 0.35 -0.74 -0.25 0.00 0.31 0.00 0.00 61.69 61.36 2jdm s THR 12 Cb -0.17 -1.36 -0.08 0.00 0.01 0.00 0.00 72.50 70.90 2jdm s THR 12 CO 0.80 0.45 1.32 -0.13 -0.69 0.00 0.00 174.62 176.37 2jdm s ARG 13 N 0.37 3.78 0.02 4.92 0.52 -1.26 -1.15 118.95 126.16 2jdm s ARG 13 Ca -0.13 2.18 -0.06 0.00 -0.52 0.00 0.00 55.73 57.21 2jdm s ARG 13 Cb -0.15 -2.64 -0.01 0.00 0.52 0.00 0.00 34.95 32.67 2jdm s ARG 13 CO 0.05 -0.66 0.10 -0.59 0.02 0.00 0.00 175.30 174.22 2jdm s PHE 14 N -1.28 0.15 0.10 -0.53 -0.71 -0.04 -4.27 117.98 111.40 2jdm s PHE 14 Ca 0.60 -0.38 -0.09 0.00 -1.04 0.00 0.00 56.93 56.02 2jdm s PHE 14 Cb -0.39 -0.11 -0.06 0.00 -1.21 0.00 0.00 43.02 41.25 2jdm s PHE 14 CO 0.49 -0.32 0.41 0.20 -1.34 0.00 0.00 175.22 174.66 2jdm s GLY 15 N -1.79 2.33 -0.04 1.99 0.00 0.09 -1.35 107.32 108.54 2jdm s GLY 15 Ca -0.10 -0.39 0.00 0.00 0.00 0.00 0.00 44.72 44.23 2jdm s GLY 15 CO -0.02 -0.19 -0.01 0.54 0.00 0.00 0.00 173.10 173.42 2jdm s VAL 16 N -1.46 0.29 -0.01 1.40 0.11 -0.30 -1.41 120.40 119.03 2jdm s VAL 16 Ca 0.35 0.04 0.01 0.00 -2.93 0.00 0.00 61.98 59.45 2jdm s VAL 16 Cb -0.14 -0.38 0.00 0.00 -1.53 0.00 0.00 36.38 34.34 2jdm s VAL 16 CO 0.19 0.18 -0.04 -0.89 -3.33 0.00 0.00 175.10 171.21 2jdm s THR 17 N 1.12 0.36 0.02 5.04 2.01 -0.41 -1.01 115.64 122.77 2jdm s THR 17 Ca -0.08 -0.14 0.06 0.00 0.31 0.00 0.00 61.69 61.83 2jdm s THR 17 Cb -0.14 -0.34 -0.02 0.00 0.01 0.00 0.00 72.50 72.01 2jdm s THR 17 CO -0.02 0.13 -0.18 0.00 -0.69 0.00 0.00 174.62 173.86 2jdm s ALA 18 N 0.21 1.52 0.14 7.40 0.00 -0.16 -0.57 121.76 130.30 2jdm s ALA 18 Ca -0.02 -0.88 0.10 0.00 0.00 0.00 0.00 51.96 51.16 2jdm s ALA 18 Cb -0.06 -0.33 -0.04 0.00 0.00 0.00 0.00 23.12 22.70 2jdm s ALA 18 CO -0.00 0.35 -0.23 -0.06 0.00 0.00 0.00 175.76 175.82 2jdm s PHE 19 N -0.62 2.04 -0.01 0.00 0.40 0.39 -0.49 117.98 119.69 2jdm s PHE 19 Ca 0.06 -0.41 0.08 0.00 -0.60 0.00 0.00 56.93 56.06 2jdm s PHE 19 Cb -0.08 -1.07 -0.02 0.00 0.51 0.00 0.00 43.02 42.36 2jdm s PHE 19 CO 0.01 0.33 -0.25 0.00 0.70 0.00 0.00 175.22 176.00 2jdm s ALA 20 N -1.41 2.21 -0.41 5.36 0.00 -0.81 -0.97 121.76 125.73 2jdm s ALA 20 Ca 0.13 -1.13 0.08 0.00 0.00 0.00 0.00 51.96 51.04 2jdm s ALA 20 Cb -0.09 -0.57 0.25 0.00 0.00 0.00 0.00 23.12 22.71 2jdm s ALA 20 CO 0.06 0.53 0.62 0.09 0.00 0.00 0.00 175.76 177.07 2jdm n ASN 21 N 2.34 -0.58 -3.52 0.00 3.02 -0.49 -1.47 115.26 114.55 2jdm n ASN 21 Ca -0.16 -2.86 -0.08 0.00 -0.03 0.00 0.00 54.58 51.45 2jdm n ASN 21 Cb 0.51 -0.01 -0.02 0.00 -0.61 0.00 0.00 39.78 39.65 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 -0.75 -1.82 0.23 5.41 0.00 0.36 -4.16 121.76 121.03 2jdm s ALA 22 Ca 0.34 0.97 0.05 0.00 0.00 0.00 0.00 51.96 53.32 2jdm s ALA 22 Cb 0.19 0.42 0.23 0.00 0.00 0.00 0.00 23.12 23.97 2jdm s ALA 22 CO -0.14 -0.71 1.55 0.66 0.00 0.00 0.00 175.76 177.11 2jdm h SER 23 N 2.00 0.25 -3.34 0.00 4.64 -1.96 -3.36 113.55 111.78 2jdm h SER 23 Ca -0.22 -0.15 -0.53 0.00 -0.47 0.00 0.00 61.79 60.42 2jdm h SER 23 Cb 1.24 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 63.24 2jdm h SER 23 CO 0.30 0.81 -0.13 -0.83 -0.87 0.00 0.00 176.83 176.11 2jdm s GLY 24 N -4.36 2.10 0.12 -0.77 0.00 -1.26 -4.91 107.32 98.24 2jdm s GLY 24 Ca -0.04 -0.40 -0.31 0.00 0.00 0.00 0.00 44.72 43.97 2jdm s GLY 24 CO 0.80 -0.28 1.80 -1.59 0.00 0.00 0.00 173.10 173.83 2jdm s THR 25 N -1.93 2.61 -0.04 0.90 2.01 -1.26 -4.76 115.64 113.16 2jdm s THR 25 Ca 0.46 0.12 -0.17 0.00 0.31 0.00 0.00 61.69 62.40 2jdm s THR 25 Cb -0.11 -3.08 -0.05 0.00 0.01 0.00 0.00 72.50 69.27 2jdm s THR 25 CO 0.25 -0.00 0.47 -1.10 -0.69 0.00 0.00 174.62 173.55 2jdm s GLN 26 N 2.70 4.17 -0.21 4.92 -1.52 -0.17 -4.19 119.66 125.36 2jdm s GLN 26 Ca 0.80 0.48 -0.02 0.00 -1.95 0.00 0.00 55.36 54.67 2jdm s GLN 26 Cb -0.45 -3.33 0.00 0.00 -0.22 0.00 0.00 33.01 29.02 2jdm s GLN 26 CO 0.36 0.43 -0.09 0.99 -0.25 0.00 0.00 175.29 176.73 2jdm s THR 27 N -0.28 2.96 -0.21 -0.19 2.01 0.38 -2.25 115.64 118.07 2jdm s THR 27 Ca 0.26 -0.64 -0.04 0.00 0.31 0.00 0.00 61.69 61.57 2jdm s THR 27 Cb -0.16 -2.33 -0.02 0.00 0.01 0.00 0.00 72.50 70.00 2jdm s THR 27 CO 0.13 0.45 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.79 2jdm s VAL 28 N 1.42 3.63 -0.14 3.82 1.01 0.91 -1.09 120.40 129.95 2jdm s VAL 28 Ca 0.05 -0.42 -0.01 0.00 0.00 0.00 0.00 61.98 61.61 2jdm s VAL 28 Cb -0.14 -2.64 -0.02 0.00 0.00 0.00 0.00 36.38 33.58 2jdm s VAL 28 CO -0.06 0.43 -0.11 0.20 0.00 0.00 0.00 175.10 175.56 2jdm s ASN 29 N 1.19 4.20 -0.19 3.32 0.02 0.27 -0.45 114.94 123.30 2jdm s ASN 29 Ca 0.03 -0.29 -0.02 0.00 -1.02 0.00 0.00 52.86 51.56 2jdm s ASN 29 Cb -0.14 -1.66 -0.00 0.00 0.02 0.00 0.00 41.25 39.47 2jdm s ASN 29 CO -0.00 0.16 -0.10 -0.69 0.02 0.00 0.00 177.10 176.49 2jdm s VAL 30 N 0.41 3.01 -0.11 1.60 1.01 0.80 -0.83 120.40 126.29 2jdm s VAL 30 Ca -0.09 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.26 2jdm s VAL 30 Cb -0.15 -2.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.87 2jdm s VAL 30 CO 0.05 0.47 -0.08 -0.76 0.00 0.00 0.00 175.10 174.78 2jdm s LEU 31 N 1.20 3.07 -0.08 3.92 1.02 0.21 -0.13 118.68 127.89 2jdm s LEU 31 Ca 0.02 -0.13 0.05 0.00 0.02 0.00 0.00 54.13 54.08 2jdm s LEU 31 Cb -0.14 -1.69 -0.00 0.00 0.02 0.00 0.00 46.19 44.37 2jdm s LEU 31 CO -0.04 0.26 -0.22 -0.69 0.02 0.00 0.00 176.35 175.68 2jdm s VAL 32 N -0.17 1.89 -1.58 -1.59 1.01 0.75 -1.59 120.40 119.12 2jdm s VAL 32 Ca 0.02 -0.94 -0.04 0.00 0.00 0.00 0.00 61.98 61.01 2jdm s VAL 32 Cb -0.13 -1.63 0.04 0.00 0.00 0.00 0.00 36.38 34.66 2jdm s VAL 32 CO 0.03 0.52 0.19 -0.46 0.00 0.00 0.00 175.10 175.39 2jdm n ASN 33 N 3.33 0.15 -1.07 3.32 6.94 -0.78 -1.23 115.26 125.92 2jdm n ASN 33 Ca -0.19 -1.21 -0.14 0.00 -0.02 0.00 0.00 54.58 53.02 2jdm n ASN 33 Cb 0.53 -1.92 -0.06 0.00 -2.36 0.00 0.00 39.78 35.97 2jdm n ASN 33 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2jdm n ASN 34 N -2.84 -5.30 -4.25 0.53 3.02 -1.26 -4.98 115.26 100.18 2jdm n ASN 34 Ca -0.25 0.35 -0.29 0.00 -0.03 0.00 0.00 54.58 54.36 2jdm n ASN 34 Cb 0.65 -4.03 -0.16 0.00 -0.61 0.00 0.00 39.78 35.63 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 -3.12 2.02 0.02 3.52 0.41 -0.36 -5.07 118.70 116.12 2jdm s GLU 35 Ca 0.00 -0.82 -0.30 0.00 -0.41 0.00 0.00 54.97 53.44 2jdm s GLU 35 Cb 0.00 -1.87 -0.08 0.00 -1.78 0.00 0.00 34.13 30.41 2jdm s GLU 35 CO 0.00 0.44 1.76 0.99 -0.49 0.00 0.00 175.26 177.96 2jdm s THR 36 N -0.39 3.17 -0.06 3.63 2.01 -1.26 -0.18 115.64 122.55 2jdm s THR 36 Ca 0.05 0.39 0.09 0.00 0.31 0.00 0.00 61.69 62.53 2jdm s THR 36 Cb -0.10 -3.25 -0.13 0.00 0.01 0.00 0.00 72.50 69.03 2jdm s THR 36 CO 0.00 -0.02 0.10 0.00 -0.69 0.00 0.00 174.62 174.01 2jdm n ALA 37 N 6.64 1.98 -3.31 7.40 0.00 0.82 -4.88 120.51 129.17 2jdm n ALA 37 Ca 0.18 -0.48 -0.14 0.00 0.00 0.00 0.00 53.44 52.99 2jdm n ALA 37 Cb 0.41 -0.08 -0.08 0.00 0.00 0.00 0.00 19.45 19.70 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 -2.38 -1.02 -0.04 0.00 0.00 -0.87 -5.01 121.76 112.43 2jdm s ALA 38 Ca -0.04 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.59 2jdm s ALA 38 Cb 0.04 -0.07 0.03 0.00 0.00 0.00 0.00 23.12 23.11 2jdm s ALA 38 CO 0.39 -0.27 -0.01 0.99 0.00 0.00 0.00 175.76 176.86 2jdm s THR 39 N -1.03 0.30 -0.05 0.00 2.01 -1.26 -0.14 115.64 115.47 2jdm s THR 39 Ca -0.11 0.06 0.06 0.00 0.31 0.00 0.00 61.69 62.01 2jdm s THR 39 Cb -0.04 -0.40 -0.02 0.00 0.01 0.00 0.00 72.50 72.06 2jdm s THR 39 CO 0.05 0.19 -0.23 -0.36 -0.69 0.00 0.00 174.62 173.58 2jdm s PHE 40 N 1.27 2.46 -0.02 4.92 0.08 0.40 -4.98 117.98 122.11 2jdm s PHE 40 Ca -0.06 -0.55 0.01 0.00 0.12 0.00 0.00 56.93 56.45 2jdm s PHE 40 Cb -0.13 -1.58 0.01 0.00 -0.57 0.00 0.00 43.02 40.75 2jdm s PHE 40 CO -0.02 -0.10 -0.02 -1.12 -0.10 0.00 0.00 175.22 173.85 2jdm s SER 41 N -0.36 0.48 -0.13 1.36 0.01 -1.26 -0.06 113.70 113.74 2jdm s SER 41 Ca 0.03 -0.06 -0.33 0.00 1.31 0.00 0.00 55.95 56.89 2jdm s SER 41 Cb -0.12 -0.17 0.13 0.00 0.21 0.00 0.00 66.02 66.08 2jdm s SER 41 CO 0.02 -0.02 1.28 -0.83 0.41 0.00 0.00 173.24 174.09 2jdm s GLY 42 N 0.47 -0.35 -0.04 3.44 0.00 -0.95 -4.95 107.32 104.94 2jdm s GLY 42 Ca -0.05 1.23 0.02 0.00 0.00 0.00 0.00 44.72 45.92 2jdm s GLY 42 CO -0.01 0.36 -0.09 1.62 0.00 0.00 0.00 173.10 174.97 2jdm s GLN 43 N -2.35 1.15 -0.22 2.90 -0.44 -1.26 -1.00 119.66 118.44 2jdm s GLN 43 Ca 0.12 -0.31 -0.26 0.00 -2.50 0.00 0.00 55.36 52.41 2jdm s GLN 43 Cb 0.02 -1.04 0.08 0.00 -1.64 0.00 0.00 33.01 30.43 2jdm s GLN 43 CO -0.04 0.06 0.76 0.45 0.50 0.00 0.00 175.29 177.02 2jdm s SER 44 N 0.43 -0.68 -0.04 6.67 0.15 -1.26 -4.99 113.70 113.98 2jdm s SER 44 Ca -0.08 1.19 0.18 0.00 0.70 0.00 0.00 55.95 57.94 2jdm s SER 44 Cb -0.12 1.16 0.56 0.00 -1.71 0.00 0.00 66.02 65.92 2jdm s SER 44 CO 0.01 -0.32 1.48 0.35 1.20 0.00 0.00 173.24 175.96 2jdm n THR 45 N 2.18 1.32 -1.62 6.45 -2.24 -1.26 -0.49 114.28 118.61 2jdm n THR 45 Ca -0.15 -1.11 0.06 0.00 -2.27 0.00 0.00 64.05 60.58 2jdm n THR 45 Cb 0.56 0.35 0.16 0.00 -2.10 0.00 0.00 70.33 69.30 2jdm n THR 45 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2jdm n ASN 46 N 1.04 1.68 -1.89 3.42 3.02 -1.26 -4.80 115.26 116.47 2jdm n ASN 46 Ca 0.21 -3.42 -0.17 0.00 -0.03 0.00 0.00 54.58 51.18 2jdm n ASN 46 Cb 0.66 -0.47 -0.01 0.00 -0.61 0.00 0.00 39.78 39.35 2jdm n ASN 46 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2jdm n ASN 47 N -0.93 -4.99 -4.77 6.41 5.15 -0.54 -4.95 115.26 110.63 2jdm n ASN 47 Ca 0.16 0.01 -0.40 0.00 -0.60 0.00 0.00 54.58 53.75 2jdm n ASN 47 Cb 0.74 -4.08 0.02 0.00 -0.53 0.00 0.00 39.78 35.92 2jdm n ASN 47 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jdm s ALA 48 N -2.83 3.25 -0.18 5.20 0.00 -1.23 -4.59 121.76 121.38 2jdm s ALA 48 Ca 0.00 1.46 -0.29 0.00 0.00 0.00 0.00 51.96 53.13 2jdm s ALA 48 Cb 0.00 -3.59 -0.03 0.00 0.00 0.00 0.00 23.12 19.50 2jdm s ALA 48 CO 0.00 -1.18 1.57 0.08 0.00 0.00 0.00 175.76 176.23 2jdm s VAL 49 N -1.20 3.75 -1.41 0.00 1.01 -1.26 -1.93 120.40 119.36 2jdm s VAL 49 Ca 0.61 0.87 0.24 0.00 0.00 0.00 0.00 61.98 63.69 2jdm s VAL 49 Cb -0.44 -3.70 0.02 0.00 0.00 0.00 0.00 36.38 32.26 2jdm s VAL 49 CO 0.56 -0.23 1.26 2.30 0.00 0.00 0.00 175.10 179.00 2jdm n ILE 50 N 6.08 0.00 0.00 2.22 -5.35 0.36 -4.98 119.36 117.68 2jdm n ILE 50 Ca 0.18 -0.09 0.00 0.00 -0.27 0.00 0.00 62.75 62.57 2jdm n ILE 50 Cb 0.45 0.68 0.00 0.00 -1.74 0.00 0.00 39.64 39.02 2jdm n ILE 50 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2jdm n GLY 51 N 1.44 1.22 3.17 3.28 0.00 -1.20 -4.27 105.19 108.82 2jdm n GLY 51 Ca 0.08 -0.35 -0.13 0.00 0.00 0.00 0.00 46.02 45.62 2jdm n GLY 51 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2jdm s THR 52 N -2.00 0.01 0.07 2.61 -1.32 -1.26 -0.99 115.64 112.76 2jdm s THR 52 Ca 0.00 -0.07 -0.24 0.00 -1.21 0.00 0.00 61.69 60.17 2jdm s THR 52 Cb 0.00 -0.42 0.06 0.00 -1.51 0.00 0.00 72.50 70.63 2jdm s THR 52 CO 0.00 -0.04 0.57 -1.58 -2.21 0.00 0.00 174.62 171.36 2jdm s GLN 53 N -0.04 1.12 -0.13 7.08 0.74 -0.18 -5.01 119.66 123.25 2jdm s GLN 53 Ca -0.02 -0.25 -0.01 0.00 0.05 0.00 0.00 55.36 55.14 2jdm s GLN 53 Cb -0.02 0.52 -0.02 0.00 1.10 0.00 0.00 33.01 34.58 2jdm s GLN 53 CO 0.01 -0.43 -0.10 0.08 -0.55 0.00 0.00 175.29 174.30 2jdm s VAL 54 N -2.71 3.36 0.23 1.34 1.01 -1.26 -1.14 120.40 121.22 2jdm s VAL 54 Ca -0.04 -0.56 0.04 0.00 0.00 0.00 0.00 61.98 61.43 2jdm s VAL 54 Cb -0.00 -2.43 -0.05 0.00 0.00 0.00 0.00 36.38 33.90 2jdm s VAL 54 CO -0.04 0.52 -0.02 -0.76 0.00 0.00 0.00 175.10 174.80 2jdm s LEU 55 N 0.23 2.28 -0.12 3.92 1.43 -0.46 -4.95 118.68 121.01 2jdm s LEU 55 Ca -0.06 -1.19 -0.02 0.00 -1.03 0.00 0.00 54.13 51.83 2jdm s LEU 55 Cb -0.15 -0.35 -0.03 0.00 0.03 0.00 0.00 46.19 45.70 2jdm s LEU 55 CO 0.04 -0.46 -0.05 0.21 0.23 0.00 0.00 176.35 176.32 2jdm s ASN 56 N -3.31 4.74 0.27 2.29 3.84 -1.26 -0.86 114.94 120.65 2jdm s ASN 56 Ca 0.27 -0.08 0.24 0.00 0.21 0.00 0.00 52.86 53.50 2jdm s ASN 56 Cb 0.05 -1.55 0.99 0.00 -0.55 0.00 0.00 41.25 40.19 2jdm s ASN 56 CO 0.08 0.25 1.72 -1.54 -2.79 0.00 0.00 177.10 174.83 2jdm n SER 57 N 2.97 0.70 -0.35 -4.21 3.41 -0.30 -4.90 113.62 110.94 2jdm n SER 57 Ca -0.18 0.67 0.00 0.00 -0.26 0.00 0.00 58.87 59.10 2jdm n SER 57 Cb 0.53 -0.82 0.00 0.00 -0.26 0.00 0.00 64.21 63.66 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 0.05 -1.27 0.20 5.00 0.00 -1.26 -2.19 105.19 105.71 2jdm n GLY 58 Ca 0.02 -1.19 0.02 0.00 0.00 0.00 0.00 46.02 44.87 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 0.00 0.07 0.62 1.61 4.64 -1.95 0.39 113.55 118.93 2jdm h SER 59 Ca 0.00 -0.02 -0.18 0.00 -0.47 0.00 0.00 61.79 61.12 2jdm h SER 59 Cb 0.00 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.04 2jdm h SER 59 CO 0.00 0.39 -1.51 -1.54 -0.87 0.00 0.00 176.83 173.30 2jdm n SER 60 N -4.14 0.77 0.00 4.97 3.41 -1.26 -4.79 113.62 112.57 2jdm n SER 60 Ca -0.02 0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.93 2jdm n SER 60 Cb 0.38 0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.62 2jdm n SER 60 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jdm n GLY 61 N 1.41 0.31 3.66 5.00 0.00 -0.93 -4.82 105.19 109.82 2jdm n GLY 61 Ca -0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.83 4.18 -0.10 1.61 2.20 -1.26 -0.13 119.74 125.41 2jdm s LYS 62 Ca 0.00 1.60 0.04 0.00 -0.36 0.00 0.00 55.97 57.25 2jdm s LYS 62 Cb 0.00 -3.79 0.00 0.00 -1.51 0.00 0.00 37.83 32.53 2jdm s LYS 62 CO 0.00 -0.78 -0.22 0.08 -0.36 0.00 0.00 175.35 174.07 2jdm s VAL 63 N 3.66 1.91 -0.02 4.02 1.01 -0.13 -1.86 120.40 128.99 2jdm s VAL 63 Ca 0.55 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.64 2jdm s VAL 63 Cb -0.21 -1.66 -0.00 0.00 0.00 0.00 0.00 36.38 34.50 2jdm s VAL 63 CO 0.16 0.53 -0.13 -1.58 0.00 0.00 0.00 175.10 174.08 2jdm s GLN 64 N 0.41 1.23 -0.13 2.72 0.74 -0.62 -0.18 119.66 123.84 2jdm s GLN 64 Ca -0.18 -0.46 -0.01 0.00 0.05 0.00 0.00 55.36 54.76 2jdm s GLN 64 Cb -0.18 -1.14 -0.02 0.00 1.10 0.00 0.00 33.01 32.77 2jdm s GLN 64 CO 0.08 0.23 -0.09 0.08 -0.55 0.00 0.00 175.29 175.04 2jdm s VAL 65 N -0.08 3.43 0.04 1.34 1.01 0.08 -0.62 120.40 125.60 2jdm s VAL 65 Ca 0.01 -0.53 0.06 0.00 0.00 0.00 0.00 61.98 61.51 2jdm s VAL 65 Cb -0.08 -2.46 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 2jdm s VAL 65 CO 0.00 0.52 -0.17 -1.10 0.00 0.00 0.00 175.10 174.36 2jdm s GLN 66 N 0.20 1.13 -0.03 2.72 -0.21 -0.01 -4.76 119.66 118.69 2jdm s GLN 66 Ca -0.05 -0.82 0.01 0.00 0.02 0.00 0.00 55.36 54.52 2jdm s GLN 66 Cb -0.15 -1.18 0.01 0.00 1.00 0.00 0.00 33.01 32.70 2jdm s GLN 66 CO 0.04 0.30 -0.06 0.08 -2.12 0.00 0.00 175.29 173.53 2jdm s VAL 67 N -0.81 0.56 0.06 1.09 1.01 -1.26 -0.56 120.40 120.48 2jdm s VAL 67 Ca 0.04 -0.19 0.01 0.00 0.00 0.00 0.00 61.98 61.84 2jdm s VAL 67 Cb -0.08 -0.54 -0.03 0.00 0.00 0.00 0.00 36.38 35.72 2jdm s VAL 67 CO 0.01 0.21 -0.06 -0.94 0.00 0.00 0.00 175.10 174.32 2jdm s SER 68 N 0.55 0.79 -0.10 3.32 1.04 -0.25 -0.21 113.70 118.83 2jdm s SER 68 Ca -0.07 -0.75 -0.01 0.00 0.48 0.00 0.00 55.95 55.59 2jdm s SER 68 Cb -0.11 0.09 0.03 0.00 0.10 0.00 0.00 66.02 66.13 2jdm s SER 68 CO 0.00 -0.36 -0.03 -0.69 0.98 0.00 0.00 173.24 173.14 2jdm s VAL 69 N -2.48 0.72 -1.68 5.02 1.01 -0.34 -0.47 120.40 122.17 2jdm s VAL 69 Ca -0.02 -0.14 -0.13 0.00 0.00 0.00 0.00 61.98 61.70 2jdm s VAL 69 Cb -0.02 -0.83 0.12 0.00 0.00 0.00 0.00 36.38 35.65 2jdm s VAL 69 CO -0.03 0.28 0.47 0.59 0.00 0.00 0.00 175.10 176.41 2jdm n ASN 70 N 5.04 -1.31 0.00 3.32 3.02 -1.26 -1.16 115.26 122.91 2jdm n ASN 70 Ca -0.10 -1.16 0.00 0.00 -0.03 0.00 0.00 54.58 53.29 2jdm n ASN 70 Cb 0.50 -2.12 0.00 0.00 -0.61 0.00 0.00 39.78 37.54 2jdm n ASN 70 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jdm n GLY 71 N -1.67 1.74 3.58 7.41 0.00 -1.26 -5.02 105.19 109.97 2jdm n GLY 71 Ca -0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 2jdm n GLY 71 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jdm s ARG 72 N -0.37 3.83 0.19 1.61 3.52 -0.31 -5.03 118.95 122.39 2jdm s ARG 72 Ca 0.00 0.01 -0.31 0.00 -0.13 0.00 0.00 55.73 55.29 2jdm s ARG 72 Cb 0.00 -3.73 -0.10 0.00 -1.56 0.00 0.00 34.95 29.56 2jdm s ARG 72 CO 0.00 -0.47 1.58 -1.25 -0.81 0.00 0.00 175.30 174.35 2jdm s PRO 73 N 2.28 4.20 0.29 5.12 0.04 -1.26 -1.20 135.00 144.46 2jdm s PRO 73 Ca 0.18 2.41 -0.21 0.00 0.04 0.00 0.00 61.00 63.42 2jdm s PRO 73 Cb -0.16 -3.13 -0.09 0.00 0.04 0.00 0.00 34.50 31.16 2jdm s PRO 73 CO 0.11 -0.62 0.82 -1.12 0.04 0.00 0.00 177.00 176.23 2jdm s SER 74 N 1.05 7.08 0.16 6.66 0.01 0.70 -4.93 113.70 124.43 2jdm s SER 74 Ca 0.70 1.55 -0.30 0.00 1.31 0.00 0.00 55.95 59.21 2jdm s SER 74 Cb -0.45 -2.47 -0.08 0.00 0.21 0.00 0.00 66.02 63.23 2jdm s SER 74 CO 0.33 -0.08 1.17 -0.62 0.41 0.00 0.00 173.24 174.46 2jdm s ASP 75 N -1.80 7.13 0.12 2.44 2.15 -0.92 -4.75 116.67 121.04 2jdm s ASP 75 Ca 0.49 2.16 0.05 0.00 0.43 0.00 0.00 52.55 55.68 2jdm s ASP 75 Cb -0.15 -2.60 -0.04 0.00 -0.30 0.00 0.00 42.92 39.83 2jdm s ASP 75 CO 0.20 -0.35 0.06 -0.76 -0.17 0.00 0.00 175.17 174.15 2jdm s LEU 76 N -0.06 3.62 0.01 -1.34 1.43 -1.26 -0.86 118.68 120.23 2jdm s LEU 76 Ca 0.53 -0.15 0.05 0.00 -1.03 0.00 0.00 54.13 53.53 2jdm s LEU 76 Cb -0.31 -2.30 -0.02 0.00 0.03 0.00 0.00 46.19 43.59 2jdm s LEU 76 CO 0.35 0.14 -0.15 0.68 0.23 0.00 0.00 176.35 177.60 2jdm s VAL 77 N -1.50 1.17 0.15 -1.59 -7.23 -0.31 -4.86 120.40 106.23 2jdm s VAL 77 Ca 0.28 -0.81 -0.13 0.00 -1.81 0.00 0.00 61.98 59.51 2jdm s VAL 77 Cb -0.11 -1.01 0.02 0.00 0.56 0.00 0.00 36.38 35.84 2jdm s VAL 77 CO 0.21 0.19 0.36 -0.94 -0.31 0.00 0.00 175.10 174.61 2jdm s SER 78 N -0.71 -0.11 0.12 4.85 1.04 -1.26 -0.57 113.70 117.06 2jdm s SER 78 Ca 0.04 -0.56 -0.25 0.00 0.48 0.00 0.00 55.95 55.67 2jdm s SER 78 Cb -0.07 0.46 0.07 0.00 0.10 0.00 0.00 66.02 66.59 2jdm s SER 78 CO 0.00 -0.89 0.72 0.00 0.98 0.00 0.00 173.24 174.06 2jdm s ALA 79 N -3.87 -1.63 -0.08 5.32 0.00 -0.81 -4.93 121.76 115.77 2jdm s ALA 79 Ca 0.08 0.53 0.03 0.00 0.00 0.00 0.00 51.96 52.60 2jdm s ALA 79 Cb 0.02 0.73 -0.02 0.00 0.00 0.00 0.00 23.12 23.85 2jdm s ALA 79 CO -0.07 -0.80 -0.17 -1.14 0.00 0.00 0.00 175.76 173.59 2jdm s GLN 80 N -3.55 2.78 -0.02 0.00 0.74 -1.26 -0.86 119.66 117.49 2jdm s GLN 80 Ca 0.04 -0.76 0.07 0.00 0.05 0.00 0.00 55.36 54.76 2jdm s GLN 80 Cb -0.02 -2.38 -0.02 0.00 1.10 0.00 0.00 33.01 31.69 2jdm s GLN 80 CO -0.09 0.43 -0.22 0.08 -0.55 0.00 0.00 175.29 174.95 2jdm s VAL 81 N -0.23 1.70 -0.16 1.34 1.01 -0.03 -4.99 120.40 119.04 2jdm s VAL 81 Ca 0.00 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.06 2jdm s VAL 81 Cb -0.13 -1.41 0.02 0.00 0.00 0.00 0.00 36.38 34.86 2jdm s VAL 81 CO 0.03 0.47 -0.17 -0.63 0.00 0.00 0.00 175.10 174.81 2jdm s ILE 82 N -0.51 1.78 -0.08 2.22 1.01 -1.26 -1.09 121.20 123.26 2jdm s ILE 82 Ca 0.08 -0.76 -0.07 0.00 0.00 0.00 0.00 60.65 59.89 2jdm s ILE 82 Cb -0.08 -1.64 -0.04 0.00 0.01 0.00 0.00 42.46 40.71 2jdm s ILE 82 CO -0.01 0.49 0.19 -0.76 0.00 0.00 0.00 174.94 174.85 2jdm s LEU 83 N 1.39 4.40 -1.14 2.97 1.43 -0.02 -4.51 118.68 123.19 2jdm s LEU 83 Ca 0.05 0.52 -0.12 0.00 -1.03 0.00 0.00 54.13 53.55 2jdm s LEU 83 Cb -0.13 -2.25 0.11 0.00 0.03 0.00 0.00 46.19 43.95 2jdm s LEU 83 CO -0.11 0.37 0.39 1.07 0.23 0.00 0.00 176.35 178.29 2jdm n THR 84 N 1.76 -0.35 -1.60 5.49 5.66 -1.26 -1.17 114.28 122.81 2jdm n THR 84 Ca -0.17 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 60.62 2jdm n THR 84 Cb 0.54 -0.82 -0.09 0.00 -1.55 0.00 0.00 70.33 68.41 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 -2.13 -5.39 0.00 1.09 5.15 -1.26 -4.67 115.26 108.05 2jdm n ASN 85 Ca 0.04 0.50 0.00 0.00 -0.60 0.00 0.00 54.58 54.52 2jdm n ASN 85 Cb 0.50 -4.77 0.00 0.00 -0.53 0.00 0.00 39.78 34.98 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 -2.36 0.00 -3.73 1.20 -0.58 -0.49 -5.07 120.64 109.60 2jdm n GLU 86 Ca -0.20 0.00 -0.37 0.00 -0.42 0.00 0.00 57.16 56.17 2jdm n GLU 86 Cb 0.67 -0.36 -0.11 0.00 -0.57 0.00 0.00 31.44 31.07 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 -3.91 3.76 -0.08 -4.62 2.96 -0.31 -4.40 118.68 112.06 2jdm s LEU 87 Ca 0.00 -0.06 0.00 0.00 -0.22 0.00 0.00 54.13 53.85 2jdm s LEU 87 Cb 0.00 -2.01 -0.03 0.00 0.50 0.00 0.00 46.19 44.65 2jdm s LEU 87 CO 0.00 0.00 -0.07 0.20 -1.32 0.00 0.00 176.35 175.16 2jdm s ASN 88 N 1.41 4.57 -0.10 3.68 -0.87 0.39 -0.84 114.94 123.18 2jdm s ASN 88 Ca 0.06 -0.07 0.00 0.00 -1.57 0.00 0.00 52.86 51.28 2jdm s ASN 88 Cb -0.15 -1.26 0.02 0.00 -0.02 0.00 0.00 41.25 39.84 2jdm s ASN 88 CO 0.06 0.32 -0.10 -0.36 -2.57 0.00 0.00 177.10 174.45 2jdm s PHE 89 N -0.56 1.55 -0.22 2.20 0.08 -0.25 -2.10 117.98 118.68 2jdm s PHE 89 Ca 0.08 -0.73 -0.06 0.00 0.12 0.00 0.00 56.93 56.34 2jdm s PHE 89 Cb -0.12 -1.22 -0.03 0.00 -0.57 0.00 0.00 43.02 41.08 2jdm s PHE 89 CO 0.02 -0.46 0.03 0.00 -0.10 0.00 0.00 175.22 174.71 2jdm s ALA 90 N 1.38 3.11 -0.09 5.36 0.00 0.30 -0.85 121.76 130.96 2jdm s ALA 90 Ca -0.01 -1.02 0.03 0.00 0.00 0.00 0.00 51.96 50.97 2jdm s ALA 90 Cb -0.14 -1.89 -0.01 0.00 0.00 0.00 0.00 23.12 21.08 2jdm s ALA 90 CO -0.05 -0.25 -0.21 -0.51 0.00 0.00 0.00 175.76 174.75 2jdm s LEU 91 N 1.17 2.29 -0.03 0.00 1.43 -0.04 -0.54 118.68 122.96 2jdm s LEU 91 Ca 0.04 -0.46 0.03 0.00 -1.03 0.00 0.00 54.13 52.70 2jdm s LEU 91 Cb -0.14 -1.46 0.01 0.00 0.03 0.00 0.00 46.19 44.62 2jdm s LEU 91 CO 0.02 0.20 -0.10 -0.69 0.23 0.00 0.00 176.35 176.01 2jdm s VAL 92 N 0.12 0.87 0.26 -1.59 1.01 -0.04 -1.92 120.40 119.11 2jdm s VAL 92 Ca -0.10 -0.39 0.11 0.00 0.00 0.00 0.00 61.98 61.59 2jdm s VAL 92 Cb -0.16 -0.78 -0.05 0.00 0.00 0.00 0.00 36.38 35.39 2jdm s VAL 92 CO 0.06 0.27 -0.14 -0.83 0.00 0.00 0.00 175.10 174.47 2jdm s GLY 93 N 0.29 1.79 0.02 4.51 0.00 0.26 -0.80 107.32 113.38 2jdm s GLY 93 Ca -0.05 -1.75 -0.09 0.00 0.00 0.00 0.00 44.72 42.83 2jdm s GLY 93 CO 0.01 -1.82 0.18 -1.35 0.00 0.00 0.00 173.10 170.12 2jdm s SER 94 N -3.39 0.01 -0.09 1.64 1.04 -0.68 -1.16 113.70 111.07 2jdm s SER 94 Ca 0.29 -0.25 0.01 0.00 0.48 0.00 0.00 55.95 56.49 2jdm s SER 94 Cb -0.06 0.25 0.02 0.00 0.10 0.00 0.00 66.02 66.32 2jdm s SER 94 CO 0.16 -0.46 -0.13 -0.70 0.98 0.00 0.00 173.24 173.09 2jdm s GLU 95 N -1.87 1.92 0.00 4.02 2.56 -0.04 -1.85 118.70 123.43 2jdm s GLU 95 Ca -0.11 -0.45 0.10 0.00 0.00 0.00 0.00 54.97 54.51 2jdm s GLU 95 Cb -0.05 -1.67 0.05 0.00 2.00 0.00 0.00 34.13 34.46 2jdm s GLU 95 CO -0.00 -0.07 0.74 -0.40 -0.56 0.00 0.00 175.26 174.97 2jdm n ASP 96 N 4.21 1.57 0.00 -1.70 5.68 -1.26 -2.16 116.55 122.89 2jdm n ASP 96 Ca -0.19 -1.29 0.00 0.00 -0.50 0.00 0.00 54.79 52.81 2jdm n ASP 96 Cb 0.51 0.20 0.00 0.00 -1.14 0.00 0.00 41.12 40.69 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 0.70 5.56 0.00 6.12 0.00 -1.26 -5.07 105.19 111.24 2jdm n GLY 97 Ca 0.05 -0.95 0.02 0.00 0.00 0.00 0.00 46.02 45.14 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 0.90 2.61 -2.24 -1.26 -4.65 114.28 109.65 2jdm n THR 98 Ca 0.00 -0.35 0.14 0.00 -2.27 0.00 0.00 64.05 61.57 2jdm n THR 98 Cb 0.00 0.90 0.54 0.00 -2.10 0.00 0.00 70.33 69.67 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 -1.20 0.23 -3.58 3.42 5.75 -1.26 -4.93 116.55 114.99 2jdm n ASP 99 Ca 0.01 0.48 -0.27 0.00 -0.01 0.00 0.00 54.79 55.00 2jdm n ASP 99 Cb 0.08 -0.53 0.00 0.00 -1.03 0.00 0.00 41.12 39.64 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 -1.70 -4.11 0.22 -1.12 3.02 -1.26 -4.87 115.26 105.44 2jdm n ASN 100 Ca 0.07 -0.56 0.13 0.00 -0.03 0.00 0.00 54.58 54.19 2jdm n ASN 100 Cb 0.36 -3.36 0.28 0.00 -0.61 0.00 0.00 39.78 36.45 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 -1.33 0.00 -1.99 6.41 2.03 -1.93 -3.48 116.42 116.13 2jdm h ASP 101 Ca -0.49 0.00 -0.36 0.00 -0.73 0.00 0.00 57.03 55.45 2jdm h ASP 101 Cb 1.33 0.00 -0.09 0.00 -0.83 0.00 0.00 39.33 39.73 2jdm h ASP 101 CO 0.60 0.00 -0.38 -1.22 -1.03 0.00 0.00 179.24 177.22 2jdm n TYR 102 N -3.00 -0.54 -0.13 4.15 4.01 -1.26 -4.83 117.16 115.56 2jdm n TYR 102 Ca 0.04 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.81 2jdm n TYR 102 Cb 0.48 -3.27 0.09 0.00 -0.31 0.00 0.00 39.34 36.33 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 -1.37 2.52 -0.23 7.72 0.23 -1.17 -1.68 115.26 121.29 2jdm n ASN 103 Ca -0.19 -2.04 -0.06 0.00 -0.53 0.00 0.00 54.58 51.76 2jdm n ASN 103 Cb 0.61 -0.14 0.04 0.00 -2.08 0.00 0.00 39.78 38.22 2jdm n ASN 103 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2jdm h ASP 104 N 1.08 0.76 -3.39 0.53 3.32 -1.53 -3.23 116.42 113.96 2jdm h ASP 104 Ca 0.00 -0.05 -0.49 0.00 0.02 0.00 0.00 57.03 56.51 2jdm h ASP 104 Cb 0.65 -0.19 -0.34 0.00 0.22 0.00 0.00 39.33 39.67 2jdm h ASP 104 CO 0.01 0.58 -0.80 0.00 -1.72 0.00 0.00 179.24 177.30 2jdm s ALA 105 N -6.04 1.13 -0.14 3.45 0.00 -1.26 -1.40 121.76 117.51 2jdm s ALA 105 Ca -0.13 -0.35 -0.01 0.00 0.00 0.00 0.00 51.96 51.46 2jdm s ALA 105 Cb 0.14 -0.59 -0.02 0.00 0.00 0.00 0.00 23.12 22.65 2jdm s ALA 105 CO 0.77 -0.00 -0.10 0.08 0.00 0.00 0.00 175.76 176.51 2jdm s VAL 106 N 0.90 3.30 -0.08 0.00 1.01 -0.15 -2.46 120.40 122.92 2jdm s VAL 106 Ca -0.11 -0.57 0.05 0.00 0.00 0.00 0.00 61.98 61.35 2jdm s VAL 106 Cb -0.15 -2.41 -0.00 0.00 0.00 0.00 0.00 36.38 33.82 2jdm s VAL 106 CO 0.01 0.51 -0.24 -0.69 0.00 0.00 0.00 175.10 174.69 2jdm s VAL 107 N 0.44 2.01 -0.15 2.92 1.01 0.02 -0.46 120.40 126.18 2jdm s VAL 107 Ca -0.08 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 60.91 2jdm s VAL 107 Cb -0.15 -1.72 0.01 0.00 0.00 0.00 0.00 36.38 34.52 2jdm s VAL 107 CO 0.04 0.55 -0.21 -0.69 0.00 0.00 0.00 175.10 174.80 2jdm s VAL 108 N 0.16 2.11 -0.09 2.92 1.01 0.26 -0.86 120.40 125.91 2jdm s VAL 108 Ca -0.13 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 60.91 2jdm s VAL 108 Cb -0.16 -1.86 -0.02 0.00 0.00 0.00 0.00 36.38 34.34 2jdm s VAL 108 CO 0.07 0.54 -0.11 -0.63 0.00 0.00 0.00 175.10 174.97 2jdm s ILE 109 N 0.97 3.27 0.01 2.22 1.01 0.30 -1.28 121.20 127.70 2jdm s ILE 109 Ca -0.03 -0.62 0.01 0.00 0.00 0.00 0.00 60.65 60.01 2jdm s ILE 109 Cb -0.15 -2.34 -0.01 0.00 0.01 0.00 0.00 42.46 39.97 2jdm s ILE 109 CO -0.05 0.56 -0.04 0.54 0.00 0.00 0.00 174.94 175.95 2jdm s ASN 110 N -0.29 0.44 0.17 3.58 4.22 -0.50 -0.54 114.94 122.03 2jdm s ASN 110 Ca 0.03 -0.20 -0.22 0.00 -2.14 0.00 0.00 52.86 50.33 2jdm s ASN 110 Cb -0.13 -0.01 0.06 0.00 1.28 0.00 0.00 41.25 42.45 2jdm s ASN 110 CO 0.03 -0.05 0.60 -1.66 -2.04 0.00 0.00 177.10 173.98 2jdm s TRP 111 N -0.48 -0.47 0.83 1.54 -2.14 -0.89 -0.74 118.94 116.59 2jdm s TRP 111 Ca -0.03 0.23 -0.12 0.00 2.66 0.00 0.00 56.10 58.84 2jdm s TRP 111 Cb -0.04 0.55 0.09 0.00 -3.10 0.00 0.00 33.47 30.97 2jdm s TRP 111 CO -0.00 -0.88 1.15 -1.25 -2.66 0.00 0.00 176.95 173.31 2jdm s PRO 112 N -3.77 1.80 0.51 3.25 0.04 -1.26 -0.46 135.00 135.10 2jdm s PRO 112 Ca 0.02 0.24 0.07 0.00 0.04 0.00 0.00 61.00 61.37 2jdm s PRO 112 Cb -0.01 -1.92 0.03 0.00 0.04 0.00 0.00 34.50 32.64 2jdm s PRO 112 CO -0.11 -1.73 0.49 -0.51 0.04 0.00 0.00 177.00 175.18 2jdm s LEU 113 N -5.71 3.03 0.00 -3.56 1.43 -1.26 -4.97 118.68 107.64 2jdm s LEU 113 Ca 0.62 -0.98 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 2jdm s LEU 113 Cb -0.12 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.50 2jdm s LEU 113 CO 0.51 -1.01 0.00 0.61 0.23 0.00 0.00 176.35 176.69