#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hfd s SER 2 N 0.00 5.03 0.29 7.83 1.04 -1.26 -5.03 113.70 121.60 2hfd s SER 2 Ca 0.00 0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.49 2hfd s SER 2 Cb 0.00 -1.44 0.00 0.00 0.10 0.00 0.00 66.02 64.68 2hfd s SER 2 CO 0.00 0.34 0.00 0.59 0.98 0.00 0.00 173.24 175.15 2hfd n ASN 3 N 2.37 -5.88 -4.58 7.02 4.13 -1.26 -4.76 115.26 112.31 2hfd n ASN 3 Ca -0.18 0.56 -0.42 0.00 1.68 0.00 0.00 54.58 56.23 2hfd n ASN 3 Cb 0.53 -3.09 -0.06 0.00 -1.54 0.00 0.00 39.78 35.62 2hfd n ASN 3 CO 0.00 0.00 0.00 1.51 0.28 0.00 0.00 177.26 179.05 2hfd s ASP 4 N -6.07 6.45 0.21 6.41 -4.77 -1.26 -4.74 116.67 112.89 2hfd s ASP 4 Ca 0.00 0.22 0.00 0.00 -3.30 0.00 0.00 52.55 49.47 2hfd s ASP 4 Cb 0.00 -2.33 0.00 0.00 -1.09 0.00 0.00 42.92 39.50 2hfd s ASP 4 CO 0.00 -0.58 0.00 0.41 0.70 0.00 0.00 175.17 175.70 2hfd n THR 5 N 5.56 0.00 0.03 2.11 -1.04 -1.26 -4.95 114.28 114.73 2hfd n THR 5 Ca -0.01 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.99 2hfd n THR 5 Cb 0.49 -0.04 -0.01 0.00 -1.82 0.00 0.00 70.33 68.95 2hfd n THR 5 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 2hfd h PRO 6 N 0.00 -0.10 -0.32 -2.82 0.13 -1.94 -2.65 132.00 124.31 2hfd h PRO 6 Ca 0.00 0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.13 2hfd h PRO 6 Cb 0.00 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.14 2hfd h PRO 6 CO 0.00 -0.06 0.16 0.27 -0.23 0.00 0.00 178.00 178.14 2hfd h PHE 7 N -0.33 0.42 0.37 1.56 -0.00 -1.97 -2.03 116.94 114.96 2hfd h PHE 7 Ca -0.01 -0.00 -0.02 0.00 -0.00 0.00 0.00 57.97 57.94 2hfd h PHE 7 Cb 0.08 -0.14 0.00 0.00 -0.00 0.00 0.00 35.95 35.89 2hfd h PHE 7 CO 0.04 0.31 -0.18 0.22 -0.00 0.00 0.00 178.31 178.70 2hfd h ASP 8 N 0.44 -0.42 -0.93 -0.68 3.58 -1.93 0.21 116.42 116.70 2hfd h ASP 8 Ca 0.11 -0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.53 2hfd h ASP 8 Cb 0.03 0.11 -0.04 0.00 1.72 0.00 0.00 39.33 41.14 2hfd h ASP 8 CO -0.02 -0.24 0.56 0.00 -2.88 0.00 0.00 179.24 176.66 2hfd h ALA 9 N 0.04 1.24 0.47 -0.78 0.00 -1.18 0.61 119.26 119.67 2hfd h ALA 9 Ca -0.05 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2hfd h ALA 9 Cb 0.42 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2hfd h ALA 9 CO 0.08 0.65 -0.22 1.25 0.00 0.00 0.00 179.25 181.01 2hfd h LEU 10 N 1.28 -0.53 -0.90 0.00 7.12 -1.19 -2.54 115.31 118.55 2hfd h LEU 10 Ca 0.33 -0.05 -0.08 0.00 0.13 0.00 0.00 57.88 58.22 2hfd h LEU 10 Cb -0.06 0.14 -0.02 0.00 -0.53 0.00 0.00 40.66 40.19 2hfd h LEU 10 CO -0.06 -0.28 -0.03 -0.25 -0.13 0.00 0.00 178.44 177.69 2hfd h TRP 11 N -0.76 0.83 -0.99 1.25 7.01 -0.76 -1.99 115.95 120.55 2hfd h TRP 11 Ca -0.06 -0.12 0.09 0.00 2.11 0.00 0.00 58.89 60.90 2hfd h TRP 11 Cb 0.54 -0.22 -0.07 0.00 -2.10 0.00 0.00 29.16 27.31 2hfd h TRP 11 CO -0.01 0.79 0.63 1.96 -2.79 0.00 0.00 178.44 179.01 2hfd h GLN 12 N 0.72 1.03 0.16 2.65 1.08 -0.85 0.41 115.11 120.31 2hfd h GLN 12 Ca 0.14 -0.06 -0.01 0.00 -1.45 0.00 0.00 58.65 57.27 2hfd h GLN 12 Cb 0.49 -0.23 0.00 0.00 -0.05 0.00 0.00 27.48 27.68 2hfd h GLN 12 CO 0.02 0.68 -0.08 0.00 -0.95 0.00 0.00 178.83 178.51 2hfd h ARG 13 N 1.06 -0.21 -0.95 1.46 2.47 -0.93 0.18 114.38 117.46 2hfd h ARG 13 Ca 0.45 0.01 0.11 0.00 -1.26 0.00 0.00 59.98 59.30 2hfd h ARG 13 Cb 0.33 0.05 -0.07 0.00 -1.65 0.00 0.00 29.97 28.62 2hfd h ARG 13 CO -0.21 -0.01 0.61 0.52 0.56 0.00 0.00 179.97 181.44 2hfd h MET 14 N -0.37 0.89 -0.17 0.04 2.86 -0.74 -1.39 114.93 116.05 2hfd h MET 14 Ca -0.02 -0.05 -0.20 0.00 -2.06 0.00 0.00 59.70 57.37 2hfd h MET 14 Cb 0.29 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.76 2hfd h MET 14 CO 0.04 0.59 -0.68 -0.07 1.06 0.00 0.00 176.91 177.84 2hfd h LEU 15 N 0.92 0.80 -1.94 1.22 -0.00 -0.02 -3.01 115.31 113.27 2hfd h LEU 15 Ca 0.46 -0.49 -0.02 0.00 -0.00 0.00 0.00 57.88 57.83 2hfd h LEU 15 Cb 0.49 -0.23 -0.00 0.00 -0.00 0.00 0.00 40.66 40.91 2hfd h LEU 15 CO -0.22 1.26 -0.09 0.00 -0.00 0.00 0.00 178.44 179.39 2hfd h ALA 16 N 0.74 1.67 0.00 1.53 0.00 0.30 0.53 119.26 124.02 2hfd h ALA 16 Ca -0.02 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2hfd h ALA 16 Cb 1.28 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 2hfd h ALA 16 CO 0.14 0.11 -0.02 0.00 0.00 0.00 0.00 179.25 179.48 2hfd h ARG 17 N 0.00 0.00 -0.08 0.00 2.47 -1.15 -3.46 114.38 112.16 2hfd h ARG 17 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2hfd h ARG 17 Cb 0.18 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 2hfd h ARG 17 CO 0.01 0.02 0.00 0.41 0.56 0.00 0.00 179.97 180.97 2hfd n GLY 18 N -0.66 1.36 3.80 0.04 0.00 0.18 -5.08 105.19 104.83 2hfd n GLY 18 Ca -0.02 -0.26 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 2hfd n GLY 18 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2hfd s TRP 19 N -2.08 3.52 0.08 1.61 0.51 -1.24 -5.06 118.94 116.29 2hfd s TRP 19 Ca 0.00 0.51 -0.23 0.00 -2.12 0.00 0.00 56.10 54.26 2hfd s TRP 19 Cb 0.00 -2.11 -0.07 0.00 -0.81 0.00 0.00 33.47 30.48 2hfd s TRP 19 CO 0.00 0.49 0.69 0.95 -0.51 0.00 0.00 176.95 178.57 2hfd s THR 20 N -0.29 4.65 0.22 2.01 -4.23 -1.19 -4.72 115.64 112.08 2hfd s THR 20 Ca 0.13 1.48 -0.26 0.00 -1.18 0.00 0.00 61.69 61.86 2hfd s THR 20 Cb -0.12 -4.03 -0.09 0.00 1.34 0.00 0.00 72.50 69.60 2hfd s THR 20 CO 0.03 0.47 0.84 -2.16 -0.54 0.00 0.00 174.62 173.26 2hfd s PRO 21 N -0.71 4.61 0.08 3.99 0.05 -1.25 -0.48 135.00 141.30 2hfd s PRO 21 Ca 0.34 1.24 0.08 0.00 0.05 0.00 0.00 61.00 62.71 2hfd s PRO 21 Cb -0.21 -3.14 -0.03 0.00 0.05 0.00 0.00 34.50 31.17 2hfd s PRO 21 CO 0.22 0.49 -0.22 0.54 0.05 0.00 0.00 177.00 178.08 2hfd s VAL 22 N -1.28 1.82 0.38 -0.36 0.11 0.12 -4.86 120.40 116.33 2hfd s VAL 22 Ca 0.40 -1.47 0.08 0.00 -2.93 0.00 0.00 61.98 58.07 2hfd s VAL 22 Cb -0.22 -1.62 -0.05 0.00 -1.53 0.00 0.00 36.38 32.95 2hfd s VAL 22 CO 0.27 0.08 0.11 -0.44 -3.33 0.00 0.00 175.10 171.78 2hfd s SER 23 N -1.66 4.34 0.15 3.54 0.01 -1.26 -3.55 113.70 115.26 2hfd s SER 23 Ca 0.08 -1.04 -0.05 0.00 1.31 0.00 0.00 55.95 56.25 2hfd s SER 23 Cb -0.10 -0.52 -0.02 0.00 0.21 0.00 0.00 66.02 65.59 2hfd s SER 23 CO 0.04 -0.41 1.39 1.05 0.41 0.00 0.00 173.24 175.72 2hfd h GLU 24 N 1.59 0.55 0.00 12.44 -0.00 -2.00 0.43 114.58 127.59 2hfd h GLU 24 Ca -0.43 -0.45 0.00 0.00 -0.00 0.00 0.00 59.36 58.48 2hfd h GLU 24 Cb 1.25 0.09 0.00 0.00 -0.00 0.00 0.00 28.75 30.09 2hfd h GLU 24 CO 0.69 1.07 0.00 0.45 -0.00 0.00 0.00 179.01 181.22 2hfd n SER 25 N -3.87 0.00 -0.00 3.06 2.88 -1.26 -2.53 113.62 111.89 2hfd n SER 25 Ca -0.05 -1.46 0.01 0.00 -1.33 0.00 0.00 58.87 56.04 2hfd n SER 25 Cb 0.72 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 64.17 2hfd n SER 25 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2hfd n ARG 26 N -0.76 4.77 -0.22 -1.46 0.63 -0.83 -4.70 116.66 114.09 2hfd n ARG 26 Ca 0.12 -0.00 0.02 0.00 -0.92 0.00 0.00 57.85 57.07 2hfd n ARG 26 Cb 0.06 -0.71 0.12 0.00 0.45 0.00 0.00 32.46 32.38 2hfd n ARG 26 CO 0.00 0.00 0.00 1.25 -2.51 0.00 0.00 177.63 176.37 2hfd h LEU 27 N 0.00 -0.25 0.09 6.15 6.46 -0.64 0.75 115.31 127.86 2hfd h LEU 27 Ca 0.00 0.16 -0.00 0.00 -0.12 0.00 0.00 57.88 57.92 2hfd h LEU 27 Cb 0.06 0.28 0.00 0.00 -0.73 0.00 0.00 40.66 40.27 2hfd h LEU 27 CO 0.00 -0.12 -0.04 -0.78 -0.62 0.00 0.00 178.44 176.88 2hfd h ASP 28 N 0.13 -0.10 0.15 1.25 3.58 -1.84 -1.57 116.42 118.02 2hfd h ASP 28 Ca 0.35 -0.35 0.02 0.00 0.42 0.00 0.00 57.03 57.47 2hfd h ASP 28 Cb 0.59 0.03 -0.04 0.00 1.72 0.00 0.00 39.33 41.63 2hfd h ASP 28 CO -0.56 0.31 -0.31 -0.78 -2.88 0.00 0.00 179.24 175.02 2hfd h ASP 29 N -0.54 -0.89 0.31 2.28 3.58 -1.68 0.15 116.42 119.64 2hfd h ASP 29 Ca -0.01 0.10 -0.10 0.00 0.42 0.00 0.00 57.03 57.43 2hfd h ASP 29 Cb 0.45 0.33 -0.01 0.00 1.72 0.00 0.00 39.33 41.81 2hfd h ASP 29 CO 0.02 -0.41 -0.43 -0.25 -2.88 0.00 0.00 179.24 175.30 2hfd h TRP 30 N -0.55 0.18 0.00 0.28 7.01 -0.97 -1.37 115.95 120.54 2hfd h TRP 30 Ca 0.02 -0.05 -0.07 0.00 2.11 0.00 0.00 58.89 60.91 2hfd h TRP 30 Cb 0.57 -0.04 -0.01 0.00 -2.10 0.00 0.00 29.16 27.58 2hfd h TRP 30 CO -0.27 0.56 -0.32 1.25 -2.79 0.00 0.00 178.44 176.88 2hfd h LEU 31 N 0.13 0.00 -0.87 0.65 5.85 -0.77 0.33 115.31 120.63 2hfd h LEU 31 Ca 0.01 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.61 2hfd h LEU 31 Cb 0.81 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.83 2hfd h LEU 31 CO 0.06 0.32 -0.56 0.74 -0.34 0.00 0.00 178.44 178.67 2hfd h THR 32 N 0.00 1.39 0.01 1.05 2.02 0.36 -3.32 112.91 114.41 2hfd h THR 32 Ca -0.00 -1.92 -0.00 0.00 0.77 0.00 0.00 66.41 65.26 2hfd h THR 32 Cb 0.63 2.04 0.00 0.00 -1.74 0.00 0.00 68.15 69.08 2hfd h THR 32 CO 0.04 0.55 -0.01 1.56 0.37 0.00 0.00 175.52 178.03 2hfd h GLN 33 N 0.00 -0.02 -4.78 6.66 1.08 -0.56 -3.45 115.11 114.05 2hfd h GLN 33 Ca -0.01 0.00 -0.68 0.00 -1.45 0.00 0.00 58.65 56.51 2hfd h GLN 33 Cb 1.00 0.00 -0.27 0.00 -0.05 0.00 0.00 27.48 28.16 2hfd h GLN 33 CO 0.07 -0.01 -0.62 0.00 -0.95 0.00 0.00 178.83 177.32 2hfd s ALA 34 N -2.65 3.05 -0.57 3.87 0.00 0.11 -4.96 121.76 120.61 2hfd s ALA 34 Ca -0.00 -1.51 0.24 0.00 0.00 0.00 0.00 51.96 50.69 2hfd s ALA 34 Cb 0.00 -2.16 0.39 0.00 0.00 0.00 0.00 23.12 21.35 2hfd s ALA 34 CO 0.01 -1.01 1.42 -1.00 0.00 0.00 0.00 175.76 175.18 2hfd h PRO 35 N 8.23 0.00 -6.01 0.00 0.13 -1.84 -3.38 132.00 129.13 2hfd h PRO 35 Ca -0.30 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.27 2hfd h PRO 35 Cb 1.12 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.10 2hfd h PRO 35 CO 0.60 0.00 -0.75 -0.51 -0.23 0.00 0.00 178.00 177.11 2hfd s ASP 36 N -4.77 3.24 0.00 1.44 1.01 -1.26 -4.20 116.67 112.13 2hfd s ASP 36 Ca 0.06 -1.02 0.00 0.00 0.71 0.00 0.00 52.55 52.30 2hfd s ASP 36 Cb 0.11 -0.24 0.00 0.00 1.01 0.00 0.00 42.92 43.80 2hfd s ASP 36 CO 0.70 -0.03 0.00 0.61 0.21 0.00 0.00 175.17 176.66 2hfd n GLY 37 N -0.50 0.99 2.91 0.21 0.00 -0.00 -3.66 105.19 105.13 2hfd n GLY 37 Ca -0.06 -1.90 -0.16 0.00 0.00 0.00 0.00 46.02 43.90 2hfd n GLY 37 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2hfd s VAL 38 N -2.35 0.31 -0.20 1.61 -7.23 0.11 -0.42 120.40 112.23 2hfd s VAL 38 Ca 0.00 -0.12 -0.01 0.00 -1.81 0.00 0.00 61.98 60.05 2hfd s VAL 38 Cb 0.00 -0.30 0.01 0.00 0.56 0.00 0.00 36.38 36.65 2hfd s VAL 38 CO 0.00 0.11 -0.15 -0.69 -0.31 0.00 0.00 175.10 174.07 2hfd s VAL 39 N 0.21 2.48 -0.25 1.32 1.01 0.89 -0.30 120.40 125.76 2hfd s VAL 39 Ca -0.02 -0.82 -0.10 0.00 0.00 0.00 0.00 61.98 61.04 2hfd s VAL 39 Cb -0.05 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 2hfd s VAL 39 CO -0.00 0.48 0.14 -0.76 0.00 0.00 0.00 175.10 174.96 2hfd s LEU 40 N 1.34 3.87 -0.13 3.92 1.02 0.72 -0.57 118.68 128.85 2hfd s LEU 40 Ca 0.05 -0.02 0.11 0.00 0.02 0.00 0.00 54.13 54.29 2hfd s LEU 40 Cb -0.14 -2.05 0.56 0.00 0.02 0.00 0.00 46.19 44.58 2hfd s LEU 40 CO -0.10 0.00 1.39 0.18 0.02 0.00 0.00 176.35 177.85 2hfd n LEU 41 N 4.70 4.06 -0.04 1.79 4.32 0.71 -2.34 117.00 130.20 2hfd n LEU 41 Ca -0.15 -2.06 0.00 0.00 -0.02 0.00 0.00 56.01 53.79 2hfd n LEU 41 Cb 0.52 -0.58 -0.00 0.00 -1.62 0.00 0.00 43.42 41.74 2hfd n LEU 41 CO 0.33 0.56 -0.01 -0.24 -1.22 0.00 0.00 177.39 176.81 2hfd n SER 42 N 0.57 -0.23 0.08 -1.43 2.88 -1.26 -4.28 113.62 109.96 2hfd n SER 42 Ca 0.19 0.03 -0.02 0.00 -1.33 0.00 0.00 58.87 57.74 2hfd n SER 42 Cb 0.83 -0.12 -0.06 0.00 -0.75 0.00 0.00 64.21 64.11 2hfd n SER 42 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2hfd h SER 43 N -0.04 0.00 -4.15 -3.46 0.02 -1.87 -2.94 113.55 101.12 2hfd h SER 43 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2hfd h SER 43 Cb 0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.58 2hfd h SER 43 CO 0.00 0.73 -0.63 -0.67 -1.14 0.00 0.00 176.83 175.13 2hfd n ASP 44 N -3.20 -6.73 0.28 3.07 2.03 -1.26 -2.45 116.55 108.29 2hfd n ASP 44 Ca -0.02 0.88 0.14 0.00 0.52 0.00 0.00 54.79 56.31 2hfd n ASP 44 Cb 0.85 -2.98 0.83 0.00 -0.72 0.00 0.00 41.12 39.10 2hfd n ASP 44 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2hfd h PRO 45 N 1.76 0.00 0.04 -0.67 0.13 -1.96 0.16 132.00 131.46 2hfd h PRO 45 Ca 0.00 0.00 -0.38 0.00 -0.87 0.00 0.00 66.00 64.75 2hfd h PRO 45 Cb 0.00 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.08 2hfd h PRO 45 CO 0.00 0.07 -2.26 1.17 -0.23 0.00 0.00 178.00 176.75 2hfd n LYS 46 N -3.65 0.67 -0.19 0.86 3.00 -1.26 -4.25 118.16 113.34 2hfd n LYS 46 Ca -0.02 0.22 -0.10 0.00 -0.00 0.00 0.00 58.31 58.41 2hfd n LYS 46 Cb 0.17 -1.59 0.01 0.00 0.00 0.00 0.00 35.03 33.62 2hfd n LYS 46 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.40 177.31 2hfd h ARG 47 N -0.14 1.03 -4.38 1.64 9.65 -1.71 -3.41 114.38 117.05 2hfd h ARG 47 Ca -0.53 -0.38 -0.59 0.00 -1.10 0.00 0.00 59.98 57.38 2hfd h ARG 47 Cb 1.88 -0.07 -0.37 0.00 -1.39 0.00 0.00 29.97 30.02 2hfd h ARG 47 CO -0.08 1.07 -0.80 0.99 2.80 0.00 0.00 179.97 183.95 2hfd s THR 48 N -4.86 1.41 0.30 0.20 2.01 0.56 -4.85 115.64 110.42 2hfd s THR 48 Ca -0.12 -0.87 -0.00 0.00 0.31 0.00 0.00 61.69 61.02 2hfd s THR 48 Cb 0.13 -1.54 0.28 0.00 0.01 0.00 0.00 72.50 71.37 2hfd s THR 48 CO 0.86 0.13 1.93 1.55 -0.69 0.00 0.00 174.62 178.40 2hfd h PRO 49 N 8.03 1.02 -3.23 4.92 0.13 -1.80 -3.20 132.00 137.87 2hfd h PRO 49 Ca -0.26 -0.06 -0.70 0.00 -0.87 0.00 0.00 66.00 64.11 2hfd h PRO 49 Cb 1.10 -0.23 -0.35 0.00 0.13 0.00 0.00 31.00 31.65 2hfd h PRO 49 CO 0.44 0.68 -0.07 0.39 -0.23 0.00 0.00 178.00 179.21 2hfd n GLU 50 N -4.47 2.73 0.04 0.86 1.02 -1.26 -4.91 120.64 114.65 2hfd n GLU 50 Ca 0.13 -4.50 0.12 0.00 -0.02 0.00 0.00 57.16 52.89 2hfd n GLU 50 Cb 0.16 -2.41 0.58 0.00 -0.02 0.00 0.00 31.44 29.75 2hfd n GLU 50 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2hfd h VAL 51 N 3.95 0.90 0.00 2.62 2.07 -1.85 -3.25 116.25 120.69 2hfd h VAL 51 Ca 0.17 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.62 2hfd h VAL 51 Cb 0.79 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 2hfd h VAL 51 CO 0.88 0.04 -0.02 -1.28 0.02 0.00 0.00 177.57 177.21 2hfd h SER 52 N 0.20 0.00 0.00 0.57 0.87 -1.92 -3.43 113.55 109.85 2hfd h SER 52 Ca 0.19 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 2hfd h SER 52 Cb 0.47 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.43 2hfd h SER 52 CO -0.03 0.07 0.00 -0.67 -0.53 0.00 0.00 176.83 175.67 2hfd n ASP 53 N -2.41 0.00 -3.72 6.23 2.03 -1.23 -4.25 116.55 113.19 2hfd n ASP 53 Ca -0.00 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 55.01 2hfd n ASP 53 Cb 0.01 0.00 -0.14 0.00 -0.72 0.00 0.00 41.12 40.27 2hfd n ASP 53 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 2hfd s ASN 54 N -4.00 3.89 0.00 1.67 -0.87 -1.26 -5.00 114.94 109.37 2hfd s ASN 54 Ca 0.00 -1.98 0.00 0.00 -1.57 0.00 0.00 52.86 49.31 2hfd s ASN 54 Cb 0.00 -0.92 0.00 0.00 -0.02 0.00 0.00 41.25 40.31 2hfd s ASN 54 CO 0.00 -0.37 0.62 -0.81 -2.57 0.00 0.00 177.10 173.97 2hfd n PRO 55 N 4.40 0.88 0.11 -0.60 -0.04 -1.26 -3.82 135.00 134.67 2hfd n PRO 55 Ca 0.02 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.44 2hfd n PRO 55 Cb 0.39 -1.26 0.11 0.00 -0.04 0.00 0.00 33.50 32.71 2hfd n PRO 55 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2hfd h VAL 56 N 0.00 1.45 0.00 0.52 2.07 -1.96 -3.20 116.25 115.12 2hfd h VAL 56 Ca 0.00 -2.20 -0.03 0.00 0.82 0.00 0.00 66.70 65.28 2hfd h VAL 56 Cb 0.26 2.17 -0.00 0.00 -1.52 0.00 0.00 31.29 32.20 2hfd h VAL 56 CO 0.00 0.64 -0.16 0.00 0.02 0.00 0.00 177.57 178.07 2hfd h MET 57 N 0.08 0.00 -0.55 1.57 -0.00 -2.00 -1.52 114.93 112.50 2hfd h MET 57 Ca -0.01 0.00 0.01 0.00 -0.00 0.00 0.00 59.70 59.69 2hfd h MET 57 Cb 1.19 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 32.76 2hfd h MET 57 CO 0.09 0.16 0.37 0.82 -0.00 0.00 0.00 176.91 178.35 2hfd h ILE 58 N 0.00 1.14 -0.51 -0.10 1.08 -1.86 -1.33 117.51 115.92 2hfd h ILE 58 Ca -0.00 -0.26 -0.10 0.00 -0.39 0.00 0.00 64.86 64.11 2hfd h ILE 58 Cb 0.33 0.33 -0.02 0.00 -3.07 0.00 0.00 36.82 34.39 2hfd h ILE 58 CO 0.02 0.14 -0.09 1.23 -0.69 0.00 0.00 178.15 178.76 2hfd h GLY 59 N 0.75 1.01 2.00 5.37 0.00 -1.45 -2.73 103.07 108.02 2hfd h GLY 59 Ca 0.20 -0.78 -0.09 0.00 0.00 0.00 0.00 47.33 46.66 2hfd h GLY 59 CO -0.04 0.71 -0.45 0.83 0.00 0.00 0.00 176.54 177.59 2hfd h GLU 60 N 0.84 0.00 -0.05 4.80 4.39 -1.24 -2.48 114.58 120.84 2hfd h GLU 60 Ca 0.14 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.83 2hfd h GLU 60 Cb 0.62 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.27 2hfd h GLU 60 CO 0.04 0.45 0.01 1.25 -1.16 0.00 0.00 179.01 179.60 2hfd h LEU 61 N 0.00 0.07 -2.37 1.33 5.85 -1.00 -2.90 115.31 116.28 2hfd h LEU 61 Ca -0.00 -0.24 -0.00 0.00 0.84 0.00 0.00 57.88 58.47 2hfd h LEU 61 Cb 0.86 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.87 2hfd h LEU 61 CO 0.06 0.29 -0.02 -0.07 -0.34 0.00 0.00 178.44 178.37 2hfd h LEU 62 N -0.16 0.00 -1.30 2.25 4.07 -1.23 -2.84 115.31 116.11 2hfd h LEU 62 Ca 0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.97 2hfd h LEU 62 Cb 0.25 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.99 2hfd h LEU 62 CO 0.00 0.02 0.12 0.03 -1.08 0.00 0.00 178.44 177.53 2hfd h ARG 63 N 0.00 0.00 -0.00 1.13 2.47 -1.23 0.11 114.38 116.86 2hfd h ARG 63 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2hfd h ARG 63 Cb 0.04 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.36 2hfd h ARG 63 CO 0.00 0.00 -0.03 -0.85 0.56 0.00 0.00 179.97 179.65 2hfd n GLU 64 N -2.23 0.14 -3.16 0.04 0.28 -1.07 -3.75 120.64 110.88 2hfd n GLU 64 Ca -0.01 -0.01 -0.23 0.00 -0.16 0.00 0.00 57.16 56.75 2hfd n GLU 64 Cb 0.15 -1.50 -0.05 0.00 1.43 0.00 0.00 31.44 31.47 2hfd n GLU 64 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 2hfd n PHE 65 N -1.42 1.43 1.62 -1.84 3.72 0.03 -4.94 117.46 116.06 2hfd n PHE 65 Ca 0.09 -3.85 0.12 0.00 -0.05 0.00 0.00 57.45 53.77 2hfd n PHE 65 Cb 0.31 -0.44 0.57 0.00 -0.94 0.00 0.00 39.48 38.98 2hfd n PHE 65 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2hfd n PRO 66 N 0.51 1.42 -0.00 -1.08 -0.04 -1.25 -3.00 135.00 131.55 2hfd n PRO 66 Ca 0.26 -0.62 0.10 0.00 -0.04 0.00 0.00 63.50 63.21 2hfd n PRO 66 Cb 0.53 -1.42 -0.13 0.00 -0.04 0.00 0.00 33.50 32.44 2hfd n PRO 66 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2hfd n ASP 67 N -0.21 0.69 -4.38 3.54 2.03 -1.26 -4.84 116.55 112.12 2hfd n ASP 67 Ca 0.18 -0.68 -0.36 0.00 0.52 0.00 0.00 54.79 54.46 2hfd n ASP 67 Cb 0.24 1.29 -0.13 0.00 -0.72 0.00 0.00 41.12 41.80 2hfd n ASP 67 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 2hfd s TYR 68 N -3.16 3.02 -0.28 -0.67 5.04 -1.16 -5.05 117.35 115.10 2hfd s TYR 68 Ca 0.03 -0.67 -0.28 0.00 -2.44 0.00 0.00 57.07 53.70 2hfd s TYR 68 Cb 0.15 -2.17 -0.03 0.00 0.35 0.00 0.00 41.96 40.26 2hfd s TYR 68 CO 0.88 -0.45 1.97 0.95 -1.34 0.00 0.00 175.55 177.56 2hfd s THR 69 N 1.55 3.28 -0.31 4.34 -4.23 -1.26 -4.96 115.64 114.05 2hfd s THR 69 Ca 0.06 0.29 -0.20 0.00 -1.18 0.00 0.00 61.69 60.66 2hfd s THR 69 Cb -0.15 -3.37 -0.01 0.00 1.34 0.00 0.00 72.50 70.31 2hfd s THR 69 CO 0.00 -0.24 0.59 0.26 -0.54 0.00 0.00 174.62 174.70 2hfd s TRP 70 N 7.44 3.21 -0.53 3.99 0.52 -1.26 -4.73 118.94 127.59 2hfd s TRP 70 Ca 0.89 0.51 -0.23 0.00 0.02 0.00 0.00 56.10 57.29 2hfd s TRP 70 Cb -0.27 -2.95 0.04 0.00 -1.15 0.00 0.00 33.47 29.15 2hfd s TRP 70 CO 0.34 -0.46 0.84 -0.65 0.02 0.00 0.00 176.95 177.04 2hfd s GLN 71 N 2.53 3.28 -0.52 4.98 1.11 -1.24 -4.91 119.66 124.90 2hfd s GLN 71 Ca 0.23 -0.41 -0.20 0.00 0.01 0.00 0.00 55.36 54.99 2hfd s GLN 71 Cb -0.15 -4.05 0.06 0.00 -1.01 0.00 0.00 33.01 27.85 2hfd s GLN 71 CO 0.12 -1.37 0.70 0.08 0.01 0.00 0.00 175.29 174.83 2hfd s VAL 72 N 3.52 4.75 -0.05 1.09 1.01 -1.26 0.08 120.40 129.55 2hfd s VAL 72 Ca 0.26 -0.32 0.04 0.00 0.00 0.00 0.00 61.98 61.96 2hfd s VAL 72 Cb -0.14 -4.36 -0.03 0.00 0.00 0.00 0.00 36.38 31.85 2hfd s VAL 72 CO 0.18 -0.89 -0.16 0.00 0.00 0.00 0.00 175.10 174.23 2hfd s ALA 73 N 2.95 2.61 -0.01 5.51 0.00 0.59 -3.18 121.76 130.23 2hfd s ALA 73 Ca 0.19 -1.00 0.07 0.00 0.00 0.00 0.00 51.96 51.22 2hfd s ALA 73 Cb -0.18 -0.92 -0.02 0.00 0.00 0.00 0.00 23.12 22.00 2hfd s ALA 73 CO 0.13 0.55 -0.24 0.96 0.00 0.00 0.00 175.76 177.17 2hfd s ILE 74 N -0.72 1.86 0.32 0.00 -4.36 0.37 -0.20 121.20 118.47 2hfd s ILE 74 Ca 0.11 -1.02 0.03 0.00 -0.26 0.00 0.00 60.65 59.51 2hfd s ILE 74 Cb -0.11 -1.55 -0.02 0.00 1.25 0.00 0.00 42.46 42.04 2hfd s ILE 74 CO 0.00 0.51 0.48 0.00 0.24 0.00 0.00 174.94 176.18 2hfd s ALA 75 N -0.57 3.89 1.14 2.27 0.00 -0.99 0.11 121.76 127.62 2hfd s ALA 75 Ca 0.09 -1.15 -0.15 0.00 0.00 0.00 0.00 51.96 50.76 2hfd s ALA 75 Cb -0.09 -1.90 0.26 0.00 0.00 0.00 0.00 23.12 21.39 2hfd s ALA 75 CO -0.01 0.02 1.05 0.34 0.00 0.00 0.00 175.76 177.17 2hfd s ASP 76 N -4.07 1.33 0.04 0.00 -1.08 -1.23 -4.69 116.67 106.96 2hfd s ASP 76 Ca 0.40 1.17 -0.28 0.00 -0.52 0.00 0.00 52.55 53.32 2hfd s ASP 76 Cb -0.09 -1.81 -0.17 0.00 -1.46 0.00 0.00 42.92 39.39 2hfd s ASP 76 CO 0.33 -3.94 1.39 0.25 0.52 0.00 0.00 175.17 173.73 2hfd h LEU 77 N -2.45 -0.54 -0.03 -1.34 6.46 -1.97 -0.18 115.31 115.28 2hfd h LEU 77 Ca -0.56 -0.06 -0.25 0.00 -0.12 0.00 0.00 57.88 56.89 2hfd h LEU 77 Cb 1.33 0.14 0.00 0.00 -0.73 0.00 0.00 40.66 41.40 2hfd h LEU 77 CO 0.49 -0.25 -1.09 -0.33 -0.62 0.00 0.00 178.44 176.64 2hfd h GLU 78 N -0.82 0.30 -0.27 1.25 5.08 -2.00 -3.32 114.58 114.79 2hfd h GLU 78 Ca -0.06 -0.41 -0.10 0.00 -1.00 0.00 0.00 59.36 57.78 2hfd h GLU 78 Cb 0.57 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 2hfd h GLU 78 CO 0.11 1.14 -0.26 1.96 -1.00 0.00 0.00 179.01 180.96 2hfd h GLN 79 N 0.13 0.52 -0.13 2.33 4.20 -1.92 -2.22 115.11 118.02 2hfd h GLN 79 Ca -0.10 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.40 2hfd h GLN 79 Cb 1.78 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.53 2hfd h GLN 79 CO 0.18 0.74 0.08 0.66 -0.67 0.00 0.00 178.83 179.82 2hfd h SER 80 N 0.46 0.16 -0.32 1.46 4.64 -1.12 0.61 113.55 119.44 2hfd h SER 80 Ca 0.06 -0.04 0.03 0.00 -0.47 0.00 0.00 61.79 61.37 2hfd h SER 80 Cb 0.70 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 62.72 2hfd h SER 80 CO 0.05 0.15 0.14 -0.08 -0.87 0.00 0.00 176.83 176.22 2hfd h GLU 81 N 0.15 0.29 -0.69 4.77 4.81 -1.64 -2.21 114.58 120.06 2hfd h GLU 81 Ca 0.05 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 2hfd h GLU 81 Cb 0.02 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.30 2hfd h GLU 81 CO -0.01 0.19 0.41 0.00 -0.73 0.00 0.00 179.01 178.87 2hfd h ALA 82 N 1.18 1.42 0.13 2.92 0.00 -1.07 0.16 119.26 124.00 2hfd h ALA 82 Ca 0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2hfd h ALA 82 Cb 0.08 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.59 2hfd h ALA 82 CO -0.12 0.50 -0.06 0.82 0.00 0.00 0.00 179.25 180.39 2hfd h ILE 83 N 0.95 0.94 -0.59 0.00 2.04 -0.31 0.10 117.51 120.65 2hfd h ILE 83 Ca 0.25 -0.23 -0.10 0.00 1.00 0.00 0.00 64.86 65.78 2hfd h ILE 83 Cb -0.03 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 2hfd h ILE 83 CO -0.05 0.06 -0.04 1.23 0.00 0.00 0.00 178.15 179.35 2hfd h GLY 84 N -0.27 1.15 0.45 5.37 0.00 -1.21 -1.65 103.07 106.91 2hfd h GLY 84 Ca -0.02 -0.88 0.09 0.00 0.00 0.00 0.00 47.33 46.53 2hfd h GLY 84 CO 0.03 0.81 0.30 -1.80 0.00 0.00 0.00 176.54 175.88 2hfd h ASP 85 N 0.96 0.37 0.55 0.19 3.58 -0.52 0.27 116.42 121.82 2hfd h ASP 85 Ca 0.16 0.07 -0.15 0.00 0.42 0.00 0.00 57.03 57.53 2hfd h ASP 85 Cb 0.61 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.65 2hfd h ASP 85 CO 0.04 0.22 -0.66 -0.09 -2.88 0.00 0.00 179.24 175.86 2hfd h ARG 86 N 0.53 0.09 0.02 0.28 2.43 -0.62 -3.28 114.38 113.84 2hfd h ARG 86 Ca 0.33 -0.07 -0.26 0.00 -0.81 0.00 0.00 59.98 59.16 2hfd h ARG 86 Cb 0.36 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.89 2hfd h ARG 86 CO -0.28 0.72 -1.40 0.35 -1.51 0.00 0.00 179.97 177.85 2hfd h PHE 87 N 0.07 0.08 0.00 2.20 3.57 -0.43 -3.48 116.94 118.95 2hfd h PHE 87 Ca -0.01 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.43 2hfd h PHE 87 Cb 1.17 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.91 2hfd h PHE 87 CO 0.01 1.08 0.00 0.41 -2.23 0.00 0.00 178.31 177.58 2hfd n GLY 88 N 1.50 1.35 3.02 2.40 0.00 0.86 -5.08 105.19 109.24 2hfd n GLY 88 Ca -0.10 -0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 2hfd n GLY 88 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hfd s VAL 89 N -2.00 1.88 0.00 1.61 1.01 -0.97 -4.90 120.40 117.03 2hfd s VAL 89 Ca 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 61.98 60.60 2hfd s VAL 89 Cb 0.00 -2.02 0.00 0.00 0.00 0.00 0.00 36.38 34.36 2hfd s VAL 89 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 175.10 175.59 2hfd n PHE 90 N 4.55 0.00 -1.14 5.22 3.01 -1.26 -4.34 117.46 123.50 2hfd n PHE 90 Ca -0.14 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.27 2hfd n PHE 90 Cb 0.44 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.89 2hfd n PHE 90 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 2hfd n ARG 91 N 0.00 -0.78 -4.20 -1.08 0.63 -1.26 -5.00 116.66 104.96 2hfd n ARG 91 Ca 0.00 0.55 -0.19 0.00 -0.92 0.00 0.00 57.85 57.29 2hfd n ARG 91 Cb 0.00 -4.34 -0.12 0.00 0.45 0.00 0.00 32.46 28.45 2hfd n ARG 91 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2hfd s PHE 92 N -1.97 1.34 0.22 -0.14 0.08 -1.26 -4.81 117.98 111.44 2hfd s PHE 92 Ca 0.00 -0.48 -0.32 0.00 0.12 0.00 0.00 56.93 56.25 2hfd s PHE 92 Cb 0.00 -0.74 -0.13 0.00 -0.57 0.00 0.00 43.02 41.58 2hfd s PHE 92 CO 0.00 0.10 1.52 -2.30 -0.10 0.00 0.00 175.22 174.44 2hfd n PRO 93 N 1.06 2.24 -2.69 0.24 -0.02 -1.26 -4.97 135.00 129.60 2hfd n PRO 93 Ca -0.20 0.80 -0.03 0.00 -2.02 0.00 0.00 63.50 62.06 2hfd n PRO 93 Cb 0.55 -2.53 0.01 0.00 -0.02 0.00 0.00 33.50 31.51 2hfd n PRO 93 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2hfd n ALA 94 N 2.58 -1.30 -3.27 3.55 0.00 -1.11 -4.65 120.51 116.32 2hfd n ALA 94 Ca 0.13 -0.62 -0.37 0.00 0.00 0.00 0.00 53.44 52.58 2hfd n ALA 94 Cb 0.32 0.41 -0.13 0.00 0.00 0.00 0.00 19.45 20.05 2hfd n ALA 94 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2hfd s THR 95 N -2.37 3.79 -0.12 0.00 2.01 -1.22 -0.21 115.64 117.52 2hfd s THR 95 Ca 0.11 -0.70 -0.04 0.00 0.31 0.00 0.00 61.69 61.37 2hfd s THR 95 Cb -0.02 -2.93 -0.04 0.00 0.01 0.00 0.00 72.50 69.53 2hfd s THR 95 CO 0.04 0.13 0.04 -0.76 -0.69 0.00 0.00 174.62 173.39 2hfd s LEU 96 N 1.48 3.76 -0.07 4.42 1.43 0.26 -0.32 118.68 129.64 2hfd s LEU 96 Ca 0.03 0.16 0.03 0.00 -1.03 0.00 0.00 54.13 53.32 2hfd s LEU 96 Cb -0.17 -1.90 -0.02 0.00 0.03 0.00 0.00 46.19 44.13 2hfd s LEU 96 CO 0.01 0.31 -0.15 0.54 0.23 0.00 0.00 176.35 177.29 2hfd s VAL 97 N -0.46 2.96 -0.11 -1.59 0.11 -0.66 -0.08 120.40 120.58 2hfd s VAL 97 Ca 0.09 -0.74 0.04 0.00 -2.93 0.00 0.00 61.98 58.43 2hfd s VAL 97 Cb -0.12 -2.17 0.00 0.00 -1.53 0.00 0.00 36.38 32.56 2hfd s VAL 97 CO 0.02 0.57 -0.23 -0.36 -3.33 0.00 0.00 175.10 171.78 2hfd s PHE 98 N -0.40 2.49 -0.29 1.54 0.40 0.44 -0.00 117.98 122.16 2hfd s PHE 98 Ca 0.04 -1.07 -0.20 0.00 -0.60 0.00 0.00 56.93 55.10 2hfd s PHE 98 Cb -0.12 -1.68 0.14 0.00 0.51 0.00 0.00 43.02 41.87 2hfd s PHE 98 CO 0.02 -0.45 1.04 0.95 0.70 0.00 0.00 175.22 177.48 2hfd s THR 99 N 0.47 0.00 -1.77 0.64 -4.23 -0.54 -0.82 115.64 109.39 2hfd s THR 99 Ca -0.16 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.35 2hfd s THR 99 Cb -0.17 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.67 2hfd s THR 99 CO 0.06 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.75 2hfd n GLY 100 N 2.96 1.18 0.00 3.99 0.00 -1.26 -4.24 105.19 107.82 2hfd n GLY 100 Ca -0.16 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.69 2hfd n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hfd n GLY 101 N -0.87 0.00 7.00 -0.02 0.00 -1.26 -5.11 105.19 104.93 2hfd n GLY 101 Ca -0.18 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.37 2hfd n GLY 101 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2hfd n ASN 102 N 0.00 -0.76 -4.38 1.61 2.85 -1.26 -4.72 115.26 108.60 2hfd n ASN 102 Ca 0.00 0.00 -0.60 0.00 -0.11 0.00 0.00 54.58 53.87 2hfd n ASN 102 Cb 0.00 0.00 -0.11 0.00 1.24 0.00 0.00 39.78 40.91 2hfd n ASN 102 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2hfd n TYR 103 N 0.00 1.35 -0.10 1.20 9.36 -1.26 -1.47 117.16 126.23 2hfd n TYR 103 Ca 0.00 0.78 -0.11 0.00 3.32 0.00 0.00 57.90 61.90 2hfd n TYR 103 Cb 0.00 -2.31 -0.15 0.00 -0.63 0.00 0.00 39.34 36.26 2hfd n TYR 103 CO 0.00 0.00 0.00 -2.13 0.22 0.00 0.00 176.86 174.95 2hfd n ARG 104 N 6.85 0.82 -3.64 2.98 3.00 1.00 -4.86 116.66 122.81 2hfd n ARG 104 Ca 0.48 0.01 0.00 0.00 -0.00 0.00 0.00 57.85 58.35 2hfd n ARG 104 Cb -0.01 -1.49 0.00 0.00 0.00 0.00 0.00 32.46 30.96 2hfd n ARG 104 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2hfd n GLY 105 N 1.90 -1.73 3.02 5.14 0.00 -1.14 -4.92 105.19 107.46 2hfd n GLY 105 Ca -0.33 -1.13 -0.20 0.00 0.00 0.00 0.00 46.02 44.35 2hfd n GLY 105 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hfd s VAL 106 N -2.58 0.83 -0.28 1.61 0.11 -1.26 -1.66 120.40 117.17 2hfd s VAL 106 Ca 0.00 -0.41 -0.10 0.00 -2.93 0.00 0.00 61.98 58.54 2hfd s VAL 106 Cb 0.00 -0.72 -0.04 0.00 -1.53 0.00 0.00 36.38 34.09 2hfd s VAL 106 CO 0.00 0.25 0.16 -0.76 -3.33 0.00 0.00 175.10 171.42 2hfd s LEU 107 N 0.04 3.93 0.01 2.54 1.43 0.56 -5.02 118.68 122.17 2hfd s LEU 107 Ca -0.01 -0.14 0.03 0.00 -1.03 0.00 0.00 54.13 52.99 2hfd s LEU 107 Cb -0.07 -2.06 -0.01 0.00 0.03 0.00 0.00 46.19 44.07 2hfd s LEU 107 CO 0.00 -0.07 -0.09 0.54 0.23 0.00 0.00 176.35 176.95 2hfd s ASN 108 N 1.71 1.09 0.00 2.29 4.22 -1.26 -3.40 114.94 119.59 2hfd s ASN 108 Ca 0.07 -0.25 0.00 0.00 -2.14 0.00 0.00 52.86 50.53 2hfd s ASN 108 Cb -0.16 -0.09 0.00 0.00 1.28 0.00 0.00 41.25 42.28 2hfd s ASN 108 CO 0.09 0.06 0.00 0.61 -2.04 0.00 0.00 177.10 175.81 2hfd n GLY 109 N 2.54 -1.03 0.00 0.45 0.00 -1.26 -4.89 105.19 101.00 2hfd n GLY 109 Ca -0.15 -1.63 -0.00 0.00 0.00 0.00 0.00 46.02 44.24 2hfd n GLY 109 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2hfd h ILE 110 N 0.00 0.00 -1.56 -0.61 1.08 -1.98 -3.51 117.51 110.93 2hfd h ILE 110 Ca 0.00 -0.07 0.10 0.00 -0.39 0.00 0.00 64.86 64.50 2hfd h ILE 110 Cb 0.00 0.00 -0.05 0.00 -3.07 0.00 0.00 36.82 33.70 2hfd h ILE 110 CO 0.00 0.00 -0.51 1.41 -0.69 0.00 0.00 178.15 178.36 2hfd n HIS 111 N -2.26 -1.74 -1.74 1.37 8.25 -1.26 -4.82 115.22 113.02 2hfd n HIS 111 Ca -0.00 0.96 -0.35 0.00 -0.26 0.00 0.00 57.72 58.07 2hfd n HIS 111 Cb 0.01 -1.64 0.06 0.00 1.12 0.00 0.00 29.99 29.53 2hfd n HIS 111 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2hfd s PRO 112 N -3.94 2.59 0.26 -0.41 0.04 -1.26 -4.79 135.00 127.49 2hfd s PRO 112 Ca 0.00 1.78 -0.03 0.00 0.04 0.00 0.00 61.00 62.79 2hfd s PRO 112 Cb 0.00 -1.89 0.40 0.00 0.04 0.00 0.00 34.50 33.05 2hfd s PRO 112 CO 0.00 -1.49 1.86 2.35 0.04 0.00 0.00 177.00 179.76 2hfd h TRP 113 N 0.31 1.10 -1.00 0.56 -0.00 -1.99 0.55 115.95 115.47 2hfd h TRP 113 Ca -0.49 0.03 0.05 0.00 -0.00 0.00 0.00 58.89 58.48 2hfd h TRP 113 Cb 1.30 -0.35 -0.06 0.00 -0.00 0.00 0.00 29.16 30.04 2hfd h TRP 113 CO 0.47 0.54 0.65 0.00 -0.00 0.00 0.00 178.44 180.10 2hfd h ALA 114 N 1.45 1.36 0.00 2.65 0.00 -2.00 -1.14 119.26 121.58 2hfd h ALA 114 Ca 0.42 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 55.15 2hfd h ALA 114 Cb 0.22 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2hfd h ALA 114 CO -0.19 0.51 -0.70 0.93 0.00 0.00 0.00 179.25 179.80 2hfd h GLU 115 N 1.23 0.00 -0.27 0.00 4.39 -1.58 -0.85 114.58 117.50 2hfd h GLU 115 Ca 0.42 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 60.10 2hfd h GLU 115 Cb 0.08 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 2hfd h GLU 115 CO -0.15 0.67 0.10 1.25 -1.16 0.00 0.00 179.01 179.73 2hfd h LEU 116 N 0.00 0.38 -0.66 1.33 7.12 -0.25 0.56 115.31 123.79 2hfd h LEU 116 Ca -0.01 -0.17 -0.06 0.00 0.13 0.00 0.00 57.88 57.77 2hfd h LEU 116 Cb 1.53 -0.10 -0.03 0.00 -0.53 0.00 0.00 40.66 41.53 2hfd h LEU 116 CO 0.09 0.45 0.18 0.40 -0.13 0.00 0.00 178.44 179.43 2hfd h ILE 117 N 0.28 1.25 -0.04 4.05 2.04 -1.21 -1.63 117.51 122.26 2hfd h ILE 117 Ca 0.09 -0.91 0.04 0.00 1.00 0.00 0.00 64.86 65.08 2hfd h ILE 117 Cb 0.19 0.59 -0.05 0.00 -0.74 0.00 0.00 36.82 36.81 2hfd h ILE 117 CO -0.01 0.35 -0.25 -1.13 0.00 0.00 0.00 178.15 177.11 2hfd h ASN 118 N 0.97 -0.75 -0.07 1.72 -0.73 -0.74 0.11 115.58 116.09 2hfd h ASN 118 Ca 0.21 0.11 -0.00 0.00 1.87 0.00 0.00 56.30 58.48 2hfd h ASN 118 Cb 0.33 0.31 -0.00 0.00 0.27 0.00 0.00 38.32 39.23 2hfd h ASN 118 CO -0.00 -0.31 0.03 -0.07 -0.37 0.00 0.00 177.43 176.71 2hfd h LEU 119 N -0.36 0.09 -0.13 0.34 3.38 -0.84 0.13 115.31 117.92 2hfd h LEU 119 Ca 0.07 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 57.95 2hfd h LEU 119 Cb 0.47 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 2hfd h LEU 119 CO -0.25 0.21 -0.16 -0.03 0.09 0.00 0.00 178.44 178.30 2hfd h MET 120 N -0.02 -0.19 -0.12 1.13 4.05 -0.98 -0.33 114.93 118.47 2hfd h MET 120 Ca 0.02 0.01 -0.13 0.00 -0.28 0.00 0.00 59.70 59.32 2hfd h MET 120 Cb 0.14 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.97 2hfd h MET 120 CO -0.00 -0.13 -0.51 -0.09 0.23 0.00 0.00 176.91 176.41 2hfd h ARG 121 N -0.20 0.33 -0.08 0.39 2.43 -0.75 0.49 114.38 116.99 2hfd h ARG 121 Ca 0.09 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 59.06 2hfd h ARG 121 Cb 0.33 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 2hfd h ARG 121 CO -0.25 0.76 0.01 0.78 -1.51 0.00 0.00 179.97 179.76 2hfd h GLY 122 N 1.28 0.12 0.00 2.80 0.00 -0.09 0.14 103.07 107.32 2hfd h GLY 122 Ca 0.01 -0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.29 2hfd h GLY 122 CO 0.08 0.05 -0.20 1.41 0.00 0.00 0.00 176.54 177.88 2hfd h LEU 123 N 0.11 0.00 -1.69 3.11 3.38 -0.57 -3.35 115.31 116.30 2hfd h LEU 123 Ca 0.03 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2hfd h LEU 123 Cb 0.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2hfd h LEU 123 CO 0.00 0.61 -0.19 -0.37 0.09 0.00 0.00 178.44 178.58 2hfd h VAL 124 N -1.00 0.86 -3.20 1.22 -1.51 -0.90 -3.23 116.25 108.49 2hfd h VAL 124 Ca -0.00 -0.71 -0.64 0.00 -1.23 0.00 0.00 66.70 64.12 2hfd h VAL 124 Cb 0.21 1.42 -0.41 0.00 -2.13 0.00 0.00 31.29 30.38 2hfd h VAL 124 CO -0.00 0.18 -0.53 -0.70 -1.23 0.00 0.00 177.57 175.29 2hfd s GLU 125 N -4.31 2.43 0.70 5.19 2.12 0.49 -4.86 118.70 120.47 2hfd s GLU 125 Ca -0.03 -3.14 -0.01 0.00 0.36 0.00 0.00 54.97 52.15 2hfd s GLU 125 Cb 0.14 -3.46 0.11 0.00 0.26 0.00 0.00 34.13 31.18 2hfd s GLU 125 CO 0.64 -1.24 0.97 -1.25 -0.54 0.00 0.00 175.26 173.85 2hfd s PRO 126 N -1.12 1.79 0.00 4.30 0.04 -1.22 -4.50 135.00 134.28 2hfd s PRO 126 Ca 0.23 -1.04 0.27 0.00 0.04 0.00 0.00 61.00 60.50 2hfd s PRO 126 Cb -0.10 -2.34 0.74 0.00 0.04 0.00 0.00 34.50 32.83 2hfd s PRO 126 CO -0.12 -1.36 1.57 1.04 0.04 0.00 0.00 177.00 178.17 2hfd n GLN 127 N -2.79 1.88 -3.17 4.56 1.13 -1.26 -4.92 117.38 112.81 2hfd n GLN 127 Ca 0.14 -1.29 -0.20 0.00 -1.94 0.00 0.00 57.00 53.71 2hfd n GLN 127 Cb 0.60 -1.47 0.05 0.00 0.11 0.00 0.00 30.24 29.53 2hfd n GLN 127 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2hfd n GLN 128 N 0.57 -5.52 -4.36 -1.09 6.02 -1.26 -5.02 117.38 106.72 2hfd n GLN 128 Ca 0.17 0.76 -0.35 0.00 -0.01 0.00 0.00 57.00 57.57 2hfd n GLN 128 Cb 0.44 -5.43 -0.09 0.00 1.02 0.00 0.00 30.24 26.18 2hfd n GLN 128 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2hfd s GLU 129 N -5.82 3.02 -0.36 -1.09 0.41 -1.26 -4.71 118.70 108.88 2hfd s GLU 129 Ca 0.38 -0.40 -0.10 0.00 -0.41 0.00 0.00 54.97 54.43 2hfd s GLU 129 Cb -0.17 -2.81 0.01 0.00 -1.78 0.00 0.00 34.13 29.39 2hfd s GLU 129 CO 0.47 0.69 0.38 0.54 -0.49 0.00 0.00 175.26 176.85 2hfd n ARG 130 N 2.18 -2.52 -1.65 1.61 1.74 -1.26 -4.81 116.66 111.96 2hfd n ARG 130 Ca -0.19 2.19 -0.23 0.00 -0.77 0.00 0.00 57.85 58.86 2hfd n ARG 130 Cb 0.54 -5.26 -0.05 0.00 -1.02 0.00 0.00 32.46 26.66 2hfd n ARG 130 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2hfd s ALA 131 N -2.19 1.14 -1.74 7.54 0.00 -1.26 -5.15 121.76 120.10 2hfd s ALA 131 Ca 0.16 -0.65 0.14 0.00 0.00 0.00 0.00 51.96 51.61 2hfd s ALA 131 Cb -0.04 -4.50 0.11 0.00 0.00 0.00 0.00 23.12 18.69 2hfd s ALA 131 CO 0.71 -5.29 0.94 -1.13 0.00 0.00 0.00 175.76 170.99