#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f6n h LEU 12 N 0.00 -0.19 -0.90 -2.12 7.12 -2.05 -1.43 115.31 115.73 1f6n h LEU 12 Ca 0.00 0.10 -0.07 0.00 0.13 0.00 0.00 57.88 58.04 1f6n h LEU 12 Cb 0.00 0.18 -0.02 0.00 -0.53 0.00 0.00 40.66 40.29 1f6n h LEU 12 CO 0.00 -0.06 -0.00 0.00 -0.13 0.00 0.00 178.44 178.25 1f6n h ALA 13 N 1.37 1.08 0.00 1.25 0.00 -2.06 -1.85 119.26 119.06 1f6n h ALA 13 Ca 0.21 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1f6n h ALA 13 Cb 0.30 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1f6n h ALA 13 CO -0.35 0.58 -0.39 0.77 0.00 0.00 0.00 179.25 179.85 1f6n h SER 14 N 0.75 0.00 0.22 0.00 0.02 -1.74 -1.88 113.55 110.93 1f6n h SER 14 Ca 0.15 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.81 1f6n h SER 14 Cb 0.46 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.02 1f6n h SER 14 CO 0.02 0.39 -1.20 0.25 -1.14 0.00 0.00 176.83 175.15 1f6n h LEU 15 N 0.00 0.78 -0.08 5.07 5.85 -1.10 -2.85 115.31 122.97 1f6n h LEU 15 Ca -0.00 -0.71 0.02 0.00 0.84 0.00 0.00 57.88 58.02 1f6n h LEU 15 Cb 0.70 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 1f6n h LEU 15 CO 0.05 1.53 -0.03 0.00 -0.34 0.00 0.00 178.44 179.65 1f6n h ALA 16 N 0.39 0.05 -0.20 1.25 0.00 -1.11 -0.12 119.26 119.52 1f6n h ALA 16 Ca -0.17 0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.59 1f6n h ALA 16 Cb 1.87 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.74 1f6n h ALA 16 CO 0.22 -0.50 -0.62 0.97 0.00 0.00 0.00 179.25 179.33 1f6n h ILE 17 N -0.01 1.30 -0.38 0.00 6.09 -1.43 -0.37 117.51 122.70 1f6n h ILE 17 Ca 0.04 -1.86 -0.06 0.00 -1.37 0.00 0.00 64.86 61.62 1f6n h ILE 17 Cb 0.07 1.81 -0.01 0.00 0.47 0.00 0.00 36.82 39.16 1f6n h ILE 17 CO -0.09 0.59 0.01 0.22 -3.07 0.00 0.00 178.15 175.81 1f6n h TYR 18 N 0.51 0.72 -0.92 2.19 3.20 -1.46 -1.90 116.97 119.31 1f6n h TYR 18 Ca -0.01 -0.12 0.02 0.00 3.14 0.00 0.00 58.73 61.76 1f6n h TYR 18 Cb 1.21 -0.19 -0.05 0.00 1.54 0.00 0.00 36.73 39.24 1f6n h TYR 18 CO 0.06 0.74 0.61 0.77 -1.64 0.00 0.00 178.16 178.70 1f6n h SER 19 N 0.49 1.03 -0.21 -2.11 0.02 -0.81 -2.46 113.55 109.48 1f6n h SER 19 Ca 0.11 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 61.07 1f6n h SER 19 Cb 0.45 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.71 1f6n h SER 19 CO 0.02 0.72 0.02 0.15 -1.14 0.00 0.00 176.83 176.60 1f6n h PHE 20 N 1.21 0.03 0.00 3.45 3.04 -0.65 -1.61 116.94 122.40 1f6n h PHE 20 Ca 0.35 0.01 -0.03 0.00 3.98 0.00 0.00 57.97 62.29 1f6n h PHE 20 Cb -0.07 0.02 -0.00 0.00 2.56 0.00 0.00 35.95 38.46 1f6n h PHE 20 CO -0.01 -0.01 -0.14 -1.49 -2.02 0.00 0.00 178.31 174.65 1f6n h TRP 21 N 0.09 0.00 0.09 0.41 4.06 -0.89 0.96 115.95 120.67 1f6n h TRP 21 Ca 0.10 0.00 -0.27 0.00 2.06 0.00 0.00 58.89 60.78 1f6n h TRP 21 Cb 0.11 0.00 0.03 0.00 -1.00 0.00 0.00 29.16 28.30 1f6n h TRP 21 CO -0.16 0.14 -1.10 0.82 -3.56 0.00 0.00 178.44 174.58 1f6n h ILE 22 N 0.00 1.32 0.25 1.49 2.04 -1.30 -2.82 117.51 118.48 1f6n h ILE 22 Ca -0.00 -2.38 0.01 0.00 1.00 0.00 0.00 64.86 63.49 1f6n h ILE 22 Cb 0.29 2.67 -0.03 0.00 -0.74 0.00 0.00 36.82 39.00 1f6n h ILE 22 CO 0.02 0.72 -0.34 0.15 0.00 0.00 0.00 178.15 178.70 1f6n h PHE 23 N 0.20 -0.92 -0.98 1.37 3.04 -0.61 -2.32 116.94 116.71 1f6n h PHE 23 Ca -0.16 0.01 0.21 0.00 3.98 0.00 0.00 57.97 62.01 1f6n h PHE 23 Cb 1.78 0.37 -0.11 0.00 2.56 0.00 0.00 35.95 40.55 1f6n h PHE 23 CO 0.12 -0.47 0.57 1.25 -2.02 0.00 0.00 178.31 177.77 1f6n h LEU 24 N -0.65 0.68 -0.79 0.59 5.85 -0.90 0.10 115.31 120.19 1f6n h LEU 24 Ca -0.00 0.12 -0.11 0.00 0.84 0.00 0.00 57.88 58.73 1f6n h LEU 24 Cb 0.62 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 1f6n h LEU 24 CO -0.12 0.18 -0.25 0.00 -0.34 0.00 0.00 178.44 177.91 1f6n h ALA 25 N 1.68 0.97 -0.43 1.25 0.00 -1.28 0.18 119.26 121.63 1f6n h ALA 25 Ca 0.60 -0.36 -0.12 0.00 0.00 0.00 0.00 54.91 55.02 1f6n h ALA 25 Cb 1.03 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1f6n h ALA 25 CO -0.43 0.60 -0.23 0.78 0.00 0.00 0.00 179.25 179.97 1f6n h GLY 26 N 1.00 0.95 0.86 0.00 0.00 -0.34 -2.45 103.07 103.09 1f6n h GLY 26 Ca 0.08 -0.83 -0.00 0.00 0.00 0.00 0.00 47.33 46.57 1f6n h GLY 26 CO 0.06 0.76 -0.03 -2.00 0.00 0.00 0.00 176.54 175.32 1f6n h LEU 27 N 0.76 -0.08 -1.02 3.11 5.85 -0.71 -1.51 115.31 121.71 1f6n h LEU 27 Ca 0.10 -0.13 0.11 0.00 0.84 0.00 0.00 57.88 58.80 1f6n h LEU 27 Cb 0.77 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.74 1f6n h LEU 27 CO 0.06 0.08 0.63 0.40 -0.34 0.00 0.00 178.44 179.28 1f6n h ILE 28 N -0.24 0.95 0.82 4.05 1.08 -0.99 0.16 117.51 123.35 1f6n h ILE 28 Ca -0.01 -0.35 -0.04 0.00 -0.39 0.00 0.00 64.86 64.07 1f6n h ILE 28 Cb 0.21 -0.16 0.01 0.00 -3.07 0.00 0.00 36.82 33.81 1f6n h ILE 28 CO 0.02 0.19 -0.39 0.22 -0.69 0.00 0.00 178.15 177.49 1f6n h TYR 29 N 1.02 -1.02 -0.56 1.37 3.20 -1.30 -0.44 116.97 119.25 1f6n h TYR 29 Ca 0.48 -0.02 0.11 0.00 3.14 0.00 0.00 58.73 62.44 1f6n h TYR 29 Cb 0.43 0.34 -0.10 0.00 1.54 0.00 0.00 36.73 38.94 1f6n h TYR 29 CO -0.00 -0.63 -0.09 -0.92 -1.64 0.00 0.00 178.16 174.87 1f6n h TYR 30 N -1.19 -0.20 -0.73 -3.82 3.20 -1.00 -0.90 116.97 112.32 1f6n h TYR 30 Ca -0.11 0.05 0.04 0.00 3.14 0.00 0.00 58.73 61.84 1f6n h TYR 30 Cb 0.84 0.18 -0.05 0.00 1.54 0.00 0.00 36.73 39.24 1f6n h TYR 30 CO 0.02 -0.21 0.45 -0.07 -1.64 0.00 0.00 178.16 176.72 1f6n h LEU 31 N 0.04 0.73 -0.53 2.82 3.38 -0.62 -1.05 115.31 120.07 1f6n h LEU 31 Ca 0.27 0.01 -0.16 0.00 0.09 0.00 0.00 57.88 58.10 1f6n h LEU 31 Cb 0.43 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1f6n h LEU 31 CO -0.54 0.49 -0.51 -0.61 0.09 0.00 0.00 178.44 177.36 1f6n h GLN 32 N 0.86 0.59 -0.15 1.13 5.75 -0.29 -2.67 115.11 120.34 1f6n h GLN 32 Ca 0.30 -0.36 -0.12 0.00 -0.15 0.00 0.00 58.65 58.32 1f6n h GLN 32 Cb 0.07 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.64 1f6n h GLN 32 CO -0.13 0.96 -0.44 1.79 -2.65 0.00 0.00 178.83 178.36 1f6n h THR 33 N 0.46 1.32 -0.82 2.39 1.35 -0.87 -2.57 112.91 114.17 1f6n h THR 33 Ca 0.02 -1.62 0.09 0.00 -0.55 0.00 0.00 66.41 64.34 1f6n h THR 33 Cb 1.05 1.69 -0.06 0.00 -1.73 0.00 0.00 68.15 69.11 1f6n h THR 33 CO 0.10 0.49 0.54 -0.33 -0.25 0.00 0.00 175.52 176.07 1f6n h GLU 34 N 0.30 0.79 -0.86 4.72 4.39 -1.00 -2.03 114.58 120.90 1f6n h GLU 34 Ca 0.02 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 1f6n h GLU 34 Cb 0.90 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.37 1f6n h GLU 34 CO 0.08 0.52 0.02 0.09 -1.16 0.00 0.00 179.01 178.55 1f6n n ASN 35 N -4.51 2.82 -0.22 1.42 3.02 -0.97 -3.52 115.26 113.30 1f6n n ASN 35 Ca 0.13 -2.37 0.08 0.00 -0.03 0.00 0.00 54.58 52.39 1f6n n ASN 35 Cb 0.29 -0.57 0.13 0.00 -0.61 0.00 0.00 39.78 39.02 1f6n n ASN 35 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1f6n n MET 36 N 0.21 1.96 0.00 3.52 2.81 -0.76 -4.64 117.12 120.22 1f6n n MET 36 Ca 0.11 -2.39 0.14 0.00 -1.81 0.00 0.00 57.70 53.75 1f6n n MET 36 Cb 0.63 -1.45 0.53 0.00 -0.71 0.00 0.00 33.22 32.22 1f6n n MET 36 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1f6n n ARG 37 N -1.01 0.60 -4.24 0.03 1.74 -1.23 -4.51 116.66 108.04 1f6n n ARG 37 Ca 0.14 -0.25 -0.18 0.00 -0.77 0.00 0.00 57.85 56.78 1f6n n ARG 37 Cb 0.60 -1.49 -0.11 0.00 -1.02 0.00 0.00 32.46 30.43 1f6n n ARG 37 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1f6n s GLU 38 N -2.57 1.02 0.00 5.56 0.41 -1.26 -4.13 118.70 117.73 1f6n s GLU 38 Ca 0.25 -1.21 0.00 0.00 -0.41 0.00 0.00 54.97 53.60 1f6n s GLU 38 Cb 0.20 -0.94 0.00 0.00 -1.78 0.00 0.00 34.13 31.61 1f6n s GLU 38 CO 0.51 0.19 0.00 0.41 -0.49 0.00 0.00 175.26 175.87 1f6n n GLY 39 N 0.62 3.07 3.66 -1.39 0.00 -1.26 -4.98 105.19 104.91 1f6n n GLY 39 Ca -0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.59 1f6n n GLY 39 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1f6n s TYR 40 N -1.72 2.82 0.66 1.61 2.02 -1.26 -4.34 117.35 117.14 1f6n s TYR 40 Ca 0.00 -0.14 -0.14 0.00 -0.37 0.00 0.00 57.07 56.42 1f6n s TYR 40 Cb 0.00 -1.37 -0.00 0.00 -0.40 0.00 0.00 41.96 40.19 1f6n s TYR 40 CO 0.00 0.52 1.08 -2.14 -1.57 0.00 0.00 175.55 173.44 1f6n s PRO 41 N -2.94 2.90 0.59 -1.71 0.02 -1.26 -4.86 135.00 127.74 1f6n s PRO 41 Ca 0.27 1.22 -0.19 0.00 0.02 0.00 0.00 61.00 62.33 1f6n s PRO 41 Cb -0.09 -1.98 -0.06 0.00 0.02 0.00 0.00 34.50 32.40 1f6n s PRO 41 CO 0.18 -1.15 0.90 1.28 -0.33 0.00 0.00 177.00 177.89 1f6n n LEU 42 N -2.59 3.22 -4.37 -5.54 4.77 -1.26 -4.94 117.00 106.29 1f6n n LEU 42 Ca 0.09 0.80 -0.19 0.00 -0.03 0.00 0.00 56.01 56.69 1f6n n LEU 42 Cb 0.53 -1.35 -0.10 0.00 -2.33 0.00 0.00 43.42 40.16 1f6n n LEU 42 CO 0.50 -2.03 -0.33 -1.61 -1.33 0.00 0.00 177.39 172.59 1f6n s GLU 43 N -2.63 1.43 0.66 3.23 2.02 -1.26 -2.15 118.70 120.00 1f6n s GLU 43 Ca 0.74 -1.73 -0.07 0.00 0.02 0.00 0.00 54.97 53.93 1f6n s GLU 43 Cb -0.43 -0.77 0.04 0.00 0.10 0.00 0.00 34.13 33.07 1f6n s GLU 43 CO 0.48 -0.08 0.98 -0.80 0.02 0.00 0.00 175.26 175.87 1f6n s ASN 44 N -3.36 5.16 0.04 -0.19 0.01 0.32 -4.58 114.94 112.33 1f6n s ASN 44 Ca 0.30 0.62 0.05 0.00 -0.71 0.00 0.00 52.86 53.11 1f6n s ASN 44 Cb 0.06 -1.40 0.24 0.00 0.41 0.00 0.00 41.25 40.55 1f6n s ASN 44 CO 0.10 -1.38 1.16 -0.62 -1.51 0.00 0.00 177.10 174.85 1f6n n GLU 45 N -2.81 0.02 -0.16 -0.60 1.02 -1.26 -0.95 120.64 115.90 1f6n n GLU 45 Ca 0.07 0.47 0.09 0.00 -0.02 0.00 0.00 57.16 57.77 1f6n n GLU 45 Cb 0.59 -1.55 0.18 0.00 -0.02 0.00 0.00 31.44 30.64 1f6n n GLU 45 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1f6n n ASP 46 N -1.59 3.11 0.00 1.62 5.75 -1.26 -4.97 116.55 119.22 1f6n n ASP 46 Ca 0.01 -1.90 0.00 0.00 -0.01 0.00 0.00 54.79 52.88 1f6n n ASP 46 Cb 0.04 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 39.91 1f6n n ASP 46 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1f6n n GLY 47 N 1.15 2.02 3.78 6.12 0.00 -0.12 -5.04 105.19 113.10 1f6n n GLY 47 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 1f6n n GLY 47 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1f6n s THR 48 N -2.41 3.44 0.17 2.61 -4.23 -1.26 -4.73 115.64 109.23 1f6n s THR 48 Ca 0.00 0.62 -0.31 0.00 -1.18 0.00 0.00 61.69 60.81 1f6n s THR 48 Cb 0.00 -3.15 -0.10 0.00 1.34 0.00 0.00 72.50 70.59 1f6n s THR 48 CO 0.00 -0.46 1.57 -2.84 -0.54 0.00 0.00 174.62 172.35 1f6n s PRO 49 N -4.29 4.21 0.61 3.99 0.02 -1.26 -0.52 135.00 137.76 1f6n s PRO 49 Ca 0.65 2.37 -0.17 0.00 0.02 0.00 0.00 61.00 63.86 1f6n s PRO 49 Cb -0.18 -3.15 -0.02 0.00 0.02 0.00 0.00 34.50 31.16 1f6n s PRO 49 CO 0.44 -0.60 1.14 0.00 -0.33 0.00 0.00 177.00 177.65 1f6n s ALA 50 N 1.08 2.53 -0.02 -1.55 0.00 -0.91 -4.66 121.76 118.22 1f6n s ALA 50 Ca 0.70 0.76 -0.22 0.00 0.00 0.00 0.00 51.96 53.20 1f6n s ALA 50 Cb -0.44 -3.37 -0.14 0.00 0.00 0.00 0.00 23.12 19.17 1f6n s ALA 50 CO 0.32 -1.13 0.96 0.00 0.00 0.00 0.00 175.76 175.91 1f6n h ALA 51 N 0.57 -0.51 -2.47 0.00 0.00 -1.94 -3.43 119.26 111.47 1f6n h ALA 51 Ca -0.49 -0.18 -0.58 0.00 0.00 0.00 0.00 54.91 53.67 1f6n h ALA 51 Cb 1.27 0.20 -0.07 0.00 0.00 0.00 0.00 17.79 19.19 1f6n h ALA 51 CO 0.55 -0.55 0.29 1.21 0.00 0.00 0.00 179.25 180.75 1f6n s ASN 52 N -5.00 6.94 0.00 0.00 2.47 -1.26 -4.92 114.94 113.17 1f6n s ASN 52 Ca -0.12 1.15 0.10 0.00 0.42 0.00 0.00 52.86 54.41 1f6n s ASN 52 Cb 0.01 -2.44 0.05 0.00 -1.45 0.00 0.00 41.25 37.43 1f6n s ASN 52 CO 0.42 -0.32 0.76 0.00 -3.72 0.00 0.00 177.10 174.24 1f6n n GLN 53 N 4.86 1.04 0.00 0.43 1.13 -1.26 -4.95 117.38 118.62 1f6n n GLN 53 Ca 0.03 -0.93 0.00 0.00 -1.94 0.00 0.00 57.00 54.15 1f6n n GLN 53 Cb 0.49 -1.15 0.00 0.00 0.11 0.00 0.00 30.24 29.69 1f6n n GLN 53 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1f6n n GLY 54 N 0.69 -2.34 0.23 1.08 0.00 -1.26 -4.60 105.19 98.99 1f6n n GLY 54 Ca 0.05 -1.57 0.13 0.00 0.00 0.00 0.00 46.02 44.63 1f6n n GLY 54 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1f6n h PRO 55 N 0.00 0.00 -5.68 1.61 0.13 -2.05 -3.45 132.00 122.56 1f6n h PRO 55 Ca 0.00 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.54 1f6n h PRO 55 Cb 0.00 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.05 1f6n h PRO 55 CO 0.00 0.04 -0.25 -0.06 -0.23 0.00 0.00 178.00 177.50 1f6n s PHE 56 N -3.35 3.54 0.58 1.56 0.40 -1.26 -5.08 117.98 114.36 1f6n s PHE 56 Ca 0.05 0.77 -0.14 0.00 -0.60 0.00 0.00 56.93 57.01 1f6n s PHE 56 Cb 0.06 -2.38 -0.05 0.00 0.51 0.00 0.00 43.02 41.16 1f6n s PHE 56 CO 0.64 0.31 1.02 -1.25 0.70 0.00 0.00 175.22 176.64 1f6n s PRO 57 N 0.16 3.66 0.45 0.24 0.04 -1.26 -5.04 135.00 133.24 1f6n s PRO 57 Ca 0.21 0.90 -0.24 0.00 0.04 0.00 0.00 61.00 61.91 1f6n s PRO 57 Cb -0.14 -2.09 -0.07 0.00 0.04 0.00 0.00 34.50 32.23 1f6n s PRO 57 CO 0.08 -0.51 1.24 -0.51 0.04 0.00 0.00 177.00 177.33 1f6n s LEU 58 N -4.68 4.07 0.73 -3.56 1.43 -1.26 -4.83 118.68 110.58 1f6n s LEU 58 Ca 0.58 2.50 -0.11 0.00 -1.03 0.00 0.00 54.13 56.06 1f6n s LEU 58 Cb -0.11 -4.12 0.03 0.00 0.03 0.00 0.00 46.19 42.02 1f6n s LEU 58 CO 0.43 -0.98 1.08 -2.16 0.23 0.00 0.00 176.35 174.94 1f6n s PRO 59 N -2.54 2.62 0.03 1.29 0.04 -1.26 -5.01 135.00 130.16 1f6n s PRO 59 Ca 0.62 0.75 -0.30 0.00 0.04 0.00 0.00 61.00 62.11 1f6n s PRO 59 Cb -0.34 -1.97 -0.06 0.00 0.04 0.00 0.00 34.50 32.17 1f6n s PRO 59 CO 0.42 -1.28 1.45 0.15 0.04 0.00 0.00 177.00 177.78 1f6n s LYS 60 N -5.14 4.27 0.50 4.56 1.02 -1.26 -4.69 119.74 119.01 1f6n s LYS 60 Ca 0.59 2.05 -0.21 0.00 0.02 0.00 0.00 55.97 58.42 1f6n s LYS 60 Cb -0.14 -3.52 -0.08 0.00 -0.52 0.00 0.00 37.83 33.57 1f6n s LYS 60 CO 0.54 -0.58 0.92 -0.35 -0.92 0.00 0.00 175.35 174.96 1f6n n PRO 61 N 5.18 1.07 -4.40 -1.68 -0.04 -1.26 -4.82 135.00 129.05 1f6n n PRO 61 Ca 0.13 0.40 -0.28 0.00 -0.04 0.00 0.00 63.50 63.71 1f6n n PRO 61 Cb 0.43 -2.02 -0.12 0.00 -0.04 0.00 0.00 33.50 31.74 1f6n n PRO 61 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1f6n s LYS 62 N -2.25 1.47 -0.15 0.54 -2.85 -0.04 -4.94 119.74 111.52 1f6n s LYS 62 Ca 0.68 -1.42 0.01 0.00 -1.00 0.00 0.00 55.97 54.25 1f6n s LYS 62 Cb -0.50 -1.89 0.02 0.00 -2.06 0.00 0.00 37.83 33.40 1f6n s LYS 62 CO 0.53 0.43 -0.19 0.99 0.10 0.00 0.00 175.35 177.21 1f6n s THR 63 N -1.33 1.90 -0.15 3.79 2.01 -1.26 -1.73 115.64 118.87 1f6n s THR 63 Ca 0.17 -0.86 -0.21 0.00 0.31 0.00 0.00 61.69 61.10 1f6n s THR 63 Cb -0.09 -1.71 -0.03 0.00 0.01 0.00 0.00 72.50 70.67 1f6n s THR 63 CO 0.08 0.52 0.63 -0.36 -0.69 0.00 0.00 174.62 174.80 1f6n s PHE 64 N 1.15 3.45 -0.43 4.92 0.40 0.84 -4.93 117.98 123.37 1f6n s PHE 64 Ca -0.00 1.02 -0.25 0.00 -0.60 0.00 0.00 56.93 57.09 1f6n s PHE 64 Cb -0.14 -2.77 0.02 0.00 0.51 0.00 0.00 43.02 40.64 1f6n s PHE 64 CO -0.08 -0.06 0.92 0.42 0.70 0.00 0.00 175.22 177.13 1f6n s ILE 65 N 1.45 4.51 0.48 0.64 1.01 -1.26 -1.25 121.20 126.77 1f6n s ILE 65 Ca 0.31 0.88 -0.19 0.00 0.00 0.00 0.00 60.65 61.64 1f6n s ILE 65 Cb -0.16 -4.40 -0.09 0.00 0.01 0.00 0.00 42.46 37.82 1f6n s ILE 65 CO 0.12 -0.75 1.00 -0.76 0.00 0.00 0.00 174.94 174.55 1f6n s LEU 66 N 3.67 3.81 0.28 2.97 1.43 -0.61 -4.97 118.68 125.26 1f6n s LEU 66 Ca 0.37 1.76 0.10 0.00 -1.03 0.00 0.00 54.13 55.33 1f6n s LEU 66 Cb -0.11 -4.54 0.39 0.00 0.03 0.00 0.00 46.19 41.96 1f6n s LEU 66 CO 0.24 -0.61 1.63 -0.65 0.23 0.00 0.00 176.35 177.19 1f6n h PRO 67 N 1.48 0.03 -1.29 1.29 0.11 -1.96 -3.32 132.00 128.35 1f6n h PRO 67 Ca -0.49 -0.02 -0.58 0.00 0.11 0.00 0.00 66.00 65.02 1f6n h PRO 67 Cb 1.20 0.00 -0.42 0.00 0.11 0.00 0.00 31.00 31.89 1f6n h PRO 67 CO 0.60 0.61 -0.73 0.72 -0.21 0.00 0.00 178.00 178.99 1f6n n HIS 68 N -3.85 3.21 -1.15 0.65 8.25 -1.26 -4.88 115.22 116.18 1f6n n HIS 68 Ca -0.01 -2.84 -0.05 0.00 -0.26 0.00 0.00 57.72 54.55 1f6n n HIS 68 Cb 0.59 -0.18 -0.02 0.00 1.12 0.00 0.00 29.99 31.50 1f6n n HIS 68 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1f6n n GLY 69 N -0.55 0.59 0.00 -1.41 0.00 -1.25 -4.82 105.19 97.75 1f6n n GLY 69 Ca 0.41 -0.06 0.10 0.00 0.00 0.00 0.00 46.02 46.47 1f6n n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f6n n ARG 70 N -0.56 0.84 0.00 1.61 1.74 -1.26 -4.97 116.66 114.06 1f6n n ARG 70 Ca -0.05 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 1f6n n ARG 70 Cb 0.46 -1.37 0.00 0.00 -1.02 0.00 0.00 32.46 30.53 1f6n n ARG 70 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1f6n n GLY 71 N 0.59 0.61 3.15 -0.13 0.00 -1.26 -4.91 105.19 103.24 1f6n n GLY 71 Ca 0.15 -1.33 -0.12 0.00 0.00 0.00 0.00 46.02 44.71 1f6n n GLY 71 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1f6n s THR 72 N 0.00 0.03 -0.08 2.61 2.01 -1.26 -1.57 115.64 117.38 1f6n s THR 72 Ca 0.00 -0.26 0.02 0.00 0.31 0.00 0.00 61.69 61.76 1f6n s THR 72 Cb 0.00 -0.43 0.01 0.00 0.01 0.00 0.00 72.50 72.09 1f6n s THR 72 CO 0.00 -0.14 -0.14 -0.22 -0.69 0.00 0.00 174.62 173.43 1f6n s LEU 73 N -0.53 1.70 -0.18 4.42 2.96 -0.38 -4.95 118.68 121.71 1f6n s LEU 73 Ca -0.06 -0.35 0.01 0.00 -0.22 0.00 0.00 54.13 53.51 1f6n s LEU 73 Cb -0.04 -0.94 0.02 0.00 0.50 0.00 0.00 46.19 45.73 1f6n s LEU 73 CO 0.01 0.04 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.00 1f6n s THR 74 N 0.70 2.03 -0.02 3.68 2.01 -1.26 -0.11 115.64 122.67 1f6n s THR 74 Ca -0.13 -0.92 0.02 0.00 0.31 0.00 0.00 61.69 60.97 1f6n s THR 74 Cb -0.16 -1.83 0.00 0.00 0.01 0.00 0.00 72.50 70.52 1f6n s THR 74 CO 0.03 0.53 -0.07 0.68 -0.69 0.00 0.00 174.62 175.11 1f6n s VAL 75 N 1.30 0.58 0.57 3.82 -7.23 -0.70 -3.63 120.40 115.09 1f6n s VAL 75 Ca 0.05 -0.27 -0.18 0.00 -1.81 0.00 0.00 61.98 59.76 1f6n s VAL 75 Cb -0.13 -0.52 -0.05 0.00 0.56 0.00 0.00 36.38 36.25 1f6n s VAL 75 CO -0.13 0.18 1.11 -2.16 -0.31 0.00 0.00 175.10 173.79 1f6n s PRO 76 N 0.10 3.28 0.37 4.82 0.04 -1.26 -0.86 135.00 141.49 1f6n s PRO 76 Ca -0.01 1.51 -0.08 0.00 0.04 0.00 0.00 61.00 62.45 1f6n s PRO 76 Cb -0.06 -2.01 0.03 0.00 0.04 0.00 0.00 34.50 32.51 1f6n s PRO 76 CO -0.00 -0.89 0.64 0.41 0.04 0.00 0.00 177.00 177.20 1f6n n GLY 77 N -0.12 1.54 3.65 0.56 0.00 -1.24 -4.76 105.19 104.82 1f6n n GLY 77 Ca 0.11 -1.44 -0.44 0.00 0.00 0.00 0.00 46.02 44.25 1f6n n GLY 77 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1f6n n PRO 78 N -0.56 2.49 -3.21 1.61 -0.02 -1.26 -4.93 135.00 129.11 1f6n n PRO 78 Ca -0.04 0.88 -0.40 0.00 -2.02 0.00 0.00 63.50 61.92 1f6n n PRO 78 Cb 0.59 -2.94 -0.07 0.00 -0.02 0.00 0.00 33.50 31.06 1f6n n PRO 78 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1f6n s GLU 79 N 4.77 4.15 -0.18 -0.52 0.41 -1.26 -5.06 118.70 121.01 1f6n s GLU 79 Ca 0.93 0.43 -0.21 0.00 -0.41 0.00 0.00 54.97 55.71 1f6n s GLU 79 Cb -0.50 -3.60 0.05 0.00 -1.78 0.00 0.00 34.13 28.31 1f6n s GLU 79 CO 0.44 -0.24 0.56 -1.54 -0.49 0.00 0.00 175.26 173.98 1f6n s SER 80 N 1.30 -0.57 -0.27 -0.19 1.04 -1.26 -5.11 113.70 108.64 1f6n s SER 80 Ca 0.24 1.01 -0.29 0.00 0.48 0.00 0.00 55.95 57.39 1f6n s SER 80 Cb -0.16 1.02 -0.01 0.00 0.10 0.00 0.00 66.02 66.98 1f6n s SER 80 CO 0.09 -0.26 1.34 -1.61 0.98 0.00 0.00 173.24 173.78 1f6n s GLU 81 N 0.00 3.95 -0.61 4.02 0.41 -1.26 -4.93 118.70 120.29 1f6n s GLU 81 Ca -0.02 1.37 -0.04 0.00 -0.41 0.00 0.00 54.97 55.87 1f6n s GLU 81 Cb -0.04 -3.88 0.06 0.00 -1.78 0.00 0.00 34.13 28.50 1f6n s GLU 81 CO 0.02 -1.08 2.72 -0.25 -0.49 0.00 0.00 175.26 176.19 1f6n n ASP 82 N 7.57 6.74 -3.51 -0.19 10.43 -1.26 -4.80 116.55 131.53 1f6n n ASP 82 Ca 0.15 -3.18 -0.09 0.00 2.57 0.00 0.00 54.79 54.24 1f6n n ASP 82 Cb 0.46 -1.26 -0.03 0.00 1.84 0.00 0.00 41.12 42.13 1f6n n ASP 82 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1f6n s ARG 83 N -1.54 0.83 0.12 -1.24 1.70 -1.26 -4.93 118.95 112.62 1f6n s ARG 83 Ca 0.58 -0.22 -0.17 0.00 -0.47 0.00 0.00 55.73 55.45 1f6n s ARG 83 Cb 0.34 0.38 -0.07 0.00 -0.57 0.00 0.00 34.95 35.04 1f6n s ARG 83 CO -0.19 -0.34 0.57 -1.25 -1.08 0.00 0.00 175.30 173.00 1f6n s PRO 84 N -2.79 4.09 -0.35 3.89 0.05 -1.26 -5.07 135.00 133.57 1f6n s PRO 84 Ca 0.03 0.62 -0.10 0.00 0.05 0.00 0.00 61.00 61.60 1f6n s PRO 84 Cb -0.01 -3.05 0.01 0.00 0.05 0.00 0.00 34.50 31.50 1f6n s PRO 84 CO -0.07 0.54 0.18 0.42 0.05 0.00 0.00 177.00 178.12 1f6n s ILE 85 N -1.32 4.59 -1.34 0.56 -1.09 -1.26 -5.01 121.20 116.32 1f6n s ILE 85 Ca 0.35 -0.67 -0.12 0.00 -2.23 0.00 0.00 60.65 57.97 1f6n s ILE 85 Cb -0.17 -3.46 0.11 0.00 -1.58 0.00 0.00 42.46 37.36 1f6n s ILE 85 CO 0.19 -0.10 1.93 0.00 -1.23 0.00 0.00 174.94 175.73 1f6n n ALA 86 N 4.99 5.05 -2.97 9.38 0.00 -1.26 -4.91 120.51 130.80 1f6n n ALA 86 Ca -0.13 -4.11 -0.09 0.00 0.00 0.00 0.00 53.44 49.11 1f6n n ALA 86 Cb 0.47 -3.25 -0.11 0.00 0.00 0.00 0.00 19.45 16.56 1f6n n ALA 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1f6n s LEU 87 N 1.36 2.24 0.03 0.00 1.43 -1.26 -2.21 118.68 120.26 1f6n s LEU 87 Ca 0.44 -0.51 0.04 0.00 -1.03 0.00 0.00 54.13 53.08 1f6n s LEU 87 Cb 0.09 0.07 -0.02 0.00 0.03 0.00 0.00 46.19 46.36 1f6n s LEU 87 CO -0.02 -0.29 -0.13 0.00 0.23 0.00 0.00 176.35 176.14 1f6n s ALA 88 N -1.45 1.09 0.46 4.21 0.00 0.24 -4.89 121.76 121.42 1f6n s ALA 88 Ca -0.15 -0.74 -0.23 0.00 0.00 0.00 0.00 51.96 50.84 1f6n s ALA 88 Cb -0.10 -0.19 -0.09 0.00 0.00 0.00 0.00 23.12 22.75 1f6n s ALA 88 CO -0.01 0.21 1.09 0.54 0.00 0.00 0.00 175.76 177.60 1f6n n ARG 89 N 2.11 1.44 -0.20 0.00 1.74 -1.26 -1.48 116.66 119.00 1f6n n ARG 89 Ca -0.17 0.52 0.06 0.00 -0.77 0.00 0.00 57.85 57.49 1f6n n ARG 89 Cb 0.55 -2.19 0.16 0.00 -1.02 0.00 0.00 32.46 29.95 1f6n n ARG 89 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1f6n n THR 90 N -0.69 1.19 -3.57 0.55 -2.24 -1.20 -4.82 114.28 103.49 1f6n n THR 90 Ca 0.09 -1.14 -0.09 0.00 -2.27 0.00 0.00 64.05 60.65 1f6n n THR 90 Cb 0.41 0.39 -0.02 0.00 -2.10 0.00 0.00 70.33 69.01 1f6n n THR 90 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1f6n s ALA 91 N -1.28 -1.57 -2.12 6.98 0.00 -1.26 -5.04 121.76 117.47 1f6n s ALA 91 Ca 0.24 0.38 0.28 0.00 0.00 0.00 0.00 51.96 52.86 1f6n s ALA 91 Cb 0.14 0.76 1.06 0.00 0.00 0.00 0.00 23.12 25.09 1f6n s ALA 91 CO 0.13 -0.84 1.75 1.33 0.00 0.00 0.00 175.76 178.13 1f6n n VAL 92 N -0.38 0.00 -4.14 0.00 0.24 -1.26 -4.91 118.33 107.88 1f6n n VAL 92 Ca -0.11 -0.17 -0.09 0.00 -2.04 0.00 0.00 64.34 61.93 1f6n n VAL 92 Cb 0.63 0.30 -0.10 0.00 -1.47 0.00 0.00 33.84 33.20 1f6n n VAL 92 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1f6n s SER 93 N -2.21 0.92 0.31 -1.34 1.04 -1.26 -5.13 113.70 106.03 1f6n s SER 93 Ca 0.34 -1.00 -0.27 0.00 0.48 0.00 0.00 55.95 55.49 1f6n s SER 93 Cb 0.20 0.13 -0.14 0.00 0.10 0.00 0.00 66.02 66.32 1f6n s SER 93 CO 0.41 -0.51 0.91 -0.62 0.98 0.00 0.00 173.24 174.41 1f6n n GLU 94 N 0.01 1.14 0.00 4.02 1.02 -1.26 -4.17 120.64 121.40 1f6n n GLU 94 Ca -0.13 0.40 0.00 0.00 -0.02 0.00 0.00 57.16 57.42 1f6n n GLU 94 Cb 0.61 -1.75 0.00 0.00 -0.02 0.00 0.00 31.44 30.27 1f6n n GLU 94 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1f6n n GLY 95 N 1.35 0.89 3.77 0.62 0.00 -1.26 -5.09 105.19 105.46 1f6n n GLY 95 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 1f6n n GLY 95 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1f6n s PHE 96 N -2.00 2.94 0.55 1.61 0.40 -1.26 -5.09 117.98 115.12 1f6n s PHE 96 Ca 0.00 -0.18 -0.20 0.00 -0.60 0.00 0.00 56.93 55.95 1f6n s PHE 96 Cb 0.00 -1.39 -0.06 0.00 0.51 0.00 0.00 43.02 42.07 1f6n s PHE 96 CO 0.00 0.51 1.00 -2.30 0.70 0.00 0.00 175.22 175.12 1f6n n PRO 97 N -1.11 1.08 -3.86 0.24 -0.02 -1.26 -4.88 135.00 125.19 1f6n n PRO 97 Ca -0.06 0.41 -0.36 0.00 -2.02 0.00 0.00 63.50 61.46 1f6n n PRO 97 Cb 0.59 -2.16 -0.13 0.00 -0.02 0.00 0.00 33.50 31.77 1f6n n PRO 97 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1f6n s HIS 98 N -1.45 3.27 0.41 6.00 3.76 -1.26 -3.26 115.29 122.76 1f6n s HIS 98 Ca 0.72 -1.75 -0.26 0.00 -0.15 0.00 0.00 55.06 53.62 1f6n s HIS 98 Cb -0.45 -2.19 -0.08 0.00 1.11 0.00 0.00 32.58 30.96 1f6n s HIS 98 CO 0.50 -0.79 1.25 0.00 -0.85 0.00 0.00 174.74 174.85 1f6n s ALA 99 N 1.29 3.20 0.22 -1.40 0.00 -0.55 -4.73 121.76 119.79 1f6n s ALA 99 Ca -0.04 1.13 -0.32 0.00 0.00 0.00 0.00 51.96 52.73 1f6n s ALA 99 Cb -0.20 -3.45 -0.13 0.00 0.00 0.00 0.00 23.12 19.35 1f6n s ALA 99 CO 0.00 -0.72 1.63 -2.30 0.00 0.00 0.00 175.76 174.37 1f6n n PRO 100 N 0.07 2.54 0.00 0.00 -0.02 -1.26 -0.59 135.00 135.73 1f6n n PRO 100 Ca 0.04 0.91 0.13 0.00 -2.02 0.00 0.00 63.50 62.56 1f6n n PRO 100 Cb 0.45 -2.71 0.31 0.00 -0.02 0.00 0.00 33.50 31.52 1f6n n PRO 100 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1f6n n THR 101 N 3.27 0.00 0.00 3.45 -2.24 -0.94 -4.86 114.28 112.96 1f6n n THR 101 Ca 0.14 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1f6n n THR 101 Cb 0.33 0.73 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 1f6n n THR 101 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f6n n GLY 102 N 1.31 4.98 3.47 3.38 0.00 -1.26 -5.07 105.19 112.01 1f6n n GLY 102 Ca 0.14 -0.70 -0.43 0.00 0.00 0.00 0.00 46.02 45.03 1f6n n GLY 102 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1f6n s ASP 103 N 1.04 6.13 0.46 1.61 2.15 -1.26 -4.97 116.67 121.82 1f6n s ASP 103 Ca 0.00 -0.78 0.12 0.00 0.43 0.00 0.00 52.55 52.32 1f6n s ASP 103 Cb 0.00 -2.18 1.05 0.00 -0.30 0.00 0.00 42.92 41.50 1f6n s ASP 103 CO 0.00 -0.46 2.07 1.55 -0.17 0.00 0.00 175.17 178.16 1f6n h PRO 104 N 8.64 0.31 0.64 4.34 0.13 -1.94 0.23 132.00 144.35 1f6n h PRO 104 Ca -0.27 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 64.81 1f6n h PRO 104 Cb 1.12 -0.07 0.01 0.00 0.13 0.00 0.00 31.00 32.19 1f6n h PRO 104 CO 0.74 0.20 -0.31 0.52 -0.23 0.00 0.00 178.00 178.92 1f6n h MET 105 N 0.32 -0.83 -0.39 0.86 2.86 -1.93 -0.71 114.93 115.11 1f6n h MET 105 Ca 0.12 0.06 -0.12 0.00 -2.06 0.00 0.00 59.70 57.70 1f6n h MET 105 Cb 0.11 0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 1f6n h MET 105 CO -0.03 -0.53 -0.25 0.87 1.06 0.00 0.00 176.91 178.04 1f6n h LYS 106 N -0.94 0.79 0.00 1.72 1.57 -1.81 -3.11 116.57 114.79 1f6n h LYS 106 Ca -0.09 -0.33 -0.09 0.00 -1.87 0.00 0.00 60.65 58.27 1f6n h LYS 106 Cb 0.69 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.96 1f6n h LYS 106 CO 0.14 0.96 -0.43 -0.44 -0.57 0.00 0.00 179.45 179.11 1f6n h ASP 107 N 0.68 0.00 -2.99 0.86 3.32 -0.60 -3.48 116.42 114.21 1f6n h ASP 107 Ca 0.09 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.11 1f6n h ASP 107 Cb 0.77 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.34 1f6n h ASP 107 CO 0.06 0.43 -0.08 0.61 -1.72 0.00 0.00 179.24 178.54 1f6n n GLY 108 N 0.68 0.62 3.32 2.75 0.00 -0.34 -4.83 105.19 107.40 1f6n n GLY 108 Ca 0.01 -0.26 -0.20 0.00 0.00 0.00 0.00 46.02 45.57 1f6n n GLY 108 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1f6n s VAL 109 N -3.04 1.71 0.00 1.61 -7.23 -0.81 -4.05 120.40 108.60 1f6n s VAL 109 Ca 0.03 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.20 1f6n s VAL 109 Cb -0.00 -1.87 0.00 0.00 0.56 0.00 0.00 36.38 35.06 1f6n s VAL 109 CO 0.07 -0.44 0.00 0.61 -0.31 0.00 0.00 175.10 175.03 1f6n n GLY 110 N 0.07 2.06 0.33 2.32 0.00 -1.26 -1.51 105.19 107.19 1f6n n GLY 110 Ca -0.11 -0.44 0.20 0.00 0.00 0.00 0.00 46.02 45.67 1f6n n GLY 110 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1f6n h PRO 111 N 0.00 0.00 -0.45 1.61 0.11 -1.94 -2.38 132.00 128.95 1f6n h PRO 111 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1f6n h PRO 111 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1f6n h PRO 111 CO 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.79 1f6n n ALA 112 N -2.14 2.43 -1.73 -0.75 0.00 -0.57 -2.53 120.51 115.22 1f6n n ALA 112 Ca -0.03 -0.85 -0.39 0.00 0.00 0.00 0.00 53.44 52.18 1f6n n ALA 112 Cb 0.12 -0.97 0.04 0.00 0.00 0.00 0.00 19.45 18.64 1f6n n ALA 112 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1f6n n SER 113 N 0.94 2.43 -4.23 0.00 7.64 -0.90 -3.99 113.62 115.50 1f6n n SER 113 Ca 0.17 0.96 -0.16 0.00 1.01 0.00 0.00 58.87 60.85 1f6n n SER 113 Cb 0.43 -1.55 -0.11 0.00 -1.01 0.00 0.00 64.21 61.97 1f6n n SER 113 CO 0.00 0.00 0.00 -1.66 -3.01 0.00 0.00 175.04 170.37 1f6n s TRP 114 N -1.31 1.27 0.07 1.43 1.48 -1.26 -4.44 118.94 116.18 1f6n s TRP 114 Ca 0.72 -0.66 0.02 0.00 -1.06 0.00 0.00 56.10 55.13 1f6n s TRP 114 Cb -0.42 -0.66 -0.04 0.00 -1.16 0.00 0.00 33.47 31.19 1f6n s TRP 114 CO 0.49 0.09 0.09 0.14 -4.06 0.00 0.00 176.95 173.70 1f6n s VAL 115 N -2.70 4.64 -1.04 -0.66 -7.23 -1.26 -5.02 120.40 107.13 1f6n s VAL 115 Ca 0.11 -0.69 -0.21 0.00 -1.81 0.00 0.00 61.98 59.39 1f6n s VAL 115 Cb -0.01 -3.22 -0.09 0.00 0.56 0.00 0.00 36.38 33.61 1f6n s VAL 115 CO 0.01 0.15 1.94 0.00 -0.31 0.00 0.00 175.10 176.90 1f6n n ALA 116 N 0.52 3.11 -1.25 1.32 0.00 -1.26 -4.81 120.51 118.14 1f6n n ALA 116 Ca -0.09 -3.34 -0.30 0.00 0.00 0.00 0.00 53.44 49.72 1f6n n ALA 116 Cb 0.52 -3.57 0.21 0.00 0.00 0.00 0.00 19.45 16.60 1f6n n ALA 116 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1f6n s ARG 117 N 5.18 -0.38 0.42 0.00 0.52 -1.26 -4.95 118.95 118.47 1f6n s ARG 117 Ca 0.59 0.06 -0.26 0.00 -0.52 0.00 0.00 55.73 55.61 1f6n s ARG 117 Cb 0.08 -1.68 -0.09 0.00 0.52 0.00 0.00 34.95 33.78 1f6n s ARG 117 CO 0.10 -3.18 1.37 1.03 0.02 0.00 0.00 175.30 174.64 1f6n s ARG 118 N -5.34 3.89 -0.44 3.54 0.52 -1.26 -4.24 118.95 115.61 1f6n s ARG 118 Ca 0.69 2.30 -0.03 0.00 -0.52 0.00 0.00 55.73 58.18 1f6n s ARG 118 Cb -0.12 -2.75 0.15 0.00 0.52 0.00 0.00 34.95 32.75 1f6n s ARG 118 CO 0.56 -0.61 2.44 -3.47 0.02 0.00 0.00 175.30 174.23 1f6n n ASP 119 N 0.07 6.61 -4.42 0.23 4.64 -1.26 -0.98 116.55 121.43 1f6n n ASP 119 Ca 0.04 -3.23 -0.22 0.00 -1.38 0.00 0.00 54.79 50.00 1f6n n ASP 119 Cb 0.42 -1.15 -0.10 0.00 -1.04 0.00 0.00 41.12 39.25 1f6n n ASP 119 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 1f6n s LEU 120 N -2.26 2.58 0.63 -2.67 2.01 -1.26 -4.93 118.68 112.78 1f6n s LEU 120 Ca 0.50 -1.03 -0.11 0.00 0.01 0.00 0.00 54.13 53.50 1f6n s LEU 120 Cb 0.35 -0.94 -0.03 0.00 0.01 0.00 0.00 46.19 45.58 1f6n s LEU 120 CO -0.14 -0.04 1.04 -2.16 1.01 0.00 0.00 176.35 176.05 1f6n s PRO 121 N -3.56 3.45 0.19 1.29 0.04 -1.26 -0.77 135.00 134.39 1f6n s PRO 121 Ca 0.27 0.82 -0.30 0.00 0.04 0.00 0.00 61.00 61.83 1f6n s PRO 121 Cb -0.03 -2.06 -0.08 0.00 0.04 0.00 0.00 34.50 32.36 1f6n s PRO 121 CO 0.12 -0.69 1.18 -2.00 0.04 0.00 0.00 177.00 175.66 1f6n s GLU 122 N -5.06 4.51 0.04 4.56 2.12 -1.26 -4.88 118.70 118.73 1f6n s GLU 122 Ca 0.56 1.86 0.03 0.00 0.36 0.00 0.00 54.97 57.78 1f6n s GLU 122 Cb -0.12 -3.24 -0.04 0.00 0.26 0.00 0.00 34.13 31.00 1f6n s GLU 122 CO 0.53 -0.05 -0.01 -0.51 -0.54 0.00 0.00 175.26 174.67 1f6n s LEU 123 N -0.38 3.44 0.00 2.70 1.43 -1.26 -1.31 118.68 123.30 1f6n s LEU 123 Ca 0.52 -0.10 -0.03 0.00 -1.03 0.00 0.00 54.13 53.49 1f6n s LEU 123 Cb -0.32 -2.05 0.05 0.00 0.03 0.00 0.00 46.19 43.89 1f6n s LEU 123 CO 0.37 0.24 0.20 -0.90 0.23 0.00 0.00 176.35 176.49 1f6n n ASP 124 N 1.09 -0.91 0.03 2.29 5.68 0.18 -4.81 116.55 120.11 1f6n n ASP 124 Ca -0.13 -0.72 0.02 0.00 -0.50 0.00 0.00 54.79 53.45 1f6n n ASP 124 Cb 0.52 -0.17 0.35 0.00 -1.14 0.00 0.00 41.12 40.68 1f6n n ASP 124 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1f6n h GLY 125 N -0.75 0.48 0.25 6.12 0.00 -2.00 -2.29 103.07 104.88 1f6n h GLY 125 Ca -0.07 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.00 1f6n h GLY 125 CO 0.05 0.24 -0.14 1.42 0.00 0.00 0.00 176.54 178.11 1f6n n HIS 126 N -4.33 0.00 -0.03 5.60 8.25 -1.26 -4.92 115.22 118.53 1f6n n HIS 126 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1f6n n HIS 126 Cb 0.20 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.21 1f6n n HIS 126 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1f6n n GLY 127 N 1.27 0.73 3.87 -1.41 0.00 -0.86 -5.09 105.19 103.70 1f6n n GLY 127 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 1f6n n GLY 127 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1f6n s HIS 128 N -2.04 3.47 -0.25 1.61 3.76 -1.26 -4.76 115.29 115.82 1f6n s HIS 128 Ca 0.00 0.85 -0.42 0.00 -0.15 0.00 0.00 55.06 55.34 1f6n s HIS 128 Cb 0.00 -2.23 -0.18 0.00 1.11 0.00 0.00 32.58 31.28 1f6n s HIS 128 CO 0.00 0.34 1.54 0.09 -0.85 0.00 0.00 174.74 175.85 1f6n n ASN 129 N 0.11 1.55 -0.16 1.40 4.13 -1.26 -0.65 115.26 120.38 1f6n n ASN 129 Ca -0.01 1.13 -0.04 0.00 1.68 0.00 0.00 54.58 57.34 1f6n n ASN 129 Cb 0.52 -1.03 0.15 0.00 -1.54 0.00 0.00 39.78 37.88 1f6n n ASN 129 CO 0.00 0.00 0.00 0.50 0.28 0.00 0.00 177.26 178.04 1f6n h LYS 130 N 5.48 0.90 -4.71 3.52 3.64 -1.51 -3.42 116.57 120.47 1f6n h LYS 130 Ca -0.47 -0.20 -0.68 0.00 -1.27 0.00 0.00 60.65 58.04 1f6n h LYS 130 Cb 1.35 -0.13 -0.36 0.00 -0.41 0.00 0.00 32.23 32.69 1f6n h LYS 130 CO 0.89 0.82 -0.70 0.42 -2.27 0.00 0.00 179.45 178.61 1f6n s ILE 131 N -5.20 2.67 0.10 2.00 1.01 -1.26 -1.39 121.20 119.14 1f6n s ILE 131 Ca -0.10 -1.84 0.03 0.00 0.00 0.00 0.00 60.65 58.74 1f6n s ILE 131 Cb 0.15 -2.72 -0.04 0.00 0.01 0.00 0.00 42.46 39.86 1f6n s ILE 131 CO 0.81 -0.34 0.12 -0.54 0.00 0.00 0.00 174.94 175.00 1f6n s LYS 132 N 1.10 2.99 0.60 2.79 -0.14 -0.80 -4.53 119.74 121.75 1f6n s LYS 132 Ca 0.01 -0.70 -0.19 0.00 -1.36 0.00 0.00 55.97 53.73 1f6n s LYS 132 Cb -0.20 -2.76 -0.03 0.00 -1.68 0.00 0.00 37.83 33.16 1f6n s LYS 132 CO -0.04 0.55 1.27 -1.25 -0.76 0.00 0.00 175.35 175.12 1f6n s PRO 133 N -2.64 2.87 0.25 -1.68 0.04 -1.26 0.11 135.00 132.69 1f6n s PRO 133 Ca 0.31 2.01 0.01 0.00 0.04 0.00 0.00 61.00 63.37 1f6n s PRO 133 Cb -0.12 -1.98 0.32 0.00 0.04 0.00 0.00 34.50 32.76 1f6n s PRO 133 CO 0.24 -1.33 1.65 1.98 0.04 0.00 0.00 177.00 179.57 1f6n h MET 134 N 0.92 0.46 -0.77 4.56 4.05 -1.63 -2.65 114.93 119.88 1f6n h MET 134 Ca -0.51 -0.22 0.14 0.00 -0.28 0.00 0.00 59.70 58.84 1f6n h MET 134 Cb 1.31 -0.00 -0.09 0.00 -0.80 0.00 0.00 31.60 32.01 1f6n h MET 134 CO 0.55 0.77 0.32 1.57 0.23 0.00 0.00 176.91 180.35 1f6n h LYS 135 N 0.39 0.45 -0.04 0.39 2.10 -1.92 0.23 116.57 118.17 1f6n h LYS 135 Ca 0.04 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.66 1f6n h LYS 135 Cb 0.83 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 32.06 1f6n h LYS 135 CO 0.07 0.30 0.00 0.00 -2.00 0.00 0.00 179.45 177.82 1f6n n ALA 136 N -2.50 2.58 -3.83 0.07 0.00 -1.01 -4.67 120.51 111.16 1f6n n ALA 136 Ca 0.15 -0.19 -0.34 0.00 0.00 0.00 0.00 53.44 53.06 1f6n n ALA 136 Cb 0.42 -1.23 -0.14 0.00 0.00 0.00 0.00 19.45 18.50 1f6n n ALA 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1f6n s ALA 137 N -1.95 2.81 -0.18 0.00 0.00 0.80 -4.98 121.76 118.25 1f6n s ALA 137 Ca 0.26 -1.98 -0.26 0.00 0.00 0.00 0.00 51.96 49.98 1f6n s ALA 137 Cb 0.12 -1.92 -0.01 0.00 0.00 0.00 0.00 23.12 21.32 1f6n s ALA 137 CO 0.20 -1.39 0.86 0.00 0.00 0.00 0.00 175.76 175.43 1f6n s ALA 138 N 1.15 3.55 0.00 0.00 0.00 -1.26 -3.09 121.76 122.10 1f6n s ALA 138 Ca -0.02 0.04 0.00 0.00 0.00 0.00 0.00 51.96 51.98 1f6n s ALA 138 Cb -0.20 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.64 1f6n s ALA 138 CO -0.04 -0.73 0.00 0.41 0.00 0.00 0.00 175.76 175.40 1f6n n GLY 139 N 3.48 2.73 3.64 0.00 0.00 -1.26 -5.07 105.19 108.70 1f6n n GLY 139 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1f6n n GLY 139 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1f6n s PHE 140 N -2.44 3.26 0.07 1.61 0.08 -1.18 -5.03 117.98 114.35 1f6n s PHE 140 Ca 0.00 1.09 0.04 0.00 0.12 0.00 0.00 56.93 58.18 1f6n s PHE 140 Cb 0.00 -3.21 -0.03 0.00 -0.57 0.00 0.00 43.02 39.21 1f6n s PHE 140 CO 0.00 -0.51 -0.12 -3.38 -0.10 0.00 0.00 175.22 171.11 1f6n s HIS 141 N 3.02 1.10 0.19 0.36 -3.43 -1.26 -4.94 115.29 110.32 1f6n s HIS 141 Ca 0.37 -0.50 -0.33 0.00 -0.80 0.00 0.00 55.06 53.79 1f6n s HIS 141 Cb -0.14 -0.62 -0.14 0.00 -1.43 0.00 0.00 32.58 30.25 1f6n s HIS 141 CO 0.10 0.03 1.44 0.28 -2.00 0.00 0.00 174.74 174.58 1f6n n VAL 142 N 1.16 0.49 -0.05 -5.38 0.31 -1.26 -4.91 118.33 108.69 1f6n n VAL 142 Ca -0.20 -0.12 -0.09 0.00 -0.01 0.00 0.00 64.34 63.91 1f6n n VAL 142 Cb 0.55 -1.36 -0.04 0.00 -0.91 0.00 0.00 33.84 32.08 1f6n n VAL 142 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1f6n n SER 143 N 2.64 1.55 -4.06 4.52 2.88 -1.26 -5.07 113.62 114.82 1f6n n SER 143 Ca 0.15 0.06 -0.09 0.00 -1.33 0.00 0.00 58.87 57.66 1f6n n SER 143 Cb 0.28 -0.24 -0.09 0.00 -0.75 0.00 0.00 64.21 63.41 1f6n n SER 143 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1f6n s ALA 144 N -2.18 0.47 0.10 -1.46 0.00 -1.26 -5.12 121.76 112.31 1f6n s ALA 144 Ca -0.13 -1.19 0.00 0.00 0.00 0.00 0.00 51.96 50.63 1f6n s ALA 144 Cb 0.05 0.77 0.00 0.00 0.00 0.00 0.00 23.12 23.94 1f6n s ALA 144 CO 0.19 -0.53 0.00 0.41 0.00 0.00 0.00 175.76 175.83 1f6n n GLY 145 N -0.11 -2.05 3.70 0.00 0.00 -1.26 -4.79 105.19 100.68 1f6n n GLY 145 Ca -0.08 -1.42 -0.42 0.00 0.00 0.00 0.00 46.02 44.11 1f6n n GLY 145 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1f6n s LYS 146 N -2.21 4.24 -0.23 1.61 2.47 -1.26 -4.98 119.74 119.39 1f6n s LYS 146 Ca 0.00 2.20 -0.29 0.00 -1.56 0.00 0.00 55.97 56.31 1f6n s LYS 146 Cb 0.00 -3.47 -0.01 0.00 -1.46 0.00 0.00 37.83 32.88 1f6n s LYS 146 CO 0.00 -0.63 1.41 1.21 0.16 0.00 0.00 175.35 177.51 1f6n s ASN 147 N 1.88 6.65 0.37 1.43 3.84 -1.26 -4.94 114.94 122.90 1f6n s ASN 147 Ca 0.69 1.52 0.24 0.00 0.21 0.00 0.00 52.86 55.52 1f6n s ASN 147 Cb -0.38 -2.54 0.40 0.00 -0.55 0.00 0.00 41.25 38.19 1f6n s ASN 147 CO 0.30 -1.05 1.58 1.55 -2.79 0.00 0.00 177.10 176.70 1f6n h PRO 148 N 9.49 0.00 -6.21 0.43 0.13 -1.97 -3.46 132.00 130.42 1f6n h PRO 148 Ca -0.29 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.28 1f6n h PRO 148 Cb 1.12 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.26 1f6n h PRO 148 CO 1.00 0.00 1.34 0.42 -0.23 0.00 0.00 178.00 180.53 1f6n s ILE 149 N -3.20 3.01 0.00 -3.56 1.01 -1.26 -0.85 121.20 116.35 1f6n s ILE 149 Ca 0.07 0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.74 1f6n s ILE 149 Cb 0.07 -3.01 0.00 0.00 0.01 0.00 0.00 42.46 39.53 1f6n s ILE 149 CO 0.67 -0.00 0.00 0.61 0.00 0.00 0.00 174.94 176.21 1f6n n GLY 150 N 5.03 2.22 3.76 6.18 0.00 0.13 -5.01 105.19 117.50 1f6n n GLY 150 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 1f6n n GLY 150 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1f6n s LEU 151 N 0.00 4.41 0.64 0.99 1.02 -0.03 -4.69 118.68 121.02 1f6n s LEU 151 Ca 0.00 2.69 -0.15 0.00 0.02 0.00 0.00 54.13 56.68 1f6n s LEU 151 Cb 0.00 -3.64 -0.01 0.00 0.02 0.00 0.00 46.19 42.56 1f6n s LEU 151 CO 0.00 -0.60 1.11 -2.16 0.02 0.00 0.00 176.35 174.72 1f6n s PRO 152 N -1.33 2.89 -0.13 1.29 0.04 -1.26 -1.04 135.00 135.45 1f6n s PRO 152 Ca 0.52 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.95 1f6n s PRO 152 Cb -0.40 -1.96 -0.01 0.00 0.04 0.00 0.00 34.50 32.16 1f6n s PRO 152 CO 0.50 -1.18 -0.14 0.08 0.04 0.00 0.00 177.00 176.30 1f6n s VAL 153 N -2.31 2.97 0.11 -0.36 1.01 -0.71 -1.58 120.40 119.53 1f6n s VAL 153 Ca 0.67 -0.69 0.07 0.00 0.00 0.00 0.00 61.98 62.02 1f6n s VAL 153 Cb -0.20 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.90 1f6n s VAL 153 CO 0.40 0.53 -0.07 -0.60 0.00 0.00 0.00 175.10 175.36 1f6n s ARG 154 N 0.33 2.24 0.44 2.72 3.52 -0.69 -0.04 118.95 127.47 1f6n s ARG 154 Ca -0.11 -0.99 0.05 0.00 -0.13 0.00 0.00 55.73 54.55 1f6n s ARG 154 Cb -0.16 -2.36 0.08 0.00 -1.56 0.00 0.00 34.95 30.95 1f6n s ARG 154 CO 0.06 0.51 0.61 0.41 -0.81 0.00 0.00 175.30 176.08 1f6n n GLY 155 N 0.60 1.66 0.14 8.12 0.00 -0.37 -1.40 105.19 113.95 1f6n n GLY 155 Ca -0.12 -2.16 -0.05 0.00 0.00 0.00 0.00 46.02 43.69 1f6n n GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f6n s ASP 157 N -6.88 7.11 -0.13 0.00 -4.77 -1.11 -2.62 116.67 108.28 1f6n s ASP 157 Ca -0.02 2.18 -0.01 0.00 -3.30 0.00 0.00 52.55 51.39 1f6n s ASP 157 Cb 0.11 -2.61 0.04 0.00 -1.09 0.00 0.00 42.92 39.37 1f6n s ASP 157 CO 0.80 -0.25 2.23 0.18 0.70 0.00 0.00 175.17 178.83 1f6n n LEU 158 N 0.78 5.76 -4.87 2.11 4.77 -1.26 -4.57 117.00 119.72 1f6n n LEU 158 Ca 0.01 -2.88 -0.26 0.00 -0.03 0.00 0.00 56.01 52.85 1f6n n LEU 158 Cb 0.46 -1.15 -0.04 0.00 -2.33 0.00 0.00 43.42 40.37 1f6n n LEU 158 CO 0.51 1.20 -0.16 -1.61 -1.33 0.00 0.00 177.39 176.00 1f6n s GLU 159 N -0.57 3.16 0.06 3.23 0.41 -1.26 -4.88 118.70 118.84 1f6n s GLU 159 Ca 0.21 -0.74 -0.25 0.00 -0.41 0.00 0.00 54.97 53.78 1f6n s GLU 159 Cb 0.14 -2.80 -0.06 0.00 -1.78 0.00 0.00 34.13 29.63 1f6n s GLU 159 CO -0.01 0.50 0.77 0.42 -0.49 0.00 0.00 175.26 176.45 1f6n s ILE 160 N -1.74 4.69 -0.14 -1.63 1.01 -1.26 -1.23 121.20 120.88 1f6n s ILE 160 Ca 0.33 1.64 0.06 0.00 0.00 0.00 0.00 60.65 62.68 1f6n s ILE 160 Cb -0.11 -4.12 -0.13 0.00 0.01 0.00 0.00 42.46 38.12 1f6n s ILE 160 CO 0.26 0.38 -0.06 0.00 0.00 0.00 0.00 174.94 175.52 1f6n n ALA 161 N 2.67 1.67 -2.95 9.38 0.00 0.94 -4.94 120.51 127.27 1f6n n ALA 161 Ca -0.03 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.66 1f6n n ALA 161 Cb 0.50 0.06 0.00 0.00 0.00 0.00 0.00 19.45 20.01 1f6n n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1f6n n GLY 162 N 2.50 2.44 3.45 0.00 0.00 -1.20 -4.24 105.19 108.13 1f6n n GLY 162 Ca -0.25 -0.35 -0.17 0.00 0.00 0.00 0.00 46.02 45.25 1f6n n GLY 162 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1f6n s LYS 163 N 2.25 0.98 -0.05 1.61 -2.85 -0.65 -1.75 119.74 119.28 1f6n s LYS 163 Ca 0.00 0.11 -0.28 0.00 -1.00 0.00 0.00 55.97 54.80 1f6n s LYS 163 Cb 0.00 0.46 -0.03 0.00 -2.06 0.00 0.00 37.83 36.20 1f6n s LYS 163 CO 0.00 -0.31 0.91 0.08 0.10 0.00 0.00 175.35 176.14 1f6n s VAL 164 N -1.36 4.89 -0.01 1.79 1.01 -0.21 -0.59 120.40 125.92 1f6n s VAL 164 Ca -0.11 1.89 0.00 0.00 0.00 0.00 0.00 61.98 63.77 1f6n s VAL 164 Cb -0.01 -4.25 -0.00 0.00 0.00 0.00 0.00 36.38 32.12 1f6n s VAL 164 CO 0.07 0.14 0.01 1.33 0.00 0.00 0.00 175.10 176.66 1f6n n VAL 165 N 4.06 0.00 -3.67 2.92 0.24 -0.38 -0.70 118.33 120.80 1f6n n VAL 165 Ca 0.05 -0.46 -0.05 0.00 -2.04 0.00 0.00 64.34 61.84 1f6n n VAL 165 Cb 0.50 0.96 -0.02 0.00 -1.47 0.00 0.00 33.84 33.82 1f6n n VAL 165 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1f6n s ASP 166 N -1.10 -0.23 -0.19 -1.34 3.68 -1.20 -4.93 116.67 111.37 1f6n s ASP 166 Ca 0.00 -0.27 -0.01 0.00 2.13 0.00 0.00 52.55 54.40 1f6n s ASP 166 Cb 0.00 0.44 0.00 0.00 -1.45 0.00 0.00 42.92 41.92 1f6n s ASP 166 CO 0.01 -0.79 -0.12 -0.63 0.13 0.00 0.00 175.17 173.77 1f6n s ILE 167 N -3.20 2.77 -0.14 4.11 1.01 -1.26 -1.50 121.20 123.00 1f6n s ILE 167 Ca 0.10 -0.71 -0.23 0.00 0.00 0.00 0.00 60.65 59.82 1f6n s ILE 167 Cb -0.01 -2.21 -0.03 0.00 0.01 0.00 0.00 42.46 40.22 1f6n s ILE 167 CO -0.01 0.49 0.70 0.26 0.00 0.00 0.00 174.94 176.37 1f6n s TRP 168 N 1.20 3.47 0.07 3.97 0.52 -0.41 -1.53 118.94 126.23 1f6n s TRP 168 Ca 0.02 1.13 0.07 0.00 0.02 0.00 0.00 56.10 57.33 1f6n s TRP 168 Cb -0.14 -2.84 -0.04 0.00 -1.15 0.00 0.00 33.47 29.30 1f6n s TRP 168 CO -0.05 -0.07 -0.13 0.14 0.02 0.00 0.00 176.95 176.86 1f6n s VAL 169 N 1.47 3.19 -0.29 4.03 -7.23 0.12 -1.70 120.40 119.98 1f6n s VAL 169 Ca 0.34 -1.19 -0.27 0.00 -1.81 0.00 0.00 61.98 59.06 1f6n s VAL 169 Cb -0.17 -2.43 0.01 0.00 0.56 0.00 0.00 36.38 34.35 1f6n s VAL 169 CO 0.14 0.23 0.97 -0.62 -0.31 0.00 0.00 175.10 175.50 1f6n s ASP 170 N -1.84 6.88 -0.02 4.85 2.15 0.23 -1.91 116.67 127.01 1f6n s ASP 170 Ca 0.18 1.01 -0.25 0.00 0.43 0.00 0.00 52.55 53.92 1f6n s ASP 170 Cb -0.11 -2.50 -0.20 0.00 -0.30 0.00 0.00 42.92 39.82 1f6n s ASP 170 CO 0.10 -0.73 1.23 0.40 -0.17 0.00 0.00 175.17 175.99 1f6n h ILE 171 N 5.61 1.42 0.00 4.11 5.03 -1.52 0.90 117.51 133.06 1f6n h ILE 171 Ca -0.21 -1.32 -0.10 0.00 -0.12 0.00 0.00 64.86 63.11 1f6n h ILE 171 Cb 1.07 2.26 -0.01 0.00 -3.03 0.00 0.00 36.82 37.10 1f6n h ILE 171 CO 0.97 0.35 -0.46 1.55 -0.68 0.00 0.00 178.15 179.88 1f6n h PRO 172 N -0.45 0.00 0.00 2.37 0.13 -1.94 -2.00 132.00 130.11 1f6n h PRO 172 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1f6n h PRO 172 Cb 0.59 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.72 1f6n h PRO 172 CO 0.01 0.46 -0.51 0.93 -0.23 0.00 0.00 178.00 178.66 1f6n h GLU 173 N 0.00 0.00 -6.24 0.86 5.08 -1.94 -3.48 114.58 108.86 1f6n h GLU 173 Ca -0.00 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.05 1f6n h GLU 173 Cb 1.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1f6n h GLU 173 CO 0.06 0.00 -0.75 1.04 -1.00 0.00 0.00 179.01 178.36 1f6n n GLN 174 N -2.23 -1.57 -3.67 2.33 6.02 0.22 -5.01 117.38 113.47 1f6n n GLN 174 Ca 0.03 1.12 -0.11 0.00 -0.01 0.00 0.00 57.00 58.04 1f6n n GLN 174 Cb 0.45 -3.48 -0.08 0.00 1.02 0.00 0.00 30.24 28.15 1f6n n GLN 174 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 1f6n s MET 175 N -3.98 0.64 -0.43 -1.09 1.75 -0.65 -4.96 119.30 110.58 1f6n s MET 175 Ca 0.05 0.94 -0.29 0.00 -1.25 0.00 0.00 55.69 55.15 1f6n s MET 175 Cb -0.01 0.21 0.02 0.00 2.84 0.00 0.00 34.83 37.89 1f6n s MET 175 CO 0.84 -0.12 1.29 0.00 -0.65 0.00 0.00 175.02 176.39 1f6n s ALA 176 N 0.93 3.11 -0.16 4.11 0.00 -1.26 0.75 121.76 129.24 1f6n s ALA 176 Ca -0.05 -0.27 0.06 0.00 0.00 0.00 0.00 51.96 51.70 1f6n s ALA 176 Cb -0.05 -3.91 -0.23 0.00 0.00 0.00 0.00 23.12 18.93 1f6n s ALA 176 CO -0.08 -2.30 0.20 0.54 0.00 0.00 0.00 175.76 174.12 1f6n n ARG 177 N 7.93 0.68 -4.19 0.00 1.74 -0.69 -4.66 116.66 117.47 1f6n n ARG 177 Ca 0.15 0.17 -0.11 0.00 -0.77 0.00 0.00 57.85 57.28 1f6n n ARG 177 Cb 0.48 -1.63 -0.10 0.00 -1.02 0.00 0.00 32.46 30.19 1f6n n ARG 177 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1f6n s PHE 178 N -2.54 0.98 -0.20 -1.55 0.08 -1.03 -1.15 117.98 112.58 1f6n s PHE 178 Ca -0.19 -0.88 -0.04 0.00 0.12 0.00 0.00 56.93 55.95 1f6n s PHE 178 Cb 0.07 -0.55 -0.02 0.00 -0.57 0.00 0.00 43.02 41.96 1f6n s PHE 178 CO 0.75 -0.10 -0.04 -0.51 -0.10 0.00 0.00 175.22 175.22 1f6n s LEU 179 N -3.07 3.00 -0.10 -0.37 1.43 0.01 -1.29 118.68 118.28 1f6n s LEU 179 Ca 0.13 -0.31 -0.30 0.00 -1.03 0.00 0.00 54.13 52.63 1f6n s LEU 179 Cb 0.05 -1.75 -0.01 0.00 0.03 0.00 0.00 46.19 44.51 1f6n s LEU 179 CO -0.03 0.05 1.02 -0.70 0.23 0.00 0.00 176.35 176.91 1f6n s GLU 180 N 1.08 4.42 -0.08 1.70 2.12 -0.56 -1.82 118.70 125.57 1f6n s GLU 180 Ca 0.01 1.41 0.03 0.00 0.36 0.00 0.00 54.97 56.78 1f6n s GLU 180 Cb -0.15 -3.54 0.01 0.00 0.26 0.00 0.00 34.13 30.71 1f6n s GLU 180 CO 0.00 -0.31 -0.18 0.08 -0.54 0.00 0.00 175.26 174.31 1f6n s VAL 181 N 1.98 1.60 -0.18 3.70 1.01 0.13 -1.25 120.40 127.39 1f6n s VAL 181 Ca 0.49 -0.75 -0.17 0.00 0.00 0.00 0.00 61.98 61.55 1f6n s VAL 181 Cb -0.19 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 1f6n s VAL 181 CO 0.18 0.46 0.43 -0.70 0.00 0.00 0.00 175.10 175.47 1f6n s GLU 182 N 0.50 4.22 0.63 2.72 2.12 0.24 0.07 118.70 129.19 1f6n s GLU 182 Ca -0.17 0.28 0.02 0.00 0.36 0.00 0.00 54.97 55.46 1f6n s GLU 182 Cb -0.17 -3.51 0.09 0.00 0.26 0.00 0.00 34.13 30.80 1f6n s GLU 182 CO 0.06 0.00 0.87 -0.51 -0.54 0.00 0.00 175.26 175.15 1f6n s LEU 183 N 1.16 3.12 0.60 2.70 1.43 0.68 -1.64 118.68 126.72 1f6n s LEU 183 Ca 0.21 -0.36 0.34 0.00 -1.03 0.00 0.00 54.13 53.29 1f6n s LEU 183 Cb -0.15 -2.19 1.91 0.00 0.03 0.00 0.00 46.19 45.79 1f6n s LEU 183 CO 0.08 -1.51 2.24 0.07 0.23 0.00 0.00 176.35 177.46 1f6n h LYS 184 N -0.17 0.00 -0.89 1.70 5.09 -1.87 0.30 116.57 120.73 1f6n h LYS 184 Ca -0.37 0.00 0.13 0.00 0.09 0.00 0.00 60.65 60.50 1f6n h LYS 184 Cb 1.28 0.00 -0.07 0.00 0.10 0.00 0.00 32.23 33.54 1f6n h LYS 184 CO 0.44 0.03 0.57 -0.44 -2.09 0.00 0.00 179.45 177.96 1f6n h ASP 185 N 0.00 0.71 0.00 7.07 3.45 -1.95 -3.45 116.42 122.25 1f6n h ASP 185 Ca -0.00 0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.49 1f6n h ASP 185 Cb 0.11 -0.11 0.00 0.00 -0.56 0.00 0.00 39.33 38.78 1f6n h ASP 185 CO 0.00 0.38 0.00 0.61 -1.57 0.00 0.00 179.24 178.67 1f6n n GLY 186 N -1.42 0.77 3.83 2.75 0.00 0.11 -5.07 105.19 106.16 1f6n n GLY 186 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1f6n n GLY 186 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1f6n s SER 187 N -2.84 6.79 0.27 1.61 1.04 -1.26 -4.81 113.70 114.50 1f6n s SER 187 Ca 0.00 1.63 0.06 0.00 0.48 0.00 0.00 55.95 58.12 1f6n s SER 187 Cb 0.00 -2.52 -0.03 0.00 0.10 0.00 0.00 66.02 63.57 1f6n s SER 187 CO 0.00 -0.46 0.32 0.42 0.98 0.00 0.00 173.24 174.49 1f6n s THR 188 N -2.38 4.67 0.09 2.02 -4.23 -1.26 -0.23 115.64 114.32 1f6n s THR 188 Ca 0.61 -1.16 0.02 0.00 -1.18 0.00 0.00 61.69 59.98 1f6n s THR 188 Cb -0.09 -3.59 -0.04 0.00 1.34 0.00 0.00 72.50 70.12 1f6n s THR 188 CO 0.21 -0.30 -0.07 -0.13 -0.54 0.00 0.00 174.62 173.79 1f6n s ARG 189 N -3.97 0.81 -0.18 3.99 1.81 0.11 -4.90 118.95 116.63 1f6n s ARG 189 Ca 0.36 -1.25 -0.12 0.00 -1.72 0.00 0.00 55.73 53.00 1f6n s ARG 189 Cb -0.08 -0.28 -0.05 0.00 -0.45 0.00 0.00 34.95 34.09 1f6n s ARG 189 CO 0.28 0.01 0.21 -0.51 -0.68 0.00 0.00 175.30 174.60 1f6n s LEU 190 N -2.80 4.23 -0.10 2.53 1.43 -1.26 0.22 118.68 122.93 1f6n s LEU 190 Ca 0.09 0.38 0.01 0.00 -1.03 0.00 0.00 54.13 53.57 1f6n s LEU 190 Cb 0.02 -2.23 -0.02 0.00 0.03 0.00 0.00 46.19 44.00 1f6n s LEU 190 CO -0.03 0.15 -0.13 -0.76 0.23 0.00 0.00 176.35 175.81 1f6n s LEU 191 N 0.34 2.78 0.28 1.79 1.43 -0.75 -4.97 118.68 119.58 1f6n s LEU 191 Ca 0.12 -0.25 -0.29 0.00 -1.03 0.00 0.00 54.13 52.68 1f6n s LEU 191 Cb -0.12 -1.61 -0.10 0.00 0.03 0.00 0.00 46.19 44.40 1f6n s LEU 191 CO 0.01 0.24 1.24 -2.16 0.23 0.00 0.00 176.35 175.91 1f6n s PRO 192 N -0.09 4.46 0.36 1.29 0.04 -1.26 -0.81 135.00 138.98 1f6n s PRO 192 Ca -0.02 2.04 0.07 0.00 0.04 0.00 0.00 61.00 63.14 1f6n s PRO 192 Cb -0.14 -3.14 0.76 0.00 0.04 0.00 0.00 34.50 32.02 1f6n s PRO 192 CO 0.04 -0.07 1.92 0.52 0.04 0.00 0.00 177.00 179.44 1f6n h MET 193 N 3.97 0.73 0.00 4.56 2.86 -1.40 -2.50 114.93 123.14 1f6n h MET 193 Ca -0.47 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.12 1f6n h MET 193 Cb 1.22 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.71 1f6n h MET 193 CO 0.68 0.48 0.00 1.04 1.06 0.00 0.00 176.91 180.18 1f6n n GLN 194 N -4.51 0.61 -0.15 1.72 3.00 -1.26 -2.27 117.38 114.52 1f6n n GLN 194 Ca 0.14 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.16 1f6n n GLN 194 Cb 0.32 -1.41 0.05 0.00 0.00 0.00 0.00 30.24 29.21 1f6n n GLN 194 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 1f6n n MET 195 N -0.91 1.15 -4.23 -1.09 2.81 -0.94 -5.04 117.12 108.87 1f6n n MET 195 Ca 0.12 -1.65 -0.17 0.00 -1.81 0.00 0.00 57.70 54.19 1f6n n MET 195 Cb 0.06 -1.00 -0.13 0.00 -0.71 0.00 0.00 33.22 31.43 1f6n n MET 195 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1f6n s VAL 196 N -1.34 0.71 -0.42 2.03 -7.23 -0.96 -4.49 120.40 108.70 1f6n s VAL 196 Ca 0.12 -0.70 -0.17 0.00 -1.81 0.00 0.00 61.98 59.43 1f6n s VAL 196 Cb 0.11 -0.66 0.02 0.00 0.56 0.00 0.00 36.38 36.41 1f6n s VAL 196 CO 0.01 -0.03 0.39 -0.54 -0.31 0.00 0.00 175.10 174.63 1f6n s LYS 197 N -0.81 3.07 -0.88 4.82 -0.14 -0.64 -4.97 119.74 120.19 1f6n s LYS 197 Ca -0.01 -0.83 -0.25 0.00 -1.36 0.00 0.00 55.97 53.52 1f6n s LYS 197 Cb -0.06 -3.97 -0.00 0.00 -1.68 0.00 0.00 37.83 32.12 1f6n s LYS 197 CO 0.00 -0.81 1.69 0.08 -0.76 0.00 0.00 175.35 175.55 1f6n s VAL 198 N 1.99 3.62 0.38 3.17 1.01 -1.26 -1.16 120.40 128.16 1f6n s VAL 198 Ca 0.10 -0.31 -0.06 0.00 0.00 0.00 0.00 61.98 61.70 1f6n s VAL 198 Cb -0.18 -4.46 0.09 0.00 0.00 0.00 0.00 36.38 31.83 1f6n s VAL 198 CO 0.12 -1.38 0.52 0.00 0.00 0.00 0.00 175.10 174.36 1f6n n GLN 199 N 8.98 -0.51 0.04 2.72 6.02 -0.39 -5.00 117.38 129.25 1f6n n GLN 199 Ca 0.30 -0.80 -0.20 0.00 -0.01 0.00 0.00 57.00 56.29 1f6n n GLN 199 Cb 0.49 -0.53 -0.10 0.00 1.02 0.00 0.00 30.24 31.12 1f6n n GLN 199 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1f6n h SER 200 N -0.68 0.90 -0.01 1.08 4.64 -2.02 -3.37 113.55 114.09 1f6n h SER 200 Ca -0.17 -0.74 0.00 0.00 -0.47 0.00 0.00 61.79 60.41 1f6n h SER 200 Cb 0.46 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1f6n h SER 200 CO 0.12 1.52 -0.08 -0.46 -0.87 0.00 0.00 176.83 177.07 1f6n n ASN 201 N -3.87 1.77 -3.64 4.97 0.23 -1.26 -5.04 115.26 108.42 1f6n n ASN 201 Ca -0.11 -1.38 -0.04 0.00 -0.53 0.00 0.00 54.58 52.52 1f6n n ASN 201 Cb 0.87 0.15 -0.01 0.00 -2.08 0.00 0.00 39.78 38.71 1f6n n ASN 201 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1f6n s ARG 202 N -1.15 0.84 -0.19 -3.83 1.70 -1.26 -4.60 118.95 110.47 1f6n s ARG 202 Ca 0.12 -0.42 -0.06 0.00 -0.47 0.00 0.00 55.73 54.91 1f6n s ARG 202 Cb 0.10 0.32 -0.03 0.00 -0.57 0.00 0.00 34.95 34.76 1f6n s ARG 202 CO 0.19 -0.38 0.03 0.08 -1.08 0.00 0.00 175.30 174.14 1f6n s VAL 203 N -2.99 4.39 -0.09 4.99 1.01 -0.61 -1.26 120.40 125.85 1f6n s VAL 203 Ca 0.10 -0.17 -0.04 0.00 0.00 0.00 0.00 61.98 61.87 1f6n s VAL 203 Cb -0.00 -2.98 -0.04 0.00 0.00 0.00 0.00 36.38 33.36 1f6n s VAL 203 CO -0.03 0.45 0.07 -2.28 0.00 0.00 0.00 175.10 173.31 1f6n s HIS 204 N 0.61 3.37 -0.29 5.22 2.46 -0.31 -1.71 115.29 124.65 1f6n s HIS 204 Ca 0.01 0.34 0.01 0.00 0.47 0.00 0.00 55.06 55.89 1f6n s HIS 204 Cb -0.14 -1.85 0.09 0.00 -0.13 0.00 0.00 32.58 30.55 1f6n s HIS 204 CO 0.02 0.60 0.04 0.08 -2.47 0.00 0.00 174.74 173.01 1f6n s VAL 205 N -1.00 1.42 0.09 0.89 1.01 -0.49 -1.62 120.40 120.70 1f6n s VAL 205 Ca 0.16 -1.56 -0.15 0.00 0.00 0.00 0.00 61.98 60.42 1f6n s VAL 205 Cb -0.12 -1.95 -0.10 0.00 0.00 0.00 0.00 36.38 34.22 1f6n s VAL 205 CO 0.05 -0.47 1.40 -1.13 0.00 0.00 0.00 175.10 174.95 1f6n h ASN 206 N 7.93 0.71 -0.84 3.32 -0.00 -1.85 -2.57 115.58 122.28 1f6n h ASN 206 Ca -0.12 -0.49 0.03 0.00 -0.00 0.00 0.00 56.30 55.72 1f6n h ASN 206 Cb 1.04 -0.20 -0.05 0.00 -0.00 0.00 0.00 38.32 39.11 1f6n h ASN 206 CO 0.46 1.06 0.56 0.00 -0.00 0.00 0.00 177.43 179.50 1f6n h ALA 207 N 0.68 1.46 -4.25 1.57 0.00 -1.87 -3.38 119.26 113.46 1f6n h ALA 207 Ca 0.04 -0.05 -0.69 0.00 0.00 0.00 0.00 54.91 54.21 1f6n h ALA 207 Cb 0.87 -0.31 -0.26 0.00 0.00 0.00 0.00 17.79 18.09 1f6n h ALA 207 CO 0.07 0.47 -0.82 -0.51 0.00 0.00 0.00 179.25 178.46 1f6n s LEU 208 N -9.94 2.44 0.59 0.00 1.43 -1.25 -3.61 118.68 108.35 1f6n s LEU 208 Ca -0.11 -0.34 -0.08 0.00 -1.03 0.00 0.00 54.13 52.56 1f6n s LEU 208 Cb 0.18 -1.46 -0.01 0.00 0.03 0.00 0.00 46.19 44.93 1f6n s LEU 208 CO 0.79 0.32 0.94 -0.94 0.23 0.00 0.00 176.35 177.70 1f6n s SER 209 N -0.79 5.89 0.18 2.29 1.04 -1.26 -0.31 113.70 120.73 1f6n s SER 209 Ca 0.11 1.03 -0.15 0.00 0.48 0.00 0.00 55.95 57.42 1f6n s SER 209 Cb -0.10 -2.08 0.16 0.00 0.10 0.00 0.00 66.02 64.10 1f6n s SER 209 CO 0.01 -0.95 1.68 0.77 0.98 0.00 0.00 173.24 175.73 1f6n h SER 210 N -0.21 -0.23 0.18 7.02 4.64 -1.84 -1.86 113.55 121.24 1f6n h SER 210 Ca -0.45 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 1f6n h SER 210 Cb 1.23 0.21 0.00 0.00 -0.31 0.00 0.00 62.40 63.53 1f6n h SER 210 CO 0.62 -0.08 0.00 -0.90 -0.87 0.00 0.00 176.83 175.60 1f6n n ASP 211 N -5.24 0.00 -0.47 4.97 5.75 -1.26 -1.34 116.55 118.96 1f6n n ASP 211 Ca 0.05 0.40 0.11 0.00 -0.01 0.00 0.00 54.79 55.33 1f6n n ASP 211 Cb 0.25 -0.43 0.01 0.00 -1.03 0.00 0.00 41.12 39.92 1f6n n ASP 211 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1f6n n LEU 212 N -1.43 1.96 -0.18 -2.12 4.77 -0.70 -4.38 117.00 114.92 1f6n n LEU 212 Ca 0.02 -0.73 -0.07 0.00 -0.03 0.00 0.00 56.01 55.20 1f6n n LEU 212 Cb 0.07 -0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.23 1f6n n LEU 212 CO 0.05 0.37 0.87 -0.26 -1.33 0.00 0.00 177.39 177.09 1f6n h PHE 213 N 2.32 1.06 -0.70 -1.77 -1.00 -1.30 -2.62 116.94 112.93 1f6n h PHE 213 Ca 0.00 -0.16 0.05 0.00 2.81 0.00 0.00 57.97 60.67 1f6n h PHE 213 Cb 0.74 -0.29 -0.04 0.00 3.61 0.00 0.00 35.95 39.97 1f6n h PHE 213 CO 0.00 0.93 0.46 0.00 -1.61 0.00 0.00 178.31 178.09 1f6n h ALA 214 N 1.12 1.66 0.00 2.45 0.00 -1.77 -2.58 119.26 120.13 1f6n h ALA 214 Ca 0.17 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1f6n h ALA 214 Cb 0.48 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1f6n h ALA 214 CO 0.02 0.24 0.00 0.78 0.00 0.00 0.00 179.25 180.30 1f6n h GLY 215 N 0.78 0.00 -5.33 0.00 0.00 -1.73 -3.45 103.07 93.34 1f6n h GLY 215 Ca 0.29 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.96 1f6n h GLY 215 CO -0.09 0.00 0.54 1.39 0.00 0.00 0.00 176.54 178.38 1f6n n ILE 216 N -2.57 0.00 -1.71 2.60 5.41 -0.97 -4.90 119.36 117.22 1f6n n ILE 216 Ca 0.02 -0.00 -0.43 0.00 1.00 0.00 0.00 62.75 63.34 1f6n n ILE 216 Cb 0.31 -1.00 -0.02 0.00 -0.71 0.00 0.00 39.64 38.22 1f6n n ILE 216 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1f6n n PRO 217 N 2.74 2.40 -3.93 0.38 -0.02 -1.26 -5.00 135.00 130.32 1f6n n PRO 217 Ca 0.18 0.85 -0.30 0.00 -2.02 0.00 0.00 63.50 62.22 1f6n n PRO 217 Cb 0.21 -2.59 -0.04 0.00 -0.02 0.00 0.00 33.50 31.07 1f6n n PRO 217 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1f6n s THR 218 N 0.05 5.36 0.37 3.45 -4.23 -1.26 -4.77 115.64 114.60 1f6n s THR 218 Ca 0.67 -0.47 -0.11 0.00 -1.18 0.00 0.00 61.69 60.60 1f6n s THR 218 Cb -0.57 -3.65 -0.07 0.00 1.34 0.00 0.00 72.50 69.56 1f6n s THR 218 CO 0.48 0.09 0.73 0.27 -0.54 0.00 0.00 174.62 175.65 1f6n s ILE 219 N -1.56 4.79 -0.36 2.99 -4.36 -1.26 -4.99 121.20 116.45 1f6n s ILE 219 Ca 0.35 0.64 0.15 0.00 -0.26 0.00 0.00 60.65 61.52 1f6n s ILE 219 Cb -0.13 -3.70 0.80 0.00 1.25 0.00 0.00 42.46 40.69 1f6n s ILE 219 CO 0.28 -0.40 1.73 2.29 0.24 0.00 0.00 174.94 179.08 1f6n n LYS 220 N -0.98 4.70 -3.15 0.37 2.85 -1.26 -4.79 118.16 115.89 1f6n n LYS 220 Ca 0.02 -3.13 0.05 0.00 -1.05 0.00 0.00 58.31 54.20 1f6n n LYS 220 Cb 0.54 -2.21 -0.01 0.00 -0.65 0.00 0.00 35.03 32.69 1f6n n LYS 220 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1f6n s SER 221 N -0.85 -0.72 0.00 -5.58 0.15 -1.26 -5.05 113.70 100.38 1f6n s SER 221 Ca 0.54 0.46 0.17 0.00 0.70 0.00 0.00 55.95 57.81 1f6n s SER 221 Cb 0.40 1.61 1.01 0.00 -1.71 0.00 0.00 66.02 67.34 1f6n s SER 221 CO 0.17 -0.14 1.42 -0.81 1.20 0.00 0.00 173.24 175.08 1f6n n PRO 222 N 5.46 0.54 -0.03 5.44 -0.04 -1.26 -2.21 135.00 142.90 1f6n n PRO 222 Ca -0.05 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.27 1f6n n PRO 222 Cb 0.53 -1.49 -0.14 0.00 -0.04 0.00 0.00 33.50 32.36 1f6n n PRO 222 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1f6n n THR 223 N -0.99 1.63 -4.19 0.52 -2.24 -1.26 -4.92 114.28 102.83 1f6n n THR 223 Ca 0.13 -0.75 -0.13 0.00 -2.27 0.00 0.00 64.05 61.03 1f6n n THR 223 Cb 0.06 -1.22 -0.10 0.00 -2.10 0.00 0.00 70.33 66.97 1f6n n THR 223 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1f6n s GLU 224 N -2.57 0.90 -0.03 -0.78 -1.05 -0.94 -4.18 118.70 110.05 1f6n s GLU 224 Ca -0.13 -1.30 0.05 0.00 -0.15 0.00 0.00 54.97 53.45 1f6n s GLU 224 Cb 0.07 -0.45 -0.02 0.00 -0.44 0.00 0.00 34.13 33.29 1f6n s GLU 224 CO 0.79 0.05 -0.18 0.08 0.95 0.00 0.00 175.26 176.95 1f6n s VAL 225 N -3.07 2.71 0.32 1.83 1.01 -1.26 -4.55 120.40 117.38 1f6n s VAL 225 Ca 0.11 -0.90 -0.01 0.00 0.00 0.00 0.00 61.98 61.18 1f6n s VAL 225 Cb 0.01 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.32 1f6n s VAL 225 CO -0.01 0.56 0.53 0.42 0.00 0.00 0.00 175.10 176.59 1f6n s THR 226 N -0.72 5.10 0.39 3.92 -4.23 -1.26 -4.02 115.64 114.82 1f6n s THR 226 Ca 0.11 -0.34 0.09 0.00 -1.18 0.00 0.00 61.69 60.38 1f6n s THR 226 Cb -0.10 -3.82 0.30 0.00 1.34 0.00 0.00 72.50 70.22 1f6n s THR 226 CO 0.01 -0.46 1.98 -0.07 -0.54 0.00 0.00 174.62 175.54 1f6n h LEU 227 N 1.12 0.53 -1.37 4.79 3.38 -0.96 0.22 115.31 123.02 1f6n h LEU 227 Ca -0.49 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.43 1f6n h LEU 227 Cb 1.21 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1f6n h LEU 227 CO 0.63 0.34 -0.17 0.25 0.09 0.00 0.00 178.44 179.59 1f6n h LEU 228 N 0.61 0.20 0.11 1.67 5.85 -1.23 -3.03 115.31 119.48 1f6n h LEU 228 Ca 0.28 -0.04 -0.32 0.00 0.84 0.00 0.00 57.88 58.63 1f6n h LEU 228 Cb 0.32 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 1f6n h LEU 228 CO -0.09 0.39 -1.66 -0.33 -0.34 0.00 0.00 178.44 176.41 1f6n h GLU 229 N 0.20 0.23 -0.87 1.25 5.08 -0.98 -2.88 114.58 116.61 1f6n h GLU 229 Ca 0.04 -0.40 0.02 0.00 -1.00 0.00 0.00 59.36 58.02 1f6n h GLU 229 Cb 0.42 0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.77 1f6n h GLU 229 CO 0.03 1.07 0.57 0.93 -1.00 0.00 0.00 179.01 180.61 1f6n h GLU 230 N 0.06 1.11 -0.71 2.33 5.08 -0.99 -1.66 114.58 119.80 1f6n h GLU 230 Ca -0.29 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 57.93 1f6n h GLU 230 Cb 2.03 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 31.00 1f6n h GLU 230 CO 0.14 0.73 0.17 -0.44 -1.00 0.00 0.00 179.01 178.61 1f6n h ASP 231 N 1.14 1.08 0.30 1.42 5.19 -1.54 0.35 116.42 124.36 1f6n h ASP 231 Ca 0.34 -0.23 -0.13 0.00 -0.62 0.00 0.00 57.03 56.39 1f6n h ASP 231 Cb -0.06 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.15 1f6n h ASP 231 CO -0.10 1.03 -0.52 0.11 -3.12 0.00 0.00 179.24 176.65 1f6n h LYS 232 N 1.08 0.24 0.05 3.56 1.57 -1.26 0.22 116.57 122.02 1f6n h LYS 232 Ca 0.22 -0.14 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1f6n h LYS 232 Cb 0.38 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1f6n h LYS 232 CO 0.00 0.70 -0.02 0.82 -0.57 0.00 0.00 179.45 180.38 1f6n h ILE 233 N 0.19 1.05 -0.76 1.86 2.04 -0.83 -1.50 117.51 119.56 1f6n h ILE 233 Ca 0.01 -1.62 -0.01 0.00 1.00 0.00 0.00 64.86 64.24 1f6n h ILE 233 Cb 0.98 1.92 -0.04 0.00 -0.74 0.00 0.00 36.82 38.94 1f6n h ILE 233 CO 0.08 0.33 0.45 0.00 0.00 0.00 0.00 178.15 179.01 1f6n h GLY 235 N 1.05 -0.91 -0.17 0.00 0.00 -1.05 -1.55 103.07 100.44 1f6n h GLY 235 Ca 0.27 0.44 0.06 0.00 0.00 0.00 0.00 47.33 48.11 1f6n h GLY 235 CO -0.05 -0.31 -0.40 -1.82 0.00 0.00 0.00 176.54 173.96 1f6n h TYR 236 N -0.79 -1.14 -0.21 5.60 3.20 -1.06 -0.61 116.97 121.95 1f6n h TYR 236 Ca -0.03 0.06 -0.16 0.00 3.14 0.00 0.00 58.73 61.74 1f6n h TYR 236 Cb 0.71 0.55 -0.01 0.00 1.54 0.00 0.00 36.73 39.52 1f6n h TYR 236 CO -0.21 -0.43 -0.52 -0.24 -1.64 0.00 0.00 178.16 175.11 1f6n h VAL 237 N -0.35 1.31 -0.75 1.81 3.04 -1.35 -3.13 116.25 116.83 1f6n h VAL 237 Ca 0.13 -1.75 -0.05 0.00 -1.01 0.00 0.00 66.70 64.02 1f6n h VAL 237 Cb 0.58 1.71 -0.03 0.00 -2.01 0.00 0.00 31.29 31.54 1f6n h VAL 237 CO -0.51 0.55 0.28 0.00 -1.01 0.00 0.00 177.57 176.88 1f6n h ALA 238 N 0.94 0.97 0.00 3.17 0.00 -1.09 -2.12 119.26 121.13 1f6n h ALA 238 Ca 0.02 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1f6n h ALA 238 Cb 1.07 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1f6n h ALA 238 CO 0.10 0.61 0.00 0.41 0.00 0.00 0.00 179.25 180.37 1f6n n GLY 239 N -0.84 -0.63 0.07 0.00 0.00 -0.25 -2.08 105.19 101.46 1f6n n GLY 239 Ca 0.06 0.02 -0.06 0.00 0.00 0.00 0.00 46.02 46.04 1f6n n GLY 239 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1f6n h GLY 240 N 0.40 0.00 -0.06 -0.02 0.00 -1.37 -2.25 103.07 99.77 1f6n h GLY 240 Ca 0.00 -0.00 0.26 0.00 0.00 0.00 0.00 47.33 47.59 1f6n h GLY 240 CO 0.00 0.00 0.68 1.41 0.00 0.00 0.00 176.54 178.63 1f6n h LEU 241 N 0.00 0.37 0.00 3.11 3.38 -1.48 0.13 115.31 120.81 1f6n h LEU 241 Ca -0.01 0.06 -0.18 0.00 0.09 0.00 0.00 57.88 57.84 1f6n h LEU 241 Cb 1.64 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.37 1f6n h LEU 241 CO 0.12 0.09 -1.06 -0.03 0.09 0.00 0.00 178.44 177.65 1f6n h MET 242 N 0.33 0.00 0.00 1.13 4.05 -1.73 -3.42 114.93 115.29 1f6n h MET 242 Ca 0.56 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.98 1f6n h MET 242 Cb 1.54 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.34 1f6n h MET 242 CO -0.22 0.83 -0.62 1.88 0.23 0.00 0.00 176.91 179.00 1f6n h TYR 243 N -1.00 0.00 -0.52 1.39 0.05 -1.08 -3.24 116.97 112.57 1f6n h TYR 243 Ca -0.27 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.51 1f6n h TYR 243 Cb 1.15 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.89 1f6n h TYR 243 CO 0.06 0.00 0.00 0.00 -1.05 0.00 0.00 178.16 177.17 1f6n n ALA 244 N -2.02 3.63 0.29 3.88 0.00 0.41 -4.56 120.51 122.14 1f6n n ALA 244 Ca 0.02 -1.66 0.12 0.00 0.00 0.00 0.00 53.44 51.92 1f6n n ALA 244 Cb 0.50 -1.10 0.12 0.00 0.00 0.00 0.00 19.45 18.97 1f6n n ALA 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1f6n h ALA 245 N 3.83 0.69 0.00 0.00 0.00 -1.71 -2.14 119.26 119.93 1f6n h ALA 245 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1f6n h ALA 245 Cb 1.75 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.54 1f6n h ALA 245 CO 0.41 0.00 0.00 -2.30 0.00 0.00 0.00 179.25 177.36 1f6n n PRO 246 N -2.61 0.12 -0.00 0.00 -0.02 -1.26 -3.15 135.00 128.07 1f6n n PRO 246 Ca 0.02 0.56 0.04 0.00 -2.02 0.00 0.00 63.50 62.11 1f6n n PRO 246 Cb 0.51 -1.86 -0.05 0.00 -0.02 0.00 0.00 33.50 32.08 1f6n n PRO 246 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1f6n n LYS 247 N -2.11 3.93 -2.11 -0.52 5.02 -0.85 -4.99 118.16 116.54 1f6n n LYS 247 Ca -0.00 -0.01 -0.42 0.00 -2.02 0.00 0.00 58.31 55.86 1f6n n LYS 247 Cb 0.07 -0.92 -0.03 0.00 -0.02 0.00 0.00 35.03 34.13 1f6n n LYS 247 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1f6n s ARG 248 N -1.85 4.31 0.00 1.97 3.52 -0.92 -2.74 118.95 123.24 1f6n s ARG 248 Ca 0.03 2.17 0.07 0.00 -0.13 0.00 0.00 55.73 57.86 1f6n s ARG 248 Cb 0.06 -3.19 -0.02 0.00 -1.56 0.00 0.00 34.95 30.24 1f6n s ARG 248 CO 0.35 -0.43 -0.21 0.15 -0.81 0.00 0.00 175.30 174.35 1f6n s LYS 249 N 0.57 1.60 0.00 5.12 1.02 -1.08 -4.93 119.74 122.04 1f6n s LYS 249 Ca 0.63 -0.82 0.00 0.00 0.02 0.00 0.00 55.97 55.80 1f6n s LYS 249 Cb -0.39 -1.61 0.00 0.00 -0.52 0.00 0.00 37.83 35.31 1f6n s LYS 249 CO 0.35 0.43 0.00 0.45 -0.92 0.00 0.00 175.35 175.66