#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i2v n ARG 2 N 0.00 -0.79 -3.86 -1.46 5.12 -1.26 -4.92 116.66 109.49 2i2v n ARG 2 Ca 0.00 0.05 -0.27 0.00 -1.93 0.00 0.00 57.85 55.70 2i2v n ARG 2 Cb 0.00 -2.84 -0.17 0.00 -1.16 0.00 0.00 32.46 28.29 2i2v n ARG 2 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 2i2v s VAL 3 N -4.09 0.93 0.55 1.55 -7.23 -1.25 -3.84 120.40 107.02 2i2v s VAL 3 Ca 0.11 -0.48 0.30 0.00 -1.81 0.00 0.00 61.98 60.09 2i2v s VAL 3 Cb -0.06 -1.13 0.45 0.00 0.56 0.00 0.00 36.38 36.20 2i2v s VAL 3 CO 0.87 0.13 1.90 0.00 -0.31 0.00 0.00 175.10 177.69 2i2v n GLN 5 N -4.15 0.00 -0.09 0.00 7.27 -1.26 -3.74 117.38 115.42 2i2v n GLN 5 Ca 0.15 0.00 -0.10 0.00 0.07 0.00 0.00 57.00 57.12 2i2v n GLN 5 Cb 0.85 -1.05 -0.14 0.00 2.41 0.00 0.00 30.24 32.31 2i2v n GLN 5 CO 0.00 0.00 0.00 1.55 0.07 0.00 0.00 177.06 178.68 2i2v n VAL 6 N -0.10 1.28 -0.26 1.69 3.14 -1.26 -4.50 118.33 118.32 2i2v n VAL 6 Ca 0.00 -0.77 0.01 0.00 -2.96 0.00 0.00 64.34 60.61 2i2v n VAL 6 Cb 0.00 -0.55 0.01 0.00 -1.06 0.00 0.00 33.84 32.23 2i2v n VAL 6 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 2i2v n THR 7 N -2.72 0.86 -4.14 1.55 -2.24 -1.26 -5.02 114.28 101.31 2i2v n THR 7 Ca -0.31 -0.88 -0.34 0.00 -2.27 0.00 0.00 64.05 60.25 2i2v n THR 7 Cb 1.10 0.55 -0.02 0.00 -2.10 0.00 0.00 70.33 69.86 2i2v n THR 7 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2i2v n GLY 8 N -0.45 -0.43 3.60 3.38 0.00 -1.26 -4.92 105.19 105.11 2i2v n GLY 8 Ca 0.01 0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 2i2v n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i2v s LYS 9 N -6.84 3.92 0.07 1.61 1.02 -1.26 -4.80 119.74 113.47 2i2v s LYS 9 Ca 0.64 0.39 0.01 0.00 0.02 0.00 0.00 55.97 57.03 2i2v s LYS 9 Cb -0.34 -3.73 0.01 0.00 -0.52 0.00 0.00 37.83 33.25 2i2v s LYS 9 CO 0.91 -0.60 0.07 0.54 -0.92 0.00 0.00 175.35 175.35 2i2v n ARG 10 N 5.97 1.22 -3.12 1.68 1.74 -1.25 -2.23 116.66 120.67 2i2v n ARG 10 Ca 0.00 -0.42 -0.43 0.00 -0.77 0.00 0.00 57.85 56.24 2i2v n ARG 10 Cb 0.49 0.02 -0.07 0.00 -1.02 0.00 0.00 32.46 31.88 2i2v n ARG 10 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2i2v s PRO 11 N -2.30 3.40 1.05 5.56 0.04 -1.26 -4.14 135.00 137.36 2i2v s PRO 11 Ca 0.05 -0.25 -0.17 0.00 0.04 0.00 0.00 61.00 60.67 2i2v s PRO 11 Cb -0.00 -3.91 0.23 0.00 0.04 0.00 0.00 34.50 30.86 2i2v s PRO 11 CO 0.03 -0.92 1.23 0.14 0.04 0.00 0.00 177.00 177.53 2i2v s VAL 12 N 2.76 1.84 0.09 -0.36 -7.23 -0.71 -4.80 120.40 111.99 2i2v s VAL 12 Ca 0.23 0.00 0.08 0.00 -1.81 0.00 0.00 61.98 60.48 2i2v s VAL 12 Cb -0.14 -2.79 -0.03 0.00 0.56 0.00 0.00 36.38 33.97 2i2v s VAL 12 CO 0.18 0.00 -0.22 0.42 -0.31 0.00 0.00 175.10 175.17 2i2v s THR 13 N -3.52 1.76 0.24 5.32 -4.23 -1.26 -0.85 115.64 113.10 2i2v s THR 13 Ca 0.72 -1.47 -0.19 0.00 -1.18 0.00 0.00 61.69 59.57 2i2v s THR 13 Cb -0.06 -1.58 0.07 0.00 1.34 0.00 0.00 72.50 72.27 2i2v s THR 13 CO 0.54 0.03 0.95 0.61 -0.54 0.00 0.00 174.62 176.22 2i2v n GLY 14 N 1.28 0.72 3.91 3.99 0.00 -1.26 -4.78 105.19 109.04 2i2v n GLY 14 Ca -0.19 -1.18 -0.26 0.00 0.00 0.00 0.00 46.02 44.40 2i2v n GLY 14 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2i2v s ASN 15 N -3.31 6.11 0.04 1.61 0.01 -1.26 -0.19 114.94 117.96 2i2v s ASN 15 Ca 0.21 0.08 -0.04 0.00 -0.71 0.00 0.00 52.86 52.40 2i2v s ASN 15 Cb -0.03 -1.78 -0.28 0.00 0.41 0.00 0.00 41.25 39.57 2i2v s ASN 15 CO 0.07 0.05 1.01 -1.13 -1.51 0.00 0.00 177.10 175.59 2i2v h ASN 16 N 2.13 0.41 -6.20 -1.22 -0.73 -0.35 -3.46 115.58 106.17 2i2v h ASN 16 Ca -0.48 -0.49 0.00 0.00 1.87 0.00 0.00 56.30 57.20 2i2v h ASN 16 Cb 1.20 -0.13 -0.00 0.00 0.27 0.00 0.00 38.32 39.65 2i2v h ASN 16 CO 0.67 1.39 -0.51 0.54 -0.37 0.00 0.00 177.43 179.15 2i2v n ARG 17 N -3.49 -0.98 -3.32 6.67 3.00 -1.21 -4.96 116.66 112.37 2i2v n ARG 17 Ca -0.12 1.13 -0.21 0.00 -0.01 0.00 0.00 57.85 58.64 2i2v n ARG 17 Cb 1.03 -1.12 0.03 0.00 0.00 0.00 0.00 32.46 32.40 2i2v n ARG 17 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 2i2v s SER 18 N -0.50 5.03 0.78 0.55 1.04 -1.25 -4.83 113.70 114.52 2i2v s SER 18 Ca -0.01 -0.90 -0.16 0.00 0.48 0.00 0.00 55.95 55.36 2i2v s SER 18 Cb 0.00 0.14 -0.04 0.00 0.10 0.00 0.00 66.02 66.22 2i2v s SER 18 CO 0.04 -1.15 0.36 1.41 0.98 0.00 0.00 173.24 174.89 2i2v n HIS 19 N -2.00 -1.40 -0.30 5.02 8.25 -1.26 0.39 115.22 123.92 2i2v n HIS 19 Ca 0.09 0.30 0.00 0.00 -0.26 0.00 0.00 57.72 57.85 2i2v n HIS 19 Cb 0.62 -1.84 0.00 0.00 1.12 0.00 0.00 29.99 29.89 2i2v n HIS 19 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2i2v n ALA 20 N -2.60 0.00 -3.01 -1.41 0.00 -1.26 -4.08 120.51 108.15 2i2v n ALA 20 Ca 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.52 2i2v n ALA 20 Cb 0.51 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.83 2i2v n ALA 20 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2i2v n LEU 21 N 0.00 -6.69 -4.25 0.00 4.77 0.16 -4.99 117.00 106.01 2i2v n LEU 21 Ca 0.00 -0.06 -0.43 0.00 -0.03 0.00 0.00 56.01 55.50 2i2v n LEU 21 Cb 0.00 -3.25 -0.07 0.00 -2.33 0.00 0.00 43.42 37.77 2i2v n LEU 21 CO 0.00 -1.12 0.07 0.20 -1.33 0.00 0.00 177.39 175.21 2i2v s ASN 22 N -2.96 5.93 0.26 -1.43 0.01 -1.15 -4.86 114.94 110.73 2i2v s ASN 22 Ca 0.01 -1.96 -0.31 0.00 -0.71 0.00 0.00 52.86 49.89 2i2v s ASN 22 Cb -0.00 -2.09 -0.12 0.00 0.41 0.00 0.00 41.25 39.45 2i2v s ASN 22 CO 0.73 -0.73 1.65 0.00 -1.51 0.00 0.00 177.10 177.24 2i2v n ALA 23 N 4.92 2.69 -3.32 0.60 0.00 -1.26 -3.29 120.51 120.85 2i2v n ALA 23 Ca -0.08 0.38 0.02 0.00 0.00 0.00 0.00 53.44 53.76 2i2v n ALA 23 Cb 0.41 -2.49 -0.02 0.00 0.00 0.00 0.00 19.45 17.34 2i2v n ALA 23 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2i2v s THR 24 N 0.46 -0.97 0.30 0.00 -4.23 -1.26 -4.89 115.64 105.04 2i2v s THR 24 Ca 0.68 0.00 -0.27 0.00 -1.18 0.00 0.00 61.69 60.93 2i2v s THR 24 Cb -0.50 -0.98 -0.14 0.00 1.34 0.00 0.00 72.50 72.22 2i2v s THR 24 CO 0.42 -0.00 0.81 0.29 -0.54 0.00 0.00 174.62 175.59 2i2v n LYS 25 N 5.43 0.90 0.00 3.99 4.76 -1.26 0.37 118.16 132.35 2i2v n LYS 25 Ca -0.05 0.32 0.00 0.00 -2.87 0.00 0.00 58.31 55.71 2i2v n LYS 25 Cb 0.50 -1.60 0.00 0.00 -1.84 0.00 0.00 35.03 32.09 2i2v n LYS 25 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 2i2v n ARG 26 N 0.72 0.00 -1.69 1.97 -4.01 0.74 -4.75 116.66 109.65 2i2v n ARG 26 Ca 0.12 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.93 2i2v n ARG 26 Cb 0.32 -0.32 0.00 0.00 -3.04 0.00 0.00 32.46 29.43 2i2v n ARG 26 CO 0.00 0.00 0.00 2.89 -3.04 0.00 0.00 177.63 177.48 2i2v n ARG 27 N -0.50 -4.53 -3.81 2.89 1.85 -1.23 -4.86 116.66 106.46 2i2v n ARG 27 Ca 0.00 3.37 -0.36 0.00 -1.00 0.00 0.00 57.85 59.86 2i2v n ARG 27 Cb 0.00 -3.84 -0.12 0.00 -1.05 0.00 0.00 32.46 27.45 2i2v n ARG 27 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2i2v s PHE 28 N -3.41 3.39 0.37 2.89 0.40 -0.03 -4.84 117.98 116.75 2i2v s PHE 28 Ca 0.00 -1.97 -0.15 0.00 -0.60 0.00 0.00 56.93 54.21 2i2v s PHE 28 Cb 0.00 -2.62 -0.09 0.00 0.51 0.00 0.00 43.02 40.82 2i2v s PHE 28 CO 0.00 -0.86 0.80 -0.48 0.70 0.00 0.00 175.22 175.38 2i2v s LEU 29 N 1.25 3.97 0.00 -0.37 2.34 -1.26 -1.74 118.68 122.87 2i2v s LEU 29 Ca 0.01 1.34 -0.15 0.00 0.06 0.00 0.00 54.13 55.40 2i2v s LEU 29 Cb -0.21 -4.18 0.23 0.00 -0.56 0.00 0.00 46.19 41.47 2i2v s LEU 29 CO -0.01 -0.29 0.52 -2.65 -1.06 0.00 0.00 176.35 172.85 2i2v n PRO 30 N -0.66 -2.78 -0.03 1.48 -0.02 -1.26 -4.98 135.00 126.76 2i2v n PRO 30 Ca 0.04 -0.87 -0.01 0.00 -2.02 0.00 0.00 63.50 60.64 2i2v n PRO 30 Cb 0.53 -1.32 -0.00 0.00 -0.02 0.00 0.00 33.50 32.69 2i2v n PRO 30 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 2i2v h ASN 31 N -2.94 0.00 -3.48 2.55 -0.73 -1.93 -3.51 115.58 105.54 2i2v h ASN 31 Ca -0.24 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.93 2i2v h ASN 31 Cb 0.79 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.38 2i2v h ASN 31 CO 0.14 0.28 -0.77 0.18 -0.37 0.00 0.00 177.43 176.89 2i2v n LEU 32 N -3.27 -1.48 0.00 0.34 4.32 -1.26 -4.95 117.00 110.70 2i2v n LEU 32 Ca -0.02 2.36 0.00 0.00 -0.02 0.00 0.00 56.01 58.34 2i2v n LEU 32 Cb 0.06 -2.89 0.00 0.00 -1.62 0.00 0.00 43.42 38.96 2i2v n LEU 32 CO 0.02 -0.37 0.00 1.41 -1.22 0.00 0.00 177.39 177.24 2i2v n HIS 33 N -2.06 0.00 -1.97 -1.77 8.25 -0.16 -4.89 115.22 112.63 2i2v n HIS 33 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.45 2i2v n HIS 33 Cb 0.28 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.38 2i2v n HIS 33 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2i2v n SER 34 N -0.24 -4.61 -4.28 0.41 2.88 -1.19 -4.93 113.62 101.66 2i2v n SER 34 Ca 0.00 1.05 -0.32 0.00 -1.33 0.00 0.00 58.87 58.27 2i2v n SER 34 Cb 0.00 -3.65 -0.16 0.00 -0.75 0.00 0.00 64.21 59.65 2i2v n SER 34 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 2i2v s HIS 35 N -0.39 2.49 -0.99 0.66 5.04 0.33 -4.89 115.29 117.54 2i2v s HIS 35 Ca -0.07 -0.72 -0.23 0.00 -1.54 0.00 0.00 55.06 52.50 2i2v s HIS 35 Cb 0.00 -1.63 0.03 0.00 0.04 0.00 0.00 32.58 31.03 2i2v s HIS 35 CO 0.18 -0.21 1.52 1.03 -2.34 0.00 0.00 174.74 174.92 2i2v s ARG 36 N -0.11 3.42 0.40 2.88 1.81 -1.26 -1.91 118.95 124.18 2i2v s ARG 36 Ca -0.05 -0.97 -0.09 0.00 -1.72 0.00 0.00 55.73 52.90 2i2v s ARG 36 Cb -0.14 -5.28 -0.06 0.00 -0.45 0.00 0.00 34.95 29.02 2i2v s ARG 36 CO 0.04 -2.38 0.75 -0.06 -0.68 0.00 0.00 175.30 172.97 2i2v s PHE 37 N 5.76 3.48 -0.49 -0.53 0.08 -1.26 -4.88 117.98 120.15 2i2v s PHE 37 Ca 0.49 0.98 -0.04 0.00 0.12 0.00 0.00 56.93 58.48 2i2v s PHE 37 Cb -0.01 -2.40 0.13 0.00 -0.57 0.00 0.00 43.02 40.17 2i2v s PHE 37 CO -0.08 -0.10 0.31 -0.46 -0.10 0.00 0.00 175.22 174.79 2i2v s TRP 38 N -2.39 3.51 0.34 0.36 -0.11 -1.26 -1.08 118.94 118.31 2i2v s TRP 38 Ca 0.50 -2.38 0.07 0.00 1.22 0.00 0.00 56.10 55.51 2i2v s TRP 38 Cb -0.10 -3.29 0.76 0.00 -1.50 0.00 0.00 33.47 29.34 2i2v s TRP 38 CO 0.33 -0.94 1.86 -0.39 -4.62 0.00 0.00 176.95 173.19 2i2v h VAL 39 N 5.99 0.85 0.00 5.86 -1.51 -1.87 -3.45 116.25 122.12 2i2v h VAL 39 Ca -0.11 -0.26 0.00 0.00 -1.23 0.00 0.00 66.70 65.10 2i2v h VAL 39 Cb 1.03 0.03 0.00 0.00 -2.13 0.00 0.00 31.29 30.22 2i2v h VAL 39 CO 0.74 0.14 0.00 1.21 -1.23 0.00 0.00 177.57 178.42 2i2v n GLU 40 N -4.57 0.00 0.00 5.19 0.00 -1.26 -4.15 120.64 115.85 2i2v n GLU 40 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.34 2i2v n GLU 40 Cb 0.44 0.00 0.02 0.00 0.00 0.00 0.00 31.44 31.90 2i2v n GLU 40 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 2i2v n SER 41 N 1.15 0.00 0.00 4.31 3.41 -1.26 -1.10 113.62 120.13 2i2v n SER 41 Ca 0.00 -0.93 0.00 0.00 -0.26 0.00 0.00 58.87 57.68 2i2v n SER 41 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2i2v n SER 41 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2i2v n GLU 42 N -0.53 0.00 -3.75 4.33 2.13 -1.26 -5.06 120.64 116.51 2i2v n GLU 42 Ca 0.01 -0.18 -0.25 0.00 0.66 0.00 0.00 57.16 57.40 2i2v n GLU 42 Cb 0.00 -0.44 0.00 0.00 0.27 0.00 0.00 31.44 31.27 2i2v n GLU 42 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2i2v n LYS 43 N 0.00 -1.57 -3.87 5.31 4.01 -0.26 -4.95 118.16 116.84 2i2v n LYS 43 Ca 0.00 0.83 0.02 0.00 -0.51 0.00 0.00 58.31 58.65 2i2v n LYS 43 Cb 0.35 -2.40 0.01 0.00 -0.51 0.00 0.00 35.03 32.48 2i2v n LYS 43 CO 0.00 0.00 0.00 0.50 -1.11 0.00 0.00 177.40 176.79 2i2v s ARG 44 N -4.70 0.44 -0.08 1.97 3.52 -1.26 -4.97 118.95 113.87 2i2v s ARG 44 Ca 0.03 -0.27 0.02 0.00 -0.13 0.00 0.00 55.73 55.37 2i2v s ARG 44 Cb -0.00 0.13 -0.02 0.00 -1.56 0.00 0.00 34.95 33.49 2i2v s ARG 44 CO 0.89 -0.20 -0.12 -0.06 -0.81 0.00 0.00 175.30 175.00 2i2v s PHE 45 N -2.15 2.79 -0.59 5.12 2.99 -1.26 -2.53 117.98 122.36 2i2v s PHE 45 Ca 0.24 -0.25 0.06 0.00 0.00 0.00 0.00 56.93 56.98 2i2v s PHE 45 Cb 0.01 -1.72 0.24 0.00 0.00 0.00 0.00 43.02 41.55 2i2v s PHE 45 CO -0.01 0.10 0.66 1.33 -0.00 0.00 0.00 175.22 177.30 2i2v n VAL 46 N 2.67 1.52 -1.53 -0.44 0.24 -0.24 -4.95 118.33 115.59 2i2v n VAL 46 Ca -0.18 -4.87 -0.45 0.00 -2.04 0.00 0.00 64.34 56.80 2i2v n VAL 46 Cb 0.52 -2.06 -0.05 0.00 -1.47 0.00 0.00 33.84 30.78 2i2v n VAL 46 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 2i2v n THR 47 N 1.15 0.24 -4.47 3.34 5.66 -1.26 -3.98 114.28 114.96 2i2v n THR 47 Ca 0.27 -0.41 -0.31 0.00 -3.05 0.00 0.00 64.05 60.56 2i2v n THR 47 Cb 0.43 -2.21 -0.11 0.00 -1.55 0.00 0.00 70.33 66.89 2i2v n THR 47 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2i2v s LEU 48 N 8.30 2.82 -1.29 1.09 1.43 -0.81 -4.88 118.68 125.35 2i2v s LEU 48 Ca 1.05 -0.39 -0.08 0.00 -1.03 0.00 0.00 54.13 53.68 2i2v s LEU 48 Cb -0.53 -1.65 -0.07 0.00 0.03 0.00 0.00 46.19 43.97 2i2v s LEU 48 CO 0.40 0.23 2.55 -1.14 0.23 0.00 0.00 176.35 178.62 2i2v n ARG 49 N 1.24 2.92 -2.01 1.70 3.00 -1.26 -0.51 116.66 121.74 2i2v n ARG 49 Ca -0.15 -1.88 -0.29 0.00 -0.00 0.00 0.00 57.85 55.53 2i2v n ARG 49 Cb 0.52 -2.66 0.18 0.00 0.00 0.00 0.00 32.46 30.50 2i2v n ARG 49 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2i2v s VAL 50 N 2.81 2.01 0.20 5.15 1.01 -1.25 -4.09 120.40 126.25 2i2v s VAL 50 Ca 0.56 -0.07 -0.13 0.00 0.00 0.00 0.00 61.98 62.34 2i2v s VAL 50 Cb 0.14 -2.95 0.01 0.00 0.00 0.00 0.00 36.38 33.58 2i2v s VAL 50 CO -0.05 0.00 0.44 -0.94 0.00 0.00 0.00 175.10 174.55 2i2v s SER 51 N -4.89 -0.11 0.92 3.32 1.04 -1.26 -0.99 113.70 111.74 2i2v s SER 51 Ca 0.74 -0.76 -0.15 0.00 0.48 0.00 0.00 55.95 56.26 2i2v s SER 51 Cb -0.04 0.54 -0.05 0.00 0.10 0.00 0.00 66.02 66.57 2i2v s SER 51 CO 0.52 -1.04 -0.06 0.00 0.98 0.00 0.00 173.24 173.65 2i2v n ALA 52 N -0.32 -3.59 0.00 5.32 0.00 -1.26 -1.10 120.51 119.56 2i2v n ALA 52 Ca -0.06 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.81 2i2v n ALA 52 Cb 0.62 -1.54 0.00 0.00 0.00 0.00 0.00 19.45 18.53 2i2v n ALA 52 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2i2v n LYS 53 N 0.13 0.00 -0.27 0.00 0.00 -1.26 -4.24 118.16 112.52 2i2v n LYS 53 Ca 0.04 0.00 0.03 0.00 0.00 0.00 0.00 58.31 58.38 2i2v n LYS 53 Cb 0.54 0.00 0.26 0.00 0.00 0.00 0.00 35.03 35.82 2i2v n LYS 53 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 2i2v h GLY 54 N 0.00 1.20 1.13 3.14 0.00 -1.53 0.15 103.07 107.16 2i2v h GLY 54 Ca 0.00 -0.39 -0.17 0.00 0.00 0.00 0.00 47.33 46.76 2i2v h GLY 54 CO 0.00 0.32 -0.47 -0.33 0.00 0.00 0.00 176.54 176.06 2i2v h MET 55 N 0.99 0.90 -0.35 4.80 2.86 -1.44 -1.55 114.93 121.14 2i2v h MET 55 Ca 0.35 -0.53 0.10 0.00 -2.06 0.00 0.00 59.70 57.56 2i2v h MET 55 Cb 0.12 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 2i2v h MET 55 CO -0.12 1.17 0.30 0.00 1.06 0.00 0.00 176.91 179.32 2i2v h ARG 56 N 0.70 0.00 0.02 1.72 3.08 -1.12 0.15 114.38 118.93 2i2v h ARG 56 Ca 0.04 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.01 2i2v h ARG 56 Cb 1.07 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.13 2i2v h ARG 56 CO 0.11 0.00 -0.31 0.28 -1.07 0.00 0.00 179.97 178.98 2i2v h VAL 57 N 0.00 1.59 -0.97 2.04 2.07 -0.19 -1.96 116.25 118.82 2i2v h VAL 57 Ca 0.16 -2.12 0.15 0.00 0.82 0.00 0.00 66.70 65.71 2i2v h VAL 57 Cb 0.76 2.95 -0.09 0.00 -1.52 0.00 0.00 31.29 33.39 2i2v h VAL 57 CO -0.00 0.58 0.61 0.40 0.02 0.00 0.00 177.57 179.18 2i2v h ILE 58 N -0.56 0.83 -0.00 4.57 1.08 0.13 0.69 117.51 124.25 2i2v h ILE 58 Ca -0.04 -0.28 -0.22 0.00 -0.39 0.00 0.00 64.86 63.93 2i2v h ILE 58 Cb 1.12 -0.06 0.00 0.00 -3.07 0.00 0.00 36.82 34.81 2i2v h ILE 58 CO 0.06 0.15 -0.93 0.44 -0.69 0.00 0.00 178.15 177.18 2i2v h ASP 59 N 0.81 0.49 1.50 1.72 3.32 -0.86 0.40 116.42 123.80 2i2v h ASP 59 Ca 0.50 -0.39 -0.03 0.00 0.02 0.00 0.00 57.03 57.13 2i2v h ASP 59 Cb 0.70 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 2i2v h ASP 59 CO -0.27 1.19 -0.51 0.50 -1.72 0.00 0.00 179.24 178.42 2i2v h LYS 60 N 0.21 0.00 0.00 3.56 3.64 -0.39 -3.38 116.57 120.21 2i2v h LYS 60 Ca -0.07 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.12 2i2v h LYS 60 Cb 1.56 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.34 2i2v h LYS 60 CO 0.16 0.11 -1.72 1.63 -2.27 0.00 0.00 179.45 177.36 2i2v n LYS 61 N -2.97 0.92 0.00 1.90 5.02 0.23 -5.06 118.16 118.19 2i2v n LYS 61 Ca 0.01 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 2i2v n LYS 61 Cb 0.60 -1.26 0.00 0.00 -0.02 0.00 0.00 35.03 34.35 2i2v n LYS 61 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2i2v n GLY 62 N 2.74 2.44 0.33 0.72 0.00 0.14 -4.67 105.19 106.89 2i2v n GLY 62 Ca -0.21 -1.53 -0.11 0.00 0.00 0.00 0.00 46.02 44.17 2i2v n GLY 62 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2i2v h ILE 63 N 0.00 0.00 0.00 -0.61 5.03 -1.93 -0.90 117.51 119.09 2i2v h ILE 63 Ca 0.00 0.00 -0.30 0.00 -0.12 0.00 0.00 64.86 64.44 2i2v h ILE 63 Cb 0.00 0.00 -0.01 0.00 -3.03 0.00 0.00 36.82 33.78 2i2v h ILE 63 CO 0.00 0.00 1.54 0.47 -0.68 0.00 0.00 178.15 179.48 2i2v n ASP 64 N -4.57 4.81 0.00 1.72 8.00 -1.26 0.06 116.55 125.31 2i2v n ASP 64 Ca -0.05 -2.28 0.00 0.00 0.71 0.00 0.00 54.79 53.17 2i2v n ASP 64 Cb 0.28 -1.09 0.00 0.00 -0.02 0.00 0.00 41.12 40.28 2i2v n ASP 64 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2i2v n THR 65 N 3.41 0.00 0.13 -3.53 -1.04 -0.77 -4.72 114.28 107.77 2i2v n THR 65 Ca 0.42 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 62.19 2i2v n THR 65 Cb 0.37 0.00 -0.16 0.00 -1.82 0.00 0.00 70.33 68.72 2i2v n THR 65 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 2i2v h VAL 66 N 0.00 1.23 0.00 12.58 2.07 0.54 -2.92 116.25 129.74 2i2v h VAL 66 Ca 0.00 -2.66 0.00 0.00 0.82 0.00 0.00 66.70 64.86 2i2v h VAL 66 Cb 0.00 3.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.77 2i2v h VAL 66 CO 0.00 0.81 0.00 -0.07 0.02 0.00 0.00 177.57 178.33 2i2v h LEU 67 N 0.12 0.00 0.18 2.57 3.38 -0.61 -0.48 115.31 120.47 2i2v h LEU 67 Ca -0.27 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 2i2v h LEU 67 Cb 2.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.89 2i2v h LEU 67 CO 0.26 0.00 -0.09 0.00 0.09 0.00 0.00 178.44 178.70 2i2v h ALA 68 N 2.13 -0.24 -3.03 1.53 0.00 -1.72 -3.23 119.26 114.70 2i2v h ALA 68 Ca 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2i2v h ALA 68 Cb 0.33 0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.22 2i2v h ALA 68 CO 0.00 -0.55 0.02 0.39 0.00 0.00 0.00 179.25 179.11 2i2v n GLU 69 N -5.12 -0.43 0.00 0.00 1.02 -0.19 -2.36 120.64 113.57 2i2v n GLU 69 Ca -0.09 -0.10 0.00 0.00 -0.02 0.00 0.00 57.16 56.96 2i2v n GLU 69 Cb 0.18 -0.07 0.00 0.00 -0.02 0.00 0.00 31.44 31.53 2i2v n GLU 69 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2i2v n LEU 70 N 0.00 0.00 -0.05 -4.62 -0.00 -1.24 -3.98 117.00 107.11 2i2v n LEU 70 Ca 0.01 0.00 -0.14 0.00 -0.00 0.00 0.00 56.01 55.88 2i2v n LEU 70 Cb 0.03 0.00 -0.12 0.00 -0.00 0.00 0.00 43.42 43.33 2i2v n LEU 70 CO 0.02 0.00 0.48 -0.09 -0.00 0.00 0.00 177.39 177.80 2i2v h ARG 71 N 0.00 -0.00 0.00 1.96 2.43 -1.62 0.64 114.38 117.79 2i2v h ARG 71 Ca 0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 2i2v h ARG 71 Cb 0.00 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.55 2i2v h ARG 71 CO 0.00 0.81 -0.09 0.00 -1.51 0.00 0.00 179.97 179.18 2i2v h ALA 72 N 0.19 1.10 0.00 2.80 0.00 -1.60 -0.57 119.26 121.19 2i2v h ALA 72 Ca -0.00 -0.08 -0.19 0.00 0.00 0.00 0.00 54.91 54.64 2i2v h ALA 72 Cb 0.81 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 2i2v h ALA 72 CO 0.00 0.11 -1.00 -0.09 0.00 0.00 0.00 179.25 178.27 2i2v h ARG 73 N 0.00 0.00 -1.59 0.00 2.43 -1.80 -3.49 114.38 109.93 2i2v h ARG 73 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2i2v h ARG 73 Cb 0.42 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 2i2v h ARG 73 CO 0.01 0.72 0.00 0.41 -1.51 0.00 0.00 179.97 179.60 2i2v n GLY 74 N 1.35 0.86 3.14 2.80 0.00 0.17 -4.95 105.19 108.55 2i2v n GLY 74 Ca -0.03 -0.53 -0.15 0.00 0.00 0.00 0.00 46.02 45.31 2i2v n GLY 74 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2i2v s GLU 75 N -2.53 0.73 0.00 1.61 2.12 0.15 -4.99 118.70 115.79 2i2v s GLU 75 Ca 0.00 -0.95 0.00 0.00 0.36 0.00 0.00 54.97 54.38 2i2v s GLU 75 Cb 0.00 -0.57 0.00 0.00 0.26 0.00 0.00 34.13 33.82 2i2v s GLU 75 CO 0.00 0.11 0.00 0.36 -0.54 0.00 0.00 175.26 175.19 2i2v n LYS 76 N 1.14 0.00 -0.63 4.30 2.85 -1.26 -4.62 118.16 119.94 2i2v n LYS 76 Ca -0.20 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.06 2i2v n LYS 76 Cb 0.55 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.93 2i2v n LYS 76 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 177.40 178.33