#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i2v n GLN 2 N 0.00 -2.54 -0.53 0.38 7.27 -1.26 -4.76 117.38 115.94 2i2v n GLN 2 Ca 0.00 2.04 -0.29 0.00 0.07 0.00 0.00 57.00 58.82 2i2v n GLN 2 Cb 0.00 -2.75 0.21 0.00 2.41 0.00 0.00 30.24 30.11 2i2v n GLN 2 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 2i2v n GLU 3 N -3.11 -2.47 0.00 3.69 1.02 -1.26 -4.48 120.64 114.03 2i2v n GLU 3 Ca -0.04 -0.71 0.00 0.00 -0.02 0.00 0.00 57.16 56.39 2i2v n GLU 3 Cb 0.42 -1.80 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 2i2v n GLU 3 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2i2v n GLN 4 N -3.28 0.00 -1.50 3.49 1.13 -0.36 -4.90 117.38 111.97 2i2v n GLN 4 Ca 0.04 0.00 0.01 0.00 -1.94 0.00 0.00 57.00 55.11 2i2v n GLN 4 Cb 0.56 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.90 2i2v n GLN 4 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 2i2v n THR 5 N 0.00 -2.66 -3.94 5.09 -1.04 -1.26 -1.43 114.28 109.03 2i2v n THR 5 Ca 0.00 1.36 -0.28 0.00 -2.04 0.00 0.00 64.05 63.09 2i2v n THR 5 Cb 0.00 -2.26 -0.17 0.00 -1.82 0.00 0.00 70.33 66.08 2i2v n THR 5 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 2i2v s MET 6 N -5.29 1.76 0.35 -2.82 -1.94 -1.26 -2.82 119.30 107.27 2i2v s MET 6 Ca 0.00 -0.38 0.08 0.00 -1.71 0.00 0.00 55.69 53.68 2i2v s MET 6 Cb 0.00 -1.80 -0.04 0.00 2.01 0.00 0.00 34.83 35.01 2i2v s MET 6 CO 0.00 -0.28 0.18 -0.51 -0.01 0.00 0.00 175.02 174.41 2i2v s LEU 7 N 1.63 3.32 0.20 -0.03 1.02 -0.78 -4.71 118.68 119.32 2i2v s LEU 7 Ca 0.04 -0.74 0.05 0.00 0.02 0.00 0.00 54.13 53.50 2i2v s LEU 7 Cb -0.13 -1.82 -0.04 0.00 0.02 0.00 0.00 46.19 44.23 2i2v s LEU 7 CO -0.09 -0.34 0.23 0.20 0.02 0.00 0.00 176.35 176.37 2i2v s ASN 8 N -3.89 5.87 -0.20 2.29 0.01 0.82 -2.89 114.94 116.95 2i2v s ASN 8 Ca 0.39 -0.05 -0.28 0.00 -0.71 0.00 0.00 52.86 52.21 2i2v s ASN 8 Cb -0.03 -1.63 0.00 0.00 0.41 0.00 0.00 41.25 40.01 2i2v s ASN 8 CO 0.24 0.01 0.98 -0.69 -1.51 0.00 0.00 177.10 176.13 2i2v s VAL 9 N -1.89 4.74 -0.33 1.60 1.01 -1.26 0.56 120.40 124.84 2i2v s VAL 9 Ca 0.33 1.93 0.12 0.00 0.00 0.00 0.00 61.98 64.36 2i2v s VAL 9 Cb -0.10 -4.27 0.73 0.00 0.00 0.00 0.00 36.38 32.75 2i2v s VAL 9 CO 0.26 -0.11 1.63 0.00 0.00 0.00 0.00 175.10 176.88 2i2v n ALA 10 N 5.93 3.81 -2.00 5.51 0.00 -0.41 -4.84 120.51 128.50 2i2v n ALA 10 Ca 0.10 -1.75 0.00 0.00 0.00 0.00 0.00 53.44 51.79 2i2v n ALA 10 Cb 0.47 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.79 2i2v n ALA 10 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2i2v n ASP 11 N 0.50 0.00 -3.22 0.00 5.68 -1.26 0.40 116.55 118.66 2i2v n ASP 11 Ca 0.26 0.00 -0.10 0.00 -0.50 0.00 0.00 54.79 54.45 2i2v n ASP 11 Cb 1.12 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 41.10 2i2v n ASP 11 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2i2v s ASN 12 N 1.33 0.17 -0.13 -1.12 2.20 -1.26 -4.59 114.94 111.54 2i2v s ASN 12 Ca 0.00 -1.13 -0.05 0.00 -0.94 0.00 0.00 52.86 50.74 2i2v s ASN 12 Cb 0.00 0.77 0.01 0.00 -2.00 0.00 0.00 41.25 40.03 2i2v s ASN 12 CO 0.00 -1.51 0.17 -0.24 -2.94 0.00 0.00 177.10 172.58 2i2v n SER 13 N -1.20 -3.91 0.00 3.54 2.88 -1.26 -4.83 113.62 108.85 2i2v n SER 13 Ca -0.05 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 2i2v n SER 13 Cb 0.60 -2.40 0.00 0.00 -0.75 0.00 0.00 64.21 61.66 2i2v n SER 13 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2i2v n GLY 14 N -0.36 0.73 3.58 0.46 0.00 -1.26 -4.34 105.19 104.00 2i2v n GLY 14 Ca 0.03 -0.63 -0.30 0.00 0.00 0.00 0.00 46.02 45.12 2i2v n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i2v s ALA 15 N 0.00 0.50 0.00 4.61 0.00 -1.26 -4.62 121.76 120.98 2i2v s ALA 15 Ca 0.00 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.12 2i2v s ALA 15 Cb 0.00 -2.93 0.00 0.00 0.00 0.00 0.00 23.12 20.19 2i2v s ALA 15 CO 0.00 -3.59 0.00 0.54 0.00 0.00 0.00 175.76 172.71 2i2v n ARG 16 N -4.77 0.00 0.00 0.00 5.12 -1.26 -2.86 116.66 112.89 2i2v n ARG 16 Ca 0.12 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.04 2i2v n ARG 16 Cb 0.59 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.89 2i2v n ARG 16 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2i2v n ARG 17 N 0.00 0.00 -3.67 5.56 1.74 -1.26 -4.43 116.66 114.60 2i2v n ARG 17 Ca 0.00 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 56.94 2i2v n ARG 17 Cb 0.00 0.00 -0.13 0.00 -1.02 0.00 0.00 32.46 31.31 2i2v n ARG 17 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2i2v s VAL 18 N 0.00 -0.38 -0.08 1.55 1.01 -1.14 -2.34 120.40 119.02 2i2v s VAL 18 Ca 0.00 0.27 -0.15 0.00 0.00 0.00 0.00 61.98 62.10 2i2v s VAL 18 Cb 0.00 -0.43 -0.05 0.00 0.00 0.00 0.00 36.38 35.90 2i2v s VAL 18 CO 0.00 0.11 0.39 -0.32 0.00 0.00 0.00 175.10 175.28 2i2v s MET 19 N 2.32 4.13 0.37 2.72 1.75 -0.84 -1.87 119.30 127.88 2i2v s MET 19 Ca 0.00 0.32 -0.25 0.00 -1.25 0.00 0.00 55.69 54.51 2i2v s MET 19 Cb -0.12 -3.34 -0.09 0.00 2.84 0.00 0.00 34.83 34.12 2i2v s MET 19 CO -0.08 0.40 1.04 0.00 -0.65 0.00 0.00 175.02 175.73 2i2v n ILE 21 N 0.23 0.00 -3.55 0.00 -5.35 -0.54 -1.22 119.36 108.93 2i2v n ILE 21 Ca 0.04 -0.21 -0.01 0.00 -0.27 0.00 0.00 62.75 62.30 2i2v n ILE 21 Cb 0.49 1.41 -0.06 0.00 -1.74 0.00 0.00 39.64 39.74 2i2v n ILE 21 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 2i2v s LYS 22 N -0.12 0.32 -0.46 6.28 2.47 -1.24 -4.86 119.74 122.13 2i2v s LYS 22 Ca 0.00 0.63 -0.23 0.00 -1.56 0.00 0.00 55.97 54.82 2i2v s LYS 22 Cb 0.00 0.20 0.03 0.00 -1.46 0.00 0.00 37.83 36.60 2i2v s LYS 22 CO 0.00 -0.08 0.77 0.08 0.16 0.00 0.00 175.35 176.27 2i2v s VAL 23 N 1.74 4.67 0.27 4.02 1.01 -1.26 -2.10 120.40 128.75 2i2v s VAL 23 Ca -0.06 0.32 -0.24 0.00 0.00 0.00 0.00 61.98 62.00 2i2v s VAL 23 Cb -0.04 -4.32 -0.09 0.00 0.00 0.00 0.00 36.38 31.93 2i2v s VAL 23 CO -0.16 -0.73 0.85 -0.76 0.00 0.00 0.00 175.10 174.30 2i2v s LEU 24 N 3.23 4.37 0.00 3.92 1.43 -1.25 -4.56 118.68 125.83 2i2v s LEU 24 Ca 0.28 1.67 0.00 0.00 -1.03 0.00 0.00 54.13 55.05 2i2v s LEU 24 Cb -0.13 -3.78 0.00 0.00 0.03 0.00 0.00 46.19 42.31 2i2v s LEU 24 CO 0.21 0.00 0.00 0.61 0.23 0.00 0.00 176.35 177.40 2i2v n GLY 25 N 0.74 1.01 0.00 -3.19 0.00 -1.26 -4.81 105.19 97.68 2i2v n GLY 25 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2i2v n GLY 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i2v n GLY 26 N 0.00 3.34 3.69 -0.02 0.00 -1.26 -5.02 105.19 105.92 2i2v n GLY 26 Ca 0.00 -1.01 -0.56 0.00 0.00 0.00 0.00 46.02 44.45 2i2v n GLY 26 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2i2v n SER 27 N 0.00 2.31 -0.05 1.61 3.41 -1.26 -1.27 113.62 118.37 2i2v n SER 27 Ca 0.00 1.08 -0.01 0.00 -0.26 0.00 0.00 58.87 59.68 2i2v n SER 27 Cb 0.00 -1.16 -0.00 0.00 -0.26 0.00 0.00 64.21 62.79 2i2v n SER 27 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2i2v n HIS 28 N 4.94 0.00 -1.64 7.33 8.25 -1.26 -4.95 115.22 127.90 2i2v n HIS 28 Ca 0.25 0.00 -0.50 0.00 -0.26 0.00 0.00 57.72 57.20 2i2v n HIS 28 Cb 0.15 -0.80 -0.06 0.00 1.12 0.00 0.00 29.99 30.40 2i2v n HIS 28 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 2i2v n ARG 29 N -1.66 1.74 0.00 -0.41 0.63 -0.40 -4.88 116.66 111.69 2i2v n ARG 29 Ca -0.01 0.61 0.00 0.00 -0.92 0.00 0.00 57.85 57.53 2i2v n ARG 29 Cb 0.19 -2.53 0.00 0.00 0.45 0.00 0.00 32.46 30.57 2i2v n ARG 29 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2i2v n ARG 30 N 6.82 0.00 -4.51 -0.14 5.12 -1.26 -4.80 116.66 117.89 2i2v n ARG 30 Ca 0.27 0.00 -0.25 0.00 -1.93 0.00 0.00 57.85 55.95 2i2v n ARG 30 Cb 0.26 -0.81 -0.10 0.00 -1.16 0.00 0.00 32.46 30.64 2i2v n ARG 30 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 2i2v s TYR 31 N -0.65 2.28 0.24 -1.55 2.02 -1.26 -4.02 117.35 114.40 2i2v s TYR 31 Ca 0.00 -0.56 0.04 0.00 -0.37 0.00 0.00 57.07 56.19 2i2v s TYR 31 Cb 0.00 -1.30 -0.05 0.00 -0.40 0.00 0.00 41.96 40.20 2i2v s TYR 31 CO 0.00 0.50 -0.02 0.00 -1.57 0.00 0.00 175.55 174.46 2i2v s ALA 32 N -2.72 1.91 0.00 3.71 0.00 -1.26 -4.78 121.76 118.62 2i2v s ALA 32 Ca 0.32 -1.78 0.00 0.00 0.00 0.00 0.00 51.96 50.50 2i2v s ALA 32 Cb 0.03 0.39 0.00 0.00 0.00 0.00 0.00 23.12 23.53 2i2v s ALA 32 CO 0.15 -0.20 0.00 0.41 0.00 0.00 0.00 175.76 176.13 2i2v n GLY 33 N -0.44 1.95 1.17 0.00 0.00 -1.26 -2.72 105.19 103.89 2i2v n GLY 33 Ca -0.06 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2i2v n GLY 33 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2i2v n VAL 34 N 0.00 0.00 -2.84 1.61 0.24 -1.26 -2.05 118.33 114.03 2i2v n VAL 34 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.19 2i2v n VAL 34 Cb 0.00 0.00 0.05 0.00 -1.47 0.00 0.00 33.84 32.42 2i2v n VAL 34 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2i2v n GLY 35 N 0.00 1.24 3.88 7.63 0.00 -1.24 -3.85 105.19 112.85 2i2v n GLY 35 Ca 0.00 -0.38 -0.21 0.00 0.00 0.00 0.00 46.02 45.44 2i2v n GLY 35 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2i2v s ASP 36 N -1.56 5.13 -0.04 1.61 1.01 -0.87 -4.81 116.67 117.14 2i2v s ASP 36 Ca 0.27 -0.69 -0.19 0.00 0.71 0.00 0.00 52.55 52.66 2i2v s ASP 36 Cb 0.29 -0.63 -0.05 0.00 1.01 0.00 0.00 42.92 43.54 2i2v s ASP 36 CO -0.08 -0.62 0.53 -0.63 0.21 0.00 0.00 175.17 174.58 2i2v s ILE 37 N -2.44 5.02 -0.03 0.77 -1.09 -1.26 -2.50 121.20 119.68 2i2v s ILE 37 Ca 0.48 1.09 -0.01 0.00 -2.23 0.00 0.00 60.65 59.98 2i2v s ILE 37 Cb -0.04 -3.86 0.02 0.00 -1.58 0.00 0.00 42.46 37.00 2i2v s ILE 37 CO 0.28 0.41 0.05 -0.63 -1.23 0.00 0.00 174.94 173.82 2i2v s ILE 38 N -0.02 -0.04 0.10 2.92 -1.09 0.34 -3.76 121.20 119.64 2i2v s ILE 38 Ca 0.28 0.14 -0.31 0.00 -2.23 0.00 0.00 60.65 58.53 2i2v s ILE 38 Cb -0.17 -0.10 -0.09 0.00 -1.58 0.00 0.00 42.46 40.52 2i2v s ILE 38 CO 0.14 0.06 1.66 -0.75 -1.23 0.00 0.00 174.94 174.82 2i2v s LYS 39 N 0.74 4.19 0.27 2.79 2.47 -0.89 0.76 119.74 130.06 2i2v s LYS 39 Ca -0.06 2.37 0.11 0.00 -1.56 0.00 0.00 55.97 56.84 2i2v s LYS 39 Cb -0.08 -3.51 -0.05 0.00 -1.46 0.00 0.00 37.83 32.73 2i2v s LYS 39 CO -0.02 -0.72 -0.19 0.42 0.16 0.00 0.00 175.35 175.00 2i2v s ILE 40 N 2.35 2.36 -0.21 5.43 1.09 -0.39 -1.47 121.20 130.36 2i2v s ILE 40 Ca 0.74 -2.37 -0.04 0.00 -1.10 0.00 0.00 60.65 57.88 2i2v s ILE 40 Cb -0.41 -2.29 0.07 0.00 -1.06 0.00 0.00 42.46 38.77 2i2v s ILE 40 CO 0.33 -0.41 0.09 -0.89 -0.10 0.00 0.00 174.94 173.95 2i2v s THR 41 N -2.58 0.10 0.16 2.92 2.01 0.14 -2.36 115.64 116.02 2i2v s THR 41 Ca 0.29 -0.46 -0.34 0.00 0.31 0.00 0.00 61.69 61.50 2i2v s THR 41 Cb -0.04 -0.83 -0.15 0.00 0.01 0.00 0.00 72.50 71.50 2i2v s THR 41 CO 0.14 -0.40 1.44 -0.38 -0.69 0.00 0.00 174.62 174.73 2i2v n ILE 42 N 5.20 0.29 -0.03 1.82 5.41 -0.83 -1.99 119.36 129.23 2i2v n ILE 42 Ca -0.07 -0.07 -0.03 0.00 1.00 0.00 0.00 62.75 63.58 2i2v n ILE 42 Cb 0.47 -1.28 -0.04 0.00 -0.71 0.00 0.00 39.64 38.07 2i2v n ILE 42 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2i2v n LYS 43 N 2.74 2.83 0.00 0.38 4.76 -0.99 -1.79 118.16 126.09 2i2v n LYS 43 Ca 0.16 0.00 -0.00 0.00 -2.87 0.00 0.00 58.31 55.60 2i2v n LYS 43 Cb 0.27 -1.15 -0.00 0.00 -1.84 0.00 0.00 35.03 32.31 2i2v n LYS 43 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2i2v n GLU 44 N -2.25 0.02 -1.41 1.97 1.02 -1.00 -4.87 120.64 114.12 2i2v n GLU 44 Ca -0.10 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.05 2i2v n GLU 44 Cb 0.68 -0.23 0.00 0.00 -0.02 0.00 0.00 31.44 31.87 2i2v n GLU 44 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2i2v n ALA 45 N -2.68 -1.85 -1.81 0.62 0.00 -1.14 -4.46 120.51 109.20 2i2v n ALA 45 Ca -0.01 0.41 -0.34 0.00 0.00 0.00 0.00 53.44 53.51 2i2v n ALA 45 Cb 0.02 -1.33 -0.05 0.00 0.00 0.00 0.00 19.45 18.09 2i2v n ALA 45 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2i2v s ILE 46 N -4.04 4.12 0.19 0.00 1.01 -1.26 -4.55 121.20 116.67 2i2v s ILE 46 Ca 0.00 1.35 -0.19 0.00 0.00 0.00 0.00 60.65 61.81 2i2v s ILE 46 Cb 0.00 -3.56 0.14 0.00 0.01 0.00 0.00 42.46 39.05 2i2v s ILE 46 CO 0.00 -0.26 1.60 1.55 0.00 0.00 0.00 174.94 177.83 2i2v h PRO 47 N 1.86 -0.14 0.00 2.79 0.13 -1.96 -3.41 132.00 131.27 2i2v h PRO 47 Ca -0.49 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2i2v h PRO 47 Cb 1.20 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2i2v h PRO 47 CO 0.60 -0.09 0.00 0.54 -0.23 0.00 0.00 178.00 178.82 2i2v n ARG 48 N -5.43 1.49 -0.13 0.86 1.74 -1.26 -5.03 116.66 108.89 2i2v n ARG 48 Ca 0.04 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 57.14 2i2v n ARG 48 Cb 0.34 0.00 -0.00 0.00 -1.02 0.00 0.00 32.46 31.78 2i2v n ARG 48 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2i2v n GLY 49 N 5.00 -1.44 0.02 -0.13 0.00 -1.26 -4.65 105.19 102.72 2i2v n GLY 49 Ca 0.00 -1.50 0.09 0.00 0.00 0.00 0.00 46.02 44.61 2i2v n GLY 49 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2i2v n LYS 50 N -1.53 0.65 -4.52 1.61 4.81 -1.26 -4.92 118.16 112.99 2i2v n LYS 50 Ca 0.00 -0.18 -0.31 0.00 -0.87 0.00 0.00 58.31 56.94 2i2v n LYS 50 Cb 0.06 -1.50 -0.11 0.00 0.02 0.00 0.00 35.03 33.50 2i2v n LYS 50 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2i2v s VAL 51 N -3.40 3.31 0.09 3.15 1.01 -1.26 -5.11 120.40 118.19 2i2v s VAL 51 Ca -0.08 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 60.96 2i2v s VAL 51 Cb 0.13 -2.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 2i2v s VAL 51 CO 0.87 0.35 -0.07 -1.59 0.00 0.00 0.00 175.10 174.67 2i2v s LYS 52 N -1.48 0.80 0.24 2.72 0.00 -1.26 -4.13 119.74 116.64 2i2v s LYS 52 Ca 0.16 -1.24 -0.27 0.00 0.00 0.00 0.00 55.97 54.62 2i2v s LYS 52 Cb -0.11 -0.25 -0.17 0.00 0.00 0.00 0.00 37.83 37.30 2i2v s LYS 52 CO 0.07 0.00 0.44 0.36 0.00 0.00 0.00 175.35 176.23 2i2v n LYS 53 N 0.21 0.01 0.00 1.78 0.00 -1.26 -1.85 118.16 117.05 2i2v n LYS 53 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.18 2i2v n LYS 53 Cb 0.60 -1.01 0.00 0.00 -0.00 0.00 0.00 35.03 34.62 2i2v n LYS 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2i2v n GLY 54 N 2.06 3.04 3.54 2.58 0.00 -0.74 -5.00 105.19 110.66 2i2v n GLY 54 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 2i2v n GLY 54 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2i2v n ASP 55 N 0.13 -0.69 -3.49 1.61 8.00 -0.77 -4.73 116.55 116.62 2i2v n ASP 55 Ca 0.00 0.46 -0.27 0.00 0.71 0.00 0.00 54.79 55.70 2i2v n ASP 55 Cb 0.00 -1.33 -0.10 0.00 -0.02 0.00 0.00 41.12 39.67 2i2v n ASP 55 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2i2v n VAL 56 N -3.38 -0.45 -0.64 2.53 0.31 -1.26 -1.97 118.33 113.47 2i2v n VAL 56 Ca 0.10 -3.84 0.00 0.00 -0.01 0.00 0.00 64.34 60.59 2i2v n VAL 56 Cb 0.52 -1.81 0.00 0.00 -0.91 0.00 0.00 33.84 31.64 2i2v n VAL 56 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2i2v n LEU 57 N 2.47 0.00 -3.98 7.52 4.77 -1.00 -4.88 117.00 121.90 2i2v n LEU 57 Ca 0.27 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 56.17 2i2v n LEU 57 Cb 0.45 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.46 2i2v n LEU 57 CO 0.14 0.00 -0.21 -1.59 -1.33 0.00 0.00 177.39 174.40 2i2v s LYS 58 N 3.62 0.79 0.29 3.23 -2.85 -1.26 -1.26 119.74 122.30 2i2v s LYS 58 Ca 0.00 -1.12 -0.10 0.00 -1.00 0.00 0.00 55.97 53.75 2i2v s LYS 58 Cb 0.00 0.29 0.00 0.00 -2.06 0.00 0.00 37.83 36.06 2i2v s LYS 58 CO 0.00 -0.22 0.51 0.00 0.10 0.00 0.00 175.35 175.74 2i2v s ALA 59 N -3.91 -0.02 -0.12 0.59 0.00 0.23 -3.04 121.76 115.49 2i2v s ALA 59 Ca 0.09 -1.04 0.01 0.00 0.00 0.00 0.00 51.96 51.02 2i2v s ALA 59 Cb 0.06 1.05 -0.01 0.00 0.00 0.00 0.00 23.12 24.23 2i2v s ALA 59 CO -0.09 -0.85 -0.17 0.14 0.00 0.00 0.00 175.76 174.79 2i2v s VAL 60 N -3.58 2.69 0.30 0.00 -7.23 -0.53 0.12 120.40 112.17 2i2v s VAL 60 Ca 0.24 -0.79 -0.29 0.00 -1.81 0.00 0.00 61.98 59.33 2i2v s VAL 60 Cb -0.01 -2.10 -0.10 0.00 0.56 0.00 0.00 36.38 34.73 2i2v s VAL 60 CO 0.12 0.54 1.37 -0.69 -0.31 0.00 0.00 175.10 176.13 2i2v s VAL 61 N 0.36 2.67 0.00 1.32 1.01 -1.04 -2.49 120.40 122.23 2i2v s VAL 61 Ca -0.14 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.47 2i2v s VAL 61 Cb -0.17 -3.40 0.00 0.00 0.00 0.00 0.00 36.38 32.82 2i2v s VAL 61 CO 0.07 0.13 0.00 0.52 0.00 0.00 0.00 175.10 175.81 2i2v n VAL 62 N 1.43 0.00 -3.34 2.92 0.31 -0.94 -3.68 118.33 115.02 2i2v n VAL 62 Ca 0.03 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.21 2i2v n VAL 62 Cb 0.41 -0.85 -0.07 0.00 -0.91 0.00 0.00 33.84 32.42 2i2v n VAL 62 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2i2v s ARG 63 N -1.86 0.65 0.77 5.55 3.00 -1.25 -4.58 118.95 121.21 2i2v s ARG 63 Ca 0.00 -0.74 -0.11 0.00 0.00 0.00 0.00 55.73 54.87 2i2v s ARG 63 Cb 0.00 -0.61 0.05 0.00 0.00 0.00 0.00 34.95 34.39 2i2v s ARG 63 CO 0.00 -1.19 1.10 0.95 0.00 0.00 0.00 175.30 176.16 2i2v s THR 64 N 1.53 3.20 0.03 0.02 -4.23 -1.26 -0.18 115.64 114.76 2i2v s THR 64 Ca 0.16 0.39 0.10 0.00 -1.18 0.00 0.00 61.69 61.17 2i2v s THR 64 Cb -0.14 -3.21 -0.20 0.00 1.34 0.00 0.00 72.50 70.29 2i2v s THR 64 CO -0.05 -0.51 1.01 0.50 -0.54 0.00 0.00 174.62 175.03 2i2v h LYS 65 N -0.95 0.00 0.60 3.99 3.64 -1.68 -3.13 116.57 119.03 2i2v h LYS 65 Ca -0.46 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 58.89 2i2v h LYS 65 Cb 1.26 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.09 2i2v h LYS 65 CO 0.61 0.73 -0.29 -0.22 -2.27 0.00 0.00 179.45 178.00 2i2v h LYS 66 N 0.00 -0.78 0.00 1.90 3.64 -1.89 -3.35 116.57 116.09 2i2v h LYS 66 Ca -0.13 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2i2v h LYS 66 Cb 1.84 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 33.84 2i2v h LYS 66 CO 0.10 -0.52 0.00 0.41 -2.27 0.00 0.00 179.45 177.17 2i2v n GLY 67 N -0.62 0.55 3.21 5.01 0.00 -1.26 -4.55 105.19 107.53 2i2v n GLY 67 Ca -0.10 -2.19 -0.13 0.00 0.00 0.00 0.00 46.02 43.60 2i2v n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2i2v s VAL 68 N -0.69 0.10 0.00 1.61 1.01 -0.00 -4.85 120.40 117.58 2i2v s VAL 68 Ca 0.00 -1.99 0.00 0.00 0.00 0.00 0.00 61.98 59.99 2i2v s VAL 68 Cb 0.00 -2.48 0.00 0.00 0.00 0.00 0.00 36.38 33.90 2i2v s VAL 68 CO 0.00 -0.04 0.00 -2.11 0.00 0.00 0.00 175.10 172.95 2i2v n ARG 69 N -0.29 0.00 0.00 2.72 1.85 -1.26 -0.09 116.66 119.59 2i2v n ARG 69 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.86 2i2v n ARG 69 Cb 0.66 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.07 2i2v n ARG 69 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2i2v n ARG 70 N -0.26 0.00 0.00 2.89 5.12 -1.26 -4.99 116.66 118.16 2i2v n ARG 70 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2i2v n ARG 70 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 2i2v n ARG 70 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 2i2v n PRO 71 N 0.00 0.00 -0.11 5.56 -0.02 -1.26 0.18 135.00 139.35 2i2v n PRO 71 Ca 0.00 0.00 0.26 0.00 -2.02 0.00 0.00 63.50 61.74 2i2v n PRO 71 Cb 0.00 0.00 0.57 0.00 -0.02 0.00 0.00 33.50 34.05 2i2v n PRO 71 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 2i2v h ASP 72 N 0.00 0.00 0.00 2.55 2.03 -2.06 -3.43 116.42 115.51 2i2v h ASP 72 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2i2v h ASP 72 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 2i2v h ASP 72 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.82 2i2v n GLY 73 N -1.63 1.12 3.74 7.15 0.00 0.47 -5.06 105.19 110.97 2i2v n GLY 73 Ca 0.18 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 2i2v n GLY 73 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2i2v s SER 74 N -2.40 6.47 -0.14 1.61 1.04 -1.26 -4.90 113.70 114.13 2i2v s SER 74 Ca 0.00 0.55 -0.12 0.00 0.48 0.00 0.00 55.95 56.86 2i2v s SER 74 Cb 0.00 -2.19 -0.05 0.00 0.10 0.00 0.00 66.02 63.88 2i2v s SER 74 CO 0.00 0.11 0.25 -0.69 0.98 0.00 0.00 173.24 173.89 2i2v s VAL 75 N 0.36 5.33 -0.35 5.02 1.01 -1.26 -4.13 120.40 126.38 2i2v s VAL 75 Ca 0.17 0.46 -0.06 0.00 0.00 0.00 0.00 61.98 62.55 2i2v s VAL 75 Cb -0.13 -3.57 0.05 0.00 0.00 0.00 0.00 36.38 32.73 2i2v s VAL 75 CO 0.05 0.47 0.12 -0.63 0.00 0.00 0.00 175.10 175.10 2i2v s ILE 76 N -0.05 3.74 0.25 2.22 1.01 0.87 -4.92 121.20 124.33 2i2v s ILE 76 Ca 0.16 -1.23 0.10 0.00 0.00 0.00 0.00 60.65 59.68 2i2v s ILE 76 Cb -0.13 -3.16 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 2i2v s ILE 76 CO 0.04 -0.24 -0.08 -0.13 0.00 0.00 0.00 174.94 174.54 2i2v s ARG 77 N 1.38 2.07 0.44 2.79 0.52 -1.26 -0.82 118.95 124.06 2i2v s ARG 77 Ca -0.01 -1.49 0.03 0.00 -0.52 0.00 0.00 55.73 53.75 2i2v s ARG 77 Cb -0.20 -2.05 -0.03 0.00 0.52 0.00 0.00 34.95 33.19 2i2v s ARG 77 CO 0.02 0.37 0.05 -0.06 0.02 0.00 0.00 175.30 175.70 2i2v s PHE 78 N -2.24 1.94 -0.67 -0.53 0.40 -1.18 -4.99 117.98 110.70 2i2v s PHE 78 Ca 0.30 -1.03 0.02 0.00 -0.60 0.00 0.00 56.93 55.62 2i2v s PHE 78 Cb -0.06 -1.43 0.16 0.00 0.51 0.00 0.00 43.02 42.20 2i2v s PHE 78 CO 0.17 0.05 0.46 0.16 0.70 0.00 0.00 175.22 176.77 2i2v s ASP 79 N -3.71 4.93 0.00 1.36 1.47 -1.26 -4.34 116.67 115.12 2i2v s ASP 79 Ca 0.20 -3.44 0.00 0.00 1.18 0.00 0.00 52.55 50.49 2i2v s ASP 79 Cb 0.04 -1.72 0.00 0.00 -0.34 0.00 0.00 42.92 40.90 2i2v s ASP 79 CO 0.11 -0.18 0.00 0.61 0.68 0.00 0.00 175.17 176.38 2i2v n GLY 80 N 2.58 2.90 3.09 2.12 0.00 -1.26 -5.03 105.19 109.59 2i2v n GLY 80 Ca 0.14 -1.80 -0.32 0.00 0.00 0.00 0.00 46.02 44.04 2i2v n GLY 80 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2i2v s ASN 81 N 0.00 3.72 0.39 1.61 0.01 -1.21 -2.49 114.94 116.97 2i2v s ASN 81 Ca 0.00 -1.00 -0.08 0.00 -0.71 0.00 0.00 52.86 51.07 2i2v s ASN 81 Cb 0.00 -1.48 -0.06 0.00 0.41 0.00 0.00 41.25 40.12 2i2v s ASN 81 CO 0.00 -0.10 0.72 0.00 -1.51 0.00 0.00 177.10 176.21 2i2v s ALA 82 N 1.22 3.43 0.33 0.60 0.00 0.75 -0.13 121.76 127.96 2i2v s ALA 82 Ca -0.02 -0.35 0.08 0.00 0.00 0.00 0.00 51.96 51.67 2i2v s ALA 82 Cb -0.16 -2.58 -0.03 0.00 0.00 0.00 0.00 23.12 20.35 2i2v s ALA 82 CO -0.09 -0.00 0.27 0.00 0.00 0.00 0.00 175.76 175.94 2i2v s VAL 84 N -3.32 -0.59 0.40 0.00 1.01 -1.04 -1.29 120.40 115.58 2i2v s VAL 84 Ca 0.38 0.00 -0.23 0.00 0.00 0.00 0.00 61.98 62.14 2i2v s VAL 84 Cb 0.02 -1.00 -0.10 0.00 0.00 0.00 0.00 36.38 35.30 2i2v s VAL 84 CO 0.27 0.00 0.97 -0.76 0.00 0.00 0.00 175.10 175.58 2i2v s LEU 85 N 2.57 4.07 -0.06 3.92 1.43 -1.26 -1.45 118.68 127.90 2i2v s LEU 85 Ca -0.02 1.81 -0.05 0.00 -1.03 0.00 0.00 54.13 54.83 2i2v s LEU 85 Cb -0.08 -4.35 0.02 0.00 0.03 0.00 0.00 46.19 41.81 2i2v s LEU 85 CO -0.17 -0.34 0.16 -1.48 0.23 0.00 0.00 176.35 174.74 2i2v s LEU 86 N -2.82 1.39 -0.18 1.79 2.34 -1.17 -1.44 118.68 118.59 2i2v s LEU 86 Ca 0.59 0.31 -0.34 0.00 0.06 0.00 0.00 54.13 54.75 2i2v s LEU 86 Cb -0.14 0.53 -0.11 0.00 -0.56 0.00 0.00 46.19 45.91 2i2v s LEU 86 CO 0.19 -0.06 1.98 -0.46 -1.06 0.00 0.00 176.35 176.95 2i2v n ASN 87 N 3.01 3.05 -0.07 1.48 6.94 -1.18 -4.39 115.26 124.10 2i2v n ASN 87 Ca -0.13 0.76 -0.02 0.00 -0.02 0.00 0.00 54.58 55.18 2i2v n ASN 87 Cb 0.59 -1.35 -0.02 0.00 -2.36 0.00 0.00 39.78 36.64 2i2v n ASN 87 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 2i2v n ASN 88 N 7.90 -0.17 -0.04 0.53 2.85 -1.26 -3.30 115.26 121.77 2i2v n ASN 88 Ca 0.28 1.05 0.13 0.00 -0.11 0.00 0.00 54.58 55.93 2i2v n ASN 88 Cb 0.28 -0.42 0.55 0.00 1.24 0.00 0.00 39.78 41.44 2i2v n ASN 88 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 2i2v h ASN 89 N 0.00 0.27 -1.54 1.20 -1.07 -2.01 -3.39 115.58 109.04 2i2v h ASN 89 Ca 0.03 0.01 -0.25 0.00 0.07 0.00 0.00 56.30 56.15 2i2v h ASN 89 Cb 0.07 -0.05 -0.26 0.00 -2.07 0.00 0.00 38.32 36.01 2i2v h ASN 89 CO -0.15 0.16 -0.60 -0.44 0.07 0.00 0.00 177.43 176.47 2i2v s SER 90 N -6.29 -0.04 0.00 6.14 0.01 -1.21 -5.16 113.70 107.14 2i2v s SER 90 Ca -0.07 -1.44 0.00 0.00 1.31 0.00 0.00 55.95 55.75 2i2v s SER 90 Cb 0.19 1.13 0.00 0.00 0.21 0.00 0.00 66.02 67.55 2i2v s SER 90 CO 0.74 -0.20 0.00 -0.62 0.41 0.00 0.00 173.24 173.57 2i2v n GLU 91 N 4.05 0.00 -0.39 12.44 -0.58 -1.23 -4.88 120.64 130.05 2i2v n GLU 91 Ca 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 2i2v n GLU 91 Cb 0.51 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.38 2i2v n GLU 91 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2i2v n GLN 92 N 0.00 -1.09 -1.60 3.49 1.13 -1.26 -4.58 117.38 113.46 2i2v n GLN 92 Ca 0.00 0.80 -0.52 0.00 -1.94 0.00 0.00 57.00 55.34 2i2v n GLN 92 Cb 0.00 -0.89 -0.06 0.00 0.11 0.00 0.00 30.24 29.40 2i2v n GLN 92 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 2i2v n PRO 93 N -0.56 1.19 -2.06 -1.09 -0.04 -1.26 -3.10 135.00 128.08 2i2v n PRO 93 Ca 0.00 0.43 -0.41 0.00 -0.04 0.00 0.00 63.50 63.47 2i2v n PRO 93 Cb 0.00 -2.08 -0.00 0.00 -0.04 0.00 0.00 33.50 31.38 2i2v n PRO 93 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 2i2v n ILE 94 N 2.74 4.46 -3.55 0.52 0.13 -0.52 -4.78 119.36 118.35 2i2v n ILE 94 Ca 0.19 -4.02 -0.02 0.00 -1.10 0.00 0.00 62.75 57.80 2i2v n ILE 94 Cb 0.19 -2.34 0.01 0.00 -0.84 0.00 0.00 39.64 36.66 2i2v n ILE 94 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2i2v n GLY 95 N 2.76 1.15 0.33 4.50 0.00 -1.26 -4.86 105.19 107.81 2i2v n GLY 95 Ca 0.51 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2i2v n GLY 95 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2i2v n THR 96 N -0.30 0.00 -3.31 2.61 -2.24 -1.26 -5.05 114.28 104.72 2i2v n THR 96 Ca -0.02 0.02 -0.38 0.00 -2.27 0.00 0.00 64.05 61.40 2i2v n THR 96 Cb 0.27 -0.75 -0.06 0.00 -2.10 0.00 0.00 70.33 67.69 2i2v n THR 96 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2i2v s ARG 97 N -0.37 4.28 -0.36 -0.78 1.81 -1.26 -5.02 118.95 117.25 2i2v s ARG 97 Ca 0.00 0.50 -0.12 0.00 -1.72 0.00 0.00 55.73 54.39 2i2v s ARG 97 Cb 0.00 -3.39 0.01 0.00 -0.45 0.00 0.00 34.95 31.12 2i2v s ARG 97 CO 0.00 0.26 0.22 0.42 -0.68 0.00 0.00 175.30 175.53 2i2v s ILE 98 N 0.26 4.87 0.21 1.52 1.09 -1.26 -4.05 121.20 123.84 2i2v s ILE 98 Ca 0.27 -0.60 -0.29 0.00 -1.10 0.00 0.00 60.65 58.92 2i2v s ILE 98 Cb -0.16 -3.63 -0.08 0.00 -1.06 0.00 0.00 42.46 37.53 2i2v s ILE 98 CO 0.12 -0.15 0.92 -0.36 -0.10 0.00 0.00 174.94 175.37 2i2v s PHE 99 N 1.63 3.95 0.00 3.97 0.40 0.16 -4.40 117.98 123.69 2i2v s PHE 99 Ca 0.04 1.86 0.00 0.00 -0.60 0.00 0.00 56.93 58.23 2i2v s PHE 99 Cb -0.18 -2.96 0.00 0.00 0.51 0.00 0.00 43.02 40.38 2i2v s PHE 99 CO 0.08 0.43 0.00 0.41 0.70 0.00 0.00 175.22 176.84 2i2v n GLY 100 N 1.63 -0.83 3.80 4.36 0.00 -1.26 -4.65 105.19 108.23 2i2v n GLY 100 Ca -0.02 -1.68 -0.29 0.00 0.00 0.00 0.00 46.02 44.03 2i2v n GLY 100 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2i2v s PRO 101 N -1.81 0.50 0.00 1.61 0.04 -1.26 -4.25 135.00 129.83 2i2v s PRO 101 Ca 0.00 -0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.00 2i2v s PRO 101 Cb 0.00 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.75 2i2v s PRO 101 CO 0.00 -2.57 0.00 1.33 0.04 0.00 0.00 177.00 175.80 2i2v n VAL 102 N -3.96 0.00 -4.10 -0.36 0.24 -1.21 -4.88 118.33 104.06 2i2v n VAL 102 Ca 0.11 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.29 2i2v n VAL 102 Cb 0.59 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.86 2i2v n VAL 102 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2i2v s THR 103 N -1.52 0.56 -1.09 3.34 -4.23 -1.10 -4.57 115.64 107.02 2i2v s THR 103 Ca 0.00 -1.41 0.14 0.00 -1.18 0.00 0.00 61.69 59.24 2i2v s THR 103 Cb 0.00 -1.02 0.14 0.00 1.34 0.00 0.00 72.50 72.96 2i2v s THR 103 CO 0.00 -0.60 1.43 -2.11 -0.54 0.00 0.00 174.62 172.81 2i2v n ARG 104 N 0.86 0.04 0.00 3.99 0.00 -1.24 -1.46 116.66 118.85 2i2v n ARG 104 Ca -0.19 0.24 0.10 0.00 -0.00 0.00 0.00 57.85 58.00 2i2v n ARG 104 Cb 0.57 -1.50 0.55 0.00 -0.00 0.00 0.00 32.46 32.08 2i2v n ARG 104 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 2i2v n GLU 105 N -1.46 0.41 0.00 2.89 4.71 -1.26 -1.52 120.64 124.42 2i2v n GLU 105 Ca 0.04 0.06 0.09 0.00 -0.01 0.00 0.00 57.16 57.34 2i2v n GLU 105 Cb 0.15 -1.50 -0.10 0.00 -1.01 0.00 0.00 31.44 28.99 2i2v n GLU 105 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 2i2v n LEU 106 N -1.19 0.99 -0.05 -4.62 7.94 -0.54 -4.32 117.00 115.21 2i2v n LEU 106 Ca 0.12 -0.53 0.00 0.00 -1.11 0.00 0.00 56.01 54.49 2i2v n LEU 106 Cb 0.13 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.08 2i2v n LEU 106 CO 0.14 0.24 0.19 -2.11 -1.11 0.00 0.00 177.39 174.74 2i2v n ARG 107 N -1.31 0.40 -0.80 1.96 1.85 -0.57 -4.18 116.66 114.01 2i2v n ARG 107 Ca 0.04 0.00 -0.25 0.00 -1.00 0.00 0.00 57.85 56.64 2i2v n ARG 107 Cb 0.31 -1.02 -0.02 0.00 -1.05 0.00 0.00 32.46 30.68 2i2v n ARG 107 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 2i2v n SER 108 N -0.42 4.82 0.00 2.89 3.41 -1.26 -4.84 113.62 118.22 2i2v n SER 108 Ca 0.00 -2.37 0.00 0.00 -0.26 0.00 0.00 58.87 56.24 2i2v n SER 108 Cb 0.01 -1.12 0.00 0.00 -0.26 0.00 0.00 64.21 62.84 2i2v n SER 108 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2i2v n GLU 109 N 4.45 0.00 0.00 4.33 4.71 -1.26 -3.40 120.64 129.47 2i2v n GLU 109 Ca 0.46 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.61 2i2v n GLU 109 Cb 0.16 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.59 2i2v n GLU 109 CO 0.00 0.00 0.00 0.36 0.09 0.00 0.00 177.13 177.58 2i2v n LYS 110 N 0.00 0.00 0.00 3.49 0.00 -1.26 0.42 118.16 120.81 2i2v n LYS 110 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2i2v n LYS 110 Cb 0.00 -1.34 0.00 0.00 -0.00 0.00 0.00 35.03 33.69 2i2v n LYS 110 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 2i2v n PHE 111 N -0.60 0.00 0.00 5.58 0.99 -1.22 -4.80 117.46 117.41 2i2v n PHE 111 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 2i2v n PHE 111 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.48 2i2v n PHE 111 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.76 175.43 2i2v n MET 112 N -1.79 0.00 -0.44 -1.08 2.81 0.17 -0.44 117.12 116.35 2i2v n MET 112 Ca 0.00 0.00 0.37 0.00 -1.81 0.00 0.00 57.70 56.26 2i2v n MET 112 Cb 0.42 0.00 0.65 0.00 -0.71 0.00 0.00 33.22 33.58 2i2v n MET 112 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 2i2v h LYS 113 N 0.00 0.04 0.01 0.03 1.63 -1.90 -0.25 116.57 116.12 2i2v h LYS 113 Ca 0.00 -0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2i2v h LYS 113 Cb 0.00 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.62 2i2v h LYS 113 CO 0.00 0.02 -0.00 0.97 -3.45 0.00 0.00 179.45 176.99 2i2v h ILE 114 N 0.04 1.62 -0.51 2.00 2.10 -1.15 -3.32 117.51 118.28 2i2v h ILE 114 Ca 0.86 -1.93 0.02 0.00 1.08 0.00 0.00 64.86 64.89 2i2v h ILE 114 Cb 2.63 2.91 -0.03 0.00 -1.09 0.00 0.00 36.82 41.24 2i2v h ILE 114 CO -0.51 0.49 0.34 0.16 -1.08 0.00 0.00 178.15 177.55 2i2v h ILE 115 N -0.84 1.09 -0.46 2.19 -0.00 -1.26 0.70 117.51 118.93 2i2v h ILE 115 Ca -0.00 -0.22 0.04 0.00 -0.00 0.00 0.00 64.86 64.68 2i2v h ILE 115 Cb 0.81 0.41 -0.03 0.00 -0.00 0.00 0.00 36.82 38.02 2i2v h ILE 115 CO 0.00 0.12 0.31 0.77 -0.00 0.00 0.00 178.15 179.34 2i2v h SER 116 N 0.63 0.41 -2.32 2.16 4.64 -1.48 -3.40 113.55 114.20 2i2v h SER 116 Ca 0.19 -0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.98 2i2v h SER 116 Cb 0.01 -0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 61.98 2i2v h SER 116 CO -0.05 0.28 1.31 -0.76 -0.87 0.00 0.00 176.83 176.74 2i2v s LEU 117 N -9.41 3.39 0.00 5.97 1.43 0.24 -4.89 118.68 115.40 2i2v s LEU 117 Ca -0.08 0.74 0.00 0.00 -1.03 0.00 0.00 54.13 53.76 2i2v s LEU 117 Cb 0.18 -2.96 0.00 0.00 0.03 0.00 0.00 46.19 43.44 2i2v s LEU 117 CO 0.73 -2.08 0.00 0.00 0.23 0.00 0.00 176.35 175.23 2i2v n ALA 118 N 11.65 0.00 0.09 4.21 0.00 -1.26 -4.64 120.51 130.57 2i2v n ALA 118 Ca 0.21 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.61 2i2v n ALA 118 Cb 0.50 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.93 2i2v n ALA 118 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2i2v h PRO 119 N 0.00 -0.25 0.00 0.00 0.11 -1.77 -3.49 132.00 126.60 2i2v h PRO 119 Ca 0.00 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.11 2i2v h PRO 119 Cb 0.00 0.06 0.01 0.00 0.11 0.00 0.00 31.00 31.17 2i2v h PRO 119 CO 0.00 -0.16 0.26 -1.91 -0.21 0.00 0.00 178.00 175.98 2i2v n GLU 120 N -3.07 0.96 0.00 1.05 2.13 -1.26 -4.93 120.64 115.52 2i2v n GLU 120 Ca -0.03 -1.90 0.00 0.00 0.66 0.00 0.00 57.16 55.89 2i2v n GLU 120 Cb 0.10 2.38 0.00 0.00 0.27 0.00 0.00 31.44 34.19 2i2v n GLU 120 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00