#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b5i n LEU 35 N 0.00 4.00 -4.68 1.53 4.77 -1.26 -4.94 117.00 116.43 2b5i n LEU 35 Ca 0.00 1.06 -0.40 0.00 -0.03 0.00 0.00 56.01 56.65 2b5i n LEU 35 Cb 0.00 -1.48 0.03 0.00 -2.33 0.00 0.00 43.42 39.63 2b5i n LEU 35 CO 0.00 -0.82 0.78 -2.65 -1.33 0.00 0.00 177.39 173.37 2b5i n PRO 36 N -0.13 1.55 -2.41 3.23 -0.02 -1.26 -4.96 135.00 130.99 2b5i n PRO 36 Ca 0.08 0.56 -0.41 0.00 -2.02 0.00 0.00 63.50 61.71 2b5i n PRO 36 Cb 0.41 -2.33 -0.04 0.00 -0.02 0.00 0.00 33.50 31.52 2b5i n PRO 36 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2b5i s GLU 37 N -2.46 4.54 -0.13 -0.52 2.12 -1.26 -5.00 118.70 116.00 2b5i s GLU 37 Ca 0.67 1.85 -0.17 0.00 0.36 0.00 0.00 54.97 57.68 2b5i s GLU 37 Cb -0.47 -3.22 -0.04 0.00 0.26 0.00 0.00 34.13 30.65 2b5i s GLU 37 CO 0.53 0.02 0.44 0.08 -0.54 0.00 0.00 175.26 175.79 2b5i s VAL 38 N -0.48 5.21 -0.20 3.70 1.01 -1.26 -4.46 120.40 123.93 2b5i s VAL 38 Ca 0.49 0.86 -0.03 0.00 0.00 0.00 0.00 61.98 63.31 2b5i s VAL 38 Cb -0.32 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.27 2b5i s VAL 38 CO 0.39 0.34 -0.06 0.00 0.00 0.00 0.00 175.10 175.77 2b5i s GLN 39 N 0.56 3.40 -0.15 2.72 -2.07 -0.18 -4.93 119.66 119.00 2b5i s GLN 39 Ca 0.24 -0.63 -0.05 0.00 -1.82 0.00 0.00 55.36 53.10 2b5i s GLN 39 Cb -0.15 -2.92 -0.03 0.00 -1.09 0.00 0.00 33.01 28.82 2b5i s GLN 39 CO 0.09 -0.08 0.01 0.00 -1.32 0.00 0.00 175.29 173.99 2b5i s PHE 41 N 0.08 1.36 -0.32 0.00 0.40 -0.22 -4.91 117.98 114.36 2b5i s PHE 41 Ca 0.02 -0.37 -0.14 0.00 -0.60 0.00 0.00 56.93 55.85 2b5i s PHE 41 Cb -0.13 -0.93 -0.02 0.00 0.51 0.00 0.00 43.02 42.45 2b5i s PHE 41 CO 0.02 -0.13 0.30 0.08 0.70 0.00 0.00 175.22 176.19 2b5i s VAL 42 N 0.09 5.22 -0.53 -0.44 1.01 -0.04 -1.76 120.40 123.96 2b5i s VAL 42 Ca -0.03 0.07 -0.19 0.00 0.00 0.00 0.00 61.98 61.82 2b5i s VAL 42 Cb -0.10 -3.73 0.07 0.00 0.00 0.00 0.00 36.38 32.62 2b5i s VAL 42 CO 0.01 0.02 0.65 -0.36 0.00 0.00 0.00 175.10 175.43 2b5i s PHE 43 N 1.90 3.03 -1.36 5.22 0.40 0.40 0.55 117.98 128.12 2b5i s PHE 43 Ca 0.10 -0.60 -0.01 0.00 -0.60 0.00 0.00 56.93 55.81 2b5i s PHE 43 Cb -0.17 -3.65 0.01 0.00 0.51 0.00 0.00 43.02 39.72 2b5i s PHE 43 CO 0.11 -1.10 0.11 -1.71 0.70 0.00 0.00 175.22 173.33 2b5i n ASN 44 N 6.26 -4.76 -3.32 1.36 4.05 0.18 -0.60 115.26 118.43 2b5i n ASN 44 Ca -0.07 0.03 -0.21 0.00 0.45 0.00 0.00 54.58 54.78 2b5i n ASN 44 Cb 0.45 -3.98 -0.01 0.00 1.23 0.00 0.00 39.78 37.47 2b5i n ASN 44 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 177.26 174.73 2b5i n VAL 45 N -3.75 -0.65 -0.04 3.44 0.31 -1.26 -4.86 118.33 111.53 2b5i n VAL 45 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 2b5i n VAL 45 Cb 0.63 -1.31 -0.11 0.00 -0.91 0.00 0.00 33.84 32.14 2b5i n VAL 45 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2b5i n GLU 46 N -3.49 1.10 -3.79 5.55 1.02 0.23 -4.94 120.64 116.32 2b5i n GLU 46 Ca -0.00 -0.07 0.01 0.00 -0.02 0.00 0.00 57.16 57.08 2b5i n GLU 46 Cb 0.53 -1.35 0.00 0.00 -0.02 0.00 0.00 31.44 30.60 2b5i n GLU 46 CO 0.00 0.00 0.00 1.52 1.18 0.00 0.00 177.13 179.83 2b5i s TYR 47 N -2.68 -0.01 -0.03 -0.32 -0.85 -1.23 -3.52 117.35 108.72 2b5i s TYR 47 Ca -0.06 -0.13 -0.00 0.00 -0.52 0.00 0.00 57.07 56.36 2b5i s TYR 47 Cb 0.07 0.57 0.03 0.00 0.38 0.00 0.00 41.96 43.00 2b5i s TYR 47 CO 0.59 -0.34 0.02 1.41 -1.52 0.00 0.00 175.55 175.71 2b5i s MET 48 N -2.27 0.17 -0.26 -3.49 -2.45 -0.46 -0.45 119.30 110.09 2b5i s MET 48 Ca 0.21 0.15 -0.13 0.00 -1.25 0.00 0.00 55.69 54.66 2b5i s MET 48 Cb 0.02 -0.44 -0.04 0.00 1.25 0.00 0.00 34.83 35.61 2b5i s MET 48 CO -0.02 -0.18 0.29 -0.80 1.05 0.00 0.00 175.02 175.36 2b5i s ASN 49 N 1.24 6.19 -0.24 1.11 0.01 -0.72 -0.71 114.94 121.81 2b5i s ASN 49 Ca -0.07 0.21 -0.06 0.00 -0.71 0.00 0.00 52.86 52.23 2b5i s ASN 49 Cb -0.13 -2.17 -0.02 0.00 0.41 0.00 0.00 41.25 39.34 2b5i s ASN 49 CO -0.02 -0.09 0.03 0.00 -1.51 0.00 0.00 177.10 175.51 2b5i s THR 51 N 1.57 1.78 -0.08 0.00 -4.23 -0.42 0.58 115.64 114.84 2b5i s THR 51 Ca 0.06 -2.18 -0.26 0.00 -1.18 0.00 0.00 61.69 58.13 2b5i s THR 51 Cb -0.15 -2.33 0.06 0.00 1.34 0.00 0.00 72.50 71.42 2b5i s THR 51 CO 0.01 -0.39 0.60 -1.66 -0.54 0.00 0.00 174.62 172.65 2b5i s TRP 52 N -2.93 -0.57 -0.32 3.99 -2.14 0.12 -1.01 118.94 116.07 2b5i s TRP 52 Ca 0.28 1.07 -0.18 0.00 2.66 0.00 0.00 56.10 59.92 2b5i s TRP 52 Cb 0.02 0.32 -0.01 0.00 -3.10 0.00 0.00 33.47 30.70 2b5i s TRP 52 CO 0.11 -0.52 0.53 -1.14 -2.66 0.00 0.00 176.95 173.27 2b5i s GLN 53 N -0.95 3.77 0.06 3.25 2.00 -1.26 -4.52 119.66 122.02 2b5i s GLN 53 Ca -0.10 0.03 0.24 0.00 -2.00 0.00 0.00 55.36 53.53 2b5i s GLN 53 Cb -0.02 -3.76 0.19 0.00 0.80 0.00 0.00 33.01 30.23 2b5i s GLN 53 CO 0.07 -0.57 1.16 0.45 -0.50 0.00 0.00 175.29 175.91 2b5i n SER 54 N 5.73 0.63 0.00 6.67 2.88 -1.26 -4.47 113.62 123.81 2b5i n SER 54 Ca -0.04 -0.15 0.02 0.00 -1.33 0.00 0.00 58.87 57.37 2b5i n SER 54 Cb 0.49 0.54 0.10 0.00 -0.75 0.00 0.00 64.21 64.59 2b5i n SER 54 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2b5i n SER 55 N -1.91 0.00 -2.11 -3.46 3.41 -1.26 -3.70 113.62 104.58 2b5i n SER 55 Ca 0.03 0.45 -0.18 0.00 -0.26 0.00 0.00 58.87 58.92 2b5i n SER 55 Cb 0.42 -0.46 -0.06 0.00 -0.26 0.00 0.00 64.21 63.85 2b5i n SER 55 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2b5i n SER 56 N -1.46 6.03 -3.64 4.04 3.41 -1.26 -4.81 113.62 115.93 2b5i n SER 56 Ca 0.01 -2.90 -0.12 0.00 -0.26 0.00 0.00 58.87 55.60 2b5i n SER 56 Cb 0.05 -1.23 -0.07 0.00 -0.26 0.00 0.00 64.21 62.70 2b5i n SER 56 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2b5i s GLU 57 N -0.86 0.79 0.71 4.33 2.02 -1.24 -5.05 118.70 119.41 2b5i s GLU 57 Ca 0.48 1.03 -0.15 0.00 0.02 0.00 0.00 54.97 56.35 2b5i s GLU 57 Cb 0.29 0.34 0.03 0.00 0.10 0.00 0.00 34.13 34.89 2b5i s GLU 57 CO -0.09 -0.11 1.19 -1.25 0.02 0.00 0.00 175.26 175.02 2b5i s PRO 58 N 0.65 2.28 0.12 0.39 0.04 -1.26 -4.58 135.00 132.63 2b5i s PRO 58 Ca -0.02 1.69 0.00 0.00 0.04 0.00 0.00 61.00 62.71 2b5i s PRO 58 Cb -0.05 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2b5i s PRO 58 CO -0.04 -1.71 0.00 1.04 0.04 0.00 0.00 177.00 176.33 2b5i n GLN 59 N -2.64 -5.44 -1.69 4.56 1.13 -1.26 -4.84 117.38 107.20 2b5i n GLN 59 Ca 0.13 3.88 -0.50 0.00 -1.94 0.00 0.00 57.00 58.57 2b5i n GLN 59 Cb 0.51 -4.53 -0.05 0.00 0.11 0.00 0.00 30.24 26.28 2b5i n GLN 59 CO 0.00 0.00 0.00 -2.30 -1.44 0.00 0.00 177.06 173.32 2b5i n PRO 60 N 1.93 2.00 -4.88 -1.09 -0.02 -1.26 -4.96 135.00 126.72 2b5i n PRO 60 Ca 0.00 0.73 -0.28 0.00 -2.02 0.00 0.00 63.50 61.93 2b5i n PRO 60 Cb 0.00 -2.55 -0.17 0.00 -0.02 0.00 0.00 33.50 30.76 2b5i n PRO 60 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2b5i s THR 61 N 3.87 1.56 -0.99 3.45 2.01 -1.26 -5.06 115.64 119.21 2b5i s THR 61 Ca 0.93 -0.73 -0.18 0.00 0.31 0.00 0.00 61.69 62.02 2b5i s THR 61 Cb -0.76 -1.38 0.13 0.00 0.01 0.00 0.00 72.50 70.50 2b5i s THR 61 CO 0.54 0.45 1.22 0.20 -0.69 0.00 0.00 174.62 176.34 2b5i s ASN 62 N 0.49 6.70 0.55 3.53 0.01 -1.26 -4.52 114.94 120.45 2b5i s ASN 62 Ca -0.16 -2.17 -0.21 0.00 -0.71 0.00 0.00 52.86 49.61 2b5i s ASN 62 Cb -0.17 -2.42 -0.05 0.00 0.41 0.00 0.00 41.25 39.03 2b5i s ASN 62 CO 0.06 -1.05 1.29 -0.76 -1.51 0.00 0.00 177.10 175.13 2b5i s LEU 63 N 2.73 3.82 0.22 0.60 1.02 -1.26 -4.52 118.68 121.29 2b5i s LEU 63 Ca 0.36 2.60 0.06 0.00 0.02 0.00 0.00 54.13 57.18 2b5i s LEU 63 Cb -0.04 -4.36 -0.04 0.00 0.02 0.00 0.00 46.19 41.77 2b5i s LEU 63 CO -0.07 -1.51 0.20 0.42 0.02 0.00 0.00 176.35 175.40 2b5i s THR 64 N -1.40 4.55 -0.10 5.49 -4.23 -0.85 -4.80 115.64 114.29 2b5i s THR 64 Ca 0.72 -1.26 0.04 0.00 -1.18 0.00 0.00 61.69 60.01 2b5i s THR 64 Cb -0.36 -3.42 -0.00 0.00 1.34 0.00 0.00 72.50 70.06 2b5i s THR 64 CO 0.42 -0.27 -0.23 -0.22 -0.54 0.00 0.00 174.62 173.77 2b5i s LEU 65 N -3.63 2.13 0.12 4.79 0.20 -1.26 -1.99 118.68 119.03 2b5i s LEU 65 Ca 0.32 -0.55 0.09 0.00 0.69 0.00 0.00 54.13 54.69 2b5i s LEU 65 Cb -0.09 -1.42 -0.04 0.00 -0.43 0.00 0.00 46.19 44.21 2b5i s LEU 65 CO 0.25 0.16 -0.23 -1.00 -0.29 0.00 0.00 176.35 175.24 2b5i s HIS 66 N 0.35 1.98 0.10 5.38 3.76 -0.53 -2.22 115.29 124.11 2b5i s HIS 66 Ca -0.18 -0.41 -0.03 0.00 -0.15 0.00 0.00 55.06 54.29 2b5i s HIS 66 Cb -0.18 -1.07 -0.03 0.00 1.11 0.00 0.00 32.58 32.41 2b5i s HIS 66 CO 0.08 0.26 0.08 1.52 -0.85 0.00 0.00 174.74 175.84 2b5i s TYR 67 N -1.18 0.54 0.03 1.40 -0.85 -0.49 -0.03 117.35 116.78 2b5i s TYR 67 Ca 0.10 -0.99 -0.27 0.00 -0.52 0.00 0.00 57.07 55.38 2b5i s TYR 67 Cb -0.10 -0.31 0.08 0.00 0.38 0.00 0.00 41.96 42.01 2b5i s TYR 67 CO 0.05 -0.50 0.69 1.67 -1.52 0.00 0.00 175.55 175.94 2b5i s TRP 68 N -3.96 -0.56 -0.50 -3.49 -2.14 -0.70 0.11 118.94 107.70 2b5i s TRP 68 Ca 0.13 0.69 -0.16 0.00 2.66 0.00 0.00 56.10 59.43 2b5i s TRP 68 Cb 0.07 0.48 0.09 0.00 -3.10 0.00 0.00 33.47 31.01 2b5i s TRP 68 CO -0.05 -0.68 0.43 0.71 -2.66 0.00 0.00 176.95 174.70 2b5i s TYR 69 N -2.39 3.24 0.16 1.66 1.51 -1.26 -1.00 117.35 119.28 2b5i s TYR 69 Ca -0.04 -1.03 -0.30 0.00 -1.01 0.00 0.00 57.07 54.68 2b5i s TYR 69 Cb -0.01 -3.38 -0.08 0.00 -0.11 0.00 0.00 41.96 38.39 2b5i s TYR 69 CO -0.02 -0.87 1.28 0.21 -1.11 0.00 0.00 175.55 175.05 2b5i s LYS 70 N 1.65 4.40 -1.14 -0.62 2.20 -0.12 -3.77 119.74 122.35 2b5i s LYS 70 Ca 0.04 1.98 -0.06 0.00 -0.36 0.00 0.00 55.97 57.56 2b5i s LYS 70 Cb -0.26 -3.24 0.01 0.00 -1.51 0.00 0.00 37.83 32.83 2b5i s LYS 70 CO 0.06 -0.25 0.99 0.09 -0.36 0.00 0.00 175.35 175.87 2b5i n ASN 71 N 3.05 -5.09 -0.82 1.43 3.02 -1.26 -4.36 115.26 111.22 2b5i n ASN 71 Ca 0.07 -0.48 0.00 0.00 -0.03 0.00 0.00 54.58 54.15 2b5i n ASN 71 Cb 0.44 -4.41 0.00 0.00 -0.61 0.00 0.00 39.78 35.19 2b5i n ASN 71 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2b5i n SER 72 N -2.47 0.00 -4.77 6.41 2.88 -1.25 -5.02 113.62 109.40 2b5i n SER 72 Ca -0.04 -0.82 -0.36 0.00 -1.33 0.00 0.00 58.87 56.32 2b5i n SER 72 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 2b5i n SER 72 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2b5i s ASP 73 N -0.58 5.81 -0.46 -3.46 1.01 -1.26 -4.14 116.67 113.59 2b5i s ASP 73 Ca 0.00 2.27 -0.30 0.00 0.71 0.00 0.00 52.55 55.23 2b5i s ASP 73 Cb 0.00 -2.59 0.04 0.00 1.01 0.00 0.00 42.92 41.38 2b5i s ASP 73 CO 0.00 -1.16 0.64 -3.20 0.21 0.00 0.00 175.17 171.66 2b5i n ASN 74 N -1.03 -6.37 -0.36 0.27 5.15 -1.26 -4.93 115.26 106.72 2b5i n ASN 74 Ca 0.10 0.06 0.06 0.00 -0.60 0.00 0.00 54.58 54.20 2b5i n ASN 74 Cb 0.50 -3.00 0.13 0.00 -0.53 0.00 0.00 39.78 36.87 2b5i n ASN 74 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 2b5i n ASP 75 N -0.30 2.72 -4.75 1.20 2.03 -1.26 -4.38 116.55 111.81 2b5i n ASP 75 Ca -0.02 -2.50 -0.34 0.00 0.52 0.00 0.00 54.79 52.45 2b5i n ASP 75 Cb 0.61 -0.28 0.06 0.00 -0.72 0.00 0.00 41.12 40.78 2b5i n ASP 75 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2b5i s LYS 76 N -1.88 2.61 -0.13 -0.67 -0.14 -1.26 -4.63 119.74 113.65 2b5i s LYS 76 Ca 0.23 1.56 -0.29 0.00 -1.36 0.00 0.00 55.97 56.10 2b5i s LYS 76 Cb 0.17 -1.91 -0.01 0.00 -1.68 0.00 0.00 37.83 34.40 2b5i s LYS 76 CO 0.06 -1.43 1.11 0.08 -0.76 0.00 0.00 175.35 174.41 2b5i s VAL 77 N -2.14 4.53 -0.04 3.17 1.01 -1.26 -4.56 120.40 121.11 2b5i s VAL 77 Ca 0.70 1.83 -0.02 0.00 0.00 0.00 0.00 61.98 64.50 2b5i s VAL 77 Cb -0.24 -4.18 -0.04 0.00 0.00 0.00 0.00 36.38 31.92 2b5i s VAL 77 CO 0.41 -0.06 0.08 -1.10 0.00 0.00 0.00 175.10 174.44 2b5i s GLN 78 N 2.54 3.14 0.22 2.72 -1.52 0.12 -4.95 119.66 121.93 2b5i s GLN 78 Ca 0.51 -0.40 -0.06 0.00 -1.95 0.00 0.00 55.36 53.45 2b5i s GLN 78 Cb -0.20 -2.92 -0.06 0.00 -0.22 0.00 0.00 33.01 29.61 2b5i s GLN 78 CO 0.16 0.68 0.49 0.15 -0.25 0.00 0.00 175.29 176.52 2b5i s LYS 79 N -1.49 3.69 0.16 2.91 1.02 -1.26 -1.39 119.74 123.37 2b5i s LYS 79 Ca 0.20 0.06 -0.24 0.00 0.02 0.00 0.00 55.97 56.02 2b5i s LYS 79 Cb -0.12 -2.71 0.04 0.00 -0.52 0.00 0.00 37.83 34.52 2b5i s LYS 79 CO 0.11 0.33 1.60 0.00 -0.92 0.00 0.00 175.35 176.47 2b5i n SER 81 N -5.41 0.00 -3.33 0.00 2.88 -1.26 -4.81 113.62 101.69 2b5i n SER 81 Ca -0.00 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.33 2b5i n SER 81 Cb 0.33 -0.19 -0.08 0.00 -0.75 0.00 0.00 64.21 63.52 2b5i n SER 81 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 2b5i s HIS 82 N -0.74 0.14 0.27 0.66 2.46 -1.26 -5.09 115.29 111.73 2b5i s HIS 82 Ca 0.00 -1.37 -0.29 0.00 0.47 0.00 0.00 55.06 53.87 2b5i s HIS 82 Cb 0.00 -0.57 -0.09 0.00 -0.13 0.00 0.00 32.58 31.79 2b5i s HIS 82 CO 0.00 -0.94 0.98 0.71 -2.47 0.00 0.00 174.74 173.03 2b5i s TYR 83 N 0.92 3.81 -0.01 3.88 1.51 -1.26 -1.56 117.35 124.65 2b5i s TYR 83 Ca 0.23 1.84 -0.02 0.00 -1.01 0.00 0.00 57.07 58.10 2b5i s TYR 83 Cb -0.10 -3.05 -0.04 0.00 -0.11 0.00 0.00 41.96 38.66 2b5i s TYR 83 CO -0.07 0.14 0.15 -0.51 -1.11 0.00 0.00 175.55 174.16 2b5i s LEU 84 N -1.46 4.24 0.06 -1.29 1.02 0.16 -4.90 118.68 116.51 2b5i s LEU 84 Ca 0.44 0.29 0.07 0.00 0.02 0.00 0.00 54.13 54.95 2b5i s LEU 84 Cb -0.26 -2.52 -0.03 0.00 0.02 0.00 0.00 46.19 43.40 2b5i s LEU 84 CO 0.32 0.27 -0.19 -0.36 0.02 0.00 0.00 176.35 176.41 2b5i s PHE 85 N -1.29 1.68 -0.08 0.29 0.40 -1.26 -1.34 117.98 116.37 2b5i s PHE 85 Ca 0.26 -0.38 -0.00 0.00 -0.60 0.00 0.00 56.93 56.21 2b5i s PHE 85 Cb -0.12 -0.98 0.02 0.00 0.51 0.00 0.00 43.02 42.45 2b5i s PHE 85 CO 0.17 0.10 -0.05 0.45 0.70 0.00 0.00 175.22 176.60 2b5i s SER 86 N -1.33 1.75 -1.41 1.36 0.15 0.25 -4.81 113.70 109.66 2b5i s SER 86 Ca 0.06 -0.20 -0.05 0.00 0.70 0.00 0.00 55.95 56.46 2b5i s SER 86 Cb -0.09 -0.64 0.03 0.00 -1.71 0.00 0.00 66.02 63.61 2b5i s SER 86 CO 0.02 -0.12 0.74 -0.62 1.20 0.00 0.00 173.24 174.47 2b5i n GLU 87 N 4.77 -4.77 -2.12 5.44 1.02 -1.26 -1.99 120.64 121.72 2b5i n GLU 87 Ca -0.14 0.57 -0.19 0.00 -0.02 0.00 0.00 57.16 57.39 2b5i n GLU 87 Cb 0.50 -5.16 -0.03 0.00 -0.02 0.00 0.00 31.44 26.73 2b5i n GLU 87 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2b5i n GLU 88 N -4.42 -1.44 -4.02 3.49 1.02 -1.26 -4.98 120.64 109.02 2b5i n GLU 88 Ca -0.18 0.98 -0.15 0.00 -0.02 0.00 0.00 57.16 57.78 2b5i n GLU 88 Cb 0.63 -5.45 -0.15 0.00 -0.02 0.00 0.00 31.44 26.45 2b5i n GLU 88 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2b5i s ILE 89 N -2.87 0.25 0.19 -3.67 1.01 -0.84 -5.02 121.20 110.25 2b5i s ILE 89 Ca 0.00 -0.08 -0.33 0.00 0.00 0.00 0.00 60.65 60.25 2b5i s ILE 89 Cb 0.00 -0.25 -0.14 0.00 0.01 0.00 0.00 42.46 42.08 2b5i s ILE 89 CO 0.00 0.10 1.39 0.35 0.00 0.00 0.00 174.94 176.77 2b5i n THR 90 N 3.36 0.65 -0.00 2.92 -2.24 -1.26 -0.58 114.28 117.13 2b5i n THR 90 Ca -0.17 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 2b5i n THR 90 Cb 0.56 -1.29 0.00 0.00 -2.10 0.00 0.00 70.33 67.50 2b5i n THR 90 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2b5i n SER 91 N 2.42 0.00 -3.38 3.42 2.88 -0.45 -4.65 113.62 113.86 2b5i n SER 91 Ca 0.14 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.68 2b5i n SER 91 Cb 0.28 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.76 2b5i n SER 91 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2b5i n GLY 92 N 0.00 0.46 2.92 0.46 0.00 -1.14 0.15 105.19 108.05 2b5i n GLY 92 Ca 0.00 -1.09 -0.12 0.00 0.00 0.00 0.00 46.02 44.81 2b5i n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b5i s GLN 94 N -0.05 3.37 -0.14 0.00 0.74 -0.60 -0.33 119.66 122.65 2b5i s GLN 94 Ca -0.01 -0.63 -0.10 0.00 0.05 0.00 0.00 55.36 54.67 2b5i s GLN 94 Cb -0.01 -2.98 -0.05 0.00 1.10 0.00 0.00 33.01 31.08 2b5i s GLN 94 CO 0.00 -0.17 0.20 -0.51 -0.55 0.00 0.00 175.29 174.26 2b5i s LEU 95 N 1.40 4.31 0.67 3.68 1.43 0.11 -4.52 118.68 125.75 2b5i s LEU 95 Ca 0.05 0.45 -0.11 0.00 -1.03 0.00 0.00 54.13 53.49 2b5i s LEU 95 Cb -0.14 -2.21 -0.01 0.00 0.03 0.00 0.00 46.19 43.86 2b5i s LEU 95 CO -0.03 0.25 1.06 -1.10 0.23 0.00 0.00 176.35 176.76 2b5i s GLN 96 N -0.22 3.19 0.29 1.70 -0.21 -1.26 -1.35 119.66 121.79 2b5i s GLN 96 Ca 0.14 0.62 0.00 0.00 0.02 0.00 0.00 55.36 56.15 2b5i s GLN 96 Cb -0.12 -2.04 0.68 0.00 1.00 0.00 0.00 33.01 32.52 2b5i s GLN 96 CO 0.03 -0.84 1.62 -0.22 -2.12 0.00 0.00 175.29 173.76 2b5i h LYS 97 N -0.51 0.11 0.00 2.91 3.64 -1.92 0.31 116.57 121.11 2b5i h LYS 97 Ca -0.44 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 2b5i h LYS 97 Cb 1.22 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 2b5i h LYS 97 CO 0.63 0.07 0.00 1.63 -2.27 0.00 0.00 179.45 179.51 2b5i n LYS 98 N -5.34 0.19 0.00 1.90 4.01 -1.26 -1.21 118.16 116.44 2b5i n LYS 98 Ca 0.21 0.46 0.13 0.00 -0.51 0.00 0.00 58.31 58.59 2b5i n LYS 98 Cb 0.67 -1.89 0.40 0.00 -0.51 0.00 0.00 35.03 33.70 2b5i n LYS 98 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 2b5i n GLU 99 N -2.25 0.69 -3.62 1.97 1.02 0.11 -4.87 120.64 113.69 2b5i n GLU 99 Ca 0.02 -0.38 -0.37 0.00 -0.02 0.00 0.00 57.16 56.41 2b5i n GLU 99 Cb 0.20 -1.49 -0.10 0.00 -0.02 0.00 0.00 31.44 30.03 2b5i n GLU 99 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2b5i s ILE 100 N -2.58 5.33 -0.42 -3.67 1.01 -0.35 -4.98 121.20 115.55 2b5i s ILE 100 Ca 0.23 0.22 0.02 0.00 0.00 0.00 0.00 60.65 61.12 2b5i s ILE 100 Cb 0.19 -3.53 0.13 0.00 0.01 0.00 0.00 42.46 39.26 2b5i s ILE 100 CO 0.54 0.31 0.21 -1.00 0.00 0.00 0.00 174.94 175.00 2b5i s HIS 101 N 1.26 2.10 1.03 3.97 3.76 -1.26 -5.02 115.29 121.13 2b5i s HIS 101 Ca 0.08 -2.40 -0.12 0.00 -0.15 0.00 0.00 55.06 52.48 2b5i s HIS 101 Cb -0.14 -1.97 0.18 0.00 1.11 0.00 0.00 32.58 31.76 2b5i s HIS 101 CO 0.06 -0.80 0.91 1.28 -0.85 0.00 0.00 174.74 175.34 2b5i n LEU 102 N 3.75 0.74 0.00 0.89 4.77 -1.26 -2.80 117.00 123.08 2b5i n LEU 102 Ca 0.06 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 2b5i n LEU 102 Cb 0.36 -1.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.12 2b5i n LEU 102 CO 0.23 -2.82 0.00 -1.22 -1.33 0.00 0.00 177.39 172.24 2b5i n TYR 103 N -4.45 0.00 -4.76 -1.77 0.53 -1.26 -4.94 117.16 100.51 2b5i n TYR 103 Ca 0.07 0.00 -0.33 0.00 -1.02 0.00 0.00 57.90 56.62 2b5i n TYR 103 Cb 0.54 -0.28 -0.15 0.00 -1.03 0.00 0.00 39.34 38.42 2b5i n TYR 103 CO 0.00 0.00 0.00 -0.65 -1.02 0.00 0.00 176.86 175.19 2b5i s GLN 104 N 0.00 3.31 -0.12 -0.72 -0.21 -1.12 -5.07 119.66 115.73 2b5i s GLN 104 Ca 0.00 -0.72 -0.32 0.00 0.02 0.00 0.00 55.36 54.34 2b5i s GLN 104 Cb 0.00 -2.60 -0.09 0.00 1.00 0.00 0.00 33.01 31.32 2b5i s GLN 104 CO 0.00 0.16 2.03 2.41 -2.12 0.00 0.00 175.29 177.76 2b5i n THR 105 N 3.67 0.54 -3.58 -0.19 -1.04 -1.26 -4.69 114.28 107.72 2b5i n THR 105 Ca -0.18 -0.22 -0.38 0.00 -2.04 0.00 0.00 64.05 61.23 2b5i n THR 105 Cb 0.52 -2.14 -0.10 0.00 -1.82 0.00 0.00 70.33 66.79 2b5i n THR 105 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 2b5i s PHE 106 N 5.58 3.27 -0.21 -1.42 5.36 -0.43 -0.94 117.98 129.20 2b5i s PHE 106 Ca 0.96 0.22 -0.04 0.00 -0.96 0.00 0.00 56.93 57.11 2b5i s PHE 106 Cb -0.55 -2.37 -0.02 0.00 -0.34 0.00 0.00 43.02 39.74 2b5i s PHE 106 CO 0.45 -0.08 -0.03 0.08 -1.46 0.00 0.00 175.22 174.18 2b5i s VAL 107 N 1.51 3.59 -0.06 3.12 1.01 -0.17 0.73 120.40 130.12 2b5i s VAL 107 Ca 0.09 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.64 2b5i s VAL 107 Cb -0.15 -2.62 -0.03 0.00 0.00 0.00 0.00 36.38 33.58 2b5i s VAL 107 CO 0.08 0.43 -0.05 0.68 0.00 0.00 0.00 175.10 176.24 2b5i s VAL 108 N 1.24 3.84 -0.09 2.92 -7.23 -0.40 -1.73 120.40 118.95 2b5i s VAL 108 Ca 0.03 -0.45 0.01 0.00 -1.81 0.00 0.00 61.98 59.75 2b5i s VAL 108 Cb -0.14 -2.59 0.02 0.00 0.56 0.00 0.00 36.38 34.23 2b5i s VAL 108 CO -0.01 0.58 -0.10 -1.58 -0.31 0.00 0.00 175.10 173.69 2b5i s GLN 109 N -0.89 1.61 -0.08 4.82 0.74 0.95 -0.94 119.66 125.86 2b5i s GLN 109 Ca 0.13 -0.32 -0.11 0.00 0.05 0.00 0.00 55.36 55.11 2b5i s GLN 109 Cb -0.11 -1.52 -0.05 0.00 1.10 0.00 0.00 33.01 32.43 2b5i s GLN 109 CO 0.02 -0.15 0.26 -0.51 -0.55 0.00 0.00 175.29 174.36 2b5i s LEU 110 N 1.28 4.40 -0.03 3.68 1.43 0.34 -1.45 118.68 128.32 2b5i s LEU 110 Ca -0.03 0.65 0.01 0.00 -1.03 0.00 0.00 54.13 53.73 2b5i s LEU 110 Cb -0.14 -2.31 0.02 0.00 0.03 0.00 0.00 46.19 43.80 2b5i s LEU 110 CO -0.04 0.33 -0.01 -1.58 0.23 0.00 0.00 176.35 175.28 2b5i s GLN 111 N -0.79 0.42 -0.12 1.70 2.00 -0.84 -1.16 119.66 120.87 2b5i s GLN 111 Ca 0.18 0.02 -0.29 0.00 -2.00 0.00 0.00 55.36 53.27 2b5i s GLN 111 Cb -0.14 -0.55 -0.03 0.00 0.80 0.00 0.00 33.01 33.09 2b5i s GLN 111 CO 0.07 -0.11 1.47 0.34 -0.50 0.00 0.00 175.29 176.57 2b5i s ASP 112 N 0.94 6.77 0.48 6.67 -1.08 -0.53 -2.02 116.67 127.90 2b5i s ASP 112 Ca -0.10 1.93 0.27 0.00 -0.52 0.00 0.00 52.55 54.13 2b5i s ASP 112 Cb -0.13 -2.54 1.15 0.00 -1.46 0.00 0.00 42.92 39.94 2b5i s ASP 112 CO -0.01 -0.88 1.92 1.55 0.52 0.00 0.00 175.17 178.27 2b5i h PRO 113 N 9.04 0.00 0.00 4.34 0.13 -1.91 -3.07 132.00 140.53 2b5i h PRO 113 Ca -0.33 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.56 2b5i h PRO 113 Cb 1.14 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.23 2b5i h PRO 113 CO 0.97 0.16 -1.56 0.00 -0.23 0.00 0.00 178.00 177.34 2b5i h ARG 114 N 0.00 0.00 -3.53 0.86 3.08 -1.94 -3.45 114.38 109.41 2b5i h ARG 114 Ca -0.00 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.53 2b5i h ARG 114 Cb 0.60 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.25 2b5i h ARG 114 CO 0.02 0.42 -0.76 -1.83 -1.07 0.00 0.00 179.97 176.75 2b5i s GLU 115 N -2.73 0.63 0.36 0.04 -1.05 -1.16 -5.03 118.70 109.75 2b5i s GLU 115 Ca -0.04 -0.43 0.09 0.00 -0.15 0.00 0.00 54.97 54.44 2b5i s GLU 115 Cb 0.08 -2.10 0.81 0.00 -0.44 0.00 0.00 34.13 32.48 2b5i s GLU 115 CO 0.82 -0.65 1.88 -1.35 0.95 0.00 0.00 175.26 176.90 2b5i h PRO 116 N 8.25 0.68 0.00 -4.83 0.11 -1.88 -2.45 132.00 131.89 2b5i h PRO 116 Ca -0.16 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.87 2b5i h PRO 116 Cb 1.12 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 2b5i h PRO 116 CO 0.34 0.45 -0.18 0.00 -0.21 0.00 0.00 178.00 178.40 2b5i h ARG 117 N 0.70 0.00 -5.21 1.05 2.47 -1.96 -3.34 114.38 108.09 2b5i h ARG 117 Ca 0.43 0.00 -0.70 0.00 -1.26 0.00 0.00 59.98 58.45 2b5i h ARG 117 Cb 0.67 0.00 -0.10 0.00 -1.65 0.00 0.00 29.97 28.89 2b5i h ARG 117 CO -0.19 0.18 2.17 -2.13 0.56 0.00 0.00 179.97 180.56 2b5i n ARG 118 N -3.42 3.20 -4.51 0.04 0.63 -0.92 -4.92 116.66 106.76 2b5i n ARG 118 Ca -0.00 -3.31 -0.24 0.00 -0.92 0.00 0.00 57.85 53.38 2b5i n ARG 118 Cb 0.37 -3.34 -0.14 0.00 0.45 0.00 0.00 32.46 29.80 2b5i n ARG 118 CO 0.00 0.00 0.00 1.14 -2.51 0.00 0.00 177.63 176.26 2b5i s GLN 119 N 3.30 1.22 -0.02 -0.14 -2.07 -1.26 -1.45 119.66 119.25 2b5i s GLN 119 Ca 0.50 -0.92 0.03 0.00 -1.82 0.00 0.00 55.36 53.15 2b5i s GLN 119 Cb 0.04 -1.33 -0.00 0.00 -1.09 0.00 0.00 33.01 30.64 2b5i s GLN 119 CO 0.03 0.33 -0.10 0.00 -1.32 0.00 0.00 175.29 174.23 2b5i s ALA 120 N -0.87 0.92 0.04 2.60 0.00 -0.31 -4.99 121.76 119.15 2b5i s ALA 120 Ca 0.06 -0.40 0.07 0.00 0.00 0.00 0.00 51.96 51.68 2b5i s ALA 120 Cb -0.09 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.71 2b5i s ALA 120 CO 0.02 0.18 -0.19 0.95 0.00 0.00 0.00 175.76 176.72 2b5i s THR 121 N 0.03 1.51 -0.03 0.00 -4.23 -1.26 -0.51 115.64 111.16 2b5i s THR 121 Ca -0.01 -1.10 0.04 0.00 -1.18 0.00 0.00 61.69 59.44 2b5i s THR 121 Cb -0.07 -1.32 -0.00 0.00 1.34 0.00 0.00 72.50 72.44 2b5i s THR 121 CO 0.00 0.18 -0.16 -1.10 -0.54 0.00 0.00 174.62 173.00 2b5i s GLN 122 N -1.08 1.61 -0.22 3.99 -0.21 -0.12 -4.98 119.66 118.64 2b5i s GLN 122 Ca 0.06 -0.58 -0.17 0.00 0.02 0.00 0.00 55.36 54.69 2b5i s GLN 122 Cb -0.08 -1.44 -0.04 0.00 1.00 0.00 0.00 33.01 32.45 2b5i s GLN 122 CO 0.01 0.26 0.44 -1.64 -2.12 0.00 0.00 175.29 172.25 2b5i s MET 123 N -0.05 4.14 0.06 2.91 -1.94 -1.26 -1.28 119.30 121.88 2b5i s MET 123 Ca -0.01 0.25 0.08 0.00 -1.71 0.00 0.00 55.69 54.31 2b5i s MET 123 Cb -0.10 -3.58 -0.03 0.00 2.01 0.00 0.00 34.83 33.13 2b5i s MET 123 CO 0.01 -0.15 -0.23 -0.51 -0.01 0.00 0.00 175.02 174.13 2b5i s LEU 124 N 1.66 2.20 -0.41 -0.03 1.43 0.22 -4.99 118.68 118.77 2b5i s LEU 124 Ca 0.20 -0.59 -0.11 0.00 -1.03 0.00 0.00 54.13 52.60 2b5i s LEU 124 Cb -0.15 -1.08 0.06 0.00 0.03 0.00 0.00 46.19 45.05 2b5i s LEU 124 CO 0.09 0.18 0.25 -0.54 0.23 0.00 0.00 176.35 176.56 2b5i s LYS 125 N -1.39 2.74 0.48 1.70 1.02 -1.26 -1.31 119.74 121.71 2b5i s LYS 125 Ca 0.09 -1.29 0.31 0.00 0.02 0.00 0.00 55.97 55.11 2b5i s LYS 125 Cb -0.09 -3.80 1.31 0.00 -0.52 0.00 0.00 37.83 34.72 2b5i s LYS 125 CO 0.03 -0.86 1.93 -0.07 -0.92 0.00 0.00 175.35 175.46 2b5i h LEU 126 N 8.46 0.00 0.00 3.17 3.38 -1.88 -2.09 115.31 126.35 2b5i h LEU 126 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2b5i h LEU 126 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 2b5i h LEU 126 CO 0.73 0.00 -0.09 0.00 0.09 0.00 0.00 178.44 179.18 2b5i n GLN 127 N -2.86 0.17 -0.05 1.13 0.00 -1.26 -2.43 117.38 112.08 2b5i n GLN 127 Ca 0.01 0.12 0.12 0.00 0.00 0.00 0.00 57.00 57.25 2b5i n GLN 127 Cb 0.27 -1.68 0.43 0.00 0.00 0.00 0.00 30.24 29.26 2b5i n GLN 127 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2b5i n ASN 128 N -1.97 1.70 -0.04 2.61 3.02 -0.79 -3.35 115.26 116.44 2b5i n ASN 128 Ca 0.06 -1.64 0.01 0.00 -0.03 0.00 0.00 54.58 52.99 2b5i n ASN 128 Cb 0.40 -0.06 0.02 0.00 -0.61 0.00 0.00 39.78 39.53 2b5i n ASN 128 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2b5i n LEU 129 N 0.33 1.35 -4.73 3.41 4.77 -1.02 -3.99 117.00 117.13 2b5i n LEU 129 Ca 0.17 -1.51 -0.41 0.00 -0.03 0.00 0.00 56.01 54.23 2b5i n LEU 129 Cb 0.36 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.36 2b5i n LEU 129 CO 0.15 0.37 0.83 -0.69 -1.33 0.00 0.00 177.39 176.72 2b5i s VAL 130 N -0.89 3.94 -0.18 4.08 1.01 -1.19 -0.86 120.40 126.32 2b5i s VAL 130 Ca 0.04 1.55 0.00 0.00 0.00 0.00 0.00 61.98 63.57 2b5i s VAL 130 Cb 0.03 -3.99 0.01 0.00 0.00 0.00 0.00 36.38 32.44 2b5i s VAL 130 CO 0.00 0.20 -0.18 -0.63 0.00 0.00 0.00 175.10 174.50 2b5i s ILE 131 N 0.32 2.28 0.48 2.22 -1.09 0.19 -4.49 121.20 121.11 2b5i s ILE 131 Ca 0.53 -0.87 -0.20 0.00 -2.23 0.00 0.00 60.65 57.88 2b5i s ILE 131 Cb -0.29 -1.97 -0.09 0.00 -1.58 0.00 0.00 42.46 38.53 2b5i s ILE 131 CO 0.33 0.52 1.02 -2.84 -1.23 0.00 0.00 174.94 172.74 2b5i s PRO 132 N 1.26 3.86 0.65 2.79 0.02 -1.26 0.50 135.00 142.82 2b5i s PRO 132 Ca 0.04 1.32 -0.17 0.00 0.02 0.00 0.00 61.00 62.20 2b5i s PRO 132 Cb -0.13 -2.11 -0.01 0.00 0.02 0.00 0.00 34.50 32.27 2b5i s PRO 132 CO -0.10 -0.37 1.22 -1.58 -0.33 0.00 0.00 177.00 175.84 2b5i s TRP 133 N -2.02 2.23 0.64 6.54 0.23 -1.26 -4.32 118.94 120.99 2b5i s TRP 133 Ca 0.66 1.53 -0.17 0.00 -2.03 0.00 0.00 56.10 56.09 2b5i s TRP 133 Cb -0.15 -3.52 -0.01 0.00 0.03 0.00 0.00 33.47 29.82 2b5i s TRP 133 CO 0.19 -2.47 1.20 0.00 0.96 0.00 0.00 176.95 176.84 2b5i s ALA 134 N -1.68 2.40 0.54 0.98 0.00 -1.26 -4.75 121.76 117.99 2b5i s ALA 134 Ca 0.77 0.95 -0.20 0.00 0.00 0.00 0.00 51.96 53.48 2b5i s ALA 134 Cb -0.31 -3.45 -0.08 0.00 0.00 0.00 0.00 23.12 19.28 2b5i s ALA 134 CO 0.38 -1.41 0.80 -2.30 0.00 0.00 0.00 175.76 173.23 2b5i n PRO 135 N -2.01 0.83 -4.29 0.00 -0.02 -1.26 -4.75 135.00 123.51 2b5i n PRO 135 Ca 0.13 0.32 -0.17 0.00 -2.02 0.00 0.00 63.50 61.76 2b5i n PRO 135 Cb 0.50 -1.94 -0.09 0.00 -0.02 0.00 0.00 33.50 31.95 2b5i n PRO 135 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2b5i s GLU 136 N -2.30 1.51 -1.44 -0.52 2.02 0.32 -4.47 118.70 113.82 2b5i s GLU 136 Ca 0.70 -1.85 -0.04 0.00 0.02 0.00 0.00 54.97 53.80 2b5i s GLU 136 Cb -0.47 0.08 0.03 0.00 0.10 0.00 0.00 34.13 33.88 2b5i s GLU 136 CO 0.52 -0.47 0.58 -1.71 0.02 0.00 0.00 175.26 174.21 2b5i n ASN 137 N -0.85 -1.38 -4.63 -0.19 5.15 -1.26 0.88 115.26 112.98 2b5i n ASN 137 Ca 0.03 -0.95 -0.43 0.00 -0.60 0.00 0.00 54.58 52.63 2b5i n ASN 137 Cb 0.65 -3.29 -0.03 0.00 -0.53 0.00 0.00 39.78 36.58 2b5i n ASN 137 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2b5i s LEU 138 N -6.99 3.86 0.11 1.20 1.02 -1.26 -4.19 118.68 112.44 2b5i s LEU 138 Ca 0.18 1.86 0.10 0.00 0.02 0.00 0.00 54.13 56.30 2b5i s LEU 138 Cb -0.10 -3.53 -0.04 0.00 0.02 0.00 0.00 46.19 42.55 2b5i s LEU 138 CO 0.87 -1.42 -0.26 0.42 0.02 0.00 0.00 176.35 175.98 2b5i s THR 139 N 5.91 2.19 0.09 5.49 -4.23 -0.49 -4.99 115.64 119.62 2b5i s THR 139 Ca 0.82 -1.67 0.06 0.00 -1.18 0.00 0.00 61.69 59.72 2b5i s THR 139 Cb -0.30 -1.93 -0.04 0.00 1.34 0.00 0.00 72.50 71.57 2b5i s THR 139 CO 0.33 0.13 -0.08 -0.76 -0.54 0.00 0.00 174.62 173.70 2b5i s LEU 140 N -1.89 3.11 -0.24 4.79 1.43 -1.26 -0.69 118.68 123.93 2b5i s LEU 140 Ca 0.13 -0.33 -0.16 0.00 -1.03 0.00 0.00 54.13 52.74 2b5i s LEU 140 Cb -0.10 -1.88 0.07 0.00 0.03 0.00 0.00 46.19 44.31 2b5i s LEU 140 CO 0.05 0.19 0.61 -2.28 0.23 0.00 0.00 176.35 175.15 2b5i s HIS 141 N -1.20 -0.85 -0.02 0.29 5.65 -0.86 -4.96 115.29 113.34 2b5i s HIS 141 Ca 0.21 1.81 -0.20 0.00 0.25 0.00 0.00 55.06 57.13 2b5i s HIS 141 Cb -0.11 0.43 -0.05 0.00 -1.18 0.00 0.00 32.58 31.67 2b5i s HIS 141 CO 0.14 -0.43 0.59 0.15 -0.65 0.00 0.00 174.74 174.54 2b5i s LYS 142 N 1.18 4.32 0.00 2.88 1.02 -1.26 -0.33 119.74 127.55 2b5i s LYS 142 Ca -0.07 0.71 0.11 0.00 0.02 0.00 0.00 55.97 56.74 2b5i s LYS 142 Cb -0.06 -3.35 0.13 0.00 -0.52 0.00 0.00 37.83 34.03 2b5i s LYS 142 CO -0.12 0.34 0.92 1.47 -0.92 0.00 0.00 175.35 177.04 2b5i n LEU 143 N 2.85 2.10 -3.74 3.17 -0.00 -0.76 -4.98 117.00 115.63 2b5i n LEU 143 Ca -0.07 -1.17 -0.08 0.00 -0.00 0.00 0.00 56.01 54.69 2b5i n LEU 143 Cb 0.51 -0.04 -0.02 0.00 -0.00 0.00 0.00 43.42 43.87 2b5i n LEU 143 CO 0.44 0.43 0.45 -0.55 -0.00 0.00 0.00 177.39 178.15 2b5i s SER 144 N -0.94 -0.34 0.27 1.45 0.15 -1.20 -4.94 113.70 108.13 2b5i s SER 144 Ca 0.15 -0.44 0.21 0.00 0.70 0.00 0.00 55.95 56.57 2b5i s SER 144 Cb 0.10 0.69 1.02 0.00 -1.71 0.00 0.00 66.02 66.12 2b5i s SER 144 CO 0.14 -1.25 1.65 -0.62 1.20 0.00 0.00 173.24 174.37 2b5i n GLU 145 N -0.44 0.16 -0.46 5.44 -0.58 -1.26 -3.20 120.64 120.29 2b5i n GLU 145 Ca -0.08 0.52 0.02 0.00 -0.42 0.00 0.00 57.16 57.20 2b5i n GLU 145 Cb 0.61 -1.89 0.03 0.00 -0.57 0.00 0.00 31.44 29.62 2b5i n GLU 145 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2b5i n SER 146 N -2.20 0.50 -3.88 1.62 3.41 -1.26 -4.94 113.62 106.87 2b5i n SER 146 Ca 0.00 -2.22 -0.25 0.00 -0.26 0.00 0.00 58.87 56.15 2b5i n SER 146 Cb 0.13 -0.25 -0.17 0.00 -0.26 0.00 0.00 64.21 63.66 2b5i n SER 146 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2b5i s GLN 147 N -0.57 1.21 0.28 4.33 -0.21 -1.19 -1.99 119.66 121.52 2b5i s GLN 147 Ca 0.08 -0.15 0.12 0.00 0.02 0.00 0.00 55.36 55.42 2b5i s GLN 147 Cb 0.07 -1.31 -0.05 0.00 1.00 0.00 0.00 33.01 32.73 2b5i s GLN 147 CO -0.00 -0.22 -0.19 -0.48 -2.12 0.00 0.00 175.29 172.28 2b5i s LEU 148 N 1.56 2.60 -0.11 2.90 0.05 0.03 -1.83 118.68 123.88 2b5i s LEU 148 Ca 0.01 -1.04 0.00 0.00 0.05 0.00 0.00 54.13 53.15 2b5i s LEU 148 Cb -0.13 -1.07 0.02 0.00 -2.05 0.00 0.00 46.19 42.96 2b5i s LEU 148 CO -0.05 0.01 -0.09 -0.70 -0.55 0.00 0.00 176.35 174.97 2b5i s GLU 149 N -3.52 1.62 -0.10 1.48 2.12 0.56 -0.06 118.70 120.79 2b5i s GLU 149 Ca 0.30 -0.31 -0.22 0.00 0.36 0.00 0.00 54.97 55.11 2b5i s GLU 149 Cb -0.04 -1.59 -0.04 0.00 0.26 0.00 0.00 34.13 32.72 2b5i s GLU 149 CO 0.15 -0.21 0.62 -1.17 -0.54 0.00 0.00 175.26 174.11 2b5i s LEU 150 N 1.49 4.29 0.18 2.70 0.20 0.02 -2.02 118.68 125.54 2b5i s LEU 150 Ca 0.01 1.04 0.08 0.00 0.69 0.00 0.00 54.13 55.95 2b5i s LEU 150 Cb -0.13 -2.94 -0.04 0.00 -0.43 0.00 0.00 46.19 42.64 2b5i s LEU 150 CO -0.06 -0.10 -0.16 0.20 -0.29 0.00 0.00 176.35 175.94 2b5i s ASN 151 N 0.78 2.56 0.26 3.68 0.01 0.14 -0.83 114.94 121.54 2b5i s ASN 151 Ca 0.33 -0.94 -0.22 0.00 -0.71 0.00 0.00 52.86 51.32 2b5i s ASN 151 Cb -0.17 -0.14 0.03 0.00 0.41 0.00 0.00 41.25 41.38 2b5i s ASN 151 CO 0.15 -0.11 0.77 -1.66 -1.51 0.00 0.00 177.10 174.73 2b5i s TRP 152 N -2.53 -0.18 0.11 2.20 -2.14 -1.22 -1.40 118.94 113.79 2b5i s TRP 152 Ca 0.19 -0.25 0.09 0.00 2.66 0.00 0.00 56.10 58.78 2b5i s TRP 152 Cb -0.03 0.70 -0.04 0.00 -3.10 0.00 0.00 33.47 31.00 2b5i s TRP 152 CO 0.06 -1.16 -0.23 -0.80 -2.66 0.00 0.00 176.95 172.16 2b5i s ASN 153 N -2.93 2.81 0.10 -2.66 -0.87 0.26 -4.89 114.94 106.75 2b5i s ASN 153 Ca 0.11 -0.71 0.09 0.00 -1.57 0.00 0.00 52.86 50.79 2b5i s ASN 153 Cb -0.05 -0.17 -0.03 0.00 -0.02 0.00 0.00 41.25 40.98 2b5i s ASN 153 CO 0.06 0.10 -0.24 0.20 -2.57 0.00 0.00 177.10 174.65 2b5i s ASN 154 N -1.96 2.93 0.00 -1.22 0.01 -1.26 0.12 114.94 113.56 2b5i s ASN 154 Ca 0.09 -0.67 0.00 0.00 -0.71 0.00 0.00 52.86 51.56 2b5i s ASN 154 Cb -0.10 -0.20 0.00 0.00 0.41 0.00 0.00 41.25 41.36 2b5i s ASN 154 CO 0.05 0.15 0.83 0.54 -1.51 0.00 0.00 177.10 177.16 2b5i n ARG 155 N 1.22 0.00 -0.01 -0.60 5.12 -1.26 -4.72 116.66 116.41 2b5i n ARG 155 Ca -0.18 0.59 -0.05 0.00 -1.93 0.00 0.00 57.85 56.28 2b5i n ARG 155 Cb 0.53 -1.33 -0.02 0.00 -1.16 0.00 0.00 32.46 30.48 2b5i n ARG 155 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 2b5i n PHE 156 N -1.93 0.00 -0.84 -1.55 0.99 -1.26 -5.03 117.46 107.84 2b5i n PHE 156 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.45 57.15 2b5i n PHE 156 Cb 0.00 -0.17 0.24 0.00 -1.00 0.00 0.00 39.48 38.55 2b5i n PHE 156 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 2b5i s LEU 157 N -6.57 0.42 0.13 4.37 1.43 -1.26 -4.97 118.68 112.22 2b5i s LEU 157 Ca -0.07 0.92 0.00 0.00 -1.03 0.00 0.00 54.13 53.95 2b5i s LEU 157 Cb 0.02 -2.69 0.00 0.00 0.03 0.00 0.00 46.19 43.56 2b5i s LEU 157 CO 0.09 -4.28 0.00 -3.20 0.23 0.00 0.00 176.35 169.20 2b5i n ASN 158 N -4.91 -1.15 0.07 2.29 2.85 -1.26 -4.83 115.26 108.33 2b5i n ASN 158 Ca 0.10 0.32 0.06 0.00 -0.11 0.00 0.00 54.58 54.95 2b5i n ASN 158 Cb 0.58 1.32 0.31 0.00 1.24 0.00 0.00 39.78 43.23 2b5i n ASN 158 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2b5i n HIS 159 N -2.61 0.34 0.62 1.20 1.44 -1.26 -2.44 115.22 112.51 2b5i n HIS 159 Ca 0.00 0.16 0.11 0.00 -2.01 0.00 0.00 57.72 55.97 2b5i n HIS 159 Cb 0.00 -0.75 0.27 0.00 0.12 0.00 0.00 29.99 29.63 2b5i n HIS 159 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2b5i s LEU 161 N -1.40 2.11 0.39 0.00 1.02 -1.02 -3.45 118.68 116.33 2b5i s LEU 161 Ca 0.36 -0.47 0.08 0.00 0.02 0.00 0.00 54.13 54.11 2b5i s LEU 161 Cb 0.20 -1.08 -0.06 0.00 0.02 0.00 0.00 46.19 45.27 2b5i s LEU 161 CO 0.28 0.22 0.09 -1.83 0.02 0.00 0.00 176.35 175.13 2b5i s GLU 162 N -0.88 2.12 0.07 1.70 -1.05 -0.57 -3.58 118.70 116.50 2b5i s GLU 162 Ca 0.08 -1.87 0.01 0.00 -0.15 0.00 0.00 54.97 53.05 2b5i s GLU 162 Cb -0.09 -1.89 -0.04 0.00 -0.44 0.00 0.00 34.13 31.68 2b5i s GLU 162 CO 0.01 -0.02 -0.06 -1.01 0.95 0.00 0.00 175.26 175.13 2b5i s HIS 163 N -2.60 0.73 -0.16 4.83 3.76 0.13 -1.69 115.29 120.29 2b5i s HIS 163 Ca 0.38 -0.82 0.01 0.00 -0.15 0.00 0.00 55.06 54.48 2b5i s HIS 163 Cb 0.04 -0.44 0.02 0.00 1.11 0.00 0.00 32.58 33.30 2b5i s HIS 163 CO 0.20 -0.18 -0.19 -1.17 -0.85 0.00 0.00 174.74 172.56 2b5i s LEU 164 N -2.57 1.99 -0.22 0.89 2.96 -0.21 -0.48 118.68 121.04 2b5i s LEU 164 Ca 0.04 -0.59 -0.11 0.00 -0.22 0.00 0.00 54.13 53.25 2b5i s LEU 164 Cb 0.01 -1.38 -0.05 0.00 0.50 0.00 0.00 46.19 45.27 2b5i s LEU 164 CO -0.04 -0.00 0.18 -0.69 -1.32 0.00 0.00 176.35 174.47 2b5i s VAL 165 N 1.26 5.36 -0.10 1.68 1.01 -0.30 -1.64 120.40 127.66 2b5i s VAL 165 Ca 0.03 0.24 0.01 0.00 0.00 0.00 0.00 61.98 62.25 2b5i s VAL 165 Cb -0.13 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 32.71 2b5i s VAL 165 CO -0.10 0.36 -0.11 -1.10 0.00 0.00 0.00 175.10 174.15 2b5i s GLN 166 N 0.88 3.09 0.05 2.72 -0.21 0.40 -0.37 119.66 126.23 2b5i s GLN 166 Ca 0.09 -0.65 -0.00 0.00 0.02 0.00 0.00 55.36 54.82 2b5i s GLN 166 Cb -0.13 -2.60 -0.04 0.00 1.00 0.00 0.00 33.01 31.25 2b5i s GLN 166 CO 0.03 0.39 -0.04 1.52 -2.12 0.00 0.00 175.29 175.08 2b5i s TYR 167 N -0.11 0.54 0.09 0.91 -0.85 0.79 -0.75 117.35 117.98 2b5i s TYR 167 Ca -0.01 -0.93 -0.19 0.00 -0.52 0.00 0.00 57.07 55.42 2b5i s TYR 167 Cb -0.14 -0.37 0.05 0.00 0.38 0.00 0.00 41.96 41.88 2b5i s TYR 167 CO 0.03 -0.30 0.47 -0.98 -1.52 0.00 0.00 175.55 173.25 2b5i s ARG 168 N -3.38 1.07 0.31 -3.49 1.70 -0.66 0.62 118.95 115.13 2b5i s ARG 168 Ca 0.03 -0.47 0.06 0.00 -0.47 0.00 0.00 55.73 54.88 2b5i s ARG 168 Cb 0.04 0.48 -0.02 0.00 -0.57 0.00 0.00 34.95 34.88 2b5i s ARG 168 CO -0.07 -0.41 0.43 0.95 -1.08 0.00 0.00 175.30 175.12 2b5i s THR 169 N -3.17 4.32 -1.69 4.99 -4.23 -1.26 -0.21 115.64 114.39 2b5i s THR 169 Ca -0.01 -1.03 0.00 0.00 -1.18 0.00 0.00 61.69 59.47 2b5i s THR 169 Cb 0.00 -3.50 0.00 0.00 1.34 0.00 0.00 72.50 70.34 2b5i s THR 169 CO -0.07 -0.20 0.40 0.47 -0.54 0.00 0.00 174.62 174.67 2b5i n ASP 170 N -1.56 0.00 -0.00 3.99 9.92 0.11 -0.90 116.55 128.11 2b5i n ASP 170 Ca -0.02 0.00 0.02 0.00 -0.53 0.00 0.00 54.79 54.26 2b5i n ASP 170 Cb 0.58 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 41.03 2b5i n ASP 170 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 2b5i n TRP 171 N -0.89 0.00 -3.29 1.24 7.02 -1.26 -5.02 117.44 115.23 2b5i n TRP 171 Ca 0.00 0.00 -0.34 0.00 -1.02 0.00 0.00 57.50 56.14 2b5i n TRP 171 Cb 0.00 -0.04 -0.06 0.00 -2.42 0.00 0.00 31.31 28.80 2b5i n TRP 171 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2b5i s ASP 172 N -1.81 6.82 0.00 -0.99 1.01 -0.07 -4.99 116.67 116.63 2b5i s ASP 172 Ca 0.01 1.14 0.26 0.00 0.71 0.00 0.00 52.55 54.66 2b5i s ASP 172 Cb 0.03 -2.31 0.66 0.00 1.01 0.00 0.00 42.92 42.32 2b5i s ASP 172 CO 0.20 0.01 1.52 1.41 0.21 0.00 0.00 175.17 178.52 2b5i n HIS 173 N 0.44 0.00 -3.63 4.23 8.25 -1.26 -4.83 115.22 118.42 2b5i n HIS 173 Ca -0.02 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.35 2b5i n HIS 173 Cb 0.52 -0.02 -0.02 0.00 1.12 0.00 0.00 29.99 31.59 2b5i n HIS 173 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2b5i s SER 174 N -2.12 -0.38 0.11 0.41 1.04 -1.26 -5.16 113.70 106.33 2b5i s SER 174 Ca 0.31 -0.28 -0.27 0.00 0.48 0.00 0.00 55.95 56.20 2b5i s SER 174 Cb 0.20 0.61 -0.07 0.00 0.10 0.00 0.00 66.02 66.87 2b5i s SER 174 CO 0.37 -1.07 0.83 0.26 0.98 0.00 0.00 173.24 174.62 2b5i s TRP 175 N -3.69 3.82 -0.01 5.02 0.52 -1.26 -4.68 118.94 118.67 2b5i s TRP 175 Ca 0.07 1.63 -0.22 0.00 0.02 0.00 0.00 56.10 57.60 2b5i s TRP 175 Cb -0.03 -2.88 -0.05 0.00 -1.15 0.00 0.00 33.47 29.36 2b5i s TRP 175 CO -0.03 0.34 0.63 0.99 0.02 0.00 0.00 176.95 178.90 2b5i s THR 176 N -0.43 4.91 0.13 2.01 2.01 0.20 -4.90 115.64 119.57 2b5i s THR 176 Ca 0.40 1.33 0.10 0.00 0.31 0.00 0.00 61.69 63.83 2b5i s THR 176 Cb -0.22 -3.97 -0.04 0.00 0.01 0.00 0.00 72.50 68.27 2b5i s THR 176 CO 0.26 0.38 -0.24 -1.83 -0.69 0.00 0.00 174.62 172.50 2b5i s GLU 177 N 0.01 1.33 -0.16 4.92 -1.05 -1.26 -0.14 118.70 122.35 2b5i s GLU 177 Ca 0.33 -1.33 -0.06 0.00 -0.15 0.00 0.00 54.97 53.76 2b5i s GLU 177 Cb -0.18 -1.71 0.07 0.00 -0.44 0.00 0.00 34.13 31.87 2b5i s GLU 177 CO 0.18 0.39 0.35 -1.14 0.95 0.00 0.00 175.26 175.99 2b5i s GLN 178 N -2.17 0.26 0.21 -4.83 2.00 0.50 -4.97 119.66 110.66 2b5i s GLN 178 Ca 0.13 0.85 -0.30 0.00 -2.00 0.00 0.00 55.36 54.04 2b5i s GLN 178 Cb -0.09 0.10 -0.09 0.00 0.80 0.00 0.00 33.01 33.73 2b5i s GLN 178 CO 0.06 -0.24 1.23 0.45 -0.50 0.00 0.00 175.29 176.29 2b5i s SER 179 N 2.22 7.02 -0.03 6.67 0.15 -1.26 -1.14 113.70 127.33 2b5i s SER 179 Ca -0.03 2.32 0.02 0.00 0.70 0.00 0.00 55.95 58.96 2b5i s SER 179 Cb -0.11 -2.61 0.01 0.00 -1.71 0.00 0.00 66.02 61.59 2b5i s SER 179 CO -0.11 -0.41 -0.08 -0.69 1.20 0.00 0.00 173.24 173.16 2b5i s VAL 180 N -0.20 0.68 0.00 4.45 1.01 0.36 -4.96 120.40 121.75 2b5i s VAL 180 Ca 0.53 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.22 2b5i s VAL 180 Cb -0.34 -0.63 0.00 0.00 0.00 0.00 0.00 36.38 35.41 2b5i s VAL 180 CO 0.39 0.23 0.00 -0.90 0.00 0.00 0.00 175.10 174.81 2b5i n ASP 181 N 3.43 0.00 0.00 3.32 3.85 -1.26 0.20 116.55 126.08 2b5i n ASP 181 Ca -0.19 0.00 0.03 0.00 -0.71 0.00 0.00 54.79 53.92 2b5i n ASP 181 Cb 0.54 0.00 0.15 0.00 -1.35 0.00 0.00 41.12 40.46 2b5i n ASP 181 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2b5i n TYR 182 N 0.00 0.00 -2.40 2.11 0.18 -1.24 -4.10 117.16 111.71 2b5i n TYR 182 Ca 0.00 0.00 -0.43 0.00 1.88 0.00 0.00 57.90 59.35 2b5i n TYR 182 Cb 0.00 -0.40 -0.02 0.00 -0.38 0.00 0.00 39.34 38.54 2b5i n TYR 182 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 2b5i s ARG 183 N -2.79 3.77 -0.89 -3.48 3.00 -1.26 -4.83 118.95 112.47 2b5i s ARG 183 Ca 0.05 1.09 -0.03 0.00 0.00 0.00 0.00 55.73 56.84 2b5i s ARG 183 Cb 0.04 -3.94 0.21 0.00 0.00 0.00 0.00 34.95 31.27 2b5i s ARG 183 CO 0.11 -1.31 2.27 -2.39 0.00 0.00 0.00 175.30 173.97 2b5i n HIS 184 N 8.12 2.47 -4.46 -0.53 1.44 -1.26 -4.85 115.22 116.15 2b5i n HIS 184 Ca 0.15 -2.38 -0.24 0.00 -2.01 0.00 0.00 57.72 53.25 2b5i n HIS 184 Cb 0.47 -1.39 -0.10 0.00 0.12 0.00 0.00 29.99 29.10 2b5i n HIS 184 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 2b5i s LYS 185 N -2.85 1.66 -0.12 -1.40 1.02 -1.26 -3.40 119.74 113.39 2b5i s LYS 185 Ca 0.51 -1.76 -0.05 0.00 0.02 0.00 0.00 55.97 54.70 2b5i s LYS 185 Cb 0.31 -1.73 0.06 0.00 -0.52 0.00 0.00 37.83 35.95 2b5i s LYS 185 CO -0.23 0.32 0.25 0.12 -0.92 0.00 0.00 175.35 174.90 2b5i s PHE 186 N -2.54 -0.39 -0.08 3.18 5.36 -0.01 -4.94 117.98 118.56 2b5i s PHE 186 Ca 0.30 0.93 -0.26 0.00 -0.96 0.00 0.00 56.93 56.93 2b5i s PHE 186 Cb -0.05 -0.06 -0.03 0.00 -0.34 0.00 0.00 43.02 42.55 2b5i s PHE 186 CO 0.15 -0.34 0.82 -1.12 -1.46 0.00 0.00 175.22 173.27 2b5i s SER 187 N 2.36 7.08 -0.46 6.13 0.01 -1.26 -0.80 113.70 126.76 2b5i s SER 187 Ca 0.01 1.32 -0.03 0.00 1.31 0.00 0.00 55.95 58.56 2b5i s SER 187 Cb -0.12 -2.47 0.12 0.00 0.21 0.00 0.00 66.02 63.76 2b5i s SER 187 CO -0.08 -0.26 0.27 -0.22 0.41 0.00 0.00 173.24 173.36 2b5i s LEU 188 N 1.33 5.27 0.00 2.44 2.96 0.91 -5.00 118.68 126.59 2b5i s LEU 188 Ca 0.42 -2.23 0.27 0.00 -0.22 0.00 0.00 54.13 52.37 2b5i s LEU 188 Cb -0.18 -1.84 1.17 0.00 0.50 0.00 0.00 46.19 45.83 2b5i s LEU 188 CO 0.19 -0.51 1.86 -0.81 -1.32 0.00 0.00 176.35 175.76 2b5i n PRO 189 N 4.34 0.06 -3.34 0.98 -0.04 -1.26 -0.79 135.00 134.94 2b5i n PRO 189 Ca -0.00 0.04 -0.11 0.00 -0.04 0.00 0.00 63.50 63.39 2b5i n PRO 189 Cb 0.40 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.29 2b5i n PRO 189 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2b5i s SER 190 N -2.94 0.69 0.12 3.54 0.15 -1.22 -4.55 113.70 109.49 2b5i s SER 190 Ca 0.15 -0.32 0.10 0.00 0.70 0.00 0.00 55.95 56.58 2b5i s SER 190 Cb 0.17 0.94 -0.04 0.00 -1.71 0.00 0.00 66.02 65.39 2b5i s SER 190 CO 0.47 -0.35 -0.24 0.68 1.20 0.00 0.00 173.24 175.00 2b5i s VAL 191 N 2.49 2.44 -0.34 4.45 -7.23 -0.84 -5.03 120.40 116.34 2b5i s VAL 191 Ca 0.10 -1.65 -0.12 0.00 -1.81 0.00 0.00 61.98 58.51 2b5i s VAL 191 Cb -0.14 -2.08 -0.00 0.00 0.56 0.00 0.00 36.38 34.72 2b5i s VAL 191 CO -0.27 0.12 0.21 -0.62 -0.31 0.00 0.00 175.10 174.23 2b5i s ASP 192 N -2.01 5.81 0.50 4.85 -1.08 -1.26 -4.83 116.67 118.64 2b5i s ASP 192 Ca 0.15 -0.61 0.15 0.00 -0.52 0.00 0.00 52.55 51.72 2b5i s ASP 192 Cb -0.10 -2.07 1.18 0.00 -1.46 0.00 0.00 42.92 40.47 2b5i s ASP 192 CO 0.07 -0.27 2.11 1.23 0.52 0.00 0.00 175.17 178.83 2b5i h GLY 193 N 8.44 0.03 2.00 2.66 0.00 -2.00 -2.40 103.07 111.81 2b5i h GLY 193 Ca -0.30 -0.01 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 2b5i h GLY 193 CO 0.64 0.01 -0.09 1.46 0.00 0.00 0.00 176.54 178.56 2b5i h GLN 194 N 0.03 0.00 -6.18 4.80 1.08 -2.00 -3.45 115.11 109.39 2b5i h GLN 194 Ca 0.01 0.00 -0.52 0.00 -1.45 0.00 0.00 58.65 56.69 2b5i h GLN 194 Cb 0.08 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.49 2b5i h GLN 194 CO 0.00 0.09 -0.38 0.15 -0.95 0.00 0.00 178.83 177.74 2b5i s LYS 195 N -3.69 3.48 -0.22 1.46 1.02 -0.91 -5.10 119.74 115.78 2b5i s LYS 195 Ca 0.01 -0.50 -0.08 0.00 0.02 0.00 0.00 55.97 55.42 2b5i s LYS 195 Cb 0.10 -2.87 -0.04 0.00 -0.52 0.00 0.00 37.83 34.50 2b5i s LYS 195 CO 0.58 0.42 0.08 0.50 -0.92 0.00 0.00 175.35 176.01 2b5i s ARG 196 N -3.50 3.82 0.01 1.68 3.52 -1.26 -4.91 118.95 118.31 2b5i s ARG 196 Ca 0.36 -0.41 -0.08 0.00 -0.13 0.00 0.00 55.73 55.48 2b5i s ARG 196 Cb -0.11 -3.31 -0.05 0.00 -1.56 0.00 0.00 34.95 29.93 2b5i s ARG 196 CO 0.29 0.01 0.30 0.71 -0.81 0.00 0.00 175.30 175.80 2b5i s TYR 197 N 1.09 3.59 -0.09 5.12 1.51 0.10 0.09 117.35 128.76 2b5i s TYR 197 Ca 0.05 0.64 0.04 0.00 -1.01 0.00 0.00 57.07 56.79 2b5i s TYR 197 Cb -0.14 -2.04 -0.00 0.00 -0.11 0.00 0.00 41.96 39.67 2b5i s TYR 197 CO 0.03 0.60 -0.23 0.99 -1.11 0.00 0.00 175.55 175.84 2b5i s THR 198 N -1.29 1.96 0.01 -0.71 2.01 0.71 -1.20 115.64 117.13 2b5i s THR 198 Ca 0.28 -0.97 0.08 0.00 0.31 0.00 0.00 61.69 61.39 2b5i s THR 198 Cb -0.13 -1.69 -0.02 0.00 0.01 0.00 0.00 72.50 70.66 2b5i s THR 198 CO 0.16 0.54 -0.26 -0.36 -0.69 0.00 0.00 174.62 174.01 2b5i s PHE 199 N 0.27 2.28 0.04 4.92 0.40 0.80 -1.65 117.98 125.04 2b5i s PHE 199 Ca -0.15 -0.42 -0.09 0.00 -0.60 0.00 0.00 56.93 55.67 2b5i s PHE 199 Cb -0.17 -1.42 0.00 0.00 0.51 0.00 0.00 43.02 41.94 2b5i s PHE 199 CO 0.07 0.03 0.18 -0.98 0.70 0.00 0.00 175.22 175.22 2b5i s ARG 200 N -0.86 0.67 0.00 0.44 1.70 0.07 -0.79 118.95 120.18 2b5i s ARG 200 Ca 0.10 -0.65 0.02 0.00 -0.47 0.00 0.00 55.73 54.73 2b5i s ARG 200 Cb -0.10 0.28 -0.01 0.00 -0.57 0.00 0.00 34.95 34.55 2b5i s ARG 200 CO 0.00 -0.19 -0.05 0.08 -1.08 0.00 0.00 175.30 174.06 2b5i s VAL 201 N -2.57 0.41 0.21 4.99 1.01 -1.26 -0.46 120.40 122.73 2b5i s VAL 201 Ca -0.05 -0.33 0.06 0.00 0.00 0.00 0.00 61.98 61.66 2b5i s VAL 201 Cb -0.01 -0.37 -0.05 0.00 0.00 0.00 0.00 36.38 35.95 2b5i s VAL 201 CO -0.04 0.04 -0.10 0.00 0.00 0.00 0.00 175.10 175.00 2b5i s ARG 202 N -0.32 1.32 0.28 2.72 1.70 -0.65 -0.84 118.95 123.15 2b5i s ARG 202 Ca 0.00 -1.61 0.08 0.00 -0.47 0.00 0.00 55.73 53.72 2b5i s ARG 202 Cb -0.03 -0.96 -0.06 0.00 -0.57 0.00 0.00 34.95 33.33 2b5i s ARG 202 CO -0.00 0.10 -0.09 -1.12 -1.08 0.00 0.00 175.30 173.10 2b5i s SER 203 N -3.31 2.93 -0.19 -2.89 0.01 -1.26 -1.04 113.70 107.94 2b5i s SER 203 Ca 0.24 -1.15 -0.18 0.00 1.31 0.00 0.00 55.95 56.17 2b5i s SER 203 Cb 0.02 -0.20 0.05 0.00 0.21 0.00 0.00 66.02 66.10 2b5i s SER 203 CO 0.07 -0.26 0.52 -0.60 0.41 0.00 0.00 173.24 173.37 2b5i s ARG 204 N -3.68 0.60 -1.26 12.44 3.52 -0.68 0.86 118.95 130.74 2b5i s ARG 204 Ca 0.29 0.72 -0.12 0.00 -0.13 0.00 0.00 55.73 56.49 2b5i s ARG 204 Cb 0.02 0.29 0.16 0.00 -1.56 0.00 0.00 34.95 33.86 2b5i s ARG 204 CO 0.12 -0.07 1.70 0.34 -0.81 0.00 0.00 175.30 176.57 2b5i n PHE 205 N 2.83 3.96 -3.54 5.12 7.35 -1.26 -1.52 117.46 130.41 2b5i n PHE 205 Ca -0.14 -3.05 -0.13 0.00 -0.76 0.00 0.00 57.45 53.37 2b5i n PHE 205 Cb 0.56 -2.12 -0.05 0.00 0.35 0.00 0.00 39.48 38.22 2b5i n PHE 205 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 2b5i s ASN 206 N 2.03 -0.48 0.00 -2.13 3.84 -1.22 -1.85 114.94 115.13 2b5i s ASN 206 Ca 0.42 0.44 0.23 0.00 0.21 0.00 0.00 52.86 54.16 2b5i s ASN 206 Cb 0.04 0.41 0.47 0.00 -0.55 0.00 0.00 41.25 41.62 2b5i s ASN 206 CO 0.00 -0.50 1.42 -0.81 -2.79 0.00 0.00 177.10 174.43 2b5i n PRO 207 N 0.62 2.39 0.05 0.43 -0.04 -1.25 -3.40 135.00 133.80 2b5i n PRO 207 Ca -0.13 -2.10 -0.15 0.00 -0.04 0.00 0.00 63.50 61.08 2b5i n PRO 207 Cb 0.58 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.41 2b5i n PRO 207 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2b5i h LEU 208 N 4.14 0.30 -0.76 1.53 3.38 -1.88 -3.37 115.31 118.65 2b5i h LEU 208 Ca 0.00 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.55 2b5i h LEU 208 Cb 0.91 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2b5i h LEU 208 CO 0.00 1.35 -0.08 0.00 0.09 0.00 0.00 178.44 179.79 2b5i s GLY 210 N -0.82 -0.36 -0.44 0.00 0.00 -1.26 -4.94 107.32 99.51 2b5i s GLY 210 Ca 0.05 0.58 0.07 0.00 0.00 0.00 0.00 44.72 45.42 2b5i s GLY 210 CO 0.11 2.64 1.06 1.44 0.00 0.00 0.00 173.10 178.35 2b5i n SER 211 N -0.70 4.09 -4.77 1.64 7.64 -1.21 -3.81 113.62 116.48 2b5i n SER 211 Ca -0.04 -3.54 -0.41 0.00 1.01 0.00 0.00 58.87 55.89 2b5i n SER 211 Cb 0.62 -0.49 -0.01 0.00 -1.01 0.00 0.00 64.21 63.32 2b5i n SER 211 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b5i s ALA 212 N -3.44 3.48 -0.14 -0.43 0.00 -0.77 -4.71 121.76 115.75 2b5i s ALA 212 Ca 0.45 1.41 0.17 0.00 0.00 0.00 0.00 51.96 53.99 2b5i s ALA 212 Cb 0.39 -3.55 -0.24 0.00 0.00 0.00 0.00 23.12 19.73 2b5i s ALA 212 CO -0.15 -0.89 0.35 1.04 0.00 0.00 0.00 175.76 176.11 2b5i n GLN 213 N 0.49 0.66 -3.36 0.00 6.02 -1.26 -4.67 117.38 115.27 2b5i n GLN 213 Ca 0.01 0.06 -0.38 0.00 -0.01 0.00 0.00 57.00 56.68 2b5i n GLN 213 Cb 0.41 -1.62 -0.06 0.00 1.02 0.00 0.00 30.24 29.99 2b5i n GLN 213 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 2b5i s HIS 214 N -2.71 3.76 0.22 1.08 3.76 -1.26 -5.08 115.29 115.06 2b5i s HIS 214 Ca -0.08 1.14 -0.05 0.00 -0.15 0.00 0.00 55.06 55.93 2b5i s HIS 214 Cb 0.08 -2.43 -0.05 0.00 1.11 0.00 0.00 32.58 31.29 2b5i s HIS 214 CO 0.84 0.58 0.48 -1.58 -0.85 0.00 0.00 174.74 174.20 2b5i s TRP 215 N -0.96 3.47 1.11 1.40 0.52 -1.26 -4.61 118.94 118.62 2b5i s TRP 215 Ca 0.27 0.60 -0.15 0.00 0.02 0.00 0.00 56.10 56.83 2b5i s TRP 215 Cb -0.18 -2.05 0.17 0.00 -1.15 0.00 0.00 33.47 30.26 2b5i s TRP 215 CO 0.16 0.30 0.51 -1.13 0.02 0.00 0.00 176.95 176.81 2b5i n SER 216 N -0.49 -1.93 -4.72 2.95 3.41 0.25 -4.90 113.62 108.19 2b5i n SER 216 Ca -0.02 -0.06 -0.31 0.00 -0.26 0.00 0.00 58.87 58.23 2b5i n SER 216 Cb 0.53 -1.14 0.13 0.00 -0.26 0.00 0.00 64.21 63.48 2b5i n SER 216 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2b5i s GLU 217 N -3.91 1.55 0.37 4.33 2.02 -1.26 -4.61 118.70 117.19 2b5i s GLU 217 Ca 0.62 1.19 -0.27 0.00 0.02 0.00 0.00 54.97 56.53 2b5i s GLU 217 Cb -0.19 -1.81 -0.09 0.00 0.10 0.00 0.00 34.13 32.14 2b5i s GLU 217 CO 0.65 -2.15 1.25 -1.58 0.02 0.00 0.00 175.26 173.46 2b5i s TRP 218 N -2.82 3.02 1.20 1.61 0.52 -1.26 -4.45 118.94 116.75 2b5i s TRP 218 Ca 0.64 1.48 -0.14 0.00 0.02 0.00 0.00 56.10 58.09 2b5i s TRP 218 Cb -0.19 -3.56 0.27 0.00 -1.15 0.00 0.00 33.47 28.83 2b5i s TRP 218 CO 0.57 -1.68 0.79 -1.13 0.02 0.00 0.00 176.95 175.52 2b5i n SER 219 N 0.39 -2.08 -4.73 2.95 3.41 -0.02 -4.90 113.62 108.64 2b5i n SER 219 Ca 0.02 -0.22 -0.42 0.00 -0.26 0.00 0.00 58.87 58.00 2b5i n SER 219 Cb 0.44 -1.17 -0.03 0.00 -0.26 0.00 0.00 64.21 63.19 2b5i n SER 219 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2b5i s HIS 220 N -2.34 3.00 0.56 7.33 0.09 -1.26 -4.77 115.29 117.89 2b5i s HIS 220 Ca 0.66 0.80 -0.19 0.00 -0.00 0.00 0.00 55.06 56.33 2b5i s HIS 220 Cb -0.23 -3.91 -0.05 0.00 -0.00 0.00 0.00 32.58 28.40 2b5i s HIS 220 CO 0.66 -3.16 1.18 -1.25 -0.00 0.00 0.00 174.74 172.16 2b5i s PRO 221 N 0.30 3.19 0.19 8.40 0.04 -1.26 -4.83 135.00 141.03 2b5i s PRO 221 Ca 0.65 1.75 0.06 0.00 0.04 0.00 0.00 61.00 63.50 2b5i s PRO 221 Cb -0.44 -2.00 -0.05 0.00 0.04 0.00 0.00 34.50 32.05 2b5i s PRO 221 CO 0.38 -1.02 -0.11 0.96 0.04 0.00 0.00 177.00 177.26 2b5i s ILE 222 N -1.65 1.49 0.06 0.56 -4.36 0.03 -4.95 121.20 112.38 2b5i s ILE 222 Ca 0.74 -2.14 0.05 0.00 -0.26 0.00 0.00 60.65 59.05 2b5i s ILE 222 Cb -0.28 -2.04 -0.03 0.00 1.25 0.00 0.00 42.46 41.36 2b5i s ILE 222 CO 0.31 -0.60 -0.15 -1.00 0.24 0.00 0.00 174.94 173.75 2b5i s HIS 223 N -3.13 1.26 0.00 1.37 3.76 -1.26 -0.14 115.29 117.15 2b5i s HIS 223 Ca 0.22 -0.41 0.00 0.00 -0.15 0.00 0.00 55.06 54.71 2b5i s HIS 223 Cb 0.01 -0.72 0.00 0.00 1.11 0.00 0.00 32.58 32.98 2b5i s HIS 223 CO 0.05 0.06 0.28 1.87 -0.85 0.00 0.00 174.74 176.15