#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wrs s TYR 33 N 0.00 2.45 0.35 -1.84 5.04 -1.26 -4.91 117.35 117.18 2wrs s TYR 33 Ca 0.00 1.23 -0.26 0.00 -2.44 0.00 0.00 57.07 55.60 2wrs s TYR 33 Cb 0.00 -3.96 -0.09 0.00 0.35 0.00 0.00 41.96 38.26 2wrs s TYR 33 CO 0.00 -3.03 1.07 -2.14 -1.34 0.00 0.00 175.55 170.12 2wrs s PRO 34 N -2.41 4.33 0.24 4.97 0.02 -1.26 -5.03 135.00 135.86 2wrs s PRO 34 Ca 0.60 1.63 0.08 0.00 0.02 0.00 0.00 61.00 63.34 2wrs s PRO 34 Cb -0.45 -2.79 -0.04 0.00 0.02 0.00 0.00 34.50 31.24 2wrs s PRO 34 CO 0.58 -0.02 0.05 0.95 -0.33 0.00 0.00 177.00 178.23 2wrs s THR 35 N -1.46 3.76 0.42 0.99 -4.23 -1.26 -4.93 115.64 108.94 2wrs s THR 35 Ca 0.53 -1.68 0.16 0.00 -1.18 0.00 0.00 61.69 59.52 2wrs s THR 35 Cb -0.26 -2.99 0.36 0.00 1.34 0.00 0.00 72.50 70.95 2wrs s THR 35 CO 0.33 -0.31 1.90 1.62 -0.54 0.00 0.00 174.62 177.61 2wrs h VAL 36 N 1.91 0.76 0.00 2.29 3.04 -1.95 0.11 116.25 122.41 2wrs h VAL 36 Ca -0.46 -0.14 -0.06 0.00 -1.01 0.00 0.00 66.70 65.02 2wrs h VAL 36 Cb 1.24 0.31 -0.01 0.00 -2.01 0.00 0.00 31.29 30.81 2wrs h VAL 36 CO 0.60 0.08 -0.31 0.78 -1.01 0.00 0.00 177.57 177.71 2wrs h ASN 37 N 0.42 0.00 1.28 3.17 4.21 -1.96 -3.09 115.58 119.61 2wrs h ASN 37 Ca 0.40 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.91 2wrs h ASN 37 Cb 0.96 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.16 2wrs h ASN 37 CO -0.14 0.31 -0.01 -0.62 -1.29 0.00 0.00 177.43 175.68 2wrs n GLU 38 N -4.01 0.16 -4.03 0.81 1.02 0.39 -4.74 120.64 110.24 2wrs n GLU 38 Ca -0.02 0.13 -0.31 0.00 -0.02 0.00 0.00 57.16 56.94 2wrs n GLU 38 Cb 0.37 -1.68 -0.16 0.00 -0.02 0.00 0.00 31.44 29.95 2wrs n GLU 38 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2wrs s ILE 39 N -3.06 1.85 0.18 -3.67 1.01 -1.17 -4.97 121.20 111.37 2wrs s ILE 39 Ca 0.12 -1.24 -0.30 0.00 0.00 0.00 0.00 60.65 59.22 2wrs s ILE 39 Cb 0.15 -1.94 -0.08 0.00 0.01 0.00 0.00 42.46 40.60 2wrs s ILE 39 CO 0.57 0.11 1.30 -2.84 0.00 0.00 0.00 174.94 174.09 2wrs s PRO 40 N 1.28 4.39 0.49 2.79 0.02 -1.26 -4.80 135.00 137.91 2wrs s PRO 40 Ca -0.04 2.03 -0.21 0.00 0.02 0.00 0.00 61.00 62.80 2wrs s PRO 40 Cb -0.17 -3.21 -0.10 0.00 0.02 0.00 0.00 34.50 31.03 2wrs s PRO 40 CO -0.07 -0.26 0.71 1.33 -0.33 0.00 0.00 177.00 178.37 2wrs n VAL 41 N 2.86 2.34 0.00 3.83 0.24 -1.26 -1.91 118.33 124.43 2wrs n VAL 41 Ca 0.07 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.87 2wrs n VAL 41 Cb 0.43 -0.82 0.00 0.00 -1.47 0.00 0.00 33.84 31.98 2wrs n VAL 41 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wrs n GLY 42 N 1.57 2.42 3.91 7.63 0.00 -1.26 -5.04 105.19 114.43 2wrs n GLY 42 Ca 0.11 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.93 2wrs n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wrs s GLU 43 N -0.36 2.72 0.00 1.61 2.02 -0.80 -4.62 118.70 119.27 2wrs s GLU 43 Ca 0.00 -1.34 0.00 0.00 0.02 0.00 0.00 54.97 53.65 2wrs s GLU 43 Cb 0.00 -2.54 -0.00 0.00 0.10 0.00 0.00 34.13 31.69 2wrs s GLU 43 CO 0.00 -0.09 -0.02 0.08 0.02 0.00 0.00 175.26 175.25 2wrs s VAL 44 N -2.36 0.12 0.11 2.63 1.01 -1.26 -4.32 120.40 116.33 2wrs s VAL 44 Ca 0.47 -0.11 0.10 0.00 0.00 0.00 0.00 61.98 62.44 2wrs s VAL 44 Cb -0.06 -0.12 -0.04 0.00 0.00 0.00 0.00 36.38 36.16 2wrs s VAL 44 CO 0.29 0.00 -0.26 -0.13 0.00 0.00 0.00 175.10 175.00 2wrs s ARG 45 N -0.12 1.54 -0.14 2.72 1.81 0.27 -4.95 118.95 120.08 2wrs s ARG 45 Ca -0.00 -1.27 -0.02 0.00 -1.72 0.00 0.00 55.73 52.72 2wrs s ARG 45 Cb -0.01 -1.94 -0.02 0.00 -0.45 0.00 0.00 34.95 32.53 2wrs s ARG 45 CO -0.00 0.47 -0.09 -0.51 -0.68 0.00 0.00 175.30 174.49 2wrs s LEU 46 N -1.85 2.94 -0.28 2.53 1.43 -1.26 0.82 118.68 123.01 2wrs s LEU 46 Ca 0.14 -0.24 -0.04 0.00 -1.03 0.00 0.00 54.13 52.95 2wrs s LEU 46 Cb -0.10 -1.68 0.02 0.00 0.03 0.00 0.00 46.19 44.46 2wrs s LEU 46 CO 0.05 0.17 0.01 -0.47 0.23 0.00 0.00 176.35 176.34 2wrs s TYR 47 N 0.35 3.13 -0.18 0.29 5.04 0.43 -4.95 117.35 121.46 2wrs s TYR 47 Ca -0.08 -1.34 -0.29 0.00 -2.44 0.00 0.00 57.07 52.92 2wrs s TYR 47 Cb -0.15 -2.16 -0.07 0.00 0.35 0.00 0.00 41.96 39.94 2wrs s TYR 47 CO 0.05 -0.67 2.17 0.94 -1.34 0.00 0.00 175.55 176.69 2wrs n GLN 48 N 4.75 2.06 -0.03 4.97 -0.06 -1.26 0.11 117.38 127.93 2wrs n GLN 48 Ca -0.15 0.62 0.05 0.00 -2.00 0.00 0.00 57.00 55.51 2wrs n GLN 48 Cb 0.47 -3.11 -0.16 0.00 -4.06 0.00 0.00 30.24 23.38 2wrs n GLN 48 CO 0.00 0.00 0.00 -0.89 -0.20 0.00 0.00 177.06 175.97 2wrs n ILE 49 N 7.21 0.46 -3.61 1.69 2.08 -0.27 -4.94 119.36 121.98 2wrs n ILE 49 Ca 0.29 -0.61 -0.02 0.00 0.56 0.00 0.00 62.75 62.97 2wrs n ILE 49 Cb 0.42 -0.17 -0.01 0.00 -0.75 0.00 0.00 39.64 39.12 2wrs n ILE 49 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2wrs s ALA 50 N -3.20 -2.11 -0.20 -1.39 0.00 -1.08 -5.01 121.76 108.76 2wrs s ALA 50 Ca -0.08 1.13 -0.39 0.00 0.00 0.00 0.00 51.96 52.62 2wrs s ALA 50 Cb 0.11 0.14 -0.15 0.00 0.00 0.00 0.00 23.12 23.23 2wrs s ALA 50 CO 0.88 -0.81 1.74 -0.25 0.00 0.00 0.00 175.76 177.31 2wrs n ASP 51 N -0.28 2.55 -2.15 0.00 10.43 -1.26 -2.29 116.55 123.56 2wrs n ASP 51 Ca -0.04 1.06 -0.20 0.00 2.57 0.00 0.00 54.79 58.18 2wrs n ASP 51 Cb 0.60 -1.20 -0.03 0.00 1.84 0.00 0.00 41.12 42.34 2wrs n ASP 51 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2wrs n GLY 52 N 4.09 0.24 2.84 0.44 0.00 -1.26 -4.98 105.19 106.57 2wrs n GLY 52 Ca 0.25 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.10 2wrs n GLY 52 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wrs s VAL 53 N -2.89 0.22 0.12 1.61 1.01 -0.97 -1.46 120.40 118.03 2wrs s VAL 53 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 2wrs s VAL 53 Cb 0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 36.05 2wrs s VAL 53 CO 0.00 0.14 0.02 0.26 0.00 0.00 0.00 175.10 175.52 2wrs s TRP 54 N 0.82 0.83 0.16 5.22 0.51 -0.80 -1.12 118.94 124.56 2wrs s TRP 54 Ca -0.09 -1.15 0.09 0.00 -2.12 0.00 0.00 56.10 52.83 2wrs s TRP 54 Cb -0.12 -0.49 -0.04 0.00 -0.81 0.00 0.00 33.47 32.01 2wrs s TRP 54 CO -0.01 -0.43 -0.16 -1.54 -0.51 0.00 0.00 176.95 174.30 2wrs s SER 55 N -3.03 3.93 -0.09 2.95 1.04 0.12 -1.80 113.70 116.81 2wrs s SER 55 Ca 0.19 -0.63 -0.02 0.00 0.48 0.00 0.00 55.95 55.97 2wrs s SER 55 Cb 0.07 -0.55 -0.03 0.00 0.10 0.00 0.00 66.02 65.61 2wrs s SER 55 CO -0.01 0.14 -0.02 -1.38 0.98 0.00 0.00 173.24 172.95 2wrs s HIS 56 N -1.47 3.09 -0.07 5.02 -3.43 0.43 -0.43 115.29 118.43 2wrs s HIS 56 Ca 0.21 0.07 0.05 0.00 -0.80 0.00 0.00 55.06 54.59 2wrs s HIS 56 Cb -0.09 -1.80 -0.00 0.00 -1.43 0.00 0.00 32.58 29.25 2wrs s HIS 56 CO 0.12 0.35 -0.22 0.42 -2.00 0.00 0.00 174.74 173.41 2wrs s ILE 57 N -0.63 1.82 0.04 -5.38 1.09 0.24 -0.51 121.20 117.88 2wrs s ILE 57 Ca 0.10 -0.92 -0.07 0.00 -1.10 0.00 0.00 60.65 58.66 2wrs s ILE 57 Cb -0.12 -1.56 -0.01 0.00 -1.06 0.00 0.00 42.46 39.71 2wrs s ILE 57 CO 0.02 0.51 0.14 0.00 -0.10 0.00 0.00 174.94 175.51 2wrs s ALA 58 N 0.08 -0.17 0.17 9.38 0.00 -0.56 -0.56 121.76 130.11 2wrs s ALA 58 Ca -0.09 -0.49 0.07 0.00 0.00 0.00 0.00 51.96 51.46 2wrs s ALA 58 Cb -0.14 0.29 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 2wrs s ALA 58 CO 0.05 -0.36 0.04 0.95 0.00 0.00 0.00 175.76 176.44 2wrs s THR 59 N -2.78 3.96 -0.12 0.00 -4.23 -1.26 -0.53 115.64 110.68 2wrs s THR 59 Ca -0.03 -1.32 -0.08 0.00 -1.18 0.00 0.00 61.69 59.07 2wrs s THR 59 Cb -0.00 -3.00 0.04 0.00 1.34 0.00 0.00 72.50 70.88 2wrs s THR 59 CO -0.05 -0.11 0.31 -1.58 -0.54 0.00 0.00 174.62 172.64 2wrs s GLN 60 N -2.99 0.31 -0.30 3.99 2.00 -0.71 -4.42 119.66 117.53 2wrs s GLN 60 Ca 0.29 0.54 -0.40 0.00 -2.00 0.00 0.00 55.36 53.79 2wrs s GLN 60 Cb -0.09 0.02 -0.15 0.00 0.80 0.00 0.00 33.01 33.59 2wrs s GLN 60 CO 0.20 -0.11 1.82 0.43 -0.50 0.00 0.00 175.29 177.13 2wrs n SER 61 N 3.68 2.32 -3.68 6.67 7.64 -1.26 -2.07 113.62 126.91 2wrs n SER 61 Ca -0.20 0.98 -0.10 0.00 1.01 0.00 0.00 58.87 60.56 2wrs n SER 61 Cb 0.56 -1.15 -0.10 0.00 -1.01 0.00 0.00 64.21 62.50 2wrs n SER 61 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 2wrs s PHE 62 N 4.14 -0.67 -1.21 1.43 2.19 -0.85 -4.94 117.98 118.06 2wrs s PHE 62 Ca 1.01 1.38 -0.06 0.00 0.33 0.00 0.00 56.93 59.58 2wrs s PHE 62 Cb -1.06 0.28 0.01 0.00 -1.31 0.00 0.00 43.02 40.94 2wrs s PHE 62 CO 0.64 -0.39 0.80 -3.47 1.83 0.00 0.00 175.22 174.62 2wrs n ASP 63 N 4.67 -5.59 0.00 6.13 4.64 -1.26 -1.79 116.55 123.35 2wrs n ASP 63 Ca -0.18 -0.37 0.00 0.00 -1.38 0.00 0.00 54.79 52.87 2wrs n ASP 63 Cb 0.53 -4.29 0.00 0.00 -1.04 0.00 0.00 41.12 36.32 2wrs n ASP 63 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2wrs n GLY 64 N -1.62 2.78 3.17 0.27 0.00 -1.26 -5.02 105.19 103.50 2wrs n GLY 64 Ca -0.04 -0.09 -0.18 0.00 0.00 0.00 0.00 46.02 45.72 2wrs n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrs n ALA 65 N 0.00 0.45 -4.07 4.61 0.00 -0.74 -5.09 120.51 115.67 2wrs n ALA 65 Ca 0.00 -1.63 -0.32 0.00 0.00 0.00 0.00 53.44 51.48 2wrs n ALA 65 Cb 0.00 0.33 -0.15 0.00 0.00 0.00 0.00 19.45 19.63 2wrs n ALA 65 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2wrs s VAL 66 N -2.29 2.13 0.09 0.00 1.01 -1.26 -2.00 120.40 118.07 2wrs s VAL 66 Ca 0.53 -1.52 -0.01 0.00 0.00 0.00 0.00 61.98 60.97 2wrs s VAL 66 Cb -0.03 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 2wrs s VAL 66 CO 0.34 0.05 0.27 -0.31 0.00 0.00 0.00 175.10 175.45 2wrs s TYR 67 N 1.14 3.50 0.44 5.22 1.51 -0.88 -4.90 117.35 123.38 2wrs s TYR 67 Ca -0.07 0.34 -0.01 0.00 -1.01 0.00 0.00 57.07 56.32 2wrs s TYR 67 Cb -0.19 -1.83 -0.02 0.00 -0.11 0.00 0.00 41.96 39.81 2wrs s TYR 67 CO -0.06 0.53 0.68 -1.25 -1.11 0.00 0.00 175.55 174.34 2wrs s PRO 68 N -2.62 3.27 0.14 -1.71 0.04 -1.26 -1.74 135.00 131.12 2wrs s PRO 68 Ca 0.37 -0.26 -0.18 0.00 0.04 0.00 0.00 61.00 60.97 2wrs s PRO 68 Cb -0.13 -2.52 0.04 0.00 0.04 0.00 0.00 34.50 31.93 2wrs s PRO 68 CO 0.27 -0.17 0.46 -1.54 0.04 0.00 0.00 177.00 176.06 2wrs s SER 69 N -4.15 -0.31 0.01 6.66 1.04 0.31 -4.60 113.70 112.66 2wrs s SER 69 Ca 0.46 -0.26 0.08 0.00 0.48 0.00 0.00 55.95 56.71 2wrs s SER 69 Cb -0.10 0.51 -0.02 0.00 0.10 0.00 0.00 66.02 66.51 2wrs s SER 69 CO 0.39 -0.90 -0.24 0.20 0.98 0.00 0.00 173.24 173.67 2wrs s ASN 70 N -2.80 2.87 0.00 7.02 0.01 -0.21 -1.49 114.94 120.34 2wrs s ASN 70 Ca 0.03 -0.50 0.00 0.00 -0.71 0.00 0.00 52.86 51.68 2wrs s ASN 70 Cb 0.01 -0.29 0.00 0.00 0.41 0.00 0.00 41.25 41.38 2wrs s ASN 70 CO -0.11 0.26 0.00 0.61 -1.51 0.00 0.00 177.10 176.35 2wrs n GLY 71 N 2.15 4.28 3.06 0.66 0.00 0.34 -4.86 105.19 110.82 2wrs n GLY 71 Ca -0.16 -1.69 -0.18 0.00 0.00 0.00 0.00 46.02 43.99 2wrs n GLY 71 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wrs s LEU 72 N 0.00 2.11 -0.19 0.99 2.96 -0.77 -0.43 118.68 123.35 2wrs s LEU 72 Ca 0.00 -0.32 0.01 0.00 -0.22 0.00 0.00 54.13 53.60 2wrs s LEU 72 Cb 0.00 -0.42 0.04 0.00 0.50 0.00 0.00 46.19 46.30 2wrs s LEU 72 CO 0.00 0.02 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.30 2wrs s ILE 73 N -0.61 1.70 -0.29 6.68 1.01 -0.75 0.79 121.20 129.73 2wrs s ILE 73 Ca 0.00 -0.97 -0.05 0.00 0.00 0.00 0.00 60.65 59.62 2wrs s ILE 73 Cb -0.06 -1.72 0.02 0.00 0.01 0.00 0.00 42.46 40.71 2wrs s ILE 73 CO 0.00 0.24 0.05 -0.69 0.00 0.00 0.00 174.94 174.55 2wrs s VAL 74 N 1.38 3.68 0.11 2.92 1.01 0.20 -1.91 120.40 127.80 2wrs s VAL 74 Ca -0.00 -0.85 -0.34 0.00 0.00 0.00 0.00 61.98 60.79 2wrs s VAL 74 Cb -0.16 -2.93 -0.18 0.00 0.00 0.00 0.00 36.38 33.11 2wrs s VAL 74 CO -0.09 0.06 0.84 -1.14 0.00 0.00 0.00 175.10 174.77 2wrs n ARG 75 N 4.81 0.15 -3.46 2.72 0.63 -0.54 -1.17 116.66 119.80 2wrs n ARG 75 Ca -0.15 0.05 -0.27 0.00 -0.92 0.00 0.00 57.85 56.57 2wrs n ARG 75 Cb 0.47 -1.34 -0.09 0.00 0.45 0.00 0.00 32.46 31.96 2wrs n ARG 75 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 2wrs n ASP 76 N 1.77 2.45 0.00 6.15 -0.08 0.38 -4.73 116.55 122.49 2wrs n ASP 76 Ca 0.18 -3.14 0.00 0.00 -1.51 0.00 0.00 54.79 50.33 2wrs n ASP 76 Cb 0.18 -0.67 0.00 0.00 2.34 0.00 0.00 41.12 42.96 2wrs n ASP 76 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2wrs n GLY 77 N 1.37 0.22 0.01 0.27 0.00 -1.26 -0.59 105.19 105.21 2wrs n GLY 77 Ca 0.26 0.65 0.06 0.00 0.00 0.00 0.00 46.02 46.99 2wrs n GLY 77 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2wrs n ASP 78 N 2.39 2.00 -4.37 1.61 2.03 -1.26 -4.95 116.55 114.00 2wrs n ASP 78 Ca 0.00 0.00 -0.29 0.00 0.52 0.00 0.00 54.79 55.02 2wrs n ASP 78 Cb 0.00 1.57 -0.08 0.00 -0.72 0.00 0.00 41.12 41.89 2wrs n ASP 78 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2wrs s GLU 79 N -2.89 2.04 -0.11 -0.67 2.02 0.25 -4.53 118.70 114.80 2wrs s GLU 79 Ca -0.05 -2.27 0.00 0.00 0.02 0.00 0.00 54.97 52.68 2wrs s GLU 79 Cb 0.08 -0.98 -0.02 0.00 0.10 0.00 0.00 34.13 33.32 2wrs s GLU 79 CO 0.54 -0.43 -0.12 -0.51 0.02 0.00 0.00 175.26 174.76 2wrs s LEU 80 N -3.72 2.78 -0.01 1.80 1.43 -0.83 0.14 118.68 120.28 2wrs s LEU 80 Ca 0.17 -0.27 -0.16 0.00 -1.03 0.00 0.00 54.13 52.83 2wrs s LEU 80 Cb 0.02 -1.62 -0.06 0.00 0.03 0.00 0.00 46.19 44.57 2wrs s LEU 80 CO 0.10 0.21 0.44 -0.22 0.23 0.00 0.00 176.35 177.11 2wrs s LEU 81 N 0.08 4.45 -0.10 1.79 2.96 -0.32 -2.71 118.68 124.84 2wrs s LEU 81 Ca -0.05 0.98 -0.00 0.00 -0.22 0.00 0.00 54.13 54.84 2wrs s LEU 81 Cb -0.15 -2.64 -0.03 0.00 0.50 0.00 0.00 46.19 43.88 2wrs s LEU 81 CO 0.04 0.27 -0.08 -0.22 -1.32 0.00 0.00 176.35 175.04 2wrs s LEU 82 N -0.82 3.07 -0.33 -0.68 2.96 0.35 -0.62 118.68 122.60 2wrs s LEU 82 Ca 0.25 -0.12 0.03 0.00 -0.22 0.00 0.00 54.13 54.06 2wrs s LEU 82 Cb -0.17 -1.69 0.09 0.00 0.50 0.00 0.00 46.19 44.93 2wrs s LEU 82 CO 0.14 0.27 0.04 -0.63 -1.32 0.00 0.00 176.35 174.85 2wrs s ILE 83 N -0.28 2.41 0.00 6.68 -1.09 0.24 -0.87 121.20 128.29 2wrs s ILE 83 Ca 0.04 -2.15 0.00 0.00 -2.23 0.00 0.00 60.65 56.31 2wrs s ILE 83 Cb -0.13 -2.69 0.00 0.00 -1.58 0.00 0.00 42.46 38.07 2wrs s ILE 83 CO 0.03 -0.49 0.00 0.47 -1.23 0.00 0.00 174.94 173.72 2wrs n ASP 84 N 4.34 -0.61 -4.79 3.58 8.00 0.20 -1.84 116.55 125.43 2wrs n ASP 84 Ca -0.01 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.20 2wrs n ASP 84 Cb 0.42 0.66 0.12 0.00 -0.02 0.00 0.00 41.12 42.30 2wrs n ASP 84 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2wrs s THR 85 N -1.77 2.37 -0.95 -3.53 -4.23 -0.96 -4.69 115.64 101.87 2wrs s THR 85 Ca 0.00 0.12 0.05 0.00 -1.18 0.00 0.00 61.69 60.68 2wrs s THR 85 Cb 0.00 -2.86 0.25 0.00 1.34 0.00 0.00 72.50 71.22 2wrs s THR 85 CO 0.00 -0.16 0.93 0.00 -0.54 0.00 0.00 174.62 174.85 2wrs n ALA 86 N -3.66 2.86 -2.09 3.99 0.00 -1.26 -4.64 120.51 115.71 2wrs n ALA 86 Ca 0.07 -0.56 -0.00 0.00 0.00 0.00 0.00 53.44 52.94 2wrs n ALA 86 Cb 0.58 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 19.00 2wrs n ALA 86 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 2wrs n TRP 87 N 0.19 -1.92 0.00 0.00 -0.00 -1.26 -4.60 117.44 109.85 2wrs n TRP 87 Ca 0.08 0.85 0.00 0.00 -0.00 0.00 0.00 57.50 58.43 2wrs n TRP 87 Cb 0.49 -2.72 0.00 0.00 -0.00 0.00 0.00 31.31 29.08 2wrs n TRP 87 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2wrs n GLY 88 N 0.30 0.31 0.22 5.87 0.00 0.11 -4.40 105.19 107.60 2wrs n GLY 88 Ca 0.00 -1.62 -0.08 0.00 0.00 0.00 0.00 46.02 44.33 2wrs n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrs h ALA 89 N 0.00 -0.77 -1.00 4.61 0.00 -1.92 -0.72 119.26 119.47 2wrs h ALA 89 Ca 0.00 -0.05 0.22 0.00 0.00 0.00 0.00 54.91 55.07 2wrs h ALA 89 Cb 0.00 0.64 -0.19 0.00 0.00 0.00 0.00 17.79 18.24 2wrs h ALA 89 CO 0.00 -0.83 -0.18 0.87 0.00 0.00 0.00 179.25 179.11 2wrs h LYS 90 N -0.35 0.00 -0.01 0.00 1.57 -1.96 -0.15 116.57 115.67 2wrs h LYS 90 Ca -0.01 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2wrs h LYS 90 Cb 0.35 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 2wrs h LYS 90 CO -0.12 0.00 -0.00 -0.91 -0.57 0.00 0.00 179.45 177.85 2wrs h ASN 91 N 0.00 0.02 -0.49 0.86 2.35 -1.66 -1.81 115.58 114.85 2wrs h ASN 91 Ca 0.51 -0.39 0.04 0.00 -0.55 0.00 0.00 56.30 55.92 2wrs h ASN 91 Cb 0.86 -0.01 -0.04 0.00 0.05 0.00 0.00 38.32 39.18 2wrs h ASN 91 CO -1.00 0.40 0.25 0.74 -1.65 0.00 0.00 177.43 176.16 2wrs h THR 92 N -0.36 0.96 -0.90 2.81 2.02 -0.30 1.21 112.91 118.34 2wrs h THR 92 Ca 0.00 -0.17 0.18 0.00 0.77 0.00 0.00 66.41 67.20 2wrs h THR 92 Cb 0.39 0.43 -0.11 0.00 -1.74 0.00 0.00 68.15 67.13 2wrs h THR 92 CO 0.00 0.09 0.48 0.00 0.37 0.00 0.00 175.52 176.45 2wrs h ALA 93 N 1.26 1.43 -0.44 6.16 0.00 -0.94 -1.18 119.26 125.55 2wrs h ALA 93 Ca 0.22 0.10 -0.10 0.00 0.00 0.00 0.00 54.91 55.13 2wrs h ALA 93 Cb 0.13 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2wrs h ALA 93 CO -0.15 -0.15 -0.10 0.00 0.00 0.00 0.00 179.25 178.85 2wrs h ALA 94 N 1.62 0.61 0.01 0.00 0.00 0.21 -2.46 119.26 119.25 2wrs h ALA 94 Ca 0.52 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 55.12 2wrs h ALA 94 Cb 0.83 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 2wrs h ALA 94 CO -0.41 0.49 -0.32 1.25 0.00 0.00 0.00 179.25 180.26 2wrs h LEU 95 N 0.69 -0.99 -1.10 0.00 5.85 0.38 -1.13 115.31 119.01 2wrs h LEU 95 Ca 0.11 0.11 0.27 0.00 0.84 0.00 0.00 57.88 59.21 2wrs h LEU 95 Cb 0.64 0.37 -0.12 0.00 0.37 0.00 0.00 40.66 41.92 2wrs h LEU 95 CO 0.04 -0.31 0.62 -0.07 -0.34 0.00 0.00 178.44 178.38 2wrs h LEU 96 N -0.40 0.59 -0.69 2.25 3.38 -1.11 0.27 115.31 119.60 2wrs h LEU 96 Ca 0.01 0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 2wrs h LEU 96 Cb 0.43 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 2wrs h LEU 96 CO -0.21 0.06 -0.53 0.00 0.09 0.00 0.00 178.44 177.85 2wrs h ALA 97 N 1.71 0.89 0.01 1.53 0.00 -0.99 -1.48 119.26 120.94 2wrs h ALA 97 Ca 0.65 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 2wrs h ALA 97 Cb 1.39 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2wrs h ALA 97 CO -0.45 0.66 -0.01 1.49 0.00 0.00 0.00 179.25 180.95 2wrs h GLU 98 N 0.00 -0.01 -0.92 0.00 4.57 0.74 -1.83 114.58 117.12 2wrs h GLU 98 Ca -0.01 0.00 0.08 0.00 -1.18 0.00 0.00 59.36 58.26 2wrs h GLU 98 Cb 1.10 0.00 -0.11 0.00 -0.16 0.00 0.00 28.75 29.58 2wrs h GLU 98 CO 0.07 0.79 -0.58 0.82 -1.18 0.00 0.00 179.01 178.93 2wrs h ILE 99 N -0.93 0.00 0.00 2.32 2.04 -1.16 0.20 117.51 119.99 2wrs h ILE 99 Ca -0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.85 2wrs h ILE 99 Cb 0.81 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.89 2wrs h ILE 99 CO 0.00 0.00 -0.02 -0.08 0.00 0.00 0.00 178.15 178.05 2wrs h GLU 100 N -0.04 0.00 0.00 2.37 4.57 -1.23 0.22 114.58 120.46 2wrs h GLU 100 Ca 0.15 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.20 2wrs h GLU 100 Cb 0.43 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.00 2wrs h GLU 100 CO -0.89 0.02 -0.80 -0.22 -1.18 0.00 0.00 179.01 175.95 2wrs h LYS 101 N 0.00 0.00 0.00 1.92 3.64 -0.14 -3.26 116.57 118.73 2wrs h LYS 101 Ca -0.00 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 2wrs h LYS 101 Cb 0.05 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 2wrs h LYS 101 CO 0.00 0.44 -1.16 1.04 -2.27 0.00 0.00 179.45 177.50 2wrs n GLN 102 N -3.11 3.07 -0.07 1.90 6.02 -0.24 -4.77 117.38 120.18 2wrs n GLN 102 Ca -0.02 -0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.87 2wrs n GLN 102 Cb 0.77 -1.06 -0.07 0.00 1.02 0.00 0.00 30.24 30.90 2wrs n GLN 102 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 2wrs n ILE 103 N -2.01 0.83 -1.08 5.09 5.41 0.60 -5.05 119.36 123.15 2wrs n ILE 103 Ca -0.03 -0.31 -0.03 0.00 1.00 0.00 0.00 62.75 63.38 2wrs n ILE 103 Cb 0.50 -1.06 -0.01 0.00 -0.71 0.00 0.00 39.64 38.36 2wrs n ILE 103 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2wrs n GLY 104 N 2.75 0.59 3.45 7.39 0.00 -0.99 -5.03 105.19 113.36 2wrs n GLY 104 Ca -0.26 -0.54 -0.29 0.00 0.00 0.00 0.00 46.02 44.93 2wrs n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wrs s LEU 105 N -0.60 2.57 0.18 0.99 1.02 -1.26 -5.04 118.68 116.54 2wrs s LEU 105 Ca 0.00 -0.62 -0.28 0.00 0.02 0.00 0.00 54.13 53.24 2wrs s LEU 105 Cb 0.00 -1.43 -0.08 0.00 0.02 0.00 0.00 46.19 44.70 2wrs s LEU 105 CO 0.00 0.18 0.89 -2.16 0.02 0.00 0.00 176.35 175.28 2wrs s PRO 106 N -2.09 4.73 0.07 1.29 0.04 -1.26 -4.71 135.00 133.07 2wrs s PRO 106 Ca 0.16 1.37 -0.30 0.00 0.04 0.00 0.00 61.00 62.27 2wrs s PRO 106 Cb -0.10 -3.30 -0.05 0.00 0.04 0.00 0.00 34.50 31.08 2wrs s PRO 106 CO 0.09 0.45 1.07 0.08 0.04 0.00 0.00 177.00 178.73 2wrs s VAL 107 N -0.85 4.33 0.00 -0.36 1.01 -1.26 -1.97 120.40 121.30 2wrs s VAL 107 Ca 0.41 1.77 0.00 0.00 0.00 0.00 0.00 61.98 64.16 2wrs s VAL 107 Cb -0.24 -4.13 0.00 0.00 0.00 0.00 0.00 36.38 32.00 2wrs s VAL 107 CO 0.29 0.19 0.00 0.35 0.00 0.00 0.00 175.10 175.94 2wrs n THR 108 N 3.42 0.00 -3.92 3.92 -2.24 -1.10 -4.66 114.28 109.70 2wrs n THR 108 Ca 0.06 -0.08 -0.09 0.00 -2.27 0.00 0.00 64.05 61.66 2wrs n THR 108 Cb 0.48 0.50 -0.08 0.00 -2.10 0.00 0.00 70.33 69.13 2wrs n THR 108 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2wrs s ARG 109 N -0.97 0.92 -0.27 -0.78 0.52 -1.25 -1.56 118.95 115.56 2wrs s ARG 109 Ca 0.00 -1.07 -0.09 0.00 -0.52 0.00 0.00 55.73 54.05 2wrs s ARG 109 Cb 0.00 0.34 0.11 0.00 0.52 0.00 0.00 34.95 35.92 2wrs s ARG 109 CO 0.00 -0.30 0.58 0.00 0.02 0.00 0.00 175.30 175.60 2wrs s ALA 110 N -3.91 -1.75 -0.09 2.13 0.00 -0.60 -0.49 121.76 117.05 2wrs s ALA 110 Ca 0.10 2.08 -0.00 0.00 0.00 0.00 0.00 51.96 54.13 2wrs s ALA 110 Cb 0.05 -1.61 -0.03 0.00 0.00 0.00 0.00 23.12 21.53 2wrs s ALA 110 CO -0.07 -0.84 -0.07 0.08 0.00 0.00 0.00 175.76 174.86 2wrs s VAL 111 N 2.73 3.67 -0.24 0.00 1.01 -0.05 0.17 120.40 127.69 2wrs s VAL 111 Ca -0.05 -0.48 -0.07 0.00 0.00 0.00 0.00 61.98 61.39 2wrs s VAL 111 Cb -0.12 -2.52 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 2wrs s VAL 111 CO -0.17 0.57 0.05 -0.44 0.00 0.00 0.00 175.10 175.11 2wrs s SER 112 N -0.46 5.01 0.22 3.32 0.01 -0.81 0.62 113.70 121.61 2wrs s SER 112 Ca 0.07 -0.22 0.25 0.00 1.31 0.00 0.00 55.95 57.35 2wrs s SER 112 Cb -0.12 -1.89 0.90 0.00 0.21 0.00 0.00 66.02 65.12 2wrs s SER 112 CO 0.02 -0.02 1.75 0.35 0.41 0.00 0.00 173.24 175.75 2wrs n THR 113 N 4.83 0.69 -3.94 1.44 -2.24 -1.26 -4.60 114.28 109.20 2wrs n THR 113 Ca -0.16 -0.03 0.02 0.00 -2.27 0.00 0.00 64.05 61.60 2wrs n THR 113 Cb 0.51 -0.86 0.01 0.00 -2.10 0.00 0.00 70.33 67.90 2wrs n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wrs n HIS 114 N -2.21 -0.44 0.85 4.78 1.44 -1.26 0.08 115.22 118.47 2wrs n HIS 114 Ca 0.04 -0.60 0.13 0.00 -2.01 0.00 0.00 57.72 55.28 2wrs n HIS 114 Cb 0.33 0.28 0.32 0.00 0.12 0.00 0.00 29.99 31.04 2wrs n HIS 114 CO 0.00 0.00 0.00 1.97 -2.81 0.00 0.00 176.34 175.50 2wrs n PHE 115 N -0.68 0.22 -0.67 -1.40 -1.74 -1.26 -4.30 117.46 107.63 2wrs n PHE 115 Ca 0.03 0.06 -0.31 0.00 -0.56 0.00 0.00 57.45 56.68 2wrs n PHE 115 Cb 0.44 -0.47 0.18 0.00 1.52 0.00 0.00 39.48 41.15 2wrs n PHE 115 CO 0.00 0.00 0.00 -1.01 -0.56 0.00 0.00 176.76 175.19 2wrs s HIS 116 N -3.05 1.57 -0.40 2.97 3.76 -1.26 -4.66 115.29 114.21 2wrs s HIS 116 Ca 0.10 1.69 0.20 0.00 -0.15 0.00 0.00 55.06 56.90 2wrs s HIS 116 Cb 0.16 -3.30 0.98 0.00 1.11 0.00 0.00 32.58 31.54 2wrs s HIS 116 CO 0.66 -3.01 1.61 -0.25 -0.85 0.00 0.00 174.74 172.91 2wrs n ASP 117 N -4.36 0.52 -0.46 1.40 10.43 -1.26 -1.40 116.55 121.42 2wrs n ASP 117 Ca 0.10 0.70 0.14 0.00 2.57 0.00 0.00 54.79 58.30 2wrs n ASP 117 Cb 0.52 -0.78 0.48 0.00 1.84 0.00 0.00 41.12 43.19 2wrs n ASP 117 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 2wrs n ASP 118 N -2.15 1.48 -0.02 -2.24 5.75 -1.26 -2.06 116.55 116.05 2wrs n ASP 118 Ca 0.00 -1.42 -0.04 0.00 -0.01 0.00 0.00 54.79 53.32 2wrs n ASP 118 Cb 0.10 0.02 -0.02 0.00 -1.03 0.00 0.00 41.12 40.20 2wrs n ASP 118 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2wrs n ARG 119 N 0.09 0.11 0.01 0.11 5.12 -0.87 -3.98 116.66 117.25 2wrs n ARG 119 Ca 0.18 0.04 0.11 0.00 -1.93 0.00 0.00 57.85 56.24 2wrs n ARG 119 Cb 0.36 -0.88 -0.04 0.00 -1.16 0.00 0.00 32.46 30.75 2wrs n ARG 119 CO 0.00 0.00 0.00 1.33 -1.93 0.00 0.00 177.63 177.03 2wrs n VAL 120 N -2.95 0.06 -2.66 1.55 0.24 -0.49 -2.27 118.33 111.80 2wrs n VAL 120 Ca -0.09 -0.16 -0.43 0.00 -2.04 0.00 0.00 64.34 61.63 2wrs n VAL 120 Cb 0.58 0.51 -0.03 0.00 -1.47 0.00 0.00 33.84 33.43 2wrs n VAL 120 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2wrs s GLY 121 N -3.44 1.25 0.00 7.63 0.00 -0.87 -2.16 107.32 109.72 2wrs s GLY 121 Ca 0.05 -0.85 0.00 0.00 0.00 0.00 0.00 44.72 43.91 2wrs s GLY 121 CO 0.83 2.36 0.00 0.61 0.00 0.00 0.00 173.10 176.90 2wrs n GLY 122 N 5.03 1.03 0.26 0.20 0.00 -1.26 0.04 105.19 110.49 2wrs n GLY 122 Ca 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.09 2wrs n GLY 122 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wrs h VAL 123 N 0.00 0.32 -0.54 1.61 2.07 -1.78 0.18 116.25 118.11 2wrs h VAL 123 Ca 0.00 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.58 2wrs h VAL 123 Cb 0.00 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.06 2wrs h VAL 123 CO 0.00 0.00 0.36 0.44 0.02 0.00 0.00 177.57 178.39 2wrs h ASP 124 N -0.01 0.43 0.14 0.57 3.32 -1.95 0.44 116.42 119.37 2wrs h ASP 124 Ca 0.32 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 57.20 2wrs h ASP 124 Cb 0.49 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 2wrs h ASP 124 CO -0.69 0.28 -0.64 0.58 -1.72 0.00 0.00 179.24 177.05 2wrs h VAL 125 N 0.49 1.35 0.23 -1.35 2.07 -1.34 0.23 116.25 117.92 2wrs h VAL 125 Ca 0.23 -1.96 -0.01 0.00 0.82 0.00 0.00 66.70 65.78 2wrs h VAL 125 Cb 0.30 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.01 2wrs h VAL 125 CO -0.06 0.60 -0.11 -0.07 0.02 0.00 0.00 177.57 177.94 2wrs h LEU 126 N 0.35 -0.26 -0.88 2.57 3.38 0.90 -3.10 115.31 118.27 2wrs h LEU 126 Ca -0.01 0.01 0.24 0.00 0.09 0.00 0.00 57.88 58.21 2wrs h LEU 126 Cb 1.19 0.07 -0.16 0.00 0.09 0.00 0.00 40.66 41.85 2wrs h LEU 126 CO 0.11 -0.18 0.03 -1.14 0.09 0.00 0.00 178.44 177.35 2wrs n ARG 127 N -2.85 -0.07 0.09 1.13 0.63 0.14 0.14 116.66 115.86 2wrs n ARG 127 Ca -0.04 1.31 0.06 0.00 -0.92 0.00 0.00 57.85 58.26 2wrs n ARG 127 Cb 0.12 -2.09 0.33 0.00 0.45 0.00 0.00 32.46 31.27 2wrs n ARG 127 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2wrs n ALA 128 N -3.20 1.02 -2.30 5.13 0.00 0.07 -2.15 120.51 119.08 2wrs n ALA 128 Ca 0.21 0.11 -0.28 0.00 0.00 0.00 0.00 53.44 53.48 2wrs n ALA 128 Cb 0.69 -1.17 0.01 0.00 0.00 0.00 0.00 19.45 18.98 2wrs n ALA 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wrs n ALA 129 N -1.65 5.26 -4.46 0.00 0.00 0.36 -4.92 120.51 115.10 2wrs n ALA 129 Ca -0.01 -4.18 -0.41 0.00 0.00 0.00 0.00 53.44 48.84 2wrs n ALA 129 Cb 0.02 -0.70 -0.07 0.00 0.00 0.00 0.00 19.45 18.70 2wrs n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wrs n GLY 130 N -0.54 -0.41 3.52 0.00 0.00 -0.92 -4.87 105.19 101.97 2wrs n GLY 130 Ca 0.42 0.07 -0.41 0.00 0.00 0.00 0.00 46.02 46.10 2wrs n GLY 130 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wrs s VAL 131 N -3.22 5.18 -0.07 1.61 1.01 -1.18 -4.76 120.40 118.97 2wrs s VAL 131 Ca 0.81 -0.17 -0.31 0.00 0.00 0.00 0.00 61.98 62.31 2wrs s VAL 131 Cb -0.47 -3.86 -0.09 0.00 0.00 0.00 0.00 36.38 31.96 2wrs s VAL 131 CO 0.99 -0.18 2.03 0.00 0.00 0.00 0.00 175.10 177.95 2wrs n ALA 132 N 5.36 1.47 -2.81 5.51 0.00 -0.60 -3.82 120.51 125.61 2wrs n ALA 132 Ca -0.10 0.10 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 2wrs n ALA 132 Cb 0.49 -2.70 -0.07 0.00 0.00 0.00 0.00 19.45 17.16 2wrs n ALA 132 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2wrs s THR 133 N 5.51 5.21 0.04 0.00 -4.23 -1.26 -1.55 115.64 119.36 2wrs s THR 133 Ca 0.94 0.10 0.03 0.00 -1.18 0.00 0.00 61.69 61.59 2wrs s THR 133 Cb -0.48 -3.30 -0.02 0.00 1.34 0.00 0.00 72.50 70.04 2wrs s THR 133 CO 0.43 0.55 -0.10 -0.31 -0.54 0.00 0.00 174.62 174.65 2wrs s TYR 134 N -0.48 0.90 0.21 3.99 1.51 0.13 0.89 117.35 124.48 2wrs s TYR 134 Ca 0.11 -0.42 -0.21 0.00 -1.01 0.00 0.00 57.07 55.55 2wrs s TYR 134 Cb -0.12 -0.53 0.04 0.00 -0.11 0.00 0.00 41.96 41.25 2wrs s TYR 134 CO 0.02 -0.02 0.61 0.00 -1.11 0.00 0.00 175.55 175.05 2wrs s ALA 135 N -1.11 -1.27 0.91 3.71 0.00 -0.99 -1.93 121.76 121.07 2wrs s ALA 135 Ca -0.04 0.02 -0.11 0.00 0.00 0.00 0.00 51.96 51.83 2wrs s ALA 135 Cb -0.09 0.86 0.12 0.00 0.00 0.00 0.00 23.12 24.02 2wrs s ALA 135 CO 0.01 -0.86 1.04 -1.13 0.00 0.00 0.00 175.76 174.82 2wrs n SER 136 N -0.39 0.06 0.20 0.00 3.41 -1.26 -1.09 113.62 114.54 2wrs n SER 136 Ca -0.11 0.43 0.14 0.00 -0.26 0.00 0.00 58.87 59.07 2wrs n SER 136 Cb 0.62 -1.44 0.47 0.00 -0.26 0.00 0.00 64.21 63.61 2wrs n SER 136 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2wrs h PRO 137 N -1.69 0.00 -0.00 4.33 0.11 -1.90 -1.99 132.00 130.85 2wrs h PRO 137 Ca -0.44 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.67 2wrs h PRO 137 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2wrs h PRO 137 CO 0.41 0.00 -0.01 1.03 -0.21 0.00 0.00 178.00 179.22 2wrs h SER 138 N 0.00 0.01 -0.78 -2.05 0.87 -1.92 -2.72 113.55 106.96 2wrs h SER 138 Ca 0.00 -0.58 0.15 0.00 -1.23 0.00 0.00 61.79 60.13 2wrs h SER 138 Cb 0.62 -0.00 -0.10 0.00 -0.44 0.00 0.00 62.40 62.49 2wrs h SER 138 CO 0.00 0.59 0.34 0.74 -0.53 0.00 0.00 176.83 177.97 2wrs h THR 139 N -0.57 0.66 -0.24 2.23 2.02 -1.80 -1.31 112.91 113.90 2wrs h THR 139 Ca 0.00 -0.17 -0.05 0.00 0.77 0.00 0.00 66.41 66.96 2wrs h THR 139 Cb 0.59 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 2wrs h THR 139 CO 0.00 0.09 -0.08 0.03 0.37 0.00 0.00 175.52 175.93 2wrs h ARG 140 N 0.48 0.38 0.29 6.66 3.08 -1.38 -1.71 114.38 122.18 2wrs h ARG 140 Ca 0.43 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.38 2wrs h ARG 140 Cb 0.66 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.66 2wrs h ARG 140 CO -0.40 0.48 -0.14 0.00 -1.07 0.00 0.00 179.97 178.84 2wrs h ARG 141 N 0.36 -0.38 -0.11 0.04 3.08 -1.01 -3.18 114.38 113.19 2wrs h ARG 141 Ca 0.08 0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.18 2wrs h ARG 141 Cb 0.38 0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.51 2wrs h ARG 141 CO 0.02 -0.25 0.24 -0.07 -1.07 0.00 0.00 179.97 178.84 2wrs h LEU 142 N -0.39 0.00 0.00 3.04 3.38 -1.09 -0.86 115.31 119.38 2wrs h LEU 142 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2wrs h LEU 142 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2wrs h LEU 142 CO 0.07 0.00 -0.92 0.00 0.09 0.00 0.00 178.44 177.67 2wrs h ALA 143 N 1.62 0.52 0.00 1.53 0.00 -1.38 -2.44 119.26 119.11 2wrs h ALA 143 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.79 2wrs h ALA 143 Cb 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 2wrs h ALA 143 CO -0.00 0.00 -0.92 1.49 0.00 0.00 0.00 179.25 179.82 2wrs h GLU 144 N 0.00 0.00 -0.22 0.00 4.81 -1.14 -1.52 114.58 116.52 2wrs h GLU 144 Ca 0.00 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.14 2wrs h GLU 144 Cb 0.97 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.33 2wrs h GLU 144 CO 0.00 0.70 -0.25 0.00 -0.73 0.00 0.00 179.01 178.73 2wrs h ALA 145 N 1.23 1.17 -0.02 2.92 0.00 -1.43 -2.67 119.26 120.46 2wrs h ALA 145 Ca -0.05 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2wrs h ALA 145 Cb 1.63 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.31 2wrs h ALA 145 CO 0.09 0.53 -0.27 -1.91 0.00 0.00 0.00 179.25 177.69 2wrs n GLU 146 N -4.13 1.49 -0.94 0.00 4.07 -0.93 -4.96 120.64 115.24 2wrs n GLU 146 Ca -0.01 -1.16 0.00 0.00 -0.06 0.00 0.00 57.16 55.94 2wrs n GLU 146 Cb 0.39 -1.48 0.00 0.00 -0.06 0.00 0.00 31.44 30.30 2wrs n GLU 146 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2wrs n GLY 147 N 1.37 0.47 3.74 8.31 0.00 -1.01 -5.02 105.19 113.05 2wrs n GLY 147 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2wrs n GLY 147 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wrs s ASN 148 N -2.25 4.11 0.73 1.61 -0.87 -0.59 -4.99 114.94 112.69 2wrs s ASN 148 Ca 0.00 1.93 -0.16 0.00 -1.57 0.00 0.00 52.86 53.06 2wrs s ASN 148 Cb 0.00 -2.54 -0.01 0.00 -0.02 0.00 0.00 41.25 38.69 2wrs s ASN 148 CO 0.00 -2.30 0.81 -0.62 -2.57 0.00 0.00 177.10 172.42 2wrs n GLU 149 N -3.66 0.41 -3.97 -0.60 1.02 -1.26 -4.40 120.64 108.17 2wrs n GLU 149 Ca 0.10 0.19 -0.33 0.00 -0.02 0.00 0.00 57.16 57.09 2wrs n GLU 149 Cb 0.53 -2.08 -0.14 0.00 -0.02 0.00 0.00 31.44 29.72 2wrs n GLU 149 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2wrs s ILE 150 N -1.87 2.61 0.23 -3.67 1.01 -1.26 -4.82 121.20 113.42 2wrs s ILE 150 Ca 0.70 -1.73 -0.32 0.00 0.00 0.00 0.00 60.65 59.30 2wrs s ILE 150 Cb -0.34 -2.62 -0.13 0.00 0.01 0.00 0.00 42.46 39.38 2wrs s ILE 150 CO 0.53 -0.24 1.58 -2.65 0.00 0.00 0.00 174.94 174.16 2wrs n PRO 151 N 4.48 2.42 0.03 2.79 -0.02 -1.26 -4.94 135.00 138.50 2wrs n PRO 151 Ca -0.09 0.87 -0.02 0.00 -2.02 0.00 0.00 63.50 62.24 2wrs n PRO 151 Cb 0.42 -2.63 -0.01 0.00 -0.02 0.00 0.00 33.50 31.26 2wrs n PRO 151 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2wrs h THR 152 N 3.45 0.00 -3.90 3.45 2.02 -1.87 -3.44 112.91 112.62 2wrs h THR 152 Ca -0.45 0.00 -0.48 0.00 0.77 0.00 0.00 66.41 66.25 2wrs h THR 152 Cb 1.24 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.65 2wrs h THR 152 CO 0.85 0.00 0.22 -1.00 0.37 0.00 0.00 175.52 175.96 2wrs s HIS 153 N -3.29 3.43 -0.37 3.16 3.76 0.26 -4.95 115.29 117.28 2wrs s HIS 153 Ca -0.02 1.28 -0.06 0.00 -0.15 0.00 0.00 55.06 56.11 2wrs s HIS 153 Cb 0.00 -2.62 0.07 0.00 1.11 0.00 0.00 32.58 31.14 2wrs s HIS 153 CO 0.06 -0.15 0.16 0.45 -0.85 0.00 0.00 174.74 174.41 2wrs s SER 154 N -2.85 5.35 0.01 1.40 0.15 -1.26 -2.36 113.70 114.14 2wrs s SER 154 Ca 0.55 -1.43 -0.30 0.00 0.70 0.00 0.00 55.95 55.47 2wrs s SER 154 Cb -0.10 -1.88 -0.06 0.00 -1.71 0.00 0.00 66.02 62.27 2wrs s SER 154 CO 0.26 -0.42 1.43 -0.76 1.20 0.00 0.00 173.24 174.96 2wrs s LEU 155 N 1.34 4.32 0.25 3.45 1.43 -0.25 -4.87 118.68 124.35 2wrs s LEU 155 Ca 0.01 2.17 0.06 0.00 -1.03 0.00 0.00 54.13 55.34 2wrs s LEU 155 Cb -0.21 -3.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.41 2wrs s LEU 155 CO 0.01 -0.74 0.27 -1.61 0.23 0.00 0.00 176.35 174.51 2wrs s GLU 156 N 2.38 3.14 -0.24 1.70 0.41 -1.26 -3.77 118.70 121.06 2wrs s GLU 156 Ca 0.65 -0.93 -0.01 0.00 -0.41 0.00 0.00 54.97 54.27 2wrs s GLU 156 Cb -0.33 -2.70 0.00 0.00 -1.78 0.00 0.00 34.13 29.32 2wrs s GLU 156 CO 0.27 0.41 0.21 0.41 -0.49 0.00 0.00 175.26 176.07 2wrs n GLY 157 N -1.28 0.55 0.00 -1.39 0.00 -1.26 -4.94 105.19 96.86 2wrs n GLY 157 Ca -0.08 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2wrs n GLY 157 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2wrs n LEU 158 N -1.42 0.23 -0.24 0.99 4.77 -1.26 -4.46 117.00 115.61 2wrs n LEU 158 Ca -0.02 -0.23 -0.06 0.00 -0.03 0.00 0.00 56.01 55.67 2wrs n LEU 158 Cb 0.52 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.65 2wrs n LEU 158 CO 0.12 0.06 1.06 0.77 -1.33 0.00 0.00 177.39 178.07 2wrs h SER 159 N 0.00 0.86 -2.75 -1.43 4.64 -1.93 -3.41 113.55 109.52 2wrs h SER 159 Ca 0.00 -0.12 -0.66 0.00 -0.47 0.00 0.00 61.79 60.55 2wrs h SER 159 Cb 0.54 -0.22 -0.08 0.00 -0.31 0.00 0.00 62.40 62.33 2wrs h SER 159 CO 0.00 0.73 -0.48 -0.94 -0.87 0.00 0.00 176.83 175.27 2wrs s SER 160 N -6.03 6.36 0.63 4.97 1.04 -1.26 -5.06 113.70 114.34 2wrs s SER 160 Ca -0.13 0.43 -0.17 0.00 0.48 0.00 0.00 55.95 56.55 2wrs s SER 160 Cb 0.14 -2.07 -0.05 0.00 0.10 0.00 0.00 66.02 64.14 2wrs s SER 160 CO 0.79 0.37 0.77 -1.54 0.98 0.00 0.00 173.24 174.61 2wrs n SER 161 N 2.25 -0.12 0.00 7.02 3.41 -1.26 -2.56 113.62 122.36 2wrs n SER 161 Ca -0.19 0.73 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 2wrs n SER 161 Cb 0.54 -1.30 0.00 0.00 -0.26 0.00 0.00 64.21 63.19 2wrs n SER 161 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wrs n GLY 162 N 1.47 3.26 3.78 5.00 0.00 -0.16 -4.86 105.19 113.67 2wrs n GLY 162 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 2wrs n GLY 162 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wrs s ASP 163 N -0.66 5.06 0.11 1.61 1.01 -1.06 -4.89 116.67 117.85 2wrs s ASP 163 Ca 0.00 1.92 -0.02 0.00 0.71 0.00 0.00 52.55 55.16 2wrs s ASP 163 Cb 0.00 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.35 2wrs s ASP 163 CO 0.00 -1.66 0.05 0.00 0.21 0.00 0.00 175.17 173.77 2wrs s ALA 164 N -2.51 0.68 -0.07 5.23 0.00 -1.26 -2.45 121.76 121.38 2wrs s ALA 164 Ca 0.65 -1.34 -0.23 0.00 0.00 0.00 0.00 51.96 51.04 2wrs s ALA 164 Cb -0.19 0.70 0.05 0.00 0.00 0.00 0.00 23.12 23.68 2wrs s ALA 164 CO 0.45 -0.47 0.53 0.14 0.00 0.00 0.00 175.76 176.41 2wrs s VAL 165 N -4.00 0.02 0.45 0.00 -7.23 -0.70 -4.92 120.40 104.01 2wrs s VAL 165 Ca 0.19 -0.16 -0.12 0.00 -1.81 0.00 0.00 61.98 60.08 2wrs s VAL 165 Cb 0.07 -0.83 -0.06 0.00 0.56 0.00 0.00 36.38 36.12 2wrs s VAL 165 CO -0.02 -0.09 0.84 -0.60 -0.31 0.00 0.00 175.10 174.92 2wrs s ARG 166 N -0.96 3.80 -0.29 4.82 6.06 -1.26 -0.33 118.95 130.78 2wrs s ARG 166 Ca -0.10 0.59 0.05 0.00 -2.50 0.00 0.00 55.73 53.77 2wrs s ARG 166 Cb -0.03 -2.31 0.19 0.00 0.06 0.00 0.00 34.95 32.86 2wrs s ARG 166 CO 0.06 -0.13 0.53 0.12 -2.50 0.00 0.00 175.30 173.38 2wrs s PHE 167 N -2.50 -1.57 0.00 5.12 5.36 -0.06 -4.88 117.98 119.44 2wrs s PHE 167 Ca 0.53 0.82 0.00 0.00 -0.96 0.00 0.00 56.93 57.32 2wrs s PHE 167 Cb -0.10 0.16 0.00 0.00 -0.34 0.00 0.00 43.02 42.73 2wrs s PHE 167 CO 0.33 -1.06 0.00 0.41 -1.46 0.00 0.00 175.22 173.45 2wrs n GLY 168 N 5.39 2.70 0.04 13.12 0.00 -1.26 -2.18 105.19 123.00 2wrs n GLY 168 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2wrs n GLY 168 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2wrs n PRO 169 N 14.00 1.01 -4.32 1.61 -0.02 -1.26 -4.81 135.00 141.21 2wrs n PRO 169 Ca 0.00 -0.01 -0.17 0.00 -2.02 0.00 0.00 63.50 61.30 2wrs n PRO 169 Cb 0.00 -1.03 -0.10 0.00 -0.02 0.00 0.00 33.50 32.34 2wrs n PRO 169 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2wrs s VAL 170 N -1.93 1.04 -0.01 -1.45 -7.23 -0.93 -4.17 120.40 105.71 2wrs s VAL 170 Ca 0.00 -2.04 0.03 0.00 -1.81 0.00 0.00 61.98 58.16 2wrs s VAL 170 Cb 0.00 -2.29 -0.03 0.00 0.56 0.00 0.00 36.38 34.62 2wrs s VAL 170 CO 0.00 -0.37 -0.07 -0.70 -0.31 0.00 0.00 175.10 173.66 2wrs s GLU 171 N -3.85 2.59 -0.19 4.82 2.12 0.16 -0.89 118.70 123.45 2wrs s GLU 171 Ca 0.27 -0.69 -0.02 0.00 0.36 0.00 0.00 54.97 54.90 2wrs s GLU 171 Cb 0.05 -2.51 -0.00 0.00 0.26 0.00 0.00 34.13 31.93 2wrs s GLU 171 CO 0.08 0.61 -0.11 -0.51 -0.54 0.00 0.00 175.26 174.80 2wrs s LEU 172 N -1.28 2.63 -0.07 2.70 1.43 0.55 0.15 118.68 124.79 2wrs s LEU 172 Ca 0.16 -0.45 0.05 0.00 -1.03 0.00 0.00 54.13 52.85 2wrs s LEU 172 Cb -0.11 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.46 2wrs s LEU 172 CO 0.06 0.02 -0.22 0.12 0.23 0.00 0.00 176.35 176.56 2wrs s PHE 173 N 1.19 2.53 -0.40 0.29 5.36 0.14 -1.73 117.98 125.37 2wrs s PHE 173 Ca 0.02 -0.74 -0.04 0.00 -0.96 0.00 0.00 56.93 55.21 2wrs s PHE 173 Cb -0.14 -1.65 0.09 0.00 -0.34 0.00 0.00 43.02 40.98 2wrs s PHE 173 CO -0.04 -0.23 0.19 -0.47 -1.46 0.00 0.00 175.22 173.21 2wrs s TYR 174 N -0.04 3.47 -1.16 10.12 5.04 -1.03 0.60 117.35 134.34 2wrs s TYR 174 Ca -0.06 -2.09 0.04 0.00 -2.44 0.00 0.00 57.07 52.52 2wrs s TYR 174 Cb -0.15 -2.99 0.19 0.00 0.35 0.00 0.00 41.96 39.37 2wrs s TYR 174 CO 0.05 -0.92 0.91 -0.35 -1.34 0.00 0.00 175.55 173.90 2wrs n PRO 175 N 4.69 1.82 -0.06 4.97 -0.04 -1.26 -0.99 135.00 144.13 2wrs n PRO 175 Ca -0.06 -0.75 0.01 0.00 -0.04 0.00 0.00 63.50 62.65 2wrs n PRO 175 Cb 0.42 -1.53 -0.00 0.00 -0.04 0.00 0.00 33.50 32.35 2wrs n PRO 175 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wrs n GLY 176 N 0.35 -1.74 3.72 0.55 0.00 -1.26 -4.28 105.19 102.52 2wrs n GLY 176 Ca 0.07 -1.50 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 2wrs n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrs s ALA 177 N -1.71 3.89 0.00 4.61 0.00 -1.26 -4.85 121.76 122.45 2wrs s ALA 177 Ca 0.00 1.55 0.00 0.00 0.00 0.00 0.00 51.96 53.51 2wrs s ALA 177 Cb 0.00 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.44 2wrs s ALA 177 CO 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 175.76 174.86 2wrs n ALA 178 N 3.82 0.00 -0.27 0.00 0.00 -1.26 -3.20 120.51 119.60 2wrs n ALA 178 Ca 0.15 0.00 0.33 0.00 0.00 0.00 0.00 53.44 53.91 2wrs n ALA 178 Cb 0.36 0.00 0.62 0.00 0.00 0.00 0.00 19.45 20.43 2wrs n ALA 178 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2wrs h HIS 179 N 0.00 0.00 -2.83 0.00 -0.00 -1.87 -2.28 115.15 108.17 2wrs h HIS 179 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 60.37 60.43 2wrs h HIS 179 Cb 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 27.41 27.32 2wrs h HIS 179 CO 0.00 0.00 0.29 -1.54 -0.00 0.00 0.00 177.93 176.68 2wrs s SER 180 N -4.13 -0.38 0.48 3.26 1.04 -1.26 -3.18 113.70 109.54 2wrs s SER 180 Ca -0.04 -0.28 0.32 0.00 0.48 0.00 0.00 55.95 56.43 2wrs s SER 180 Cb 0.18 0.61 1.45 0.00 0.10 0.00 0.00 66.02 68.36 2wrs s SER 180 CO 0.61 -1.06 1.96 0.71 0.98 0.00 0.00 173.24 176.44 2wrs h THR 181 N 2.00 0.00 0.00 2.02 1.35 -1.84 -3.28 112.91 113.16 2wrs h THR 181 Ca -0.26 -0.31 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 2wrs h THR 181 Cb 1.27 1.20 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 2wrs h THR 181 CO 0.30 0.00 -0.33 -0.90 -0.25 0.00 0.00 175.52 174.33 2wrs n ASP 182 N -2.81 0.57 -4.61 5.36 5.75 -1.26 -4.27 116.55 115.28 2wrs n ASP 182 Ca 0.00 -0.56 -0.57 0.00 -0.01 0.00 0.00 54.79 53.65 2wrs n ASP 182 Cb 0.22 1.02 -0.07 0.00 -1.03 0.00 0.00 41.12 41.26 2wrs n ASP 182 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 2wrs n ASN 183 N -1.17 1.34 -4.95 -1.12 2.04 -1.24 -4.72 115.26 105.44 2wrs n ASN 183 Ca 0.01 1.13 -0.19 0.00 -0.44 0.00 0.00 54.58 55.09 2wrs n ASN 183 Cb 0.08 -1.07 -0.01 0.00 -2.53 0.00 0.00 39.78 36.25 2wrs n ASN 183 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 2wrs s LEU 184 N 1.36 3.64 0.25 -4.53 1.43 0.11 -4.39 118.68 116.55 2wrs s LEU 184 Ca 0.92 -0.47 0.02 0.00 -1.03 0.00 0.00 54.13 53.56 2wrs s LEU 184 Cb -1.13 -2.46 -0.05 0.00 0.03 0.00 0.00 46.19 42.58 2wrs s LEU 184 CO 0.58 -0.62 0.08 0.68 0.23 0.00 0.00 176.35 177.30 2wrs s VAL 185 N -2.34 0.66 -0.03 -1.59 -7.23 0.20 -4.71 120.40 105.34 2wrs s VAL 185 Ca 0.49 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.66 2wrs s VAL 185 Cb -0.08 -2.58 0.03 0.00 0.56 0.00 0.00 36.38 34.31 2wrs s VAL 185 CO 0.30 -0.07 0.03 -0.69 -0.31 0.00 0.00 175.10 174.36 2wrs s VAL 186 N -3.68 0.01 -0.15 1.32 1.01 -0.86 0.27 120.40 118.32 2wrs s VAL 186 Ca 0.36 0.25 -0.01 0.00 0.00 0.00 0.00 61.98 62.58 2wrs s VAL 186 Cb 0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 36.38 36.26 2wrs s VAL 186 CO 0.12 0.15 -0.11 -0.47 0.00 0.00 0.00 175.10 174.79 2wrs s TYR 187 N 1.50 2.86 -0.77 5.22 5.04 0.12 -0.92 117.35 130.39 2wrs s TYR 187 Ca -0.03 -0.71 -0.13 0.00 -2.44 0.00 0.00 57.07 53.75 2wrs s TYR 187 Cb -0.13 -1.91 0.20 0.00 0.35 0.00 0.00 41.96 40.48 2wrs s TYR 187 CO -0.03 -0.29 0.70 0.08 -1.34 0.00 0.00 175.55 174.67 2wrs s VAL 188 N 0.60 5.36 0.49 3.14 1.01 -0.77 0.36 120.40 130.59 2wrs s VAL 188 Ca -0.07 -2.40 0.14 0.00 0.00 0.00 0.00 61.98 59.65 2wrs s VAL 188 Cb -0.15 -4.34 0.27 0.00 0.00 0.00 0.00 36.38 32.16 2wrs s VAL 188 CO 0.03 -0.99 2.12 1.55 0.00 0.00 0.00 175.10 177.81 2wrs h PRO 189 N 7.85 0.16 -1.69 2.72 0.14 -1.84 0.12 132.00 139.46 2wrs h PRO 189 Ca 0.04 -0.01 0.49 0.00 0.14 0.00 0.00 66.00 66.66 2wrs h PRO 189 Cb 1.04 -0.04 -0.07 0.00 0.14 0.00 0.00 31.00 32.07 2wrs h PRO 189 CO 0.78 0.11 1.29 1.03 0.14 0.00 0.00 178.00 181.36 2wrs h SER 190 N 0.17 0.00 0.00 1.44 0.87 -1.92 -3.20 113.55 110.91 2wrs h SER 190 Ca 0.05 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 2wrs h SER 190 Cb 0.01 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 2wrs h SER 190 CO -0.01 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.29 2wrs n ALA 191 N -2.79 0.37 -1.54 6.23 0.00 0.27 -5.00 120.51 118.06 2wrs n ALA 191 Ca 0.38 -0.11 -0.07 0.00 0.00 0.00 0.00 53.44 53.64 2wrs n ALA 191 Cb 1.81 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 21.24 2wrs n ALA 191 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2wrs n ASN 192 N 0.00 -3.45 -4.79 0.00 4.13 -0.26 -4.71 115.26 106.18 2wrs n ASN 192 Ca 0.00 0.11 -0.38 0.00 1.68 0.00 0.00 54.58 55.99 2wrs n ASN 192 Cb 0.34 -2.01 -0.06 0.00 -1.54 0.00 0.00 39.78 36.51 2wrs n ASN 192 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2wrs s VAL 193 N -2.30 4.39 -0.08 2.41 1.01 -1.22 0.20 120.40 124.81 2wrs s VAL 193 Ca 0.00 1.61 -0.01 0.00 0.00 0.00 0.00 61.98 63.58 2wrs s VAL 193 Cb 0.00 -4.03 0.03 0.00 0.00 0.00 0.00 36.38 32.37 2wrs s VAL 193 CO 0.00 0.35 -0.03 -0.22 0.00 0.00 0.00 175.10 175.20 2wrs s LEU 194 N -1.58 0.88 -0.38 3.92 2.96 0.11 -1.85 118.68 122.73 2wrs s LEU 194 Ca 0.41 -0.15 -0.09 0.00 -0.22 0.00 0.00 54.13 54.08 2wrs s LEU 194 Cb -0.20 -0.55 0.04 0.00 0.50 0.00 0.00 46.19 45.98 2wrs s LEU 194 CO 0.24 -0.15 0.19 -0.47 -1.32 0.00 0.00 176.35 174.85 2wrs s TYR 195 N 1.71 3.27 0.00 5.38 5.04 -0.10 0.90 117.35 133.56 2wrs s TYR 195 Ca 0.02 -1.25 0.11 0.00 -2.44 0.00 0.00 57.07 53.51 2wrs s TYR 195 Cb -0.13 -2.53 -0.13 0.00 0.35 0.00 0.00 41.96 39.52 2wrs s TYR 195 CO -0.05 -0.73 1.22 0.78 -1.34 0.00 0.00 175.55 175.43 2wrs h GLY 196 N 8.37 0.00 0.00 8.97 0.00 -1.14 -2.27 103.07 116.99 2wrs h GLY 196 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2wrs h GLY 196 CO 0.67 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.82 2wrs n GLY 197 N 1.34 -1.02 0.00 4.60 0.00 -1.26 -3.66 105.19 105.20 2wrs n GLY 197 Ca -0.02 -1.21 0.03 0.00 0.00 0.00 0.00 46.02 44.81 2wrs n GLY 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrs n ALA 199 N -0.62 2.83 -3.79 0.00 0.00 -1.24 -4.61 120.51 113.07 2wrs n ALA 199 Ca 0.04 -0.63 -0.24 0.00 0.00 0.00 0.00 53.44 52.62 2wrs n ALA 199 Cb 0.02 -0.87 -0.17 0.00 0.00 0.00 0.00 19.45 18.42 2wrs n ALA 199 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2wrs s VAL 200 N -2.17 0.49 0.21 0.00 1.01 -0.65 -4.79 120.40 114.50 2wrs s VAL 200 Ca 0.26 0.05 -0.06 0.00 0.00 0.00 0.00 61.98 62.23 2wrs s VAL 200 Cb 0.20 -0.62 -0.06 0.00 0.00 0.00 0.00 36.38 35.89 2wrs s VAL 200 CO 0.40 0.28 0.48 -1.00 0.00 0.00 0.00 175.10 175.25 2wrs s HIS 201 N 1.91 3.46 0.76 5.22 0.09 -1.26 -2.63 115.29 122.84 2wrs s HIS 201 Ca 0.05 0.66 -0.11 0.00 -0.00 0.00 0.00 55.06 55.66 2wrs s HIS 201 Cb -0.12 -2.10 0.05 0.00 -0.00 0.00 0.00 32.58 30.41 2wrs s HIS 201 CO -0.06 0.31 1.08 -1.83 -0.00 0.00 0.00 174.74 174.25 2wrs s GLU 202 N -2.98 2.35 0.17 1.40 -1.05 -1.25 -4.74 118.70 112.60 2wrs s GLU 202 Ca 0.44 1.01 -0.14 0.00 -0.15 0.00 0.00 54.97 56.12 2wrs s GLU 202 Cb -0.11 -1.92 0.13 0.00 -0.44 0.00 0.00 34.13 31.79 2wrs s GLU 202 CO 0.25 -1.53 1.76 -0.07 0.95 0.00 0.00 175.26 176.63 2wrs h LEU 203 N -1.04 0.22 0.00 1.83 3.38 -1.94 -1.68 115.31 116.08 2wrs h LEU 203 Ca -0.45 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2wrs h LEU 203 Cb 1.23 0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.00 2wrs h LEU 203 CO 0.54 0.16 0.00 -1.54 0.09 0.00 0.00 178.44 177.70 2wrs n SER 204 N -4.97 0.00 -4.51 -0.43 3.41 -1.26 -4.47 113.62 101.39 2wrs n SER 204 Ca 0.04 -0.01 -0.43 0.00 -0.26 0.00 0.00 58.87 58.21 2wrs n SER 204 Cb 0.16 -0.07 -0.07 0.00 -0.26 0.00 0.00 64.21 63.97 2wrs n SER 204 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2wrs s ARG 205 N -2.14 3.24 0.11 4.33 3.52 -0.64 -4.90 118.95 122.47 2wrs s ARG 205 Ca 0.04 -0.47 0.24 0.00 -0.13 0.00 0.00 55.73 55.41 2wrs s ARG 205 Cb 0.02 -3.97 0.29 0.00 -1.56 0.00 0.00 34.95 29.73 2wrs s ARG 205 CO 0.04 -1.01 1.27 2.41 -0.81 0.00 0.00 175.30 177.20 2wrs n THR 206 N 5.78 0.33 -4.23 4.11 -1.04 -1.26 -4.90 114.28 113.06 2wrs n THR 206 Ca -0.03 -0.28 -0.26 0.00 -2.04 0.00 0.00 64.05 61.44 2wrs n THR 206 Cb 0.48 -0.08 -0.08 0.00 -1.82 0.00 0.00 70.33 68.82 2wrs n THR 206 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 2wrs s SER 207 N -4.21 4.64 0.31 8.00 1.04 -1.26 -4.96 113.70 117.25 2wrs s SER 207 Ca 0.06 -0.46 -0.29 0.00 0.48 0.00 0.00 55.95 55.74 2wrs s SER 207 Cb 0.13 -0.93 -0.10 0.00 0.10 0.00 0.00 66.02 65.22 2wrs s SER 207 CO 0.74 0.08 1.17 0.00 0.98 0.00 0.00 173.24 176.21 2wrs s ALA 208 N -1.78 3.41 0.22 5.32 0.00 -1.26 -5.04 121.76 122.64 2wrs s ALA 208 Ca 0.27 1.02 0.00 0.00 0.00 0.00 0.00 51.96 53.25 2wrs s ALA 208 Cb -0.09 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.65 2wrs s ALA 208 CO 0.18 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 176.00 2wrs n GLY 209 N 1.00 0.72 3.63 0.00 0.00 -1.26 -4.87 105.19 104.42 2wrs n GLY 209 Ca -0.00 -1.35 -0.56 0.00 0.00 0.00 0.00 46.02 44.10 2wrs n GLY 209 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wrs n ASN 210 N 0.00 1.59 0.00 1.61 5.15 -1.26 -4.84 115.26 117.51 2wrs n ASN 210 Ca 0.00 1.12 0.00 0.00 -0.60 0.00 0.00 54.58 55.10 2wrs n ASN 210 Cb 0.00 -1.11 0.00 0.00 -0.53 0.00 0.00 39.78 38.14 2wrs n ASN 210 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 2wrs n VAL 211 N 3.16 0.33 -0.36 3.44 0.24 -1.26 -4.80 118.33 119.09 2wrs n VAL 211 Ca 0.22 -0.60 0.03 0.00 -2.04 0.00 0.00 64.34 61.96 2wrs n VAL 211 Cb 0.13 0.92 0.10 0.00 -1.47 0.00 0.00 33.84 33.52 2wrs n VAL 211 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wrs h ALA 212 N 0.00 0.47 -0.38 2.33 0.00 -1.94 -2.05 119.26 117.68 2wrs h ALA 212 Ca 0.00 0.34 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2wrs h ALA 212 Cb 0.26 0.83 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2wrs h ALA 212 CO 0.00 -0.47 0.00 -0.25 0.00 0.00 0.00 179.25 178.53 2wrs n ASP 213 N -5.56 3.04 -3.71 0.00 8.00 -1.26 -5.00 116.55 112.05 2wrs n ASP 213 Ca 0.13 -1.95 -0.28 0.00 0.71 0.00 0.00 54.79 53.40 2wrs n ASP 213 Cb 0.46 -0.26 0.20 0.00 -0.02 0.00 0.00 41.12 41.50 2wrs n ASP 213 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wrs n ALA 214 N 0.75 -1.84 -3.35 2.24 0.00 -0.77 -4.12 120.51 113.42 2wrs n ALA 214 Ca 0.14 -1.60 -0.16 0.00 0.00 0.00 0.00 53.44 51.82 2wrs n ALA 214 Cb 0.45 -0.09 -0.07 0.00 0.00 0.00 0.00 19.45 19.74 2wrs n ALA 214 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2wrs s ASP 215 N -5.25 1.05 0.43 0.00 -1.08 -0.86 -4.90 116.67 106.06 2wrs s ASP 215 Ca 0.70 -1.49 0.23 0.00 -0.52 0.00 0.00 52.55 51.47 2wrs s ASP 215 Cb -0.03 0.63 0.90 0.00 -1.46 0.00 0.00 42.92 42.96 2wrs s ASP 215 CO 0.50 -0.26 1.82 -0.07 0.52 0.00 0.00 175.17 177.67 2wrs h LEU 216 N 7.13 0.00 0.51 -1.34 3.38 -1.95 0.99 115.31 124.03 2wrs h LEU 216 Ca 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2wrs h LEU 216 Cb 1.06 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 2wrs h LEU 216 CO 0.20 0.24 -0.49 0.00 0.09 0.00 0.00 178.44 178.48 2wrs h ALA 217 N 1.76 -1.12 0.00 1.53 0.00 -1.96 -3.28 119.26 116.19 2wrs h ALA 217 Ca -0.00 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.61 2wrs h ALA 217 Cb 0.76 0.71 -0.02 0.00 0.00 0.00 0.00 17.79 19.24 2wrs h ALA 217 CO 0.03 -1.17 -0.80 1.49 0.00 0.00 0.00 179.25 178.81 2wrs h GLU 218 N -1.00 0.00 -0.68 0.00 4.57 -1.73 -3.39 114.58 112.35 2wrs h GLU 218 Ca -0.06 0.00 0.10 0.00 -1.18 0.00 0.00 59.36 58.22 2wrs h GLU 218 Cb 0.87 0.00 -0.12 0.00 -0.16 0.00 0.00 28.75 29.34 2wrs h GLU 218 CO -0.06 0.35 -0.41 2.35 -1.18 0.00 0.00 179.01 180.07 2wrs h TRP 219 N 0.00 -1.18 -0.84 0.92 2.91 -0.77 -0.68 115.95 116.31 2wrs h TRP 219 Ca -0.05 0.09 0.10 0.00 1.13 0.00 0.00 58.89 60.15 2wrs h TRP 219 Cb 1.39 0.61 -0.06 0.00 -0.51 0.00 0.00 29.16 30.59 2wrs h TRP 219 CO 0.00 -0.41 0.55 -1.00 -1.03 0.00 0.00 178.44 176.55 2wrs h PRO 220 N -0.16 0.76 0.39 2.65 0.13 -1.76 -1.88 132.00 132.13 2wrs h PRO 220 Ca 0.22 -0.05 -0.02 0.00 -0.87 0.00 0.00 66.00 65.29 2wrs h PRO 220 Cb 0.56 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.52 2wrs h PRO 220 CO -0.75 0.50 -0.19 1.15 -0.23 0.00 0.00 178.00 178.49 2wrs h THR 221 N 0.79 0.61 -0.98 1.56 2.02 -1.41 -2.92 112.91 112.58 2wrs h THR 221 Ca 0.39 -0.28 0.34 0.00 0.77 0.00 0.00 66.41 67.63 2wrs h THR 221 Cb 0.46 0.76 -0.16 0.00 -1.74 0.00 0.00 68.15 67.46 2wrs h THR 221 CO -0.16 0.05 0.46 0.28 0.37 0.00 0.00 175.52 176.53 2wrs h SER 222 N -0.69 0.29 -0.45 4.18 0.02 -0.92 0.53 113.55 116.52 2wrs h SER 222 Ca -0.05 0.22 -0.03 0.00 -0.84 0.00 0.00 61.79 61.09 2wrs h SER 222 Cb 0.49 0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.24 2wrs h SER 222 CO 0.09 -0.25 0.18 0.58 -1.14 0.00 0.00 176.83 176.28 2wrs h VAL 223 N 0.18 1.20 -0.10 2.27 2.07 -1.28 -3.04 116.25 117.54 2wrs h VAL 223 Ca 0.73 -0.63 0.02 0.00 0.82 0.00 0.00 66.70 67.65 2wrs h VAL 223 Cb 1.73 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 32.26 2wrs h VAL 223 CO -0.69 0.23 -0.03 -0.08 0.02 0.00 0.00 177.57 177.02 2wrs h GLU 224 N 0.58 -0.01 -0.19 1.57 4.57 0.17 0.19 114.58 121.46 2wrs h GLU 224 Ca 0.15 0.00 0.05 0.00 -1.18 0.00 0.00 59.36 58.38 2wrs h GLU 224 Cb 0.19 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.78 2wrs h GLU 224 CO -0.01 -0.01 0.63 -0.09 -1.18 0.00 0.00 179.01 178.35 2wrs h ARG 225 N -0.01 0.00 0.00 1.92 2.43 -1.32 -2.82 114.38 114.58 2wrs h ARG 225 Ca 0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 2wrs h ARG 225 Cb 0.09 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 2wrs h ARG 225 CO -0.11 0.00 0.00 -0.89 -1.51 0.00 0.00 179.97 177.46 2wrs n ILE 226 N -2.97 0.00 -0.52 1.20 5.41 0.64 -3.26 119.36 119.87 2wrs n ILE 226 Ca 0.03 0.17 0.44 0.00 1.00 0.00 0.00 62.75 64.40 2wrs n ILE 226 Cb 0.71 -0.58 0.79 0.00 -0.71 0.00 0.00 39.64 39.85 2wrs n ILE 226 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 176.55 176.61 2wrs h GLN 227 N 0.00 0.00 0.34 0.38 3.07 -1.36 0.15 115.11 117.69 2wrs h GLN 227 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.72 2wrs h GLN 227 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.56 2wrs h GLN 227 CO 0.00 0.00 -0.16 -0.22 0.09 0.00 0.00 178.83 178.54 2wrs h LYS 228 N 0.00 -0.44 -0.11 0.06 3.64 -1.69 -3.14 116.57 114.89 2wrs h LYS 228 Ca 0.75 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 60.19 2wrs h LYS 228 Cb 3.04 0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 34.95 2wrs h LYS 228 CO -0.01 -0.29 0.13 1.25 -2.27 0.00 0.00 179.45 178.25 2wrs h HIS 229 N -0.62 0.00 -2.49 1.91 2.76 -0.76 -3.23 115.15 112.72 2wrs h HIS 229 Ca -0.05 0.00 -0.60 0.00 -2.20 0.00 0.00 60.37 57.52 2wrs h HIS 229 Cb 0.35 0.00 -0.41 0.00 1.55 0.00 0.00 27.41 28.90 2wrs h HIS 229 CO 0.08 0.00 -0.67 0.66 -1.30 0.00 0.00 177.93 176.70 2wrs n TYR 230 N -3.80 2.75 0.03 5.26 4.01 -0.27 -4.94 117.16 120.19 2wrs n TYR 230 Ca -0.00 -4.08 -0.06 0.00 -0.16 0.00 0.00 57.90 53.59 2wrs n TYR 230 Cb 0.23 -0.50 -0.11 0.00 -0.31 0.00 0.00 39.34 38.65 2wrs n TYR 230 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2wrs h PRO 231 N 4.68 0.00 -0.64 -0.72 0.14 -1.56 -3.30 132.00 130.59 2wrs h PRO 231 Ca 0.17 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.31 2wrs h PRO 231 Cb 0.73 0.00 0.00 0.00 0.14 0.00 0.00 31.00 31.87 2wrs h PRO 231 CO 0.72 0.63 0.00 -0.85 0.14 0.00 0.00 178.00 178.65 2wrs n GLU 232 N -3.14 1.20 -2.04 0.86 -0.00 -1.26 -4.87 120.64 111.40 2wrs n GLU 232 Ca -0.09 -0.19 -0.41 0.00 -0.00 0.00 0.00 57.16 56.47 2wrs n GLU 232 Cb 0.96 -1.37 -0.03 0.00 -0.00 0.00 0.00 31.44 31.00 2wrs n GLU 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2wrs s ALA 233 N -1.41 2.58 0.00 -1.84 0.00 -1.24 -4.84 121.76 115.01 2wrs s ALA 233 Ca 0.03 -0.15 -0.04 0.00 0.00 0.00 0.00 51.96 51.80 2wrs s ALA 233 Cb 0.02 -4.13 -0.02 0.00 0.00 0.00 0.00 23.12 18.99 2wrs s ALA 233 CO 0.01 -3.16 0.71 0.93 0.00 0.00 0.00 175.76 174.25 2wrs h GLU 234 N 13.66 -0.15 -5.53 0.00 5.08 -0.53 -3.39 114.58 123.72 2wrs h GLU 234 Ca -0.30 0.01 -0.64 0.00 -1.00 0.00 0.00 59.36 57.43 2wrs h GLU 234 Cb 1.16 0.04 -0.09 0.00 0.50 0.00 0.00 28.75 30.36 2wrs h GLU 234 CO 1.11 -0.10 -0.47 0.08 -1.00 0.00 0.00 179.01 178.63 2wrs s VAL 235 N -2.67 5.46 0.01 3.13 1.01 -1.08 -4.29 120.40 121.97 2wrs s VAL 235 Ca -0.02 0.23 0.06 0.00 0.00 0.00 0.00 61.98 62.25 2wrs s VAL 235 Cb 0.00 -3.44 -0.03 0.00 0.00 0.00 0.00 36.38 32.92 2wrs s VAL 235 CO 0.07 0.55 -0.19 -0.69 0.00 0.00 0.00 175.10 174.85 2wrs s VAL 236 N -0.54 2.70 -0.10 2.92 1.01 -0.79 0.05 120.40 125.65 2wrs s VAL 236 Ca 0.13 -1.05 0.04 0.00 0.00 0.00 0.00 61.98 61.09 2wrs s VAL 236 Cb -0.12 -2.08 0.00 0.00 0.00 0.00 0.00 36.38 34.18 2wrs s VAL 236 CO 0.02 0.45 -0.24 -0.63 0.00 0.00 0.00 175.10 174.71 2wrs s ILE 237 N -0.81 2.06 0.42 2.22 1.01 0.26 -1.33 121.20 125.03 2wrs s ILE 237 Ca 0.13 -1.01 -0.09 0.00 0.00 0.00 0.00 60.65 59.68 2wrs s ILE 237 Cb -0.10 -1.78 -0.06 0.00 0.01 0.00 0.00 42.46 40.53 2wrs s ILE 237 CO 0.03 0.56 0.77 -2.16 0.00 0.00 0.00 174.94 174.14 2wrs s PRO 238 N 0.38 3.71 0.24 2.79 0.04 -1.26 -0.60 135.00 140.29 2wrs s PRO 238 Ca -0.18 0.39 -0.09 0.00 0.04 0.00 0.00 61.00 61.16 2wrs s PRO 238 Cb -0.18 -2.39 0.38 0.00 0.04 0.00 0.00 34.50 32.35 2wrs s PRO 238 CO 0.08 -0.08 1.63 0.78 0.04 0.00 0.00 177.00 179.45 2wrs h GLY 239 N 0.97 0.74 -5.63 0.56 0.00 -0.89 -3.41 103.07 95.40 2wrs h GLY 239 Ca -0.47 0.14 -0.43 0.00 0.00 0.00 0.00 47.33 46.56 2wrs h GLY 239 CO 0.63 -0.27 -0.79 0.30 0.00 0.00 0.00 176.54 176.41 2wrs s HIS 240 N -6.15 0.97 0.00 5.60 3.76 -1.26 -1.04 115.29 117.17 2wrs s HIS 240 Ca -0.14 -0.26 0.00 0.00 -0.15 0.00 0.00 55.06 54.52 2wrs s HIS 240 Cb 0.22 -0.71 0.00 0.00 1.11 0.00 0.00 32.58 33.20 2wrs s HIS 240 CO 0.75 -0.12 0.00 0.41 -0.85 0.00 0.00 174.74 174.93 2wrs n GLY 241 N 3.39 -1.48 3.74 -2.22 0.00 -1.26 -3.97 105.19 103.40 2wrs n GLY 241 Ca -0.19 -2.08 -0.41 0.00 0.00 0.00 0.00 46.02 43.33 2wrs n GLY 241 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wrs s LEU 242 N 0.00 4.39 0.33 0.99 1.02 -1.26 -4.71 118.68 119.44 2wrs s LEU 242 Ca 0.00 2.65 -0.18 0.00 0.02 0.00 0.00 54.13 56.62 2wrs s LEU 242 Cb 0.00 -3.62 -0.09 0.00 0.02 0.00 0.00 46.19 42.49 2wrs s LEU 242 CO 0.00 -0.70 0.81 -2.16 0.02 0.00 0.00 176.35 174.32 2wrs s PRO 243 N -0.29 4.15 0.00 1.29 0.05 -1.26 -4.59 135.00 134.34 2wrs s PRO 243 Ca 0.60 0.87 0.00 0.00 0.05 0.00 0.00 61.00 62.52 2wrs s PRO 243 Cb -0.42 -2.47 0.00 0.00 0.05 0.00 0.00 34.50 31.66 2wrs s PRO 243 CO 0.42 0.16 0.00 0.41 0.05 0.00 0.00 177.00 178.04 2wrs n GLY 244 N -0.18 4.80 0.00 0.56 0.00 -0.44 -4.96 105.19 104.97 2wrs n GLY 244 Ca 0.03 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.03 2wrs n GLY 244 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wrs n GLY 245 N 2.95 6.47 0.36 -0.02 0.00 -1.26 -1.88 105.19 111.80 2wrs n GLY 245 Ca 0.00 -2.06 0.18 0.00 0.00 0.00 0.00 46.02 44.14 2wrs n GLY 245 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wrs h LEU 246 N 0.00 0.00 -1.21 0.99 3.38 -1.76 -2.96 115.31 113.75 2wrs h LEU 246 Ca 0.00 0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.15 2wrs h LEU 246 Cb 0.00 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.66 2wrs h LEU 246 CO 0.00 0.00 0.61 -2.24 0.09 0.00 0.00 178.44 176.90 2wrs h ASP 247 N 0.00 0.66 0.00 -0.43 3.04 -1.96 -2.22 116.42 115.50 2wrs h ASP 247 Ca 0.10 0.07 0.00 0.00 -3.24 0.00 0.00 57.03 53.96 2wrs h ASP 247 Cb 0.75 -0.06 0.00 0.00 -1.04 0.00 0.00 39.33 38.98 2wrs h ASP 247 CO -0.00 0.27 0.07 -0.07 -2.04 0.00 0.00 179.24 177.47 2wrs h LEU 248 N 0.66 0.00 0.04 0.15 3.38 -1.86 0.13 115.31 117.80 2wrs h LEU 248 Ca 0.52 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 58.25 2wrs h LEU 248 Cb 0.93 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 2wrs h LEU 248 CO -0.28 0.00 -1.15 -0.07 0.09 0.00 0.00 178.44 177.03 2wrs h LEU 249 N 0.00 0.13 0.18 1.67 3.38 -1.65 -2.42 115.31 116.60 2wrs h LEU 249 Ca 0.00 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 2wrs h LEU 249 Cb 0.14 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2wrs h LEU 249 CO 0.00 1.12 -0.08 -0.61 0.09 0.00 0.00 178.44 178.95 2wrs h GLN 250 N 0.02 -0.23 -0.98 1.13 5.75 -0.95 -2.85 115.11 117.00 2wrs h GLN 250 Ca -0.08 0.02 0.23 0.00 -0.15 0.00 0.00 58.65 58.67 2wrs h GLN 250 Cb 1.85 0.05 -0.12 0.00 1.07 0.00 0.00 27.48 30.33 2wrs h GLN 250 CO 0.15 0.19 0.56 1.25 -2.65 0.00 0.00 178.83 178.33 2wrs h HIS 251 N -0.84 0.96 -0.25 3.99 2.76 -1.14 0.13 115.15 120.76 2wrs h HIS 251 Ca -0.02 0.04 -0.11 0.00 -2.20 0.00 0.00 60.37 58.08 2wrs h HIS 251 Cb 0.52 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 29.20 2wrs h HIS 251 CO 0.08 0.08 -0.29 1.15 -1.30 0.00 0.00 177.93 177.65 2wrs h THR 252 N 0.59 1.28 0.13 6.26 2.02 -1.43 -2.04 112.91 119.71 2wrs h THR 252 Ca 0.62 -1.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.43 2wrs h THR 252 Cb 1.13 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.94 2wrs h THR 252 CO -0.46 0.43 -0.06 0.00 0.37 0.00 0.00 175.52 175.79 2wrs h ALA 253 N 1.25 -0.18 -0.33 6.16 0.00 -0.76 -1.73 119.26 123.67 2wrs h ALA 253 Ca 0.06 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.91 2wrs h ALA 253 Cb 0.73 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.51 2wrs h ALA 253 CO 0.06 -0.53 -0.53 -0.91 0.00 0.00 0.00 179.25 177.34 2wrs h ASN 254 N -0.32 -1.76 -0.97 0.00 -0.26 -1.11 0.42 115.58 111.59 2wrs h ASN 254 Ca -0.02 0.23 0.03 0.00 -0.56 0.00 0.00 56.30 55.98 2wrs h ASN 254 Cb 0.26 0.72 -0.05 0.00 -1.06 0.00 0.00 38.32 38.18 2wrs h ASN 254 CO 0.03 -0.42 0.64 0.58 -1.06 0.00 0.00 177.43 177.19 2wrs h VAL 255 N -0.44 1.20 -0.24 2.81 2.07 -1.40 -0.36 116.25 119.89 2wrs h VAL 255 Ca 0.07 -0.43 -0.09 0.00 0.82 0.00 0.00 66.70 67.07 2wrs h VAL 255 Cb 0.62 -0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.21 2wrs h VAL 255 CO -0.55 0.23 -0.19 0.58 0.02 0.00 0.00 177.57 177.66 2wrs h VAL 256 N 1.26 1.31 0.00 2.57 2.07 -0.55 -1.00 116.25 121.91 2wrs h VAL 256 Ca 0.38 -1.33 0.00 0.00 0.82 0.00 0.00 66.70 66.56 2wrs h VAL 256 Cb -0.05 1.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.37 2wrs h VAL 256 CO -0.11 0.41 0.00 1.17 0.02 0.00 0.00 177.57 179.07 2wrs n LYS 257 N -4.41 0.38 -0.11 1.57 0.00 0.14 -3.24 118.16 112.49 2wrs n LYS 257 Ca -0.04 0.06 -0.19 0.00 0.00 0.00 0.00 58.31 58.13 2wrs n LYS 257 Cb 0.40 -1.50 -0.12 0.00 0.00 0.00 0.00 35.03 33.81 2wrs n LYS 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2wrs n ALA 258 N -1.25 1.34 0.38 3.14 0.00 -0.19 -4.24 120.51 119.69 2wrs n ALA 258 Ca 0.12 -1.03 0.05 0.00 0.00 0.00 0.00 53.44 52.58 2wrs n ALA 258 Cb 0.17 -0.18 0.22 0.00 0.00 0.00 0.00 19.45 19.67 2wrs n ALA 258 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2wrs n HIS 259 N -3.36 0.00 0.11 0.00 -0.00 -0.41 -2.10 115.22 109.46 2wrs n HIS 259 Ca -0.44 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 57.24 2wrs n HIS 259 Cb 0.99 -0.42 0.11 0.00 -0.00 0.00 0.00 29.99 30.67 2wrs n HIS 259 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.34 177.21 2wrs h LYS 260 N 0.00 0.06 0.00 1.57 6.56 -1.73 -3.52 116.57 119.51 2wrs h LYS 260 Ca 0.00 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.54 2wrs h LYS 260 Cb 0.14 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 31.81 2wrs h LYS 260 CO 0.00 0.72 0.00 0.27 -2.06 0.00 0.00 179.45 178.38