#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g3p s THR 3 N 0.00 2.09 0.19 2.62 -4.23 -1.26 -4.99 115.64 110.06 2g3p s THR 3 Ca 0.00 -1.91 -0.12 0.00 -1.18 0.00 0.00 61.69 58.49 2g3p s THR 3 Cb 0.00 -2.99 0.10 0.00 1.34 0.00 0.00 72.50 70.95 2g3p s THR 3 CO 0.00 0.00 1.79 0.58 -0.54 0.00 0.00 174.62 176.45 2g3p h VAL 4 N 1.66 0.93 -0.61 2.29 2.07 -1.98 -0.49 116.25 120.12 2g3p h VAL 4 Ca -0.44 -0.18 -0.07 0.00 0.82 0.00 0.00 66.70 66.83 2g3p h VAL 4 Cb 1.24 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 2g3p h VAL 4 CO 0.78 0.10 0.09 -0.33 0.02 0.00 0.00 177.57 178.22 2g3p h GLU 5 N 0.53 0.99 -0.22 1.57 3.07 -1.98 -0.90 114.58 117.64 2g3p h GLU 5 Ca 0.25 -0.25 -0.13 0.00 -0.50 0.00 0.00 59.36 58.73 2g3p h GLU 5 Cb 0.18 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 27.96 2g3p h GLU 5 CO -0.18 0.92 -0.42 0.66 -1.40 0.00 0.00 179.01 178.59 2g3p h SER 6 N 0.93 0.56 -0.40 1.42 4.64 -1.76 -1.88 113.55 117.05 2g3p h SER 6 Ca 0.19 -0.25 -0.02 0.00 -0.47 0.00 0.00 61.79 61.24 2g3p h SER 6 Cb 0.42 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.33 2g3p h SER 6 CO 0.01 0.91 0.18 0.00 -0.87 0.00 0.00 176.83 177.06 2g3p h LEU 8 N 0.51 0.00 -0.01 0.00 3.38 -0.98 -1.93 115.31 116.27 2g3p h LEU 8 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2g3p h LEU 8 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2g3p h LEU 8 CO -0.01 0.17 -0.01 0.00 0.09 0.00 0.00 178.44 178.67 2g3p n ALA 9 N -2.31 2.48 -1.78 1.53 0.00 -0.72 -4.85 120.51 114.86 2g3p n ALA 9 Ca -0.02 -0.14 -0.36 0.00 0.00 0.00 0.00 53.44 52.92 2g3p n ALA 9 Cb 0.28 -1.47 -0.01 0.00 0.00 0.00 0.00 19.45 18.25 2g3p n ALA 9 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2g3p s LYS 10 N -2.67 3.60 0.51 0.00 1.02 -0.73 -5.00 119.74 116.47 2g3p s LYS 10 Ca 0.25 1.62 -0.19 0.00 0.02 0.00 0.00 55.97 57.67 2g3p s LYS 10 Cb 0.20 -2.18 -0.07 0.00 -0.52 0.00 0.00 37.83 35.25 2g3p s LYS 10 CO 0.48 -0.65 1.03 -1.25 -0.92 0.00 0.00 175.35 174.04 2g3p s PRO 11 N -3.04 3.73 0.41 -1.68 0.04 -1.26 -4.77 135.00 128.42 2g3p s PRO 11 Ca 0.68 1.26 -0.27 0.00 0.04 0.00 0.00 61.00 62.72 2g3p s PRO 11 Cb -0.24 -2.09 -0.09 0.00 0.04 0.00 0.00 34.50 32.12 2g3p s PRO 11 CO 0.28 -0.48 1.40 -1.01 0.04 0.00 0.00 177.00 177.23 2g3p s HIS 12 N -2.18 2.65 -0.10 0.56 3.76 -1.26 -4.80 115.29 113.92 2g3p s HIS 12 Ca 0.65 1.29 0.03 0.00 -0.15 0.00 0.00 55.06 56.89 2g3p s HIS 12 Cb -0.15 -3.86 -0.01 0.00 1.11 0.00 0.00 32.58 29.68 2g3p s HIS 12 CO 0.25 -2.62 -0.21 0.99 -0.85 0.00 0.00 174.74 172.30 2g3p s THR 13 N -1.19 2.32 -0.68 1.30 2.01 0.05 -4.92 115.64 114.54 2g3p s THR 13 Ca 0.57 -0.93 -0.14 0.00 0.31 0.00 0.00 61.69 61.50 2g3p s THR 13 Cb -0.43 -1.91 0.17 0.00 0.01 0.00 0.00 72.50 70.35 2g3p s THR 13 CO 0.56 0.55 0.62 -0.70 -0.69 0.00 0.00 174.62 174.96 2g3p s GLU 14 N 0.27 3.23 0.32 4.92 2.12 -1.26 0.13 118.70 128.44 2g3p s GLU 14 Ca -0.15 -2.11 -0.16 0.00 0.36 0.00 0.00 54.97 52.90 2g3p s GLU 14 Cb -0.17 -4.31 0.03 0.00 0.26 0.00 0.00 34.13 29.94 2g3p s GLU 14 CO 0.08 -1.30 0.69 -0.80 -0.54 0.00 0.00 175.26 173.39 2g3p s ASN 15 N 2.72 -0.04 -0.04 -1.70 -0.87 -0.83 -4.92 114.94 109.26 2g3p s ASN 15 Ca 0.11 -0.93 -0.19 0.00 -1.57 0.00 0.00 52.86 50.28 2g3p s ASN 15 Cb -0.20 0.75 -0.05 0.00 -0.02 0.00 0.00 41.25 41.73 2g3p s ASN 15 CO -0.03 -1.45 0.52 -0.44 -2.57 0.00 0.00 177.10 173.13 2g3p s SER 16 N -3.02 6.84 0.07 -1.22 0.01 -1.26 -2.36 113.70 112.77 2g3p s SER 16 Ca 0.16 1.01 0.10 0.00 1.31 0.00 0.00 55.95 58.52 2g3p s SER 16 Cb -0.04 -2.32 -0.03 0.00 0.21 0.00 0.00 66.02 63.84 2g3p s SER 16 CO 0.10 0.11 -0.26 -0.36 0.41 0.00 0.00 173.24 173.24 2g3p s PHE 17 N -0.10 2.26 0.45 2.43 0.40 -0.32 -0.86 117.98 122.25 2g3p s PHE 17 Ca 0.28 -0.40 0.06 0.00 -0.60 0.00 0.00 56.93 56.27 2g3p s PHE 17 Cb -0.17 -1.31 -0.03 0.00 0.51 0.00 0.00 43.02 42.02 2g3p s PHE 17 CO 0.14 0.19 0.24 -0.08 0.70 0.00 0.00 175.22 176.40 2g3p s THR 18 N -0.89 2.10 -1.29 0.64 -1.32 -1.26 -1.80 115.64 111.82 2g3p s THR 18 Ca 0.12 -1.64 -0.07 0.00 -1.21 0.00 0.00 61.69 58.89 2g3p s THR 18 Cb -0.10 -2.74 0.01 0.00 -1.51 0.00 0.00 72.50 68.16 2g3p s THR 18 CO 0.03 0.00 1.12 0.59 -2.21 0.00 0.00 174.62 174.15 2g3p n ASN 19 N -1.39 -5.30 -4.77 8.08 5.03 -0.85 -4.75 115.26 111.32 2g3p n ASN 19 Ca -0.02 -0.55 -0.38 0.00 0.87 0.00 0.00 54.58 54.50 2g3p n ASN 19 Cb 0.64 -4.95 -0.06 0.00 -1.02 0.00 0.00 39.78 34.39 2g3p n ASN 19 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2g3p s VAL 20 N -3.32 4.13 0.15 2.41 1.01 -0.94 -4.67 120.40 119.17 2g3p s VAL 20 Ca 0.44 1.92 0.05 0.00 0.00 0.00 0.00 61.98 64.40 2g3p s VAL 20 Cb -0.19 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.00 2g3p s VAL 20 CO 0.71 0.30 -0.12 -1.66 0.00 0.00 0.00 175.10 174.33 2g3p s TRP 21 N -1.42 1.38 0.01 5.22 -2.14 -0.32 -4.78 118.94 116.89 2g3p s TRP 21 Ca 0.46 -0.66 0.06 0.00 2.66 0.00 0.00 56.10 58.63 2g3p s TRP 21 Cb -0.22 -0.69 -0.02 0.00 -3.10 0.00 0.00 33.47 29.44 2g3p s TRP 21 CO 0.28 0.15 -0.20 0.21 -2.66 0.00 0.00 176.95 174.73 2g3p s LYS 22 N -3.37 1.47 -0.02 3.25 2.20 -1.26 -0.24 119.74 121.78 2g3p s LYS 22 Ca 0.15 -0.78 -0.30 0.00 -0.36 0.00 0.00 55.97 54.68 2g3p s LYS 22 Cb -0.00 -1.48 -0.04 0.00 -1.51 0.00 0.00 37.83 34.80 2g3p s LYS 22 CO 0.02 0.40 1.12 0.34 -0.36 0.00 0.00 175.35 176.87 2g3p s ASP 23 N -0.73 7.17 0.47 1.43 -1.08 0.37 -4.91 116.67 119.38 2g3p s ASP 23 Ca 0.07 1.79 0.24 0.00 -0.52 0.00 0.00 52.55 54.13 2g3p s ASP 23 Cb -0.08 -2.57 1.16 0.00 -1.46 0.00 0.00 42.92 39.97 2g3p s ASP 23 CO 0.00 -0.45 1.95 0.44 0.52 0.00 0.00 175.17 177.63 2g3p h ASP 24 N 7.05 0.00 0.11 -0.34 3.32 -1.91 0.11 116.42 124.76 2g3p h ASP 24 Ca -0.38 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 56.35 2g3p h ASP 24 Cb 1.19 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.72 2g3p h ASP 24 CO 0.82 0.20 -1.73 0.11 -1.72 0.00 0.00 179.24 176.93 2g3p h LYS 25 N 0.00 0.22 0.00 3.56 1.57 -1.92 -3.37 116.57 116.63 2g3p h LYS 25 Ca -0.00 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 2g3p h LYS 25 Cb 0.53 0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.99 2g3p h LYS 25 CO 0.03 1.18 -1.25 0.25 -0.57 0.00 0.00 179.45 179.09 2g3p n THR 26 N -3.76 0.00 -1.38 -0.16 -2.24 -1.24 -4.90 114.28 100.60 2g3p n THR 26 Ca -0.30 -0.21 -0.09 0.00 -2.27 0.00 0.00 64.05 61.17 2g3p n THR 26 Cb 0.95 0.64 -0.04 0.00 -2.10 0.00 0.00 70.33 69.78 2g3p n THR 26 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2g3p n LEU 27 N -1.71 -0.77 -4.78 3.22 4.77 0.39 -4.83 117.00 113.29 2g3p n LEU 27 Ca 0.01 0.21 -0.35 0.00 -0.03 0.00 0.00 56.01 55.85 2g3p n LEU 27 Cb 0.36 -1.58 -0.00 0.00 -2.33 0.00 0.00 43.42 39.88 2g3p n LEU 27 CO 0.38 -0.45 0.76 -1.81 -1.33 0.00 0.00 177.39 174.94 2g3p s ASP 28 N -2.86 5.81 -0.13 -1.43 1.01 -1.25 -4.67 116.67 113.14 2g3p s ASP 28 Ca 0.00 2.10 -0.02 0.00 0.71 0.00 0.00 52.55 55.34 2g3p s ASP 28 Cb 0.00 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.33 2g3p s ASP 28 CO 0.00 -1.15 -0.05 -0.13 0.21 0.00 0.00 175.17 174.05 2g3p s ARG 29 N -3.36 3.46 0.16 8.23 1.81 -1.26 -0.48 118.95 127.51 2g3p s ARG 29 Ca 0.71 -0.54 0.06 0.00 -1.72 0.00 0.00 55.73 54.24 2g3p s ARG 29 Cb -0.22 -2.82 -0.04 0.00 -0.45 0.00 0.00 34.95 31.42 2g3p s ARG 29 CO 0.27 0.33 -0.13 0.71 -0.68 0.00 0.00 175.30 175.79 2g3p s TYR 30 N 0.11 1.51 0.01 -0.53 2.02 0.67 -1.16 117.35 119.98 2g3p s TYR 30 Ca -0.02 -0.61 -0.28 0.00 -0.37 0.00 0.00 57.07 55.79 2g3p s TYR 30 Cb -0.14 -0.74 0.09 0.00 -0.40 0.00 0.00 41.96 40.77 2g3p s TYR 30 CO 0.03 0.22 0.75 0.00 -1.57 0.00 0.00 175.55 174.98 2g3p s ALA 31 N -2.79 -1.75 -0.03 3.71 0.00 -0.50 -1.17 121.76 119.22 2g3p s ALA 31 Ca 0.17 1.02 -0.03 0.00 0.00 0.00 0.00 51.96 53.12 2g3p s ALA 31 Cb -0.01 0.28 -0.04 0.00 0.00 0.00 0.00 23.12 23.35 2g3p s ALA 31 CO 0.04 -0.56 0.13 -0.80 0.00 0.00 0.00 175.76 174.57 2g3p s ASN 32 N -1.98 6.10 -0.28 0.00 0.01 -1.26 -0.86 114.94 116.67 2g3p s ASN 32 Ca -0.02 0.30 -0.16 0.00 -0.71 0.00 0.00 52.86 52.26 2g3p s ASN 32 Cb -0.01 -1.87 0.11 0.00 0.41 0.00 0.00 41.25 39.89 2g3p s ASN 32 CO -0.03 0.30 0.83 -0.47 -1.51 0.00 0.00 177.10 176.22 2g3p s TYR 33 N -1.21 -0.82 -1.48 2.20 5.04 -0.13 -4.85 117.35 116.11 2g3p s TYR 33 Ca 0.23 1.65 -0.03 0.00 -2.44 0.00 0.00 57.07 56.47 2g3p s TYR 33 Cb -0.12 0.49 0.01 0.00 0.35 0.00 0.00 41.96 42.69 2g3p s TYR 33 CO 0.14 -0.40 0.30 0.39 -1.34 0.00 0.00 175.55 174.64 2g3p n GLU 34 N 3.94 -3.25 -0.92 4.97 1.02 -1.26 -1.57 120.64 123.57 2g3p n GLU 34 Ca -0.19 0.80 0.00 0.00 -0.02 0.00 0.00 57.16 57.75 2g3p n GLU 34 Cb 0.58 -5.54 0.00 0.00 -0.02 0.00 0.00 31.44 26.46 2g3p n GLU 34 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2g3p n GLY 35 N -1.19 0.67 3.33 0.62 0.00 -1.26 -4.90 105.19 102.47 2g3p n GLY 35 Ca -0.14 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.66 2g3p n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g3p s LEU 37 N -2.71 4.32 0.09 0.00 2.96 0.11 -0.95 118.68 122.49 2g3p s LEU 37 Ca 0.16 0.69 0.10 0.00 -0.22 0.00 0.00 54.13 54.85 2g3p s LEU 37 Cb -0.05 -2.48 -0.03 0.00 0.50 0.00 0.00 46.19 44.12 2g3p s LEU 37 CO 0.07 0.15 -0.25 0.26 -1.32 0.00 0.00 176.35 175.26 2g3p s TRP 38 N 0.03 2.14 -0.09 5.38 0.52 -0.04 -0.80 118.94 126.08 2g3p s TRP 38 Ca 0.20 -0.39 0.03 0.00 0.02 0.00 0.00 56.10 55.96 2g3p s TRP 38 Cb -0.14 -1.20 0.01 0.00 -1.15 0.00 0.00 33.47 30.98 2g3p s TRP 38 CO 0.08 0.23 -0.17 1.21 0.02 0.00 0.00 176.95 178.32 2g3p s ASN 39 N -1.73 2.41 0.25 2.95 3.04 0.08 -1.41 114.94 120.52 2g3p s ASN 39 Ca 0.11 -0.43 -0.30 0.00 0.04 0.00 0.00 52.86 52.29 2g3p s ASN 39 Cb -0.10 -1.10 -0.09 0.00 -1.54 0.00 0.00 41.25 38.42 2g3p s ASN 39 CO 0.04 0.07 1.11 0.00 -3.04 0.00 0.00 177.10 175.28 2g3p s ALA 40 N 0.66 3.40 -0.06 1.71 0.00 -0.31 -1.15 121.76 126.01 2g3p s ALA 40 Ca -0.14 0.88 0.06 0.00 0.00 0.00 0.00 51.96 52.76 2g3p s ALA 40 Cb -0.16 -3.34 -0.01 0.00 0.00 0.00 0.00 23.12 19.61 2g3p s ALA 40 CO 0.04 -0.18 -0.23 0.95 0.00 0.00 0.00 175.76 176.34 2g3p s THR 41 N -0.87 1.91 0.00 0.00 -4.23 0.43 -4.66 115.64 108.21 2g3p s THR 41 Ca 0.46 -0.98 0.00 0.00 -1.18 0.00 0.00 61.69 59.99 2g3p s THR 41 Cb -0.31 -1.62 0.00 0.00 1.34 0.00 0.00 72.50 71.91 2g3p s THR 41 CO 0.39 0.53 0.00 0.61 -0.54 0.00 0.00 174.62 175.61 2g3p n GLY 42 N 3.04 -1.75 3.70 3.99 0.00 -1.26 -4.17 105.19 108.74 2g3p n GLY 42 Ca -0.18 -1.42 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 2g3p n GLY 42 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2g3p s VAL 43 N 0.00 4.57 0.34 1.61 -7.23 -1.26 -4.93 120.40 113.50 2g3p s VAL 43 Ca 0.00 1.85 0.09 0.00 -1.81 0.00 0.00 61.98 62.11 2g3p s VAL 43 Cb 0.00 -4.19 -0.05 0.00 0.56 0.00 0.00 36.38 32.70 2g3p s VAL 43 CO 0.00 0.07 0.05 0.68 -0.31 0.00 0.00 175.10 175.59 2g3p s VAL 44 N 1.55 2.76 -0.21 1.32 -7.23 -1.24 -4.80 120.40 112.55 2g3p s VAL 44 Ca 0.53 -1.89 -0.03 0.00 -1.81 0.00 0.00 61.98 58.77 2g3p s VAL 44 Cb -0.22 -2.85 -0.00 0.00 0.56 0.00 0.00 36.38 33.86 2g3p s VAL 44 CO 0.24 -0.20 -0.06 -0.69 -0.31 0.00 0.00 175.10 174.08 2g3p s VAL 45 N -2.49 3.20 0.26 1.32 1.01 0.39 -0.32 120.40 123.77 2g3p s VAL 45 Ca 0.35 -0.55 0.08 0.00 0.00 0.00 0.00 61.98 61.87 2g3p s VAL 45 Cb -0.01 -2.44 -0.05 0.00 0.00 0.00 0.00 36.38 33.88 2g3p s VAL 45 CO 0.20 0.44 -0.13 0.00 0.00 0.00 0.00 175.10 175.62 2g3p s THR 47 N -2.85 2.72 0.25 0.00 -4.23 -0.58 -0.74 115.64 110.22 2g3p s THR 47 Ca 0.27 0.24 -0.03 0.00 -1.18 0.00 0.00 61.69 60.99 2g3p s THR 47 Cb 0.00 -2.94 0.22 0.00 1.34 0.00 0.00 72.50 71.12 2g3p s THR 47 CO 0.11 -0.31 1.77 1.23 -0.54 0.00 0.00 174.62 176.89 2g3p h GLY 48 N -1.27 1.28 1.78 3.99 0.00 -1.93 -0.82 103.07 106.10 2g3p h GLY 48 Ca -0.48 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 46.59 2g3p h GLY 48 CO 0.59 0.01 -0.12 2.09 0.00 0.00 0.00 176.54 179.12 2g3p n ASP 49 N -4.85 0.24 -0.68 0.19 5.68 -1.26 -4.87 116.55 111.00 2g3p n ASP 49 Ca 0.15 0.36 -0.07 0.00 -0.50 0.00 0.00 54.79 54.72 2g3p n ASP 49 Cb 0.37 -0.37 -0.02 0.00 -1.14 0.00 0.00 41.12 39.96 2g3p n ASP 49 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2g3p n GLU 50 N -1.63 -0.54 0.08 0.11 1.02 -0.31 -4.92 120.64 114.44 2g3p n GLU 50 Ca 0.06 0.58 -0.09 0.00 -0.02 0.00 0.00 57.16 57.69 2g3p n GLU 50 Cb 0.36 -4.43 -0.01 0.00 -0.02 0.00 0.00 31.44 27.34 2g3p n GLU 50 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 2g3p h THR 51 N 0.00 1.47 -4.23 2.62 1.35 -1.86 -3.41 112.91 108.85 2g3p h THR 51 Ca -0.16 -2.55 -0.51 0.00 -0.55 0.00 0.00 66.41 62.64 2g3p h THR 51 Cb 0.76 2.43 -0.28 0.00 -1.73 0.00 0.00 68.15 69.33 2g3p h THR 51 CO 0.21 0.75 -0.82 -1.10 -0.25 0.00 0.00 175.52 174.31 2g3p s GLN 52 N -3.25 1.24 -0.00 4.72 -0.21 -1.26 -2.01 119.66 118.89 2g3p s GLN 52 Ca -0.04 -0.61 0.01 0.00 0.02 0.00 0.00 55.36 54.75 2g3p s GLN 52 Cb 0.10 -1.21 -0.00 0.00 1.00 0.00 0.00 33.01 32.89 2g3p s GLN 52 CO 0.83 0.33 -0.03 0.00 -2.12 0.00 0.00 175.29 174.30 2g3p s TYR 54 N 0.01 3.05 -2.45 0.00 5.04 0.18 -1.17 117.35 122.00 2g3p s TYR 54 Ca 0.00 -0.16 0.00 0.00 -2.44 0.00 0.00 57.07 54.48 2g3p s TYR 54 Cb -0.02 -1.91 0.00 0.00 0.35 0.00 0.00 41.96 40.38 2g3p s TYR 54 CO -0.00 0.11 0.00 0.41 -1.34 0.00 0.00 175.55 174.72 2g3p n GLY 55 N 3.14 -0.75 3.58 8.97 0.00 -0.99 -0.46 105.19 118.67 2g3p n GLY 55 Ca -0.18 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.53 2g3p n GLY 55 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g3p s THR 56 N -3.00 4.87 -0.13 2.61 2.01 -1.26 -1.96 115.64 118.79 2g3p s THR 56 Ca 0.00 0.66 -0.04 0.00 0.31 0.00 0.00 61.69 62.62 2g3p s THR 56 Cb 0.00 -4.09 -0.03 0.00 0.01 0.00 0.00 72.50 68.39 2g3p s THR 56 CO 0.00 -0.31 0.02 0.26 -0.69 0.00 0.00 174.62 173.90 2g3p s TRP 57 N 2.75 3.20 -0.11 4.92 0.52 0.12 -0.43 118.94 129.92 2g3p s TRP 57 Ca 0.25 0.11 0.01 0.00 0.02 0.00 0.00 56.10 56.49 2g3p s TRP 57 Cb -0.14 -1.91 -0.02 0.00 -1.15 0.00 0.00 33.47 30.25 2g3p s TRP 57 CO 0.15 0.33 -0.14 0.08 0.02 0.00 0.00 176.95 177.39 2g3p s VAL 58 N -0.35 3.01 -0.00 4.03 1.01 -0.30 -0.77 120.40 127.02 2g3p s VAL 58 Ca 0.08 -0.69 -0.30 0.00 0.00 0.00 0.00 61.98 61.06 2g3p s VAL 58 Cb -0.12 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 2g3p s VAL 58 CO 0.02 0.54 1.17 -2.16 0.00 0.00 0.00 175.10 174.67 2g3p s PRO 59 N 0.10 4.41 0.00 2.72 0.04 -1.26 -0.74 135.00 140.26 2g3p s PRO 59 Ca -0.06 1.67 0.00 0.00 0.04 0.00 0.00 61.00 62.65 2g3p s PRO 59 Cb -0.15 -3.46 0.00 0.00 0.04 0.00 0.00 34.50 30.93 2g3p s PRO 59 CO 0.05 -0.32 0.17 0.44 0.04 0.00 0.00 177.00 177.38 2g3p n ILE 60 N 4.25 0.00 -3.63 0.56 -5.35 0.02 -4.70 119.36 110.51 2g3p n ILE 60 Ca 0.09 -0.42 0.00 0.00 -0.27 0.00 0.00 62.75 62.16 2g3p n ILE 60 Cb 0.47 1.07 0.00 0.00 -1.74 0.00 0.00 39.64 39.44 2g3p n ILE 60 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2g3p n GLY 61 N 0.49 -1.24 3.77 3.28 0.00 -1.21 -4.95 105.19 105.33 2g3p n GLY 61 Ca 0.00 -1.06 -0.35 0.00 0.00 0.00 0.00 46.02 44.62 2g3p n GLY 61 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g3p s LEU 62 N 0.00 3.68 0.65 0.99 1.02 -1.26 0.06 118.68 123.81 2g3p s LEU 62 Ca 0.00 2.14 -0.18 0.00 0.02 0.00 0.00 54.13 56.11 2g3p s LEU 62 Cb 0.00 -4.57 -0.01 0.00 0.02 0.00 0.00 46.19 41.63 2g3p s LEU 62 CO 0.00 -1.29 1.28 0.00 0.02 0.00 0.00 176.35 176.36 2g3p s ALA 63 N -1.89 2.35 0.13 4.21 0.00 -0.33 -3.61 121.76 122.62 2g3p s ALA 63 Ca 0.71 1.18 0.10 0.00 0.00 0.00 0.00 51.96 53.96 2g3p s ALA 63 Cb -0.23 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.31 2g3p s ALA 63 CO 0.30 -1.62 -0.24 0.96 0.00 0.00 0.00 175.76 175.16 2g3p s ILE 64 N -1.45 2.05 0.28 0.00 -4.36 -1.26 -4.77 121.20 111.69 2g3p s ILE 64 Ca 0.82 -1.73 -0.30 0.00 -0.26 0.00 0.00 60.65 59.18 2g3p s ILE 64 Cb -0.37 -1.85 -0.13 0.00 1.25 0.00 0.00 42.46 41.36 2g3p s ILE 64 CO 0.40 -0.02 1.32 -2.65 0.24 0.00 0.00 174.94 174.24 2g3p n PRO 65 N 0.84 2.00 -3.98 0.37 -0.02 -1.26 -4.89 135.00 128.06 2g3p n PRO 65 Ca -0.17 0.71 -0.22 0.00 -2.02 0.00 0.00 63.50 61.80 2g3p n PRO 65 Cb 0.54 -2.31 -0.02 0.00 -0.02 0.00 0.00 33.50 31.69 2g3p n PRO 65 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 2g3p s GLU 66 N -1.08 3.40 0.00 -0.52 1.03 -1.26 -5.10 118.70 115.16 2g3p s GLU 66 Ca 0.62 -0.77 0.00 0.00 0.03 0.00 0.00 54.97 54.86 2g3p s GLU 66 Cb -0.62 -2.87 0.00 0.00 -0.80 0.00 0.00 34.13 29.83 2g3p s GLU 66 CO 0.55 0.44 0.00 0.27 -1.33 0.00 0.00 175.26 175.19 2g3p n ASN 67 N -1.31 0.00 0.00 0.83 2.04 -1.26 -5.13 115.26 110.43 2g3p n ASN 67 Ca -0.09 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.05 2g3p n ASN 67 Cb 0.57 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.82 2g3p n ASN 67 CO 0.00 0.00 0.00 0.09 -0.44 0.00 0.00 177.26 176.91 2g3p n PRO 90 N 0.00 0.00 0.00 -0.53 -0.07 -1.26 -5.25 135.00 127.89 2g3p n PRO 90 Ca 0.00 0.00 0.00 0.00 -0.07 0.00 0.00 63.50 63.43 2g3p n PRO 90 Cb 0.00 0.00 0.00 0.00 -0.07 0.00 0.00 33.50 33.43 2g3p n PRO 90 CO 0.00 0.00 0.00 0.39 -0.07 0.00 0.00 175.50 175.82 2g3p n GLU 91 N 0.00 0.00 -3.72 0.58 -0.58 -1.26 -5.22 120.64 110.45 2g3p n GLU 91 Ca 0.00 0.00 -0.28 0.00 -0.42 0.00 0.00 57.16 56.46 2g3p n GLU 91 Cb 0.00 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 30.84 2g3p n GLU 91 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 2g3p s TYR 92 N 0.46 3.48 0.00 -0.32 2.02 -1.26 -5.14 117.35 116.60 2g3p s TYR 92 Ca 0.00 0.35 0.00 0.00 -0.37 0.00 0.00 57.07 57.05 2g3p s TYR 92 Cb 0.00 -1.86 0.00 0.00 -0.40 0.00 0.00 41.96 39.70 2g3p s TYR 92 CO 0.00 0.41 0.00 0.41 -1.57 0.00 0.00 175.55 174.80 2g3p n GLY 93 N -0.48 2.51 0.04 0.71 0.00 -1.26 -4.94 105.19 101.76 2g3p n GLY 93 Ca -0.04 -2.10 0.03 0.00 0.00 0.00 0.00 46.02 43.90 2g3p n GLY 93 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2g3p n ASP 94 N -1.59 1.83 -4.69 1.61 5.68 -1.26 -2.22 116.55 115.92 2g3p n ASP 94 Ca 0.00 -2.22 -0.35 0.00 -0.50 0.00 0.00 54.79 51.72 2g3p n ASP 94 Cb 0.00 -0.13 -0.09 0.00 -1.14 0.00 0.00 41.12 39.76 2g3p n ASP 94 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 2g3p s THR 95 N -1.39 4.47 0.46 2.12 -4.23 -1.26 -4.58 115.64 111.23 2g3p s THR 95 Ca 0.09 -0.18 -0.22 0.00 -1.18 0.00 0.00 61.69 60.20 2g3p s THR 95 Cb 0.08 -2.91 -0.11 0.00 1.34 0.00 0.00 72.50 70.90 2g3p s THR 95 CO 0.01 0.58 0.68 -2.65 -0.54 0.00 0.00 174.62 172.70 2g3p n PRO 96 N 2.37 0.76 -4.42 3.99 -0.02 -1.26 -4.44 135.00 131.99 2g3p n PRO 96 Ca -0.18 0.28 -0.24 0.00 -2.02 0.00 0.00 63.50 61.34 2g3p n PRO 96 Cb 0.54 -1.71 -0.11 0.00 -0.02 0.00 0.00 33.50 32.20 2g3p n PRO 96 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 2g3p s ILE 97 N -1.47 2.27 0.24 4.25 -4.36 -0.60 -4.94 121.20 116.58 2g3p s ILE 97 Ca 0.65 -2.19 -0.30 0.00 -0.26 0.00 0.00 60.65 58.55 2g3p s ILE 97 Cb -0.55 -2.15 -0.09 0.00 1.25 0.00 0.00 42.46 40.92 2g3p s ILE 97 CO 0.56 -0.31 1.09 -2.16 0.24 0.00 0.00 174.94 174.36 2g3p s PRO 98 N -3.14 4.64 0.17 0.37 0.04 -1.26 -1.43 135.00 134.40 2g3p s PRO 98 Ca 0.24 1.75 -0.04 0.00 0.04 0.00 0.00 61.00 62.99 2g3p s PRO 98 Cb -0.06 -3.22 0.02 0.00 0.04 0.00 0.00 34.50 31.28 2g3p s PRO 98 CO 0.11 0.19 0.30 0.41 0.04 0.00 0.00 177.00 178.05 2g3p n GLY 99 N 1.50 2.04 3.17 0.56 0.00 0.98 -4.67 105.19 108.77 2g3p n GLY 99 Ca 0.00 -1.29 -0.18 0.00 0.00 0.00 0.00 46.02 44.55 2g3p n GLY 99 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2g3p s TYR 100 N -5.07 1.19 -0.42 1.61 2.02 0.08 -0.13 117.35 116.63 2g3p s TYR 100 Ca 0.10 -0.47 -0.29 0.00 -0.37 0.00 0.00 57.07 56.05 2g3p s TYR 100 Cb -0.01 -0.67 0.00 0.00 -0.40 0.00 0.00 41.96 40.88 2g3p s TYR 100 CO 0.07 0.05 1.50 0.99 -1.57 0.00 0.00 175.55 176.60 2g3p s THR 101 N -1.32 3.79 0.06 -0.71 2.01 -0.50 -1.46 115.64 117.51 2g3p s THR 101 Ca -0.02 0.79 -0.23 0.00 0.31 0.00 0.00 61.69 62.53 2g3p s THR 101 Cb -0.10 -4.11 -0.06 0.00 0.01 0.00 0.00 72.50 68.24 2g3p s THR 101 CO 0.02 -0.74 0.70 -0.31 -0.69 0.00 0.00 174.62 173.61 2g3p s TYR 102 N 5.89 3.76 0.20 4.92 1.51 0.56 -4.45 117.35 129.74 2g3p s TYR 102 Ca 0.64 1.41 0.04 0.00 -1.01 0.00 0.00 57.07 58.15 2g3p s TYR 102 Cb -0.15 -2.72 -0.03 0.00 -0.11 0.00 0.00 41.96 38.95 2g3p s TYR 102 CO 0.32 0.37 0.32 0.96 -1.11 0.00 0.00 175.55 176.41 2g3p s ILE 103 N -0.40 5.28 -0.28 2.71 -5.25 -1.26 -3.71 121.20 118.28 2g3p s ILE 103 Ca 0.35 -0.85 -0.05 0.00 -0.99 0.00 0.00 60.65 59.10 2g3p s ILE 103 Cb -0.20 -3.80 0.02 0.00 2.95 0.00 0.00 42.46 41.43 2g3p s ILE 103 CO 0.22 -0.22 0.04 0.21 -1.79 0.00 0.00 174.94 173.40 2g3p s ASN 104 N -3.63 4.90 0.61 4.36 3.84 -1.26 -4.99 114.94 118.77 2g3p s ASN 104 Ca 0.34 -0.80 0.33 0.00 0.21 0.00 0.00 52.86 52.94 2g3p s ASN 104 Cb -0.10 -1.81 1.94 0.00 -0.55 0.00 0.00 41.25 40.73 2g3p s ASN 104 CO 0.29 -0.18 2.27 -0.65 -2.79 0.00 0.00 177.10 176.04 2g3p h PRO 105 N 8.16 0.00 -0.62 0.43 0.11 -1.95 -2.66 132.00 135.48 2g3p h PRO 105 Ca -0.31 0.00 -0.43 0.00 0.11 0.00 0.00 66.00 65.37 2g3p h PRO 105 Cb 1.12 0.00 -0.29 0.00 0.11 0.00 0.00 31.00 31.94 2g3p h PRO 105 CO 0.59 0.00 -0.31 1.28 -0.21 0.00 0.00 178.00 179.35 2g3p n LEU 106 N -3.69 5.00 -0.02 2.35 4.77 -1.26 -0.12 117.00 124.03 2g3p n LEU 106 Ca -0.03 -4.35 0.15 0.00 -0.03 0.00 0.00 56.01 51.75 2g3p n LEU 106 Cb 0.09 -0.54 0.72 0.00 -2.33 0.00 0.00 43.42 41.36 2g3p n LEU 106 CO 0.26 1.73 0.98 -0.90 -1.33 0.00 0.00 177.39 178.13 2g3p n ASP 107 N -0.89 0.11 -0.20 -1.43 5.68 -1.00 -4.90 116.55 113.91 2g3p n ASP 107 Ca 0.42 -0.23 -0.03 0.00 -0.50 0.00 0.00 54.79 54.46 2g3p n ASP 107 Cb 0.91 -0.23 -0.01 0.00 -1.14 0.00 0.00 41.12 40.65 2g3p n ASP 107 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2g3p n GLY 108 N 1.29 0.59 0.09 6.12 0.00 -1.19 -4.91 105.19 107.18 2g3p n GLY 108 Ca 0.14 -0.55 0.13 0.00 0.00 0.00 0.00 46.02 45.75 2g3p n GLY 108 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2g3p n THR 109 N -2.85 0.52 -2.98 2.61 -2.24 -0.52 -4.24 114.28 104.59 2g3p n THR 109 Ca -0.03 -0.20 -0.16 0.00 -2.27 0.00 0.00 64.05 61.39 2g3p n THR 109 Cb 0.13 -0.62 -0.01 0.00 -2.10 0.00 0.00 70.33 67.73 2g3p n THR 109 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2g3p n TYR 110 N -2.13 -1.75 -2.12 4.78 9.36 0.65 -4.66 117.16 121.30 2g3p n TYR 110 Ca 0.06 -2.72 -0.41 0.00 3.32 0.00 0.00 57.90 58.14 2g3p n TYR 110 Cb 0.40 0.57 -0.02 0.00 -0.63 0.00 0.00 39.34 39.66 2g3p n TYR 110 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 2g3p s PRO 111 N -0.37 4.35 1.00 2.98 0.04 -1.26 -4.38 135.00 137.35 2g3p s PRO 111 Ca 0.33 2.21 -0.12 0.00 0.04 0.00 0.00 61.00 63.46 2g3p s PRO 111 Cb 0.21 -3.08 0.19 0.00 0.04 0.00 0.00 34.50 31.86 2g3p s PRO 111 CO -0.16 -0.21 1.09 -1.25 0.04 0.00 0.00 177.00 176.50 2g3p s PRO 112 N -1.55 0.44 -1.05 0.56 0.04 -1.26 -3.96 135.00 128.22 2g3p s PRO 112 Ca 0.50 0.65 0.00 0.00 0.04 0.00 0.00 61.00 62.19 2g3p s PRO 112 Cb -0.40 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.42 2g3p s PRO 112 CO 0.51 -2.76 0.00 0.41 0.04 0.00 0.00 177.00 175.20 2g3p n GLY 113 N -0.83 0.98 3.74 0.56 0.00 -0.13 -4.74 105.19 104.77 2g3p n GLY 113 Ca 0.05 -0.55 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 2g3p n GLY 113 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2g3p s THR 114 N -2.40 0.92 0.17 2.61 -4.23 -0.57 -5.00 115.64 107.14 2g3p s THR 114 Ca 0.00 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.42 2g3p s THR 114 Cb 0.00 -2.07 0.01 0.00 1.34 0.00 0.00 72.50 71.78 2g3p s THR 114 CO 0.00 0.00 1.56 -0.08 -0.54 0.00 0.00 174.62 175.56 2g3p h GLU 115 N 1.36 0.94 -0.13 3.99 4.81 -1.95 -3.13 114.58 120.47 2g3p h GLU 115 Ca -0.42 -0.40 -0.21 0.00 -0.13 0.00 0.00 59.36 58.20 2g3p h GLU 115 Cb 1.32 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.67 2g3p h GLU 115 CO 0.69 1.07 -0.75 -0.56 -0.73 0.00 0.00 179.01 178.73 2g3p h GLN 116 N 0.81 0.64 -3.93 1.92 3.07 -1.96 -3.39 115.11 112.27 2g3p h GLN 116 Ca 0.10 -0.52 -0.63 0.00 0.09 0.00 0.00 58.65 57.70 2g3p h GLN 116 Cb 0.80 0.10 -0.40 0.00 0.08 0.00 0.00 27.48 28.06 2g3p h GLN 116 CO 0.07 1.14 -0.72 1.21 0.09 0.00 0.00 178.83 180.61 2g3p s ASN 117 N -7.05 4.33 0.00 0.06 2.47 -1.22 -4.99 114.94 108.55 2g3p s ASN 117 Ca -0.08 -2.19 0.16 0.00 0.42 0.00 0.00 52.86 51.16 2g3p s ASN 117 Cb 0.09 -1.32 0.96 0.00 -1.45 0.00 0.00 41.25 39.53 2g3p s ASN 117 CO 0.88 -0.35 1.56 -0.81 -3.72 0.00 0.00 177.10 174.65 2g3p n PRO 118 N 4.16 0.92 -0.99 0.43 -0.04 -1.19 -1.52 135.00 136.77 2g3p n PRO 118 Ca 0.03 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.16 2g3p n PRO 118 Cb 0.39 -1.27 0.12 0.00 -0.04 0.00 0.00 33.50 32.70 2g3p n PRO 118 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2g3p n ALA 119 N -0.77 -1.08 -1.98 0.55 0.00 -1.26 -4.59 120.51 111.38 2g3p n ALA 119 Ca 0.12 -0.42 -0.42 0.00 0.00 0.00 0.00 53.44 52.72 2g3p n ALA 119 Cb 0.06 -2.05 -0.03 0.00 0.00 0.00 0.00 19.45 17.42 2g3p n ALA 119 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2g3p s ASN 120 N -2.05 6.63 0.00 0.00 3.84 -1.26 -0.96 114.94 121.15 2g3p s ASN 120 Ca 0.67 2.53 0.28 0.00 0.21 0.00 0.00 52.86 56.55 2g3p s ASN 120 Cb -0.27 -2.59 1.28 0.00 -0.55 0.00 0.00 41.25 39.12 2g3p s ASN 120 CO 0.57 -0.81 1.93 -0.81 -2.79 0.00 0.00 177.10 175.20 2g3p n PRO 121 N 4.31 0.13 -3.35 0.43 -0.04 -1.26 -4.72 135.00 130.50 2g3p n PRO 121 Ca 0.14 0.02 -0.38 0.00 -0.04 0.00 0.00 63.50 63.24 2g3p n PRO 121 Cb 0.40 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.29 2g3p n PRO 121 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2g3p s ASN 122 N -2.87 6.65 0.61 3.54 0.01 -1.26 -4.79 114.94 116.82 2g3p s ASN 122 Ca 0.18 0.77 -0.19 0.00 -0.71 0.00 0.00 52.86 52.91 2g3p s ASN 122 Cb 0.19 -2.27 -0.03 0.00 0.41 0.00 0.00 41.25 39.55 2g3p s ASN 122 CO 0.49 0.02 1.23 -2.84 -1.51 0.00 0.00 177.10 174.49 2g3p s PRO 123 N 0.57 2.88 0.18 -0.60 0.02 -1.26 -4.77 135.00 132.00 2g3p s PRO 123 Ca 0.25 1.89 0.10 0.00 0.02 0.00 0.00 61.00 63.26 2g3p s PRO 123 Cb -0.15 -1.91 -0.04 0.00 0.02 0.00 0.00 34.50 32.42 2g3p s PRO 123 CO 0.09 -1.30 -0.20 -1.54 -0.33 0.00 0.00 177.00 173.73 2g3p s SER 124 N -1.54 3.68 -0.19 2.53 1.04 -0.57 -4.97 113.70 113.67 2g3p s SER 124 Ca 0.79 -0.75 -0.05 0.00 0.48 0.00 0.00 55.95 56.42 2g3p s SER 124 Cb -0.32 -0.40 -0.03 0.00 0.10 0.00 0.00 66.02 65.37 2g3p s SER 124 CO 0.35 0.13 0.00 -0.76 0.98 0.00 0.00 173.24 173.94 2g3p s LEU 125 N -2.59 3.35 -0.14 2.42 1.43 -1.26 -1.44 118.68 120.44 2g3p s LEU 125 Ca 0.21 -0.14 -0.06 0.00 -1.03 0.00 0.00 54.13 53.11 2g3p s LEU 125 Cb -0.09 -1.84 -0.04 0.00 0.03 0.00 0.00 46.19 44.26 2g3p s LEU 125 CO 0.11 0.10 0.06 -1.61 0.23 0.00 0.00 176.35 175.24 2g3p s GLU 126 N 0.78 3.54 0.44 1.70 0.41 -0.01 -4.88 118.70 120.68 2g3p s GLU 126 Ca 0.00 -0.31 0.16 0.00 -0.41 0.00 0.00 54.97 54.41 2g3p s GLU 126 Cb -0.14 -3.07 1.00 0.00 -1.78 0.00 0.00 34.13 30.13 2g3p s GLU 126 CO 0.02 0.53 1.97 0.93 -0.49 0.00 0.00 175.26 178.22 2g3p h GLU 127 N 5.81 0.00 -3.82 1.61 5.08 -1.87 0.42 114.58 121.81 2g3p h GLU 127 Ca -0.45 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 57.81 2g3p h GLU 127 Cb 1.19 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.31 2g3p h GLU 127 CO 0.62 0.21 -0.33 -1.54 -1.00 0.00 0.00 179.01 176.98 2g3p s SER 128 N -6.89 0.06 0.18 1.42 1.04 -1.26 -4.76 113.70 103.49 2g3p s SER 128 Ca -0.04 -0.74 -0.33 0.00 0.48 0.00 0.00 55.95 55.33 2g3p s SER 128 Cb 0.15 0.39 -0.15 0.00 0.10 0.00 0.00 66.02 66.52 2g3p s SER 128 CO 0.69 -0.82 1.39 0.00 0.98 0.00 0.00 173.24 175.48 2g3p n GLN 129 N -0.14 1.73 -0.74 4.02 1.13 -1.26 -4.85 117.38 117.26 2g3p n GLN 129 Ca -0.11 0.62 -0.30 0.00 -1.94 0.00 0.00 57.00 55.27 2g3p n GLN 129 Cb 0.63 -2.27 0.19 0.00 0.11 0.00 0.00 30.24 28.90 2g3p n GLN 129 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2g3p s PRO 130 N 0.10 0.32 0.00 -1.09 0.04 -1.26 -5.03 135.00 128.08 2g3p s PRO 130 Ca 0.75 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.92 2g3p s PRO 130 Cb -0.75 -1.68 0.00 0.00 0.04 0.00 0.00 34.50 32.11 2g3p s PRO 130 CO 0.47 -2.97 0.00 1.28 0.04 0.00 0.00 177.00 175.81 2g3p n LEU 131 N -4.43 0.00 -3.51 -3.56 4.77 -1.26 -4.53 117.00 104.48 2g3p n LEU 131 Ca 0.07 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 56.01 2g3p n LEU 131 Cb 0.53 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.61 2g3p n LEU 131 CO 0.54 0.00 0.47 0.59 -1.33 0.00 0.00 177.39 177.65 2g3p n ASN 132 N 0.00 -0.13 -4.97 -1.43 5.03 -1.20 -4.67 115.26 107.89 2g3p n ASN 132 Ca 0.00 -1.01 -0.21 0.00 0.87 0.00 0.00 54.58 54.23 2g3p n ASN 132 Cb 0.00 -0.15 -0.01 0.00 -1.02 0.00 0.00 39.78 38.60 2g3p n ASN 132 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2g3p s THR 133 N 2.88 4.68 0.05 3.41 -4.23 -1.26 -4.56 115.64 116.61 2g3p s THR 133 Ca 0.07 -0.82 0.01 0.00 -1.18 0.00 0.00 61.69 59.77 2g3p s THR 133 Cb 0.01 -3.67 -0.03 0.00 1.34 0.00 0.00 72.50 70.16 2g3p s THR 133 CO 0.03 -0.32 -0.05 0.72 -0.54 0.00 0.00 174.62 174.46 2g3p s PHE 134 N -2.19 0.60 -0.21 3.99 -0.71 -0.42 -1.92 117.98 117.12 2g3p s PHE 134 Ca 0.41 -0.75 -0.07 0.00 -1.04 0.00 0.00 56.93 55.48 2g3p s PHE 134 Cb -0.09 -0.38 -0.03 0.00 -1.21 0.00 0.00 43.02 41.30 2g3p s PHE 134 CO 0.32 -0.20 0.05 -1.64 -1.34 0.00 0.00 175.22 172.41 2g3p s MET 135 N -2.71 3.78 -0.05 1.99 -1.94 0.46 -0.75 119.30 120.07 2g3p s MET 135 Ca -0.01 -0.44 -0.02 0.00 -1.71 0.00 0.00 55.69 53.51 2g3p s MET 135 Cb -0.02 -3.20 0.03 0.00 2.01 0.00 0.00 34.83 33.65 2g3p s MET 135 CO -0.04 0.07 0.04 0.12 -0.01 0.00 0.00 175.02 175.20 2g3p s PHE 136 N 0.90 0.28 -1.46 -0.03 5.36 -0.50 -2.03 117.98 120.49 2g3p s PHE 136 Ca 0.03 0.10 -0.06 0.00 -0.96 0.00 0.00 56.93 56.04 2g3p s PHE 136 Cb -0.14 -0.59 0.04 0.00 -0.34 0.00 0.00 43.02 42.00 2g3p s PHE 136 CO 0.02 -0.23 0.62 1.04 -1.46 0.00 0.00 175.22 175.21 2g3p n GLN 137 N 5.19 -3.91 -2.22 10.12 6.02 -1.26 -1.56 117.38 129.76 2g3p n GLN 137 Ca -0.06 0.47 -0.19 0.00 -0.01 0.00 0.00 57.00 57.21 2g3p n GLN 137 Cb 0.50 -4.90 -0.02 0.00 1.02 0.00 0.00 30.24 26.84 2g3p n GLN 137 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2g3p n ASN 138 N -2.91 -5.47 -4.30 1.08 4.13 -1.26 -5.00 115.26 101.53 2g3p n ASN 138 Ca -0.18 0.07 -0.25 0.00 1.68 0.00 0.00 54.58 55.90 2g3p n ASN 138 Cb 0.62 -4.54 -0.13 0.00 -1.54 0.00 0.00 39.78 34.20 2g3p n ASN 138 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 2g3p s ASN 139 N -2.26 2.67 -0.21 6.41 0.01 -0.60 -5.13 114.94 115.83 2g3p s ASN 139 Ca 0.00 -0.66 -0.06 0.00 -0.71 0.00 0.00 52.86 51.43 2g3p s ASN 139 Cb 0.00 -0.17 -0.03 0.00 0.41 0.00 0.00 41.25 41.47 2g3p s ASN 139 CO 0.00 0.10 0.02 -0.60 -1.51 0.00 0.00 177.10 175.11 2g3p s ARG 140 N -1.78 3.65 0.32 -0.60 3.52 -1.26 -1.41 118.95 121.39 2g3p s ARG 140 Ca 0.08 -0.50 0.10 0.00 -0.13 0.00 0.00 55.73 55.28 2g3p s ARG 140 Cb -0.10 -3.13 -0.06 0.00 -1.56 0.00 0.00 34.95 30.10 2g3p s ARG 140 CO 0.04 -0.01 -0.10 -0.06 -0.81 0.00 0.00 175.30 174.36 2g3p s PHE 141 N 1.08 2.41 -0.01 5.12 0.40 0.07 -0.49 117.98 126.55 2g3p s PHE 141 Ca 0.03 -0.43 0.03 0.00 -0.60 0.00 0.00 56.93 55.96 2g3p s PHE 141 Cb -0.14 -1.28 -0.01 0.00 0.51 0.00 0.00 43.02 42.10 2g3p s PHE 141 CO 0.02 0.61 -0.11 0.50 0.70 0.00 0.00 175.22 176.94 2g3p s ARG 142 N -3.60 0.88 -0.23 0.44 3.52 0.30 -1.30 118.95 118.96 2g3p s ARG 142 Ca 0.32 -0.38 0.02 0.00 -0.13 0.00 0.00 55.73 55.56 2g3p s ARG 142 Cb -0.00 -0.85 0.05 0.00 -1.56 0.00 0.00 34.95 32.58 2g3p s ARG 142 CO 0.17 0.23 -0.13 1.21 -0.81 0.00 0.00 175.30 175.96 2g3p s ASN 143 N -0.23 3.87 -0.53 -2.12 2.47 -1.26 -0.95 114.94 116.19 2g3p s ASN 143 Ca 0.04 -1.09 0.01 0.00 0.42 0.00 0.00 52.86 52.24 2g3p s ASN 143 Cb -0.04 -1.45 0.14 0.00 -1.45 0.00 0.00 41.25 38.44 2g3p s ASN 143 CO -0.00 -0.13 0.29 -0.13 -3.72 0.00 0.00 177.10 173.41 2g3p s ARG 144 N 1.22 2.13 -1.42 0.43 1.81 0.92 -4.72 118.95 119.33 2g3p s ARG 144 Ca -0.04 -2.44 -0.08 0.00 -1.72 0.00 0.00 55.73 51.45 2g3p s ARG 144 Cb -0.17 -3.47 0.04 0.00 -0.45 0.00 0.00 34.95 30.89 2g3p s ARG 144 CO -0.08 -1.11 0.93 1.04 -0.68 0.00 0.00 175.30 175.41 2g3p n GLN 145 N 3.49 -5.82 -0.21 3.54 3.00 -1.26 -1.08 117.38 119.05 2g3p n GLN 145 Ca 0.05 0.66 0.00 0.00 -0.01 0.00 0.00 57.00 57.70 2g3p n GLN 145 Cb 0.36 -5.49 0.00 0.00 0.00 0.00 0.00 30.24 25.11 2g3p n GLN 145 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2g3p n GLY 146 N -1.68 0.93 3.54 1.08 0.00 -1.26 -5.03 105.19 102.77 2g3p n GLY 146 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 2g3p n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g3p s ALA 147 N -2.60 3.45 -0.09 4.61 0.00 -0.24 -5.04 121.76 121.84 2g3p s ALA 147 Ca 0.00 -1.16 -0.12 0.00 0.00 0.00 0.00 51.96 50.68 2g3p s ALA 147 Cb 0.00 -3.03 -0.05 0.00 0.00 0.00 0.00 23.12 20.04 2g3p s ALA 147 CO 0.00 -1.34 0.27 -0.51 0.00 0.00 0.00 175.76 174.18 2g3p s LEU 148 N 2.34 4.37 0.03 0.00 1.43 -1.26 -0.06 118.68 125.54 2g3p s LEU 148 Ca 0.17 0.64 0.03 0.00 -1.03 0.00 0.00 54.13 53.94 2g3p s LEU 148 Cb -0.16 -2.33 -0.02 0.00 0.03 0.00 0.00 46.19 43.72 2g3p s LEU 148 CO 0.14 0.29 -0.10 -0.89 0.23 0.00 0.00 176.35 176.01 2g3p s THR 149 N -0.59 0.79 -0.03 5.49 2.01 -0.12 -1.35 115.64 121.85 2g3p s THR 149 Ca 0.18 -0.86 0.04 0.00 0.31 0.00 0.00 61.69 61.36 2g3p s THR 149 Cb -0.14 -0.75 -0.01 0.00 0.01 0.00 0.00 72.50 71.61 2g3p s THR 149 CO 0.07 -0.09 -0.16 0.54 -0.69 0.00 0.00 174.62 174.29 2g3p s VAL 150 N -0.86 1.29 -0.07 3.82 0.11 0.88 -0.54 120.40 125.03 2g3p s VAL 150 Ca -0.02 -0.67 -0.30 0.00 -2.93 0.00 0.00 61.98 58.07 2g3p s VAL 150 Cb -0.07 -1.09 -0.05 0.00 -1.53 0.00 0.00 36.38 33.63 2g3p s VAL 150 CO 0.01 0.37 1.65 -0.47 -3.33 0.00 0.00 175.10 173.32 2g3p s TYR 151 N -0.16 2.00 -0.18 1.54 5.04 0.35 -1.09 117.35 124.85 2g3p s TYR 151 Ca 0.02 0.25 0.14 0.00 -2.44 0.00 0.00 57.07 55.04 2g3p s TYR 151 Cb -0.09 -3.91 0.38 0.00 0.35 0.00 0.00 41.96 38.69 2g3p s TYR 151 CO 0.01 -3.71 1.22 0.25 -1.34 0.00 0.00 175.55 171.98 2g3p n THR 152 N 5.59 2.11 0.00 4.34 -2.24 -0.28 -4.71 114.28 119.09 2g3p n THR 152 Ca 0.17 -2.74 0.00 0.00 -2.27 0.00 0.00 64.05 59.21 2g3p n THR 152 Cb 0.43 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.41 2g3p n THR 152 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2g3p n GLY 153 N -1.22 -3.13 3.86 3.38 0.00 -1.26 -3.90 105.19 102.92 2g3p n GLY 153 Ca 0.19 -2.16 -0.34 0.00 0.00 0.00 0.00 46.02 43.70 2g3p n GLY 153 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2g3p s THR 154 N -0.94 4.94 0.01 2.61 -4.23 -1.26 -0.93 115.64 115.83 2g3p s THR 154 Ca 0.00 0.64 0.06 0.00 -1.18 0.00 0.00 61.69 61.21 2g3p s THR 154 Cb 0.00 -3.68 -0.02 0.00 1.34 0.00 0.00 72.50 70.14 2g3p s THR 154 CO 0.00 0.18 -0.18 0.68 -0.54 0.00 0.00 174.62 174.76 2g3p s VAL 155 N -1.54 1.41 0.30 2.29 -7.23 -0.70 -4.94 120.40 110.00 2g3p s VAL 155 Ca 0.39 -0.91 0.11 0.00 -1.81 0.00 0.00 61.98 59.76 2g3p s VAL 155 Cb -0.14 -1.20 -0.06 0.00 0.56 0.00 0.00 36.38 35.54 2g3p s VAL 155 CO 0.19 0.28 -0.16 0.42 -0.31 0.00 0.00 175.10 175.53 2g3p s THR 156 N -0.58 2.40 0.23 5.32 -4.23 -1.26 -0.78 115.64 116.74 2g3p s THR 156 Ca 0.06 -2.32 -0.17 0.00 -1.18 0.00 0.00 61.69 58.08 2g3p s THR 156 Cb -0.07 -2.44 0.02 0.00 1.34 0.00 0.00 72.50 71.34 2g3p s THR 156 CO 0.00 -0.32 0.55 -1.58 -0.54 0.00 0.00 174.62 172.73 2g3p s GLN 157 N -3.55 1.52 -0.03 3.99 0.74 -0.64 -5.00 119.66 116.69 2g3p s GLN 157 Ca 0.31 -1.02 -0.02 0.00 0.05 0.00 0.00 55.36 54.68 2g3p s GLN 157 Cb -0.02 0.52 0.01 0.00 1.10 0.00 0.00 33.01 34.62 2g3p s GLN 157 CO 0.16 -0.66 0.04 0.41 -0.55 0.00 0.00 175.29 174.69 2g3p n GLY 158 N -0.38 -3.35 3.51 2.59 0.00 -1.26 -1.83 105.19 104.46 2g3p n GLY 158 Ca -0.06 -0.07 -0.19 0.00 0.00 0.00 0.00 46.02 45.70 2g3p n GLY 158 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2g3p n THR 159 N 0.30 0.00 -1.28 2.61 -2.24 -1.26 -3.47 114.28 108.95 2g3p n THR 159 Ca -0.06 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.22 2g3p n THR 159 Cb 0.10 -0.50 0.00 0.00 -2.10 0.00 0.00 70.33 67.83 2g3p n THR 159 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2g3p n ASP 160 N 8.79 -3.29 -0.18 3.42 9.92 -1.26 -4.78 116.55 129.17 2g3p n ASP 160 Ca 0.62 0.51 -0.02 0.00 -0.53 0.00 0.00 54.79 55.36 2g3p n ASP 160 Cb 0.22 -2.86 0.08 0.00 -0.64 0.00 0.00 41.12 37.91 2g3p n ASP 160 CO 0.00 0.00 0.00 -0.65 0.13 0.00 0.00 177.20 176.68 2g3p h PRO 161 N 1.33 0.40 0.00 -0.24 0.10 -1.90 -3.48 132.00 128.21 2g3p h PRO 161 Ca 0.00 -0.02 0.00 0.00 0.10 0.00 0.00 66.00 66.08 2g3p h PRO 161 Cb 0.00 -0.09 0.00 0.00 0.10 0.00 0.00 31.00 31.01 2g3p h PRO 161 CO 0.00 0.26 0.00 0.28 0.10 0.00 0.00 178.00 178.64 2g3p n VAL 162 N -4.97 0.00 -2.82 3.15 0.31 -1.23 -5.10 118.33 107.67 2g3p n VAL 162 Ca 0.06 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 63.99 2g3p n VAL 162 Cb 0.21 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.09 2g3p n VAL 162 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2g3p s LYS 163 N -0.28 4.72 -0.12 5.55 1.02 -0.76 -4.88 119.74 124.99 2g3p s LYS 163 Ca 0.00 1.36 -0.02 0.00 0.02 0.00 0.00 55.97 57.34 2g3p s LYS 163 Cb 0.00 -3.31 -0.03 0.00 -0.52 0.00 0.00 37.83 33.98 2g3p s LYS 163 CO 0.00 0.44 -0.05 0.99 -0.92 0.00 0.00 175.35 175.81 2g3p s THR 164 N -0.80 3.84 0.21 2.17 2.01 -1.26 -1.62 115.64 120.18 2g3p s THR 164 Ca 0.41 -0.40 0.11 0.00 0.31 0.00 0.00 61.69 62.12 2g3p s THR 164 Cb -0.24 -2.63 -0.05 0.00 0.01 0.00 0.00 72.50 69.59 2g3p s THR 164 CO 0.29 0.54 -0.22 -0.31 -0.69 0.00 0.00 174.62 174.24 2g3p s TYR 165 N -0.19 2.20 -0.27 4.92 2.02 0.04 -4.75 117.35 121.32 2g3p s TYR 165 Ca 0.03 -0.38 -0.06 0.00 -0.37 0.00 0.00 57.07 56.30 2g3p s TYR 165 Cb -0.13 -1.06 0.00 0.00 -0.40 0.00 0.00 41.96 40.38 2g3p s TYR 165 CO 0.02 0.52 0.04 0.71 -1.57 0.00 0.00 175.55 175.27 2g3p s TYR 166 N -1.97 3.09 -0.14 2.71 2.02 0.15 -1.72 117.35 121.49 2g3p s TYR 166 Ca 0.22 -0.98 -0.22 0.00 -0.37 0.00 0.00 57.07 55.73 2g3p s TYR 166 Cb -0.07 -2.20 -0.03 0.00 -0.40 0.00 0.00 41.96 39.27 2g3p s TYR 166 CO 0.10 -0.56 0.64 -1.14 -1.57 0.00 0.00 175.55 173.02 2g3p s GLN 167 N 1.49 4.31 -0.27 -0.62 0.74 -0.11 -0.83 119.66 124.36 2g3p s GLN 167 Ca 0.03 0.70 -0.03 0.00 0.05 0.00 0.00 55.36 56.11 2g3p s GLN 167 Cb -0.16 -3.51 0.02 0.00 1.10 0.00 0.00 33.01 30.46 2g3p s GLN 167 CO 0.01 -0.09 -0.01 0.71 -0.55 0.00 0.00 175.29 175.36 2g3p s TYR 168 N 1.37 3.12 -0.11 1.67 1.51 -0.52 -1.12 117.35 123.27 2g3p s TYR 168 Ca 0.32 -1.42 -0.04 0.00 -1.01 0.00 0.00 57.07 54.91 2g3p s TYR 168 Cb -0.16 -2.13 -0.04 0.00 -0.11 0.00 0.00 41.96 39.52 2g3p s TYR 168 CO 0.13 -0.69 0.06 0.99 -1.11 0.00 0.00 175.55 174.93 2g3p s THR 169 N 1.37 4.85 0.27 -0.71 2.01 -0.25 -1.51 115.64 121.66 2g3p s THR 169 Ca 0.00 -0.04 -0.31 0.00 0.31 0.00 0.00 61.69 61.66 2g3p s THR 169 Cb -0.17 -3.08 -0.12 0.00 0.01 0.00 0.00 72.50 69.14 2g3p s THR 169 CO -0.02 0.60 1.60 -2.65 -0.69 0.00 0.00 174.62 173.46 2g3p n PRO 170 N 2.16 2.62 -2.31 4.92 -0.02 -1.26 -0.09 135.00 141.03 2g3p n PRO 170 Ca -0.19 0.94 -0.41 0.00 -2.02 0.00 0.00 63.50 61.81 2g3p n PRO 170 Cb 0.54 -2.71 -0.03 0.00 -0.02 0.00 0.00 33.50 31.27 2g3p n PRO 170 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2g3p s VAL 171 N 0.20 3.47 -0.08 -1.45 1.01 -0.46 -4.83 120.40 118.27 2g3p s VAL 171 Ca 0.67 1.19 0.11 0.00 0.00 0.00 0.00 61.98 63.95 2g3p s VAL 171 Cb -0.52 -3.76 0.18 0.00 0.00 0.00 0.00 36.38 32.28 2g3p s VAL 171 CO 0.46 0.17 1.08 -1.54 0.00 0.00 0.00 175.10 175.27 2g3p n SER 172 N 2.82 2.15 -4.58 3.32 3.41 0.83 -4.63 113.62 116.94 2g3p n SER 172 Ca 0.06 -2.65 -0.40 0.00 -0.26 0.00 0.00 58.87 55.62 2g3p n SER 172 Cb 0.44 -0.26 -0.08 0.00 -0.26 0.00 0.00 64.21 64.04 2g3p n SER 172 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2g3p s SER 173 N -2.12 6.30 0.23 4.04 0.15 -1.04 -0.25 113.70 121.01 2g3p s SER 173 Ca 0.19 0.17 -0.06 0.00 0.70 0.00 0.00 55.95 56.95 2g3p s SER 173 Cb 0.17 -2.24 0.22 0.00 -1.71 0.00 0.00 66.02 62.45 2g3p s SER 173 CO 0.02 -0.33 1.75 0.50 1.20 0.00 0.00 173.24 176.39 2g3p h LYS 174 N 8.27 1.03 -0.86 5.44 1.63 -1.87 -2.53 116.57 127.68 2g3p h LYS 174 Ca -0.30 -0.24 0.07 0.00 -0.85 0.00 0.00 60.65 59.33 2g3p h LYS 174 Cb 1.14 -0.14 -0.06 0.00 -0.60 0.00 0.00 32.23 32.57 2g3p h LYS 174 CO 0.71 0.92 0.53 0.00 -3.45 0.00 0.00 179.45 178.16 2g3p h ALA 175 N 1.18 1.19 -0.39 5.00 0.00 -1.96 0.29 119.26 124.58 2g3p h ALA 175 Ca 0.21 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 2g3p h ALA 175 Cb 0.36 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2g3p h ALA 175 CO 0.00 0.26 0.09 1.98 0.00 0.00 0.00 179.25 181.59 2g3p h MET 176 N 0.96 0.62 -0.46 0.00 1.85 -1.86 -1.94 114.93 114.09 2g3p h MET 176 Ca 0.38 -0.15 -0.11 0.00 -0.61 0.00 0.00 59.70 59.22 2g3p h MET 176 Cb 0.19 -0.08 -0.02 0.00 0.43 0.00 0.00 31.60 32.13 2g3p h MET 176 CO -0.18 0.65 -0.14 1.88 -0.40 0.00 0.00 176.91 178.71 2g3p h TYR 177 N 0.48 0.96 -0.61 1.39 0.05 -1.00 -1.35 116.97 116.89 2g3p h TYR 177 Ca 0.12 -0.20 0.02 0.00 0.05 0.00 0.00 58.73 58.72 2g3p h TYR 177 Cb 0.31 -0.24 -0.03 0.00 1.01 0.00 0.00 36.73 37.77 2g3p h TYR 177 CO 0.02 0.94 0.39 -0.44 -1.05 0.00 0.00 178.16 178.02 2g3p h ASP 178 N 0.77 0.66 -0.57 3.88 3.32 -0.19 0.17 116.42 124.45 2g3p h ASP 178 Ca 0.12 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.13 2g3p h ASP 178 Cb 0.66 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.03 2g3p h ASP 178 CO 0.05 0.47 0.22 0.00 -1.72 0.00 0.00 179.24 178.26 2g3p h ALA 179 N 1.24 0.74 -0.39 3.45 0.00 -1.13 -1.47 119.26 121.70 2g3p h ALA 179 Ca 0.23 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2g3p h ALA 179 Cb -0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2g3p h ALA 179 CO -0.07 0.36 0.21 -0.92 0.00 0.00 0.00 179.25 178.83 2g3p h TYR 180 N 0.78 0.54 0.00 0.00 3.20 -0.63 -1.23 116.97 119.64 2g3p h TYR 180 Ca 0.19 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 2g3p h TYR 180 Cb 0.21 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.31 2g3p h TYR 180 CO 0.01 0.42 -0.03 -1.49 -1.64 0.00 0.00 178.16 175.43 2g3p h TRP 181 N 0.51 0.00 -0.15 -3.82 6.55 -0.49 -2.60 115.95 115.95 2g3p h TRP 181 Ca 0.14 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.98 2g3p h TRP 181 Cb 0.06 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.36 2g3p h TRP 181 CO -0.02 0.03 0.00 0.09 -1.05 0.00 0.00 178.44 177.48 2g3p n ASN 182 N -3.13 1.99 -0.44 -3.49 3.02 -0.57 -4.95 115.26 107.68 2g3p n ASN 182 Ca 0.01 -1.72 -0.02 0.00 -0.03 0.00 0.00 54.58 52.82 2g3p n ASN 182 Cb 0.32 -0.09 0.00 0.00 -0.61 0.00 0.00 39.78 39.40 2g3p n ASN 182 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2g3p n GLY 183 N 1.21 0.54 0.19 7.41 0.00 -0.98 -4.97 105.19 108.59 2g3p n GLY 183 Ca 0.17 -0.72 0.11 0.00 0.00 0.00 0.00 46.02 45.58 2g3p n GLY 183 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2g3p h LYS 184 N -0.10 0.00 -0.36 1.61 1.79 -1.41 -3.29 116.57 114.82 2g3p h LYS 184 Ca -0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 2g3p h LYS 184 Cb 1.03 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.68 2g3p h LYS 184 CO 0.05 0.02 0.00 1.19 -1.08 0.00 0.00 179.45 179.63 2g3p n PHE 185 N -3.00 1.22 -0.31 -1.35 3.72 -1.26 -4.47 117.46 112.01 2g3p n PHE 185 Ca 0.03 -0.81 0.14 0.00 -0.05 0.00 0.00 57.45 56.76 2g3p n PHE 185 Cb 0.55 -0.34 0.29 0.00 -0.94 0.00 0.00 39.48 39.04 2g3p n PHE 185 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 2g3p h ARG 186 N 2.46 0.13 0.00 -1.08 2.43 -1.92 -0.85 114.38 115.56 2g3p h ARG 186 Ca 0.00 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2g3p h ARG 186 Cb 1.53 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 31.05 2g3p h ARG 186 CO 0.28 0.09 -0.02 0.38 -1.51 0.00 0.00 179.97 179.18 2g3p h ASP 187 N 0.14 0.00 0.00 -3.80 2.03 -1.91 -3.41 116.42 109.47 2g3p h ASP 187 Ca 0.57 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.86 2g3p h ASP 187 Cb 1.17 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.66 2g3p h ASP 187 CO -0.72 0.02 -1.05 0.00 -1.03 0.00 0.00 179.24 176.46 2g3p n ALA 189 N -1.72 2.40 -1.60 0.00 0.00 -0.44 -4.53 120.51 114.62 2g3p n ALA 189 Ca -0.01 -0.96 0.06 0.00 0.00 0.00 0.00 53.44 52.54 2g3p n ALA 189 Cb 0.21 -0.77 0.19 0.00 0.00 0.00 0.00 19.45 19.09 2g3p n ALA 189 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2g3p n PHE 190 N 1.30 0.00 -2.61 0.00 3.72 -1.26 -4.70 117.46 113.91 2g3p n PHE 190 Ca 0.17 -1.38 -0.31 0.00 -0.05 0.00 0.00 57.45 55.87 2g3p n PHE 190 Cb 0.56 -0.23 -0.03 0.00 -0.94 0.00 0.00 39.48 38.83 2g3p n PHE 190 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 2g3p s HIS 191 N -3.00 3.46 0.15 1.38 3.76 -1.26 -5.08 115.29 114.69 2g3p s HIS 191 Ca 0.37 1.28 0.03 0.00 -0.15 0.00 0.00 55.06 56.59 2g3p s HIS 191 Cb 0.36 -2.64 -0.05 0.00 1.11 0.00 0.00 32.58 31.37 2g3p s HIS 191 CO -0.06 -0.24 -0.05 -1.12 -0.85 0.00 0.00 174.74 172.41 2g3p s SER 192 N -3.08 1.46 0.00 1.40 0.01 -1.26 -4.87 113.70 107.36 2g3p s SER 192 Ca 0.55 -1.08 0.00 0.00 1.31 0.00 0.00 55.95 56.73 2g3p s SER 192 Cb -0.10 0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.19 2g3p s SER 192 CO 0.31 -0.46 0.00 0.61 0.41 0.00 0.00 173.24 174.11 2g3p n GLY 193 N -0.20 -0.43 3.26 3.44 0.00 -1.26 -4.82 105.19 105.18 2g3p n GLY 193 Ca -0.09 -1.78 -0.44 0.00 0.00 0.00 0.00 46.02 43.71 2g3p n GLY 193 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2g3p s PHE 194 N 0.00 3.59 -0.31 1.61 5.36 -1.26 -4.65 117.98 122.32 2g3p s PHE 194 Ca 0.00 -2.09 0.01 0.00 -0.96 0.00 0.00 56.93 53.89 2g3p s PHE 194 Cb 0.00 -3.63 0.10 0.00 -0.34 0.00 0.00 43.02 39.15 2g3p s PHE 194 CO 0.00 -0.96 0.07 -0.80 -1.46 0.00 0.00 175.22 172.07 2g3p s ASN 195 N 2.00 4.30 0.05 6.13 0.01 -1.26 -5.03 114.94 121.14 2g3p s ASN 195 Ca 0.15 -1.80 -0.16 0.00 -0.71 0.00 0.00 52.86 50.34 2g3p s ASN 195 Cb -0.16 -1.19 -0.26 0.00 0.41 0.00 0.00 41.25 40.05 2g3p s ASN 195 CO -0.05 -0.39 1.13 -0.33 -1.51 0.00 0.00 177.10 175.95 2g3p h GLU 196 N 7.89 0.60 -6.66 -0.60 5.08 -1.91 -3.18 114.58 115.80 2g3p h GLU 196 Ca -0.10 -0.70 -0.50 0.00 -1.00 0.00 0.00 59.36 57.05 2g3p h GLU 196 Cb 1.02 0.21 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 2g3p h GLU 196 CO 0.48 1.29 0.18 -0.51 -1.00 0.00 0.00 179.01 179.46 2g3p s ASP 197 N -7.20 7.17 0.34 1.42 1.11 -1.26 -4.88 116.67 113.36 2g3p s ASP 197 Ca -0.11 1.56 -0.27 0.00 0.18 0.00 0.00 52.55 53.92 2g3p s ASP 197 Cb 0.05 -2.47 -0.09 0.00 1.07 0.00 0.00 42.92 41.48 2g3p s ASP 197 CO 0.90 0.02 1.07 -2.16 1.18 0.00 0.00 175.17 176.18 2g3p s PRO 198 N -1.94 4.41 0.01 8.23 0.04 -1.26 -4.75 135.00 139.75 2g3p s PRO 198 Ca 0.45 1.67 -0.30 0.00 0.04 0.00 0.00 61.00 62.85 2g3p s PRO 198 Cb -0.18 -2.89 -0.03 0.00 0.04 0.00 0.00 34.50 31.44 2g3p s PRO 198 CO 0.22 0.05 1.00 -0.06 0.04 0.00 0.00 177.00 178.25 2g3p s PHE 199 N -1.39 3.64 -0.38 0.56 0.08 -0.81 -4.80 117.98 114.89 2g3p s PHE 199 Ca 0.51 1.66 -0.24 0.00 0.12 0.00 0.00 56.93 58.98 2g3p s PHE 199 Cb -0.27 -3.15 0.01 0.00 -0.57 0.00 0.00 43.02 39.04 2g3p s PHE 199 CO 0.35 -0.13 0.81 0.08 -0.10 0.00 0.00 175.22 176.23 2g3p s VAL 200 N 0.96 4.69 0.47 -0.44 1.01 -1.26 -0.40 120.40 125.44 2g3p s VAL 200 Ca 0.52 0.88 -0.25 0.00 0.00 0.00 0.00 61.98 63.14 2g3p s VAL 200 Cb -0.22 -4.25 -0.08 0.00 0.00 0.00 0.00 36.38 31.84 2g3p s VAL 200 CO 0.28 -0.49 1.43 0.00 0.00 0.00 0.00 175.10 176.32 2g3p h GLU 202 N 2.12 0.33 -6.35 0.00 5.08 -1.90 -3.41 114.58 110.45 2g3p h GLU 202 Ca -0.51 -0.13 -0.55 0.00 -1.00 0.00 0.00 59.36 57.17 2g3p h GLU 202 Cb 1.27 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 2g3p h GLU 202 CO 0.60 0.62 0.72 -0.47 -1.00 0.00 0.00 179.01 179.48 2g3p s TYR 203 N -4.67 3.13 -0.11 4.33 5.04 -1.26 -4.88 117.35 118.93 2g3p s TYR 203 Ca -0.14 1.12 0.14 0.00 -2.44 0.00 0.00 57.07 55.75 2g3p s TYR 203 Cb 0.06 -3.49 0.26 0.00 0.35 0.00 0.00 41.96 39.14 2g3p s TYR 203 CO 0.74 -1.61 1.13 1.04 -1.34 0.00 0.00 175.55 175.51 2g3p n GLN 204 N 5.10 0.98 0.00 4.97 1.13 -1.26 -4.82 117.38 123.48 2g3p n GLN 204 Ca 0.11 -2.33 0.00 0.00 -1.94 0.00 0.00 57.00 52.85 2g3p n GLN 204 Cb 0.46 -1.22 0.00 0.00 0.11 0.00 0.00 30.24 29.59 2g3p n GLN 204 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2g3p n GLY 205 N -0.97 1.76 3.67 1.08 0.00 -1.26 -4.75 105.19 104.72 2g3p n GLY 205 Ca 0.13 -2.02 -0.42 0.00 0.00 0.00 0.00 46.02 43.70 2g3p n GLY 205 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2g3p s GLN 206 N -2.14 4.25 0.47 1.61 2.00 -1.26 -4.82 119.66 119.76 2g3p s GLN 206 Ca 0.00 1.94 -0.23 0.00 -2.00 0.00 0.00 55.36 55.07 2g3p s GLN 206 Cb 0.00 -3.73 -0.09 0.00 0.80 0.00 0.00 33.01 30.00 2g3p s GLN 206 CO 0.00 -0.67 1.13 0.45 -0.50 0.00 0.00 175.29 175.69 2g3p n SER 207 N 6.12 1.76 -3.55 6.67 2.88 -1.26 -1.41 113.62 124.84 2g3p n SER 207 Ca 0.14 1.01 -0.12 0.00 -1.33 0.00 0.00 58.87 58.58 2g3p n SER 207 Cb 0.44 -1.43 -0.05 0.00 -0.75 0.00 0.00 64.21 62.42 2g3p n SER 207 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2g3p s SER 208 N -0.78 -0.44 -0.05 -3.46 0.15 0.82 -4.78 113.70 105.17 2g3p s SER 208 Ca 0.66 0.40 -0.02 0.00 0.70 0.00 0.00 55.95 57.69 2g3p s SER 208 Cb -0.50 0.38 -0.04 0.00 -1.71 0.00 0.00 66.02 64.15 2g3p s SER 208 CO 0.55 -0.46 0.07 -1.81 1.20 0.00 0.00 173.24 172.79 2g3p s ASP 209 N -1.38 5.70 -0.30 5.45 1.01 -1.26 -0.01 116.67 125.88 2g3p s ASP 209 Ca -0.03 0.21 -0.11 0.00 0.71 0.00 0.00 52.55 53.33 2g3p s ASP 209 Cb -0.00 -1.67 -0.04 0.00 1.01 0.00 0.00 42.92 42.21 2g3p s ASP 209 CO 0.02 0.32 0.20 -0.76 0.21 0.00 0.00 175.17 175.16 2g3p s LEU 210 N -1.39 4.15 0.51 1.23 1.02 -0.51 -4.91 118.68 118.79 2g3p s LEU 210 Ca 0.19 -0.12 -0.23 0.00 0.02 0.00 0.00 54.13 53.99 2g3p s LEU 210 Cb -0.12 -2.12 -0.06 0.00 0.02 0.00 0.00 46.19 43.91 2g3p s LEU 210 CO 0.09 -0.10 1.33 -2.84 0.02 0.00 0.00 176.35 174.85 2g3p s PRO 211 N 1.75 3.34 0.12 1.29 0.02 -1.26 -1.56 135.00 138.70 2g3p s PRO 211 Ca 0.07 2.18 0.06 0.00 0.02 0.00 0.00 61.00 63.32 2g3p s PRO 211 Cb -0.16 -2.35 -0.04 0.00 0.02 0.00 0.00 34.50 31.97 2g3p s PRO 211 CO 0.11 -1.01 -0.14 -0.65 -0.33 0.00 0.00 177.00 174.98 2g3p s GLN 212 N -2.79 1.00 0.69 5.54 -1.52 -1.26 -4.50 119.66 116.81 2g3p s GLN 212 Ca 0.68 -1.21 -0.05 0.00 -1.95 0.00 0.00 55.36 52.83 2g3p s GLN 212 Cb -0.39 -0.88 0.07 0.00 -0.22 0.00 0.00 33.01 31.59 2g3p s GLN 212 CO 0.47 0.17 0.99 -1.25 -0.25 0.00 0.00 175.29 175.42 2g3p s PRO 213 N -2.60 2.15 0.47 2.91 0.04 -0.94 -4.38 135.00 132.64 2g3p s PRO 213 Ca 0.08 -0.40 -0.24 0.00 0.04 0.00 0.00 61.00 60.48 2g3p s PRO 213 Cb -0.05 -2.21 -0.07 0.00 0.04 0.00 0.00 34.50 32.20 2g3p s PRO 213 CO 0.03 -1.23 1.39 -1.25 0.04 0.00 0.00 177.00 175.98 2g3p s PRO 214 N -5.20 3.55 0.42 0.56 0.04 -1.26 -4.85 135.00 128.26 2g3p s PRO 214 Ca 0.61 2.33 0.10 0.00 0.04 0.00 0.00 61.00 64.07 2g3p s PRO 214 Cb -0.10 -2.54 0.90 0.00 0.04 0.00 0.00 34.50 32.80 2g3p s PRO 214 CO 0.44 -0.89 2.01 -0.24 0.04 0.00 0.00 177.00 178.35 2g3p h VAL 215 N 2.06 1.12 -0.72 -0.36 3.04 -1.38 -2.53 116.25 117.48 2g3p h VAL 215 Ca -0.51 -0.44 -0.30 0.00 -1.01 0.00 0.00 66.70 64.44 2g3p h VAL 215 Cb 1.27 0.94 -0.18 0.00 -2.01 0.00 0.00 31.29 31.32 2g3p h VAL 215 CO 0.60 0.15 0.31 -0.46 -1.01 0.00 0.00 177.57 177.17 2g3p n ASN 216 N -4.39 3.95 0.05 3.17 6.94 -1.26 -4.69 115.26 119.02 2g3p n ASN 216 Ca 0.00 -3.45 -0.12 0.00 -0.02 0.00 0.00 54.58 51.00 2g3p n ASN 216 Cb 0.17 -0.74 -0.06 0.00 -2.36 0.00 0.00 39.78 36.79 2g3p n ASN 216 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2g3p h ALA 217 N 1.72 -0.06 -2.46 -2.53 0.00 -1.82 -3.42 119.26 110.68 2g3p h ALA 217 Ca 0.36 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.69 2g3p h ALA 217 Cb 2.32 0.09 0.16 0.00 0.00 0.00 0.00 17.79 20.36 2g3p h ALA 217 CO 0.76 -0.55 -0.18 0.00 0.00 0.00 0.00 179.25 179.27 2g3p n ALA 218 N -2.22 -0.69 -1.51 0.00 0.00 -1.26 -4.66 120.51 110.16 2g3p n ALA 218 Ca -0.06 0.07 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 2g3p n ALA 218 Cb 0.09 -1.92 -0.10 0.00 0.00 0.00 0.00 19.45 17.52 2g3p n ALA 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g3p n ALA 219 N -1.31 0.32 -0.05 0.00 0.00 -1.26 -4.38 120.51 113.83 2g3p n ALA 219 Ca 0.12 -1.75 -0.01 0.00 0.00 0.00 0.00 53.44 51.80 2g3p n ALA 219 Cb 0.44 -2.97 -0.15 0.00 0.00 0.00 0.00 19.45 16.77 2g3p n ALA 219 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2g3p n HIS 220 N 17.15 0.18 -1.02 0.00 -0.00 -1.26 -4.70 115.22 125.56 2g3p n HIS 220 Ca 0.40 0.06 -0.16 0.00 -0.00 0.00 0.00 57.72 58.03 2g3p n HIS 220 Cb 0.44 -0.84 -0.15 0.00 -0.00 0.00 0.00 29.99 29.44 2g3p n HIS 220 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2g3p n HIS 221 N -2.60 0.34 -3.74 4.41 -0.00 -1.26 -4.76 115.22 107.60 2g3p n HIS 221 Ca -0.19 -1.69 -0.13 0.00 -0.00 0.00 0.00 57.72 55.71 2g3p n HIS 221 Cb 0.90 -1.70 -0.11 0.00 -0.00 0.00 0.00 29.99 29.08 2g3p n HIS 221 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2g3p s HIS 222 N 1.21 -0.42 0.00 4.41 3.76 -1.26 -4.82 115.29 118.18 2g3p s HIS 222 Ca 0.66 1.00 0.00 0.00 -0.15 0.00 0.00 55.06 56.57 2g3p s HIS 222 Cb 0.29 0.14 0.00 0.00 1.11 0.00 0.00 32.58 34.13 2g3p s HIS 222 CO -0.01 -0.21 0.00 1.58 -0.85 0.00 0.00 174.74 175.26 2g3p n HIS 223 N 3.01 0.00 -0.72 1.40 -0.00 -1.26 -5.09 115.22 112.56 2g3p n HIS 223 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.58 2g3p n HIS 223 Cb 0.57 -1.52 0.00 0.00 -0.00 0.00 0.00 29.99 29.04 2g3p n HIS 223 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92