#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3msm n VAL 0 N 0.00 0.96 -0.29 -4.37 0.24 -1.26 -0.28 118.33 113.32 3msm n VAL 0 Ca 0.00 0.26 0.04 0.00 -2.04 0.00 0.00 64.34 62.60 3msm n VAL 0 Cb 0.00 -1.11 0.18 0.00 -1.47 0.00 0.00 33.84 31.44 3msm n VAL 0 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 3msm h GLU 1 N 0.00 0.74 -0.01 7.34 4.11 -1.97 -3.29 114.58 121.51 3msm h GLU 1 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.36 59.39 3msm h GLU 1 Cb 0.28 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3msm h GLU 1 CO 0.00 0.49 -0.56 -1.33 0.07 0.00 0.00 179.01 177.68 3msm n MET 2 N -4.76 0.58 -2.22 1.06 2.81 0.61 -4.71 117.12 110.50 3msm n MET 2 Ca 0.14 -0.43 -0.41 0.00 -1.81 0.00 0.00 57.70 55.19 3msm n MET 2 Cb 0.31 -1.49 -0.03 0.00 -0.71 0.00 0.00 33.22 31.30 3msm n MET 2 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3msm s VAL 3 N -2.71 2.95 -1.81 2.03 1.01 -1.17 -3.12 120.40 117.58 3msm s VAL 3 Ca 0.16 0.94 0.00 0.00 0.00 0.00 0.00 61.98 63.08 3msm s VAL 3 Cb 0.18 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.96 3msm s VAL 3 CO 0.66 0.22 0.00 -0.67 0.00 0.00 0.00 175.10 175.31 3msm n ASP 4 N 1.06 -5.32 -0.28 3.32 4.64 -1.15 -4.88 116.55 113.93 3msm n ASP 4 Ca 0.00 0.24 0.02 0.00 -1.38 0.00 0.00 54.79 53.68 3msm n ASP 4 Cb 0.43 -4.43 0.06 0.00 -1.04 0.00 0.00 41.12 36.14 3msm n ASP 4 CO 0.00 0.00 0.00 -0.46 -0.82 0.00 0.00 177.20 175.92 3msm n ASN 5 N -1.27 0.81 -4.49 1.67 6.94 -1.15 -4.78 115.26 112.99 3msm n ASN 5 Ca -0.20 -2.01 -0.33 0.00 -0.02 0.00 0.00 54.58 52.02 3msm n ASN 5 Cb 0.64 -0.11 -0.13 0.00 -2.36 0.00 0.00 39.78 37.82 3msm n ASN 5 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3msm s LEU 6 N -0.99 2.96 0.34 -4.53 1.43 -0.96 -4.37 118.68 112.57 3msm s LEU 6 Ca 0.10 -0.15 0.03 0.00 -1.03 0.00 0.00 54.13 53.08 3msm s LEU 6 Cb 0.05 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.58 3msm s LEU 6 CO 0.07 0.29 0.12 -0.13 0.23 0.00 0.00 176.35 176.92 3msm s ARG 7 N -0.36 1.69 0.00 1.70 0.52 -0.30 -2.48 118.95 119.72 3msm s ARG 7 Ca 0.05 -1.98 0.00 0.00 -0.52 0.00 0.00 55.73 53.28 3msm s ARG 7 Cb -0.12 -0.45 0.00 0.00 0.52 0.00 0.00 34.95 34.90 3msm s ARG 7 CO 0.02 -0.38 0.00 0.41 0.02 0.00 0.00 175.30 175.37 3msm n GLY 8 N -0.69 -1.46 3.06 -3.53 0.00 -0.84 -1.06 105.19 100.67 3msm n GLY 8 Ca -0.02 -1.16 -0.17 0.00 0.00 0.00 0.00 46.02 44.66 3msm n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3msm s LYS 9 N -1.68 0.71 -0.19 1.61 1.02 -1.25 -0.54 119.74 119.42 3msm s LYS 9 Ca 0.00 -0.54 -0.37 0.00 0.02 0.00 0.00 55.97 55.08 3msm s LYS 9 Cb 0.00 -0.65 -0.14 0.00 -0.52 0.00 0.00 37.83 36.52 3msm s LYS 9 CO 0.00 0.16 1.81 0.45 -0.92 0.00 0.00 175.35 176.85 3msm n SER 10 N 2.25 2.88 0.00 2.83 2.88 0.40 -0.11 113.62 124.75 3msm n SER 10 Ca -0.17 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.40 3msm n SER 10 Cb 0.56 -1.25 0.00 0.00 -0.75 0.00 0.00 64.21 62.77 3msm n SER 10 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3msm n GLY 11 N 4.29 1.09 1.06 0.46 0.00 -1.26 -4.84 105.19 106.00 3msm n GLY 11 Ca 0.25 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.35 3msm n GLY 11 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3msm n GLN 12 N -2.00 3.07 0.00 1.61 6.02 0.84 -5.05 117.38 121.87 3msm n GLN 12 Ca 0.00 -2.50 0.00 0.00 -0.01 0.00 0.00 57.00 54.49 3msm n GLN 12 Cb 0.00 -1.56 0.00 0.00 1.02 0.00 0.00 30.24 29.70 3msm n GLN 12 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3msm n GLY 13 N 0.77 -1.45 3.66 1.08 0.00 -1.23 -4.79 105.19 103.23 3msm n GLY 13 Ca 0.19 -1.58 -0.35 0.00 0.00 0.00 0.00 46.02 44.29 3msm n GLY 13 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3msm s TYR 14 N -2.08 3.26 0.13 1.61 1.51 -1.26 -3.90 117.35 116.61 3msm s TYR 14 Ca 0.00 0.11 0.10 0.00 -1.01 0.00 0.00 57.07 56.27 3msm s TYR 14 Cb 0.00 -2.02 -0.04 0.00 -0.11 0.00 0.00 41.96 39.79 3msm s TYR 14 CO 0.00 0.24 -0.26 1.52 -1.11 0.00 0.00 175.55 175.95 3msm s TYR 15 N 0.05 2.19 0.09 2.71 -0.85 -0.22 -0.64 117.35 120.68 3msm s TYR 15 Ca 0.05 -0.39 0.10 0.00 -0.52 0.00 0.00 57.07 56.31 3msm s TYR 15 Cb -0.12 -1.19 -0.03 0.00 0.38 0.00 0.00 41.96 41.00 3msm s TYR 15 CO 0.01 0.31 -0.25 0.54 -1.52 0.00 0.00 175.55 174.64 3msm s VAL 16 N -1.10 2.29 0.26 -3.49 0.11 0.43 -1.15 120.40 117.76 3msm s VAL 16 Ca 0.12 -1.54 -0.29 0.00 -2.93 0.00 0.00 61.98 57.34 3msm s VAL 16 Cb -0.10 -1.96 -0.09 0.00 -1.53 0.00 0.00 36.38 32.70 3msm s VAL 16 CO 0.06 0.23 1.00 -0.70 -3.33 0.00 0.00 175.10 172.35 3msm s GLU 17 N -1.66 4.74 0.05 1.54 2.12 -1.26 -1.23 118.70 123.01 3msm s GLU 17 Ca 0.13 1.58 -0.07 0.00 0.36 0.00 0.00 54.97 56.98 3msm s GLU 17 Cb -0.10 -3.19 -0.01 0.00 0.26 0.00 0.00 34.13 31.09 3msm s GLU 17 CO 0.04 0.38 0.14 -1.64 -0.54 0.00 0.00 175.26 173.64 3msm s MET 18 N -1.37 0.68 0.06 4.30 -1.94 -0.41 -4.29 119.30 116.33 3msm s MET 18 Ca 0.43 -0.79 0.08 0.00 -1.71 0.00 0.00 55.69 53.71 3msm s MET 18 Cb -0.27 0.27 -0.03 0.00 2.01 0.00 0.00 34.83 36.81 3msm s MET 18 CO 0.34 -0.19 -0.23 0.95 -0.01 0.00 0.00 175.02 175.89 3msm s THR 19 N -2.96 1.85 0.02 2.05 -4.23 0.00 -0.57 115.64 111.80 3msm s THR 19 Ca -0.02 -1.36 0.04 0.00 -1.18 0.00 0.00 61.69 59.17 3msm s THR 19 Cb 0.01 -1.62 -0.01 0.00 1.34 0.00 0.00 72.50 72.22 3msm s THR 19 CO -0.06 0.19 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.41 3msm s VAL 20 N -0.88 0.87 0.00 2.29 1.01 -0.29 -2.14 120.40 121.25 3msm s VAL 20 Ca 0.09 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.36 3msm s VAL 20 Cb -0.09 -0.77 0.00 0.00 0.00 0.00 0.00 36.38 35.51 3msm s VAL 20 CO 0.03 0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.80 3msm n GLY 21 N 2.32 -1.67 3.13 4.51 0.00 -0.45 -0.38 105.19 112.64 3msm n GLY 21 Ca -0.16 -1.52 -0.31 0.00 0.00 0.00 0.00 46.02 44.02 3msm n GLY 21 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3msm s SER 22 N -3.92 2.87 0.99 1.61 0.01 -1.26 -2.32 113.70 111.68 3msm s SER 22 Ca 0.00 -0.54 -0.11 0.00 1.31 0.00 0.00 55.95 56.61 3msm s SER 22 Cb 0.00 -1.32 0.18 0.00 0.21 0.00 0.00 66.02 65.10 3msm s SER 22 CO 0.00 0.05 1.09 -2.16 0.41 0.00 0.00 173.24 172.64 3msm s PRO 23 N 0.89 0.49 0.22 12.44 0.04 -1.26 -0.93 135.00 146.89 3msm s PRO 23 Ca -0.07 1.13 -0.31 0.00 0.04 0.00 0.00 61.00 61.80 3msm s PRO 23 Cb -0.15 -1.70 -0.11 0.00 0.04 0.00 0.00 34.50 32.58 3msm s PRO 23 CO -0.02 -2.86 1.57 -1.25 0.04 0.00 0.00 177.00 174.48 3msm s PRO 24 N -4.67 4.19 -0.24 0.56 0.04 -0.98 -4.91 135.00 129.00 3msm s PRO 24 Ca 0.66 2.43 -0.09 0.00 0.04 0.00 0.00 61.00 64.05 3msm s PRO 24 Cb -0.22 -3.10 -0.04 0.00 0.04 0.00 0.00 34.50 31.18 3msm s PRO 24 CO 0.60 -0.59 0.11 -0.65 0.04 0.00 0.00 177.00 176.51 3msm s GLN 25 N 0.42 3.87 0.01 4.56 -0.21 0.49 -4.88 119.66 123.92 3msm s GLN 25 Ca 0.67 -0.37 -0.30 0.00 0.02 0.00 0.00 55.36 55.37 3msm s GLN 25 Cb -0.45 -3.42 -0.04 0.00 1.00 0.00 0.00 33.01 30.10 3msm s GLN 25 CO 0.38 -0.04 1.12 0.99 -2.12 0.00 0.00 175.29 175.62 3msm s THR 26 N 1.27 4.39 0.02 -0.19 2.01 -1.26 -1.14 115.64 120.74 3msm s THR 26 Ca 0.06 1.71 0.01 0.00 0.31 0.00 0.00 61.69 63.78 3msm s THR 26 Cb -0.14 -4.10 -0.01 0.00 0.01 0.00 0.00 72.50 68.25 3msm s THR 26 CO 0.05 0.10 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.28 3msm s LEU 27 N 1.31 2.15 -0.07 4.42 1.43 0.26 -4.93 118.68 123.24 3msm s LEU 27 Ca 0.55 -0.33 -0.21 0.00 -1.03 0.00 0.00 54.13 53.12 3msm s LEU 27 Cb -0.25 -0.08 -0.04 0.00 0.03 0.00 0.00 46.19 45.84 3msm s LEU 27 CO 0.27 -0.13 0.59 0.20 0.23 0.00 0.00 176.35 177.51 3msm s ASN 28 N -0.92 6.87 -0.08 2.29 0.01 -1.26 -1.29 114.94 120.57 3msm s ASN 28 Ca -0.07 1.05 0.01 0.00 -0.71 0.00 0.00 52.86 53.13 3msm s ASN 28 Cb -0.06 -2.35 0.02 0.00 0.41 0.00 0.00 41.25 39.26 3msm s ASN 28 CO -0.00 -0.02 -0.07 -0.63 -1.51 0.00 0.00 177.10 174.87 3msm s ILE 29 N 0.49 0.86 0.17 0.60 -1.09 -0.36 -0.55 121.20 121.32 3msm s ILE 29 Ca 0.32 -0.25 -0.31 0.00 -2.23 0.00 0.00 60.65 58.18 3msm s ILE 29 Cb -0.17 -0.86 -0.09 0.00 -1.58 0.00 0.00 42.46 39.75 3msm s ILE 29 CO 0.15 0.32 1.48 -0.22 -1.23 0.00 0.00 174.94 175.44 3msm s LEU 30 N 1.25 4.38 -0.23 2.97 0.20 0.77 -0.43 118.68 127.58 3msm s LEU 30 Ca -0.05 2.55 -0.20 0.00 0.69 0.00 0.00 54.13 57.12 3msm s LEU 30 Cb -0.14 -3.60 -0.02 0.00 -0.43 0.00 0.00 46.19 42.00 3msm s LEU 30 CO -0.02 -0.74 0.60 -0.69 -0.29 0.00 0.00 176.35 175.21 3msm s VAL 31 N 0.82 5.02 -0.27 1.68 1.01 0.18 0.11 120.40 128.96 3msm s VAL 31 Ca 0.66 1.09 -0.03 0.00 0.00 0.00 0.00 61.98 63.70 3msm s VAL 31 Cb -0.41 -3.91 0.09 0.00 0.00 0.00 0.00 36.38 32.15 3msm s VAL 31 CO 0.34 0.08 0.10 -0.62 0.00 0.00 0.00 175.10 175.00 3msm s ASP 32 N 1.36 3.46 0.00 3.32 2.15 -0.16 -4.49 116.67 122.31 3msm s ASP 32 Ca 0.26 -1.25 0.03 0.00 0.43 0.00 0.00 52.55 52.02 3msm s ASP 32 Cb -0.16 -0.54 0.19 0.00 -0.30 0.00 0.00 42.92 42.11 3msm s ASP 32 CO 0.09 -0.40 1.10 0.35 -0.17 0.00 0.00 175.17 176.14 3msm n THR 33 N 5.09 0.00 -0.27 1.71 -2.24 -1.26 -0.62 114.28 116.69 3msm n THR 33 Ca -0.05 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.80 3msm n THR 33 Cb 0.44 -0.06 0.22 0.00 -2.10 0.00 0.00 70.33 68.82 3msm n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3msm n GLY 34 N 0.52 2.70 3.69 3.38 0.00 -1.26 -4.37 105.19 109.85 3msm n GLY 34 Ca 0.02 -0.54 -0.11 0.00 0.00 0.00 0.00 46.02 45.39 3msm n GLY 34 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3msm s SER 35 N -1.01 0.34 0.00 1.61 1.04 -1.24 -5.00 113.70 109.43 3msm s SER 35 Ca 0.33 -1.26 0.00 0.00 0.48 0.00 0.00 55.95 55.50 3msm s SER 35 Cb 0.17 0.78 0.00 0.00 0.10 0.00 0.00 66.02 67.08 3msm s SER 35 CO 0.22 -1.54 0.47 -1.20 0.98 0.00 0.00 173.24 172.16 3msm n SER 36 N -1.39 0.32 -4.85 7.02 7.64 -1.26 -0.46 113.62 120.64 3msm n SER 36 Ca -0.05 -1.14 -0.37 0.00 1.01 0.00 0.00 58.87 58.32 3msm n SER 36 Cb 0.60 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.74 3msm n SER 36 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3msm s ASN 37 N -0.14 6.54 -0.58 6.43 -0.87 -1.26 -4.42 114.94 120.64 3msm s ASN 37 Ca 0.00 0.64 -0.27 0.00 -1.57 0.00 0.00 52.86 51.67 3msm s ASN 37 Cb 0.00 -2.14 0.03 0.00 -0.02 0.00 0.00 41.25 39.12 3msm s ASN 37 CO 0.00 0.35 1.10 0.12 -2.57 0.00 0.00 177.10 176.10 3msm s PHE 38 N -0.89 2.66 0.01 2.20 5.36 -1.26 -1.03 117.98 125.02 3msm s PHE 38 Ca 0.18 0.23 0.05 0.00 -0.96 0.00 0.00 56.93 56.43 3msm s PHE 38 Cb -0.14 -4.36 -0.02 0.00 -0.34 0.00 0.00 43.02 38.17 3msm s PHE 38 CO 0.07 -1.52 -0.17 0.00 -1.46 0.00 0.00 175.22 172.14 3msm s ALA 39 N 4.61 1.40 -0.09 11.12 0.00 -0.93 -1.08 121.76 136.79 3msm s ALA 39 Ca 0.38 -0.79 -0.12 0.00 0.00 0.00 0.00 51.96 51.43 3msm s ALA 39 Cb -0.09 -0.32 0.03 0.00 0.00 0.00 0.00 23.12 22.74 3msm s ALA 39 CO 0.22 0.32 0.31 0.14 0.00 0.00 0.00 175.76 176.76 3msm s VAL 40 N -0.54 0.02 0.23 0.00 -7.23 -0.32 -0.70 120.40 111.85 3msm s VAL 40 Ca 0.06 -0.16 -0.32 0.00 -1.81 0.00 0.00 61.98 59.75 3msm s VAL 40 Cb -0.07 -0.49 -0.13 0.00 0.56 0.00 0.00 36.38 36.25 3msm s VAL 40 CO 0.00 -0.09 1.53 0.61 -0.31 0.00 0.00 175.10 176.85 3msm n GLY 41 N 2.39 1.08 0.00 2.32 0.00 0.23 0.12 105.19 111.34 3msm n GLY 41 Ca -0.16 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.41 3msm n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3msm n ALA 42 N 2.60 1.64 -2.66 4.61 0.00 -0.41 0.01 120.51 126.29 3msm n ALA 42 Ca 0.13 -0.17 -0.19 0.00 0.00 0.00 0.00 53.44 53.21 3msm n ALA 42 Cb 0.32 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.65 3msm n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3msm s ALA 43 N -0.39 1.28 -0.74 0.00 0.00 -1.25 -4.64 121.76 116.02 3msm s ALA 43 Ca 0.00 -1.06 -0.18 0.00 0.00 0.00 0.00 51.96 50.73 3msm s ALA 43 Cb 0.00 -0.11 -0.14 0.00 0.00 0.00 0.00 23.12 22.87 3msm s ALA 43 CO 0.00 0.19 1.92 -0.35 0.00 0.00 0.00 175.76 177.52 3msm n PRO 44 N 1.19 1.52 -1.94 0.00 -0.04 -1.26 -4.91 135.00 129.56 3msm n PRO 44 Ca -0.20 -1.66 -0.41 0.00 -0.04 0.00 0.00 63.50 61.19 3msm n PRO 44 Cb 0.54 -2.74 -0.01 0.00 -0.04 0.00 0.00 33.50 31.25 3msm n PRO 44 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3msm s HIS 45 N 4.69 2.81 0.34 0.54 2.46 -1.26 -4.94 115.29 119.93 3msm s HIS 45 Ca 0.51 1.23 0.31 0.00 0.47 0.00 0.00 55.06 57.58 3msm s HIS 45 Cb 0.13 -3.88 1.48 0.00 -0.13 0.00 0.00 32.58 30.19 3msm s HIS 45 CO 0.09 -2.56 2.06 -1.00 -2.47 0.00 0.00 174.74 170.86 3msm h PRO 46 N 3.39 0.00 0.00 2.88 0.13 -2.04 -2.11 132.00 134.25 3msm h PRO 46 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 3msm h PRO 46 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 3msm h PRO 46 CO 0.66 0.09 0.00 1.19 -0.23 0.00 0.00 178.00 179.72 3msm n PHE 47 N -3.40 0.19 -3.19 1.56 3.72 -1.26 -4.89 117.46 110.19 3msm n PHE 47 Ca -0.01 0.06 -0.37 0.00 -0.05 0.00 0.00 57.45 57.08 3msm n PHE 47 Cb 0.26 -0.60 -0.06 0.00 -0.94 0.00 0.00 39.48 38.14 3msm n PHE 47 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3msm s LEU 48 N -3.32 4.44 -0.07 4.37 1.43 -0.80 -4.65 118.68 120.09 3msm s LEU 48 Ca 0.11 1.34 -0.20 0.00 -1.03 0.00 0.00 54.13 54.35 3msm s LEU 48 Cb 0.15 -3.25 -0.30 0.00 0.03 0.00 0.00 46.19 42.82 3msm s LEU 48 CO 0.47 0.16 0.77 0.45 0.23 0.00 0.00 176.35 178.42 3msm h HIS 49 N 3.96 0.49 -4.54 0.29 3.86 -1.88 -3.48 115.15 113.86 3msm h HIS 49 Ca -0.48 -0.36 -0.23 0.00 -1.16 0.00 0.00 60.37 58.14 3msm h HIS 49 Cb 1.20 -0.02 -0.15 0.00 1.06 0.00 0.00 27.41 29.50 3msm h HIS 49 CO 0.65 1.39 -0.62 -0.98 0.86 0.00 0.00 177.93 179.24 3msm s ARG 50 N -2.44 1.15 0.13 2.45 1.70 -1.26 -5.18 118.95 115.51 3msm s ARG 50 Ca -0.16 -1.59 -0.18 0.00 -0.47 0.00 0.00 55.73 53.34 3msm s ARG 50 Cb 0.02 0.27 0.04 0.00 -0.57 0.00 0.00 34.95 34.71 3msm s ARG 50 CO 0.80 -0.37 0.45 1.52 -1.08 0.00 0.00 175.30 176.63 3msm s TYR 51 N -4.14 -0.29 -0.02 5.89 1.13 -1.26 -4.88 117.35 113.78 3msm s TYR 51 Ca 0.36 0.00 -0.30 0.00 -1.41 0.00 0.00 57.07 55.72 3msm s TYR 51 Cb 0.07 0.34 -0.05 0.00 -1.10 0.00 0.00 41.96 41.22 3msm s TYR 51 CO 0.10 -0.74 1.40 -0.47 -2.51 0.00 0.00 175.55 173.33 3msm s TYR 52 N -3.79 2.80 -0.38 -3.49 5.04 0.10 -4.93 117.35 112.70 3msm s TYR 52 Ca 0.02 0.81 -0.02 0.00 -2.44 0.00 0.00 57.07 55.45 3msm s TYR 52 Cb 0.01 -3.65 0.10 0.00 0.35 0.00 0.00 41.96 38.77 3msm s TYR 52 CO -0.12 -2.42 0.15 -0.65 -1.34 0.00 0.00 175.55 171.17 3msm s GLN 53 N 2.63 1.98 0.44 4.97 -0.21 -1.26 -4.34 119.66 123.86 3msm s GLN 53 Ca 0.63 -1.76 0.20 0.00 0.02 0.00 0.00 55.36 54.46 3msm s GLN 53 Cb -0.30 -3.48 1.01 0.00 1.00 0.00 0.00 33.01 31.24 3msm s GLN 53 CO 0.25 -0.99 1.90 0.00 -2.12 0.00 0.00 175.29 174.33 3msm h ARG 54 N 7.98 0.00 0.00 2.91 3.08 -1.94 -2.96 114.38 123.44 3msm h ARG 54 Ca -0.13 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.91 3msm h ARG 54 Cb 1.05 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.09 3msm h ARG 54 CO 0.65 0.26 -0.04 -0.56 -1.07 0.00 0.00 179.97 179.21 3msm h GLN 55 N 0.00 0.00 0.00 0.04 -0.00 -2.01 -1.30 115.11 111.84 3msm h GLN 55 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 3msm h GLN 55 Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.07 3msm h GLN 55 CO 0.03 0.04 -0.28 1.28 -0.00 0.00 0.00 178.83 179.90 3msm n LEU 56 N -3.33 0.44 -4.64 0.06 4.77 -1.12 -4.83 117.00 108.35 3msm n LEU 56 Ca -0.02 0.31 -0.38 0.00 -0.03 0.00 0.00 56.01 55.89 3msm n LEU 56 Cb 0.18 -0.33 -0.09 0.00 -2.33 0.00 0.00 43.42 40.86 3msm n LEU 56 CO 0.26 -0.01 -0.05 -0.55 -1.33 0.00 0.00 177.39 175.71 3msm s SER 57 N -3.53 6.22 0.01 -1.43 0.15 -0.49 -4.24 113.70 110.38 3msm s SER 57 Ca 0.11 0.24 0.28 0.00 0.70 0.00 0.00 55.95 57.28 3msm s SER 57 Cb 0.16 -2.16 1.07 0.00 -1.71 0.00 0.00 66.02 63.38 3msm s SER 57 CO 0.63 -0.04 1.82 -1.54 1.20 0.00 0.00 173.24 175.31 3msm n SER 58 N 4.69 0.13 -0.79 5.45 3.41 -0.11 -3.52 113.62 122.87 3msm n SER 58 Ca -0.12 0.36 0.09 0.00 -0.26 0.00 0.00 58.87 58.94 3msm n SER 58 Cb 0.51 -0.36 0.11 0.00 -0.26 0.00 0.00 64.21 64.22 3msm n SER 58 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3msm n THR 59 N -1.54 0.23 -2.42 6.66 -2.24 -1.26 -4.99 114.28 108.73 3msm n THR 59 Ca 0.07 -0.61 -0.39 0.00 -2.27 0.00 0.00 64.05 60.84 3msm n THR 59 Cb 0.34 1.18 -0.03 0.00 -2.10 0.00 0.00 70.33 69.72 3msm n THR 59 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3msm s TYR 60 N -1.39 3.33 -0.10 4.78 5.04 -1.23 -4.61 117.35 123.16 3msm s TYR 60 Ca 0.25 1.63 -0.01 0.00 -2.44 0.00 0.00 57.07 56.49 3msm s TYR 60 Cb 0.16 -3.30 0.03 0.00 0.35 0.00 0.00 41.96 39.20 3msm s TYR 60 CO 0.23 -0.87 -0.02 1.03 -1.34 0.00 0.00 175.55 174.58 3msm s ARG 61 N -1.96 0.95 0.10 4.97 0.52 -0.59 -5.00 118.95 117.94 3msm s ARG 61 Ca 0.51 -0.09 -0.31 0.00 -0.52 0.00 0.00 55.73 55.33 3msm s ARG 61 Cb -0.30 -1.32 -0.07 0.00 0.52 0.00 0.00 34.95 33.78 3msm s ARG 61 CO 0.38 -0.33 1.35 0.34 0.02 0.00 0.00 175.30 177.06 3msm s ASP 62 N 1.86 6.88 0.00 0.23 -1.08 -1.26 -1.15 116.67 122.15 3msm s ASP 62 Ca 0.04 2.25 0.21 0.00 -0.52 0.00 0.00 52.55 54.54 3msm s ASP 62 Cb -0.13 -2.58 0.79 0.00 -1.46 0.00 0.00 42.92 39.54 3msm s ASP 62 CO -0.07 -0.62 1.57 0.18 0.52 0.00 0.00 175.17 176.76 3msm n LEU 63 N 4.03 1.57 -3.94 -1.34 4.77 -0.94 -4.93 117.00 116.22 3msm n LEU 63 Ca 0.11 -0.65 -0.39 0.00 -0.03 0.00 0.00 56.01 55.05 3msm n LEU 63 Cb 0.43 -0.09 0.02 0.00 -2.33 0.00 0.00 43.42 41.45 3msm n LEU 63 CO 0.58 0.32 -0.15 0.54 -1.33 0.00 0.00 177.39 177.35 3msm n ARG 64 N 0.26 -0.67 -3.64 3.23 1.74 -1.26 -4.96 116.66 111.36 3msm n ARG 64 Ca 0.16 0.30 -0.05 0.00 -0.77 0.00 0.00 57.85 57.49 3msm n ARG 64 Cb 0.32 -2.80 -0.07 0.00 -1.02 0.00 0.00 32.46 28.90 3msm n ARG 64 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 3msm s LYS 65 N -6.63 0.62 0.38 5.56 2.47 -1.26 -5.04 119.74 115.83 3msm s LYS 65 Ca 0.39 1.11 -0.04 0.00 -1.56 0.00 0.00 55.97 55.86 3msm s LYS 65 Cb -0.20 0.19 -0.04 0.00 -1.46 0.00 0.00 37.83 36.32 3msm s LYS 65 CO 0.94 -0.14 0.65 0.20 0.16 0.00 0.00 175.35 177.15 3msm s GLY 66 N 1.69 1.61 -0.05 5.54 0.00 -1.26 -0.47 107.32 114.38 3msm s GLY 66 Ca -0.09 -0.60 0.03 0.00 0.00 0.00 0.00 44.72 44.05 3msm s GLY 66 CO -0.19 -0.48 -0.13 0.54 0.00 0.00 0.00 173.10 172.84 3msm s VAL 67 N -2.38 1.15 -0.17 1.40 0.11 0.56 -4.87 120.40 116.20 3msm s VAL 67 Ca 0.45 -0.54 0.01 0.00 -2.93 0.00 0.00 61.98 58.96 3msm s VAL 67 Cb -0.10 -1.02 0.02 0.00 -1.53 0.00 0.00 36.38 33.75 3msm s VAL 67 CO 0.36 0.35 -0.18 -0.47 -3.33 0.00 0.00 175.10 171.83 3msm s TYR 68 N 0.29 2.62 -0.38 1.54 6.14 -1.26 -1.44 117.35 124.85 3msm s TYR 68 Ca -0.07 -1.54 0.04 0.00 0.64 0.00 0.00 57.07 56.13 3msm s TYR 68 Cb -0.12 -1.83 0.11 0.00 0.42 0.00 0.00 41.96 40.53 3msm s TYR 68 CO 0.02 -0.77 0.11 0.08 0.64 0.00 0.00 175.55 175.62 3msm s VAL 69 N 1.34 2.27 0.22 3.14 1.01 0.62 -4.98 120.40 124.01 3msm s VAL 69 Ca 0.05 -2.55 -0.06 0.00 0.00 0.00 0.00 61.98 59.42 3msm s VAL 69 Cb -0.13 -2.66 -0.06 0.00 0.00 0.00 0.00 36.38 33.53 3msm s VAL 69 CO -0.12 -0.66 0.49 -2.16 0.00 0.00 0.00 175.10 172.65 3msm s PRO 70 N 0.63 3.69 0.05 2.72 0.04 -1.26 -0.77 135.00 140.10 3msm s PRO 70 Ca 0.13 0.06 0.01 0.00 0.04 0.00 0.00 61.00 61.24 3msm s PRO 70 Cb -0.21 -2.72 -0.00 0.00 0.04 0.00 0.00 34.50 31.61 3msm s PRO 70 CO -0.07 0.34 0.04 2.48 0.04 0.00 0.00 177.00 179.84 3msm n TYR 71 N -0.29 -0.10 -0.03 0.56 0.18 0.51 -4.95 117.16 113.04 3msm n TYR 71 Ca -0.01 -0.43 -0.08 0.00 1.88 0.00 0.00 57.90 59.25 3msm n TYR 71 Cb 0.53 0.04 -0.02 0.00 -0.38 0.00 0.00 39.34 39.50 3msm n TYR 71 CO 0.00 0.00 0.00 1.15 -2.08 0.00 0.00 176.86 175.93 3msm h THR 72 N 1.16 0.55 0.00 -3.48 2.02 -2.02 -3.25 112.91 107.89 3msm h THR 72 Ca -0.04 0.00 -0.25 0.00 0.77 0.00 0.00 66.41 66.90 3msm h THR 72 Cb 0.19 0.55 -0.05 0.00 -1.74 0.00 0.00 68.15 67.10 3msm h THR 72 CO 0.06 0.00 -2.06 0.00 0.37 0.00 0.00 175.52 173.89 3msm n GLN 73 N -5.32 0.66 0.00 6.66 1.13 -1.26 -5.06 117.38 114.20 3msm n GLN 73 Ca -0.02 0.02 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 3msm n GLN 73 Cb 0.23 -1.60 0.00 0.00 0.11 0.00 0.00 30.24 28.98 3msm n GLN 73 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3msm n GLY 74 N 1.56 4.34 3.52 1.08 0.00 -1.23 -4.89 105.19 109.57 3msm n GLY 74 Ca -0.21 -0.74 -0.09 0.00 0.00 0.00 0.00 46.02 44.98 3msm n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3msm s LYS 75 N 2.28 0.78 0.10 1.61 0.00 -0.39 -0.37 119.74 123.75 3msm s LYS 75 Ca 0.00 -0.20 0.08 0.00 0.00 0.00 0.00 55.97 55.86 3msm s LYS 75 Cb 0.00 0.36 -0.03 0.00 0.00 0.00 0.00 37.83 38.16 3msm s LYS 75 CO 0.00 -0.32 -0.22 1.67 0.00 0.00 0.00 175.35 176.48 3msm s TRP 76 N -2.69 1.86 0.04 1.78 1.48 0.05 -0.97 118.94 120.49 3msm s TRP 76 Ca 0.03 -0.41 -0.00 0.00 -1.06 0.00 0.00 56.10 54.66 3msm s TRP 76 Cb -0.01 -1.02 -0.03 0.00 -1.16 0.00 0.00 33.47 31.25 3msm s TRP 76 CO -0.06 0.21 -0.03 -1.83 -4.06 0.00 0.00 176.95 171.17 3msm s GLU 77 N -1.86 0.45 0.12 3.25 -1.05 -0.04 -0.28 118.70 119.30 3msm s GLU 77 Ca 0.07 -0.87 -0.14 0.00 -0.15 0.00 0.00 54.97 53.88 3msm s GLU 77 Cb -0.10 0.12 0.05 0.00 -0.44 0.00 0.00 34.13 33.76 3msm s GLU 77 CO 0.04 -0.07 0.67 0.41 0.95 0.00 0.00 175.26 177.27 3msm n GLY 78 N 0.97 0.85 3.18 -3.83 0.00 -0.52 -0.79 105.19 105.05 3msm n GLY 78 Ca -0.20 -1.07 -0.30 0.00 0.00 0.00 0.00 46.02 44.45 3msm n GLY 78 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3msm s GLU 79 N -2.03 2.69 0.39 1.61 2.02 -0.81 -0.32 118.70 122.25 3msm s GLU 79 Ca 0.15 -0.78 -0.18 0.00 0.02 0.00 0.00 54.97 54.19 3msm s GLU 79 Cb -0.02 -2.08 -0.10 0.00 0.10 0.00 0.00 34.13 32.04 3msm s GLU 79 CO 0.04 0.17 0.86 -0.51 0.02 0.00 0.00 175.26 175.83 3msm s LEU 80 N 0.35 3.95 0.20 1.80 1.43 0.37 -0.91 118.68 125.88 3msm s LEU 80 Ca -0.16 1.48 -0.23 0.00 -1.03 0.00 0.00 54.13 54.19 3msm s LEU 80 Cb -0.17 -4.33 0.06 0.00 0.03 0.00 0.00 46.19 41.79 3msm s LEU 80 CO 0.07 -0.32 0.95 -0.83 0.23 0.00 0.00 176.35 176.44 3msm s GLY 81 N -2.36 -0.04 0.13 -3.19 0.00 -0.42 -2.22 107.32 99.21 3msm s GLY 81 Ca 0.58 -0.16 0.08 0.00 0.00 0.00 0.00 44.72 45.22 3msm s GLY 81 CO 0.18 0.68 -0.18 -0.51 0.00 0.00 0.00 173.10 173.26 3msm s THR 82 N -2.88 1.61 0.32 0.90 -4.23 -0.30 0.15 115.64 111.22 3msm s THR 82 Ca 0.15 -1.71 -0.18 0.00 -1.18 0.00 0.00 61.69 58.77 3msm s THR 82 Cb -0.03 -1.62 0.03 0.00 1.34 0.00 0.00 72.50 72.23 3msm s THR 82 CO 0.05 -0.26 0.74 -0.62 -0.54 0.00 0.00 174.62 173.99 3msm s ASP 83 N -2.31 -0.13 -0.21 3.99 -1.08 -0.54 -1.54 116.67 114.84 3msm s ASP 83 Ca 0.10 -0.85 -0.29 0.00 -0.52 0.00 0.00 52.55 50.99 3msm s ASP 83 Cb -0.07 0.78 0.00 0.00 -1.46 0.00 0.00 42.92 42.17 3msm s ASP 83 CO 0.05 -1.49 1.10 -0.76 0.52 0.00 0.00 175.17 174.59 3msm s LEU 84 N -2.99 4.12 -0.01 -1.34 1.43 -1.26 -1.53 118.68 117.10 3msm s LEU 84 Ca 0.13 1.46 0.06 0.00 -1.03 0.00 0.00 54.13 54.75 3msm s LEU 84 Cb -0.05 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.60 3msm s LEU 84 CO 0.09 -0.70 -0.18 -0.69 0.23 0.00 0.00 176.35 175.10 3msm s VAL 85 N 3.30 2.75 0.17 -1.59 1.01 0.15 -1.35 120.40 124.83 3msm s VAL 85 Ca 0.47 -0.99 -0.07 0.00 0.00 0.00 0.00 61.98 61.40 3msm s VAL 85 Cb -0.17 -2.09 -0.02 0.00 0.00 0.00 0.00 36.38 34.11 3msm s VAL 85 CO 0.09 0.49 0.23 -0.94 0.00 0.00 0.00 175.10 174.97 3msm s SER 86 N -0.99 0.10 -0.33 3.32 1.04 -0.91 -1.07 113.70 114.87 3msm s SER 86 Ca 0.12 -1.00 0.01 0.00 0.48 0.00 0.00 55.95 55.56 3msm s SER 86 Cb -0.10 0.41 0.10 0.00 0.10 0.00 0.00 66.02 66.53 3msm s SER 86 CO 0.02 -0.87 0.10 -0.63 0.98 0.00 0.00 173.24 172.84 3msm s ILE 87 N -4.01 1.23 0.14 -1.02 1.01 -1.26 -0.82 121.20 116.48 3msm s ILE 87 Ca 0.21 -1.72 -0.26 0.00 0.00 0.00 0.00 60.65 58.88 3msm s ILE 87 Cb 0.04 -1.92 -0.01 0.00 0.01 0.00 0.00 42.46 40.59 3msm s ILE 87 CO 0.02 -0.68 1.60 -0.65 0.00 0.00 0.00 174.94 175.22 3msm h PRO 88 N 7.85 -0.37 -1.92 2.79 0.11 -1.91 0.60 132.00 139.15 3msm h PRO 88 Ca -0.10 0.02 -0.45 0.00 0.11 0.00 0.00 66.00 65.58 3msm h PRO 88 Cb 1.01 0.08 -0.16 0.00 0.11 0.00 0.00 31.00 32.03 3msm h PRO 88 CO 0.48 -0.24 0.35 0.72 -0.21 0.00 0.00 178.00 179.10 3msm n HIS 89 N -5.42 1.49 -3.75 0.65 8.25 -1.26 -4.85 115.22 110.33 3msm n HIS 89 Ca -0.02 -1.92 0.00 0.00 -0.26 0.00 0.00 57.72 55.52 3msm n HIS 89 Cb 0.34 -1.33 0.00 0.00 1.12 0.00 0.00 29.99 30.12 3msm n HIS 89 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3msm n GLY 90 N 0.89 4.49 3.76 -1.41 0.00 0.21 -4.41 105.19 108.71 3msm n GLY 90 Ca 0.46 -1.72 -0.39 0.00 0.00 0.00 0.00 46.02 44.37 3msm n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3msm s PRO 91 N -1.26 3.41 -1.32 1.61 0.04 -1.26 -4.83 135.00 131.39 3msm s PRO 91 Ca 0.00 2.24 -0.17 0.00 0.04 0.00 0.00 61.00 63.11 3msm s PRO 91 Cb 0.00 -2.42 0.04 0.00 0.04 0.00 0.00 34.50 32.16 3msm s PRO 91 CO 0.00 -0.98 1.92 -1.71 0.04 0.00 0.00 177.00 176.28 3msm n ASN 92 N -0.66 4.33 -3.78 6.66 5.15 -1.26 -4.65 115.26 121.05 3msm n ASN 92 Ca 0.08 -2.86 -0.10 0.00 -0.60 0.00 0.00 54.58 51.09 3msm n ASN 92 Cb 0.44 -1.69 -0.07 0.00 -0.53 0.00 0.00 39.78 37.93 3msm n ASN 92 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3msm s VAL 93 N 4.46 0.10 -0.04 3.44 -7.23 -1.26 -5.17 120.40 114.70 3msm s VAL 93 Ca 0.53 -0.85 0.04 0.00 -1.81 0.00 0.00 61.98 59.90 3msm s VAL 93 Cb 0.07 -1.10 -0.00 0.00 0.56 0.00 0.00 36.38 35.91 3msm s VAL 93 CO 0.03 -0.47 -0.17 -0.89 -0.31 0.00 0.00 175.10 173.29 3msm s THR 94 N -3.17 1.41 0.02 5.32 2.01 -1.26 -4.44 115.64 115.53 3msm s THR 94 Ca -0.01 -0.71 0.01 0.00 0.31 0.00 0.00 61.69 61.30 3msm s THR 94 Cb 0.01 -1.21 -0.02 0.00 0.01 0.00 0.00 72.50 71.29 3msm s THR 94 CO -0.07 0.41 -0.05 0.68 -0.69 0.00 0.00 174.62 174.89 3msm s VAL 95 N 0.01 0.33 -0.32 3.82 -7.23 -0.23 -4.93 120.40 111.85 3msm s VAL 95 Ca -0.03 -0.78 -0.29 0.00 -1.81 0.00 0.00 61.98 59.07 3msm s VAL 95 Cb -0.11 -0.40 0.01 0.00 0.56 0.00 0.00 36.38 36.44 3msm s VAL 95 CO 0.02 -0.30 1.19 -0.60 -0.31 0.00 0.00 175.10 175.09 3msm s ARG 96 N -1.15 3.97 0.20 4.82 3.52 -1.26 0.30 118.95 129.35 3msm s ARG 96 Ca -0.09 1.12 0.06 0.00 -0.13 0.00 0.00 55.73 56.69 3msm s ARG 96 Cb -0.08 -3.82 -0.05 0.00 -1.56 0.00 0.00 34.95 29.45 3msm s ARG 96 CO -0.00 -1.04 -0.11 0.00 -0.81 0.00 0.00 175.30 173.34 3msm s ALA 97 N 4.04 1.91 0.32 6.12 0.00 -0.58 -4.91 121.76 128.66 3msm s ALA 97 Ca 0.51 -1.67 -0.28 0.00 0.00 0.00 0.00 51.96 50.51 3msm s ALA 97 Cb -0.14 0.04 -0.10 0.00 0.00 0.00 0.00 23.12 22.93 3msm s ALA 97 CO 0.20 -0.02 1.18 -0.80 0.00 0.00 0.00 175.76 176.32 3msm s ASN 98 N -3.30 6.99 -0.04 0.00 0.01 -1.26 -1.47 114.94 115.87 3msm s ASN 98 Ca 0.23 2.42 0.01 0.00 -0.71 0.00 0.00 52.86 54.80 3msm s ASN 98 Cb 0.01 -2.63 0.02 0.00 0.41 0.00 0.00 41.25 39.07 3msm s ASN 98 CO 0.06 -0.36 -0.02 -0.63 -1.51 0.00 0.00 177.10 174.65 3msm s ILE 99 N -1.20 0.32 -0.22 0.60 1.01 0.12 -4.65 121.20 117.17 3msm s ILE 99 Ca 0.48 0.01 -0.18 0.00 0.00 0.00 0.00 60.65 60.96 3msm s ILE 99 Cb -0.34 -0.39 -0.03 0.00 0.01 0.00 0.00 42.46 41.71 3msm s ILE 99 CO 0.44 0.18 0.50 0.00 0.00 0.00 0.00 174.94 176.07 3msm s ALA 100 N 1.01 3.56 -0.58 9.38 0.00 -0.24 -1.30 121.76 133.60 3msm s ALA 100 Ca -0.10 -0.49 -0.23 0.00 0.00 0.00 0.00 51.96 51.14 3msm s ALA 100 Cb -0.14 -2.82 0.05 0.00 0.00 0.00 0.00 23.12 20.22 3msm s ALA 100 CO -0.01 -0.53 0.89 0.00 0.00 0.00 0.00 175.76 176.11 3msm s ALA 101 N 1.84 3.19 -0.06 0.00 0.00 -0.09 -1.18 121.76 125.47 3msm s ALA 101 Ca 0.22 -1.51 -0.30 0.00 0.00 0.00 0.00 51.96 50.37 3msm s ALA 101 Cb -0.15 -3.70 -0.03 0.00 0.00 0.00 0.00 23.12 19.23 3msm s ALA 101 CO 0.09 -2.43 1.24 0.42 0.00 0.00 0.00 175.76 175.08 3msm s ILE 102 N 3.74 4.18 -0.02 0.00 1.01 0.32 -1.92 121.20 128.52 3msm s ILE 102 Ca 0.25 1.50 0.00 0.00 0.00 0.00 0.00 60.65 62.41 3msm s ILE 102 Cb -0.15 -3.97 -0.00 0.00 0.01 0.00 0.00 42.46 38.35 3msm s ILE 102 CO 0.15 -0.02 0.02 0.35 0.00 0.00 0.00 174.94 175.44 3msm n THR 103 N 4.72 0.00 -3.68 2.92 -2.24 0.03 -1.29 114.28 114.73 3msm n THR 103 Ca 0.12 -0.47 -0.14 0.00 -2.27 0.00 0.00 64.05 61.29 3msm n THR 103 Cb 0.46 0.98 -0.09 0.00 -2.10 0.00 0.00 70.33 69.58 3msm n THR 103 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3msm s GLU 104 N -1.07 0.66 0.12 -0.78 2.12 -1.11 -4.93 118.70 113.70 3msm s GLU 104 Ca 0.00 0.78 -0.16 0.00 0.36 0.00 0.00 54.97 55.95 3msm s GLU 104 Cb 0.00 0.32 0.03 0.00 0.26 0.00 0.00 34.13 34.75 3msm s GLU 104 CO 0.02 -0.08 0.40 -1.54 -0.54 0.00 0.00 175.26 173.51 3msm s SER 105 N 0.29 -0.23 -0.04 -1.70 1.04 -1.26 -0.86 113.70 110.95 3msm s SER 105 Ca -0.00 -0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.13 3msm s SER 105 Cb -0.04 0.47 0.03 0.00 0.10 0.00 0.00 66.02 66.57 3msm s SER 105 CO 0.01 -0.84 -0.00 -1.81 0.98 0.00 0.00 173.24 171.58 3msm s ASP 106 N -2.75 0.67 -1.49 7.02 1.01 -0.14 -4.89 116.67 116.10 3msm s ASP 106 Ca 0.02 -0.04 -0.07 0.00 0.71 0.00 0.00 52.55 53.17 3msm s ASP 106 Cb 0.02 -0.27 0.05 0.00 1.01 0.00 0.00 42.92 43.73 3msm s ASP 106 CO -0.11 -0.12 0.66 0.29 0.21 0.00 0.00 175.17 176.11 3msm n LYS 107 N 4.32 -3.99 -0.04 8.23 5.02 -1.26 -1.26 118.16 129.18 3msm n LYS 107 Ca -0.22 0.47 -0.09 0.00 -2.02 0.00 0.00 58.31 56.44 3msm n LYS 107 Cb 0.50 -4.96 -0.03 0.00 -0.02 0.00 0.00 35.03 30.52 3msm n LYS 107 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3msm n PHE 108 N -4.44 0.00 -1.97 2.13 7.35 -1.26 -4.72 117.46 114.55 3msm n PHE 108 Ca -0.15 0.00 -0.33 0.00 -0.76 0.00 0.00 57.45 56.22 3msm n PHE 108 Cb 0.61 -0.36 0.02 0.00 0.35 0.00 0.00 39.48 40.10 3msm n PHE 108 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 3msm s PHE 109 N -2.35 2.97 -0.23 -5.13 0.08 -1.26 -5.04 117.98 107.02 3msm s PHE 109 Ca -0.16 1.51 -0.05 0.00 0.12 0.00 0.00 56.93 58.34 3msm s PHE 109 Cb 0.04 -3.01 -0.02 0.00 -0.57 0.00 0.00 43.02 39.47 3msm s PHE 109 CO 0.22 -1.17 -0.00 0.42 -0.10 0.00 0.00 175.22 174.59 3msm s ILE 110 N -2.50 3.72 0.12 0.64 1.01 -1.26 -5.07 121.20 117.85 3msm s ILE 110 Ca 0.63 -0.37 -0.31 0.00 0.00 0.00 0.00 60.65 60.60 3msm s ILE 110 Cb -0.16 -2.71 -0.10 0.00 0.01 0.00 0.00 42.46 39.50 3msm s ILE 110 CO 0.39 0.39 1.72 0.21 0.00 0.00 0.00 174.94 177.65 3msm s ASN 111 N 1.52 6.50 0.00 3.58 2.47 -1.26 -1.88 114.94 125.87 3msm s ASN 111 Ca 0.06 2.65 0.00 0.00 0.42 0.00 0.00 52.86 55.99 3msm s ASN 111 Cb -0.15 -2.57 0.00 0.00 -1.45 0.00 0.00 41.25 37.08 3msm s ASN 111 CO -0.01 -0.93 0.00 0.61 -3.72 0.00 0.00 177.10 173.05 3msm n GLY 112 N 4.06 0.70 3.88 1.21 0.00 -1.26 -5.06 105.19 108.72 3msm n GLY 112 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 3msm n GLY 112 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3msm s SER 113 N -2.57 5.87 -0.29 1.61 1.04 -0.79 -5.02 113.70 113.56 3msm s SER 113 Ca 0.00 1.21 0.10 0.00 0.48 0.00 0.00 55.95 57.74 3msm s SER 113 Cb 0.00 -2.18 0.56 0.00 0.10 0.00 0.00 66.02 64.51 3msm s SER 113 CO 0.00 -1.05 1.56 -3.20 0.98 0.00 0.00 173.24 171.54 3msm n ASN 114 N -2.80 3.26 -4.62 7.02 5.15 -1.26 -4.84 115.26 117.18 3msm n ASN 114 Ca 0.06 -3.51 -0.23 0.00 -0.60 0.00 0.00 54.58 50.29 3msm n ASN 114 Cb 0.56 -0.66 -0.08 0.00 -0.53 0.00 0.00 39.78 39.07 3msm n ASN 114 CO 0.00 0.00 0.00 -1.66 1.40 0.00 0.00 177.26 177.00 3msm s TRP 115 N -3.13 2.60 0.00 1.20 1.48 -1.26 -4.64 118.94 115.18 3msm s TRP 115 Ca 0.47 -0.29 0.00 0.00 -1.06 0.00 0.00 56.10 55.22 3msm s TRP 115 Cb 0.41 -1.25 0.00 0.00 -1.16 0.00 0.00 33.47 31.47 3msm s TRP 115 CO 0.05 0.59 0.32 0.39 -4.06 0.00 0.00 176.95 174.24 3msm n GLU 116 N -0.88 0.15 -4.00 3.25 4.71 0.29 -4.83 120.64 119.33 3msm n GLU 116 Ca -0.05 -0.36 0.03 0.00 -0.01 0.00 0.00 57.16 56.76 3msm n GLU 116 Cb 0.60 -0.57 0.01 0.00 -1.01 0.00 0.00 31.44 30.47 3msm n GLU 116 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 3msm s GLY 117 N -0.07 -0.13 -0.03 0.62 0.00 -1.21 -0.60 107.32 105.90 3msm s GLY 117 Ca 0.00 0.03 0.01 0.00 0.00 0.00 0.00 44.72 44.76 3msm s GLY 117 CO 0.00 5.78 -0.04 -1.50 0.00 0.00 0.00 173.10 177.33 3msm s ILE 118 N -2.02 0.47 -0.40 0.90 2.07 0.12 -0.16 121.20 122.18 3msm s ILE 118 Ca 0.30 -0.14 -0.04 0.00 -1.41 0.00 0.00 60.65 59.35 3msm s ILE 118 Cb -0.01 -0.47 0.10 0.00 0.13 0.00 0.00 42.46 42.21 3msm s ILE 118 CO -0.01 0.18 0.19 -0.22 -1.91 0.00 0.00 174.94 173.18 3msm s LEU 119 N 0.56 5.07 -0.26 8.50 2.96 0.30 -2.19 118.68 133.63 3msm s LEU 119 Ca -0.07 -1.82 -0.29 0.00 -0.22 0.00 0.00 54.13 51.73 3msm s LEU 119 Cb -0.10 -1.85 0.01 0.00 0.50 0.00 0.00 46.19 44.75 3msm s LEU 119 CO -0.00 -0.51 1.05 -0.83 -1.32 0.00 0.00 176.35 174.74 3msm s GLY 120 N 1.85 1.66 0.00 7.98 0.00 -0.20 -0.99 107.32 117.62 3msm s GLY 120 Ca 0.05 0.11 0.22 0.00 0.00 0.00 0.00 44.72 45.10 3msm s GLY 120 CO -0.02 2.21 1.28 1.04 0.00 0.00 0.00 173.10 177.61 3msm n LEU 121 N 6.49 3.10 0.00 0.66 4.77 0.20 -4.22 117.00 128.00 3msm n LEU 121 Ca 0.12 -1.26 0.00 0.00 -0.03 0.00 0.00 56.01 54.84 3msm n LEU 121 Cb 0.46 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 3msm n LEU 121 CO 0.54 0.61 0.00 0.00 -1.33 0.00 0.00 177.39 177.21 3msm n ALA 122 N 1.32 0.00 -2.33 -1.18 0.00 0.40 -4.88 120.51 113.83 3msm n ALA 122 Ca 0.16 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.37 3msm n ALA 122 Cb 0.57 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.03 3msm n ALA 122 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3msm s TYR 123 N 0.35 3.19 0.35 0.00 2.02 0.05 -4.61 117.35 118.71 3msm s TYR 123 Ca 0.00 0.16 0.08 0.00 -0.37 0.00 0.00 57.07 56.94 3msm s TYR 123 Cb 0.00 -2.28 0.80 0.00 -0.40 0.00 0.00 41.96 40.07 3msm s TYR 123 CO 0.00 -0.33 1.87 0.00 -1.57 0.00 0.00 175.55 175.53 3msm h ALA 124 N 0.46 1.80 -0.02 3.71 0.00 -1.84 -2.90 119.26 120.48 3msm h ALA 124 Ca -0.46 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3msm h ALA 124 Cb 1.25 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 3msm h ALA 124 CO 0.56 -0.04 0.10 1.49 0.00 0.00 0.00 179.25 181.37 3msm h GLU 125 N 0.72 0.00 -0.16 0.00 4.57 -1.87 0.43 114.58 118.27 3msm h GLU 125 Ca 0.44 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.62 3msm h GLU 125 Cb 0.68 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.27 3msm h GLU 125 CO -0.20 0.00 0.00 0.44 -1.18 0.00 0.00 179.01 178.07 3msm n ILE 126 N -3.14 1.13 -1.81 2.32 -5.35 -1.10 -4.78 119.36 106.64 3msm n ILE 126 Ca -0.02 -1.13 -0.37 0.00 -0.27 0.00 0.00 62.75 60.95 3msm n ILE 126 Cb 0.17 0.41 0.05 0.00 -1.74 0.00 0.00 39.64 38.54 3msm n ILE 126 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3msm s ALA 127 N -1.22 2.58 -0.03 -1.28 0.00 0.15 -4.55 121.76 117.41 3msm s ALA 127 Ca 0.14 1.23 0.05 0.00 0.00 0.00 0.00 51.96 53.38 3msm s ALA 127 Cb 0.09 -3.54 -0.03 0.00 0.00 0.00 0.00 23.12 19.64 3msm s ALA 127 CO 0.07 -1.44 -0.18 1.03 0.00 0.00 0.00 175.76 175.25 3msm s ARG 128 N -3.18 2.34 0.08 0.00 0.52 -1.26 -2.95 118.95 114.50 3msm s ARG 128 Ca 0.78 -0.79 0.25 0.00 -0.52 0.00 0.00 55.73 55.44 3msm s ARG 128 Cb -0.37 -2.27 0.97 0.00 0.52 0.00 0.00 34.95 33.80 3msm s ARG 128 CO 0.42 0.60 1.77 -0.35 0.02 0.00 0.00 175.30 177.75 3msm n PRO 129 N 2.23 0.09 -3.82 3.54 -0.04 -1.26 -4.93 135.00 130.82 3msm n PRO 129 Ca -0.17 0.16 -0.05 0.00 -0.04 0.00 0.00 63.50 63.40 3msm n PRO 129 Cb 0.52 -1.62 0.00 0.00 -0.04 0.00 0.00 33.50 32.36 3msm n PRO 129 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 3msm s ASP 130 N -3.51 -0.11 0.00 3.54 -4.77 -1.15 -5.05 116.67 105.61 3msm s ASP 130 Ca 0.10 -0.65 0.17 0.00 -3.30 0.00 0.00 52.55 48.87 3msm s ASP 130 Cb 0.14 0.61 1.00 0.00 -1.09 0.00 0.00 42.92 43.57 3msm s ASP 130 CO 0.47 -1.16 1.47 -0.90 0.70 0.00 0.00 175.17 175.75 3msm n ASP 131 N -0.84 0.00 0.03 2.11 5.68 -1.26 -2.09 116.55 120.19 3msm n ASP 131 Ca -0.05 -0.93 0.13 0.00 -0.50 0.00 0.00 54.79 53.43 3msm n ASP 131 Cb 0.60 0.00 0.41 0.00 -1.14 0.00 0.00 41.12 40.99 3msm n ASP 131 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3msm n SER 132 N -0.86 0.40 -4.47 -1.12 3.41 -1.26 -4.51 113.62 105.21 3msm n SER 132 Ca 0.13 0.27 -0.43 0.00 -0.26 0.00 0.00 58.87 58.57 3msm n SER 132 Cb 0.06 -0.26 -0.03 0.00 -0.26 0.00 0.00 64.21 63.71 3msm n SER 132 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3msm s LEU 133 N -3.50 4.55 -0.29 1.04 2.96 -0.89 -4.98 118.68 117.56 3msm s LEU 133 Ca 0.11 -1.56 -0.40 0.00 -0.22 0.00 0.00 54.13 52.06 3msm s LEU 133 Cb 0.16 -2.44 -0.16 0.00 0.50 0.00 0.00 46.19 44.26 3msm s LEU 133 CO 0.62 -1.28 1.76 1.21 -1.32 0.00 0.00 176.35 177.34 3msm n GLU 134 N 7.36 1.11 -1.08 1.98 2.13 -1.26 -4.87 120.64 126.01 3msm n GLU 134 Ca 0.16 0.40 -0.31 0.00 0.66 0.00 0.00 57.16 58.07 3msm n GLU 134 Cb 0.48 -2.09 0.12 0.00 0.27 0.00 0.00 31.44 30.22 3msm n GLU 134 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 3msm s PRO 135 N 3.67 1.82 0.26 5.31 0.02 -1.26 -4.60 135.00 140.22 3msm s PRO 135 Ca 0.99 1.34 -0.01 0.00 0.02 0.00 0.00 61.00 63.35 3msm s PRO 135 Cb -1.08 -1.83 0.55 0.00 0.02 0.00 0.00 34.50 32.15 3msm s PRO 135 CO 0.66 -2.00 1.75 0.35 -0.33 0.00 0.00 177.00 177.43 3msm h PHE 136 N -1.32 0.73 0.00 6.54 3.57 -1.78 -2.48 116.94 122.19 3msm h PHE 136 Ca -0.44 0.04 -0.14 0.00 3.53 0.00 0.00 57.97 60.96 3msm h PHE 136 Cb 1.25 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.77 3msm h PHE 136 CO 0.55 0.15 -0.66 0.35 -2.23 0.00 0.00 178.31 176.47 3msm h PHE 137 N 0.58 0.00 -0.27 0.41 3.57 -1.90 -2.26 116.94 117.07 3msm h PHE 137 Ca 0.47 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.95 3msm h PHE 137 Cb 0.69 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.42 3msm h PHE 137 CO -0.10 0.66 0.08 -0.44 -2.23 0.00 0.00 178.31 176.27 3msm h ASP 138 N 0.00 0.39 -0.66 0.41 3.45 -1.82 -2.46 116.42 115.74 3msm h ASP 138 Ca -0.01 -0.21 0.09 0.00 0.43 0.00 0.00 57.03 57.33 3msm h ASP 138 Cb 1.23 -0.10 -0.07 0.00 -0.56 0.00 0.00 39.33 39.82 3msm h ASP 138 CO 0.09 0.50 0.30 0.28 -1.57 0.00 0.00 179.24 178.83 3msm h SER 139 N 0.27 0.36 -0.16 6.45 0.02 -1.27 -0.47 113.55 118.74 3msm h SER 139 Ca 0.09 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 3msm h SER 139 Cb 0.25 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 3msm h SER 139 CO -0.00 0.21 0.10 0.25 -1.14 0.00 0.00 176.83 176.25 3msm h LEU 140 N 0.51 0.19 -0.46 5.07 5.85 -1.28 -0.04 115.31 125.16 3msm h LEU 140 Ca 0.32 -0.02 -0.14 0.00 0.84 0.00 0.00 57.88 58.88 3msm h LEU 140 Cb 0.36 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 3msm h LEU 140 CO -0.28 0.16 -0.28 0.58 -0.34 0.00 0.00 178.44 178.28 3msm h VAL 141 N 0.20 1.27 -0.52 1.05 2.07 -1.05 -2.19 116.25 117.08 3msm h VAL 141 Ca 0.06 -1.45 -0.09 0.00 0.82 0.00 0.00 66.70 66.04 3msm h VAL 141 Cb -0.00 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 3msm h VAL 141 CO -0.01 0.50 -0.03 0.50 0.02 0.00 0.00 177.57 178.54 3msm h LYS 142 N 0.83 0.95 -0.00 1.57 3.64 -0.82 -3.20 116.57 119.53 3msm h LYS 142 Ca 0.09 -0.32 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 3msm h LYS 142 Cb 0.87 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 3msm h LYS 142 CO 0.08 0.98 -0.34 1.04 -2.27 0.00 0.00 179.45 178.94 3msm n GLN 143 N -4.26 0.53 -2.43 1.90 6.02 -0.05 -4.94 117.38 114.15 3msm n GLN 143 Ca 0.01 -0.31 -0.04 0.00 -0.01 0.00 0.00 57.00 56.66 3msm n GLN 143 Cb 0.35 -1.49 -0.01 0.00 1.02 0.00 0.00 30.24 30.10 3msm n GLN 143 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3msm n THR 144 N -0.97 0.00 -0.77 5.09 -2.24 -0.83 -5.05 114.28 109.51 3msm n THR 144 Ca 0.10 -0.45 0.08 0.00 -2.27 0.00 0.00 64.05 61.51 3msm n THR 144 Cb 0.34 0.20 0.38 0.00 -2.10 0.00 0.00 70.33 69.15 3msm n THR 144 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3msm n HIS 145 N -0.14 1.74 -2.16 4.78 8.25 -1.26 -4.80 115.22 121.63 3msm n HIS 145 Ca 0.00 -0.68 -0.42 0.00 -0.26 0.00 0.00 57.72 56.37 3msm n HIS 145 Cb 0.11 -0.37 -0.03 0.00 1.12 0.00 0.00 29.99 30.82 3msm n HIS 145 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3msm s VAL 146 N -2.32 3.16 0.67 1.59 1.01 -1.26 -4.99 120.40 118.26 3msm s VAL 146 Ca 0.52 0.90 -0.15 0.00 0.00 0.00 0.00 61.98 63.25 3msm s VAL 146 Cb 0.37 -3.58 0.01 0.00 0.00 0.00 0.00 36.38 33.18 3msm s VAL 146 CO 0.20 0.11 1.14 -2.84 0.00 0.00 0.00 175.10 173.70 3msm s PRO 147 N 0.41 2.63 -1.41 2.72 0.02 -1.26 -4.71 135.00 133.40 3msm s PRO 147 Ca 0.61 1.52 -0.12 0.00 0.02 0.00 0.00 61.00 63.03 3msm s PRO 147 Cb -0.38 -1.92 0.08 0.00 0.02 0.00 0.00 34.50 32.30 3msm s PRO 147 CO 0.35 -1.40 2.19 -1.71 -0.33 0.00 0.00 177.00 176.09 3msm n ASN 148 N -2.44 4.99 -3.54 2.53 5.15 -1.26 -4.36 115.26 116.32 3msm n ASN 148 Ca 0.11 -2.93 -0.10 0.00 -0.60 0.00 0.00 54.58 51.07 3msm n ASN 148 Cb 0.51 -1.57 -0.04 0.00 -0.53 0.00 0.00 39.78 38.16 3msm n ASN 148 CO 0.00 0.00 0.00 -1.48 1.40 0.00 0.00 177.26 177.18 3msm s LEU 149 N 0.94 -0.38 0.18 1.20 0.05 -1.26 -0.72 118.68 118.70 3msm s LEU 149 Ca 0.47 0.24 0.01 0.00 0.05 0.00 0.00 54.13 54.90 3msm s LEU 149 Cb 0.13 1.95 -0.05 0.00 -2.05 0.00 0.00 46.19 46.18 3msm s LEU 149 CO -0.05 -0.47 0.04 0.72 -0.55 0.00 0.00 176.35 176.04 3msm s PHE 150 N -1.97 1.19 0.03 3.48 -0.71 -1.16 -0.40 117.98 118.44 3msm s PHE 150 Ca 0.01 -1.13 0.02 0.00 -1.04 0.00 0.00 56.93 54.78 3msm s PHE 150 Cb -0.01 -0.67 -0.02 0.00 -1.21 0.00 0.00 43.02 41.11 3msm s PHE 150 CO -0.02 -0.34 -0.06 -1.54 -1.34 0.00 0.00 175.22 171.91 3msm s SER 151 N -3.17 0.69 -0.19 1.98 1.04 -0.14 -0.86 113.70 113.06 3msm s SER 151 Ca 0.28 -0.43 -0.02 0.00 0.48 0.00 0.00 55.95 56.26 3msm s SER 151 Cb 0.07 0.02 -0.01 0.00 0.10 0.00 0.00 66.02 66.20 3msm s SER 151 CO 0.06 -0.15 -0.10 -0.76 0.98 0.00 0.00 173.24 173.27 3msm s LEU 152 N -1.21 2.72 -0.44 2.42 1.43 0.16 -1.26 118.68 122.50 3msm s LEU 152 Ca -0.08 -0.41 -0.07 0.00 -1.03 0.00 0.00 54.13 52.54 3msm s LEU 152 Cb -0.08 -1.66 0.11 0.00 0.03 0.00 0.00 46.19 44.59 3msm s LEU 152 CO 0.00 0.04 0.28 -1.58 0.23 0.00 0.00 176.35 175.32 3msm s GLN 153 N 1.10 2.37 -0.25 1.70 0.74 0.28 -1.39 119.66 124.20 3msm s GLN 153 Ca 0.01 -1.70 -0.15 0.00 0.05 0.00 0.00 55.36 53.57 3msm s GLN 153 Cb -0.15 -3.78 -0.04 0.00 1.10 0.00 0.00 33.01 30.15 3msm s GLN 153 CO -0.02 -1.09 0.37 -0.51 -0.55 0.00 0.00 175.29 173.49 3msm s LEU 154 N 1.31 4.07 0.00 3.68 1.43 -1.26 -0.41 118.68 127.50 3msm s LEU 154 Ca 0.05 0.34 0.00 0.00 -1.03 0.00 0.00 54.13 53.49 3msm s LEU 154 Cb -0.24 -2.44 0.00 0.00 0.03 0.00 0.00 46.19 43.54 3msm s LEU 154 CO -0.01 -0.15 0.00 0.00 0.23 0.00 0.00 176.35 176.41 3msm n GLY 156 N 1.95 -2.89 0.00 0.00 0.00 -1.10 -4.90 105.19 98.25 3msm n GLY 156 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3msm n GLY 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3msm n ALA 157 N 0.04 -0.23 0.00 4.61 0.00 -1.26 -4.91 120.51 118.76 3msm n ALA 157 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3msm n ALA 157 Cb 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 19.45 19.22 3msm n ALA 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3msm n ALA 168 N 0.25 0.00 -2.69 0.00 0.00 -1.26 -5.04 120.51 111.77 3msm n ALA 168 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.07 3msm n ALA 168 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 3msm n ALA 168 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3msm s SER 169 N -3.02 6.55 0.27 0.00 0.15 -1.26 0.15 113.70 116.54 3msm s SER 169 Ca 0.00 0.65 0.07 0.00 0.70 0.00 0.00 55.95 57.37 3msm s SER 169 Cb 0.00 -2.19 -0.06 0.00 -1.71 0.00 0.00 66.02 62.07 3msm s SER 169 CO 0.00 0.22 -0.08 0.68 1.20 0.00 0.00 173.24 175.26 3msm s VAL 170 N -0.27 1.70 0.27 4.45 -7.23 0.30 -4.81 120.40 114.80 3msm s VAL 170 Ca 0.19 -2.15 -0.11 0.00 -1.81 0.00 0.00 61.98 58.09 3msm s VAL 170 Cb -0.14 -2.37 -0.00 0.00 0.56 0.00 0.00 36.38 34.43 3msm s VAL 170 CO 0.07 -0.36 0.48 -0.83 -0.31 0.00 0.00 175.10 174.16 3msm s GLY 171 N -3.43 0.69 0.00 2.32 0.00 -1.26 -1.98 107.32 103.66 3msm s GLY 171 Ca 0.28 -0.98 0.00 0.00 0.00 0.00 0.00 44.72 44.02 3msm s GLY 171 CO 0.11 -0.68 0.00 0.61 0.00 0.00 0.00 173.10 173.14 3msm n GLY 172 N -0.41 -1.17 2.85 0.20 0.00 -1.04 -0.78 105.19 104.84 3msm n GLY 172 Ca -0.01 -0.83 -0.14 0.00 0.00 0.00 0.00 46.02 45.03 3msm n GLY 172 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3msm s SER 173 N -4.00 -0.02 -0.36 1.61 0.01 0.45 -2.26 113.70 109.13 3msm s SER 173 Ca 0.00 0.15 -0.09 0.00 1.31 0.00 0.00 55.95 57.32 3msm s SER 173 Cb 0.00 0.06 0.03 0.00 0.21 0.00 0.00 66.02 66.32 3msm s SER 173 CO 0.00 -0.12 0.17 -0.32 0.41 0.00 0.00 173.24 173.38 3msm s MET 174 N 0.96 2.74 -0.38 12.44 1.75 -1.26 -0.56 119.30 134.98 3msm s MET 174 Ca -0.08 -1.12 -0.20 0.00 -1.25 0.00 0.00 55.69 53.04 3msm s MET 174 Cb -0.11 -3.63 0.01 0.00 2.84 0.00 0.00 34.83 33.95 3msm s MET 174 CO -0.04 -0.69 0.60 0.42 -0.65 0.00 0.00 175.02 174.66 3msm s ILE 175 N 1.49 4.91 -0.32 10.11 -1.09 -0.39 -4.85 121.20 131.07 3msm s ILE 175 Ca 0.01 0.32 -0.20 0.00 -2.23 0.00 0.00 60.65 58.54 3msm s ILE 175 Cb -0.19 -4.09 -0.01 0.00 -1.58 0.00 0.00 42.46 36.59 3msm s ILE 175 CO 0.05 -0.39 0.62 -0.63 -1.23 0.00 0.00 174.94 173.37 3msm s ILE 176 N 2.64 4.93 0.00 2.92 -1.09 -1.26 -0.97 121.20 128.37 3msm s ILE 176 Ca 0.22 0.77 0.00 0.00 -2.23 0.00 0.00 60.65 59.40 3msm s ILE 176 Cb -0.15 -4.01 0.00 0.00 -1.58 0.00 0.00 42.46 36.72 3msm s ILE 176 CO 0.16 -0.18 0.00 0.61 -1.23 0.00 0.00 174.94 174.29 3msm n GLY 177 N 4.50 0.64 0.00 6.18 0.00 0.47 -4.80 105.19 112.18 3msm n GLY 177 Ca -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.75 3msm n GLY 177 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3msm n GLY 178 N -2.65 1.05 3.10 -0.02 0.00 -1.25 -4.48 105.19 100.93 3msm n GLY 178 Ca 0.00 -0.84 -0.24 0.00 0.00 0.00 0.00 46.02 44.94 3msm n GLY 178 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3msm s ILE 179 N -2.35 1.23 -0.32 -0.61 1.01 -1.26 -4.11 121.20 114.79 3msm s ILE 179 Ca 0.00 -0.61 -0.08 0.00 0.00 0.00 0.00 60.65 59.96 3msm s ILE 179 Cb 0.00 -1.06 0.01 0.00 0.01 0.00 0.00 42.46 41.42 3msm s ILE 179 CO 0.00 0.36 0.12 -0.62 0.00 0.00 0.00 174.94 174.80 3msm s ASP 180 N 0.04 5.32 0.48 3.58 -1.08 -1.26 -4.94 116.67 118.82 3msm s ASP 180 Ca -0.03 -0.78 0.32 0.00 -0.52 0.00 0.00 52.55 51.54 3msm s ASP 180 Cb -0.10 -1.92 1.46 0.00 -1.46 0.00 0.00 42.92 40.90 3msm s ASP 180 CO 0.01 -0.24 1.97 0.45 0.52 0.00 0.00 175.17 177.88 3msm h HIS 181 N 8.28 0.00 0.00 -5.34 3.86 -2.00 -1.36 115.15 118.59 3msm h HIS 181 Ca -0.29 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.92 3msm h HIS 181 Cb 1.12 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.59 3msm h HIS 181 CO 0.61 0.00 0.00 -1.13 0.86 0.00 0.00 177.93 178.27 3msm n SER 182 N -2.81 0.00 0.03 2.45 3.41 -1.26 -3.47 113.62 111.97 3msm n SER 182 Ca 0.00 -0.22 0.12 0.00 -0.26 0.00 0.00 58.87 58.52 3msm n SER 182 Cb 0.22 -0.25 0.30 0.00 -0.26 0.00 0.00 64.21 64.22 3msm n SER 182 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3msm n LEU 183 N -1.25 0.51 -4.19 1.04 4.77 -0.51 -4.77 117.00 112.59 3msm n LEU 183 Ca 0.15 0.22 -0.12 0.00 -0.03 0.00 0.00 56.01 56.23 3msm n LEU 183 Cb 0.21 -0.28 -0.10 0.00 -2.33 0.00 0.00 43.42 40.93 3msm n LEU 183 CO 0.21 0.01 -0.23 -0.72 -1.33 0.00 0.00 177.39 175.34 3msm s TYR 184 N -3.07 1.12 0.30 -1.77 -0.85 -1.23 -0.25 117.35 111.61 3msm s TYR 184 Ca 0.10 -1.35 0.04 0.00 -0.52 0.00 0.00 57.07 55.33 3msm s TYR 184 Cb 0.16 -0.53 -0.06 0.00 0.38 0.00 0.00 41.96 41.91 3msm s TYR 184 CO 0.67 -0.65 0.05 0.95 -1.52 0.00 0.00 175.55 175.05 3msm s THR 185 N -4.15 1.10 0.00 -3.49 -4.23 -0.81 -4.76 115.64 99.30 3msm s THR 185 Ca 0.38 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.88 3msm s THR 185 Cb 0.07 -2.71 0.00 0.00 1.34 0.00 0.00 72.50 71.20 3msm s THR 185 CO 0.11 -0.05 0.00 0.61 -0.54 0.00 0.00 174.62 174.76 3msm n GLY 186 N -0.62 1.23 3.47 3.99 0.00 -1.26 -3.97 105.19 108.03 3msm n GLY 186 Ca -0.02 -0.56 -0.28 0.00 0.00 0.00 0.00 46.02 45.16 3msm n GLY 186 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3msm s SER 187 N -4.00 3.75 0.19 1.61 0.15 -1.26 -4.99 113.70 109.14 3msm s SER 187 Ca 0.00 -0.65 -0.30 0.00 0.70 0.00 0.00 55.95 55.70 3msm s SER 187 Cb 0.00 -0.46 -0.08 0.00 -1.71 0.00 0.00 66.02 63.78 3msm s SER 187 CO 0.00 0.16 1.10 -0.76 1.20 0.00 0.00 173.24 174.94 3msm s LEU 188 N -2.32 4.50 -0.06 3.45 1.43 -1.26 -4.54 118.68 119.88 3msm s LEU 188 Ca 0.19 2.11 0.06 0.00 -1.03 0.00 0.00 54.13 55.45 3msm s LEU 188 Cb -0.10 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.51 3msm s LEU 188 CO 0.10 -0.21 -0.23 0.26 0.23 0.00 0.00 176.35 176.49 3msm s TRP 189 N -0.32 2.30 -0.04 0.29 0.52 0.13 -4.90 118.94 116.92 3msm s TRP 189 Ca 0.49 -0.70 0.02 0.00 0.02 0.00 0.00 56.10 55.92 3msm s TRP 189 Cb -0.30 -1.52 -0.03 0.00 -1.15 0.00 0.00 33.47 30.47 3msm s TRP 189 CO 0.35 -0.22 -0.07 0.71 0.02 0.00 0.00 176.95 177.74 3msm s TYR 190 N -0.08 2.92 0.06 -1.98 2.02 -1.26 0.14 117.35 119.16 3msm s TYR 190 Ca -0.05 -0.00 0.10 0.00 -0.37 0.00 0.00 57.07 56.75 3msm s TYR 190 Cb -0.14 -1.67 -0.03 0.00 -0.40 0.00 0.00 41.96 39.72 3msm s TYR 190 CO 0.04 0.34 -0.26 -0.08 -1.57 0.00 0.00 175.55 174.02 3msm s THR 191 N -0.87 2.16 0.39 -0.71 -1.32 0.86 -3.78 115.64 112.35 3msm s THR 191 Ca 0.14 -1.44 -0.26 0.00 -1.21 0.00 0.00 61.69 58.93 3msm s THR 191 Cb -0.11 -1.85 -0.09 0.00 -1.51 0.00 0.00 72.50 68.94 3msm s THR 191 CO 0.03 0.33 1.16 -2.84 -2.21 0.00 0.00 174.62 171.10 3msm s PRO 192 N -1.34 4.11 -0.42 7.08 0.02 -1.26 -0.85 135.00 142.34 3msm s PRO 192 Ca 0.12 1.83 -0.29 0.00 0.02 0.00 0.00 61.00 62.69 3msm s PRO 192 Cb -0.10 -2.72 0.02 0.00 0.02 0.00 0.00 34.50 31.73 3msm s PRO 192 CO 0.03 -0.27 1.16 0.42 -0.33 0.00 0.00 177.00 178.00 3msm s ILE 193 N -1.40 4.26 0.07 2.83 1.01 -0.24 -4.54 121.20 123.18 3msm s ILE 193 Ca 0.56 1.35 -0.32 0.00 0.00 0.00 0.00 60.65 62.24 3msm s ILE 193 Cb -0.31 -4.49 -0.19 0.00 0.01 0.00 0.00 42.46 37.49 3msm s ILE 193 CO 0.39 -0.81 1.61 -0.09 0.00 0.00 0.00 174.94 176.04 3msm h ARG 194 N 9.04 -0.81 -4.60 2.79 2.43 -1.49 -3.45 114.38 118.29 3msm h ARG 194 Ca -0.23 0.06 -0.25 0.00 -0.81 0.00 0.00 59.98 58.74 3msm h ARG 194 Cb 1.07 0.18 -0.19 0.00 -0.42 0.00 0.00 29.97 30.61 3msm h ARG 194 CO 1.09 -0.53 -0.72 0.50 -1.51 0.00 0.00 179.97 178.80 3msm s ARG 195 N -5.99 0.65 -1.12 0.20 3.52 -1.26 -5.08 118.95 109.88 3msm s ARG 195 Ca -0.17 -1.00 -0.13 0.00 -0.13 0.00 0.00 55.73 54.30 3msm s ARG 195 Cb 0.03 -0.25 0.20 0.00 -1.56 0.00 0.00 34.95 33.38 3msm s ARG 195 CO 0.62 0.02 1.25 -1.21 -0.81 0.00 0.00 175.30 175.17 3msm s GLU 196 N -2.53 4.03 0.00 5.12 2.02 -1.26 -4.18 118.70 121.90 3msm s GLU 196 Ca -0.01 -2.67 0.00 0.00 0.02 0.00 0.00 54.97 52.31 3msm s GLU 196 Cb -0.04 -4.84 0.00 0.00 0.10 0.00 0.00 34.13 29.35 3msm s GLU 196 CO -0.02 -1.57 0.00 -2.67 0.02 0.00 0.00 175.26 171.02 3msm n TRP 197 N 4.73 0.00 -1.95 1.61 4.27 -1.26 -4.49 117.44 120.35 3msm n TRP 197 Ca 0.29 0.00 -0.29 0.00 -3.89 0.00 0.00 57.50 53.61 3msm n TRP 197 Cb 0.43 0.00 0.14 0.00 -1.36 0.00 0.00 31.31 30.52 3msm n TRP 197 CO 0.00 0.00 0.00 0.71 -2.29 0.00 0.00 177.69 176.11 3msm s TYR 198 N -0.01 2.16 -1.24 -2.67 2.02 -1.26 -0.77 117.35 115.58 3msm s TYR 198 Ca 0.00 0.47 -0.18 0.00 -0.37 0.00 0.00 57.07 56.99 3msm s TYR 198 Cb 0.00 -3.83 0.09 0.00 -0.40 0.00 0.00 41.96 37.82 3msm s TYR 198 CO 0.00 -2.25 1.63 0.71 -1.57 0.00 0.00 175.55 174.06 3msm s TYR 199 N -3.73 2.90 0.11 2.71 2.02 -1.26 -4.84 117.35 115.26 3msm s TYR 199 Ca 0.69 -1.62 -0.23 0.00 -0.37 0.00 0.00 57.07 55.53 3msm s TYR 199 Cb -0.07 -4.65 -0.07 0.00 -0.40 0.00 0.00 41.96 36.77 3msm s TYR 199 CO 0.51 -1.74 0.71 -2.00 -1.57 0.00 0.00 175.55 171.46 3msm s GLU 200 N 3.76 4.45 0.18 -0.62 2.12 -1.26 -1.35 118.70 125.98 3msm s GLU 200 Ca 0.50 1.01 -0.04 0.00 0.36 0.00 0.00 54.97 56.81 3msm s GLU 200 Cb 0.02 -3.28 -0.03 0.00 0.26 0.00 0.00 34.13 31.10 3msm s GLU 200 CO 0.04 0.53 0.17 0.14 -0.54 0.00 0.00 175.26 175.60 3msm s VAL 201 N -0.92 0.04 -0.18 3.70 -7.23 -0.15 -1.24 120.40 114.43 3msm s VAL 201 Ca 0.34 -1.81 0.01 0.00 -1.81 0.00 0.00 61.98 58.71 3msm s VAL 201 Cb -0.22 -2.21 0.02 0.00 0.56 0.00 0.00 36.38 34.53 3msm s VAL 201 CO 0.23 -0.20 -0.19 -0.63 -0.31 0.00 0.00 175.10 174.00 3msm s ILE 202 N -4.08 2.08 -0.00 -0.62 1.01 -1.26 -3.98 121.20 114.35 3msm s ILE 202 Ca 0.29 -0.96 -0.26 0.00 0.00 0.00 0.00 60.65 59.72 3msm s ILE 202 Cb 0.06 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.60 3msm s ILE 202 CO 0.06 0.52 0.81 -0.63 0.00 0.00 0.00 174.94 175.70 3msm s ILE 203 N 1.29 4.87 -0.43 2.92 1.01 -1.26 -1.87 121.20 127.72 3msm s ILE 203 Ca 0.05 1.69 0.05 0.00 0.00 0.00 0.00 60.65 62.43 3msm s ILE 203 Cb -0.13 -4.15 0.00 0.00 0.01 0.00 0.00 42.46 38.19 3msm s ILE 203 CO -0.13 0.27 0.45 1.33 0.00 0.00 0.00 174.94 176.87 3msm n VAL 204 N 3.44 0.00 -3.63 2.92 0.24 0.30 -4.72 118.33 116.89 3msm n VAL 204 Ca 0.00 -0.46 -0.06 0.00 -2.04 0.00 0.00 64.34 61.79 3msm n VAL 204 Cb 0.51 1.06 -0.06 0.00 -1.47 0.00 0.00 33.84 33.88 3msm n VAL 204 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3msm s ARG 205 N -0.83 0.30 -0.04 7.34 3.52 -1.23 -4.85 118.95 123.16 3msm s ARG 205 Ca 0.04 0.21 0.01 0.00 -0.13 0.00 0.00 55.73 55.86 3msm s ARG 205 Cb 0.04 0.14 0.02 0.00 -1.56 0.00 0.00 34.95 33.59 3msm s ARG 205 CO 0.11 -0.06 -0.03 0.08 -0.81 0.00 0.00 175.30 174.58 3msm s VAL 206 N -0.40 0.44 -0.04 7.11 1.01 -1.26 -0.72 120.40 126.54 3msm s VAL 206 Ca 0.05 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.01 3msm s VAL 206 Cb -0.03 -0.49 -0.00 0.00 0.00 0.00 0.00 36.38 35.85 3msm s VAL 206 CO -0.08 0.21 -0.16 -1.61 0.00 0.00 0.00 175.10 173.46 3msm s GLU 207 N 1.01 1.63 -0.24 2.72 2.02 -0.39 -2.17 118.70 123.29 3msm s GLU 207 Ca -0.10 -0.58 -0.03 0.00 0.02 0.00 0.00 54.97 54.28 3msm s GLU 207 Cb -0.14 -1.45 0.01 0.00 0.10 0.00 0.00 34.13 32.65 3msm s GLU 207 CO -0.01 0.25 -0.05 0.42 0.02 0.00 0.00 175.26 175.90 3msm s ILE 208 N -0.03 3.12 0.00 -1.63 1.09 -1.04 -0.62 121.20 122.10 3msm s ILE 208 Ca -0.02 -0.81 0.00 0.00 -1.10 0.00 0.00 60.65 58.73 3msm s ILE 208 Cb -0.10 -2.52 0.00 0.00 -1.06 0.00 0.00 42.46 38.78 3msm s ILE 208 CO 0.01 0.28 0.00 0.59 -0.10 0.00 0.00 174.94 175.72 3msm n ASN 209 N 4.73 0.00 0.00 3.58 3.02 -0.64 -2.05 115.26 123.90 3msm n ASN 209 Ca -0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.38 3msm n ASN 209 Cb 0.49 -0.24 0.00 0.00 -0.61 0.00 0.00 39.78 39.42 3msm n ASN 209 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3msm n GLY 210 N -0.63 2.36 3.57 7.41 0.00 -1.26 -4.96 105.19 111.67 3msm n GLY 210 Ca 0.00 -0.26 -0.40 0.00 0.00 0.00 0.00 46.02 45.36 3msm n GLY 210 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3msm s GLN 211 N 0.00 2.76 0.76 1.61 -1.52 -0.87 -4.88 119.66 117.53 3msm s GLN 211 Ca 0.00 1.01 -0.12 0.00 -1.95 0.00 0.00 55.36 54.31 3msm s GLN 211 Cb 0.00 -4.36 0.19 0.00 -0.22 0.00 0.00 33.01 28.61 3msm s GLN 211 CO 0.00 -2.55 0.42 -3.47 -0.25 0.00 0.00 175.29 169.44 3msm n ASP 212 N 12.51 -2.92 0.00 5.90 2.03 -1.26 -2.49 116.55 130.32 3msm n ASP 212 Ca 0.24 -0.42 0.00 0.00 0.52 0.00 0.00 54.79 55.13 3msm n ASP 212 Cb 0.51 -0.53 0.00 0.00 -0.72 0.00 0.00 41.12 40.38 3msm n ASP 212 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3msm n LEU 213 N 0.00 0.00 -2.52 -2.67 4.77 -0.92 -4.73 117.00 110.93 3msm n LEU 213 Ca 0.07 -0.37 -0.19 0.00 -0.03 0.00 0.00 56.01 55.48 3msm n LEU 213 Cb 0.29 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.40 3msm n LEU 213 CO 0.19 0.00 -0.06 0.29 -1.33 0.00 0.00 177.39 176.48 3msm n LYS 214 N -0.82 -3.56 -3.99 3.23 5.02 -1.26 -4.98 118.16 111.80 3msm n LYS 214 Ca 0.00 0.83 -0.30 0.00 -2.02 0.00 0.00 58.31 56.82 3msm n LYS 214 Cb 0.00 -5.43 -0.05 0.00 -0.02 0.00 0.00 35.03 29.53 3msm n LYS 214 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3msm s MET 215 N -5.38 3.14 -0.26 1.97 -1.94 -1.26 -5.03 119.30 110.54 3msm s MET 215 Ca 0.19 -0.60 -0.35 0.00 -1.71 0.00 0.00 55.69 53.22 3msm s MET 215 Cb -0.09 -2.86 -0.12 0.00 2.01 0.00 0.00 34.83 33.77 3msm s MET 215 CO 0.24 0.57 2.03 -3.47 -0.01 0.00 0.00 175.02 174.39 3msm n ASP 216 N 0.27 2.60 0.05 3.03 -0.08 -1.26 -4.76 116.55 116.39 3msm n ASP 216 Ca -0.07 0.67 0.21 0.00 -1.51 0.00 0.00 54.79 54.09 3msm n ASP 216 Cb 0.52 -1.29 0.73 0.00 2.34 0.00 0.00 41.12 43.42 3msm n ASP 216 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3msm h LYS 218 N 0.00 0.08 -0.97 0.00 3.64 -1.79 0.11 116.57 117.64 3msm h LYS 218 Ca 0.23 -0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.72 3msm h LYS 218 Cb 1.19 -0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.92 3msm h LYS 218 CO -0.00 0.05 0.62 0.93 -2.27 0.00 0.00 179.45 178.78 3msm h GLU 219 N 0.08 0.94 -0.01 1.90 4.39 -1.13 -1.89 114.58 118.86 3msm h GLU 219 Ca 0.07 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.71 3msm h GLU 219 Cb 0.17 -0.21 -0.00 0.00 -0.10 0.00 0.00 28.75 28.60 3msm h GLU 219 CO -0.01 0.62 0.02 1.88 -1.16 0.00 0.00 179.01 180.36 3msm h TYR 220 N 0.97 0.00 -0.62 4.33 0.99 -0.92 -3.03 116.97 118.69 3msm h TYR 220 Ca 0.47 0.00 -0.44 0.00 2.00 0.00 0.00 58.73 60.76 3msm h TYR 220 Cb 0.46 0.00 -0.40 0.00 1.00 0.00 0.00 36.73 37.79 3msm h TYR 220 CO -0.00 0.00 -0.88 0.09 -0.00 0.00 0.00 178.16 177.36 3msm n ASN 221 N -3.47 3.87 -4.29 3.88 3.02 -0.72 -4.47 115.26 113.08 3msm n ASN 221 Ca -0.03 -3.30 -0.38 0.00 -0.03 0.00 0.00 54.58 50.84 3msm n ASN 221 Cb 0.10 -0.38 -0.12 0.00 -0.61 0.00 0.00 39.78 38.76 3msm n ASN 221 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3msm s TYR 222 N -3.57 3.26 -1.46 3.10 5.04 -1.15 -1.23 117.35 121.34 3msm s TYR 222 Ca 0.44 -1.36 0.20 0.00 -2.44 0.00 0.00 57.07 53.91 3msm s TYR 222 Cb 0.39 -2.34 0.66 0.00 0.35 0.00 0.00 41.96 41.02 3msm s TYR 222 CO 0.01 -0.72 1.57 -0.40 -1.34 0.00 0.00 175.55 174.67 3msm n ASP 223 N 4.85 4.31 -3.52 4.32 3.85 -1.26 -3.51 116.55 125.57 3msm n ASP 223 Ca -0.12 -2.24 -0.08 0.00 -0.71 0.00 0.00 54.79 51.64 3msm n ASP 223 Cb 0.45 -0.52 -0.02 0.00 -1.35 0.00 0.00 41.12 39.67 3msm n ASP 223 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.20 174.60 3msm s LYS 224 N -1.45 0.71 -0.08 0.11 -2.85 -0.37 -4.66 119.74 111.15 3msm s LYS 224 Ca 0.49 -0.24 0.02 0.00 -1.00 0.00 0.00 55.97 55.24 3msm s LYS 224 Cb 0.29 0.33 0.01 0.00 -2.06 0.00 0.00 37.83 36.40 3msm s LYS 224 CO 0.28 -0.31 -0.14 -1.12 0.10 0.00 0.00 175.35 174.16 3msm s SER 225 N -2.34 2.13 0.29 0.03 0.01 -1.26 -0.96 113.70 111.62 3msm s SER 225 Ca 0.05 -0.37 0.04 0.00 1.31 0.00 0.00 55.95 56.99 3msm s SER 225 Cb -0.01 -0.97 -0.06 0.00 0.21 0.00 0.00 66.02 65.19 3msm s SER 225 CO -0.08 0.04 0.02 0.27 0.41 0.00 0.00 173.24 173.90 3msm s ILE 226 N 0.74 1.25 -0.22 1.44 -4.36 -0.32 -0.98 121.20 118.75 3msm s ILE 226 Ca -0.13 -2.03 -0.05 0.00 -0.26 0.00 0.00 60.65 58.18 3msm s ILE 226 Cb -0.16 -2.62 -0.02 0.00 1.25 0.00 0.00 42.46 40.91 3msm s ILE 226 CO 0.03 -0.14 0.01 -0.69 0.24 0.00 0.00 174.94 174.39 3msm s VAL 227 N -3.26 3.86 -0.22 8.37 1.01 -0.46 -0.67 120.40 129.03 3msm s VAL 227 Ca 0.33 -0.33 -0.04 0.00 0.00 0.00 0.00 61.98 61.94 3msm s VAL 227 Cb 0.07 -2.77 0.08 0.00 0.00 0.00 0.00 36.38 33.76 3msm s VAL 227 CO 0.13 0.40 0.10 -0.62 0.00 0.00 0.00 175.10 175.11 3msm s ASP 228 N 1.34 2.92 0.00 3.32 2.15 -0.16 -4.47 116.67 121.76 3msm s ASP 228 Ca 0.04 -0.93 0.10 0.00 0.43 0.00 0.00 52.55 52.20 3msm s ASP 228 Cb -0.15 -0.37 0.50 0.00 -0.30 0.00 0.00 42.92 42.60 3msm s ASP 228 CO 0.01 -0.38 1.23 -1.54 -0.17 0.00 0.00 175.17 174.32 3msm n SER 229 N 5.21 0.00 -0.71 -0.34 3.41 -1.26 -2.86 113.62 117.08 3msm n SER 229 Ca -0.07 0.20 0.13 0.00 -0.26 0.00 0.00 58.87 58.87 3msm n SER 229 Cb 0.46 -0.32 0.33 0.00 -0.26 0.00 0.00 64.21 64.42 3msm n SER 229 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3msm n GLY 230 N -0.44 0.50 3.27 5.00 0.00 -1.26 -4.75 105.19 107.52 3msm n GLY 230 Ca 0.04 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.21 3msm n GLY 230 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3msm s THR 231 N -1.95 1.92 -0.14 2.61 2.01 -1.13 -5.04 115.64 113.91 3msm s THR 231 Ca 0.34 -1.03 -0.24 0.00 0.31 0.00 0.00 61.69 61.07 3msm s THR 231 Cb 0.20 -1.60 -0.25 0.00 0.01 0.00 0.00 72.50 70.87 3msm s THR 231 CO 0.31 0.54 0.61 0.74 -0.69 0.00 0.00 174.62 176.14 3msm h THR 232 N 4.63 1.42 -4.38 -0.82 2.02 -1.89 0.48 112.91 114.38 3msm h THR 232 Ca -0.40 -2.34 -0.50 0.00 0.77 0.00 0.00 66.41 63.95 3msm h THR 232 Cb 1.13 2.97 0.09 0.00 -1.74 0.00 0.00 68.15 70.60 3msm h THR 232 CO 0.47 0.56 0.38 0.20 0.37 0.00 0.00 175.52 177.50 3msm s ASN 233 N -6.60 5.24 -0.38 4.18 -0.87 -1.26 -1.75 114.94 113.49 3msm s ASN 233 Ca -0.21 1.31 -0.25 0.00 -1.57 0.00 0.00 52.86 52.14 3msm s ASN 233 Cb 0.01 -2.13 0.02 0.00 -0.02 0.00 0.00 41.25 39.12 3msm s ASN 233 CO 0.69 -1.50 0.88 -0.22 -2.57 0.00 0.00 177.10 174.39 3msm s LEU 234 N -5.50 4.04 -0.13 0.60 2.96 -0.69 -2.48 118.68 117.47 3msm s LEU 234 Ca 0.59 0.44 -0.02 0.00 -0.22 0.00 0.00 54.13 54.91 3msm s LEU 234 Cb -0.13 -3.18 -0.02 0.00 0.50 0.00 0.00 46.19 43.36 3msm s LEU 234 CO 0.53 -0.85 -0.08 -0.13 -1.32 0.00 0.00 176.35 174.51 3msm s ARG 235 N 3.41 3.45 0.07 1.98 0.52 -0.38 -1.66 118.95 126.33 3msm s ARG 235 Ca 0.36 -0.59 0.10 0.00 -0.52 0.00 0.00 55.73 55.08 3msm s ARG 235 Cb -0.12 -2.76 -0.03 0.00 0.52 0.00 0.00 34.95 32.55 3msm s ARG 235 CO 0.19 0.29 -0.27 -0.51 0.02 0.00 0.00 175.30 175.03 3msm s LEU 236 N 0.20 2.21 0.84 2.53 1.43 -0.05 -0.25 118.68 125.59 3msm s LEU 236 Ca -0.05 -0.63 -0.13 0.00 -1.03 0.00 0.00 54.13 52.30 3msm s LEU 236 Cb -0.14 -1.27 0.09 0.00 0.03 0.00 0.00 46.19 44.90 3msm s LEU 236 CO 0.04 0.24 1.11 -2.65 0.23 0.00 0.00 176.35 175.32 3msm n PRO 237 N 1.55 -0.00 -0.25 1.29 -0.02 -1.26 -0.19 135.00 136.12 3msm n PRO 237 Ca -0.17 0.08 -0.05 0.00 -2.02 0.00 0.00 63.50 61.34 3msm n PRO 237 Cb 0.52 -2.36 0.01 0.00 -0.02 0.00 0.00 33.50 31.65 3msm n PRO 237 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3msm h LYS 238 N -1.17 -0.12 -0.30 -0.52 1.57 -1.87 0.13 116.57 114.28 3msm h LYS 238 Ca -0.45 0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.25 3msm h LYS 238 Cb 1.29 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.62 3msm h LYS 238 CO 0.44 -0.08 -0.16 -0.22 -0.57 0.00 0.00 179.45 178.86 3msm h LYS 239 N -0.13 0.54 0.01 3.15 3.64 -1.91 -2.00 116.57 119.88 3msm h LYS 239 Ca 0.25 -0.17 -0.20 0.00 -1.27 0.00 0.00 60.65 59.26 3msm h LYS 239 Cb 0.56 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.31 3msm h LYS 239 CO -0.77 0.68 -0.92 0.28 -2.27 0.00 0.00 179.45 176.46 3msm h VAL 240 N 0.49 1.59 -0.51 2.00 2.07 -1.46 -3.12 116.25 117.30 3msm h VAL 240 Ca 0.08 -2.93 0.05 0.00 0.82 0.00 0.00 66.70 64.73 3msm h VAL 240 Cb 0.56 2.62 -0.05 0.00 -1.52 0.00 0.00 31.29 32.90 3msm h VAL 240 CO 0.04 0.84 0.24 0.15 0.02 0.00 0.00 177.57 178.86 3msm h PHE 241 N 0.04 0.43 0.08 1.57 3.57 -0.09 -2.48 116.94 120.05 3msm h PHE 241 Ca -0.03 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3msm h PHE 241 Cb 1.59 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 40.19 3msm h PHE 241 CO 0.01 0.19 -0.21 0.93 -2.23 0.00 0.00 178.31 177.00 3msm h GLU 242 N 0.46 -0.31 0.00 1.11 5.08 -1.37 -1.73 114.58 117.82 3msm h GLU 242 Ca 0.23 0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.61 3msm h GLU 242 Cb 0.18 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 3msm h GLU 242 CO -0.19 -0.21 -0.02 0.00 -1.00 0.00 0.00 179.01 177.60 3msm h ALA 243 N -1.20 1.06 0.00 3.43 0.00 -1.55 0.17 119.26 121.17 3msm h ALA 243 Ca -0.01 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3msm h ALA 243 Cb 0.32 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 3msm h ALA 243 CO -0.10 0.02 -0.00 0.00 0.00 0.00 0.00 179.25 179.17 3msm h ALA 244 N 1.98 0.00 -0.25 0.00 0.00 -1.28 -2.95 119.26 116.77 3msm h ALA 244 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3msm h ALA 244 Cb 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3msm h ALA 244 CO 0.00 0.00 0.16 0.28 0.00 0.00 0.00 179.25 179.69 3msm h VAL 245 N -1.00 1.08 -0.65 0.00 2.07 -0.71 0.64 116.25 117.67 3msm h VAL 245 Ca -0.00 -0.17 0.18 0.00 0.82 0.00 0.00 66.70 67.52 3msm h VAL 245 Cb 0.66 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 3msm h VAL 245 CO -0.00 0.08 0.46 0.50 0.02 0.00 0.00 177.57 178.63 3msm h LYS 246 N 0.32 0.07 0.02 1.57 3.64 -0.84 1.22 116.57 122.57 3msm h LYS 246 Ca 0.09 -0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 59.16 3msm h LYS 246 Cb -0.01 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.75 3msm h LYS 246 CO -0.02 0.05 -1.82 0.45 -2.27 0.00 0.00 179.45 175.84 3msm n SER 247 N -4.37 1.01 -0.07 4.20 2.88 -0.66 -2.50 113.62 114.11 3msm n SER 247 Ca 0.13 0.34 -0.12 0.00 -1.33 0.00 0.00 58.87 57.89 3msm n SER 247 Cb 0.67 -0.11 -0.05 0.00 -0.75 0.00 0.00 64.21 63.97 3msm n SER 247 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 3msm h ILE 248 N 0.01 1.30 -1.00 2.46 2.04 0.74 -2.77 117.51 120.28 3msm h ILE 248 Ca -0.33 -1.12 0.13 0.00 1.00 0.00 0.00 64.86 64.54 3msm h ILE 248 Cb 2.03 1.59 -0.09 0.00 -0.74 0.00 0.00 36.82 39.62 3msm h ILE 248 CO 0.07 0.34 0.63 0.50 0.00 0.00 0.00 178.15 179.70 3msm h LYS 249 N 0.14 0.94 -0.18 2.37 3.64 0.14 -1.48 116.57 122.15 3msm h LYS 249 Ca 0.05 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 59.26 3msm h LYS 249 Cb 0.56 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 3msm h LYS 249 CO 0.03 0.62 -0.40 0.00 -2.27 0.00 0.00 179.45 177.43 3msm h ALA 250 N 1.55 0.99 0.00 5.00 0.00 -1.50 -3.26 119.26 122.04 3msm h ALA 250 Ca 0.51 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 3msm h ALA 250 Cb 0.54 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3msm h ALA 250 CO -0.28 0.62 -0.22 0.00 0.00 0.00 0.00 179.25 179.37 3msm h ALA 251 N 1.24 1.08 -0.95 0.00 0.00 -0.98 -3.12 119.26 116.54 3msm h ALA 251 Ca 0.03 -0.20 -0.57 0.00 0.00 0.00 0.00 54.91 54.17 3msm h ALA 251 Cb 0.85 -0.04 -0.42 0.00 0.00 0.00 0.00 17.79 18.19 3msm h ALA 251 CO 0.07 0.27 -0.66 -1.13 0.00 0.00 0.00 179.25 177.81 3msm n SER 252 N -3.48 5.10 -0.58 0.00 3.41 -1.03 -4.74 113.62 112.30 3msm n SER 252 Ca -0.00 -3.75 0.00 0.00 -0.26 0.00 0.00 58.87 54.86 3msm n SER 252 Cb 0.39 -0.42 0.03 0.00 -0.26 0.00 0.00 64.21 63.95 3msm n SER 252 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3msm n SER 253 N -0.66 1.30 0.06 4.04 7.64 -1.18 -2.40 113.62 122.41 3msm n SER 253 Ca 0.44 -2.06 0.12 0.00 1.01 0.00 0.00 58.87 58.38 3msm n SER 253 Cb 0.86 -0.50 0.17 0.00 -1.01 0.00 0.00 64.21 63.74 3msm n SER 253 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 3msm n THR 254 N 0.03 0.34 -4.15 0.44 -1.04 -1.26 -4.89 114.28 103.75 3msm n THR 254 Ca 0.02 -0.27 -0.10 0.00 -2.04 0.00 0.00 64.05 61.67 3msm n THR 254 Cb 0.31 -0.11 -0.10 0.00 -1.82 0.00 0.00 70.33 68.60 3msm n THR 254 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 3msm s GLU 255 N -3.16 0.79 -0.06 -2.82 2.02 -1.01 -5.17 118.70 109.29 3msm s GLU 255 Ca 0.06 -1.32 0.04 0.00 0.02 0.00 0.00 54.97 53.77 3msm s GLU 255 Cb 0.13 -0.09 0.00 0.00 0.10 0.00 0.00 34.13 34.27 3msm s GLU 255 CO 0.72 -0.05 -0.18 0.21 0.02 0.00 0.00 175.26 175.98 3msm s LYS 256 N -3.86 2.11 0.16 1.61 2.20 -1.26 -4.90 119.74 115.79 3msm s LYS 256 Ca 0.11 -0.64 0.09 0.00 -0.36 0.00 0.00 55.97 55.17 3msm s LYS 256 Cb 0.06 -1.73 -0.04 0.00 -1.51 0.00 0.00 37.83 34.61 3msm s LYS 256 CO -0.06 0.18 -0.19 -0.06 -0.36 0.00 0.00 175.35 174.86 3msm s PHE 257 N 0.27 1.85 0.65 4.03 0.40 -1.26 -5.13 117.98 118.79 3msm s PHE 257 Ca -0.10 -0.46 -0.17 0.00 -0.60 0.00 0.00 56.93 55.60 3msm s PHE 257 Cb -0.14 -0.93 -0.01 0.00 0.51 0.00 0.00 43.02 42.45 3msm s PHE 257 CO 0.04 0.33 1.24 -2.14 0.70 0.00 0.00 175.22 175.39 3msm s PRO 258 N -2.69 2.59 0.54 0.24 0.02 -1.26 -4.91 135.00 129.52 3msm s PRO 258 Ca 0.15 1.90 0.24 0.00 0.02 0.00 0.00 61.00 63.31 3msm s PRO 258 Cb -0.06 -1.87 1.42 0.00 0.02 0.00 0.00 34.50 34.01 3msm s PRO 258 CO 0.07 -1.53 2.06 -0.44 -0.33 0.00 0.00 177.00 176.83 3msm h ASP 259 N 0.44 0.00 0.19 2.53 3.32 -2.02 -2.70 116.42 118.18 3msm h ASP 259 Ca -0.50 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.49 3msm h ASP 259 Cb 1.31 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.85 3msm h ASP 259 CO 0.53 0.00 -0.25 1.23 -1.72 0.00 0.00 179.24 179.03 3msm h GLY 260 N 0.00 0.12 0.94 2.75 0.00 -1.94 -2.93 103.07 102.00 3msm h GLY 260 Ca 0.15 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.38 3msm h GLY 260 CO -0.00 0.07 -0.19 -2.75 0.00 0.00 0.00 176.54 173.67 3msm h PHE 261 N 0.10 -0.49 -0.50 5.60 3.57 -1.63 -0.72 116.94 122.86 3msm h PHE 261 Ca 0.02 -0.01 0.15 0.00 3.53 0.00 0.00 57.97 61.65 3msm h PHE 261 Cb 0.50 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 3msm h PHE 261 CO 0.00 -0.26 0.40 -1.49 -2.23 0.00 0.00 178.31 174.73 3msm h TRP 262 N -0.59 0.00 -0.01 0.41 4.06 -1.70 -0.87 115.95 117.25 3msm h TRP 262 Ca -0.05 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.90 3msm h TRP 262 Cb 0.44 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.60 3msm h TRP 262 CO -0.03 0.00 -0.05 1.28 -3.56 0.00 0.00 178.44 176.08 3msm n LEU 263 N -4.19 0.83 -1.87 -4.49 4.77 -1.04 -4.92 117.00 106.10 3msm n LEU 263 Ca 0.09 -0.23 -0.15 0.00 -0.03 0.00 0.00 56.01 55.69 3msm n LEU 263 Cb 0.61 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 3msm n LEU 263 CO 0.34 0.14 -0.14 0.61 -1.33 0.00 0.00 177.39 177.01 3msm n GLY 264 N 1.18 -0.24 0.05 -0.72 0.00 -0.33 -4.91 105.19 100.21 3msm n GLY 264 Ca 0.18 -0.22 0.02 0.00 0.00 0.00 0.00 46.02 46.01 3msm n GLY 264 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3msm n GLU 265 N -2.63 0.72 -3.90 1.61 1.02 -0.30 -5.00 120.64 112.15 3msm n GLU 265 Ca -0.15 -0.11 -0.09 0.00 -0.02 0.00 0.00 57.16 56.79 3msm n GLU 265 Cb 0.62 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.47 3msm n GLU 265 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 3msm s GLN 266 N -3.02 0.74 0.57 3.49 -2.07 -1.12 -4.97 119.66 113.28 3msm s GLN 266 Ca -0.08 -0.91 0.07 0.00 -1.82 0.00 0.00 55.36 52.61 3msm s GLN 266 Cb 0.10 0.29 0.06 0.00 -1.09 0.00 0.00 33.01 32.38 3msm s GLN 266 CO 0.83 -0.21 0.54 -0.48 -1.32 0.00 0.00 175.29 174.65 3msm s LEU 267 N -2.62 2.74 0.00 2.60 0.05 -1.26 -4.13 118.68 116.06 3msm s LEU 267 Ca 0.02 -1.18 0.00 0.00 0.05 0.00 0.00 54.13 53.02 3msm s LEU 267 Cb 0.03 -1.22 -0.00 0.00 -2.05 0.00 0.00 46.19 42.95 3msm s LEU 267 CO -0.09 -1.25 -0.02 0.54 -0.55 0.00 0.00 176.35 174.99 3msm s VAL 268 N -2.78 0.12 0.12 1.48 0.11 -1.02 -4.95 120.40 113.48 3msm s VAL 268 Ca 0.41 -0.13 0.07 0.00 -2.93 0.00 0.00 61.98 59.40 3msm s VAL 268 Cb -0.03 -0.12 -0.04 0.00 -1.53 0.00 0.00 36.38 34.66 3msm s VAL 268 CO 0.26 -0.01 -0.16 0.00 -3.33 0.00 0.00 175.10 171.86 3msm s TRP 270 N -1.85 0.29 0.09 0.00 0.51 -0.86 -4.96 118.94 112.17 3msm s TRP 270 Ca 0.09 -0.49 -0.36 0.00 -2.12 0.00 0.00 56.10 53.21 3msm s TRP 270 Cb -0.07 -0.20 -0.17 0.00 -0.81 0.00 0.00 33.47 32.22 3msm s TRP 270 CO 0.04 -0.17 1.28 1.04 -0.51 0.00 0.00 176.95 178.64 3msm n GLN 271 N 1.68 1.05 -1.33 4.98 6.02 -1.26 -2.51 117.38 126.00 3msm n GLN 271 Ca -0.23 0.38 -0.24 0.00 -0.01 0.00 0.00 57.00 56.90 3msm n GLN 271 Cb 0.55 -1.98 -0.19 0.00 1.02 0.00 0.00 30.24 29.64 3msm n GLN 271 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3msm n ALA 272 N 2.25 0.84 0.00 -1.58 0.00 -1.26 -0.44 120.51 120.31 3msm n ALA 272 Ca 0.18 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 53.00 3msm n ALA 272 Cb 0.19 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.53 3msm n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3msm n GLY 273 N 5.10 1.23 2.58 0.00 0.00 -1.26 -4.99 105.19 107.86 3msm n GLY 273 Ca 0.60 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.34 3msm n GLY 273 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3msm n THR 274 N -0.51 2.60 -3.10 2.61 -2.24 0.41 -5.04 114.28 109.01 3msm n THR 274 Ca 0.00 -5.00 -0.39 0.00 -2.27 0.00 0.00 64.05 56.39 3msm n THR 274 Cb 0.00 -1.29 -0.05 0.00 -2.10 0.00 0.00 70.33 66.89 3msm n THR 274 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3msm s THR 275 N -5.34 4.97 -0.54 4.28 2.01 -1.26 -4.72 115.64 115.03 3msm s THR 275 Ca 0.48 1.38 -0.18 0.00 0.31 0.00 0.00 61.69 63.68 3msm s THR 275 Cb 0.38 -4.00 0.09 0.00 0.01 0.00 0.00 72.50 68.98 3msm s THR 275 CO -0.20 0.32 0.61 -2.16 -0.69 0.00 0.00 174.62 172.51 3msm s PRO 276 N 0.37 3.05 0.36 4.92 0.04 -1.26 -4.90 135.00 137.59 3msm s PRO 276 Ca 0.35 -1.23 0.14 0.00 0.04 0.00 0.00 61.00 60.29 3msm s PRO 276 Cb -0.18 -4.20 0.69 0.00 0.04 0.00 0.00 34.50 30.86 3msm s PRO 276 CO 0.18 -1.34 1.79 -1.49 0.04 0.00 0.00 177.00 176.18 3msm h TRP 277 N 9.03 0.00 0.00 0.56 4.06 -1.96 -3.24 115.95 124.40 3msm h TRP 277 Ca -0.29 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.62 3msm h TRP 277 Cb 1.09 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.25 3msm h TRP 277 CO 0.77 0.40 -0.19 -0.91 -3.56 0.00 0.00 178.44 174.95 3msm h ASN 278 N 0.00 0.00 0.62 -3.49 4.21 -2.02 -1.33 115.58 113.57 3msm h ASN 278 Ca -0.00 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.50 3msm h ASN 278 Cb 0.74 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.94 3msm h ASN 278 CO 0.05 0.19 -0.01 0.40 -1.29 0.00 0.00 177.43 176.77 3msm h ILE 279 N 0.00 0.04 -3.04 2.81 1.08 -1.92 -3.43 117.51 113.06 3msm h ILE 279 Ca -0.00 -0.34 -0.62 0.00 -0.39 0.00 0.00 64.86 63.50 3msm h ILE 279 Cb 0.54 1.33 -0.09 0.00 -3.07 0.00 0.00 36.82 35.52 3msm h ILE 279 CO 0.02 0.01 -0.44 -0.36 -0.69 0.00 0.00 178.15 176.70 3msm s PHE 280 N -3.87 3.51 0.43 1.37 0.40 -0.50 -3.62 117.98 115.70 3msm s PHE 280 Ca -0.01 0.49 -0.22 0.00 -0.60 0.00 0.00 56.93 56.59 3msm s PHE 280 Cb 0.11 -2.12 -0.09 0.00 0.51 0.00 0.00 43.02 41.42 3msm s PHE 280 CO 0.50 0.46 1.03 -1.25 0.70 0.00 0.00 175.22 176.67 3msm s PRO 281 N -0.21 4.04 0.68 0.24 0.04 -1.26 -4.80 135.00 133.73 3msm s PRO 281 Ca 0.13 1.41 -0.14 0.00 0.04 0.00 0.00 61.00 62.44 3msm s PRO 281 Cb -0.12 -2.33 0.01 0.00 0.04 0.00 0.00 34.50 32.09 3msm s PRO 281 CO 0.02 -0.23 1.09 0.14 0.04 0.00 0.00 177.00 178.06 3msm s VAL 282 N -1.84 3.44 -0.08 -0.36 -7.23 -1.26 -4.33 120.40 108.74 3msm s VAL 282 Ca 0.62 0.60 0.05 0.00 -1.81 0.00 0.00 61.98 61.43 3msm s VAL 282 Cb -0.18 -3.14 -0.00 0.00 0.56 0.00 0.00 36.38 33.62 3msm s VAL 282 CO 0.23 -0.48 -0.22 -0.63 -0.31 0.00 0.00 175.10 173.69 3msm s ILE 283 N -2.56 1.88 -0.12 -0.62 1.01 -0.06 -1.62 121.20 119.11 3msm s ILE 283 Ca 0.64 -0.94 0.03 0.00 0.00 0.00 0.00 60.65 60.38 3msm s ILE 283 Cb -0.18 -1.61 0.01 0.00 0.01 0.00 0.00 42.46 40.68 3msm s ILE 283 CO 0.45 0.52 -0.21 -0.44 0.00 0.00 0.00 174.94 175.27 3msm s SER 284 N 0.18 2.89 -0.16 3.58 0.01 0.21 -0.16 113.70 120.25 3msm s SER 284 Ca -0.12 -0.54 -0.04 0.00 1.31 0.00 0.00 55.95 56.57 3msm s SER 284 Cb -0.16 -1.33 -0.03 0.00 0.21 0.00 0.00 66.02 64.72 3msm s SER 284 CO 0.06 0.09 -0.04 -0.76 0.41 0.00 0.00 173.24 173.00 3msm s LEU 285 N 0.69 3.21 -0.13 2.44 1.43 0.34 -1.26 118.68 125.42 3msm s LEU 285 Ca -0.11 -0.16 -0.12 0.00 -1.03 0.00 0.00 54.13 52.71 3msm s LEU 285 Cb -0.16 -1.78 -0.05 0.00 0.03 0.00 0.00 46.19 44.23 3msm s LEU 285 CO 0.02 0.15 0.27 -0.31 0.23 0.00 0.00 176.35 176.70 3msm s TYR 286 N 0.50 3.53 0.05 0.29 1.51 0.10 -0.61 117.35 122.73 3msm s TYR 286 Ca -0.03 0.63 0.07 0.00 -1.01 0.00 0.00 57.07 56.72 3msm s TYR 286 Cb -0.14 -2.23 -0.03 0.00 -0.11 0.00 0.00 41.96 39.44 3msm s TYR 286 CO 0.03 0.42 -0.15 -0.51 -1.11 0.00 0.00 175.55 174.23 3msm s LEU 287 N -0.12 2.78 0.17 -1.29 1.43 -0.56 -0.54 118.68 120.56 3msm s LEU 287 Ca 0.17 -0.39 -0.33 0.00 -1.03 0.00 0.00 54.13 52.55 3msm s LEU 287 Cb -0.13 -1.62 -0.15 0.00 0.03 0.00 0.00 46.19 44.31 3msm s LEU 287 CO 0.05 0.24 1.30 0.80 0.23 0.00 0.00 176.35 178.97 3msm n MET 288 N 1.32 1.50 -0.92 1.70 0.00 -0.78 -2.32 117.12 117.61 3msm n MET 288 Ca -0.15 0.54 -0.06 0.00 -0.00 0.00 0.00 57.70 58.02 3msm n MET 288 Cb 0.52 -2.13 0.03 0.00 0.00 0.00 0.00 33.22 31.65 3msm n MET 288 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3msm n GLY 289 N 2.30 0.21 0.11 -5.12 0.00 0.13 -4.08 105.19 98.74 3msm n GLY 289 Ca 0.15 -1.89 0.12 0.00 0.00 0.00 0.00 46.02 44.40 3msm n GLY 289 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3msm h GLU 290 N 0.00 0.00 -6.17 1.61 5.08 -1.74 -3.40 114.58 109.95 3msm h GLU 290 Ca -0.09 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.67 3msm h GLU 290 Cb 0.29 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 29.27 3msm h GLU 290 CO 0.08 0.00 -0.85 0.08 -1.00 0.00 0.00 179.01 177.32 3msm s VAL 291 N -3.15 1.73 0.00 3.13 1.01 -1.26 -5.05 120.40 116.82 3msm s VAL 291 Ca 0.08 -1.12 -0.40 0.00 0.00 0.00 0.00 61.98 60.54 3msm s VAL 291 Cb 0.12 -1.48 -0.20 0.00 0.00 0.00 0.00 36.38 34.82 3msm s VAL 291 CO 0.66 0.32 1.11 0.41 0.00 0.00 0.00 175.10 177.60 3msm n THR 292 N 2.09 0.00 -1.19 3.92 -1.04 -1.26 -1.62 114.28 115.18 3msm n THR 292 Ca -0.16 -0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 61.78 3msm n THR 292 Cb 0.53 -0.10 -0.03 0.00 -1.82 0.00 0.00 70.33 68.91 3msm n THR 292 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3msm n ASN 293 N 1.66 -4.83 -4.26 8.00 3.02 -1.26 -4.97 115.26 112.62 3msm n ASN 293 Ca 0.20 0.16 -0.33 0.00 -0.03 0.00 0.00 54.58 54.58 3msm n ASN 293 Cb 0.09 -2.92 -0.15 0.00 -0.61 0.00 0.00 39.78 36.19 3msm n ASN 293 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3msm s GLN 294 N -2.20 3.20 0.44 3.52 -0.44 -0.64 -1.85 119.66 121.69 3msm s GLN 294 Ca 0.00 -0.76 0.03 0.00 -2.50 0.00 0.00 55.36 52.13 3msm s GLN 294 Cb 0.00 -2.62 -0.03 0.00 -1.64 0.00 0.00 33.01 28.72 3msm s GLN 294 CO 0.00 0.01 0.06 -1.54 0.50 0.00 0.00 175.29 174.31 3msm s SER 295 N 0.83 3.44 0.30 6.67 1.04 -0.39 0.20 113.70 125.79 3msm s SER 295 Ca -0.05 -1.61 0.05 0.00 0.48 0.00 0.00 55.95 54.83 3msm s SER 295 Cb -0.15 0.36 -0.03 0.00 0.10 0.00 0.00 66.02 66.30 3msm s SER 295 CO -0.01 -0.82 0.23 0.72 0.98 0.00 0.00 173.24 174.35 3msm s PHE 296 N -3.02 1.62 0.03 5.02 -0.71 -0.98 -0.93 117.98 119.01 3msm s PHE 296 Ca 0.18 -1.58 0.02 0.00 -1.04 0.00 0.00 56.93 54.51 3msm s PHE 296 Cb 0.03 -0.71 -0.02 0.00 -1.21 0.00 0.00 43.02 41.12 3msm s PHE 296 CO 0.10 -0.78 -0.07 -0.98 -1.34 0.00 0.00 175.22 172.15 3msm s ARG 297 N -3.63 0.48 -0.08 1.99 1.70 1.00 -1.49 118.95 118.92 3msm s ARG 297 Ca 0.40 -0.64 -0.02 0.00 -0.47 0.00 0.00 55.73 55.00 3msm s ARG 297 Cb 0.04 -0.26 -0.03 0.00 -0.57 0.00 0.00 34.95 34.12 3msm s ARG 297 CO 0.23 0.05 0.00 0.96 -1.08 0.00 0.00 175.30 175.46 3msm s ILE 298 N -1.17 4.30 -0.16 4.99 -4.36 0.22 -1.39 121.20 123.63 3msm s ILE 298 Ca -0.09 -0.27 0.01 0.00 -0.26 0.00 0.00 60.65 60.04 3msm s ILE 298 Cb -0.09 -2.82 0.02 0.00 1.25 0.00 0.00 42.46 40.83 3msm s ILE 298 CO 0.00 0.59 -0.16 -0.89 0.24 0.00 0.00 174.94 174.72 3msm s THR 299 N -0.90 1.76 0.21 8.37 2.01 -0.50 -0.50 115.64 126.09 3msm s THR 299 Ca 0.14 -0.77 0.07 0.00 0.31 0.00 0.00 61.69 61.43 3msm s THR 299 Cb -0.11 -1.64 -0.04 0.00 0.01 0.00 0.00 72.50 70.72 3msm s THR 299 CO 0.03 0.47 0.09 0.27 -0.69 0.00 0.00 174.62 174.79 3msm s ILE 300 N 1.41 4.06 0.41 1.82 -4.36 0.78 -2.75 121.20 122.56 3msm s ILE 300 Ca 0.05 -1.42 0.02 0.00 -0.26 0.00 0.00 60.65 59.04 3msm s ILE 300 Cb -0.13 -3.12 -0.01 0.00 1.25 0.00 0.00 42.46 40.46 3msm s ILE 300 CO -0.11 -0.22 0.60 -0.76 0.24 0.00 0.00 174.94 174.69 3msm s LEU 301 N -3.36 3.76 0.31 0.37 1.43 -1.26 -0.88 118.68 119.05 3msm s LEU 301 Ca 0.30 0.14 0.07 0.00 -1.03 0.00 0.00 54.13 53.62 3msm s LEU 301 Cb -0.09 -3.03 0.82 0.00 0.03 0.00 0.00 46.19 43.92 3msm s LEU 301 CO 0.22 -0.60 1.74 -0.65 0.23 0.00 0.00 176.35 177.28 3msm h PRO 302 N 0.57 0.58 0.00 1.29 0.11 -1.87 -0.64 132.00 132.04 3msm h PRO 302 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3msm h PRO 302 Cb 1.25 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3msm h PRO 302 CO 0.56 0.38 0.09 1.96 -0.21 0.00 0.00 178.00 180.79 3msm h GLN 303 N 0.60 0.00 0.11 1.05 7.50 -1.91 0.36 115.11 122.82 3msm h GLN 303 Ca 0.61 0.00 -0.31 0.00 0.50 0.00 0.00 58.65 59.45 3msm h GLN 303 Cb 1.11 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.62 3msm h GLN 303 CO -0.46 0.00 -1.64 1.96 -1.50 0.00 0.00 178.83 177.19 3msm h GLN 304 N 0.00 0.22 -0.00 1.46 7.50 -1.45 -3.40 115.11 119.44 3msm h GLN 304 Ca 0.00 -0.38 0.00 0.00 0.50 0.00 0.00 58.65 58.77 3msm h GLN 304 Cb 0.19 0.14 0.00 0.00 0.05 0.00 0.00 27.48 27.86 3msm h GLN 304 CO 0.00 1.18 -0.78 2.48 -1.50 0.00 0.00 178.83 180.22 3msm n TYR 305 N -3.82 0.00 -3.69 2.96 0.18 -0.42 -4.68 117.16 107.70 3msm n TYR 305 Ca -0.29 0.00 -0.38 0.00 1.88 0.00 0.00 57.90 59.11 3msm n TYR 305 Cb 0.93 -0.03 -0.11 0.00 -0.38 0.00 0.00 39.34 39.75 3msm n TYR 305 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3msm s LEU 306 N -2.83 4.84 -0.10 -3.48 1.02 0.11 -0.20 118.68 118.04 3msm s LEU 306 Ca 0.12 -1.46 -0.02 0.00 0.02 0.00 0.00 54.13 52.78 3msm s LEU 306 Cb 0.17 -1.91 -0.03 0.00 0.02 0.00 0.00 46.19 44.44 3msm s LEU 306 CO 0.76 -0.46 0.00 0.00 0.02 0.00 0.00 176.35 176.67 3msm s ARG 307 N 1.36 3.14 0.46 1.70 1.70 -1.13 -4.64 118.95 121.54 3msm s ARG 307 Ca 0.02 -0.41 -0.25 0.00 -0.47 0.00 0.00 55.73 54.62 3msm s ARG 307 Cb -0.22 -2.84 -0.08 0.00 -0.57 0.00 0.00 34.95 31.24 3msm s ARG 307 CO 0.01 0.62 1.31 -2.30 -1.08 0.00 0.00 175.30 173.86 3msm n PRO 308 N 2.41 1.93 -4.17 3.89 -0.02 -1.26 -1.89 135.00 135.90 3msm n PRO 308 Ca -0.18 0.69 -0.35 0.00 -2.02 0.00 0.00 63.50 61.64 3msm n PRO 308 Cb 0.53 -2.47 -0.13 0.00 -0.02 0.00 0.00 33.50 31.42 3msm n PRO 308 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3msm s VAL 309 N -1.22 3.87 0.11 -1.45 1.01 -0.54 -4.84 120.40 117.33 3msm s VAL 309 Ca 0.63 -0.35 -0.29 0.00 0.00 0.00 0.00 61.98 61.98 3msm s VAL 309 Cb -0.47 -2.73 -0.09 0.00 0.00 0.00 0.00 36.38 33.08 3msm s VAL 309 CO 0.56 0.45 1.62 1.05 0.00 0.00 0.00 175.10 178.78 3msm h GLU 310 N 7.30 -0.55 -4.97 2.72 9.09 -1.95 -3.36 114.58 122.86 3msm h GLU 310 Ca -0.35 0.04 -0.53 0.00 0.05 0.00 0.00 59.36 58.57 3msm h GLU 310 Cb 1.18 0.12 0.12 0.00 -1.65 0.00 0.00 28.75 28.53 3msm h GLU 310 CO 0.61 -0.37 1.30 -0.25 0.05 0.00 0.00 179.01 180.36 3msm n ASP 311 N -5.42 1.19 -1.90 3.06 8.00 -1.26 -4.64 116.55 115.58 3msm n ASP 311 Ca -0.07 -2.52 -0.08 0.00 0.71 0.00 0.00 54.79 52.83 3msm n ASP 311 Cb 0.33 -0.70 -0.11 0.00 -0.02 0.00 0.00 41.12 40.62 3msm n ASP 311 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3msm n VAL 312 N 7.15 2.48 0.09 2.53 0.24 -1.26 -4.64 118.33 124.92 3msm n VAL 312 Ca 0.47 -1.11 -0.06 0.00 -2.04 0.00 0.00 64.34 61.59 3msm n VAL 312 Cb 0.42 -1.81 0.02 0.00 -1.47 0.00 0.00 33.84 31.00 3msm n VAL 312 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3msm h ALA 313 N 2.69 0.61 0.00 2.33 0.00 -1.96 -3.23 119.26 119.71 3msm h ALA 313 Ca 0.12 -0.71 -0.06 0.00 0.00 0.00 0.00 54.91 54.27 3msm h ALA 313 Cb 1.25 -0.10 -0.13 0.00 0.00 0.00 0.00 17.79 18.82 3msm h ALA 313 CO 0.18 0.93 -0.61 0.25 0.00 0.00 0.00 179.25 180.00 3msm n THR 314 N -3.65 1.25 -4.02 0.00 -2.24 -1.26 -5.06 114.28 99.30 3msm n THR 314 Ca -0.02 -2.09 -0.09 0.00 -2.27 0.00 0.00 64.05 59.58 3msm n THR 314 Cb 0.77 0.23 -0.11 0.00 -2.10 0.00 0.00 70.33 69.13 3msm n THR 314 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3msm s SER 315 N -2.58 0.36 -0.26 3.42 0.15 -1.22 -5.10 113.70 108.47 3msm s SER 315 Ca 0.32 -0.67 -0.04 0.00 0.70 0.00 0.00 55.95 56.26 3msm s SER 315 Cb 0.33 0.13 -0.15 0.00 -1.71 0.00 0.00 66.02 64.62 3msm s SER 315 CO -0.08 -0.40 -0.27 1.67 1.20 0.00 0.00 173.24 175.36 3msm n GLN 316 N 1.08 0.61 0.00 5.44 -0.06 -1.26 -4.48 117.38 118.71 3msm n GLN 316 Ca -0.20 0.18 0.00 0.00 -2.00 0.00 0.00 57.00 54.98 3msm n GLN 316 Cb 0.57 -1.49 0.00 0.00 -4.06 0.00 0.00 30.24 25.26 3msm n GLN 316 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 3msm n ASP 317 N -3.59 0.00 -4.36 1.69 10.43 -1.26 -4.95 116.55 114.50 3msm n ASP 317 Ca -0.48 0.00 -0.46 0.00 2.57 0.00 0.00 54.79 56.42 3msm n ASP 317 Cb 0.94 0.00 -0.02 0.00 1.84 0.00 0.00 41.12 43.88 3msm n ASP 317 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 3msm s ASP 318 N -1.54 6.68 -0.10 -2.24 1.01 -1.04 -4.86 116.67 114.57 3msm s ASP 318 Ca 0.00 -2.42 -0.11 0.00 0.71 0.00 0.00 52.55 50.73 3msm s ASP 318 Cb 0.00 -2.27 -0.05 0.00 1.01 0.00 0.00 42.92 41.62 3msm s ASP 318 CO 0.00 -0.74 0.25 0.00 0.21 0.00 0.00 175.17 174.88 3msm s TYR 320 N -0.57 1.99 -0.06 0.00 1.51 0.10 -1.47 117.35 118.85 3msm s TYR 320 Ca 0.17 -0.39 -0.15 0.00 -1.01 0.00 0.00 57.07 55.69 3msm s TYR 320 Cb -0.13 -1.17 -0.05 0.00 -0.11 0.00 0.00 41.96 40.49 3msm s TYR 320 CO 0.06 0.12 0.39 0.21 -1.11 0.00 0.00 175.55 175.22 3msm s LYS 321 N -1.29 4.04 -0.33 -0.62 2.20 -0.79 -2.43 119.74 120.52 3msm s LYS 321 Ca 0.09 0.34 -0.29 0.00 -0.36 0.00 0.00 55.97 55.75 3msm s LYS 321 Cb -0.09 -3.30 -0.01 0.00 -1.51 0.00 0.00 37.83 32.92 3msm s LYS 321 CO 0.02 0.51 1.53 0.12 -0.36 0.00 0.00 175.35 177.17 3msm s PHE 322 N -0.46 2.24 -0.26 4.03 5.99 -1.26 -2.85 117.98 125.41 3msm s PHE 322 Ca 0.22 0.66 0.02 0.00 0.00 0.00 0.00 56.93 57.83 3msm s PHE 322 Cb -0.15 -4.13 0.34 0.00 0.00 0.00 0.00 43.02 39.08 3msm s PHE 322 CO 0.11 -2.38 1.58 0.00 -0.00 0.00 0.00 175.22 174.52 3msm n ALA 323 N 8.86 4.36 -3.30 11.12 0.00 0.72 -4.68 120.51 137.59 3msm n ALA 323 Ca 0.18 -1.61 -0.24 0.00 0.00 0.00 0.00 53.44 51.77 3msm n ALA 323 Cb 0.47 -1.27 -0.16 0.00 0.00 0.00 0.00 19.45 18.48 3msm n ALA 323 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3msm s ILE 324 N -1.91 1.14 0.26 0.00 1.01 -1.26 -1.70 121.20 118.74 3msm s ILE 324 Ca 0.31 -0.51 -0.03 0.00 0.00 0.00 0.00 60.65 60.43 3msm s ILE 324 Cb 0.26 -1.03 -0.02 0.00 0.01 0.00 0.00 42.46 41.68 3msm s ILE 324 CO 0.05 0.35 0.31 -0.94 0.00 0.00 0.00 174.94 174.71 3msm s SER 325 N 0.49 0.47 0.36 3.58 1.04 -0.66 -4.86 113.70 114.12 3msm s SER 325 Ca -0.11 -1.35 0.07 0.00 0.48 0.00 0.00 55.95 55.04 3msm s SER 325 Cb -0.14 0.52 -0.00 0.00 0.10 0.00 0.00 66.02 66.49 3msm s SER 325 CO 0.03 -1.05 0.51 0.00 0.98 0.00 0.00 173.24 173.71 3msm s GLN 326 N -3.78 3.04 -0.07 4.02 -2.07 -1.26 -0.87 119.66 118.65 3msm s GLN 326 Ca 0.33 -1.05 -0.13 0.00 -1.82 0.00 0.00 55.36 52.69 3msm s GLN 326 Cb 0.03 -2.79 0.03 0.00 -1.09 0.00 0.00 33.01 29.18 3msm s GLN 326 CO 0.15 -0.04 0.32 0.45 -1.32 0.00 0.00 175.29 174.85 3msm s SER 327 N -4.22 -0.27 0.00 12.60 0.15 0.74 -4.65 113.70 118.04 3msm s SER 327 Ca 0.48 0.40 0.22 0.00 0.70 0.00 0.00 55.95 57.75 3msm s SER 327 Cb -0.10 0.51 -0.02 0.00 -1.71 0.00 0.00 66.02 64.71 3msm s SER 327 CO 0.32 -0.26 1.06 -1.54 1.20 0.00 0.00 173.24 174.01 3msm n SER 328 N 2.17 1.95 -0.73 5.45 3.41 -1.26 -2.75 113.62 121.86 3msm n SER 328 Ca -0.17 -1.48 0.09 0.00 -0.26 0.00 0.00 58.87 57.05 3msm n SER 328 Cb 0.57 0.51 0.08 0.00 -0.26 0.00 0.00 64.21 65.11 3msm n SER 328 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3msm n THR 329 N -0.10 0.05 0.00 6.66 -2.24 -1.26 -4.76 114.28 112.63 3msm n THR 329 Ca 0.09 -0.52 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 3msm n THR 329 Cb 0.45 1.33 0.00 0.00 -2.10 0.00 0.00 70.33 70.01 3msm n THR 329 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3msm n GLY 330 N 1.02 -1.04 3.74 3.38 0.00 -1.23 -4.31 105.19 106.75 3msm n GLY 330 Ca 0.11 -2.18 -0.41 0.00 0.00 0.00 0.00 46.02 43.53 3msm n GLY 330 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3msm s THR 331 N -0.21 3.53 -0.17 2.61 2.01 -0.13 -4.28 115.64 119.00 3msm s THR 331 Ca 0.00 1.33 0.01 0.00 0.31 0.00 0.00 61.69 63.34 3msm s THR 331 Cb 0.00 -3.85 0.02 0.00 0.01 0.00 0.00 72.50 68.68 3msm s THR 331 CO 0.00 0.23 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.30 3msm s VAL 332 N -0.25 1.88 -0.79 3.82 1.01 0.66 -1.17 120.40 125.55 3msm s VAL 332 Ca 0.51 -0.85 -0.19 0.00 0.00 0.00 0.00 61.98 61.46 3msm s VAL 332 Cb -0.33 -1.73 0.12 0.00 0.00 0.00 0.00 36.38 34.44 3msm s VAL 332 CO 0.38 0.49 0.97 -0.04 0.00 0.00 0.00 175.10 176.90 3msm s MET 333 N 1.36 3.38 0.00 2.72 1.00 0.16 -1.25 119.30 126.66 3msm s MET 333 Ca 0.05 -1.54 0.00 0.00 0.00 0.00 0.00 55.69 54.20 3msm s MET 333 Cb -0.13 -4.58 0.00 0.00 0.00 0.00 0.00 34.83 30.12 3msm s MET 333 CO -0.12 -1.69 0.00 0.41 0.00 0.00 0.00 175.02 173.62 3msm n GLY 334 N 5.26 0.96 0.51 -0.03 0.00 -1.04 -0.99 105.19 109.86 3msm n GLY 334 Ca 0.10 -1.93 0.34 0.00 0.00 0.00 0.00 46.02 44.52 3msm n GLY 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3msm h ALA 335 N -0.92 2.91 -0.48 4.61 0.00 -0.75 -0.70 119.26 123.94 3msm h ALA 335 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.93 3msm h ALA 335 Cb 0.00 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3msm h ALA 335 CO 0.00 -1.32 0.30 0.28 0.00 0.00 0.00 179.25 178.51 3msm h VAL 336 N 0.11 1.08 -0.09 0.00 2.07 -1.58 -0.36 116.25 117.47 3msm h VAL 336 Ca 0.63 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 67.92 3msm h VAL 336 Cb 2.23 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 32.42 3msm h VAL 336 CO -0.13 0.11 -0.06 0.40 0.02 0.00 0.00 177.57 177.91 3msm h ILE 337 N 0.60 1.34 0.00 4.57 1.08 -1.64 -3.39 117.51 120.07 3msm h ILE 337 Ca 0.19 -1.12 -0.11 0.00 -0.39 0.00 0.00 64.86 63.43 3msm h ILE 337 Cb -0.02 1.89 -0.02 0.00 -3.07 0.00 0.00 36.82 35.61 3msm h ILE 337 CO -0.07 0.31 -0.51 0.24 -0.69 0.00 0.00 178.15 177.43 3msm h MET 338 N -0.18 0.00 0.00 2.37 2.86 -0.80 -3.00 114.93 116.17 3msm h MET 338 Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 3msm h MET 338 Cb 0.53 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.19 3msm h MET 338 CO 0.02 0.51 0.00 0.93 1.06 0.00 0.00 176.91 179.43 3msm h GLU 339 N 0.00 0.00 0.00 1.72 5.08 -1.25 -1.91 114.58 118.22 3msm h GLU 339 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3msm h GLU 339 Cb 0.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 3msm h GLU 339 CO 0.07 0.00 0.00 0.78 -1.00 0.00 0.00 179.01 178.86 3msm h GLY 340 N 2.46 0.00 -3.73 -3.84 0.00 -1.73 -3.41 103.07 92.82 3msm h GLY 340 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.10 3msm h GLY 340 CO 0.00 0.00 -0.71 -1.36 0.00 0.00 0.00 176.54 174.47 3msm s PHE 341 N -3.44 0.75 -0.08 5.60 0.08 -0.72 -1.68 117.98 118.49 3msm s PHE 341 Ca 0.04 -0.77 -0.22 0.00 0.12 0.00 0.00 56.93 56.10 3msm s PHE 341 Cb 0.08 -0.45 -0.04 0.00 -0.57 0.00 0.00 43.02 42.04 3msm s PHE 341 CO 0.59 -0.15 0.66 -0.47 -0.10 0.00 0.00 175.22 175.75 3msm s TYR 342 N -2.78 3.55 -0.16 0.36 5.04 0.17 -4.52 117.35 119.01 3msm s TYR 342 Ca 0.03 1.18 0.02 0.00 -2.44 0.00 0.00 57.07 55.85 3msm s TYR 342 Cb -0.00 -2.77 0.02 0.00 0.35 0.00 0.00 41.96 39.55 3msm s TYR 342 CO -0.03 0.08 -0.20 0.08 -1.34 0.00 0.00 175.55 174.13 3msm s VAL 343 N 0.86 2.09 -0.26 3.14 1.01 -0.49 -1.86 120.40 124.90 3msm s VAL 343 Ca 0.35 -0.95 -0.07 0.00 0.00 0.00 0.00 61.98 61.32 3msm s VAL 343 Cb -0.17 -1.86 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 3msm s VAL 343 CO 0.16 0.54 0.06 -0.69 0.00 0.00 0.00 175.10 175.18 3msm s VAL 344 N 1.10 4.17 -1.05 2.92 1.01 0.52 -0.66 120.40 128.41 3msm s VAL 344 Ca 0.00 -0.29 -0.15 0.00 0.00 0.00 0.00 61.98 61.54 3msm s VAL 344 Cb -0.14 -2.98 0.18 0.00 0.00 0.00 0.00 36.38 33.44 3msm s VAL 344 CO -0.08 0.30 1.19 -0.36 0.00 0.00 0.00 175.10 176.14 3msm s PHE 345 N 1.58 3.54 -1.33 5.22 0.40 -0.04 -0.86 117.98 126.50 3msm s PHE 345 Ca 0.06 -1.97 -0.11 0.00 -0.60 0.00 0.00 56.93 54.31 3msm s PHE 345 Cb -0.15 -4.16 0.13 0.00 0.51 0.00 0.00 43.02 39.35 3msm s PHE 345 CO 0.03 -1.30 1.97 -3.47 0.70 0.00 0.00 175.22 173.15 3msm n ASP 346 N 5.22 4.76 -0.34 1.36 -0.08 0.11 -2.99 116.55 124.58 3msm n ASP 346 Ca 0.27 -3.04 0.10 0.00 -1.51 0.00 0.00 54.79 50.62 3msm n ASP 346 Cb 0.45 -1.53 0.30 0.00 2.34 0.00 0.00 41.12 42.68 3msm n ASP 346 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 3msm h ARG 347 N 5.82 0.82 -0.50 -0.67 3.08 -1.72 -1.52 114.38 119.69 3msm h ARG 347 Ca 0.44 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 60.39 3msm h ARG 347 Cb 0.63 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 3msm h ARG 347 CO 1.70 0.55 0.08 0.00 -1.07 0.00 0.00 179.97 181.22 3msm h ALA 348 N 1.59 1.19 -0.52 0.04 0.00 -1.21 -2.67 119.26 117.68 3msm h ALA 348 Ca 0.52 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.21 3msm h ALA 348 Cb 0.70 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3msm h ALA 348 CO -0.30 0.54 0.00 0.54 0.00 0.00 0.00 179.25 180.04 3msm n ARG 349 N -4.26 3.72 -3.84 0.00 1.74 -0.71 -4.98 116.66 108.33 3msm n ARG 349 Ca 0.03 -2.85 -0.30 0.00 -0.77 0.00 0.00 57.85 53.97 3msm n ARG 349 Cb 0.25 -1.89 0.01 0.00 -1.02 0.00 0.00 32.46 29.81 3msm n ARG 349 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3msm n LYS 350 N 0.59 -2.13 -3.43 5.56 5.02 -0.66 -4.93 118.16 118.19 3msm n LYS 350 Ca 0.24 0.40 -0.12 0.00 -2.02 0.00 0.00 58.31 56.81 3msm n LYS 350 Cb 0.91 -4.18 -0.02 0.00 -0.02 0.00 0.00 35.03 31.71 3msm n LYS 350 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3msm s ARG 351 N -6.36 1.24 -0.08 1.97 1.70 -0.73 -1.08 118.95 115.61 3msm s ARG 351 Ca 0.26 -0.42 0.02 0.00 -0.47 0.00 0.00 55.73 55.11 3msm s ARG 351 Cb -0.10 0.57 0.02 0.00 -0.57 0.00 0.00 34.95 34.87 3msm s ARG 351 CO 0.88 -0.54 -0.12 0.42 -1.08 0.00 0.00 175.30 174.87 3msm s ILE 352 N -3.59 1.14 0.04 4.99 1.01 -0.03 0.09 121.20 124.85 3msm s ILE 352 Ca 0.01 -0.46 0.03 0.00 0.00 0.00 0.00 60.65 60.22 3msm s ILE 352 Cb -0.01 -1.07 -0.04 0.00 0.01 0.00 0.00 42.46 41.36 3msm s ILE 352 CO -0.12 0.36 0.01 -0.83 0.00 0.00 0.00 174.94 174.37 3msm s GLY 353 N 0.88 1.91 0.01 6.18 0.00 -0.04 -0.10 107.32 116.16 3msm s GLY 353 Ca -0.10 -1.01 0.06 0.00 0.00 0.00 0.00 44.72 43.67 3msm s GLY 353 CO 0.01 -0.92 -0.17 -1.36 0.00 0.00 0.00 173.10 170.66 3msm s PHE 354 N -1.19 1.52 -0.00 1.90 0.40 0.12 -0.35 117.98 120.38 3msm s PHE 354 Ca 0.23 -0.32 -0.13 0.00 -0.60 0.00 0.00 56.93 56.11 3msm s PHE 354 Cb -0.12 -0.95 0.02 0.00 0.51 0.00 0.00 43.02 42.48 3msm s PHE 354 CO 0.14 0.01 0.27 0.00 0.70 0.00 0.00 175.22 176.34 3msm s ALA 355 N -0.57 -0.66 -0.20 5.36 0.00 -0.78 -0.69 121.76 124.23 3msm s ALA 355 Ca 0.06 0.17 -0.38 0.00 0.00 0.00 0.00 51.96 51.81 3msm s ALA 355 Cb -0.07 0.12 -0.14 0.00 0.00 0.00 0.00 23.12 23.03 3msm s ALA 355 CO 0.00 -0.27 1.81 0.28 0.00 0.00 0.00 175.76 177.58 3msm n VAL 356 N 1.20 0.43 -2.25 0.00 0.31 -1.25 0.46 118.33 117.22 3msm n VAL 356 Ca -0.21 -0.08 -0.41 0.00 -0.01 0.00 0.00 64.34 63.63 3msm n VAL 356 Cb 0.56 -1.51 -0.03 0.00 -0.91 0.00 0.00 33.84 31.96 3msm n VAL 356 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3msm s SER 357 N 3.80 6.95 0.27 4.52 0.15 -0.68 -1.92 113.70 126.80 3msm s SER 357 Ca 0.96 2.44 0.23 0.00 0.70 0.00 0.00 55.95 60.28 3msm s SER 357 Cb -0.91 -2.62 1.01 0.00 -1.71 0.00 0.00 66.02 61.79 3msm s SER 357 CO 0.60 -0.44 1.71 0.00 1.20 0.00 0.00 173.24 176.31 3msm n ALA 358 N 1.81 1.57 0.69 5.45 0.00 0.65 -3.17 120.51 127.51 3msm n ALA 358 Ca 0.03 0.10 0.10 0.00 0.00 0.00 0.00 53.44 53.67 3msm n ALA 358 Cb 0.43 -1.38 -0.13 0.00 0.00 0.00 0.00 19.45 18.37 3msm n ALA 358 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3msm n HIS 360 N -1.71 1.46 -2.43 0.00 -0.00 -1.19 -4.86 115.22 106.49 3msm n HIS 360 Ca 0.02 0.42 -0.38 0.00 -0.00 0.00 0.00 57.72 57.78 3msm n HIS 360 Cb 0.39 -2.21 -0.03 0.00 -0.00 0.00 0.00 29.99 28.13 3msm n HIS 360 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 3msm s VAL 361 N -1.44 3.79 0.26 0.61 1.01 -1.26 -4.99 120.40 118.38 3msm s VAL 361 Ca 0.80 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 62.20 3msm s VAL 361 Cb -0.39 -4.79 -0.04 0.00 0.00 0.00 0.00 36.38 31.16 3msm s VAL 361 CO 0.43 -1.69 0.45 -1.38 0.00 0.00 0.00 175.10 172.90 3msm s HIS 362 N 6.25 3.48 0.00 5.22 -3.43 -1.26 -4.91 115.29 120.64 3msm s HIS 362 Ca 0.51 0.29 0.00 0.00 -0.80 0.00 0.00 55.06 55.07 3msm s HIS 362 Cb -0.02 -1.83 0.00 0.00 -1.43 0.00 0.00 32.58 29.30 3msm s HIS 362 CO -0.06 0.29 0.00 -0.40 -2.00 0.00 0.00 174.74 172.57 3msm n ASP 363 N -1.20 1.66 -0.05 7.38 3.85 -1.23 -5.08 116.55 121.87 3msm n ASP 363 Ca -0.05 -0.17 -0.15 0.00 -0.71 0.00 0.00 54.79 53.70 3msm n ASP 363 Cb 0.55 0.00 -0.07 0.00 -1.35 0.00 0.00 41.12 40.26 3msm n ASP 363 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 3msm h GLU 364 N 0.00 0.69 0.02 0.11 4.57 -2.06 -3.40 114.58 114.51 3msm h GLU 364 Ca 0.00 -0.49 -0.39 0.00 -1.18 0.00 0.00 59.36 57.30 3msm h GLU 364 Cb 0.00 0.08 -0.06 0.00 -0.16 0.00 0.00 28.75 28.61 3msm h GLU 364 CO 0.00 1.11 -2.25 1.19 -1.18 0.00 0.00 179.01 177.87 3msm n PHE 365 N -4.14 0.35 -4.37 0.92 3.01 -1.26 -5.01 117.46 106.95 3msm n PHE 365 Ca -0.06 0.11 -0.22 0.00 1.01 0.00 0.00 57.45 58.29 3msm n PHE 365 Cb 0.61 -1.04 -0.11 0.00 -0.01 0.00 0.00 39.48 38.93 3msm n PHE 365 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3msm s ARG 366 N -2.50 1.40 -0.09 -1.08 0.52 -1.26 -5.15 118.95 110.78 3msm s ARG 366 Ca -0.33 -1.55 -0.08 0.00 -0.52 0.00 0.00 55.73 53.25 3msm s ARG 366 Cb 0.10 -1.41 0.03 0.00 0.52 0.00 0.00 34.95 34.19 3msm s ARG 366 CO 0.59 0.27 0.24 0.99 0.02 0.00 0.00 175.30 177.41 3msm s THR 367 N -2.37 -0.01 0.35 0.02 2.01 -1.26 -3.57 115.64 110.80 3msm s THR 367 Ca 0.21 0.03 -0.29 0.00 0.31 0.00 0.00 61.69 61.96 3msm s THR 367 Cb -0.04 -0.35 -0.11 0.00 0.01 0.00 0.00 72.50 72.00 3msm s THR 367 CO 0.09 0.01 1.52 0.00 -0.69 0.00 0.00 174.62 175.55 3msm n ALA 368 N 3.23 2.40 -2.37 7.40 0.00 -1.26 -4.96 120.51 124.94 3msm n ALA 368 Ca -0.15 0.35 -0.08 0.00 0.00 0.00 0.00 53.44 53.56 3msm n ALA 368 Cb 0.57 -2.43 -0.10 0.00 0.00 0.00 0.00 19.45 17.49 3msm n ALA 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3msm s ALA 369 N -0.72 0.29 -0.22 0.00 0.00 -1.11 -4.91 121.76 115.10 3msm s ALA 369 Ca 0.57 -0.96 -0.01 0.00 0.00 0.00 0.00 51.96 51.57 3msm s ALA 369 Cb -0.49 0.27 0.06 0.00 0.00 0.00 0.00 23.12 22.96 3msm s ALA 369 CO 0.58 -0.34 -0.01 0.08 0.00 0.00 0.00 175.76 176.07 3msm s VAL 370 N -3.32 1.09 0.13 0.00 1.01 -1.26 -1.41 120.40 116.64 3msm s VAL 370 Ca 0.01 -0.94 0.08 0.00 0.00 0.00 0.00 61.98 61.14 3msm s VAL 370 Cb 0.03 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 3msm s VAL 370 CO -0.08 -0.15 -0.18 -1.61 0.00 0.00 0.00 175.10 173.08 3msm s GLU 371 N 1.60 1.15 -0.02 2.72 2.02 -0.48 -4.87 118.70 120.81 3msm s GLU 371 Ca -0.04 -1.26 -0.30 0.00 0.02 0.00 0.00 54.97 53.40 3msm s GLU 371 Cb -0.18 -1.25 0.12 0.00 0.10 0.00 0.00 34.13 32.91 3msm s GLU 371 CO -0.07 0.27 1.29 0.20 0.02 0.00 0.00 175.26 176.97 3msm s GLY 372 N -2.28 -0.35 0.30 -1.39 0.00 -1.26 -0.00 107.32 102.34 3msm s GLY 372 Ca 0.10 0.54 -0.03 0.00 0.00 0.00 0.00 44.72 45.33 3msm s GLY 372 CO 0.05 1.42 0.53 2.56 0.00 0.00 0.00 173.10 177.67 3msm s PRO 373 N -2.30 3.57 0.32 2.90 0.04 -1.26 -5.09 135.00 133.18 3msm s PRO 373 Ca 0.18 -0.14 0.09 0.00 0.04 0.00 0.00 61.00 61.18 3msm s PRO 373 Cb 0.04 -2.67 -0.05 0.00 0.04 0.00 0.00 34.50 31.85 3msm s PRO 373 CO -0.03 0.21 -0.02 -0.06 0.04 0.00 0.00 177.00 177.13 3msm s PHE 374 N -2.14 2.53 -0.33 0.56 0.08 -0.11 -4.98 117.98 113.59 3msm s PHE 374 Ca 0.42 -0.39 -0.14 0.00 0.12 0.00 0.00 56.93 56.94 3msm s PHE 374 Cb -0.10 -1.37 -0.02 0.00 -0.57 0.00 0.00 43.02 40.95 3msm s PHE 374 CO 0.32 0.54 0.29 0.08 -0.10 0.00 0.00 175.22 176.35 3msm s VAL 375 N -2.49 5.23 -0.07 -0.44 1.01 -1.26 -1.27 120.40 121.12 3msm s VAL 375 Ca 0.33 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.32 3msm s VAL 375 Cb -0.02 -3.73 0.02 0.00 0.00 0.00 0.00 36.38 32.66 3msm s VAL 375 CO 0.19 0.01 -0.04 -0.89 0.00 0.00 0.00 175.10 174.36 3msm s THR 376 N 1.87 0.61 0.30 3.92 2.01 -0.77 -4.93 115.64 118.64 3msm s THR 376 Ca 0.09 -0.09 -0.03 0.00 0.31 0.00 0.00 61.69 61.97 3msm s THR 376 Cb -0.17 -0.67 -0.04 0.00 0.01 0.00 0.00 72.50 71.63 3msm s THR 376 CO 0.11 0.27 0.53 -0.76 -0.69 0.00 0.00 174.62 174.08 3msm s LEU 377 N 1.39 4.06 -1.52 4.42 1.43 -1.26 -4.22 118.68 122.97 3msm s LEU 377 Ca -0.03 0.59 -0.05 0.00 -1.03 0.00 0.00 54.13 53.60 3msm s LEU 377 Cb -0.13 -3.41 0.02 0.00 0.03 0.00 0.00 46.19 42.69 3msm s LEU 377 CO -0.03 -0.21 0.56 0.47 0.23 0.00 0.00 176.35 177.37 3msm n ASP 378 N -1.17 -5.74 0.10 2.29 8.00 -1.26 -4.89 116.55 113.87 3msm n ASP 378 Ca -0.03 -0.28 0.05 0.00 0.71 0.00 0.00 54.79 55.23 3msm n ASP 378 Cb 0.55 -4.66 0.47 0.00 -0.02 0.00 0.00 41.12 37.46 3msm n ASP 378 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 3msm h MET 379 N -1.25 0.33 0.00 -1.24 2.86 -1.98 -2.23 114.93 111.41 3msm h MET 379 Ca -0.51 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.02 3msm h MET 379 Cb 1.35 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.93 3msm h MET 379 CO 0.56 0.27 -0.36 1.49 1.06 0.00 0.00 176.91 179.94 3msm h GLU 380 N 0.33 0.00 0.00 1.72 4.57 -1.97 -2.38 114.58 116.85 3msm h GLU 380 Ca 0.09 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.27 3msm h GLU 380 Cb 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.65 3msm h GLU 380 CO -0.01 0.36 0.00 -0.25 -1.18 0.00 0.00 179.01 177.93 3msm n ASP 381 N -3.75 0.00 0.07 1.04 8.00 -0.84 -2.46 116.55 118.61 3msm n ASP 381 Ca -0.01 -0.52 0.12 0.00 0.71 0.00 0.00 54.79 55.08 3msm n ASP 381 Cb 0.44 -0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.58 3msm n ASP 381 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3msm s GLY 383 N -4.06 1.64 -0.14 0.00 0.00 -1.03 -4.19 107.32 99.54 3msm s GLY 383 Ca 0.02 -0.23 -0.08 0.00 0.00 0.00 0.00 44.72 44.43 3msm s GLY 383 CO 0.78 0.12 0.13 -0.47 0.00 0.00 0.00 173.10 173.66 3msm s TYR 384 N -3.27 3.53 0.00 1.90 5.04 -1.26 -4.97 117.35 118.32 3msm s TYR 384 Ca 0.58 0.46 0.00 0.00 -2.44 0.00 0.00 57.07 55.67 3msm s TYR 384 Cb -0.12 -1.99 0.00 0.00 0.35 0.00 0.00 41.96 40.20 3msm s TYR 384 CO 0.53 0.61 0.00 0.09 -1.34 0.00 0.00 175.55 175.44 3msm n ASN 385 N 2.40 0.00 0.00 4.32 3.02 -1.26 -5.07 115.26 118.67 3msm n ASN 385 Ca -0.19 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.36 3msm n ASN 385 Cb 0.54 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.71 3msm n ASN 385 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64