#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m7n n GLU 9 N 0.00 0.00 -4.41 -0.52 4.71 -1.26 -4.85 120.64 114.32 3m7n n GLU 9 Ca 0.00 0.06 -0.29 0.00 -0.01 0.00 0.00 57.16 56.93 3m7n n GLU 9 Cb 0.00 -0.89 -0.13 0.00 -1.01 0.00 0.00 31.44 29.41 3m7n n GLU 9 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 3m7n s LYS 10 N -0.78 1.40 0.11 3.49 1.02 -1.26 -5.03 119.74 118.68 3m7n s LYS 10 Ca 0.00 -1.33 0.21 0.00 0.02 0.00 0.00 55.97 54.88 3m7n s LYS 10 Cb 0.00 -1.87 -0.12 0.00 -0.52 0.00 0.00 37.83 35.32 3m7n s LYS 10 CO 0.00 0.44 0.83 1.28 -0.92 0.00 0.00 175.35 176.98 3m7n n LEU 11 N 0.96 0.59 -4.02 3.17 4.77 -1.26 -4.88 117.00 116.34 3m7n n LEU 11 Ca -0.18 0.24 -0.23 0.00 -0.03 0.00 0.00 56.01 55.81 3m7n n LEU 11 Cb 0.53 -0.01 -0.16 0.00 -2.33 0.00 0.00 43.42 41.45 3m7n n LEU 11 CO 0.23 -0.07 -0.45 -0.63 -1.33 0.00 0.00 177.39 175.14 3m7n s ILE 12 N -3.31 0.97 -0.11 -0.08 1.01 -1.26 -2.97 121.20 115.45 3m7n s ILE 12 Ca -0.03 -0.43 -0.03 0.00 0.00 0.00 0.00 60.65 60.16 3m7n s ILE 12 Cb 0.10 -0.88 0.05 0.00 0.01 0.00 0.00 42.46 41.74 3m7n s ILE 12 CO 0.83 0.31 0.12 0.68 0.00 0.00 0.00 174.94 176.88 3m7n s VAL 13 N 0.42 -0.18 -1.41 2.92 -7.23 -0.30 -4.81 120.40 109.80 3m7n s VAL 13 Ca -0.08 0.19 -0.03 0.00 -1.81 0.00 0.00 61.98 60.25 3m7n s VAL 13 Cb -0.12 -0.37 0.00 0.00 0.56 0.00 0.00 36.38 36.45 3m7n s VAL 13 CO 0.02 0.01 0.34 0.47 -0.31 0.00 0.00 175.10 175.63 3m7n n ASP 14 N 5.31 -5.42 -0.40 4.85 8.00 -1.26 -1.83 116.55 125.81 3m7n n ASP 14 Ca -0.05 -0.17 -0.05 0.00 0.71 0.00 0.00 54.79 55.23 3m7n n ASP 14 Cb 0.50 -4.33 -0.02 0.00 -0.02 0.00 0.00 41.12 37.24 3m7n n ASP 14 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3m7n n GLY 15 N -1.28 0.75 3.36 0.44 0.00 -1.26 -5.01 105.19 102.18 3m7n n GLY 15 Ca -0.14 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.17 3m7n n GLY 15 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m7n s LEU 16 N -1.17 2.23 0.67 0.99 1.43 -0.76 -4.48 118.68 117.59 3m7n s LEU 16 Ca 0.00 -0.52 -0.05 0.00 -1.03 0.00 0.00 54.13 52.53 3m7n s LEU 16 Cb 0.00 -1.35 0.05 0.00 0.03 0.00 0.00 46.19 44.92 3m7n s LEU 16 CO 0.00 0.28 0.97 -0.13 0.23 0.00 0.00 176.35 177.70 3m7n s ARG 17 N -1.08 2.33 0.57 1.70 0.52 -0.01 -1.15 118.95 121.83 3m7n s ARG 17 Ca 0.12 -0.30 0.34 0.00 -0.52 0.00 0.00 55.73 55.37 3m7n s ARG 17 Cb -0.10 -2.23 1.45 0.00 0.52 0.00 0.00 34.95 34.59 3m7n s ARG 17 CO 0.02 -1.10 1.74 -0.07 0.02 0.00 0.00 175.30 175.91 3m7n h LEU 18 N -0.45 0.00 -1.80 2.53 4.07 -1.87 0.27 115.31 118.06 3m7n h LEU 18 Ca -0.44 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.52 3m7n h LEU 18 Cb 1.31 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.05 3m7n h LEU 18 CO 0.59 0.00 0.00 -0.90 -1.08 0.00 0.00 178.44 177.05 3m7n n ASP 19 N -3.89 2.60 0.00 -0.43 5.75 -1.26 -4.95 116.55 114.37 3m7n n ASP 19 Ca 0.21 -1.78 0.00 0.00 -0.01 0.00 0.00 54.79 53.22 3m7n n ASP 19 Cb 1.16 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 41.22 3m7n n ASP 19 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3m7n n GLY 20 N 1.03 0.46 3.81 6.12 0.00 0.95 -5.07 105.19 112.49 3m7n n GLY 20 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 3m7n n GLY 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3m7n s ARG 21 N -0.97 3.81 0.64 1.61 0.52 -1.26 -4.62 118.95 118.69 3m7n s ARG 21 Ca 0.00 1.26 -0.09 0.00 -0.52 0.00 0.00 55.73 56.38 3m7n s ARG 21 Cb 0.00 -2.10 0.00 0.00 0.52 0.00 0.00 34.95 33.37 3m7n s ARG 21 CO 0.00 -0.41 1.00 0.15 0.02 0.00 0.00 175.30 176.06 3m7n s LYS 22 N -3.42 3.00 0.58 3.54 1.02 -1.26 -0.83 119.74 122.37 3m7n s LYS 22 Ca 0.65 0.31 0.28 0.00 0.02 0.00 0.00 55.97 57.23 3m7n s LYS 22 Cb -0.14 -2.14 1.53 0.00 -0.52 0.00 0.00 37.83 36.55 3m7n s LYS 22 CO 0.22 -0.81 1.98 0.27 -0.92 0.00 0.00 175.35 176.09 3m7n h PHE 23 N -0.39 0.00 -0.32 3.18 -0.00 -1.88 -2.42 116.94 115.11 3m7n h PHE 23 Ca -0.45 0.00 -0.14 0.00 -0.00 0.00 0.00 57.97 57.38 3m7n h PHE 23 Cb 1.24 0.00 -0.08 0.00 -0.00 0.00 0.00 35.95 37.11 3m7n h PHE 23 CO 0.51 0.00 -0.07 -0.40 -0.00 0.00 0.00 178.31 178.35 3m7n n ASP 24 N -3.85 2.67 -4.27 -0.68 5.75 -1.26 -0.27 116.55 114.65 3m7n n ASP 24 Ca 0.06 -3.63 -0.33 0.00 -0.01 0.00 0.00 54.79 50.88 3m7n n ASP 24 Cb 0.54 -0.61 -0.16 0.00 -1.03 0.00 0.00 41.12 39.86 3m7n n ASP 24 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 3m7n s GLU 25 N -3.17 3.17 0.60 0.11 2.12 -0.91 -4.92 118.70 115.71 3m7n s GLU 25 Ca 0.44 -0.80 -0.18 0.00 0.36 0.00 0.00 54.97 54.79 3m7n s GLU 25 Cb 0.39 -2.47 -0.03 0.00 0.26 0.00 0.00 34.13 32.28 3m7n s GLU 25 CO 0.01 0.13 1.14 -0.51 -0.54 0.00 0.00 175.26 175.50 3m7n s LEU 26 N 0.49 3.58 0.87 2.70 1.43 -1.26 -4.78 118.68 121.72 3m7n s LEU 26 Ca -0.13 2.17 -0.11 0.00 -1.03 0.00 0.00 54.13 55.03 3m7n s LEU 26 Cb -0.17 -4.57 0.11 0.00 0.03 0.00 0.00 46.19 41.59 3m7n s LEU 26 CO 0.05 -1.50 1.09 -0.13 0.23 0.00 0.00 176.35 176.10 3m7n s ARG 27 N -3.61 1.47 0.35 1.70 0.52 -1.26 -4.97 118.95 113.15 3m7n s ARG 27 Ca 0.72 1.03 -0.29 0.00 -0.52 0.00 0.00 55.73 56.67 3m7n s ARG 27 Cb -0.24 -1.82 -0.11 0.00 0.52 0.00 0.00 34.95 33.30 3m7n s ARG 27 CO 0.34 -2.15 1.53 -2.30 0.02 0.00 0.00 175.30 172.73 3m7n n PRO 28 N -3.85 2.69 -4.77 3.54 -0.02 -1.26 -4.63 135.00 126.70 3m7n n PRO 28 Ca 0.08 0.95 -0.24 0.00 -2.02 0.00 0.00 63.50 62.27 3m7n n PRO 28 Cb 0.54 -2.70 -0.15 0.00 -0.02 0.00 0.00 33.50 31.17 3m7n n PRO 28 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3m7n s ILE 29 N -0.75 1.29 -0.05 4.25 1.01 -1.26 -1.64 121.20 124.04 3m7n s ILE 29 Ca 0.57 -0.68 0.03 0.00 0.00 0.00 0.00 60.65 60.56 3m7n s ILE 29 Cb -0.48 -1.08 0.00 0.00 0.01 0.00 0.00 42.46 40.91 3m7n s ILE 29 CO 0.59 0.37 -0.15 -0.54 0.00 0.00 0.00 174.94 175.21 3m7n s LYS 30 N -0.29 1.72 -0.07 2.79 1.02 -0.64 -4.98 119.74 119.30 3m7n s LYS 30 Ca 0.04 -0.51 0.02 0.00 0.02 0.00 0.00 55.97 55.55 3m7n s LYS 30 Cb -0.07 -1.46 0.01 0.00 -0.52 0.00 0.00 37.83 35.80 3m7n s LYS 30 CO -0.00 0.13 -0.12 0.42 -0.92 0.00 0.00 175.35 174.86 3m7n s ILE 31 N 0.33 1.15 -0.06 2.17 1.01 -1.26 -1.11 121.20 123.43 3m7n s ILE 31 Ca -0.09 -0.49 -0.00 0.00 0.00 0.00 0.00 60.65 60.07 3m7n s ILE 31 Cb -0.13 -1.05 0.02 0.00 0.01 0.00 0.00 42.46 41.32 3m7n s ILE 31 CO 0.03 0.36 -0.03 -1.61 0.00 0.00 0.00 174.94 173.69 3m7n s GLU 32 N 0.65 0.79 0.38 2.79 0.41 -0.18 -4.70 118.70 118.84 3m7n s GLU 32 Ca -0.15 -0.02 0.01 0.00 -0.41 0.00 0.00 54.97 54.41 3m7n s GLU 32 Cb -0.16 -0.98 -0.02 0.00 -1.78 0.00 0.00 34.13 31.20 3m7n s GLU 32 CO 0.04 -0.21 0.58 0.00 -0.49 0.00 0.00 175.26 175.18 3m7n s ALA 33 N 1.50 3.77 -0.95 5.21 0.00 -1.26 -0.20 121.76 129.83 3m7n s ALA 33 Ca -0.02 -1.02 -0.07 0.00 0.00 0.00 0.00 51.96 50.85 3m7n s ALA 33 Cb -0.13 -2.07 -0.03 0.00 0.00 0.00 0.00 23.12 20.89 3m7n s ALA 33 CO -0.03 -0.14 0.79 0.43 0.00 0.00 0.00 175.76 176.81 3m7n n SER 34 N -1.86 -6.53 -0.14 0.00 7.64 -0.36 -4.91 113.62 107.46 3m7n n SER 34 Ca -0.02 -0.61 0.05 0.00 1.01 0.00 0.00 58.87 59.30 3m7n n SER 34 Cb 0.57 -4.45 -0.02 0.00 -1.01 0.00 0.00 64.21 59.29 3m7n n SER 34 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 3m7n n VAL 35 N -2.94 0.00 -4.74 0.44 0.24 -1.26 -4.97 118.33 105.10 3m7n n VAL 35 Ca -0.08 -0.34 -0.31 0.00 -2.04 0.00 0.00 64.34 61.57 3m7n n VAL 35 Cb 0.58 1.07 -0.17 0.00 -1.47 0.00 0.00 33.84 33.86 3m7n n VAL 35 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3m7n s LEU 36 N -1.99 2.01 0.09 1.34 1.43 -1.26 -5.02 118.68 115.28 3m7n s LEU 36 Ca 0.07 -0.55 -0.15 0.00 -1.03 0.00 0.00 54.13 52.47 3m7n s LEU 36 Cb 0.08 -1.34 -0.14 0.00 0.03 0.00 0.00 46.19 44.82 3m7n s LEU 36 CO 0.32 0.08 1.32 0.50 0.23 0.00 0.00 176.35 178.80 3m7n h LYS 37 N 7.20 0.70 -2.70 1.70 3.64 -2.00 -3.35 116.57 121.76 3m7n h LYS 37 Ca -0.29 -0.51 -0.80 0.00 -1.27 0.00 0.00 60.65 57.78 3m7n h LYS 37 Cb 1.20 0.08 -0.25 0.00 -0.41 0.00 0.00 32.23 32.85 3m7n h LYS 37 CO 0.52 1.13 1.17 0.54 -2.27 0.00 0.00 179.45 180.54 3m7n n ARG 38 N -4.11 4.77 -3.57 1.90 5.12 -1.26 -4.85 116.66 114.65 3m7n n ARG 38 Ca -0.06 -4.39 -0.09 0.00 -1.93 0.00 0.00 57.85 51.38 3m7n n ARG 38 Cb 0.63 -2.55 -0.04 0.00 -1.16 0.00 0.00 32.46 29.33 3m7n n ARG 38 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3m7n s ALA 39 N -2.88 -1.94 0.05 7.54 0.00 -1.26 -5.05 121.76 118.22 3m7n s ALA 39 Ca 0.37 1.53 0.19 0.00 0.00 0.00 0.00 51.96 54.05 3m7n s ALA 39 Cb 0.12 -0.57 0.55 0.00 0.00 0.00 0.00 23.12 23.22 3m7n s ALA 39 CO -0.01 -0.38 1.67 -0.44 0.00 0.00 0.00 175.76 176.60 3m7n h ASP 40 N 2.40 0.00 -5.00 0.00 3.32 -1.53 -3.46 116.42 112.16 3m7n h ASP 40 Ca -0.17 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.83 3m7n h ASP 40 Cb 1.18 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 40.56 3m7n h ASP 40 CO 0.30 0.37 0.20 -0.83 -1.72 0.00 0.00 179.24 177.55 3m7n s GLY 41 N -4.37 -0.59 0.10 2.75 0.00 -1.16 -4.01 107.32 100.04 3m7n s GLY 41 Ca 0.02 0.98 -0.26 0.00 0.00 0.00 0.00 44.72 45.46 3m7n s GLY 41 CO 0.69 0.63 0.83 -1.35 0.00 0.00 0.00 173.10 173.90 3m7n s SER 42 N -1.83 -0.34 -0.28 1.64 1.04 -1.24 -1.00 113.70 111.68 3m7n s SER 42 Ca -0.06 -0.18 -0.18 0.00 0.48 0.00 0.00 55.95 56.00 3m7n s SER 42 Cb -0.00 0.50 0.09 0.00 0.10 0.00 0.00 66.02 66.70 3m7n s SER 42 CO 0.01 -0.85 0.74 0.00 0.98 0.00 0.00 173.24 174.12 3m7n s TYR 44 N 1.27 3.38 -0.10 0.00 5.04 0.73 -0.53 117.35 127.14 3m7n s TYR 44 Ca -0.07 0.33 -0.04 0.00 -2.44 0.00 0.00 57.07 54.84 3m7n s TYR 44 Cb -0.05 -1.92 0.05 0.00 0.35 0.00 0.00 41.96 40.38 3m7n s TYR 44 CO -0.14 0.52 0.21 -1.17 -1.34 0.00 0.00 175.55 173.63 3m7n s LEU 45 N -0.67 0.37 -0.10 6.97 1.98 -0.14 -1.01 118.68 126.10 3m7n s LEU 45 Ca 0.12 0.46 -0.00 0.00 -2.89 0.00 0.00 54.13 51.81 3m7n s LEU 45 Cb -0.12 0.59 -0.03 0.00 0.66 0.00 0.00 46.19 47.30 3m7n s LEU 45 CO 0.02 -0.18 -0.09 -1.61 -1.89 0.00 0.00 176.35 172.61 3m7n s GLU 46 N 1.45 3.06 -0.25 1.98 2.02 -0.26 -0.54 118.70 126.16 3m7n s GLU 46 Ca -0.07 -0.59 -0.04 0.00 0.02 0.00 0.00 54.97 54.28 3m7n s GLU 46 Cb -0.11 -2.64 0.09 0.00 0.10 0.00 0.00 34.13 31.57 3m7n s GLU 46 CO -0.08 0.47 0.12 1.41 0.02 0.00 0.00 175.26 177.20 3m7n s MET 47 N -0.28 0.15 6.79 1.61 1.75 -0.69 -1.63 119.30 127.01 3m7n s MET 47 Ca 0.03 -0.36 0.00 0.00 -1.25 0.00 0.00 55.69 54.11 3m7n s MET 47 Cb -0.13 -1.35 0.00 0.00 2.84 0.00 0.00 34.83 36.19 3m7n s MET 47 CO 0.03 -0.90 0.00 0.41 -0.65 0.00 0.00 175.02 173.90 3m7n n GLY 48 N 5.26 3.53 0.49 2.11 0.00 -0.65 -0.92 105.19 115.01 3m7n n GLY 48 Ca -0.06 -0.05 0.09 0.00 0.00 0.00 0.00 46.02 45.99 3m7n n GLY 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3m7n n LYS 49 N 14.00 1.63 -2.50 1.61 5.02 -1.26 -4.85 118.16 131.82 3m7n n LYS 49 Ca 0.00 -0.96 -0.42 0.00 -2.02 0.00 0.00 58.31 54.92 3m7n n LYS 49 Cb 0.00 -1.33 -0.03 0.00 -0.02 0.00 0.00 35.03 33.65 3m7n n LYS 49 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3m7n s ASN 50 N -1.39 7.19 -0.18 4.39 0.01 -0.09 -4.37 114.94 120.50 3m7n s ASN 50 Ca 0.28 2.00 0.01 0.00 -0.71 0.00 0.00 52.86 54.43 3m7n s ASN 50 Cb 0.15 -2.59 0.03 0.00 0.41 0.00 0.00 41.25 39.25 3m7n s ASN 50 CO 0.22 -0.34 -0.16 -0.54 -1.51 0.00 0.00 177.10 174.76 3m7n s LYS 51 N 0.49 2.58 0.08 -0.60 1.02 0.49 -1.70 119.74 122.10 3m7n s LYS 51 Ca 0.54 -0.83 0.04 0.00 0.02 0.00 0.00 55.97 55.75 3m7n s LYS 51 Cb -0.28 -2.47 -0.03 0.00 -0.52 0.00 0.00 37.83 34.53 3m7n s LYS 51 CO 0.31 -0.29 -0.12 0.14 -0.92 0.00 0.00 175.35 174.47 3m7n s VAL 52 N 1.33 0.98 -0.05 3.17 -7.23 0.30 -0.39 120.40 118.51 3m7n s VAL 52 Ca 0.02 -1.39 0.02 0.00 -1.81 0.00 0.00 61.98 58.82 3m7n s VAL 52 Cb -0.14 -1.10 0.02 0.00 0.56 0.00 0.00 36.38 35.71 3m7n s VAL 52 CO -0.11 -0.36 -0.08 -0.51 -0.31 0.00 0.00 175.10 173.73 3m7n s ILE 53 N -1.68 0.83 0.02 -0.62 -1.16 0.13 -0.96 121.20 117.76 3m7n s ILE 53 Ca -0.01 -0.30 0.09 0.00 -0.51 0.00 0.00 60.65 59.92 3m7n s ILE 53 Cb -0.08 -0.79 -0.03 0.00 0.61 0.00 0.00 42.46 42.18 3m7n s ILE 53 CO 0.01 0.29 -0.26 0.00 -2.81 0.00 0.00 174.94 172.17 3m7n s ALA 54 N 0.76 2.25 -0.01 1.50 0.00 0.31 -0.51 121.76 126.06 3m7n s ALA 54 Ca -0.13 -1.22 0.01 0.00 0.00 0.00 0.00 51.96 50.62 3m7n s ALA 54 Cb -0.15 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.46 3m7n s ALA 54 CO 0.02 0.54 -0.02 0.00 0.00 0.00 0.00 175.76 176.29 3m7n s ALA 55 N -0.75 0.27 -0.08 0.00 0.00 0.11 -1.94 121.76 119.37 3m7n s ALA 55 Ca 0.11 -0.04 0.05 0.00 0.00 0.00 0.00 51.96 52.08 3m7n s ALA 55 Cb -0.10 -0.14 -0.01 0.00 0.00 0.00 0.00 23.12 22.87 3m7n s ALA 55 CO 0.01 0.02 -0.22 0.08 0.00 0.00 0.00 175.76 175.65 3m7n s VAL 56 N 0.26 2.28 -0.12 0.00 1.01 -0.17 -0.31 120.40 123.34 3m7n s VAL 56 Ca -0.02 -0.97 -0.01 0.00 0.00 0.00 0.00 61.98 60.98 3m7n s VAL 56 Cb -0.05 -1.86 0.03 0.00 0.00 0.00 0.00 36.38 34.50 3m7n s VAL 56 CO -0.01 0.56 -0.06 -0.36 0.00 0.00 0.00 175.10 175.24 3m7n s PHE 57 N -0.04 1.41 0.00 5.22 0.40 0.20 -1.30 117.98 123.87 3m7n s PHE 57 Ca -0.06 -0.73 0.00 0.00 -0.60 0.00 0.00 56.93 55.53 3m7n s PHE 57 Cb -0.15 -1.19 0.00 0.00 0.51 0.00 0.00 43.02 42.19 3m7n s PHE 57 CO 0.05 -0.51 0.00 0.41 0.70 0.00 0.00 175.22 175.87 3m7n n GLY 58 N 4.96 1.37 3.66 4.36 0.00 -1.26 -0.56 105.19 117.72 3m7n n GLY 58 Ca -0.12 -1.86 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 3m7n n GLY 58 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3m7n s PRO 59 N -1.28 4.19 0.48 1.61 0.02 -1.26 -4.96 135.00 133.80 3m7n s PRO 59 Ca 0.00 2.18 0.06 0.00 0.02 0.00 0.00 61.00 63.26 3m7n s PRO 59 Cb 0.00 -3.92 -0.01 0.00 0.02 0.00 0.00 34.50 30.59 3m7n s PRO 59 CO 0.00 -0.81 0.25 -0.98 -0.33 0.00 0.00 177.00 175.12 3m7n s ARG 60 N 3.78 2.25 0.58 5.54 1.70 -0.67 -4.93 118.95 127.20 3m7n s ARG 60 Ca 0.72 -1.98 -0.17 0.00 -0.47 0.00 0.00 55.73 53.83 3m7n s ARG 60 Cb -0.34 -1.97 -0.04 0.00 -0.57 0.00 0.00 34.95 32.03 3m7n s ARG 60 CO 0.29 -0.35 1.07 -1.83 -1.08 0.00 0.00 175.30 173.41 3m7n s GLU 61 N -4.05 3.32 -0.27 3.89 1.03 -1.26 -1.81 118.70 119.55 3m7n s GLU 61 Ca 0.33 1.32 -0.12 0.00 0.03 0.00 0.00 54.97 56.53 3m7n s GLU 61 Cb 0.01 -2.03 -0.05 0.00 -0.80 0.00 0.00 34.13 31.27 3m7n s GLU 61 CO 0.19 -0.82 0.23 0.54 -1.33 0.00 0.00 175.26 174.07 3m7n s VAL 62 N -2.25 5.29 -0.14 1.83 0.11 -1.26 -4.63 120.40 119.35 3m7n s VAL 62 Ca 0.66 0.28 0.00 0.00 -2.93 0.00 0.00 61.98 59.99 3m7n s VAL 62 Cb -0.18 -3.57 -0.01 0.00 -1.53 0.00 0.00 36.38 31.10 3m7n s VAL 62 CO 0.33 0.25 -0.14 -1.00 -3.33 0.00 0.00 175.10 171.21 3m7n s HIS 63 N 1.67 2.79 0.66 1.54 3.76 -1.26 -3.38 115.29 121.06 3m7n s HIS 63 Ca 0.09 -0.83 -0.11 0.00 -0.15 0.00 0.00 55.06 54.07 3m7n s HIS 63 Cb -0.15 -1.86 -0.01 0.00 1.11 0.00 0.00 32.58 31.66 3m7n s HIS 63 CO 0.09 -0.33 1.05 -2.14 -0.85 0.00 0.00 174.74 172.56 3m7n s PRO 64 N 0.56 3.22 0.00 8.40 0.02 -1.26 -4.99 135.00 140.95 3m7n s PRO 64 Ca -0.09 0.75 0.00 0.00 0.02 0.00 0.00 61.00 61.68 3m7n s PRO 64 Cb -0.16 -2.04 0.00 0.00 0.02 0.00 0.00 34.50 32.32 3m7n s PRO 64 CO 0.04 -0.85 0.46 0.39 -0.33 0.00 0.00 177.00 176.71 3m7n n GLU 65 N -2.93 0.00 -0.00 5.54 1.02 -1.22 -2.21 120.64 120.84 3m7n n GLU 65 Ca 0.07 0.00 0.07 0.00 -0.02 0.00 0.00 57.16 57.28 3m7n n GLU 65 Cb 0.54 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 30.37 3m7n n GLU 65 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 3m7n n HIS 66 N -0.95 0.00 1.38 -0.32 1.44 -1.26 -4.11 115.22 111.39 3m7n n HIS 66 Ca 0.00 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 55.85 3m7n n HIS 66 Cb 0.00 -0.20 0.74 0.00 0.12 0.00 0.00 29.99 30.64 3m7n n HIS 66 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3m7n n LEU 67 N -1.74 0.00 -4.74 2.39 4.77 -0.94 -4.87 117.00 111.87 3m7n n LEU 67 Ca -0.01 0.29 -0.42 0.00 -0.03 0.00 0.00 56.01 55.84 3m7n n LEU 67 Cb 0.32 -0.29 -0.00 0.00 -2.33 0.00 0.00 43.42 41.12 3m7n n LEU 67 CO 0.30 -0.01 1.06 1.67 -1.33 0.00 0.00 177.39 179.08 3m7n n GLN 68 N -1.29 2.45 -4.20 3.23 7.27 -1.26 -4.94 117.38 118.65 3m7n n GLN 68 Ca 0.14 0.86 -0.34 0.00 0.07 0.00 0.00 57.00 57.73 3m7n n GLN 68 Cb 0.23 -2.54 -0.15 0.00 2.41 0.00 0.00 30.24 30.20 3m7n n GLN 68 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 3m7n s ASP 69 N -0.12 3.87 0.24 1.69 -1.08 -1.26 -5.01 116.67 115.00 3m7n s ASP 69 Ca 0.56 -0.45 0.24 0.00 -0.52 0.00 0.00 52.55 52.37 3m7n s ASP 69 Cb -0.52 -1.63 0.93 0.00 -1.46 0.00 0.00 42.92 40.25 3m7n s ASP 69 CO 0.61 0.03 1.73 -0.81 0.52 0.00 0.00 175.17 177.26 3m7n n PRO 70 N 4.42 0.21 0.00 4.34 -0.04 -1.26 -0.75 135.00 141.93 3m7n n PRO 70 Ca -0.19 0.36 0.05 0.00 -0.04 0.00 0.00 63.50 63.68 3m7n n PRO 70 Cb 0.51 -1.85 -0.04 0.00 -0.04 0.00 0.00 33.50 32.08 3m7n n PRO 70 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3m7n n SER 71 N -2.24 0.74 -3.60 3.54 3.41 -1.26 -4.54 113.62 109.67 3m7n n SER 71 Ca 0.03 -0.87 -0.07 0.00 -0.26 0.00 0.00 58.87 57.70 3m7n n SER 71 Cb 0.29 0.85 -0.02 0.00 -0.26 0.00 0.00 64.21 65.07 3m7n n SER 71 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 3m7n s LYS 72 N -1.88 1.02 0.53 4.33 -2.85 -1.18 -4.62 119.74 115.10 3m7n s LYS 72 Ca 0.06 -0.47 -0.22 0.00 -1.00 0.00 0.00 55.97 54.35 3m7n s LYS 72 Cb 0.09 0.41 -0.05 0.00 -2.06 0.00 0.00 37.83 36.21 3m7n s LYS 72 CO 0.40 -0.46 1.27 0.00 0.10 0.00 0.00 175.35 176.66 3m7n s ALA 73 N -3.25 2.81 0.01 0.59 0.00 -0.10 -3.22 121.76 118.61 3m7n s ALA 73 Ca 0.08 1.14 -0.05 0.00 0.00 0.00 0.00 51.96 53.13 3m7n s ALA 73 Cb -0.01 -3.49 -0.05 0.00 0.00 0.00 0.00 23.12 19.57 3m7n s ALA 73 CO -0.05 -1.11 0.25 0.96 0.00 0.00 0.00 175.76 175.82 3m7n s ILE 74 N -1.43 5.33 -0.16 0.00 -4.36 0.13 -4.88 121.20 115.82 3m7n s ILE 74 Ca 0.70 0.06 -0.04 0.00 -0.26 0.00 0.00 60.65 61.11 3m7n s ILE 74 Cb -0.35 -3.57 -0.03 0.00 1.25 0.00 0.00 42.46 39.77 3m7n s ILE 74 CO 0.41 0.33 -0.01 -0.63 0.24 0.00 0.00 174.94 175.27 3m7n s ILE 75 N -1.34 4.15 0.05 8.37 -1.09 -1.26 -0.55 121.20 129.53 3m7n s ILE 75 Ca 0.29 -0.27 0.07 0.00 -2.23 0.00 0.00 60.65 58.50 3m7n s ILE 75 Cb -0.13 -2.83 -0.02 0.00 -1.58 0.00 0.00 42.46 37.90 3m7n s ILE 75 CO 0.18 0.49 -0.19 -0.13 -1.23 0.00 0.00 174.94 174.06 3m7n s ARG 76 N 0.26 1.26 -0.09 2.79 0.52 -0.82 -4.97 118.95 117.91 3m7n s ARG 76 Ca -0.01 -0.91 -0.04 0.00 -0.52 0.00 0.00 55.73 54.26 3m7n s ARG 76 Cb -0.13 -1.36 0.05 0.00 0.52 0.00 0.00 34.95 34.02 3m7n s ARG 76 CO 0.02 0.34 0.18 -0.47 0.02 0.00 0.00 175.30 175.39 3m7n s TYR 77 N -0.83 -0.22 -0.16 -0.53 5.04 -1.26 -1.01 117.35 118.39 3m7n s TYR 77 Ca 0.06 0.63 0.01 0.00 -2.44 0.00 0.00 57.07 55.33 3m7n s TYR 77 Cb -0.09 -0.14 0.02 0.00 0.35 0.00 0.00 41.96 42.10 3m7n s TYR 77 CO 0.02 -0.24 -0.17 0.50 -1.34 0.00 0.00 175.55 174.32 3m7n s ARG 78 N 1.81 2.63 -0.24 4.97 3.52 -0.30 -4.67 118.95 126.67 3m7n s ARG 78 Ca -0.03 -0.69 -0.10 0.00 -0.13 0.00 0.00 55.73 54.79 3m7n s ARG 78 Cb -0.12 -2.30 -0.05 0.00 -1.56 0.00 0.00 34.95 30.92 3m7n s ARG 78 CO -0.06 -0.20 0.13 -0.47 -0.81 0.00 0.00 175.30 173.89 3m7n s TYR 79 N 1.32 3.26 -0.02 5.12 5.04 -1.26 -0.76 117.35 130.06 3m7n s TYR 79 Ca 0.03 0.10 0.01 0.00 -2.44 0.00 0.00 57.07 54.77 3m7n s TYR 79 Cb -0.13 -2.25 0.01 0.00 0.35 0.00 0.00 41.96 39.95 3m7n s TYR 79 CO -0.10 0.00 -0.02 1.21 -1.34 0.00 0.00 175.55 175.30 3m7n s ASN 80 N 1.09 0.46 -0.31 4.32 2.47 -0.70 -4.85 114.94 117.42 3m7n s ASN 80 Ca 0.06 -0.05 -0.13 0.00 0.42 0.00 0.00 52.86 53.17 3m7n s ASN 80 Cb -0.14 -0.17 -0.03 0.00 -1.45 0.00 0.00 41.25 39.46 3m7n s ASN 80 CO 0.04 -0.04 0.24 -0.04 -3.72 0.00 0.00 177.10 173.59 3m7n s MET 81 N 0.57 3.70 0.55 0.43 -1.94 -1.26 -1.04 119.30 120.31 3m7n s MET 81 Ca -0.06 -0.46 -0.21 0.00 -1.71 0.00 0.00 55.69 53.25 3m7n s MET 81 Cb -0.09 -3.74 -0.05 0.00 2.01 0.00 0.00 34.83 32.96 3m7n s MET 81 CO -0.01 -0.35 1.34 0.00 -0.01 0.00 0.00 175.02 176.00 3m7n s ALA 82 N 1.79 2.79 0.47 3.03 0.00 -0.57 -4.87 121.76 124.39 3m7n s ALA 82 Ca 0.08 1.31 0.19 0.00 0.00 0.00 0.00 51.96 53.53 3m7n s ALA 82 Cb -0.17 -3.56 1.18 0.00 0.00 0.00 0.00 23.12 20.57 3m7n s ALA 82 CO 0.11 -1.36 1.96 -1.35 0.00 0.00 0.00 175.76 175.11 3m7n h PRO 83 N 1.40 0.25 -0.21 0.00 0.11 -1.90 -1.47 132.00 130.19 3m7n h PRO 83 Ca -0.51 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3m7n h PRO 83 Cb 1.30 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3m7n h PRO 83 CO 0.57 0.17 0.00 1.97 -0.21 0.00 0.00 178.00 180.50 3m7n n PHE 84 N -4.44 0.26 0.94 0.65 -1.74 -1.26 -1.94 117.46 109.93 3m7n n PHE 84 Ca 0.12 -0.13 0.14 0.00 -0.56 0.00 0.00 57.45 57.01 3m7n n PHE 84 Cb 0.54 0.00 0.54 0.00 1.52 0.00 0.00 39.48 42.08 3m7n n PHE 84 CO 0.00 0.00 0.00 -1.13 -0.56 0.00 0.00 176.76 175.07 3m7n n SER 85 N 0.60 0.18 -4.54 5.98 3.41 -0.55 -4.87 113.62 113.82 3m7n n SER 85 Ca 0.17 0.43 -0.26 0.00 -0.26 0.00 0.00 58.87 58.95 3m7n n SER 85 Cb 0.40 -0.45 -0.11 0.00 -0.26 0.00 0.00 64.21 63.79 3m7n n SER 85 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3m7n s VAL 86 N -3.02 2.08 0.17 -3.33 -7.23 -1.26 -0.87 120.40 106.95 3m7n s VAL 86 Ca 0.13 -2.14 -0.14 0.00 -1.81 0.00 0.00 61.98 58.01 3m7n s VAL 86 Cb 0.18 -2.71 0.06 0.00 0.56 0.00 0.00 36.38 34.47 3m7n s VAL 86 CO 0.56 -0.16 1.83 -0.33 -0.31 0.00 0.00 175.10 176.69 3m7n h GLU 87 N 2.00 0.63 -5.37 4.82 5.08 -1.93 -3.38 114.58 116.43 3m7n h GLU 87 Ca -0.42 -0.04 -0.65 0.00 -1.00 0.00 0.00 59.36 57.26 3m7n h GLU 87 Cb 1.25 -0.14 -0.23 0.00 0.50 0.00 0.00 28.75 30.13 3m7n h GLU 87 CO 0.72 0.42 -0.69 -1.21 -1.00 0.00 0.00 179.01 177.25 3m7n s GLU 88 N -6.15 3.53 -0.23 2.33 2.02 -1.26 -5.06 118.70 113.88 3m7n s GLU 88 Ca -0.13 -0.57 -0.43 0.00 0.02 0.00 0.00 54.97 53.87 3m7n s GLU 88 Cb 0.12 -2.81 -0.20 0.00 0.10 0.00 0.00 34.13 31.34 3m7n s GLU 88 CO 0.74 0.27 1.36 -2.13 0.02 0.00 0.00 175.26 175.51 3m7n n ARG 89 N 3.43 0.12 -3.50 1.61 0.63 -1.26 -4.92 116.66 112.77 3m7n n ARG 89 Ca -0.18 0.05 -0.38 0.00 -0.92 0.00 0.00 57.85 56.42 3m7n n ARG 89 Cb 0.53 -1.56 -0.09 0.00 0.45 0.00 0.00 32.46 31.78 3m7n n ARG 89 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 3m7n s LYS 90 N 1.55 4.04 0.11 -0.14 2.20 -0.82 -5.03 119.74 121.66 3m7n s LYS 90 Ca 0.97 -0.08 -0.31 0.00 -0.36 0.00 0.00 55.97 56.19 3m7n s LYS 90 Cb -1.34 -3.61 -0.10 0.00 -1.51 0.00 0.00 37.83 31.27 3m7n s LYS 90 CO 0.68 -0.14 1.74 0.50 -0.36 0.00 0.00 175.35 177.77 3m7n s ARG 91 N 1.64 4.16 1.12 4.03 3.52 -1.26 -4.29 118.95 127.87 3m7n s ARG 91 Ca 0.12 2.48 -0.12 0.00 -0.13 0.00 0.00 55.73 58.08 3m7n s ARG 91 Cb -0.15 -3.53 0.26 0.00 -1.56 0.00 0.00 34.95 29.96 3m7n s ARG 91 CO 0.09 -0.78 1.05 -2.14 -0.81 0.00 0.00 175.30 172.71 3m7n s PRO 92 N 2.50 -0.56 0.00 5.12 0.02 -1.26 -4.90 135.00 135.92 3m7n s PRO 92 Ca 0.77 1.03 0.00 0.00 0.02 0.00 0.00 61.00 62.82 3m7n s PRO 92 Cb -0.44 -1.58 0.00 0.00 0.02 0.00 0.00 34.50 32.50 3m7n s PRO 92 CO 0.34 -3.54 0.00 0.41 -0.33 0.00 0.00 177.00 173.88 3m7n n GLY 93 N 0.76 1.30 3.74 0.52 0.00 -1.26 -5.03 105.19 105.22 3m7n n GLY 93 Ca 0.05 -1.51 -0.37 0.00 0.00 0.00 0.00 46.02 44.19 3m7n n GLY 93 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3m7n s PRO 94 N -5.14 2.74 0.44 1.61 0.04 -1.26 -5.04 135.00 128.39 3m7n s PRO 94 Ca 0.00 2.08 0.01 0.00 0.04 0.00 0.00 61.00 63.13 3m7n s PRO 94 Cb 0.00 -1.95 -0.00 0.00 0.04 0.00 0.00 34.50 32.58 3m7n s PRO 94 CO 0.00 -1.46 0.04 -0.40 0.04 0.00 0.00 177.00 175.22 3m7n n ASP 95 N -1.66 2.66 -0.37 6.66 3.85 -1.26 -5.02 116.55 121.42 3m7n n ASP 95 Ca 0.14 -3.01 -0.02 0.00 -0.71 0.00 0.00 54.79 51.18 3m7n n ASP 95 Cb 0.47 0.51 0.10 0.00 -1.35 0.00 0.00 41.12 40.86 3m7n n ASP 95 CO 0.00 0.00 0.00 0.03 -1.01 0.00 0.00 177.20 176.22 3m7n h ARG 96 N 0.00 1.31 -0.40 0.11 3.08 -1.99 -1.89 114.38 114.59 3m7n h ARG 96 Ca -0.36 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 59.56 3m7n h ARG 96 Cb 1.15 -0.29 -0.02 0.00 0.08 0.00 0.00 29.97 30.89 3m7n h ARG 96 CO 0.58 0.88 0.09 -0.09 -1.07 0.00 0.00 179.97 180.36 3m7n h ARG 97 N 1.34 0.66 -0.34 0.04 2.43 -1.99 -1.02 114.38 115.49 3m7n h ARG 97 Ca 0.36 -0.16 -0.06 0.00 -0.81 0.00 0.00 59.98 59.31 3m7n h ARG 97 Cb -0.12 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.33 3m7n h ARG 97 CO -0.07 0.69 -0.02 0.77 -1.51 0.00 0.00 179.97 179.82 3m7n h SER 98 N 0.52 0.51 -0.20 -3.80 0.02 -1.79 -0.33 113.55 108.47 3m7n h SER 98 Ca 0.13 -0.10 -0.18 0.00 -0.84 0.00 0.00 61.79 60.79 3m7n h SER 98 Cb 0.33 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.74 3m7n h SER 98 CO 0.00 0.60 -0.56 0.40 -1.14 0.00 0.00 176.83 176.14 3m7n h ILE 99 N 0.51 1.29 -0.03 3.27 2.04 -1.03 0.10 117.51 123.65 3m7n h ILE 99 Ca 0.11 -1.76 -0.00 0.00 1.00 0.00 0.00 64.86 64.21 3m7n h ILE 99 Cb 0.37 1.67 -0.00 0.00 -0.74 0.00 0.00 36.82 38.12 3m7n h ILE 99 CO 0.01 0.57 0.01 -0.08 0.00 0.00 0.00 178.15 178.66 3m7n h GLU 100 N 0.61 0.05 -0.92 2.37 4.57 -0.85 -1.67 114.58 118.74 3m7n h GLU 100 Ca 0.01 -0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.21 3m7n h GLU 100 Cb 1.15 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.68 3m7n h GLU 100 CO 0.12 0.19 0.60 0.82 -1.18 0.00 0.00 179.01 179.56 3m7n h ILE 101 N -0.10 1.18 -0.50 2.32 2.04 -0.95 -1.77 117.51 119.73 3m7n h ILE 101 Ca 0.01 -0.41 -0.08 0.00 1.00 0.00 0.00 64.86 65.39 3m7n h ILE 101 Cb 0.16 -0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.11 3m7n h ILE 101 CO -0.00 0.22 0.01 0.28 0.00 0.00 0.00 178.15 178.65 3m7n h SER 102 N 1.19 0.81 0.08 1.72 0.02 -0.67 -1.45 113.55 115.25 3m7n h SER 102 Ca 0.36 -0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 61.10 3m7n h SER 102 Cb -0.04 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.28 3m7n h SER 102 CO -0.10 0.87 -0.04 0.50 -1.14 0.00 0.00 176.83 176.91 3m7n h LYS 103 N 0.78 -0.11 -0.47 3.45 3.64 -0.78 -0.93 116.57 122.15 3m7n h LYS 103 Ca 0.15 0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.43 3m7n h LYS 103 Cb 0.46 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 3m7n h LYS 103 CO 0.02 0.17 -0.12 -0.39 -2.27 0.00 0.00 179.45 176.86 3m7n h VAL 104 N -0.38 1.26 -0.66 2.00 -1.51 -1.22 -0.86 116.25 114.89 3m7n h VAL 104 Ca -0.01 -1.22 -0.02 0.00 -1.23 0.00 0.00 66.70 64.21 3m7n h VAL 104 Cb 0.32 1.03 -0.03 0.00 -2.13 0.00 0.00 31.29 30.48 3m7n h VAL 104 CO 0.02 0.42 0.33 0.28 -1.23 0.00 0.00 177.57 177.39 3m7n h SER 105 N 0.78 0.86 -0.15 4.19 0.02 -1.28 0.18 113.55 118.14 3m7n h SER 105 Ca 0.13 -0.13 0.03 0.00 -0.84 0.00 0.00 61.79 60.98 3m7n h SER 105 Cb 0.63 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 3m7n h SER 105 CO 0.04 0.74 -0.06 0.50 -1.14 0.00 0.00 176.83 176.92 3m7n h LYS 106 N 0.91 -0.03 -0.47 3.45 3.64 -0.76 -2.46 116.57 120.85 3m7n h LYS 106 Ca 0.23 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.58 3m7n h LYS 106 Cb 0.10 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 3m7n h LYS 106 CO -0.03 -0.02 0.17 0.93 -2.27 0.00 0.00 179.45 178.23 3m7n h GLU 107 N -0.03 0.67 -0.59 1.90 5.08 -0.43 -0.74 114.58 120.45 3m7n h GLU 107 Ca 0.08 -0.10 0.08 0.00 -1.00 0.00 0.00 59.36 58.42 3m7n h GLU 107 Cb 0.15 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 3m7n h GLU 107 CO -0.18 0.57 0.39 0.00 -1.00 0.00 0.00 179.01 178.80 3m7n h ALA 108 N 1.52 1.91 0.00 3.43 0.00 -0.19 -2.87 119.26 123.06 3m7n h ALA 108 Ca 0.16 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 3m7n h ALA 108 Cb 0.16 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3m7n h ALA 108 CO -0.01 -0.02 -1.54 1.19 0.00 0.00 0.00 179.25 178.87 3m7n n PHE 109 N -4.48 0.56 0.32 0.00 3.01 -0.41 -3.71 117.46 112.76 3m7n n PHE 109 Ca 0.09 0.17 0.20 0.00 1.01 0.00 0.00 57.45 58.92 3m7n n PHE 109 Cb 0.29 -0.83 1.09 0.00 -0.01 0.00 0.00 39.48 40.02 3m7n n PHE 109 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 3m7n h GLU 110 N 0.00 0.00 0.00 -1.08 5.08 -0.98 0.46 114.58 118.06 3m7n h GLU 110 Ca -0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3m7n h GLU 110 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 3m7n h GLU 110 CO 0.01 0.00 -0.33 0.00 -1.00 0.00 0.00 179.01 177.70 3m7n h ALA 111 N 2.00 0.79 0.00 3.43 0.00 -1.63 -3.40 119.26 120.44 3m7n h ALA 111 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3m7n h ALA 111 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3m7n h ALA 111 CO 0.00 0.00 -0.72 0.28 0.00 0.00 0.00 179.25 178.81 3m7n n VAL 112 N -2.26 0.00 -2.09 0.00 0.31 -0.12 -4.95 118.33 109.23 3m7n n VAL 112 Ca 0.04 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.96 3m7n n VAL 112 Cb 0.44 -0.38 -0.02 0.00 -0.91 0.00 0.00 33.84 32.98 3m7n n VAL 112 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3m7n s ILE 113 N -1.72 2.81 -1.42 2.52 1.01 -0.04 -1.26 121.20 123.10 3m7n s ILE 113 Ca 0.00 0.71 -0.13 0.00 0.00 0.00 0.00 60.65 61.23 3m7n s ILE 113 Cb 0.00 -3.45 0.07 0.00 0.01 0.00 0.00 42.46 39.08 3m7n s ILE 113 CO 0.00 0.13 2.15 0.23 0.00 0.00 0.00 174.94 177.44 3m7n n MET 114 N 2.03 3.01 0.24 2.79 2.81 0.23 -4.77 117.12 123.46 3m7n n MET 114 Ca 0.05 -2.80 0.10 0.00 -1.81 0.00 0.00 57.70 53.25 3m7n n MET 114 Cb 0.41 -3.22 0.58 0.00 -0.71 0.00 0.00 33.22 30.28 3m7n n MET 114 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 3m7n h LYS 115 N 5.98 0.00 -0.01 0.03 2.10 -1.90 -2.45 116.57 120.32 3m7n h LYS 115 Ca 0.53 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.19 3m7n h LYS 115 Cb 0.64 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.97 3m7n h LYS 115 CO 1.83 0.20 0.15 0.93 -2.00 0.00 0.00 179.45 180.55 3m7n h GLU 116 N 0.00 0.00 0.00 0.07 3.07 -1.86 0.01 114.58 115.88 3m7n h GLU 116 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3m7n h GLU 116 Cb 0.55 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.46 3m7n h GLU 116 CO 0.03 0.00 0.00 -0.07 -1.40 0.00 0.00 179.01 177.57 3m7n h LEU 117 N 0.00 0.00 -5.87 1.33 3.38 -1.77 -3.38 115.31 109.00 3m7n h LEU 117 Ca 0.01 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 3m7n h LEU 117 Cb 0.31 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.65 3m7n h LEU 117 CO -0.00 0.00 -0.96 0.49 0.09 0.00 0.00 178.44 178.06 3m7n n PHE 118 N -2.48 1.46 -1.61 1.13 3.01 -0.67 -5.03 117.46 113.28 3m7n n PHE 118 Ca 0.04 -3.85 -0.42 0.00 1.01 0.00 0.00 57.45 54.23 3m7n n PHE 118 Cb 0.40 -0.44 0.00 0.00 -0.01 0.00 0.00 39.48 39.43 3m7n n PHE 118 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 3m7n n PRO 119 N 0.52 1.41 -2.12 -1.08 -0.02 -1.26 -1.73 135.00 130.72 3m7n n PRO 119 Ca 0.26 0.50 -0.14 0.00 -2.02 0.00 0.00 63.50 62.10 3m7n n PRO 119 Cb 0.53 -2.00 -0.02 0.00 -0.02 0.00 0.00 33.50 31.99 3m7n n PRO 119 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3m7n n ARG 120 N 0.35 -1.10 -4.44 -0.52 1.74 0.07 -4.80 116.66 107.97 3m7n n ARG 120 Ca 0.09 0.74 -0.21 0.00 -0.77 0.00 0.00 57.85 57.69 3m7n n ARG 120 Cb 0.37 -4.99 -0.10 0.00 -1.02 0.00 0.00 32.46 26.72 3m7n n ARG 120 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 3m7n s SER 121 N -2.45 2.67 0.07 0.55 0.01 -1.09 -4.21 113.70 109.25 3m7n s SER 121 Ca 0.00 -1.24 0.09 0.00 1.31 0.00 0.00 55.95 56.11 3m7n s SER 121 Cb 0.00 -0.15 -0.03 0.00 0.21 0.00 0.00 66.02 66.05 3m7n s SER 121 CO 0.00 -0.42 -0.23 0.00 0.41 0.00 0.00 173.24 173.00 3m7n s ALA 122 N -3.09 2.43 -0.23 1.44 0.00 -0.75 0.18 121.76 121.74 3m7n s ALA 122 Ca 0.31 -1.30 0.02 0.00 0.00 0.00 0.00 51.96 50.99 3m7n s ALA 122 Cb 0.05 -0.55 0.05 0.00 0.00 0.00 0.00 23.12 22.67 3m7n s ALA 122 CO 0.13 0.55 -0.10 0.42 0.00 0.00 0.00 175.76 176.75 3m7n s ILE 123 N -0.93 1.91 -0.15 0.00 1.01 0.29 -1.67 121.20 121.66 3m7n s ILE 123 Ca 0.14 -1.35 -0.06 0.00 0.00 0.00 0.00 60.65 59.38 3m7n s ILE 123 Cb -0.10 -2.01 -0.04 0.00 0.01 0.00 0.00 42.46 40.32 3m7n s ILE 123 CO 0.05 0.05 0.05 -1.81 0.00 0.00 0.00 174.94 173.27 3m7n s ASP 124 N 1.25 5.54 -0.16 3.58 -0.00 0.27 -1.94 116.67 125.20 3m7n s ASP 124 Ca -0.05 0.12 0.01 0.00 -0.00 0.00 0.00 52.55 52.62 3m7n s ASP 124 Cb -0.18 -1.85 0.02 0.00 -0.00 0.00 0.00 42.92 40.91 3m7n s ASP 124 CO -0.07 0.25 -0.15 -0.63 -0.00 0.00 0.00 175.17 174.57 3m7n s ILE 125 N -0.07 1.70 -0.14 0.77 1.01 -0.18 -0.63 121.20 123.67 3m7n s ILE 125 Ca 0.06 -0.76 -0.00 0.00 0.00 0.00 0.00 60.65 59.95 3m7n s ILE 125 Cb -0.12 -1.60 -0.01 0.00 0.01 0.00 0.00 42.46 40.74 3m7n s ILE 125 CO 0.01 0.44 -0.13 -0.36 0.00 0.00 0.00 174.94 174.90 3m7n s PHE 126 N 1.43 2.81 -0.06 3.97 0.40 0.57 -1.15 117.98 125.95 3m7n s PHE 126 Ca 0.04 -0.78 0.03 0.00 -0.60 0.00 0.00 56.93 55.62 3m7n s PHE 126 Cb -0.13 -1.87 0.00 0.00 0.51 0.00 0.00 43.02 41.53 3m7n s PHE 126 CO -0.11 -0.31 -0.16 0.08 0.70 0.00 0.00 175.22 175.42 3m7n s VAL 127 N 0.55 1.40 -0.13 -0.44 1.01 0.06 0.07 120.40 122.92 3m7n s VAL 127 Ca -0.09 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.25 3m7n s VAL 127 Cb -0.16 -1.23 0.01 0.00 0.00 0.00 0.00 36.38 35.01 3m7n s VAL 127 CO 0.04 0.41 -0.19 -0.70 0.00 0.00 0.00 175.10 174.66 3m7n s GLU 128 N 0.35 2.68 -0.35 2.72 2.56 0.34 -1.72 118.70 125.29 3m7n s GLU 128 Ca -0.11 -0.73 -0.17 0.00 0.00 0.00 0.00 54.97 53.97 3m7n s GLU 128 Cb -0.14 -2.24 -0.01 0.00 2.00 0.00 0.00 34.13 33.74 3m7n s GLU 128 CO 0.04 -0.07 0.45 0.54 -0.56 0.00 0.00 175.26 175.65 3m7n s VAL 129 N 0.99 5.08 -0.05 3.70 0.11 -0.21 -0.69 120.40 129.33 3m7n s VAL 129 Ca -0.04 0.20 -0.04 0.00 -2.93 0.00 0.00 61.98 59.17 3m7n s VAL 129 Cb -0.15 -3.90 -0.27 0.00 -1.53 0.00 0.00 36.38 30.53 3m7n s VAL 129 CO -0.04 -0.17 0.64 -0.07 -3.33 0.00 0.00 175.10 172.13 3m7n h LEU 130 N 8.94 0.39 -7.70 2.54 3.38 -1.04 -1.51 115.31 120.31 3m7n h LEU 130 Ca -0.29 -0.68 -0.40 0.00 0.09 0.00 0.00 57.88 56.61 3m7n h LEU 130 Cb 1.13 -0.13 -0.34 0.00 0.09 0.00 0.00 40.66 41.41 3m7n h LEU 130 CO 0.74 1.59 -0.77 -1.58 0.09 0.00 0.00 178.44 178.51 3m7n s GLN 131 N -2.59 0.72 -0.03 1.13 0.74 -0.82 -3.70 119.66 115.11 3m7n s GLN 131 Ca -0.14 -0.06 -0.01 0.00 0.05 0.00 0.00 55.36 55.20 3m7n s GLN 131 Cb 0.07 -0.78 -0.04 0.00 1.10 0.00 0.00 33.01 33.36 3m7n s GLN 131 CO 0.82 -0.10 0.05 0.00 -0.55 0.00 0.00 175.29 175.51 3m7n s ALA 132 N 1.00 3.45 0.00 1.58 0.00 -0.04 -0.38 121.76 127.37 3m7n s ALA 132 Ca -0.10 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 51.00 3m7n s ALA 132 Cb -0.14 -1.52 0.00 0.00 0.00 0.00 0.00 23.12 21.46 3m7n s ALA 132 CO -0.01 0.65 0.00 -3.47 0.00 0.00 0.00 175.76 172.93 3m7n n ASP 133 N 1.54 0.00 -4.75 0.00 2.03 -1.26 -4.78 116.55 109.33 3m7n n ASP 133 Ca -0.15 -0.67 -0.37 0.00 0.52 0.00 0.00 54.79 54.12 3m7n n ASP 133 Cb 0.53 0.00 0.05 0.00 -0.72 0.00 0.00 41.12 40.98 3m7n n ASP 133 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3m7n s ALA 134 N -1.92 2.63 -0.75 -1.67 0.00 -1.26 -3.16 121.76 115.63 3m7n s ALA 134 Ca 0.00 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.17 3m7n s ALA 134 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.59 3m7n s ALA 134 CO 0.00 -1.36 0.00 0.41 0.00 0.00 0.00 175.76 174.81 3m7n n GLY 135 N 0.73 0.92 0.37 0.00 0.00 -1.26 -4.89 105.19 101.05 3m7n n GLY 135 Ca 0.13 -0.62 0.12 0.00 0.00 0.00 0.00 46.02 45.65 3m7n n GLY 135 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3m7n h SER 136 N 0.00 0.69 0.48 1.61 4.64 -1.94 -0.25 113.55 118.78 3m7n h SER 136 Ca -0.14 0.05 -0.04 0.00 -0.47 0.00 0.00 61.79 61.18 3m7n h SER 136 Cb 0.50 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.50 3m7n h SER 136 CO 0.21 0.33 -0.20 0.08 -0.87 0.00 0.00 176.83 176.38 3m7n h ARG 137 N 0.72 0.00 0.02 4.77 0.11 -1.91 -0.31 114.38 117.77 3m7n h ARG 137 Ca 0.47 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 60.45 3m7n h ARG 137 Cb 0.76 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.85 3m7n h ARG 137 CO -0.23 0.20 -0.41 0.00 0.10 0.00 0.00 179.97 179.63 3m7n h THR 138 N 0.00 1.53 -0.76 0.08 1.03 -1.47 -2.62 112.91 110.70 3m7n h THR 138 Ca -0.00 -2.11 0.13 0.00 -0.01 0.00 0.00 66.41 64.42 3m7n h THR 138 Cb 0.50 2.84 -0.09 0.00 -1.07 0.00 0.00 68.15 70.33 3m7n h THR 138 CO 0.03 0.59 0.34 0.00 -0.01 0.00 0.00 175.52 176.46 3m7n h ALA 139 N 0.23 1.08 -0.27 0.00 0.00 -0.72 -2.37 119.26 117.20 3m7n h ALA 139 Ca -0.06 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 3m7n h ALA 139 Cb 1.19 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 3m7n h ALA 139 CO 0.08 -0.15 -0.05 0.00 0.00 0.00 0.00 179.25 179.14 3m7n h LEU 141 N 0.28 0.95 -0.19 0.00 3.38 -1.30 0.52 115.31 118.95 3m7n h LEU 141 Ca 0.07 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 3m7n h LEU 141 Cb 0.51 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3m7n h LEU 141 CO 0.02 0.56 0.03 0.78 0.09 0.00 0.00 178.44 179.92 3m7n h ASN 142 N 1.05 0.31 -0.27 -0.43 2.35 -1.12 -1.55 115.58 115.93 3m7n h ASN 142 Ca 0.46 -0.26 0.02 0.00 -0.55 0.00 0.00 56.30 55.96 3m7n h ASN 142 Cb 0.33 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 3m7n h ASN 142 CO -0.22 0.50 0.14 0.00 -1.65 0.00 0.00 177.43 176.19 3m7n h ALA 143 N 0.83 0.32 -0.93 -0.83 0.00 -0.88 -2.43 119.26 115.34 3m7n h ALA 143 Ca 0.06 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 3m7n h ALA 143 Cb 0.32 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 3m7n h ALA 143 CO 0.00 -0.26 0.58 0.00 0.00 0.00 0.00 179.25 179.58 3m7n h ALA 144 N 1.13 1.18 -0.55 0.00 0.00 0.20 0.14 119.26 121.36 3m7n h ALA 144 Ca 0.11 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 3m7n h ALA 144 Cb 0.02 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 3m7n h ALA 144 CO -0.07 0.62 0.11 1.03 0.00 0.00 0.00 179.25 180.94 3m7n h SER 145 N 1.27 0.86 -0.19 0.00 0.87 -1.19 0.50 113.55 115.68 3m7n h SER 145 Ca 0.34 -0.25 -0.01 0.00 -1.23 0.00 0.00 61.79 60.64 3m7n h SER 145 Cb -0.08 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.64 3m7n h SER 145 CO -0.07 0.88 0.09 0.58 -0.53 0.00 0.00 176.83 177.78 3m7n h VAL 146 N 0.79 1.14 -0.72 2.23 2.07 -0.84 -2.41 116.25 118.51 3m7n h VAL 146 Ca 0.17 -0.39 0.09 0.00 0.82 0.00 0.00 66.70 67.38 3m7n h VAL 146 Cb 0.38 1.06 -0.05 0.00 -1.52 0.00 0.00 31.29 31.16 3m7n h VAL 146 CO 0.01 0.13 0.47 0.00 0.02 0.00 0.00 177.57 178.20 3m7n h ALA 147 N 0.95 1.81 -0.48 1.67 0.00 -0.36 0.14 119.26 122.99 3m7n h ALA 147 Ca 0.06 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 3m7n h ALA 147 Cb 0.13 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3m7n h ALA 147 CO -0.01 0.05 -0.15 -0.07 0.00 0.00 0.00 179.25 179.07 3m7n h LEU 148 N 0.65 0.94 -0.19 0.00 3.38 -0.62 -0.86 115.31 118.61 3m7n h LEU 148 Ca 0.32 -0.32 -0.16 0.00 0.09 0.00 0.00 57.88 57.82 3m7n h LEU 148 Cb 0.41 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3m7n h LEU 148 CO -0.11 1.08 -0.50 0.58 0.09 0.00 0.00 178.44 179.58 3m7n h VAL 149 N 0.82 1.32 -0.88 1.22 2.07 -0.76 -2.19 116.25 117.86 3m7n h VAL 149 Ca 0.12 -1.73 0.15 0.00 0.82 0.00 0.00 66.70 66.06 3m7n h VAL 149 Cb 0.70 1.90 -0.07 0.00 -1.52 0.00 0.00 31.29 32.30 3m7n h VAL 149 CO 0.05 0.54 0.57 -0.78 0.02 0.00 0.00 177.57 177.97 3m7n h ASP 150 N 0.37 0.60 -0.01 0.57 -0.00 -0.68 0.49 116.42 117.76 3m7n h ASP 150 Ca -0.01 0.04 0.00 0.00 -0.00 0.00 0.00 57.03 57.06 3m7n h ASP 150 Cb 1.12 -0.08 0.00 0.00 -0.00 0.00 0.00 39.33 40.37 3m7n h ASP 150 CO 0.11 0.29 0.00 0.00 -0.00 0.00 0.00 179.24 179.64 3m7n n ALA 151 N -2.45 2.63 -1.90 -0.78 0.00 -0.34 -4.72 120.51 112.96 3m7n n ALA 151 Ca 0.17 -0.17 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 3m7n n ALA 151 Cb 0.51 -1.35 -0.05 0.00 0.00 0.00 0.00 19.45 18.56 3m7n n ALA 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m7n n GLY 152 N 0.87 0.80 3.66 0.00 0.00 0.16 -4.88 105.19 105.81 3m7n n GLY 152 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3m7n n GLY 152 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m7n s VAL 153 N -2.70 4.77 0.21 1.61 0.11 -0.97 -4.98 120.40 118.45 3m7n s VAL 153 Ca 0.00 1.87 -0.32 0.00 -2.93 0.00 0.00 61.98 60.60 3m7n s VAL 153 Cb 0.00 -4.24 -0.13 0.00 -1.53 0.00 0.00 36.38 30.48 3m7n s VAL 153 CO 0.00 -0.08 1.62 -2.65 -3.33 0.00 0.00 175.10 170.66 3m7n n PRO 154 N 5.77 2.48 -3.92 1.54 -0.02 -1.26 -4.73 135.00 134.86 3m7n n PRO 154 Ca 0.09 0.89 -0.10 0.00 -2.02 0.00 0.00 63.50 62.36 3m7n n PRO 154 Cb 0.47 -2.68 -0.10 0.00 -0.02 0.00 0.00 33.50 31.17 3m7n n PRO 154 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 3m7n s MET 155 N 0.65 0.52 0.48 -0.52 -1.94 -1.26 -0.60 119.30 116.63 3m7n s MET 155 Ca 0.74 -0.64 0.26 0.00 -1.71 0.00 0.00 55.69 54.34 3m7n s MET 155 Cb -0.58 0.20 1.19 0.00 2.01 0.00 0.00 34.83 37.66 3m7n s MET 155 CO 0.39 -0.12 1.95 0.87 -0.01 0.00 0.00 175.02 178.09 3m7n h LYS 156 N 3.96 0.00 0.00 2.03 1.57 -1.53 -3.48 116.57 119.12 3m7n h LYS 156 Ca -0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 3m7n h LYS 156 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.50 3m7n h LYS 156 CO 0.47 0.17 0.00 0.41 -0.57 0.00 0.00 179.45 179.93 3m7n n GLY 157 N -0.26 -1.05 3.85 3.86 0.00 -1.26 -4.86 105.19 105.46 3m7n n GLY 157 Ca -0.01 -0.87 -0.33 0.00 0.00 0.00 0.00 46.02 44.81 3m7n n GLY 157 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3m7n s MET 158 N -0.61 4.02 -0.25 1.61 -1.94 -0.78 -4.85 119.30 116.50 3m7n s MET 158 Ca 0.00 0.68 -0.11 0.00 -1.71 0.00 0.00 55.69 54.54 3m7n s MET 158 Cb 0.00 -2.48 -0.05 0.00 2.01 0.00 0.00 34.83 34.31 3m7n s MET 158 CO 0.00 0.18 0.19 0.42 -0.01 0.00 0.00 175.02 175.81 3m7n s ILE 159 N -1.94 5.33 -0.02 2.53 -1.09 -1.26 -0.84 121.20 123.91 3m7n s ILE 159 Ca 0.53 0.22 0.03 0.00 -2.23 0.00 0.00 60.65 59.20 3m7n s ILE 159 Cb -0.11 -3.53 -0.00 0.00 -1.58 0.00 0.00 42.46 37.24 3m7n s ILE 159 CO 0.18 0.30 -0.11 -0.89 -1.23 0.00 0.00 174.94 173.19 3m7n s THR 160 N 1.38 0.91 -0.01 2.92 2.01 -0.52 -4.72 115.64 117.61 3m7n s THR 160 Ca 0.08 -0.46 0.01 0.00 0.31 0.00 0.00 61.69 61.63 3m7n s THR 160 Cb -0.15 -0.78 0.01 0.00 0.01 0.00 0.00 72.50 71.59 3m7n s THR 160 CO 0.07 0.27 -0.01 -0.55 -0.69 0.00 0.00 174.62 173.71 3m7n s SER 161 N -0.03 0.26 0.07 3.53 0.15 -1.26 0.63 113.70 117.05 3m7n s SER 161 Ca 0.00 -0.03 -0.25 0.00 0.70 0.00 0.00 55.95 56.37 3m7n s SER 161 Cb -0.07 -0.07 0.06 0.00 -1.71 0.00 0.00 66.02 64.24 3m7n s SER 161 CO 0.00 -0.01 0.59 0.54 1.20 0.00 0.00 173.24 175.57 3m7n s VAL 162 N 0.25 0.01 0.25 4.45 0.11 -0.81 -4.78 120.40 119.88 3m7n s VAL 162 Ca -0.02 -0.09 0.07 0.00 -2.93 0.00 0.00 61.98 59.01 3m7n s VAL 162 Cb -0.04 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.77 3m7n s VAL 162 CO -0.01 -0.05 0.19 0.00 -3.33 0.00 0.00 175.10 171.91 3m7n s ALA 163 N -2.65 3.57 -0.04 1.54 0.00 -1.26 -0.77 121.76 122.16 3m7n s ALA 163 Ca -0.04 -1.44 0.07 0.00 0.00 0.00 0.00 51.96 50.55 3m7n s ALA 163 Cb -0.01 -1.28 -0.02 0.00 0.00 0.00 0.00 23.12 21.82 3m7n s ALA 163 CO -0.03 0.25 -0.24 0.08 0.00 0.00 0.00 175.76 175.81 3m7n s VAL 164 N -2.15 2.19 0.52 0.00 1.01 0.02 -0.45 120.40 121.54 3m7n s VAL 164 Ca 0.33 -1.05 0.03 0.00 0.00 0.00 0.00 61.98 61.30 3m7n s VAL 164 Cb -0.08 -1.78 0.01 0.00 0.00 0.00 0.00 36.38 34.53 3m7n s VAL 164 CO 0.25 0.58 0.17 -0.83 0.00 0.00 0.00 175.10 175.26 3m7n s GLY 165 N -0.49 2.73 -0.10 4.51 0.00 0.75 -0.11 107.32 114.61 3m7n s GLY 165 Ca 0.06 -0.82 -0.00 0.00 0.00 0.00 0.00 44.72 43.96 3m7n s GLY 165 CO 0.01 -2.08 -0.06 1.25 0.00 0.00 0.00 173.10 172.21 3m7n s LYS 166 N -4.04 1.31 -0.05 2.90 2.20 -0.75 0.08 119.74 121.40 3m7n s LYS 166 Ca 0.19 -0.18 0.01 0.00 -0.36 0.00 0.00 55.97 55.62 3m7n s LYS 166 Cb 0.00 -1.40 0.02 0.00 -1.51 0.00 0.00 37.83 34.95 3m7n s LYS 166 CO 0.11 -0.24 -0.04 0.00 -0.36 0.00 0.00 175.35 174.82 3m7n s ALA 167 N 1.62 0.69 -1.46 3.13 0.00 0.76 -0.15 121.76 126.34 3m7n s ALA 167 Ca 0.02 -0.07 -0.03 0.00 0.00 0.00 0.00 51.96 51.88 3m7n s ALA 167 Cb -0.13 -0.46 0.03 0.00 0.00 0.00 0.00 23.12 22.56 3m7n s ALA 167 CO -0.06 -0.06 0.44 -0.25 0.00 0.00 0.00 175.76 175.84 3m7n n ASP 168 N 4.15 -0.70 0.00 0.00 10.43 -1.26 -0.79 116.55 128.38 3m7n n ASP 168 Ca -0.23 -1.03 0.00 0.00 2.57 0.00 0.00 54.79 56.10 3m7n n ASP 168 Cb 0.51 -2.90 0.00 0.00 1.84 0.00 0.00 41.12 40.57 3m7n n ASP 168 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3m7n n GLY 169 N -1.95 0.33 3.28 0.44 0.00 -1.26 -4.99 105.19 101.04 3m7n n GLY 169 Ca -0.25 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.45 3m7n n GLY 169 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3m7n s GLN 170 N -0.83 2.64 0.09 1.61 -0.21 0.03 -5.11 119.66 117.88 3m7n s GLN 170 Ca 0.00 -0.88 -0.31 0.00 0.02 0.00 0.00 55.36 54.19 3m7n s GLN 170 Cb 0.00 -2.21 -0.07 0.00 1.00 0.00 0.00 33.01 31.73 3m7n s GLN 170 CO 0.00 0.36 1.37 -0.51 -2.12 0.00 0.00 175.29 174.39 3m7n s LEU 171 N -0.11 4.36 0.01 2.90 1.43 -1.26 -0.17 118.68 125.83 3m7n s LEU 171 Ca -0.05 2.25 0.08 0.00 -1.03 0.00 0.00 54.13 55.37 3m7n s LEU 171 Cb -0.14 -3.58 -0.02 0.00 0.03 0.00 0.00 46.19 42.48 3m7n s LEU 171 CO 0.04 -0.64 -0.23 0.68 0.23 0.00 0.00 176.35 176.43 3m7n s VAL 172 N 1.33 1.85 0.07 -1.59 -7.23 0.11 -4.81 120.40 110.14 3m7n s VAL 172 Ca 0.64 -1.10 -0.30 0.00 -1.81 0.00 0.00 61.98 59.41 3m7n s VAL 172 Cb -0.35 -1.56 -0.05 0.00 0.56 0.00 0.00 36.38 34.98 3m7n s VAL 172 CO 0.29 0.43 0.96 -0.22 -0.31 0.00 0.00 175.10 176.25 3m7n s LEU 173 N -0.79 4.45 -0.90 1.32 2.96 0.63 -0.18 118.68 126.17 3m7n s LEU 173 Ca 0.09 1.73 -0.04 0.00 -0.22 0.00 0.00 54.13 55.69 3m7n s LEU 173 Cb -0.09 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 43.01 3m7n s LEU 173 CO 0.00 -0.13 0.79 -0.67 -1.32 0.00 0.00 176.35 175.02 3m7n n ASP 174 N 3.16 -7.00 -4.64 3.68 4.64 0.40 -4.64 116.55 112.14 3m7n n ASP 174 Ca 0.03 -0.44 -0.38 0.00 -1.38 0.00 0.00 54.79 52.62 3m7n n ASP 174 Cb 0.50 -4.91 0.05 0.00 -1.04 0.00 0.00 41.12 35.72 3m7n n ASP 174 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 3m7n n PRO 175 N -2.58 0.98 -2.78 -0.67 -0.02 -1.26 -4.69 135.00 123.98 3m7n n PRO 175 Ca -0.05 0.38 -0.21 0.00 -2.02 0.00 0.00 63.50 61.60 3m7n n PRO 175 Cb 0.56 -2.24 0.05 0.00 -0.02 0.00 0.00 33.50 31.85 3m7n n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3m7n s MET 176 N -2.85 2.34 0.18 -0.52 0.23 -1.26 -4.64 119.30 112.77 3m7n s MET 176 Ca 0.77 -1.13 -0.15 0.00 -1.03 0.00 0.00 55.69 54.14 3m7n s MET 176 Cb -0.41 -2.54 0.14 0.00 -1.53 0.00 0.00 34.83 30.49 3m7n s MET 176 CO 0.46 -0.83 1.67 -0.22 -2.03 0.00 0.00 175.02 174.07 3m7n h LYS 177 N 0.06 0.05 -0.70 3.16 3.64 -1.94 -0.21 116.57 120.63 3m7n h LYS 177 Ca -0.38 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 58.98 3m7n h LYS 177 Cb 1.28 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 33.06 3m7n h LYS 177 CO 0.45 0.03 0.37 0.93 -2.27 0.00 0.00 179.45 178.97 3m7n h GLU 178 N 0.05 0.98 -0.28 1.90 3.07 -1.99 -1.86 114.58 116.44 3m7n h GLU 178 Ca 0.22 -0.11 -0.15 0.00 -0.50 0.00 0.00 59.36 58.82 3m7n h GLU 178 Cb 0.34 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.05 3m7n h GLU 178 CO -0.42 0.72 -0.44 0.93 -1.40 0.00 0.00 179.01 178.40 3m7n h GLU 179 N 0.98 0.71 0.67 2.33 5.08 -1.54 -0.79 114.58 122.03 3m7n h GLU 179 Ca 0.25 -0.39 -0.03 0.00 -1.00 0.00 0.00 59.36 58.19 3m7n h GLU 179 Cb 0.04 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3m7n h GLU 179 CO -0.04 1.01 -0.36 0.22 -1.00 0.00 0.00 179.01 178.84 3m7n h ASP 180 N 0.57 -0.88 -0.20 1.42 3.58 -0.74 -0.81 116.42 119.36 3m7n h ASP 180 Ca 0.04 0.04 -0.10 0.00 0.42 0.00 0.00 57.03 57.43 3m7n h ASP 180 Cb 0.99 0.24 -0.01 0.00 1.72 0.00 0.00 39.33 42.27 3m7n h ASP 180 CO 0.09 -0.59 -0.22 0.78 -2.88 0.00 0.00 179.24 176.42 3m7n h ASN 181 N -0.96 0.65 -0.01 2.28 2.35 -1.33 -3.31 115.58 115.25 3m7n h ASN 181 Ca -0.09 -0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.44 3m7n h ASN 181 Cb 0.75 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.94 3m7n h ASN 181 CO 0.12 0.87 -0.06 0.49 -1.65 0.00 0.00 177.43 177.20 3m7n n PHE 182 N -4.12 0.00 -1.60 1.19 3.01 -0.30 -5.00 117.46 110.63 3m7n n PHE 182 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3m7n n PHE 182 Cb 0.41 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.88 3m7n n PHE 182 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3m7n n GLY 183 N 0.63 -0.10 0.00 1.37 0.00 -0.31 -4.93 105.19 101.86 3m7n n GLY 183 Ca 0.05 -1.82 0.08 0.00 0.00 0.00 0.00 46.02 44.33 3m7n n GLY 183 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3m7n n GLU 184 N -0.94 1.27 -3.55 1.61 4.71 0.78 -5.00 120.64 119.53 3m7n n GLU 184 Ca 0.00 -0.04 -0.12 0.00 -0.01 0.00 0.00 57.16 56.99 3m7n n GLU 184 Cb 0.00 -1.31 -0.05 0.00 -1.01 0.00 0.00 31.44 29.07 3m7n n GLU 184 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3m7n s ALA 185 N -2.72 -1.87 -0.02 0.62 0.00 -1.23 -1.26 121.76 115.27 3m7n s ALA 185 Ca 0.03 1.38 0.00 0.00 0.00 0.00 0.00 51.96 53.38 3m7n s ALA 185 Cb 0.12 -0.29 0.02 0.00 0.00 0.00 0.00 23.12 22.98 3m7n s ALA 185 CO 0.69 -0.41 0.01 0.34 0.00 0.00 0.00 175.76 176.38 3m7n s ASP 186 N -1.45 0.23 -0.31 0.00 3.68 -0.32 -1.80 116.67 116.69 3m7n s ASP 186 Ca -0.02 -0.00 -0.01 0.00 2.13 0.00 0.00 52.55 54.64 3m7n s ASP 186 Cb -0.00 -0.12 0.12 0.00 -1.45 0.00 0.00 42.92 41.47 3m7n s ASP 186 CO 0.01 -0.09 0.22 -0.32 0.13 0.00 0.00 175.17 175.12 3m7n s MET 187 N 0.81 0.35 0.14 4.34 1.75 0.84 -1.87 119.30 125.66 3m7n s MET 187 Ca -0.07 -0.62 -0.30 0.00 -1.25 0.00 0.00 55.69 53.44 3m7n s MET 187 Cb -0.11 -1.00 -0.07 0.00 2.84 0.00 0.00 34.83 36.50 3m7n s MET 187 CO -0.02 -1.08 1.09 -2.14 -0.65 0.00 0.00 175.02 172.22 3m7n s PRO 188 N 1.89 4.58 0.21 4.11 0.02 -1.07 -0.80 135.00 143.94 3m7n s PRO 188 Ca 0.12 1.68 0.11 0.00 0.02 0.00 0.00 61.00 62.92 3m7n s PRO 188 Cb -0.17 -3.31 -0.05 0.00 0.02 0.00 0.00 34.50 31.00 3m7n s PRO 188 CO -0.24 0.04 -0.21 -0.06 -0.33 0.00 0.00 177.00 176.19 3m7n s PHE 189 N 0.05 2.18 -0.00 6.54 0.40 0.05 -2.26 117.98 124.94 3m7n s PHE 189 Ca 0.51 -0.38 -0.00 0.00 -0.60 0.00 0.00 56.93 56.45 3m7n s PHE 189 Cb -0.28 -1.04 -0.00 0.00 0.51 0.00 0.00 43.02 42.21 3m7n s PHE 189 CO 0.33 0.52 0.01 0.00 0.70 0.00 0.00 175.22 176.77 3m7n s ALA 190 N -2.01 -0.01 0.16 5.36 0.00 -0.53 -1.92 121.76 122.82 3m7n s ALA 190 Ca 0.22 -0.03 0.11 0.00 0.00 0.00 0.00 51.96 52.26 3m7n s ALA 190 Cb -0.06 0.00 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 3m7n s ALA 190 CO 0.10 -0.02 -0.22 -0.06 0.00 0.00 0.00 175.76 175.56 3m7n s PHE 191 N -0.13 2.38 -0.09 0.00 0.40 0.21 0.17 117.98 120.91 3m7n s PHE 191 Ca -0.02 -0.33 -0.27 0.00 -0.60 0.00 0.00 56.93 55.72 3m7n s PHE 191 Cb -0.01 -1.22 -0.02 0.00 0.51 0.00 0.00 43.02 42.27 3m7n s PHE 191 CO -0.00 0.43 0.86 -1.17 0.70 0.00 0.00 175.22 176.04 3m7n s LEU 192 N -2.42 4.27 -0.21 -0.37 2.96 -0.04 -1.43 118.68 121.43 3m7n s LEU 192 Ca 0.19 1.34 -0.04 0.00 -0.22 0.00 0.00 54.13 55.40 3m7n s LEU 192 Cb -0.09 -3.32 -0.01 0.00 0.50 0.00 0.00 46.19 43.27 3m7n s LEU 192 CO 0.09 -0.30 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.16 3m7n s ILE 193 N 1.52 3.54 0.03 6.68 1.01 -0.02 -0.69 121.20 133.26 3m7n s ILE 193 Ca 0.43 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.65 3m7n s ILE 193 Cb -0.18 -2.61 -0.02 0.00 0.01 0.00 0.00 42.46 39.66 3m7n s ILE 193 CO 0.18 0.42 -0.05 -0.60 0.00 0.00 0.00 174.94 174.89 3m7n s ARG 194 N 1.34 0.40 -1.45 2.79 3.52 -0.35 -1.86 118.95 123.34 3m7n s ARG 194 Ca 0.04 -0.57 -0.11 0.00 -0.13 0.00 0.00 55.73 54.95 3m7n s ARG 194 Cb -0.14 -0.15 0.08 0.00 -1.56 0.00 0.00 34.95 33.18 3m7n s ARG 194 CO -0.01 0.02 0.72 -1.71 -0.81 0.00 0.00 175.30 173.51 3m7n n ASN 195 N 1.83 -4.44 -0.40 -2.12 5.15 -1.26 -0.95 115.26 113.06 3m7n n ASN 195 Ca -0.21 -0.57 -0.05 0.00 -0.60 0.00 0.00 54.58 53.14 3m7n n ASN 195 Cb 0.56 -3.60 -0.02 0.00 -0.53 0.00 0.00 39.78 36.18 3m7n n ASN 195 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3m7n n GLY 196 N -1.44 0.64 3.21 8.20 0.00 -1.26 -4.96 105.19 109.58 3m7n n GLY 196 Ca 0.00 -0.12 -0.17 0.00 0.00 0.00 0.00 46.02 45.74 3m7n n GLY 196 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m7n s LYS 197 N -2.06 0.93 0.08 1.61 1.02 -0.12 -5.10 119.74 116.10 3m7n s LYS 197 Ca 0.00 -1.16 -0.31 0.00 0.02 0.00 0.00 55.97 54.52 3m7n s LYS 197 Cb 0.00 -0.78 -0.09 0.00 -0.52 0.00 0.00 37.83 36.44 3m7n s LYS 197 CO 0.00 0.15 1.78 0.42 -0.92 0.00 0.00 175.35 176.77 3m7n s ILE 198 N -2.07 2.83 -0.18 2.17 -1.09 -1.26 -1.21 121.20 120.39 3m7n s ILE 198 Ca 0.06 0.23 -0.04 0.00 -2.23 0.00 0.00 60.65 58.67 3m7n s ILE 198 Cb -0.05 -3.15 -0.10 0.00 -1.58 0.00 0.00 42.46 37.58 3m7n s ILE 198 CO 0.02 -0.00 -0.20 -0.62 -1.23 0.00 0.00 174.94 172.91 3m7n n GLU 199 N 5.98 0.41 -3.85 2.79 -0.58 0.13 -4.91 120.64 120.62 3m7n n GLU 199 Ca 0.17 0.14 -0.06 0.00 -0.42 0.00 0.00 57.16 56.99 3m7n n GLU 199 Cb 0.40 -1.25 0.02 0.00 -0.57 0.00 0.00 31.44 30.04 3m7n n GLU 199 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3m7n s SER 200 N -6.20 -0.00 -0.24 1.62 1.04 -1.21 -5.00 113.70 103.71 3m7n s SER 200 Ca -0.25 -0.89 -0.09 0.00 0.48 0.00 0.00 55.95 55.20 3m7n s SER 200 Cb 0.08 0.67 -0.04 0.00 0.10 0.00 0.00 66.02 66.83 3m7n s SER 200 CO 0.36 -1.32 0.12 -0.63 0.98 0.00 0.00 173.24 172.75 3m7n s ILE 201 N -2.27 4.92 -0.04 -1.02 1.01 -1.26 -0.86 121.20 121.67 3m7n s ILE 201 Ca 0.19 0.03 0.19 0.00 0.00 0.00 0.00 60.65 61.06 3m7n s ILE 201 Cb -0.04 -3.30 -0.30 0.00 0.01 0.00 0.00 42.46 38.84 3m7n s ILE 201 CO 0.08 0.34 0.39 0.00 0.00 0.00 0.00 174.94 175.75 3m7n n ALA 202 N 4.55 2.60 -3.56 9.38 0.00 0.13 -4.87 120.51 128.73 3m7n n ALA 202 Ca -0.15 -0.55 -0.11 0.00 0.00 0.00 0.00 53.44 52.62 3m7n n ALA 202 Cb 0.52 -0.62 -0.10 0.00 0.00 0.00 0.00 19.45 19.25 3m7n n ALA 202 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3m7n s LEU 203 N -4.48 0.06 -0.12 0.00 0.20 -1.03 -4.15 118.68 109.16 3m7n s LEU 203 Ca -0.07 0.89 -0.05 0.00 0.69 0.00 0.00 54.13 55.59 3m7n s LEU 203 Cb 0.12 1.41 0.06 0.00 -0.43 0.00 0.00 46.19 47.35 3m7n s LEU 203 CO 0.81 -0.18 0.27 -0.22 -0.29 0.00 0.00 176.35 176.74 3m7n s LEU 204 N 0.98 -0.05 0.06 -0.68 0.20 -1.26 -1.45 118.68 116.49 3m7n s LEU 204 Ca -0.06 0.59 -0.03 0.00 0.69 0.00 0.00 54.13 55.32 3m7n s LEU 204 Cb -0.06 0.76 -0.03 0.00 -0.43 0.00 0.00 46.19 46.43 3m7n s LEU 204 CO -0.08 -0.21 0.04 -1.10 -0.29 0.00 0.00 176.35 174.71 3m7n s GLN 205 N 1.96 0.69 -0.20 1.98 -0.21 -0.96 -5.04 119.66 117.89 3m7n s GLN 205 Ca -0.03 -1.14 -0.27 0.00 0.02 0.00 0.00 55.36 53.94 3m7n s GLN 205 Cb -0.11 0.25 0.09 0.00 1.00 0.00 0.00 33.01 34.24 3m7n s GLN 205 CO -0.09 -0.16 0.81 1.41 -2.12 0.00 0.00 175.29 175.13 3m7n s MET 206 N -3.90 0.80 0.01 2.91 1.75 -1.26 -2.60 119.30 117.01 3m7n s MET 206 Ca 0.07 0.62 -0.04 0.00 -1.25 0.00 0.00 55.69 55.09 3m7n s MET 206 Cb 0.07 0.38 -0.01 0.00 2.84 0.00 0.00 34.83 38.11 3m7n s MET 206 CO -0.10 -0.16 0.05 -0.51 -0.65 0.00 0.00 175.02 173.65 3m7n s ASP 207 N -0.25 0.13 0.00 1.11 1.01 -0.78 -5.02 116.67 112.87 3m7n s ASP 207 Ca -0.02 -0.34 0.00 0.00 0.71 0.00 0.00 52.55 52.90 3m7n s ASP 207 Cb -0.03 0.15 0.00 0.00 1.01 0.00 0.00 42.92 44.05 3m7n s ASP 207 CO 0.02 -0.32 0.00 0.61 0.21 0.00 0.00 175.17 175.69 3m7n n GLY 208 N 1.59 0.29 2.81 0.21 0.00 -1.26 -1.17 105.19 107.65 3m7n n GLY 208 Ca -0.23 -1.76 -0.14 0.00 0.00 0.00 0.00 46.02 43.89 3m7n n GLY 208 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3m7n s ARG 209 N -0.71 0.34 0.01 1.61 3.52 -0.39 -4.97 118.95 118.36 3m7n s ARG 209 Ca 0.00 0.03 0.07 0.00 -0.13 0.00 0.00 55.73 55.71 3m7n s ARG 209 Cb 0.00 -0.60 -0.02 0.00 -1.56 0.00 0.00 34.95 32.77 3m7n s ARG 209 CO 0.00 -0.95 -0.22 -1.64 -0.81 0.00 0.00 175.30 171.68 3m7n s MET 210 N 2.42 1.68 0.83 5.12 -1.94 -1.26 -4.78 119.30 121.37 3m7n s MET 210 Ca 0.10 -0.86 -0.11 0.00 -1.71 0.00 0.00 55.69 53.11 3m7n s MET 210 Cb -0.14 -1.69 0.09 0.00 2.01 0.00 0.00 34.83 35.10 3m7n s MET 210 CO -0.28 0.45 1.10 0.95 -0.01 0.00 0.00 175.02 177.23 3m7n s THR 211 N -0.62 2.96 0.27 2.05 -4.23 -1.26 -4.86 115.64 109.94 3m7n s THR 211 Ca 0.09 0.31 -0.01 0.00 -1.18 0.00 0.00 61.69 60.89 3m7n s THR 211 Cb -0.09 -2.69 0.26 0.00 1.34 0.00 0.00 72.50 71.32 3m7n s THR 211 CO 0.00 -0.41 1.84 -0.09 -0.54 0.00 0.00 174.62 175.42 3m7n h ARG 212 N -1.37 0.95 -0.48 3.99 1.12 -2.00 -1.55 114.38 115.04 3m7n h ARG 212 Ca -0.45 -0.06 -0.10 0.00 -1.11 0.00 0.00 59.98 58.27 3m7n h ARG 212 Cb 1.25 -0.21 -0.02 0.00 -0.01 0.00 0.00 29.97 30.98 3m7n h ARG 212 CO 0.50 0.63 -0.11 -0.44 -3.11 0.00 0.00 179.97 177.43 3m7n h ASP 213 N 0.98 0.87 -0.72 -3.80 3.32 -2.00 -2.78 116.42 112.29 3m7n h ASP 213 Ca 0.45 -0.27 -0.01 0.00 0.02 0.00 0.00 57.03 57.22 3m7n h ASP 213 Cb 0.37 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 3m7n h ASP 213 CO -0.24 1.00 0.41 -0.33 -1.72 0.00 0.00 179.24 178.36 3m7n h GLU 214 N 0.79 0.99 -0.23 3.56 5.08 -1.72 -1.24 114.58 121.82 3m7n h GLU 214 Ca 0.13 -0.11 0.05 0.00 -1.00 0.00 0.00 59.36 58.43 3m7n h GLU 214 Cb 0.63 -0.20 -0.05 0.00 0.50 0.00 0.00 28.75 29.63 3m7n h GLU 214 CO 0.04 0.73 -0.08 0.28 -1.00 0.00 0.00 179.01 178.98 3m7n h VAL 215 N 0.99 0.73 -0.43 3.13 2.07 -1.06 0.20 116.25 121.87 3m7n h VAL 215 Ca 0.25 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.67 3m7n h VAL 215 Cb 0.01 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 3m7n h VAL 215 CO -0.04 0.00 -0.14 0.11 0.02 0.00 0.00 177.57 177.52 3m7n h LYS 216 N -0.03 0.80 -0.64 1.57 1.57 -1.26 -2.55 116.57 116.03 3m7n h LYS 216 Ca 0.11 -0.28 -0.09 0.00 -1.87 0.00 0.00 60.65 58.53 3m7n h LYS 216 Cb 0.21 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 3m7n h LYS 216 CO -0.25 0.90 0.06 1.96 -0.57 0.00 0.00 179.45 181.55 3m7n h GLN 217 N 0.72 1.08 -0.87 3.15 4.20 -0.96 -2.94 115.11 119.48 3m7n h GLN 217 Ca 0.12 -0.30 0.11 0.00 0.06 0.00 0.00 58.65 58.63 3m7n h GLN 217 Cb 0.64 -0.12 -0.08 0.00 0.30 0.00 0.00 27.48 28.22 3m7n h GLN 217 CO 0.04 1.01 0.50 0.00 -0.67 0.00 0.00 178.83 179.72 3m7n h ALA 218 N 1.06 1.27 -0.82 3.87 0.00 -0.20 -1.14 119.26 123.30 3m7n h ALA 218 Ca 0.19 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3m7n h ALA 218 Cb 0.48 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 3m7n h ALA 218 CO 0.02 0.10 0.52 0.82 0.00 0.00 0.00 179.25 180.71 3m7n h ILE 219 N 0.82 1.22 -0.58 0.00 2.04 -1.31 -0.18 117.51 119.53 3m7n h ILE 219 Ca 0.43 -0.45 -0.06 0.00 1.00 0.00 0.00 64.86 65.77 3m7n h ILE 219 Cb 0.43 0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.53 3m7n h ILE 219 CO -0.27 0.22 0.11 -0.33 0.00 0.00 0.00 178.15 177.89 3m7n h GLU 220 N 1.12 0.95 -0.40 2.37 4.39 -1.19 -1.35 114.58 120.48 3m7n h GLU 220 Ca 0.30 -0.25 -0.04 0.00 0.34 0.00 0.00 59.36 59.71 3m7n h GLU 220 Cb -0.08 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.44 3m7n h GLU 220 CO -0.06 0.90 0.11 1.25 -1.16 0.00 0.00 179.01 180.05 3m7n h LEU 221 N 0.85 0.59 -0.87 1.33 6.46 -0.90 -2.49 115.31 120.29 3m7n h LEU 221 Ca 0.18 -0.22 -0.01 0.00 -0.12 0.00 0.00 57.88 57.71 3m7n h LEU 221 Cb 0.40 -0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 40.13 3m7n h LEU 221 CO 0.01 0.66 0.51 0.00 -0.62 0.00 0.00 178.44 178.99 3m7n h ALA 222 N 0.96 1.11 -0.55 1.25 0.00 -0.86 -2.37 119.26 118.80 3m7n h ALA 222 Ca 0.13 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 3m7n h ALA 222 Cb 0.29 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3m7n h ALA 222 CO -0.00 0.58 0.08 0.87 0.00 0.00 0.00 179.25 180.78 3m7n h LYS 223 N 1.20 0.92 -0.30 0.00 1.57 -1.05 0.14 116.57 119.04 3m7n h LYS 223 Ca 0.31 -0.25 0.02 0.00 -1.87 0.00 0.00 60.65 58.86 3m7n h LYS 223 Cb -0.02 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 3m7n h LYS 223 CO -0.06 0.89 0.14 -0.22 -0.57 0.00 0.00 179.45 179.64 3m7n h LYS 224 N 0.80 0.29 -0.53 3.15 3.64 -1.19 -1.11 116.57 121.63 3m7n h LYS 224 Ca 0.17 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 3m7n h LYS 224 Cb 0.42 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 3m7n h LYS 224 CO 0.01 0.19 0.17 0.78 -2.27 0.00 0.00 179.45 178.34 3m7n h GLY 225 N 0.30 0.88 1.01 5.01 0.00 -1.17 -2.93 103.07 106.17 3m7n h GLY 225 Ca 0.13 -0.51 0.01 0.00 0.00 0.00 0.00 47.33 46.95 3m7n h GLY 225 CO -0.09 0.48 0.48 0.00 0.00 0.00 0.00 176.54 177.41 3m7n h ALA 226 N 1.03 0.93 -0.61 3.60 0.00 -0.42 -1.00 119.26 122.80 3m7n h ALA 226 Ca 0.17 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.08 3m7n h ALA 226 Cb 0.26 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 3m7n h ALA 226 CO -0.01 0.36 0.33 -0.07 0.00 0.00 0.00 179.25 179.86 3m7n h LEU 227 N 1.00 0.47 -0.08 0.00 3.38 -1.16 0.32 115.31 119.24 3m7n h LEU 227 Ca 0.27 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.27 3m7n h LEU 227 Cb -0.11 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 3m7n h LEU 227 CO -0.06 0.31 0.05 1.56 0.09 0.00 0.00 178.44 180.39 3m7n h GLN 228 N 0.61 0.10 -0.81 1.13 4.20 -1.22 -2.33 115.11 116.80 3m7n h GLN 228 Ca 0.27 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.98 3m7n h GLN 228 Cb 0.17 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.89 3m7n h GLN 228 CO -0.18 0.10 0.54 0.82 -0.67 0.00 0.00 178.83 179.44 3m7n h ILE 229 N 0.08 1.20 -0.88 2.54 2.04 -0.95 -2.64 117.51 118.90 3m7n h ILE 229 Ca 0.03 -0.38 0.14 0.00 1.00 0.00 0.00 64.86 65.65 3m7n h ILE 229 Cb 0.02 0.01 -0.09 0.00 -0.74 0.00 0.00 36.82 36.02 3m7n h ILE 229 CO -0.01 0.20 0.49 0.22 0.00 0.00 0.00 178.15 179.05 3m7n h TYR 230 N 1.10 0.87 -0.18 1.37 3.20 0.02 0.12 116.97 123.46 3m7n h TYR 230 Ca 0.30 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.16 3m7n h TYR 230 Cb -0.12 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 37.88 3m7n h TYR 230 CO -0.02 0.25 -0.08 0.93 -1.64 0.00 0.00 178.16 177.60 3m7n h GLU 231 N 0.72 0.28 -0.18 1.82 4.39 -1.06 -0.91 114.58 119.64 3m7n h GLU 231 Ca 0.47 -0.06 -0.12 0.00 0.34 0.00 0.00 59.36 59.99 3m7n h GLU 231 Cb 0.62 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.21 3m7n h GLU 231 CO -0.33 0.38 -0.40 0.52 -1.16 0.00 0.00 179.01 178.02 3m7n h MET 232 N 0.27 0.41 -0.20 2.33 2.86 -0.72 -1.98 114.93 117.90 3m7n h MET 232 Ca 0.06 -0.20 -0.08 0.00 -2.06 0.00 0.00 59.70 57.42 3m7n h MET 232 Cb 0.33 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.98 3m7n h MET 232 CO 0.02 0.74 -0.20 1.96 1.06 0.00 0.00 176.91 180.49 3m7n h GLN 233 N 0.34 0.49 -0.84 1.72 4.20 0.00 -2.28 115.11 118.74 3m7n h GLN 233 Ca 0.03 -0.26 0.08 0.00 0.06 0.00 0.00 58.65 58.56 3m7n h GLN 233 Cb 0.85 0.01 -0.07 0.00 0.30 0.00 0.00 27.48 28.57 3m7n h GLN 233 CO 0.07 0.84 0.50 -0.09 -0.67 0.00 0.00 178.83 179.48 3m7n h ARG 234 N 0.17 0.84 -0.32 1.46 2.43 -1.22 -1.70 114.38 116.04 3m7n h ARG 234 Ca 0.03 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.03 3m7n h ARG 234 Cb 0.75 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 3m7n h ARG 234 CO 0.05 0.56 -0.28 1.49 -1.51 0.00 0.00 179.97 180.27 3m7n h GLU 235 N 0.87 0.76 -0.85 0.20 4.81 -1.17 0.20 114.58 119.40 3m7n h GLU 235 Ca 0.39 -0.39 0.09 0.00 -0.13 0.00 0.00 59.36 59.32 3m7n h GLU 235 Cb 0.28 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.60 3m7n h GLU 235 CO -0.21 1.01 0.50 0.00 -0.73 0.00 0.00 179.01 179.58 3m7n h ALA 236 N 0.74 1.20 -0.19 2.92 0.00 -1.10 -1.09 119.26 121.75 3m7n h ALA 236 Ca 0.06 0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.84 3m7n h ALA 236 Cb 0.86 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3m7n h ALA 236 CO 0.07 0.15 -0.50 0.82 0.00 0.00 0.00 179.25 179.79 3m7n h ILE 237 N 0.85 1.32 -0.64 0.00 1.08 -0.65 -2.59 117.51 116.88 3m7n h ILE 237 Ca 0.40 -1.72 -0.05 0.00 -0.39 0.00 0.00 64.86 63.10 3m7n h ILE 237 Cb 0.33 1.72 -0.03 0.00 -3.07 0.00 0.00 36.82 35.77 3m7n h ILE 237 CO -0.23 0.53 0.21 0.25 -0.69 0.00 0.00 178.15 178.23 3m7n h LEU 238 N 0.40 0.88 -0.58 1.44 6.46 -0.02 -0.36 115.31 123.54 3m7n h LEU 238 Ca 0.02 -0.14 -0.13 0.00 -0.12 0.00 0.00 57.88 57.51 3m7n h LEU 238 Cb 1.01 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 40.70 3m7n h LEU 238 CO 0.09 0.82 -0.23 0.03 -0.62 0.00 0.00 178.44 178.53 3m7n h ARG 239 N 0.93 0.89 -0.44 1.25 3.08 -1.07 -0.78 114.38 118.23 3m7n h ARG 239 Ca 0.21 -0.37 -0.02 0.00 0.07 0.00 0.00 59.98 59.87 3m7n h ARG 239 Cb 0.24 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 3m7n h ARG 239 CO -0.01 1.02 0.22 -0.09 -1.07 0.00 0.00 179.97 180.04 3m7n h ARG 240 N 0.76 0.64 -0.88 0.04 9.65 -1.01 0.25 114.38 123.83 3m7n h ARG 240 Ca 0.10 -0.09 0.06 0.00 -1.10 0.00 0.00 59.98 58.95 3m7n h ARG 240 Cb 0.78 -0.12 -0.06 0.00 -1.39 0.00 0.00 29.97 29.18 3m7n h ARG 240 CO 0.06 0.54 0.55 -0.92 2.80 0.00 0.00 179.97 183.01 3m7n h TYR 241 N 0.58 1.02 -0.45 2.20 3.20 -0.83 -1.19 116.97 121.49 3m7n h TYR 241 Ca 0.15 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.95 3m7n h TYR 241 Cb 0.11 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.03 3m7n h TYR 241 CO -0.01 0.53 -0.10 0.82 -1.64 0.00 0.00 178.16 177.75 3m7n h ILE 242 N 1.01 1.27 -0.63 1.81 2.04 -0.06 -3.01 117.51 119.95 3m7n h ILE 242 Ca 0.38 -1.22 -0.06 0.00 1.00 0.00 0.00 64.86 64.96 3m7n h ILE 242 Cb 0.16 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 3m7n h ILE 242 CO -0.17 0.42 0.14 -0.33 0.00 0.00 0.00 178.15 178.21 3m7n h GLU 243 N 0.70 1.01 -0.23 2.37 5.08 0.17 -1.79 114.58 121.90 3m7n h GLU 243 Ca 0.12 -0.25 -0.08 0.00 -1.00 0.00 0.00 59.36 58.14 3m7n h GLU 243 Cb 0.64 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 3m7n h GLU 243 CO 0.04 0.93 -0.22 -0.39 -1.00 0.00 0.00 179.01 178.37 3m7n h VAL 244 N 0.93 1.25 -0.24 3.13 -1.51 -1.26 -1.90 116.25 116.65 3m7n h VAL 244 Ca 0.19 -1.16 -0.13 0.00 -1.23 0.00 0.00 66.70 64.37 3m7n h VAL 244 Cb 0.38 1.31 -0.00 0.00 -2.13 0.00 0.00 31.29 30.85 3m7n h VAL 244 CO 0.01 0.37 -0.38 1.23 -1.23 0.00 0.00 177.57 177.56 3m7n h GLY 245 N 0.98 0.74 2.00 5.19 0.00 -1.35 -1.56 103.07 109.06 3m7n h GLY 245 Ca 0.06 -0.83 0.00 0.00 0.00 0.00 0.00 47.33 46.56 3m7n h GLY 245 CO 0.04 0.75 0.00 1.05 0.00 0.00 0.00 176.54 178.38 3m7n h GLU 246 N 0.39 0.00 -0.15 4.80 4.11 -1.27 -2.87 114.58 119.58 3m7n h GLU 246 Ca 0.02 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.32 3m7n h GLU 246 Cb 0.97 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.23 3m7n h GLU 246 CO 0.09 0.00 -0.43 1.05 0.07 0.00 0.00 179.01 179.79 3m7n h GLU 247 N 0.00 0.56 0.00 1.06 4.11 -1.25 -1.98 114.58 117.08 3m7n h GLU 247 Ca 0.00 -0.40 0.00 0.00 0.07 0.00 0.00 59.36 59.03 3m7n h GLU 247 Cb 0.86 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.18 3m7n h GLU 247 CO 0.00 1.02 0.00 -1.33 0.07 0.00 0.00 179.01 178.77 3m7n n MET 248 N -4.26 0.05 0.00 1.06 2.81 -0.60 0.42 117.12 116.61 3m7n n MET 248 Ca -0.07 0.51 0.05 0.00 -1.81 0.00 0.00 57.70 56.38 3m7n n MET 248 Cb 0.55 -1.65 -0.12 0.00 -0.71 0.00 0.00 33.22 31.30 3m7n n MET 248 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3m7n n ASP 249 N -1.75 0.36 0.02 7.83 9.92 -1.09 -3.73 116.55 128.11 3m7n n ASP 249 Ca 0.00 0.15 -0.13 0.00 -0.53 0.00 0.00 54.79 54.28 3m7n n ASP 249 Cb 0.04 1.10 -0.09 0.00 -0.64 0.00 0.00 41.12 41.53 3m7n n ASP 249 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 3m7n h GLU 250 N 0.00 -0.02 -0.50 -1.24 4.57 0.74 0.44 114.58 118.58 3m7n h GLU 250 Ca -0.14 0.00 0.10 0.00 -1.18 0.00 0.00 59.36 58.14 3m7n h GLU 250 Cb 1.37 0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 29.88 3m7n h GLU 250 CO 0.02 0.27 0.00 0.97 -1.18 0.00 0.00 179.01 179.09 3m7n h ILE 251 N -0.32 0.61 0.00 2.32 2.10 -1.63 0.22 117.51 120.81 3m7n h ILE 251 Ca -0.00 -0.04 0.00 0.00 1.08 0.00 0.00 64.86 65.90 3m7n h ILE 251 Cb 0.30 0.49 0.00 0.00 -1.09 0.00 0.00 36.82 36.52 3m7n h ILE 251 CO 0.00 0.02 0.00 0.41 -1.08 0.00 0.00 178.15 177.50 3m7n n THR 252 N -5.23 1.03 0.71 2.19 -1.04 -1.01 -5.15 114.28 105.79 3m7n n THR 252 Ca 0.05 0.43 0.09 0.00 -2.04 0.00 0.00 64.05 62.58 3m7n n THR 252 Cb 0.27 -1.38 0.07 0.00 -1.82 0.00 0.00 70.33 67.47 3m7n n THR 252 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64