#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gsi s GLN 3 N 0.00 0.29 -0.50 5.55 -1.52 -0.83 -5.00 119.66 117.66 2gsi s GLN 3 Ca 0.00 0.10 -0.12 0.00 -1.95 0.00 0.00 55.36 53.39 2gsi s GLN 3 Cb 0.00 0.08 0.12 0.00 -0.22 0.00 0.00 33.01 32.99 2gsi s GLN 3 CO 0.00 -0.49 0.40 -0.51 -0.25 0.00 0.00 175.29 174.45 2gsi s LEU 4 N 2.53 5.86 0.15 2.90 1.43 -1.26 -0.74 118.68 129.54 2gsi s LEU 4 Ca 0.20 -1.81 -0.23 0.00 -1.03 0.00 0.00 54.13 51.26 2gsi s LEU 4 Cb -0.02 -2.10 -0.08 0.00 0.03 0.00 0.00 46.19 44.03 2gsi s LEU 4 CO -0.19 -0.75 0.71 -1.58 0.23 0.00 0.00 176.35 174.77 2gsi s GLN 5 N 1.47 4.41 0.29 1.70 0.74 0.52 -3.58 119.66 125.22 2gsi s GLN 5 Ca 0.04 0.99 0.09 0.00 0.05 0.00 0.00 55.36 56.54 2gsi s GLN 5 Cb -0.27 -3.19 -0.04 0.00 1.10 0.00 0.00 33.01 30.60 2gsi s GLN 5 CO 0.01 0.56 0.05 -0.65 -0.55 0.00 0.00 175.29 174.72 2gsi s GLN 6 N -1.28 2.36 0.83 1.67 -0.21 -1.26 0.51 119.66 122.28 2gsi s GLN 6 Ca 0.35 -1.44 -0.11 0.00 0.02 0.00 0.00 55.36 54.18 2gsi s GLN 6 Cb -0.21 -2.19 0.09 0.00 1.00 0.00 0.00 33.01 31.70 2gsi s GLN 6 CO 0.23 0.29 1.09 -1.54 -2.12 0.00 0.00 175.29 173.25 2gsi s SER 7 N -3.73 4.11 0.81 5.90 1.04 0.19 -4.96 113.70 117.06 2gsi s SER 7 Ca 0.33 1.47 -0.11 0.00 0.48 0.00 0.00 55.95 58.12 2gsi s SER 7 Cb -0.05 -2.19 0.08 0.00 0.10 0.00 0.00 66.02 63.96 2gsi s SER 7 CO 0.21 -2.23 1.10 -0.83 0.98 0.00 0.00 173.24 172.46 2gsi s GLY 8 N -3.62 1.62 0.27 7.32 0.00 -1.26 -4.60 107.32 107.05 2gsi s GLY 8 Ca 0.62 -0.20 -0.27 0.00 0.00 0.00 0.00 44.72 44.87 2gsi s GLY 8 CO 0.56 0.24 0.64 0.00 0.00 0.00 0.00 173.10 174.54 2gsi n ALA 9 N -3.50 -1.92 -3.10 3.20 0.00 -1.26 -4.81 120.51 109.12 2gsi n ALA 9 Ca 0.07 0.37 -0.26 0.00 0.00 0.00 0.00 53.44 53.62 2gsi n ALA 9 Cb 0.56 -1.74 -0.16 0.00 0.00 0.00 0.00 19.45 18.11 2gsi n ALA 9 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2gsi s GLU 10 N -1.24 1.80 -0.16 0.00 0.41 0.10 -5.00 118.70 114.61 2gsi s GLU 10 Ca 0.62 -0.55 0.01 0.00 -0.41 0.00 0.00 54.97 54.64 2gsi s GLU 10 Cb -0.80 -1.52 0.01 0.00 -1.78 0.00 0.00 34.13 30.04 2gsi s GLU 10 CO 0.58 0.17 -0.20 -1.17 -0.49 0.00 0.00 175.26 174.15 2gsi s LEU 11 N 0.25 2.19 -0.04 1.80 2.96 -1.26 -1.49 118.68 123.09 2gsi s LEU 11 Ca -0.08 -0.60 -0.01 0.00 -0.22 0.00 0.00 54.13 53.22 2gsi s LEU 11 Cb -0.13 -1.48 0.03 0.00 0.50 0.00 0.00 46.19 45.11 2gsi s LEU 11 CO 0.03 0.05 0.04 0.68 -1.32 0.00 0.00 176.35 175.82 2gsi s VAL 12 N 1.02 0.02 0.49 1.68 -7.23 -0.43 -4.95 120.40 110.99 2gsi s VAL 12 Ca -0.02 0.29 -0.22 0.00 -1.81 0.00 0.00 61.98 60.22 2gsi s VAL 12 Cb -0.14 -0.22 -0.08 0.00 0.56 0.00 0.00 36.38 36.49 2gsi s VAL 12 CO -0.06 0.17 1.03 0.54 -0.31 0.00 0.00 175.10 176.47 2gsi n ARG 13 N 4.90 1.28 -1.84 4.82 1.74 -1.26 -3.18 116.66 123.12 2gsi n ARG 13 Ca -0.12 0.47 -0.42 0.00 -0.77 0.00 0.00 57.85 57.01 2gsi n ARG 13 Cb 0.50 -2.14 -0.03 0.00 -1.02 0.00 0.00 32.46 29.77 2gsi n ARG 13 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2gsi s SER 14 N -0.89 6.49 0.00 0.55 0.15 -1.26 -2.25 113.70 116.49 2gsi s SER 14 Ca 0.67 2.72 0.00 0.00 0.70 0.00 0.00 55.95 60.04 2gsi s SER 14 Cb -0.50 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.22 2gsi s SER 14 CO 0.54 -0.90 0.00 0.61 1.20 0.00 0.00 173.24 174.69 2gsi n GLY 15 N 3.88 2.70 3.83 9.45 0.00 0.01 -4.90 105.19 120.15 2gsi n GLY 15 Ca 0.15 -0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 2gsi n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gsi s ALA 16 N -2.60 1.91 0.28 4.61 0.00 -0.96 -3.60 121.76 121.40 2gsi s ALA 16 Ca 0.00 -0.86 0.05 0.00 0.00 0.00 0.00 51.96 51.15 2gsi s ALA 16 Cb 0.00 -2.90 -0.02 0.00 0.00 0.00 0.00 23.12 20.19 2gsi s ALA 16 CO 0.00 -2.44 0.41 -1.12 0.00 0.00 0.00 175.76 172.61 2gsi s SER 17 N -4.42 6.19 -0.12 0.00 0.01 -1.26 -2.23 113.70 111.87 2gsi s SER 17 Ca 0.68 -0.01 -0.07 0.00 1.31 0.00 0.00 55.95 57.86 2gsi s SER 17 Cb -0.09 -1.63 0.05 0.00 0.21 0.00 0.00 66.02 64.55 2gsi s SER 17 CO 0.53 -0.21 0.29 0.54 0.41 0.00 0.00 173.24 174.79 2gsi s VAL 18 N -2.06 -0.03 -0.39 3.43 0.11 -0.28 -5.00 120.40 116.17 2gsi s VAL 18 Ca 0.38 0.11 -0.13 0.00 -2.93 0.00 0.00 61.98 59.42 2gsi s VAL 18 Cb -0.09 -0.44 0.03 0.00 -1.53 0.00 0.00 36.38 34.35 2gsi s VAL 18 CO 0.30 0.05 0.25 -0.75 -3.33 0.00 0.00 175.10 171.62 2gsi s LYS 19 N 1.14 2.88 0.08 1.54 2.20 -1.26 -1.00 119.74 125.31 2gsi s LYS 19 Ca -0.08 -1.07 -0.12 0.00 -0.36 0.00 0.00 55.97 54.33 2gsi s LYS 19 Cb -0.09 -3.85 -0.06 0.00 -1.51 0.00 0.00 37.83 32.32 2gsi s LYS 19 CO -0.08 -0.74 0.45 -0.51 -0.36 0.00 0.00 175.35 174.11 2gsi s LEU 20 N 1.61 4.38 0.16 5.43 1.43 0.48 -4.90 118.68 127.26 2gsi s LEU 20 Ca 0.03 0.92 0.11 0.00 -1.03 0.00 0.00 54.13 54.16 2gsi s LEU 20 Cb -0.19 -2.98 -0.04 0.00 0.03 0.00 0.00 46.19 43.01 2gsi s LEU 20 CO 0.08 0.19 -0.24 -0.94 0.23 0.00 0.00 176.35 175.66 2gsi s SER 21 N -1.59 3.27 -0.24 2.29 1.04 -1.26 -0.11 113.70 117.10 2gsi s SER 21 Ca 0.32 -0.81 -0.03 0.00 0.48 0.00 0.00 55.95 55.91 2gsi s SER 21 Cb -0.15 -0.23 0.11 0.00 0.10 0.00 0.00 66.02 65.85 2gsi s SER 21 CO 0.17 0.12 0.23 0.00 0.98 0.00 0.00 173.24 174.75 2gsi s THR 23 N 2.30 3.41 -0.07 0.00 -1.32 0.18 0.15 115.64 120.30 2gsi s THR 23 Ca 0.08 -0.51 -0.05 0.00 -1.21 0.00 0.00 61.69 60.01 2gsi s THR 23 Cb -0.15 -2.51 -0.04 0.00 -1.51 0.00 0.00 72.50 68.29 2gsi s THR 23 CO -0.22 0.47 0.14 0.00 -2.21 0.00 0.00 174.62 172.80 2gsi s ALA 24 N 0.87 3.84 0.02 11.08 0.00 -0.45 -0.35 121.76 136.77 2gsi s ALA 24 Ca -0.02 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 51.25 2gsi s ALA 24 Cb -0.15 -1.87 -0.02 0.00 0.00 0.00 0.00 23.12 21.09 2gsi s ALA 24 CO 0.01 0.67 -0.07 -1.12 0.00 0.00 0.00 175.76 175.24 2gsi s SER 25 N -1.40 0.84 0.00 0.00 0.01 0.08 -4.85 113.70 108.38 2gsi s SER 25 Ca 0.20 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.10 2gsi s SER 25 Cb -0.12 -0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.09 2gsi s SER 25 CO 0.10 -0.07 0.00 0.61 0.41 0.00 0.00 173.24 174.29 2gsi n GLY 26 N 2.11 0.44 3.60 3.44 0.00 -1.26 -1.97 105.19 111.55 2gsi n GLY 26 Ca -0.18 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.85 2gsi n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2gsi s PHE 27 N -2.00 -0.04 0.21 1.61 -0.12 -1.26 -4.58 117.98 111.81 2gsi s PHE 27 Ca 0.00 -0.03 0.10 0.00 -0.05 0.00 0.00 56.93 56.94 2gsi s PHE 27 Cb 0.00 0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 42.88 2gsi s PHE 27 CO 0.00 -0.20 -0.12 0.54 -0.05 0.00 0.00 175.22 175.39 2gsi s ASN 28 N -2.90 4.05 0.42 1.98 6.03 -1.26 -4.96 114.94 118.31 2gsi s ASN 28 Ca 0.14 -0.71 0.26 0.00 -1.03 0.00 0.00 52.86 51.52 2gsi s ASN 28 Cb 0.05 -0.59 0.72 0.00 -3.03 0.00 0.00 41.25 38.40 2gsi s ASN 28 CO -0.05 0.08 1.74 0.40 -2.03 0.00 0.00 177.10 177.24 2gsi h ILE 29 N 2.61 0.00 -0.01 0.54 2.04 -1.94 -1.86 117.51 118.89 2gsi h ILE 29 Ca -0.45 -0.75 0.00 0.00 1.00 0.00 0.00 64.86 64.66 2gsi h ILE 29 Cb 1.22 1.73 0.00 0.00 -0.74 0.00 0.00 36.82 39.03 2gsi h ILE 29 CO 0.55 0.00 -0.08 2.29 0.00 0.00 0.00 178.15 180.90 2gsi n LYS 30 N -2.92 1.06 0.01 2.37 2.85 -1.26 -2.76 118.16 117.51 2gsi n LYS 30 Ca 0.03 -0.46 0.12 0.00 -1.05 0.00 0.00 58.31 56.94 2gsi n LYS 30 Cb 0.44 -1.49 0.17 0.00 -0.65 0.00 0.00 35.03 33.50 2gsi n LYS 30 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2gsi n ASP 31 N -0.56 0.59 -3.29 -5.58 8.00 -0.70 -4.23 116.55 110.77 2gsi n ASP 31 Ca 0.17 -0.28 -0.15 0.00 0.71 0.00 0.00 54.79 55.23 2gsi n ASP 31 Cb 0.29 0.39 -0.03 0.00 -0.02 0.00 0.00 41.12 41.75 2gsi n ASP 31 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2gsi n TYR 32 N -1.63 0.41 -4.85 1.24 4.02 -1.11 -4.91 117.16 110.32 2gsi n TYR 32 Ca 0.05 -1.20 -0.33 0.00 -0.01 0.00 0.00 57.90 56.41 2gsi n TYR 32 Cb 0.36 -0.17 -0.15 0.00 -0.02 0.00 0.00 39.34 39.37 2gsi n TYR 32 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 2gsi s TYR 33 N -1.83 2.77 -0.43 -0.72 2.02 -0.33 -4.53 117.35 114.30 2gsi s TYR 33 Ca 0.01 -0.66 -0.19 0.00 -0.37 0.00 0.00 57.07 55.87 2gsi s TYR 33 Cb -0.00 -1.81 0.02 0.00 -0.40 0.00 0.00 41.96 39.77 2gsi s TYR 33 CO 0.01 -0.21 0.52 1.41 -1.57 0.00 0.00 175.55 175.71 2gsi s MET 34 N 0.26 3.17 0.46 -0.62 -2.45 0.72 -1.51 119.30 119.32 2gsi s MET 34 Ca -0.10 -0.61 -0.01 0.00 -1.25 0.00 0.00 55.69 53.72 2gsi s MET 34 Cb -0.16 -3.96 -0.01 0.00 1.25 0.00 0.00 34.83 31.95 2gsi s MET 34 CO 0.06 -0.92 0.70 0.71 1.05 0.00 0.00 175.02 176.62 2gsi s TYR 35 N 2.41 3.30 0.05 4.11 1.51 -0.96 0.44 117.35 128.20 2gsi s TYR 35 Ca 0.16 0.37 0.05 0.00 -1.01 0.00 0.00 57.07 56.64 2gsi s TYR 35 Cb -0.16 -2.31 -0.02 0.00 -0.11 0.00 0.00 41.96 39.36 2gsi s TYR 35 CO 0.16 -0.34 -0.14 -1.58 -1.11 0.00 0.00 175.55 172.54 2gsi s TRP 36 N -2.60 1.18 -0.00 2.71 0.52 -0.47 -2.26 118.94 118.02 2gsi s TRP 36 Ca 0.48 -0.39 -0.04 0.00 0.02 0.00 0.00 56.10 56.16 2gsi s TRP 36 Cb -0.10 -0.69 -0.00 0.00 -1.15 0.00 0.00 33.47 31.53 2gsi s TRP 36 CO 0.39 0.04 0.08 0.08 0.02 0.00 0.00 176.95 177.56 2gsi s VAL 37 N -1.02 0.07 -0.06 4.03 1.01 -0.25 -0.40 120.40 123.77 2gsi s VAL 37 Ca -0.00 -0.56 0.06 0.00 0.00 0.00 0.00 61.98 61.47 2gsi s VAL 37 Cb -0.09 -0.31 -0.01 0.00 0.00 0.00 0.00 36.38 35.98 2gsi s VAL 37 CO 0.02 -0.31 -0.24 -0.75 0.00 0.00 0.00 175.10 173.82 2gsi s LYS 38 N -1.01 2.48 -0.20 2.72 2.20 0.80 -0.04 119.74 126.70 2gsi s LYS 38 Ca -0.11 -0.85 0.01 0.00 -0.36 0.00 0.00 55.97 54.66 2gsi s LYS 38 Cb -0.06 -2.08 0.03 0.00 -1.51 0.00 0.00 37.83 34.21 2gsi s LYS 38 CO 0.00 0.33 -0.18 -1.17 -0.36 0.00 0.00 175.35 173.98 2gsi s LEU 39 N -0.07 2.41 0.45 5.43 2.96 -0.06 -0.69 118.68 129.11 2gsi s LEU 39 Ca -0.05 -0.81 0.08 0.00 -0.22 0.00 0.00 54.13 53.12 2gsi s LEU 39 Cb -0.14 -1.49 0.01 0.00 0.50 0.00 0.00 46.19 45.07 2gsi s LEU 39 CO 0.04 -0.04 0.48 -0.13 -1.32 0.00 0.00 176.35 175.38 2gsi s ARG 40 N 1.25 2.57 -0.20 1.98 0.52 -1.23 -0.41 118.95 123.43 2gsi s ARG 40 Ca 0.02 -1.51 -0.28 0.00 -0.52 0.00 0.00 55.73 53.44 2gsi s ARG 40 Cb -0.15 -2.49 -0.05 0.00 0.52 0.00 0.00 34.95 32.78 2gsi s ARG 40 CO -0.11 -0.33 2.08 -2.14 0.02 0.00 0.00 175.30 174.82 2gsi s PRO 41 N -4.27 3.34 0.00 3.54 0.02 -1.26 -1.82 135.00 134.55 2gsi s PRO 41 Ca 0.50 1.98 0.00 0.00 0.02 0.00 0.00 61.00 63.50 2gsi s PRO 41 Cb -0.05 -4.29 0.00 0.00 0.02 0.00 0.00 34.50 30.17 2gsi s PRO 41 CO 0.30 -1.87 0.00 0.39 -0.33 0.00 0.00 177.00 175.49 2gsi n GLU 42 N 8.48 0.00 0.01 5.54 1.02 -1.26 -4.70 120.64 129.73 2gsi n GLU 42 Ca 0.27 0.00 0.09 0.00 -0.02 0.00 0.00 57.16 57.50 2gsi n GLU 42 Cb 0.45 -2.33 0.40 0.00 -0.02 0.00 0.00 31.44 29.94 2gsi n GLU 42 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 2gsi n GLN 43 N -0.33 0.02 0.00 3.49 7.27 -0.76 -5.03 117.38 122.05 2gsi n GLN 43 Ca 0.00 0.20 0.00 0.00 0.07 0.00 0.00 57.00 57.27 2gsi n GLN 43 Cb 0.00 -1.54 0.00 0.00 2.41 0.00 0.00 30.24 31.11 2gsi n GLN 43 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2gsi n GLY 44 N 0.41 2.43 3.72 1.69 0.00 -1.25 -4.91 105.19 107.28 2gsi n GLY 44 Ca 0.04 -1.82 -0.42 0.00 0.00 0.00 0.00 46.02 43.83 2gsi n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gsi s LEU 45 N 0.00 4.41 0.02 0.99 1.43 -1.26 -3.53 118.68 120.74 2gsi s LEU 45 Ca 0.00 1.98 0.07 0.00 -1.03 0.00 0.00 54.13 55.15 2gsi s LEU 45 Cb 0.00 -3.59 -0.03 0.00 0.03 0.00 0.00 46.19 42.61 2gsi s LEU 45 CO 0.00 -0.36 -0.21 -1.61 0.23 0.00 0.00 176.35 174.40 2gsi s GLU 46 N 0.60 2.07 -0.06 1.70 2.02 0.13 -4.94 118.70 120.22 2gsi s GLU 46 Ca 0.55 -0.97 -0.18 0.00 0.02 0.00 0.00 54.97 54.39 2gsi s GLU 46 Cb -0.28 -2.13 -0.05 0.00 0.10 0.00 0.00 34.13 31.77 2gsi s GLU 46 CO 0.31 0.55 0.50 -0.46 0.02 0.00 0.00 175.26 176.18 2gsi s TRP 47 N -0.80 3.60 -0.15 1.61 -0.11 -1.26 -0.14 118.94 121.69 2gsi s TRP 47 Ca 0.12 1.00 -0.08 0.00 1.22 0.00 0.00 56.10 58.37 2gsi s TRP 47 Cb -0.10 -2.53 -0.24 0.00 -1.50 0.00 0.00 33.47 29.10 2gsi s TRP 47 CO 0.02 0.30 0.27 -0.89 -4.62 0.00 0.00 176.95 172.04 2gsi n ILE 48 N 3.09 1.72 -0.77 5.86 5.41 0.46 -4.76 119.36 130.36 2gsi n ILE 48 Ca -0.08 -0.57 0.00 0.00 1.00 0.00 0.00 62.75 63.10 2gsi n ILE 48 Cb 0.52 -1.74 0.00 0.00 -0.71 0.00 0.00 39.64 37.70 2gsi n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2gsi n GLY 49 N 1.94 0.01 3.23 7.39 0.00 -1.24 -0.31 105.19 116.22 2gsi n GLY 49 Ca -0.34 -1.71 -0.14 0.00 0.00 0.00 0.00 46.02 43.83 2gsi n GLY 49 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2gsi s TRP 50 N -1.92 1.28 0.03 1.61 1.48 -0.90 -1.37 118.94 119.16 2gsi s TRP 50 Ca 0.00 -1.43 0.02 0.00 -1.06 0.00 0.00 56.10 53.63 2gsi s TRP 50 Cb 0.00 -0.57 -0.02 0.00 -1.16 0.00 0.00 33.47 31.72 2gsi s TRP 50 CO 0.00 -0.71 -0.07 -1.50 -4.06 0.00 0.00 176.95 170.61 2gsi s ILE 51 N -3.97 0.50 -0.43 0.66 2.07 0.17 -3.05 121.20 117.14 2gsi s ILE 51 Ca 0.39 -0.81 -0.04 0.00 -1.41 0.00 0.00 60.65 58.79 2gsi s ILE 51 Cb 0.06 -0.52 0.12 0.00 0.13 0.00 0.00 42.46 42.24 2gsi s ILE 51 CO 0.16 -0.22 0.24 -0.62 -1.91 0.00 0.00 174.94 172.58 2gsi s ASP 52 N -1.11 5.31 0.35 4.50 -1.08 0.16 -0.20 116.67 124.60 2gsi s ASP 52 Ca -0.06 -2.08 0.23 0.00 -0.52 0.00 0.00 52.55 50.12 2gsi s ASP 52 Cb -0.07 -1.85 1.24 0.00 -1.46 0.00 0.00 42.92 40.77 2gsi s ASP 52 CO 0.00 -0.55 1.69 -0.65 0.52 0.00 0.00 175.17 176.18 2gsi h PRO 52 N 8.02 0.00 -0.00 4.34 0.11 -1.80 0.34 132.00 143.01 2gsi h PRO 52 Ca -0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.98 2gsi h PRO 52 Cb 1.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2gsi h PRO 52 CO 0.72 0.00 -0.03 -1.91 -0.21 0.00 0.00 178.00 176.57 2gsi n GLU 53 N -2.31 0.76 -0.31 1.05 2.13 -1.26 -4.44 120.64 116.26 2gsi n GLU 53 Ca -0.02 -0.13 -0.00 0.00 0.66 0.00 0.00 57.16 57.68 2gsi n GLU 53 Cb 0.06 -1.50 -0.00 0.00 0.27 0.00 0.00 31.44 30.27 2gsi n GLU 53 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 2gsi n ASN 54 N -1.01 -0.03 0.00 4.31 0.23 -0.30 -5.02 115.26 113.44 2gsi n ASN 54 Ca 0.18 -0.60 0.00 0.00 -0.53 0.00 0.00 54.58 53.63 2gsi n ASN 54 Cb 0.22 0.01 0.00 0.00 -2.08 0.00 0.00 39.78 37.93 2gsi n ASN 54 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2gsi n GLY 55 N 0.00 0.09 3.71 4.83 0.00 0.10 -4.94 105.19 108.98 2gsi n GLY 55 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 2gsi n GLY 55 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2gsi n ASP 56 N -0.67 3.37 -4.19 1.61 8.00 -1.21 -4.84 116.55 118.63 2gsi n ASP 56 Ca 0.00 1.13 -0.14 0.00 0.71 0.00 0.00 54.79 56.49 2gsi n ASP 56 Cb 0.33 -1.51 -0.11 0.00 -0.02 0.00 0.00 41.12 39.81 2gsi n ASP 56 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2gsi s THR 57 N 0.15 0.97 -0.21 -3.53 -4.23 -1.26 -0.67 115.64 106.86 2gsi s THR 57 Ca 0.68 -1.71 -0.07 0.00 -1.18 0.00 0.00 61.69 59.41 2gsi s THR 57 Cb -0.57 -1.44 0.10 0.00 1.34 0.00 0.00 72.50 71.92 2gsi s THR 57 CO 0.47 -0.59 0.44 -0.70 -0.54 0.00 0.00 174.62 173.70 2gsi s GLU 58 N -2.96 0.35 -0.00 3.99 2.12 -1.17 -5.01 118.70 116.02 2gsi s GLU 58 Ca 0.07 1.07 -0.00 0.00 0.36 0.00 0.00 54.97 56.47 2gsi s GLU 58 Cb -0.02 0.37 -0.04 0.00 0.26 0.00 0.00 34.13 34.71 2gsi s GLU 58 CO -0.00 -0.26 0.07 0.71 -0.54 0.00 0.00 175.26 175.25 2gsi s TYR 59 N 2.64 3.27 0.21 5.30 4.12 -1.26 -2.12 117.35 129.51 2gsi s TYR 59 Ca -0.02 0.19 -0.32 0.00 0.02 0.00 0.00 57.07 56.95 2gsi s TYR 59 Cb -0.12 -1.73 -0.14 0.00 -1.52 0.00 0.00 41.96 38.45 2gsi s TYR 59 CO -0.13 0.54 1.30 0.28 0.02 0.00 0.00 175.55 177.55 2gsi n VAL 60 N 1.19 0.97 -0.31 0.71 0.31 0.58 -4.81 118.33 116.97 2gsi n VAL 60 Ca -0.13 -0.24 0.08 0.00 -0.01 0.00 0.00 64.34 64.04 2gsi n VAL 60 Cb 0.53 -1.21 0.24 0.00 -0.91 0.00 0.00 33.84 32.49 2gsi n VAL 60 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2gsi h PRO 61 N 3.79 0.66 0.00 5.55 0.11 -1.97 0.14 132.00 140.28 2gsi h PRO 61 Ca -0.44 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2gsi h PRO 61 Cb 1.30 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2gsi h PRO 61 CO 0.73 0.43 0.00 0.25 -0.21 0.00 0.00 178.00 179.20 2gsi n THR 62 N -4.83 0.46 0.01 -1.15 -2.24 -1.26 -2.94 114.28 102.33 2gsi n THR 62 Ca 0.18 0.12 0.00 0.00 -2.27 0.00 0.00 64.05 62.08 2gsi n THR 62 Cb 0.45 -0.96 -0.00 0.00 -2.10 0.00 0.00 70.33 67.72 2gsi n THR 62 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2gsi n PHE 63 N -1.17 0.00 -1.74 4.78 3.01 0.44 -4.91 117.46 117.87 2gsi n PHE 63 Ca 0.06 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.10 2gsi n PHE 63 Cb 0.06 -0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.50 2gsi n PHE 63 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 2gsi s GLN 64 N -1.29 4.13 0.00 -1.08 -0.21 -0.93 -1.42 119.66 118.86 2gsi s GLN 64 Ca 0.00 2.59 0.00 0.00 0.02 0.00 0.00 55.36 57.97 2gsi s GLN 64 Cb 0.00 -3.11 0.00 0.00 1.00 0.00 0.00 33.01 30.90 2gsi s GLN 64 CO 0.01 -0.75 0.00 0.41 -2.12 0.00 0.00 175.29 172.84 2gsi n GLY 65 N 3.98 2.42 0.26 3.09 0.00 -1.26 -4.74 105.19 108.94 2gsi n GLY 65 Ca 0.16 -0.18 0.01 0.00 0.00 0.00 0.00 46.02 46.01 2gsi n GLY 65 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2gsi h LYS 66 N 0.00 0.39 -3.74 1.61 1.63 -1.59 -3.46 116.57 111.41 2gsi h LYS 66 Ca 0.00 -0.08 -0.33 0.00 -0.85 0.00 0.00 60.65 59.39 2gsi h LYS 66 Cb 0.00 -0.06 -0.33 0.00 -0.60 0.00 0.00 32.23 31.24 2gsi h LYS 66 CO 0.00 0.45 -0.74 0.08 -3.45 0.00 0.00 179.45 175.79 2gsi s VAL 67 N -4.90 0.16 -0.18 2.00 1.01 -1.03 -4.36 120.40 113.10 2gsi s VAL 67 Ca -0.07 0.07 0.01 0.00 0.00 0.00 0.00 61.98 61.99 2gsi s VAL 67 Cb 0.16 -0.25 0.02 0.00 0.00 0.00 0.00 36.38 36.31 2gsi s VAL 67 CO 0.75 0.13 -0.19 -0.89 0.00 0.00 0.00 175.10 174.89 2gsi s THR 68 N 0.89 2.11 -0.12 3.92 2.01 0.43 -4.88 115.64 119.99 2gsi s THR 68 Ca -0.09 -0.95 -0.12 0.00 0.31 0.00 0.00 61.69 60.84 2gsi s THR 68 Cb -0.12 -1.90 -0.05 0.00 0.01 0.00 0.00 72.50 70.45 2gsi s THR 68 CO -0.02 0.52 0.26 -0.04 -0.69 0.00 0.00 174.62 174.65 2gsi s MET 69 N 1.29 3.98 0.29 4.92 -1.94 -1.26 -0.34 119.30 126.24 2gsi s MET 69 Ca 0.05 0.06 0.04 0.00 -1.71 0.00 0.00 55.69 54.13 2gsi s MET 69 Cb -0.13 -3.33 -0.03 0.00 2.01 0.00 0.00 34.83 33.35 2gsi s MET 69 CO -0.12 0.47 0.22 0.95 -0.01 0.00 0.00 175.02 176.52 2gsi s THR 70 N -0.22 0.07 -0.11 2.05 -4.23 -1.01 -5.00 115.64 107.18 2gsi s THR 70 Ca 0.16 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.60 2gsi s THR 70 Cb -0.13 -2.50 0.04 0.00 1.34 0.00 0.00 72.50 71.25 2gsi s THR 70 CO 0.05 0.00 0.27 0.00 -0.54 0.00 0.00 174.62 174.40 2gsi s ALA 71 N -3.66 -0.65 -0.45 3.99 0.00 -1.26 -1.14 121.76 118.60 2gsi s ALA 71 Ca 0.39 0.96 -0.14 0.00 0.00 0.00 0.00 51.96 53.17 2gsi s ALA 71 Cb 0.04 -0.59 0.06 0.00 0.00 0.00 0.00 23.12 22.63 2gsi s ALA 71 CO 0.21 -0.18 0.35 0.34 0.00 0.00 0.00 175.76 176.48 2gsi s ASP 72 N 0.86 6.05 0.39 0.00 -1.08 0.89 -4.95 116.67 118.83 2gsi s ASP 72 Ca -0.06 -1.24 0.21 0.00 -0.52 0.00 0.00 52.55 50.94 2gsi s ASP 72 Cb -0.07 -2.15 0.50 0.00 -1.46 0.00 0.00 42.92 39.74 2gsi s ASP 72 CO -0.06 -0.58 1.64 0.71 0.52 0.00 0.00 175.17 177.41 2gsi h THR 73 N 5.78 0.52 -0.50 1.71 1.35 -1.93 -0.38 112.91 119.45 2gsi h THR 73 Ca -0.27 -1.47 0.11 0.00 -0.55 0.00 0.00 66.41 64.22 2gsi h THR 73 Cb 1.11 2.05 -0.03 0.00 -1.73 0.00 0.00 68.15 69.55 2gsi h THR 73 CO 0.82 0.26 0.35 0.77 -0.25 0.00 0.00 175.52 177.47 2gsi h SER 74 N 0.00 0.17 0.00 5.36 4.64 -1.95 -2.99 113.55 118.78 2gsi h SER 74 Ca -0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 2gsi h SER 74 Cb 1.03 -0.03 -0.07 0.00 -0.31 0.00 0.00 62.40 63.03 2gsi h SER 74 CO 0.03 0.10 -0.48 -1.54 -0.87 0.00 0.00 176.83 174.08 2gsi n SER 75 N -4.44 0.81 -4.14 4.97 3.41 -1.14 -5.02 113.62 108.07 2gsi n SER 75 Ca 0.08 -2.37 -0.32 0.00 -0.26 0.00 0.00 58.87 56.00 2gsi n SER 75 Cb 0.44 -0.29 -0.03 0.00 -0.26 0.00 0.00 64.21 64.07 2gsi n SER 75 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2gsi n ASN 76 N -0.32 -1.76 -4.06 4.04 5.15 -0.25 -4.79 115.26 113.27 2gsi n ASN 76 Ca 0.06 -1.04 -0.20 0.00 -0.60 0.00 0.00 54.58 52.80 2gsi n ASN 76 Cb 0.76 -2.73 -0.15 0.00 -0.53 0.00 0.00 39.78 37.14 2gsi n ASN 76 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2gsi s THR 77 N -3.64 0.86 0.22 -0.44 2.01 -0.63 -1.34 115.64 112.67 2gsi s THR 77 Ca 0.40 -0.51 0.08 0.00 0.31 0.00 0.00 61.69 61.98 2gsi s THR 77 Cb -0.22 -0.73 -0.04 0.00 0.01 0.00 0.00 72.50 71.52 2gsi s THR 77 CO 0.92 0.22 0.01 0.00 -0.69 0.00 0.00 174.62 175.08 2gsi s ALA 78 N -0.31 3.21 0.02 7.40 0.00 0.40 -0.07 121.76 132.41 2gsi s ALA 78 Ca 0.04 -1.49 0.01 0.00 0.00 0.00 0.00 51.96 50.52 2gsi s ALA 78 Cb -0.04 -0.93 -0.02 0.00 0.00 0.00 0.00 23.12 22.13 2gsi s ALA 78 CO -0.00 0.37 -0.04 0.71 0.00 0.00 0.00 175.76 176.80 2gsi s TYR 79 N -2.00 0.37 -0.16 0.00 1.51 -0.29 -0.56 117.35 116.23 2gsi s TYR 79 Ca 0.29 -0.36 -0.02 0.00 -1.01 0.00 0.00 57.07 55.97 2gsi s TYR 79 Cb -0.08 -0.24 0.05 0.00 -0.11 0.00 0.00 41.96 41.58 2gsi s TYR 79 CO 0.20 -0.10 0.01 -1.17 -1.11 0.00 0.00 175.55 173.38 2gsi s LEU 80 N -1.04 1.13 -0.24 -1.29 2.96 0.84 -2.41 118.68 118.63 2gsi s LEU 80 Ca -0.09 -0.61 -0.13 0.00 -0.22 0.00 0.00 54.13 53.09 2gsi s LEU 80 Cb -0.07 -0.62 -0.04 0.00 0.50 0.00 0.00 46.19 45.95 2gsi s LEU 80 CO -0.00 -0.25 0.28 -1.58 -1.32 0.00 0.00 176.35 173.48 2gsi s GLN 81 N 1.84 4.07 0.35 1.98 0.74 0.54 -0.39 119.66 128.79 2gsi s GLN 81 Ca 0.01 -0.07 0.08 0.00 0.05 0.00 0.00 55.36 55.42 2gsi s GLN 81 Cb -0.15 -3.59 -0.03 0.00 1.10 0.00 0.00 33.01 30.34 2gsi s GLN 81 CO -0.07 -0.09 0.28 -0.51 -0.55 0.00 0.00 175.29 174.35 2gsi s LEU 82 N 1.48 3.49 0.00 3.68 1.43 -0.17 -0.43 118.68 128.16 2gsi s LEU 82 Ca 0.12 -0.61 0.00 0.00 -1.03 0.00 0.00 54.13 52.62 2gsi s LEU 82 Cb -0.15 -2.08 0.00 0.00 0.03 0.00 0.00 46.19 43.99 2gsi s LEU 82 CO 0.08 -0.41 0.00 -1.54 0.23 0.00 0.00 176.35 174.71 2gsi n SER 82 N -1.37 0.00 -4.91 2.29 3.41 -1.10 -1.13 113.62 110.81 2gsi n SER 82 Ca -0.01 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.31 2gsi n SER 82 Cb 0.60 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.52 2gsi n SER 82 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2gsi s LEU 82 N 0.00 4.20 0.00 1.04 1.43 -0.95 -4.81 118.68 119.60 2gsi s LEU 82 Ca 0.00 0.55 0.03 0.00 -1.03 0.00 0.00 54.13 53.68 2gsi s LEU 82 Cb 0.00 -3.31 -0.01 0.00 0.03 0.00 0.00 46.19 42.90 2gsi s LEU 82 CO 0.00 -0.04 0.11 0.35 0.23 0.00 0.00 176.35 177.00 2gsi n THR 83 N -0.44 0.00 0.11 5.49 -2.24 -1.26 -0.81 114.28 115.13 2gsi n THR 83 Ca -0.03 -1.65 -0.13 0.00 -2.27 0.00 0.00 64.05 59.98 2gsi n THR 83 Cb 0.53 0.61 -0.06 0.00 -2.10 0.00 0.00 70.33 69.31 2gsi n THR 83 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2gsi h SER 84 N 1.15 -0.43 -0.52 3.42 0.02 -1.99 -1.03 113.55 114.16 2gsi h SER 84 Ca -0.21 0.05 0.18 0.00 -0.84 0.00 0.00 61.79 60.97 2gsi h SER 84 Cb 0.84 0.16 -0.06 0.00 0.14 0.00 0.00 62.40 63.48 2gsi h SER 84 CO 0.34 -0.24 0.33 -0.62 -1.14 0.00 0.00 176.83 175.50 2gsi n GLU 85 N -5.29 -0.02 0.00 3.45 4.71 -1.26 0.39 120.64 122.63 2gsi n GLU 85 Ca -0.07 0.49 0.13 0.00 -0.01 0.00 0.00 57.16 57.71 2gsi n GLU 85 Cb 0.20 -0.96 0.50 0.00 -1.01 0.00 0.00 31.44 30.17 2gsi n GLU 85 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2gsi n ASP 86 N -3.48 0.38 -4.65 1.62 8.00 -0.39 -4.77 116.55 113.27 2gsi n ASP 86 Ca 0.16 -0.22 -0.42 0.00 0.71 0.00 0.00 54.79 55.01 2gsi n ASP 86 Cb 0.60 -0.09 -0.03 0.00 -0.02 0.00 0.00 41.12 41.59 2gsi n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2gsi s THR 87 N -2.76 3.46 0.13 -3.53 2.01 0.16 -4.82 115.64 110.29 2gsi s THR 87 Ca 0.20 0.54 -0.24 0.00 0.31 0.00 0.00 61.69 62.50 2gsi s THR 87 Cb 0.19 -3.39 0.08 0.00 0.01 0.00 0.00 72.50 69.39 2gsi s THR 87 CO 0.55 -0.10 1.11 0.00 -0.69 0.00 0.00 174.62 175.50 2gsi s ALA 88 N 4.70 -1.84 -0.21 7.40 0.00 -0.78 -4.82 121.76 126.21 2gsi s ALA 88 Ca 0.78 -0.29 -0.07 0.00 0.00 0.00 0.00 51.96 52.38 2gsi s ALA 88 Cb -0.33 0.83 -0.03 0.00 0.00 0.00 0.00 23.12 23.58 2gsi s ALA 88 CO 0.32 -1.09 0.05 0.08 0.00 0.00 0.00 175.76 175.11 2gsi s VAL 89 N -2.04 4.34 -0.23 0.00 1.01 0.45 -0.95 120.40 122.98 2gsi s VAL 89 Ca 0.25 -0.18 -0.09 0.00 0.00 0.00 0.00 61.98 61.96 2gsi s VAL 89 Cb -0.02 -2.98 -0.04 0.00 0.00 0.00 0.00 36.38 33.33 2gsi s VAL 89 CO 0.04 0.40 0.12 -0.31 0.00 0.00 0.00 175.10 175.35 2gsi s TYR 90 N 1.05 3.26 -0.06 5.22 1.51 0.98 -0.88 117.35 128.42 2gsi s TYR 90 Ca 0.03 0.08 0.03 0.00 -1.01 0.00 0.00 57.07 56.20 2gsi s TYR 90 Cb -0.14 -2.22 -0.02 0.00 -0.11 0.00 0.00 41.96 39.47 2gsi s TYR 90 CO 0.03 0.01 -0.14 0.71 -1.11 0.00 0.00 175.55 175.05 2gsi s TYR 91 N 0.98 2.73 0.05 2.71 1.51 0.95 -0.31 117.35 125.97 2gsi s TYR 91 Ca 0.06 -0.24 -0.05 0.00 -1.01 0.00 0.00 57.07 55.83 2gsi s TYR 91 Cb -0.14 -1.67 -0.05 0.00 -0.11 0.00 0.00 41.96 40.00 2gsi s TYR 91 CO 0.03 0.12 0.29 0.00 -1.11 0.00 0.00 175.55 174.88 2gsi s ASN 93 N -2.02 1.19 -0.42 0.00 3.84 -0.96 -0.26 114.94 116.32 2gsi s ASN 93 Ca 0.32 -0.17 -0.27 0.00 0.21 0.00 0.00 52.86 52.95 2gsi s ASN 93 Cb -0.13 0.51 -0.04 0.00 -0.55 0.00 0.00 41.25 41.04 2gsi s ASN 93 CO 0.20 -0.32 2.10 0.00 -2.79 0.00 0.00 177.10 176.29 2gsi s ALA 94 N 2.37 2.29 0.05 1.71 0.00 -0.63 -2.27 121.76 125.28 2gsi s ALA 94 Ca 0.08 0.11 0.04 0.00 0.00 0.00 0.00 51.96 52.19 2gsi s ALA 94 Cb -0.16 -4.20 -0.02 0.00 0.00 0.00 0.00 23.12 18.74 2gsi s ALA 94 CO -0.14 -3.53 -0.11 0.20 0.00 0.00 0.00 175.76 172.19 2gsi s GLY 95 N 8.98 0.67 0.07 0.00 0.00 -0.57 -2.04 107.32 114.43 2gsi s GLY 95 Ca 0.88 -0.84 -0.26 0.00 0.00 0.00 0.00 44.72 44.49 2gsi s GLY 95 CO 0.29 -0.87 0.63 0.54 0.00 0.00 0.00 173.10 173.69 2gsi s VAL 96 N -1.21 0.00 -0.27 1.40 0.11 -1.26 -1.19 120.40 117.99 2gsi s VAL 96 Ca -0.05 -0.01 -0.03 0.00 -2.93 0.00 0.00 61.98 58.96 2gsi s VAL 96 Cb -0.09 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.78 2gsi s VAL 96 CO 0.01 -0.01 -0.01 -0.63 -3.33 0.00 0.00 175.10 171.14 2gsi s ILE 97 N -2.60 3.25 0.35 7.04 -1.09 -1.26 -4.87 121.20 122.02 2gsi s ILE 97 Ca -0.04 -0.97 -0.28 0.00 -2.23 0.00 0.00 60.65 57.13 2gsi s ILE 97 Cb -0.01 -2.69 -0.12 0.00 -1.58 0.00 0.00 42.46 38.06 2gsi s ILE 97 CO -0.03 0.11 1.35 0.35 -1.23 0.00 0.00 174.94 175.49 2gsi n THR 98 N 4.73 2.01 -1.11 2.92 -2.24 -1.26 -4.81 114.28 114.52 2gsi n THR 98 Ca -0.15 -0.50 -0.30 0.00 -2.27 0.00 0.00 64.05 60.83 2gsi n THR 98 Cb 0.47 -1.69 -0.05 0.00 -2.10 0.00 0.00 70.33 66.95 2gsi n THR 98 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2gsi n MET 99 N 0.51 2.98 0.00 -0.78 2.81 -1.26 -4.57 117.12 116.81 2gsi n MET 99 Ca 0.04 -1.77 0.00 0.00 -1.81 0.00 0.00 57.70 54.16 2gsi n MET 99 Cb 0.37 -2.54 0.00 0.00 -0.71 0.00 0.00 33.22 30.33 2gsi n MET 99 CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 2gsi n MET 100 N 3.47 0.00 0.00 0.03 2.81 -1.26 -5.03 117.12 117.14 2gsi n MET 100 Ca 0.64 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.53 2gsi n MET 100 Cb 0.34 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.85 2gsi n MET 100 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2gsi n GLY 100 N 1.02 0.71 3.80 3.03 0.00 -1.26 -5.07 105.19 107.42 2gsi n GLY 100 Ca 0.00 -0.72 -0.32 0.00 0.00 0.00 0.00 46.02 44.98 2gsi n GLY 100 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gsi s TYR 100 N 0.00 2.92 -0.36 1.61 1.51 -1.26 -4.90 117.35 116.86 2gsi s TYR 100 Ca 0.00 1.51 -0.40 0.00 -1.01 0.00 0.00 57.07 57.17 2gsi s TYR 100 Cb 0.00 -3.02 -0.15 0.00 -0.11 0.00 0.00 41.96 38.67 2gsi s TYR 100 CO 0.00 -1.26 1.96 1.04 -1.11 0.00 0.00 175.55 176.17 2gsi n GLN 100 N -2.29 0.81 -2.49 -0.62 6.02 -1.26 -4.67 117.38 112.88 2gsi n GLN 100 Ca 0.09 0.26 -0.42 0.00 -0.01 0.00 0.00 57.00 56.92 2gsi n GLN 100 Cb 0.53 -2.05 -0.03 0.00 1.02 0.00 0.00 30.24 29.71 2gsi n GLN 100 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2gsi s ALA 100 N 5.22 3.37 -0.13 -1.58 0.00 -1.26 -5.03 121.76 122.35 2gsi s ALA 100 Ca 1.07 0.73 0.01 0.00 0.00 0.00 0.00 51.96 53.77 2gsi s ALA 100 Cb -1.12 -3.44 -0.01 0.00 0.00 0.00 0.00 23.12 18.55 2gsi s ALA 100 CO 0.62 -0.48 -0.16 -1.64 0.00 0.00 0.00 175.76 174.10 2gsi s MET 100 N 1.35 3.25 0.06 0.00 -1.94 -1.26 -5.11 119.30 115.65 2gsi s MET 100 Ca 0.57 -0.75 0.06 0.00 -1.71 0.00 0.00 55.69 53.85 2gsi s MET 100 Cb -0.27 -2.57 -0.03 0.00 2.01 0.00 0.00 34.83 33.98 2gsi s MET 100 CO 0.27 0.13 -0.16 -0.51 -0.01 0.00 0.00 175.02 174.74 2gsi s ASP 101 N 0.54 1.85 0.02 3.03 1.11 -1.26 -4.88 116.67 117.07 2gsi s ASP 101 Ca -0.10 -0.55 0.07 0.00 0.18 0.00 0.00 52.55 52.14 2gsi s ASP 101 Cb -0.16 -0.10 -0.02 0.00 1.07 0.00 0.00 42.92 43.71 2gsi s ASP 101 CO 0.04 0.00 -0.19 -0.31 1.18 0.00 0.00 175.17 175.89 2gsi s TYR 102 N -1.05 1.71 -0.03 4.23 1.51 -0.86 -5.02 117.35 117.83 2gsi s TYR 102 Ca 0.01 -0.35 0.07 0.00 -1.01 0.00 0.00 57.07 55.79 2gsi s TYR 102 Cb -0.09 -1.05 -0.02 0.00 -0.11 0.00 0.00 41.96 40.70 2gsi s TYR 102 CO 0.02 0.04 -0.24 -1.58 -1.11 0.00 0.00 175.55 172.68 2gsi s TRP 103 N -0.68 2.24 0.74 2.71 0.52 -1.26 -1.60 118.94 121.61 2gsi s TRP 103 Ca 0.07 -0.52 -0.12 0.00 0.02 0.00 0.00 56.10 55.55 2gsi s TRP 103 Cb -0.08 -1.45 0.04 0.00 -1.15 0.00 0.00 33.47 30.83 2gsi s TRP 103 CO 0.01 -0.10 1.10 0.20 0.02 0.00 0.00 176.95 178.17 2gsi s GLY 104 N -0.41 1.82 0.00 0.98 0.00 0.65 -4.58 107.32 105.78 2gsi s GLY 104 Ca 0.04 0.36 0.23 0.00 0.00 0.00 0.00 44.72 45.36 2gsi s GLY 104 CO 0.01 0.71 1.76 0.61 0.00 0.00 0.00 173.10 176.19 2gsi n GLN 105 N -3.22 0.22 0.00 2.90 0.00 -1.23 -4.77 117.38 111.28 2gsi n GLN 105 Ca 0.10 0.08 0.00 0.00 0.00 0.00 0.00 57.00 57.17 2gsi n GLN 105 Cb 0.53 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.27 2gsi n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2gsi n GLY 106 N 0.77 1.12 3.18 2.61 0.00 -1.26 -5.03 105.19 106.58 2gsi n GLY 106 Ca 0.09 -1.54 -0.34 0.00 0.00 0.00 0.00 46.02 44.23 2gsi n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gsi s THR 107 N -1.60 2.72 0.08 2.61 2.01 0.57 -4.85 115.64 117.18 2gsi s THR 107 Ca 0.00 -1.10 -0.28 0.00 0.31 0.00 0.00 61.69 60.63 2gsi s THR 107 Cb 0.00 -2.39 -0.06 0.00 0.01 0.00 0.00 72.50 70.06 2gsi s THR 107 CO 0.00 0.20 0.88 0.28 -0.69 0.00 0.00 174.62 175.28 2gsi s THR 108 N 1.29 4.61 -0.06 -0.82 -1.32 -1.26 -0.02 115.64 118.07 2gsi s THR 108 Ca -0.01 1.88 0.04 0.00 -1.21 0.00 0.00 61.69 62.39 2gsi s THR 108 Cb -0.17 -4.23 -0.00 0.00 -1.51 0.00 0.00 72.50 66.59 2gsi s THR 108 CO -0.05 0.33 -0.20 -0.69 -2.21 0.00 0.00 174.62 171.80 2gsi s VAL 109 N 0.01 1.66 -0.24 5.08 1.01 -0.12 0.02 120.40 127.81 2gsi s VAL 109 Ca 0.43 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.61 2gsi s VAL 109 Cb -0.22 -1.43 0.06 0.00 0.00 0.00 0.00 36.38 34.79 2gsi s VAL 109 CO 0.27 0.47 -0.09 -0.89 0.00 0.00 0.00 175.10 174.86 2gsi s THR 110 N 0.16 1.85 0.13 3.92 2.01 -0.56 -1.86 115.64 121.29 2gsi s THR 110 Ca -0.09 -1.39 -0.29 0.00 0.31 0.00 0.00 61.69 60.23 2gsi s THR 110 Cb -0.14 -2.02 -0.06 0.00 0.01 0.00 0.00 72.50 70.29 2gsi s THR 110 CO 0.04 -0.03 0.92 -0.89 -0.69 0.00 0.00 174.62 173.97 2gsi s THR 111 N 1.25 4.44 0.00 -0.82 2.01 -1.26 -1.32 115.64 119.94 2gsi s THR 111 Ca -0.07 2.00 0.00 0.00 0.31 0.00 0.00 61.69 63.93 2gsi s THR 111 Cb -0.19 -4.29 0.00 0.00 0.01 0.00 0.00 72.50 68.03 2gsi s THR 111 CO -0.06 0.37 0.00 -1.54 -0.69 0.00 0.00 174.62 172.70 2gsi n SER 112 N 2.46 0.00 -0.23 3.53 3.41 -1.19 -4.83 113.62 116.77 2gsi n SER 112 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.58 2gsi n SER 112 Cb 0.49 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.43 2gsi n SER 112 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2gsi n SER 113 N 0.00 -3.39 -4.54 4.04 3.41 -1.26 -4.53 113.62 107.36 2gsi n SER 113 Ca 0.00 0.07 -0.25 0.00 -0.26 0.00 0.00 58.87 58.43 2gsi n SER 113 Cb 0.00 -1.15 0.13 0.00 -0.26 0.00 0.00 64.21 62.93 2gsi n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gsi s ALA 114 N -2.11 3.24 -0.10 7.33 0.00 -1.26 -5.05 121.76 123.81 2gsi s ALA 114 Ca 0.00 -1.52 0.02 0.00 0.00 0.00 0.00 51.96 50.46 2gsi s ALA 114 Cb 0.00 -2.27 -0.01 0.00 0.00 0.00 0.00 23.12 20.84 2gsi s ALA 114 CO 0.00 -1.73 -0.17 0.15 0.00 0.00 0.00 175.76 174.01 2gsi s LYS 115 N -5.36 3.08 0.14 0.00 1.02 -1.26 -5.05 119.74 112.32 2gsi s LYS 115 Ca 0.68 -0.76 -0.32 0.00 0.02 0.00 0.00 55.97 55.59 2gsi s LYS 115 Cb -0.05 -2.46 -0.11 0.00 -0.52 0.00 0.00 37.83 34.68 2gsi s LYS 115 CO 0.47 0.28 1.79 2.41 -0.92 0.00 0.00 175.35 179.38 2gsi n THR 116 N 3.28 0.24 -4.02 2.17 -1.04 -1.26 -4.63 114.28 109.01 2gsi n THR 116 Ca -0.18 -0.04 -0.25 0.00 -2.04 0.00 0.00 64.05 61.53 2gsi n THR 116 Cb 0.53 -2.02 -0.17 0.00 -1.82 0.00 0.00 70.33 66.84 2gsi n THR 116 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2gsi s THR 117 N 2.17 0.93 0.38 12.58 2.01 0.15 -4.89 115.64 128.97 2gsi s THR 117 Ca 0.80 -0.26 -0.25 0.00 0.31 0.00 0.00 61.69 62.30 2gsi s THR 117 Cb -0.51 -0.95 -0.09 0.00 0.01 0.00 0.00 72.50 70.96 2gsi s THR 117 CO 0.36 0.34 1.05 -2.16 -0.69 0.00 0.00 174.62 173.52 2gsi s PRO 118 N 1.51 4.24 0.54 4.92 0.04 -1.26 -0.65 135.00 144.33 2gsi s PRO 118 Ca 0.01 1.53 -0.17 0.00 0.04 0.00 0.00 61.00 62.41 2gsi s PRO 118 Cb -0.13 -2.63 -0.07 0.00 0.04 0.00 0.00 34.50 31.72 2gsi s PRO 118 CO -0.05 -0.08 1.01 -1.25 0.04 0.00 0.00 177.00 176.67 2gsi s PRO 119 N -2.36 3.73 -0.20 0.56 0.04 -1.26 -4.65 135.00 130.85 2gsi s PRO 119 Ca 0.56 1.09 -0.09 0.00 0.04 0.00 0.00 61.00 62.60 2gsi s PRO 119 Cb -0.23 -2.10 -0.05 0.00 0.04 0.00 0.00 34.50 32.17 2gsi s PRO 119 CO 0.29 -0.46 0.11 -1.12 0.04 0.00 0.00 177.00 175.85 2gsi s SER 120 N -2.83 5.96 -0.30 6.66 0.01 -0.29 -4.92 113.70 118.00 2gsi s SER 120 Ca 0.61 0.15 -0.08 0.00 1.31 0.00 0.00 55.95 57.94 2gsi s SER 120 Cb -0.13 -2.04 -0.00 0.00 0.21 0.00 0.00 66.02 64.06 2gsi s SER 120 CO 0.31 0.16 0.12 -0.69 0.41 0.00 0.00 173.24 173.55 2gsi s VAL 121 N 0.48 4.34 -0.15 3.43 1.01 -1.26 -1.59 120.40 126.66 2gsi s VAL 121 Ca 0.06 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 2gsi s VAL 121 Cb -0.12 -3.20 -0.01 0.00 0.00 0.00 0.00 36.38 33.05 2gsi s VAL 121 CO -0.00 0.10 -0.11 -0.31 0.00 0.00 0.00 175.10 174.78 2gsi s TYR 122 N 1.57 2.86 0.47 5.22 2.02 0.15 -4.99 117.35 124.65 2gsi s TYR 122 Ca 0.04 -0.75 -0.23 0.00 -0.37 0.00 0.00 57.07 55.77 2gsi s TYR 122 Cb -0.17 -1.92 -0.07 0.00 -0.40 0.00 0.00 41.96 39.41 2gsi s TYR 122 CO 0.05 -0.31 1.17 -1.25 -1.57 0.00 0.00 175.55 173.64 2gsi s PRO 123 N 0.66 3.70 -0.27 -1.71 0.04 -1.26 -1.65 135.00 134.51 2gsi s PRO 123 Ca -0.06 1.78 0.03 0.00 0.04 0.00 0.00 61.00 62.79 2gsi s PRO 123 Cb -0.15 -2.37 0.07 0.00 0.04 0.00 0.00 34.50 32.09 2gsi s PRO 123 CO 0.02 -0.61 -0.07 -0.51 0.04 0.00 0.00 177.00 175.88 2gsi s LEU 124 N -3.11 3.50 -0.02 -3.56 1.43 0.13 -4.86 118.68 112.20 2gsi s LEU 124 Ca 0.65 -1.49 0.05 0.00 -1.03 0.00 0.00 54.13 52.31 2gsi s LEU 124 Cb -0.29 -1.49 -0.01 0.00 0.03 0.00 0.00 46.19 44.43 2gsi s LEU 124 CO 0.35 -0.23 -0.17 0.00 0.23 0.00 0.00 176.35 176.53 2gsi s ALA 125 N 1.12 1.38 0.00 4.21 0.00 -1.26 -1.58 121.76 125.63 2gsi s ALA 125 Ca -0.05 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.20 2gsi s ALA 125 Cb -0.20 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.56 2gsi s ALA 125 CO -0.06 0.33 0.00 -2.30 0.00 0.00 0.00 175.76 173.73 2gsi n PRO 126 N 2.72 0.00 0.00 0.00 -0.01 -1.26 -4.80 135.00 131.65 2gsi n PRO 126 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.34 2gsi n PRO 126 Cb 0.54 0.00 0.00 0.00 -0.01 0.00 0.00 33.50 34.03 2gsi n PRO 126 CO 0.00 0.00 0.00 -1.33 -0.01 0.00 0.00 175.50 174.16 2gsi n MET 137 N 0.00 0.00 -4.16 -0.52 0.00 -1.26 -4.53 117.12 106.65 2gsi n MET 137 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 57.70 57.55 2gsi n MET 137 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 33.22 33.09 2gsi n MET 137 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 2gsi s VAL 138 N 0.00 0.56 -0.24 2.03 0.11 0.20 -4.72 120.40 118.34 2gsi s VAL 138 Ca 0.00 -0.64 -0.08 0.00 -2.93 0.00 0.00 61.98 58.33 2gsi s VAL 138 Cb 0.00 -0.54 -0.03 0.00 -1.53 0.00 0.00 36.38 34.28 2gsi s VAL 138 CO 0.00 -0.08 0.09 -0.89 -3.33 0.00 0.00 175.10 170.89 2gsi s THR 139 N -0.68 4.56 0.08 5.04 2.01 -1.26 -0.54 115.64 124.84 2gsi s THR 139 Ca -0.02 -0.09 0.10 0.00 0.31 0.00 0.00 61.69 61.98 2gsi s THR 139 Cb -0.06 -3.12 -0.03 0.00 0.01 0.00 0.00 72.50 69.29 2gsi s THR 139 CO 0.00 0.34 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.27 2gsi s LEU 140 N 1.42 2.32 0.23 4.42 1.43 -0.77 -4.68 118.68 123.05 2gsi s LEU 140 Ca 0.06 -0.63 0.00 0.00 -1.03 0.00 0.00 54.13 52.53 2gsi s LEU 140 Cb -0.15 -1.31 -0.05 0.00 0.03 0.00 0.00 46.19 44.72 2gsi s LEU 140 CO 0.04 0.22 0.11 -0.83 0.23 0.00 0.00 176.35 176.13 2gsi s GLY 141 N -1.65 1.58 -0.11 -3.19 0.00 -0.62 -0.72 107.32 102.62 2gsi s GLY 141 Ca 0.13 -1.78 0.02 0.00 0.00 0.00 0.00 44.72 43.10 2gsi s GLY 141 CO 0.05 -1.50 -0.18 0.00 0.00 0.00 0.00 173.10 171.47 2gsi s LEU 143 N 0.20 4.26 -0.25 0.00 2.96 -0.66 -0.78 118.68 124.42 2gsi s LEU 143 Ca -0.11 0.50 0.00 0.00 -0.22 0.00 0.00 54.13 54.31 2gsi s LEU 143 Cb -0.16 -2.34 0.07 0.00 0.50 0.00 0.00 46.19 44.26 2gsi s LEU 143 CO 0.06 0.14 0.00 -0.69 -1.32 0.00 0.00 176.35 174.54 2gsi s VAL 144 N 0.28 1.31 0.04 1.68 1.01 -0.43 -0.68 120.40 123.62 2gsi s VAL 144 Ca 0.16 -1.26 0.06 0.00 0.00 0.00 0.00 61.98 60.94 2gsi s VAL 144 Cb -0.13 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.49 2gsi s VAL 144 CO 0.04 -0.28 -0.16 -0.75 0.00 0.00 0.00 175.10 173.95 2gsi s LYS 145 N 1.46 1.07 -0.65 2.72 2.20 -0.62 -1.73 119.74 124.20 2gsi s LYS 145 Ca -0.00 -0.81 -0.01 0.00 -0.36 0.00 0.00 55.97 54.78 2gsi s LYS 145 Cb -0.18 -1.12 -0.01 0.00 -1.51 0.00 0.00 37.83 35.01 2gsi s LYS 145 CO -0.10 0.28 0.55 0.41 -0.36 0.00 0.00 175.35 176.13 2gsi n GLY 146 N 1.89 -0.09 3.22 5.54 0.00 0.10 -1.14 105.19 114.71 2gsi n GLY 146 Ca -0.18 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.55 2gsi n GLY 146 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2gsi s TYR 147 N -3.21 1.75 0.02 1.61 1.13 -1.06 -4.21 117.35 113.38 2gsi s TYR 147 Ca 0.08 -0.35 0.02 0.00 -1.41 0.00 0.00 57.07 55.41 2gsi s TYR 147 Cb -0.01 -1.08 -0.01 0.00 -1.10 0.00 0.00 41.96 39.75 2gsi s TYR 147 CO 0.42 0.03 -0.07 0.12 -2.51 0.00 0.00 175.55 173.54 2gsi s PHE 148 N -0.64 0.60 0.00 -3.49 5.36 0.17 -1.53 117.98 118.45 2gsi s PHE 148 Ca 0.07 -0.30 0.00 0.00 -0.96 0.00 0.00 56.93 55.74 2gsi s PHE 148 Cb -0.08 -0.37 0.00 0.00 -0.34 0.00 0.00 43.02 42.23 2gsi s PHE 148 CO 0.01 -0.04 0.00 -0.35 -1.46 0.00 0.00 175.22 173.37 2gsi n PRO 149 N 2.19 2.73 -2.72 10.12 -0.04 -1.26 0.29 135.00 146.30 2gsi n PRO 149 Ca -0.18 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.03 2gsi n PRO 149 Cb 0.56 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.04 2gsi n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2gsi s GLU 150 N 2.08 3.16 0.53 0.54 0.41 -1.26 -4.75 118.70 119.40 2gsi s GLU 150 Ca 0.00 -0.14 0.09 0.00 -0.41 0.00 0.00 54.97 54.50 2gsi s GLU 150 Cb 0.00 -2.42 0.06 0.00 -1.78 0.00 0.00 34.13 29.99 2gsi s GLU 150 CO 0.00 -0.38 0.67 -1.25 -0.49 0.00 0.00 175.26 173.82 2gsi s PRO 151 N -4.74 2.41 0.16 0.39 0.04 -1.26 -4.86 135.00 127.15 2gsi s PRO 151 Ca 0.49 -1.61 0.07 0.00 0.04 0.00 0.00 61.00 59.99 2gsi s PRO 151 Cb -0.10 -2.58 -0.04 0.00 0.04 0.00 0.00 34.50 31.82 2gsi s PRO 151 CO 0.42 -0.68 0.02 0.14 0.04 0.00 0.00 177.00 176.94 2gsi s VAL 152 N -2.61 3.88 -0.19 -0.36 -7.23 -1.26 -4.43 120.40 108.19 2gsi s VAL 152 Ca 0.56 -1.32 -0.00 0.00 -1.81 0.00 0.00 61.98 59.41 2gsi s VAL 152 Cb -0.06 -2.95 0.01 0.00 0.56 0.00 0.00 36.38 33.95 2gsi s VAL 152 CO 0.35 -0.09 -0.15 0.42 -0.31 0.00 0.00 175.10 175.32 2gsi s THR 153 N -1.69 2.45 -0.22 5.32 -4.23 0.31 -4.95 115.64 112.63 2gsi s THR 153 Ca 0.28 -0.81 -0.10 0.00 -1.18 0.00 0.00 61.69 59.89 2gsi s THR 153 Cb -0.10 -2.06 -0.05 0.00 1.34 0.00 0.00 72.50 71.64 2gsi s THR 153 CO 0.19 0.51 0.13 -0.69 -0.54 0.00 0.00 174.62 174.22 2gsi s VAL 154 N 1.32 5.20 0.21 2.29 1.01 -1.26 -1.07 120.40 128.10 2gsi s VAL 154 Ca 0.05 0.12 0.04 0.00 0.00 0.00 0.00 61.98 62.18 2gsi s VAL 154 Cb -0.13 -3.40 -0.05 0.00 0.00 0.00 0.00 36.38 32.80 2gsi s VAL 154 CO -0.10 0.39 -0.03 0.42 0.00 0.00 0.00 175.10 175.79 2gsi s THR 156 N 0.79 1.06 -0.02 3.92 -4.23 0.78 -4.98 115.64 112.97 2gsi s THR 156 Ca 0.07 -2.04 0.06 0.00 -1.18 0.00 0.00 61.69 58.59 2gsi s THR 156 Cb -0.13 -2.22 -0.01 0.00 1.34 0.00 0.00 72.50 71.48 2gsi s THR 156 CO 0.02 -0.43 -0.19 0.26 -0.54 0.00 0.00 174.62 173.74 2gsi s TRP 157 N -3.40 1.72 -0.66 3.99 0.52 -1.26 0.12 118.94 119.97 2gsi s TRP 157 Ca 0.26 -0.34 -0.14 0.00 0.02 0.00 0.00 56.10 55.89 2gsi s TRP 157 Cb 0.05 -1.11 0.02 0.00 -1.15 0.00 0.00 33.47 31.28 2gsi s TRP 157 CO 0.07 -0.04 0.27 0.09 0.02 0.00 0.00 176.95 177.36 2gsi n ASN 162 N 2.65 -1.52 -1.84 2.95 3.02 0.91 -0.06 115.26 121.37 2gsi n ASN 162 Ca -0.15 -0.67 -0.03 0.00 -0.03 0.00 0.00 54.58 53.70 2gsi n ASN 162 Cb 0.53 -0.80 -0.01 0.00 -0.61 0.00 0.00 39.78 38.89 2gsi n ASN 162 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2gsi n SER 163 N -0.77 -1.40 0.00 6.41 7.64 -1.26 -1.72 113.62 122.52 2gsi n SER 163 Ca -0.08 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.06 2gsi n SER 163 Cb 0.30 -1.46 0.00 0.00 -1.01 0.00 0.00 64.21 62.04 2gsi n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gsi n GLY 164 N -0.34 1.94 0.29 0.23 0.00 0.92 -4.94 105.19 103.27 2gsi n GLY 164 Ca -0.04 -0.60 0.13 0.00 0.00 0.00 0.00 46.02 45.50 2gsi n GLY 164 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2gsi h SER 165 N 2.00 0.00 -3.39 1.61 0.02 -1.41 -3.32 113.55 109.05 2gsi h SER 165 Ca 0.00 0.00 -0.61 0.00 -0.84 0.00 0.00 61.79 60.34 2gsi h SER 165 Cb 0.00 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 62.14 2gsi h SER 165 CO 0.00 0.00 -0.74 -0.22 -1.14 0.00 0.00 176.83 174.73 2gsi s LEU 166 N -5.27 3.18 0.00 5.07 2.96 -1.22 -4.90 118.68 118.50 2gsi s LEU 166 Ca -0.03 -1.92 0.00 0.00 -0.22 0.00 0.00 54.13 51.97 2gsi s LEU 166 Cb 0.07 -1.15 0.00 0.00 0.50 0.00 0.00 46.19 45.61 2gsi s LEU 166 CO 0.22 -0.39 0.00 -1.54 -1.32 0.00 0.00 176.35 173.32 2gsi n SER 167 N 4.51 2.42 -4.72 3.68 3.41 -1.25 -4.19 113.62 117.48 2gsi n SER 167 Ca 0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.21 2gsi n SER 167 Cb 0.41 0.26 -0.04 0.00 -0.26 0.00 0.00 64.21 64.58 2gsi n SER 167 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2gsi s SER 168 N -1.90 7.46 0.00 4.04 0.15 -1.26 -3.49 113.70 118.70 2gsi s SER 168 Ca 0.00 1.75 0.00 0.00 0.70 0.00 0.00 55.95 58.40 2gsi s SER 168 Cb 0.00 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 2gsi s SER 168 CO 0.00 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 174.93 2gsi n GLY 169 N 2.43 0.92 3.71 9.45 0.00 -1.26 -4.83 105.19 115.62 2gsi n GLY 169 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 2gsi n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gsi s VAL 171 N -2.01 4.99 -0.33 1.61 1.01 -1.23 -0.26 120.40 124.19 2gsi s VAL 171 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 2gsi s VAL 171 Cb 0.00 -3.22 0.11 0.00 0.00 0.00 0.00 36.38 33.27 2gsi s VAL 171 CO 0.00 0.51 0.12 -1.00 0.00 0.00 0.00 175.10 174.74 2gsi s HIS 172 N -0.13 1.61 -0.34 5.22 3.76 0.12 -4.98 115.29 120.55 2gsi s HIS 172 Ca 0.08 -1.76 -0.16 0.00 -0.15 0.00 0.00 55.06 53.07 2gsi s HIS 172 Cb -0.12 -1.65 -0.01 0.00 1.11 0.00 0.00 32.58 31.91 2gsi s HIS 172 CO 0.01 -0.86 0.41 0.99 -0.85 0.00 0.00 174.74 174.43 2gsi s THR 173 N 1.47 5.12 0.27 1.30 2.01 -1.26 -0.68 115.64 123.87 2gsi s THR 173 Ca 0.11 0.19 -0.16 0.00 0.31 0.00 0.00 61.69 62.14 2gsi s THR 173 Cb -0.18 -3.85 -0.08 0.00 0.01 0.00 0.00 72.50 68.39 2gsi s THR 173 CO -0.22 -0.10 0.70 -0.36 -0.69 0.00 0.00 174.62 173.95 2gsi s PHE 174 N 2.13 3.47 0.48 4.92 0.40 -0.92 -5.03 117.98 123.43 2gsi s PHE 174 Ca 0.14 1.22 -0.23 0.00 -0.60 0.00 0.00 56.93 57.46 2gsi s PHE 174 Cb -0.16 -2.52 -0.07 0.00 0.51 0.00 0.00 43.02 40.78 2gsi s PHE 174 CO 0.12 0.20 1.31 -2.14 0.70 0.00 0.00 175.22 175.41 2gsi s PRO 175 N -2.62 3.56 0.36 0.24 0.02 -1.26 -4.24 135.00 131.06 2gsi s PRO 175 Ca 0.49 2.13 -0.28 0.00 0.02 0.00 0.00 61.00 63.37 2gsi s PRO 175 Cb -0.12 -2.47 -0.12 0.00 0.02 0.00 0.00 34.50 31.81 2gsi s PRO 175 CO 0.19 -0.82 1.30 0.00 -0.33 0.00 0.00 177.00 177.34 2gsi n ALA 176 N -0.51 1.39 -2.78 -1.55 0.00 -1.26 -4.75 120.51 111.05 2gsi n ALA 176 Ca 0.07 0.35 -0.34 0.00 0.00 0.00 0.00 53.44 53.52 2gsi n ALA 176 Cb 0.45 -2.27 -0.11 0.00 0.00 0.00 0.00 19.45 17.52 2gsi n ALA 176 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2gsi s VAL 177 N -1.11 3.87 -0.44 0.00 -7.23 0.29 -4.90 120.40 110.89 2gsi s VAL 177 Ca 0.56 -0.39 -0.22 0.00 -1.81 0.00 0.00 61.98 60.12 2gsi s VAL 177 Cb -0.55 -2.64 0.02 0.00 0.56 0.00 0.00 36.38 33.77 2gsi s VAL 177 CO 0.62 0.55 0.74 -0.22 -0.31 0.00 0.00 175.10 176.48 2gsi s LEU 178 N -0.27 4.33 -0.03 1.32 2.96 -1.26 -0.80 118.68 124.93 2gsi s LEU 178 Ca 0.05 -0.17 0.03 0.00 -0.22 0.00 0.00 54.13 53.81 2gsi s LEU 178 Cb -0.13 -2.89 0.00 0.00 0.50 0.00 0.00 46.19 43.68 2gsi s LEU 178 CO 0.02 -0.86 -0.10 -1.58 -1.32 0.00 0.00 176.35 172.51 2gsi s GLN 179 N 3.13 1.09 -1.46 1.98 0.74 0.81 -4.82 119.66 121.12 2gsi s GLN 179 Ca 0.28 -0.34 -0.11 0.00 0.05 0.00 0.00 55.36 55.24 2gsi s GLN 179 Cb -0.13 -1.00 0.06 0.00 1.10 0.00 0.00 33.01 33.04 2gsi s GLN 179 CO 0.21 0.12 0.98 0.43 -0.55 0.00 0.00 175.29 176.48 2gsi n SER 180 N 3.32 -4.48 -0.30 6.67 7.64 -1.26 -1.95 113.62 123.25 2gsi n SER 180 Ca -0.19 -0.74 -0.04 0.00 1.01 0.00 0.00 58.87 58.92 2gsi n SER 180 Cb 0.54 -4.15 -0.02 0.00 -1.01 0.00 0.00 64.21 59.57 2gsi n SER 180 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2gsi n ASP 183 N -2.91 -4.20 -4.57 6.43 8.00 -1.26 -4.99 116.55 113.04 2gsi n ASP 183 Ca -0.02 0.10 -0.29 0.00 0.71 0.00 0.00 54.79 55.28 2gsi n ASP 183 Cb 0.56 -2.05 -0.09 0.00 -0.02 0.00 0.00 41.12 39.52 2gsi n ASP 183 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2gsi s LEU 184 N -0.90 2.35 0.05 0.64 1.43 -0.83 -4.90 118.68 116.53 2gsi s LEU 184 Ca 0.00 -1.57 0.08 0.00 -1.03 0.00 0.00 54.13 51.61 2gsi s LEU 184 Cb 0.00 -0.61 -0.03 0.00 0.03 0.00 0.00 46.19 45.58 2gsi s LEU 184 CO 0.00 -0.76 -0.20 -0.31 0.23 0.00 0.00 176.35 175.31 2gsi s TYR 185 N -2.95 2.49 -0.03 0.29 2.02 -0.58 -0.13 117.35 118.46 2gsi s TYR 185 Ca 0.18 -0.30 -0.02 0.00 -0.37 0.00 0.00 57.07 56.57 2gsi s TYR 185 Cb 0.04 -1.43 0.02 0.00 -0.40 0.00 0.00 41.96 40.19 2gsi s TYR 185 CO 0.10 0.24 0.07 0.99 -1.57 0.00 0.00 175.55 175.37 2gsi s THR 186 N -0.92 -0.03 0.20 -0.71 2.01 0.02 -0.72 115.64 115.50 2gsi s THR 186 Ca 0.14 0.09 -0.02 0.00 0.31 0.00 0.00 61.69 62.22 2gsi s THR 186 Cb -0.10 -0.12 -0.04 0.00 0.01 0.00 0.00 72.50 72.25 2gsi s THR 186 CO 0.05 0.04 0.16 -1.48 -0.69 0.00 0.00 174.62 172.70 2gsi s LEU 187 N 0.53 1.08 0.13 4.42 0.05 -0.70 0.11 118.68 124.29 2gsi s LEU 187 Ca -0.04 -1.35 0.03 0.00 0.05 0.00 0.00 54.13 52.81 2gsi s LEU 187 Cb -0.06 0.50 -0.04 0.00 -2.05 0.00 0.00 46.19 44.54 2gsi s LEU 187 CO -0.02 -0.87 -0.07 -0.55 -0.55 0.00 0.00 176.35 174.29 2gsi s SER 188 N -3.15 1.41 -0.04 1.48 0.15 -1.26 -1.32 113.70 110.98 2gsi s SER 188 Ca 0.38 -1.03 -0.01 0.00 0.70 0.00 0.00 55.95 55.99 2gsi s SER 188 Cb 0.06 0.06 0.03 0.00 -1.71 0.00 0.00 66.02 64.46 2gsi s SER 188 CO 0.12 -0.42 0.08 -0.55 1.20 0.00 0.00 173.24 173.66 2gsi s SER 189 N -3.11 -0.01 0.14 5.45 0.15 0.04 -2.17 113.70 114.20 2gsi s SER 189 Ca 0.15 0.15 0.05 0.00 0.70 0.00 0.00 55.95 57.01 2gsi s SER 189 Cb 0.04 0.04 -0.04 0.00 -1.71 0.00 0.00 66.02 64.35 2gsi s SER 189 CO -0.02 -0.14 0.07 -0.94 1.20 0.00 0.00 173.24 173.41 2gsi s SER 190 N 1.11 5.24 -0.08 5.45 1.04 0.14 -0.53 113.70 126.07 2gsi s SER 190 Ca -0.09 -0.19 -0.02 0.00 0.48 0.00 0.00 55.95 56.13 2gsi s SER 190 Cb -0.12 -1.29 0.04 0.00 0.10 0.00 0.00 66.02 64.74 2gsi s SER 190 CO -0.04 0.11 0.04 0.54 0.98 0.00 0.00 173.24 174.87 2gsi s VAL 191 N -1.62 0.11 -0.12 5.02 0.11 0.10 0.11 120.40 124.12 2gsi s VAL 191 Ca 0.29 0.17 -0.21 0.00 -2.93 0.00 0.00 61.98 59.30 2gsi s VAL 191 Cb -0.10 -0.41 -0.04 0.00 -1.53 0.00 0.00 36.38 34.30 2gsi s VAL 191 CO 0.21 0.12 0.60 -0.89 -3.33 0.00 0.00 175.10 171.81 2gsi s THR 192 N 2.07 5.10 0.20 5.04 2.01 0.64 -1.84 115.64 128.86 2gsi s THR 192 Ca 0.04 1.20 0.03 0.00 0.31 0.00 0.00 61.69 63.27 2gsi s THR 192 Cb -0.13 -3.93 -0.05 0.00 0.01 0.00 0.00 72.50 68.40 2gsi s THR 192 CO -0.05 0.25 -0.02 0.68 -0.69 0.00 0.00 174.62 174.79 2gsi s VAL 193 N 0.98 0.96 0.36 3.82 -7.23 0.30 -4.65 120.40 114.95 2gsi s VAL 193 Ca 0.31 -2.03 -0.28 0.00 -1.81 0.00 0.00 61.98 58.17 2gsi s VAL 193 Cb -0.16 -2.19 -0.11 0.00 0.56 0.00 0.00 36.38 34.48 2gsi s VAL 193 CO 0.13 -0.45 1.51 -2.65 -0.31 0.00 0.00 175.10 173.33 2gsi n PRO 194 N -0.33 2.68 0.33 4.82 -0.02 -1.26 -0.62 135.00 140.59 2gsi n PRO 194 Ca -0.06 0.94 0.22 0.00 -2.02 0.00 0.00 63.50 62.58 2gsi n PRO 194 Cb 0.63 -2.68 1.13 0.00 -0.02 0.00 0.00 33.50 32.56 2gsi n PRO 194 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2gsi h SER 195 N 3.26 0.00 0.77 2.55 4.64 -1.86 -1.76 113.55 121.16 2gsi h SER 195 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 2gsi h SER 195 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2gsi h SER 195 CO 0.67 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.09 2gsi n SER 196 N -3.09 0.25 -0.07 4.97 3.41 -1.26 -3.26 113.62 114.57 2gsi n SER 196 Ca -0.02 0.55 0.10 0.00 -0.26 0.00 0.00 58.87 59.23 2gsi n SER 196 Cb 0.11 -0.61 -0.10 0.00 -0.26 0.00 0.00 64.21 63.36 2gsi n SER 196 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2gsi n THR 198 N -1.76 0.00 -3.78 6.66 -2.24 -0.66 -4.61 114.28 107.89 2gsi n THR 198 Ca 0.04 -0.06 -0.13 0.00 -2.27 0.00 0.00 64.05 61.63 2gsi n THR 198 Cb 0.25 1.04 -0.12 0.00 -2.10 0.00 0.00 70.33 69.40 2gsi n THR 198 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2gsi s TRP 199 N -2.82 -0.27 -1.74 4.78 -0.00 -1.20 0.55 118.94 118.23 2gsi s TRP 199 Ca 0.09 0.66 0.11 0.00 -0.00 0.00 0.00 56.10 56.96 2gsi s TRP 199 Cb 0.16 0.09 0.61 0.00 -0.00 0.00 0.00 33.47 34.32 2gsi s TRP 199 CO 0.78 -0.14 1.16 -0.35 -0.00 0.00 0.00 176.95 178.41 2gsi n PRO 200 N 3.10 0.26 -0.05 5.86 -0.04 -1.26 -4.76 135.00 138.11 2gsi n PRO 200 Ca -0.14 0.09 -0.03 0.00 -0.04 0.00 0.00 63.50 63.37 2gsi n PRO 200 Cb 0.58 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.51 2gsi n PRO 200 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2gsi h SER 202 N 0.00 -0.47 -3.25 3.54 0.02 -1.81 -3.41 113.55 108.16 2gsi h SER 202 Ca 0.00 0.06 -0.56 0.00 -0.84 0.00 0.00 61.79 60.45 2gsi h SER 202 Cb 0.05 0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 2gsi h SER 202 CO 0.00 -0.09 -0.24 -1.10 -1.14 0.00 0.00 176.83 174.26 2gsi s GLN 203 N -3.64 3.68 0.36 3.45 -0.21 0.19 -5.07 119.66 118.41 2gsi s GLN 203 Ca -0.03 0.03 -0.26 0.00 0.02 0.00 0.00 55.36 55.12 2gsi s GLN 203 Cb 0.02 -2.77 -0.09 0.00 1.00 0.00 0.00 33.01 31.17 2gsi s GLN 203 CO 0.15 0.40 1.06 0.95 -2.12 0.00 0.00 175.29 175.74 2gsi s THR 204 N -1.73 3.66 -0.06 -0.19 -4.23 -1.26 -4.41 115.64 107.41 2gsi s THR 204 Ca 0.43 1.40 0.02 0.00 -1.18 0.00 0.00 61.69 62.37 2gsi s THR 204 Cb -0.12 -3.79 0.02 0.00 1.34 0.00 0.00 72.50 69.95 2gsi s THR 204 CO 0.24 0.14 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.66 2gsi s VAL 205 N -1.48 1.01 -0.02 2.29 1.01 -1.26 -4.98 120.40 116.97 2gsi s VAL 205 Ca 0.53 -0.40 -0.00 0.00 0.00 0.00 0.00 61.98 62.11 2gsi s VAL 205 Cb -0.25 -0.95 0.03 0.00 0.00 0.00 0.00 36.38 35.21 2gsi s VAL 205 CO 0.32 0.33 0.03 -0.89 0.00 0.00 0.00 175.10 174.89 2gsi s THR 206 N 0.77 -0.03 -0.05 3.92 2.01 -1.26 -2.53 115.64 118.46 2gsi s THR 206 Ca -0.13 0.22 -0.22 0.00 0.31 0.00 0.00 61.69 61.88 2gsi s THR 206 Cb -0.15 -0.11 -0.04 0.00 0.01 0.00 0.00 72.50 72.20 2gsi s THR 206 CO 0.02 0.11 0.64 0.00 -0.69 0.00 0.00 174.62 174.70 2gsi s ASN 209 N 0.44 6.21 -0.13 0.00 -0.87 0.33 -1.96 114.94 118.97 2gsi s ASN 209 Ca 0.34 0.23 0.03 0.00 -1.57 0.00 0.00 52.86 51.88 2gsi s ASN 209 Cb -0.18 -2.12 0.01 0.00 -0.02 0.00 0.00 41.25 38.94 2gsi s ASN 209 CO 0.17 0.09 -0.21 -0.69 -2.57 0.00 0.00 177.10 173.88 2gsi s VAL 210 N 0.83 1.96 -0.06 1.60 1.01 0.21 -0.15 120.40 125.79 2gsi s VAL 210 Ca 0.10 -0.92 0.06 0.00 0.00 0.00 0.00 61.98 61.21 2gsi s VAL 210 Cb -0.13 -1.73 -0.01 0.00 0.00 0.00 0.00 36.38 34.51 2gsi s VAL 210 CO 0.03 0.53 -0.23 0.00 0.00 0.00 0.00 175.10 175.43 2gsi s ALA 211 N 0.79 2.25 -0.48 5.51 0.00 -0.24 0.54 121.76 130.14 2gsi s ALA 211 Ca -0.08 -1.04 0.03 0.00 0.00 0.00 0.00 51.96 50.87 2gsi s ALA 211 Cb -0.16 -0.73 0.15 0.00 0.00 0.00 0.00 23.12 22.38 2gsi s ALA 211 CO -0.01 0.43 0.30 -1.58 0.00 0.00 0.00 175.76 174.90 2gsi s HIS 212 N -0.23 2.11 0.31 0.00 2.46 0.15 -0.53 115.29 119.55 2gsi s HIS 212 Ca -0.01 -2.56 0.37 0.00 0.47 0.00 0.00 55.06 53.33 2gsi s HIS 212 Cb -0.13 -1.87 1.85 0.00 -0.13 0.00 0.00 32.58 32.30 2gsi s HIS 212 CO 0.03 -0.75 2.13 -1.35 -2.47 0.00 0.00 174.74 172.33 2gsi h PRO 213 N 6.33 0.00 0.04 2.88 0.11 -1.77 -1.41 132.00 138.17 2gsi h PRO 213 Ca 0.06 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.17 2gsi h PRO 213 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 2gsi h PRO 213 CO 0.50 0.00 -0.02 0.00 -0.21 0.00 0.00 178.00 178.27 2gsi h ALA 214 N 2.02 -0.05 -0.00 -0.75 0.00 -1.92 -2.68 119.26 115.87 2gsi h ALA 214 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2gsi h ALA 214 Cb 0.20 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2gsi h ALA 214 CO 0.00 -0.40 -0.01 -1.13 0.00 0.00 0.00 179.25 177.71 2gsi n SER 215 N -5.00 0.18 -2.82 0.00 3.41 -0.87 -4.92 113.62 103.61 2gsi n SER 215 Ca -0.08 -0.93 -0.20 0.00 -0.26 0.00 0.00 58.87 57.40 2gsi n SER 215 Cb 0.16 -0.04 0.04 0.00 -0.26 0.00 0.00 64.21 64.11 2gsi n SER 215 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2gsi n SER 216 N -0.91 -5.71 -4.31 4.04 7.64 -0.59 -5.01 113.62 108.77 2gsi n SER 216 Ca 0.22 -0.30 -0.31 0.00 1.01 0.00 0.00 58.87 59.49 2gsi n SER 216 Cb 0.16 -4.50 -0.16 0.00 -1.01 0.00 0.00 64.21 58.70 2gsi n SER 216 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2gsi s THR 217 N -3.15 2.05 -0.13 0.44 -4.23 -0.94 -4.98 115.64 104.69 2gsi s THR 217 Ca 0.32 -1.11 0.02 0.00 -1.18 0.00 0.00 61.69 59.75 2gsi s THR 217 Cb -0.14 -1.70 0.00 0.00 1.34 0.00 0.00 72.50 72.00 2gsi s THR 217 CO 0.40 0.58 -0.20 -0.75 -0.54 0.00 0.00 174.62 174.11 2gsi s LYS 218 N -0.57 3.11 -0.16 3.99 2.20 -1.26 0.30 119.74 127.34 2gsi s LYS 218 Ca 0.09 -0.82 -0.02 0.00 -0.36 0.00 0.00 55.97 54.86 2gsi s LYS 218 Cb -0.10 -2.47 -0.01 0.00 -1.51 0.00 0.00 37.83 33.73 2gsi s LYS 218 CO -0.01 0.06 -0.09 0.08 -0.36 0.00 0.00 175.35 175.03 2gsi s VAL 219 N 0.66 3.21 -0.31 4.02 1.01 0.19 -4.97 120.40 124.22 2gsi s VAL 219 Ca -0.10 -0.58 -0.10 0.00 0.00 0.00 0.00 61.98 61.20 2gsi s VAL 219 Cb -0.16 -2.39 -0.01 0.00 0.00 0.00 0.00 36.38 33.81 2gsi s VAL 219 CO 0.02 0.49 0.16 -1.81 0.00 0.00 0.00 175.10 173.95 2gsi s ASP 220 N 0.76 5.60 -0.15 3.32 1.01 -1.26 -0.62 116.67 125.33 2gsi s ASP 220 Ca -0.04 -0.44 0.01 0.00 0.71 0.00 0.00 52.55 52.79 2gsi s ASP 220 Cb -0.15 -2.02 0.02 0.00 1.01 0.00 0.00 42.92 41.78 2gsi s ASP 220 CO 0.02 -0.17 -0.19 -0.75 0.21 0.00 0.00 175.17 174.29 2gsi s LYS 221 N 1.64 2.73 -0.12 8.23 2.47 -0.83 -5.03 119.74 128.83 2gsi s LYS 221 Ca 0.05 -0.73 -0.24 0.00 -1.56 0.00 0.00 55.97 53.48 2gsi s LYS 221 Cb -0.17 -2.32 -0.03 0.00 -1.46 0.00 0.00 37.83 33.86 2gsi s LYS 221 CO 0.07 -0.13 0.76 0.21 0.16 0.00 0.00 175.35 176.41 2gsi s LYS 222 N 1.14 4.36 -0.31 4.03 2.20 -1.26 -1.81 119.74 128.08 2gsi s LYS 222 Ca -0.00 0.93 -0.29 0.00 -0.36 0.00 0.00 55.97 56.25 2gsi s LYS 222 Cb -0.14 -3.52 -0.00 0.00 -1.51 0.00 0.00 37.83 32.66 2gsi s LYS 222 CO -0.07 -0.14 1.43 0.42 -0.36 0.00 0.00 175.35 176.62 2gsi s ILE 223 N 1.51 3.94 -0.02 5.43 -1.09 -1.05 -4.92 121.20 125.01 2gsi s ILE 223 Ca 0.37 1.03 0.04 0.00 -2.23 0.00 0.00 60.65 59.87 2gsi s ILE 223 Cb -0.17 -4.04 -0.03 0.00 -1.58 0.00 0.00 42.46 36.64 2gsi s ILE 223 CO 0.15 -0.51 -0.13 0.68 -1.23 0.00 0.00 174.94 173.90 2gsi s VAL 226 N 4.98 3.14 0.15 2.92 -7.23 -1.26 -4.74 120.40 118.35 2gsi s VAL 226 Ca 0.62 -0.84 -0.34 0.00 -1.81 0.00 0.00 61.98 59.61 2gsi s VAL 226 Cb -0.18 -2.28 -0.16 0.00 0.56 0.00 0.00 36.38 34.32 2gsi s VAL 226 CO 0.28 0.49 1.29 -2.65 -0.31 0.00 0.00 175.10 174.20 2gsi n PRO 227 N 1.96 1.37 0.00 4.82 -0.02 -1.26 -4.84 135.00 137.03 2gsi n PRO 227 Ca -0.17 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 2gsi n PRO 227 Cb 0.52 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 2gsi n PRO 227 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02