#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dbl s ILE 2 N 0.00 3.47 0.31 5.09 1.01 -1.26 -4.77 121.20 125.05 2dbl s ILE 2 Ca 0.00 -0.48 -0.17 0.00 0.00 0.00 0.00 60.65 60.00 2dbl s ILE 2 Cb 0.00 -2.54 0.02 0.00 0.01 0.00 0.00 42.46 39.95 2dbl s ILE 2 CO 0.00 0.46 0.67 0.00 0.00 0.00 0.00 174.94 176.07 2dbl s GLN 3 N 0.95 1.87 -0.11 2.79 -2.07 -1.17 -5.06 119.66 116.85 2dbl s GLN 3 Ca -0.00 -1.22 0.01 0.00 -1.82 0.00 0.00 55.36 52.33 2dbl s GLN 3 Cb -0.15 0.57 -0.02 0.00 -1.09 0.00 0.00 33.01 32.33 2dbl s GLN 3 CO 0.01 -0.84 -0.13 -0.51 -1.32 0.00 0.00 175.29 172.50 2dbl s LEU 4 N -3.00 2.75 -0.16 2.60 1.02 -1.26 -2.74 118.68 117.89 2dbl s LEU 4 Ca 0.16 -0.28 0.00 0.00 0.02 0.00 0.00 54.13 54.03 2dbl s LEU 4 Cb -0.04 -1.61 -0.00 0.00 0.02 0.00 0.00 46.19 44.56 2dbl s LEU 4 CO 0.10 0.21 -0.15 0.54 0.02 0.00 0.00 176.35 177.07 2dbl s VAL 5 N 0.06 2.65 0.29 -1.59 0.11 0.55 -4.32 120.40 118.16 2dbl s VAL 5 Ca -0.05 -0.77 0.07 0.00 -2.93 0.00 0.00 61.98 58.30 2dbl s VAL 5 Cb -0.14 -2.12 -0.03 0.00 -1.53 0.00 0.00 36.38 32.55 2dbl s VAL 5 CO 0.04 0.51 0.23 -1.10 -3.33 0.00 0.00 175.10 171.45 2dbl s GLN 6 N 0.85 2.79 1.11 1.54 -0.21 -1.25 -0.66 119.66 123.83 2dbl s GLN 6 Ca -0.05 -1.19 -0.14 0.00 0.02 0.00 0.00 55.36 54.00 2dbl s GLN 6 Cb -0.15 -2.50 0.25 0.00 1.00 0.00 0.00 33.01 31.61 2dbl s GLN 6 CO -0.01 0.26 1.06 -1.12 -2.12 0.00 0.00 175.29 173.36 2dbl s SER 7 N -3.90 1.58 0.80 5.90 0.01 -0.87 -4.95 113.70 112.26 2dbl s SER 7 Ca 0.36 1.19 -0.12 0.00 1.31 0.00 0.00 55.95 58.69 2dbl s SER 7 Cb -0.07 -1.84 0.07 0.00 0.21 0.00 0.00 66.02 64.39 2dbl s SER 7 CO 0.25 -3.78 1.16 -0.83 0.41 0.00 0.00 173.24 170.45 2dbl s GLY 8 N -3.17 1.60 0.24 3.44 0.00 -1.26 -4.67 107.32 103.49 2dbl s GLY 8 Ca 0.67 -0.56 -0.31 0.00 0.00 0.00 0.00 44.72 44.52 2dbl s GLY 8 CO 0.60 -0.09 1.65 -4.14 0.00 0.00 0.00 173.10 171.12 2dbl s PRO 9 N -5.49 4.14 0.03 2.90 0.02 -1.26 -4.77 135.00 130.57 2dbl s PRO 9 Ca 0.61 2.56 0.03 0.00 0.02 0.00 0.00 61.00 64.22 2dbl s PRO 9 Cb -0.12 -3.06 -0.04 0.00 0.02 0.00 0.00 34.50 31.30 2dbl s PRO 9 CO 0.50 -0.68 -0.01 -1.21 -0.33 0.00 0.00 177.00 175.27 2dbl s GLU 10 N 0.50 2.69 -0.20 5.54 0.41 -0.80 -5.00 118.70 121.84 2dbl s GLU 10 Ca 0.69 -0.69 -0.00 0.00 -0.41 0.00 0.00 54.97 54.57 2dbl s GLU 10 Cb -0.48 -2.62 0.05 0.00 -1.78 0.00 0.00 34.13 29.30 2dbl s GLU 10 CO 0.38 0.60 -0.05 -1.17 -0.49 0.00 0.00 175.26 174.53 2dbl s LEU 11 N -1.77 2.04 0.12 1.80 0.20 -1.26 -2.01 118.68 117.80 2dbl s LEU 11 Ca 0.21 -0.91 0.05 0.00 0.69 0.00 0.00 54.13 54.17 2dbl s LEU 11 Cb -0.12 -1.03 -0.04 0.00 -0.43 0.00 0.00 46.19 44.58 2dbl s LEU 11 CO 0.12 -0.21 -0.13 -0.54 -0.29 0.00 0.00 176.35 175.31 2dbl s LYS 12 N 1.53 0.99 0.20 1.98 3.01 -0.47 -5.01 119.74 121.96 2dbl s LYS 12 Ca -0.02 -1.24 -0.00 0.00 -1.01 0.00 0.00 55.97 53.70 2dbl s LYS 12 Cb -0.17 -0.79 0.04 0.00 -1.01 0.00 0.00 37.83 35.90 2dbl s LYS 12 CO -0.07 0.14 0.27 1.63 0.51 0.00 0.00 175.35 177.83 2dbl n LYS 13 N 0.47 0.40 -1.63 1.68 4.76 -1.26 -1.47 118.16 121.10 2dbl n LYS 13 Ca -0.15 -0.71 -0.29 0.00 -2.87 0.00 0.00 58.31 54.28 2dbl n LYS 13 Cb 0.57 -0.18 0.11 0.00 -1.84 0.00 0.00 35.03 33.69 2dbl n LYS 13 CO 0.00 0.00 0.00 -2.14 -1.37 0.00 0.00 177.40 173.89 2dbl s PRO 14 N -3.13 1.59 -1.38 1.97 0.02 -1.26 -3.95 135.00 128.85 2dbl s PRO 14 Ca 0.18 0.33 -0.02 0.00 0.02 0.00 0.00 61.00 61.51 2dbl s PRO 14 Cb -0.01 -1.89 0.01 0.00 0.02 0.00 0.00 34.50 32.63 2dbl s PRO 14 CO 0.12 -1.90 0.13 0.41 -0.33 0.00 0.00 177.00 175.43 2dbl n GLY 15 N -2.47 -0.50 0.00 0.52 0.00 -0.37 -4.81 105.19 97.57 2dbl n GLY 15 Ca 0.07 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2dbl n GLY 15 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dbl n GLU 16 N -3.13 3.58 -3.79 1.61 1.02 -1.25 -4.52 120.64 114.15 2dbl n GLU 16 Ca -0.16 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 56.85 2dbl n GLU 16 Cb 0.63 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.95 2dbl n GLU 16 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2dbl s THR 17 N 1.74 0.04 -0.03 2.62 -4.23 -1.26 0.11 115.64 114.62 2dbl s THR 17 Ca 0.00 -0.32 0.03 0.00 -1.18 0.00 0.00 61.69 60.22 2dbl s THR 17 Cb 0.00 -0.50 0.00 0.00 1.34 0.00 0.00 72.50 73.34 2dbl s THR 17 CO 0.00 -0.18 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.10 2dbl s VAL 18 N -0.74 0.97 -0.28 2.29 1.01 -0.11 -4.97 120.40 118.57 2dbl s VAL 18 Ca -0.08 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.46 2dbl s VAL 18 Cb -0.04 -0.86 0.08 0.00 0.00 0.00 0.00 36.38 35.55 2dbl s VAL 18 CO 0.02 0.30 -0.01 -0.75 0.00 0.00 0.00 175.10 174.66 2dbl s LYS 19 N 0.20 1.58 -0.02 2.72 2.20 -1.26 -1.39 119.74 123.77 2dbl s LYS 19 Ca -0.04 -1.36 -0.24 0.00 -0.36 0.00 0.00 55.97 53.97 2dbl s LYS 19 Cb -0.10 -2.77 -0.04 0.00 -1.51 0.00 0.00 37.83 33.41 2dbl s LYS 19 CO 0.01 -0.75 0.71 0.42 -0.36 0.00 0.00 175.35 175.38 2dbl s ILE 20 N 1.21 4.92 -0.18 5.43 1.01 -0.12 -4.93 121.20 128.54 2dbl s ILE 20 Ca 0.01 1.49 -0.09 0.00 0.00 0.00 0.00 60.65 62.06 2dbl s ILE 20 Cb -0.19 -4.06 -0.05 0.00 0.01 0.00 0.00 42.46 38.18 2dbl s ILE 20 CO -0.09 0.31 0.12 -0.44 0.00 0.00 0.00 174.94 174.83 2dbl s SER 21 N 0.40 6.10 -0.54 3.58 0.01 -1.26 -2.53 113.70 119.47 2dbl s SER 21 Ca 0.37 0.23 0.04 0.00 1.31 0.00 0.00 55.95 57.91 2dbl s SER 21 Cb -0.19 -2.05 0.14 0.00 0.21 0.00 0.00 66.02 64.13 2dbl s SER 21 CO 0.20 0.22 0.31 0.00 0.41 0.00 0.00 173.24 174.38 2dbl s LYS 23 N -0.40 3.85 0.21 0.00 2.20 0.16 -0.87 119.74 124.90 2dbl s LYS 23 Ca 0.19 0.02 -0.09 0.00 -0.36 0.00 0.00 55.97 55.74 2dbl s LYS 23 Cb -0.20 -3.72 -0.07 0.00 -1.51 0.00 0.00 37.83 32.33 2dbl s LYS 23 CO -0.04 -0.45 0.51 0.00 -0.36 0.00 0.00 175.35 175.01 2dbl s ALA 24 N 2.26 3.61 -0.09 3.13 0.00 -1.07 -0.33 121.76 129.27 2dbl s ALA 24 Ca 0.18 -0.34 -0.30 0.00 0.00 0.00 0.00 51.96 51.50 2dbl s ALA 24 Cb -0.16 -2.37 0.08 0.00 0.00 0.00 0.00 23.12 20.68 2dbl s ALA 24 CO 0.11 0.53 0.75 -1.54 0.00 0.00 0.00 175.76 175.61 2dbl s SER 25 N -2.40 -0.61 0.00 0.00 1.04 -1.11 -4.84 113.70 105.79 2dbl s SER 25 Ca 0.46 0.72 0.00 0.00 0.48 0.00 0.00 55.95 57.61 2dbl s SER 25 Cb -0.11 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.58 2dbl s SER 25 CO 0.22 -0.52 0.00 0.61 0.98 0.00 0.00 173.24 174.53 2dbl n GLY 26 N 1.03 3.19 3.39 7.32 0.00 -1.26 -3.05 105.19 115.81 2dbl n GLY 26 Ca -0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.65 2dbl n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dbl s TYR 27 N -2.32 1.92 -0.83 1.61 1.13 -1.26 -4.99 117.35 112.61 2dbl s TYR 27 Ca 0.00 -0.48 -0.25 0.00 -1.41 0.00 0.00 57.07 54.93 2dbl s TYR 27 Cb 0.00 -0.87 -0.05 0.00 -1.10 0.00 0.00 41.96 39.94 2dbl s TYR 27 CO 0.00 0.48 1.96 0.00 -2.51 0.00 0.00 175.55 175.48 2dbl s ALA 28 N -2.74 1.72 0.37 9.51 0.00 -1.26 -4.86 121.76 124.49 2dbl s ALA 28 Ca 0.25 -1.29 0.15 0.00 0.00 0.00 0.00 51.96 51.07 2dbl s ALA 28 Cb -0.03 -4.50 1.04 0.00 0.00 0.00 0.00 23.12 19.63 2dbl s ALA 28 CO 0.10 -4.68 1.74 0.35 0.00 0.00 0.00 175.76 173.27 2dbl h PHE 29 N 12.20 0.81 0.00 0.00 3.57 -1.97 -2.40 116.94 129.15 2dbl h PHE 29 Ca 0.02 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.47 2dbl h PHE 29 Cb 1.04 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.54 2dbl h PHE 29 CO 1.18 0.03 -0.37 1.79 -2.23 0.00 0.00 178.31 178.71 2dbl h THR 30 N 0.44 0.92 -1.90 4.41 1.35 -1.93 -3.35 112.91 112.87 2dbl h THR 30 Ca 0.64 -1.46 -0.73 0.00 -0.55 0.00 0.00 66.41 64.32 2dbl h THR 30 Cb 1.47 1.87 -0.31 0.00 -1.73 0.00 0.00 68.15 69.46 2dbl h THR 30 CO -0.39 0.36 0.61 -0.46 -0.25 0.00 0.00 175.52 175.39 2dbl n ASN 31 N -3.60 6.81 -3.53 5.36 2.04 -0.90 -3.27 115.26 118.16 2dbl n ASN 31 Ca -0.01 -3.80 -0.13 0.00 -0.44 0.00 0.00 54.58 50.20 2dbl n ASN 31 Cb 0.48 -0.92 -0.05 0.00 -2.53 0.00 0.00 39.78 36.77 2dbl n ASN 31 CO 0.00 0.00 0.00 -0.31 -0.44 0.00 0.00 177.26 176.51 2dbl s TYR 32 N -3.95 -0.50 0.39 -2.53 2.02 -1.26 -4.80 117.35 106.72 2dbl s TYR 32 Ca 0.51 0.74 0.03 0.00 -0.37 0.00 0.00 57.07 57.97 2dbl s TYR 32 Cb 0.42 0.46 -0.01 0.00 -0.40 0.00 0.00 41.96 42.43 2dbl s TYR 32 CO -0.35 -0.54 0.57 0.20 -1.57 0.00 0.00 175.55 173.86 2dbl s GLY 33 N -1.53 1.52 -0.20 0.71 0.00 0.73 -4.08 107.32 104.47 2dbl s GLY 33 Ca -0.04 -1.17 -0.04 0.00 0.00 0.00 0.00 44.72 43.47 2dbl s GLY 33 CO 0.02 -1.05 -0.04 0.14 0.00 0.00 0.00 173.10 172.17 2dbl s VAL 34 N -2.37 3.59 0.29 1.40 1.01 0.08 0.02 120.40 124.43 2dbl s VAL 34 Ca 0.45 -0.43 0.07 0.00 0.00 0.00 0.00 61.98 62.07 2dbl s VAL 34 Cb -0.10 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.64 2dbl s VAL 34 CO 0.35 0.44 0.23 0.20 0.00 0.00 0.00 175.10 176.33 2dbl s ASN 35 N 1.09 5.40 -0.01 3.32 0.01 0.15 -0.27 114.94 124.64 2dbl s ASN 35 Ca 0.01 -0.37 0.04 0.00 -0.71 0.00 0.00 52.86 51.84 2dbl s ASN 35 Cb -0.15 -1.20 -0.01 0.00 0.41 0.00 0.00 41.25 40.30 2dbl s ASN 35 CO 0.00 -0.18 -0.12 0.26 -1.51 0.00 0.00 177.10 175.56 2dbl s TRP 36 N -2.21 1.08 -0.08 2.20 0.52 -1.20 -0.84 118.94 118.40 2dbl s TRP 36 Ca 0.36 -0.21 -0.00 0.00 0.02 0.00 0.00 56.10 56.27 2dbl s TRP 36 Cb -0.07 -0.70 0.03 0.00 -1.15 0.00 0.00 33.47 31.58 2dbl s TRP 36 CO 0.26 -0.02 -0.04 0.08 0.02 0.00 0.00 176.95 177.25 2dbl s VAL 37 N -0.26 0.64 -0.16 4.03 1.01 0.30 -0.75 120.40 125.21 2dbl s VAL 37 Ca 0.04 -0.07 -0.18 0.00 0.00 0.00 0.00 61.98 61.77 2dbl s VAL 37 Cb -0.05 -0.72 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 2dbl s VAL 37 CO -0.00 0.29 0.46 -0.75 0.00 0.00 0.00 175.10 175.10 2dbl s LYS 38 N 1.65 4.26 -0.12 2.72 2.20 -0.77 -0.63 119.74 129.06 2dbl s LYS 38 Ca 0.01 0.37 0.03 0.00 -0.36 0.00 0.00 55.97 56.02 2dbl s LYS 38 Cb -0.13 -3.49 0.00 0.00 -1.51 0.00 0.00 37.83 32.70 2dbl s LYS 38 CO -0.05 0.04 -0.21 -2.00 -0.36 0.00 0.00 175.35 172.77 2dbl s GLU 39 N 1.04 3.11 0.08 4.03 2.12 -0.42 -1.09 118.70 127.56 2dbl s GLU 39 Ca 0.24 -0.83 0.07 0.00 0.36 0.00 0.00 54.97 54.80 2dbl s GLU 39 Cb -0.15 -2.41 -0.03 0.00 0.26 0.00 0.00 34.13 31.80 2dbl s GLU 39 CO 0.09 0.12 -0.18 0.00 -0.54 0.00 0.00 175.26 174.75 2dbl s ALA 40 N 0.50 1.54 -0.30 6.30 0.00 -1.26 -1.26 121.76 127.28 2dbl s ALA 40 Ca -0.14 -1.09 -0.36 0.00 0.00 0.00 0.00 51.96 50.37 2dbl s ALA 40 Cb -0.17 -0.21 -0.13 0.00 0.00 0.00 0.00 23.12 22.61 2dbl s ALA 40 CO 0.05 0.30 2.05 -2.30 0.00 0.00 0.00 175.76 175.86 2dbl n PRO 41 N 1.38 1.21 0.00 0.00 -0.02 -1.26 -1.45 135.00 134.86 2dbl n PRO 41 Ca -0.19 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 2dbl n PRO 41 Cb 0.54 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 2dbl n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dbl n GLY 42 N 5.77 1.56 3.54 -1.23 0.00 -1.26 -4.93 105.19 108.63 2dbl n GLY 42 Ca 0.36 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 2dbl n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dbl s LYS 43 N 0.00 -0.42 0.92 1.61 1.02 -0.53 -5.01 119.74 117.33 2dbl s LYS 43 Ca 0.00 1.03 -0.12 0.00 0.02 0.00 0.00 55.97 56.89 2dbl s LYS 43 Cb 0.00 -1.60 0.14 0.00 -0.52 0.00 0.00 37.83 35.85 2dbl s LYS 43 CO 0.00 -3.45 1.14 -1.21 -0.92 0.00 0.00 175.35 170.91 2dbl s GLU 44 N -4.51 1.10 -0.22 1.68 8.01 -1.26 -4.38 118.70 119.11 2dbl s GLU 44 Ca 0.68 0.27 -0.29 0.00 0.01 0.00 0.00 54.97 55.64 2dbl s GLU 44 Cb -0.24 -1.84 0.00 0.00 -4.31 0.00 0.00 34.13 27.75 2dbl s GLU 44 CO 0.63 -2.22 1.09 -0.51 0.01 0.00 0.00 175.26 174.26 2dbl s LEU 45 N -6.05 4.12 -0.22 1.80 1.43 -1.26 -3.98 118.68 114.53 2dbl s LEU 45 Ca 0.64 1.45 0.02 0.00 -1.03 0.00 0.00 54.13 55.21 2dbl s LEU 45 Cb -0.15 -3.54 0.04 0.00 0.03 0.00 0.00 46.19 42.58 2dbl s LEU 45 CO 0.53 -0.69 -0.14 -0.75 0.23 0.00 0.00 176.35 175.53 2dbl s LYS 46 N 3.27 2.44 0.05 1.70 2.20 -0.25 -4.99 119.74 124.16 2dbl s LYS 46 Ca 0.46 -1.04 -0.30 0.00 -0.36 0.00 0.00 55.97 54.74 2dbl s LYS 46 Cb -0.17 -2.65 -0.09 0.00 -1.51 0.00 0.00 37.83 33.42 2dbl s LYS 46 CO 0.08 -0.41 1.82 -0.46 -0.36 0.00 0.00 175.35 176.03 2dbl s TRP 47 N 1.24 1.82 -0.12 4.03 -0.00 -1.26 -1.84 118.94 122.81 2dbl s TRP 47 Ca -0.02 -0.10 0.08 0.00 -0.00 0.00 0.00 56.10 56.06 2dbl s TRP 47 Cb -0.17 -4.12 -0.24 0.00 -0.00 0.00 0.00 33.47 28.95 2dbl s TRP 47 CO -0.09 -4.80 0.37 -1.33 -0.00 0.00 0.00 176.95 171.11 2dbl n MET 48 N 6.66 0.68 -3.49 5.86 2.81 0.07 -4.82 117.12 124.89 2dbl n MET 48 Ca 0.18 0.21 0.00 0.00 -1.81 0.00 0.00 57.70 56.28 2dbl n MET 48 Cb 0.41 -1.69 0.00 0.00 -0.71 0.00 0.00 33.22 31.23 2dbl n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2dbl n GLY 49 N 1.78 -0.79 3.30 3.03 0.00 -1.25 -1.78 105.19 109.47 2dbl n GLY 49 Ca -0.27 -0.91 -0.11 0.00 0.00 0.00 0.00 46.02 44.74 2dbl n GLY 49 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2dbl s TRP 50 N -3.00 -0.17 -0.05 1.61 -0.00 0.12 -3.27 118.94 114.18 2dbl s TRP 50 Ca 0.00 -0.08 0.01 0.00 -0.00 0.00 0.00 56.10 56.03 2dbl s TRP 50 Cb 0.00 0.20 0.02 0.00 -0.00 0.00 0.00 33.47 33.69 2dbl s TRP 50 CO 0.00 -0.64 -0.04 -1.50 -0.00 0.00 0.00 176.95 174.78 2dbl s ILE 51 N -3.40 0.50 -0.31 5.86 1.10 0.63 -1.71 121.20 123.86 2dbl s ILE 51 Ca 0.01 -0.08 -0.15 0.00 -0.51 0.00 0.00 60.65 59.91 2dbl s ILE 51 Cb 0.01 -0.55 -0.02 0.00 0.15 0.00 0.00 42.46 42.06 2dbl s ILE 51 CO -0.09 0.23 0.39 0.21 -2.11 0.00 0.00 174.94 173.56 2dbl s ASN 52 N 1.07 6.23 0.06 4.50 2.47 -1.18 -0.74 114.94 127.35 2dbl s ASN 52 Ca -0.09 0.01 -0.17 0.00 0.42 0.00 0.00 52.86 53.03 2dbl s ASN 52 Cb -0.14 -2.21 -0.15 0.00 -1.45 0.00 0.00 41.25 37.30 2dbl s ASN 52 CO -0.01 -0.29 1.29 0.40 -3.72 0.00 0.00 177.10 174.77 2dbl h ILE 52 N 5.49 1.35 -0.01 -5.21 1.08 -1.77 -0.01 117.51 118.42 2dbl h ILE 52 Ca -0.30 -1.68 0.00 0.00 -0.39 0.00 0.00 64.86 62.49 2dbl h ILE 52 Cb 1.15 2.01 -0.00 0.00 -3.07 0.00 0.00 36.82 36.91 2dbl h ILE 52 CO 0.68 0.51 -0.01 -1.22 -0.69 0.00 0.00 178.15 177.43 2dbl n TYR 53 N -4.27 -0.01 1.00 1.37 4.02 -1.20 -3.33 117.16 114.74 2dbl n TYR 53 Ca -0.07 0.02 0.10 0.00 -0.01 0.00 0.00 57.90 57.94 2dbl n TYR 53 Cb 0.54 -0.44 -0.10 0.00 -0.02 0.00 0.00 39.34 39.33 2dbl n TYR 53 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 2dbl n THR 54 N -2.90 0.00 0.00 -0.72 -2.24 -1.25 -5.03 114.28 102.14 2dbl n THR 54 Ca 0.00 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 2dbl n THR 54 Cb 0.00 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 2dbl n THR 54 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dbl n GLY 55 N 1.49 1.97 3.20 3.38 0.00 -0.02 -5.03 105.19 110.18 2dbl n GLY 55 Ca 0.05 -0.25 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 2dbl n GLY 55 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2dbl n GLU 56 N 0.00 0.04 -4.74 1.61 4.07 -1.26 -4.18 120.64 116.18 2dbl n GLU 56 Ca 0.00 0.02 -0.26 0.00 -0.06 0.00 0.00 57.16 56.86 2dbl n GLU 56 Cb 0.00 -1.21 -0.14 0.00 -0.06 0.00 0.00 31.44 30.02 2dbl n GLU 56 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 2dbl s PRO 57 N -1.91 1.47 -0.21 5.31 0.05 -1.26 -3.09 135.00 135.36 2dbl s PRO 57 Ca 0.52 -0.90 -0.08 0.00 0.05 0.00 0.00 61.00 60.59 2dbl s PRO 57 Cb -0.32 -1.55 -0.04 0.00 0.05 0.00 0.00 34.50 32.64 2dbl s PRO 57 CO 0.71 0.40 0.08 0.99 0.05 0.00 0.00 177.00 179.23 2dbl s THR 58 N -0.73 4.69 -0.07 1.26 2.01 -0.70 -4.97 115.64 117.13 2dbl s THR 58 Ca 0.08 -0.06 -0.01 0.00 0.31 0.00 0.00 61.69 62.01 2dbl s THR 58 Cb -0.09 -3.15 -0.03 0.00 0.01 0.00 0.00 72.50 69.24 2dbl s THR 58 CO 0.01 0.40 -0.02 -0.31 -0.69 0.00 0.00 174.62 174.01 2dbl s TYR 59 N 0.89 3.08 0.05 4.92 2.02 -1.26 0.11 117.35 127.16 2dbl s TYR 59 Ca 0.04 0.13 -0.23 0.00 -0.37 0.00 0.00 57.07 56.64 2dbl s TYR 59 Cb -0.14 -1.75 -0.06 0.00 -0.40 0.00 0.00 41.96 39.61 2dbl s TYR 59 CO 0.03 0.43 0.70 0.08 -1.57 0.00 0.00 175.55 175.21 2dbl s VAL 60 N -0.88 4.72 0.04 0.71 1.01 -0.74 -4.93 120.40 120.33 2dbl s VAL 60 Ca 0.13 1.49 -0.02 0.00 0.00 0.00 0.00 61.98 63.59 2dbl s VAL 60 Cb -0.11 -4.04 0.05 0.00 0.00 0.00 0.00 36.38 32.27 2dbl s VAL 60 CO 0.03 0.43 0.22 0.47 0.00 0.00 0.00 175.10 176.24 2dbl n ASP 61 N 2.47 -0.07 -0.25 3.32 9.92 -1.26 -0.54 116.55 130.14 2dbl n ASP 61 Ca -0.05 0.24 0.11 0.00 -0.53 0.00 0.00 54.79 54.56 2dbl n ASP 61 Cb 0.50 -0.07 0.38 0.00 -0.64 0.00 0.00 41.12 41.30 2dbl n ASP 61 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 2dbl h ASP 62 N 0.00 0.64 -0.72 -2.24 5.19 -1.92 -2.21 116.42 115.16 2dbl h ASP 62 Ca 0.06 0.03 -0.37 0.00 -0.62 0.00 0.00 57.03 56.13 2dbl h ASP 62 Cb 0.09 -0.10 -0.22 0.00 0.18 0.00 0.00 39.33 39.29 2dbl h ASP 62 CO -0.14 0.34 0.34 0.49 -3.12 0.00 0.00 179.24 177.15 2dbl n PHE 63 N -4.54 2.23 -2.08 4.55 3.72 0.30 -5.00 117.46 116.64 2dbl n PHE 63 Ca 0.16 -1.72 -0.39 0.00 -0.05 0.00 0.00 57.45 55.44 2dbl n PHE 63 Cb 0.43 -0.75 -0.01 0.00 -0.94 0.00 0.00 39.48 38.21 2dbl n PHE 63 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2dbl s LYS 64 N -3.27 4.02 0.00 -1.08 -0.14 -0.83 -3.81 119.74 114.63 2dbl s LYS 64 Ca 0.52 2.13 0.00 0.00 -1.36 0.00 0.00 55.97 57.26 2dbl s LYS 64 Cb 0.45 -2.78 0.00 0.00 -1.68 0.00 0.00 37.83 33.82 2dbl s LYS 64 CO 0.06 -0.44 0.00 0.41 -0.76 0.00 0.00 175.35 174.62 2dbl n GLY 65 N 0.68 0.22 0.14 -3.33 0.00 -1.26 -4.14 105.19 97.50 2dbl n GLY 65 Ca 0.03 -0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.07 2dbl n GLY 65 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2dbl h ARG 66 N 0.00 0.00 -5.32 1.61 2.43 -1.94 -3.41 114.38 107.75 2dbl h ARG 66 Ca 0.00 0.00 -0.60 0.00 -0.81 0.00 0.00 59.98 58.57 2dbl h ARG 66 Cb 0.00 0.00 -0.12 0.00 -0.42 0.00 0.00 29.97 29.43 2dbl h ARG 66 CO 0.00 0.56 -0.43 -0.06 -1.51 0.00 0.00 179.97 178.53 2dbl s PHE 67 N -3.27 3.41 -0.07 2.20 0.40 -1.25 -4.27 117.98 115.13 2dbl s PHE 67 Ca 0.01 0.41 0.03 0.00 -0.60 0.00 0.00 56.93 56.78 2dbl s PHE 67 Cb 0.10 -2.25 0.01 0.00 0.51 0.00 0.00 43.02 41.39 2dbl s PHE 67 CO 0.74 0.23 -0.15 0.00 0.70 0.00 0.00 175.22 176.74 2dbl s ALA 68 N 0.53 1.44 -0.38 5.36 0.00 0.21 -4.83 121.76 124.10 2dbl s ALA 68 Ca 0.11 -0.54 -0.15 0.00 0.00 0.00 0.00 51.96 51.39 2dbl s ALA 68 Cb -0.12 -0.60 0.00 0.00 0.00 0.00 0.00 23.12 22.40 2dbl s ALA 68 CO 0.01 0.16 0.31 -0.06 0.00 0.00 0.00 175.76 176.18 2dbl s PHE 69 N 0.54 3.22 0.31 0.00 0.08 -1.26 -1.21 117.98 119.66 2dbl s PHE 69 Ca -0.14 -0.36 0.05 0.00 0.12 0.00 0.00 56.93 56.60 2dbl s PHE 69 Cb -0.16 -2.61 0.05 0.00 -0.57 0.00 0.00 43.02 39.73 2dbl s PHE 69 CO 0.05 -0.51 0.41 0.43 -0.10 0.00 0.00 175.22 175.50 2dbl n SER 70 N 5.24 1.19 -3.65 1.36 7.64 0.00 -4.92 113.62 120.49 2dbl n SER 70 Ca -0.11 -1.84 -0.02 0.00 1.01 0.00 0.00 58.87 57.92 2dbl n SER 70 Cb 0.48 -0.21 -0.07 0.00 -1.01 0.00 0.00 64.21 63.40 2dbl n SER 70 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2dbl s LEU 71 N 0.00 -0.20 -0.42 -3.43 2.96 -1.26 -2.98 118.68 113.34 2dbl s LEU 71 Ca 0.31 0.35 0.04 0.00 -0.22 0.00 0.00 54.13 54.61 2dbl s LEU 71 Cb -0.02 1.34 0.17 0.00 0.50 0.00 0.00 46.19 48.17 2dbl s LEU 71 CO 0.20 -0.06 0.34 -0.70 -1.32 0.00 0.00 176.35 174.81 2dbl s GLU 72 N 0.65 0.97 0.23 1.98 2.56 -0.36 -4.99 118.70 119.73 2dbl s GLU 72 Ca -0.02 -2.13 -0.07 0.00 0.00 0.00 0.00 54.97 52.76 2dbl s GLU 72 Cb -0.04 -1.53 0.37 0.00 2.00 0.00 0.00 34.13 34.93 2dbl s GLU 72 CO -0.12 -1.37 1.74 1.15 -0.56 0.00 0.00 175.26 176.10 2dbl h THR 73 N 4.65 0.73 -0.65 -1.70 2.02 -1.93 -1.79 112.91 114.23 2dbl h THR 73 Ca 0.25 -0.16 0.14 0.00 0.77 0.00 0.00 66.41 67.40 2dbl h THR 73 Cb 0.91 0.23 -0.12 0.00 -1.74 0.00 0.00 68.15 67.43 2dbl h THR 73 CO 0.38 0.08 -0.06 0.77 0.37 0.00 0.00 175.52 177.07 2dbl h SER 74 N 0.46 -0.41 -0.01 4.18 4.64 -1.96 0.39 113.55 120.83 2dbl h SER 74 Ca 0.36 0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.86 2dbl h SER 74 Cb 0.49 0.33 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 2dbl h SER 74 CO -0.35 -0.17 0.00 0.00 -0.87 0.00 0.00 176.83 175.45 2dbl n ALA 75 N -2.93 2.56 -0.54 5.18 0.00 -0.71 -4.93 120.51 119.13 2dbl n ALA 75 Ca 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2dbl n ALA 75 Cb 0.37 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.66 2dbl n ALA 75 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2dbl n SER 76 N -0.61 -2.40 -4.85 0.00 7.64 0.14 -4.86 113.62 108.68 2dbl n SER 76 Ca 0.08 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.61 2dbl n SER 76 Cb 0.05 -2.21 -0.06 0.00 -1.01 0.00 0.00 64.21 60.98 2dbl n SER 76 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2dbl s THR 77 N -0.69 4.93 0.17 0.44 2.01 -1.20 -2.61 115.64 118.69 2dbl s THR 77 Ca 0.00 0.73 0.07 0.00 0.31 0.00 0.00 61.69 62.80 2dbl s THR 77 Cb 0.00 -3.71 -0.04 0.00 0.01 0.00 0.00 72.50 68.76 2dbl s THR 77 CO 0.00 0.28 -0.02 0.00 -0.69 0.00 0.00 174.62 174.19 2dbl s ALA 78 N -1.42 3.15 0.02 7.40 0.00 -0.05 -1.23 121.76 129.64 2dbl s ALA 78 Ca 0.35 -1.37 0.01 0.00 0.00 0.00 0.00 51.96 50.95 2dbl s ALA 78 Cb -0.15 -0.95 -0.02 0.00 0.00 0.00 0.00 23.12 22.00 2dbl s ALA 78 CO 0.19 0.49 -0.05 0.71 0.00 0.00 0.00 175.76 177.09 2dbl s TYR 79 N -1.70 0.45 -0.06 0.00 1.51 -1.16 -0.34 117.35 116.06 2dbl s TYR 79 Ca 0.27 -0.40 0.03 0.00 -1.01 0.00 0.00 57.07 55.96 2dbl s TYR 79 Cb -0.09 -0.28 0.00 0.00 -0.11 0.00 0.00 41.96 41.48 2dbl s TYR 79 CO 0.18 -0.10 -0.15 -1.17 -1.11 0.00 0.00 175.55 173.20 2dbl s LEU 80 N -1.19 1.80 -0.03 -1.29 0.20 -1.05 -0.82 118.68 116.31 2dbl s LEU 80 Ca -0.09 -0.34 0.03 0.00 0.69 0.00 0.00 54.13 54.42 2dbl s LEU 80 Cb -0.08 -0.92 -0.00 0.00 -0.43 0.00 0.00 46.19 44.76 2dbl s LEU 80 CO -0.00 0.09 -0.12 -0.70 -0.29 0.00 0.00 176.35 175.33 2dbl s GLU 81 N 0.36 1.23 0.43 1.98 2.12 -0.35 -0.95 118.70 123.52 2dbl s GLU 81 Ca -0.10 -0.42 0.02 0.00 0.36 0.00 0.00 54.97 54.82 2dbl s GLU 81 Cb -0.14 -1.12 0.02 0.00 0.26 0.00 0.00 34.13 33.15 2dbl s GLU 81 CO 0.03 0.18 0.13 -0.89 -0.54 0.00 0.00 175.26 174.17 2dbl n ILE 82 N 3.17 0.00 -2.26 -3.70 5.41 -0.49 -0.62 119.36 120.88 2dbl n ILE 82 Ca -0.18 -1.92 0.00 0.00 1.00 0.00 0.00 62.75 61.65 2dbl n ILE 82 Cb 0.54 0.21 0.00 0.00 -0.71 0.00 0.00 39.64 39.68 2dbl n ILE 82 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2dbl n ASN 82 N -1.48 0.00 -4.53 4.38 4.13 0.29 -0.93 115.26 117.12 2dbl n ASN 82 Ca -0.12 0.00 -0.52 0.00 1.68 0.00 0.00 54.58 55.62 2dbl n ASN 82 Cb 0.53 0.00 -0.07 0.00 -1.54 0.00 0.00 39.78 38.70 2dbl n ASN 82 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2dbl n LEU 82 N -0.60 2.31 -4.87 3.41 7.99 -1.04 -4.45 117.00 119.75 2dbl n LEU 82 Ca 0.00 0.65 -0.31 0.00 -0.01 0.00 0.00 56.01 56.35 2dbl n LEU 82 Cb 0.00 -1.23 0.02 0.00 -0.11 0.00 0.00 43.42 42.09 2dbl n LEU 82 CO 0.00 -0.57 0.72 -0.54 -1.51 0.00 0.00 177.39 175.48 2dbl s LYS 83 N 5.30 3.47 0.26 3.23 -0.14 -1.26 -1.23 119.74 129.37 2dbl s LYS 83 Ca 1.05 0.68 0.20 0.00 -1.36 0.00 0.00 55.97 56.54 2dbl s LYS 83 Cb -0.91 -2.08 0.98 0.00 -1.68 0.00 0.00 37.83 34.14 2dbl s LYS 83 CO 0.54 -0.64 1.60 -1.71 -0.76 0.00 0.00 175.35 174.38 2dbl n ASN 84 N -2.78 0.51 -0.12 2.83 4.05 -1.26 -2.29 115.26 116.20 2dbl n ASN 84 Ca 0.06 0.70 0.15 0.00 0.45 0.00 0.00 54.58 55.94 2dbl n ASN 84 Cb 0.55 -0.78 0.76 0.00 1.23 0.00 0.00 39.78 41.54 2dbl n ASN 84 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 2dbl n GLU 85 N -2.14 0.98 0.00 1.20 -0.58 -1.26 -3.80 120.64 115.03 2dbl n GLU 85 Ca -0.00 -0.24 0.14 0.00 -0.42 0.00 0.00 57.16 56.64 2dbl n GLU 85 Cb 0.09 -1.50 0.63 0.00 -0.57 0.00 0.00 31.44 30.09 2dbl n GLU 85 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2dbl n ASP 86 N -0.80 0.87 -4.60 1.62 8.00 -0.97 -4.85 116.55 115.82 2dbl n ASP 86 Ca 0.20 -1.12 -0.43 0.00 0.71 0.00 0.00 54.79 54.15 2dbl n ASP 86 Cb 0.21 -0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.28 2dbl n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2dbl s THR 87 N -2.16 3.22 0.04 -3.53 2.01 -1.25 -4.73 115.64 109.24 2dbl s THR 87 Ca 0.37 0.22 -0.05 0.00 0.31 0.00 0.00 61.69 62.54 2dbl s THR 87 Cb 0.21 -3.29 0.02 0.00 0.01 0.00 0.00 72.50 69.45 2dbl s THR 87 CO 0.39 -0.18 0.22 0.00 -0.69 0.00 0.00 174.62 174.37 2dbl n ALA 88 N 11.00 -0.59 -3.37 7.40 0.00 -0.69 -4.59 120.51 129.67 2dbl n ALA 88 Ca 0.27 -0.22 -0.31 0.00 0.00 0.00 0.00 53.44 53.17 2dbl n ALA 88 Cb 0.46 0.12 -0.17 0.00 0.00 0.00 0.00 19.45 19.86 2dbl n ALA 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2dbl s THR 89 N -2.46 1.95 -0.20 0.00 2.01 -0.39 -0.05 115.64 116.50 2dbl s THR 89 Ca 0.05 -0.95 -0.06 0.00 0.31 0.00 0.00 61.69 61.04 2dbl s THR 89 Cb -0.01 -1.71 -0.03 0.00 0.01 0.00 0.00 72.50 70.77 2dbl s THR 89 CO 0.01 0.53 0.04 -0.31 -0.69 0.00 0.00 174.62 174.21 2dbl s TYR 90 N 0.51 3.12 0.05 4.92 2.02 0.70 -1.30 117.35 127.38 2dbl s TYR 90 Ca -0.15 -0.23 0.04 0.00 -0.37 0.00 0.00 57.07 56.35 2dbl s TYR 90 Cb -0.17 -2.12 -0.04 0.00 -0.40 0.00 0.00 41.96 39.23 2dbl s TYR 90 CO 0.05 -0.11 -0.01 -0.06 -1.57 0.00 0.00 175.55 173.85 2dbl s PHE 91 N 0.90 3.00 -0.07 2.71 0.40 0.20 -2.16 117.98 122.96 2dbl s PHE 91 Ca 0.03 0.00 0.04 0.00 -0.60 0.00 0.00 56.93 56.41 2dbl s PHE 91 Cb -0.14 -1.59 -0.00 0.00 0.51 0.00 0.00 43.02 41.80 2dbl s PHE 91 CO 0.02 0.46 -0.21 0.00 0.70 0.00 0.00 175.22 176.20 2dbl s THR 93 N 0.16 1.31 -0.47 0.00 -4.23 -0.02 -0.84 115.64 111.55 2dbl s THR 93 Ca -0.10 -1.66 -0.23 0.00 -1.18 0.00 0.00 61.69 58.51 2dbl s THR 93 Cb -0.15 -1.48 0.03 0.00 1.34 0.00 0.00 72.50 72.24 2dbl s THR 93 CO 0.05 -0.39 0.81 -0.60 -0.54 0.00 0.00 174.62 173.96 2dbl s ARG 94 N -2.54 3.39 -0.06 3.99 3.52 -0.56 0.35 118.95 127.02 2dbl s ARG 94 Ca 0.08 -0.15 -0.17 0.00 -0.13 0.00 0.00 55.73 55.35 2dbl s ARG 94 Cb -0.06 -3.97 -0.05 0.00 -1.56 0.00 0.00 34.95 29.32 2dbl s ARG 94 CO 0.03 -1.19 0.47 0.20 -0.81 0.00 0.00 175.30 173.99 2dbl s GLY 95 N 2.29 2.45 -0.29 8.12 0.00 0.10 -2.81 107.32 117.18 2dbl s GLY 95 Ca 0.30 -0.17 -0.14 0.00 0.00 0.00 0.00 44.72 44.70 2dbl s GLY 95 CO 0.22 0.56 0.32 -0.35 0.00 0.00 0.00 173.10 173.85 2dbl s ASP 96 N -0.04 6.16 0.55 1.64 -1.08 -0.94 -0.19 116.67 122.77 2dbl s ASP 96 Ca 0.26 0.05 0.36 0.00 -0.52 0.00 0.00 52.55 52.69 2dbl s ASP 96 Cb -0.16 -2.18 1.94 0.00 -1.46 0.00 0.00 42.92 41.06 2dbl s ASP 96 CO 0.12 -0.19 2.09 1.88 0.52 0.00 0.00 175.17 179.59 2dbl h TYR 97 N 8.31 0.00 0.00 -5.34 0.05 -1.91 -1.25 116.97 116.83 2dbl h TYR 97 Ca -0.32 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.38 2dbl h TYR 97 Cb 1.16 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.89 2dbl h TYR 97 CO 0.74 0.00 -1.00 0.28 -1.05 0.00 0.00 178.16 177.13 2dbl n VAL 98 N -2.78 1.47 0.62 -2.88 0.31 -1.26 -4.58 118.33 109.22 2dbl n VAL 98 Ca -0.02 0.10 0.11 0.00 -0.01 0.00 0.00 64.34 64.51 2dbl n VAL 98 Cb 0.09 -2.28 0.27 0.00 -0.91 0.00 0.00 33.84 31.01 2dbl n VAL 98 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2dbl n ASN 99 N -4.50 2.81 -2.84 4.52 3.02 -1.26 -4.97 115.26 112.04 2dbl n ASN 99 Ca -0.18 -1.90 -0.14 0.00 -0.03 0.00 0.00 54.58 52.33 2dbl n ASN 99 Cb 0.47 -0.21 -0.01 0.00 -0.61 0.00 0.00 39.78 39.42 2dbl n ASN 99 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 2dbl n TRP 100 N 1.06 -1.67 -2.94 3.10 8.01 -0.47 -4.95 117.44 119.58 2dbl n TRP 100 Ca 0.18 0.17 -0.19 0.00 -1.31 0.00 0.00 57.50 56.35 2dbl n TRP 100 Cb 0.50 -2.27 0.04 0.00 -2.01 0.00 0.00 31.31 27.58 2dbl n TRP 100 CO 0.00 0.00 0.00 1.52 -1.01 0.00 0.00 177.69 178.20 2dbl s TYR 100 N -2.57 2.11 -0.36 -5.99 -0.85 -1.26 -4.85 117.35 103.59 2dbl s TYR 100 Ca 0.16 -0.48 -0.01 0.00 -0.52 0.00 0.00 57.07 56.22 2dbl s TYR 100 Cb -0.09 -2.41 0.09 0.00 0.38 0.00 0.00 41.96 39.94 2dbl s TYR 100 CO 0.20 -0.90 0.11 -0.06 -1.52 0.00 0.00 175.55 173.38 2dbl s PHE 100 N -2.60 3.55 -0.12 -3.49 0.08 -1.26 -2.22 117.98 111.91 2dbl s PHE 100 Ca 0.59 -2.43 0.11 0.00 0.12 0.00 0.00 56.93 55.32 2dbl s PHE 100 Cb -0.08 -2.85 -0.24 0.00 -0.57 0.00 0.00 43.02 39.28 2dbl s PHE 100 CO 0.37 -0.93 0.35 -0.40 -0.10 0.00 0.00 175.22 174.52 2dbl n ASP 101 N 4.51 0.81 -4.20 1.36 5.75 -1.12 -4.84 116.55 118.83 2dbl n ASP 101 Ca -0.04 0.20 -0.36 0.00 -0.01 0.00 0.00 54.79 54.59 2dbl n ASP 101 Cb 0.42 0.18 -0.13 0.00 -1.03 0.00 0.00 41.12 40.56 2dbl n ASP 101 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2dbl s VAL 102 N -2.55 3.19 0.01 2.12 1.01 -1.26 -5.00 120.40 117.92 2dbl s VAL 102 Ca -0.11 -1.34 -0.04 0.00 0.00 0.00 0.00 61.98 60.49 2dbl s VAL 102 Cb 0.07 -2.84 -0.04 0.00 0.00 0.00 0.00 36.38 33.57 2dbl s VAL 102 CO 0.80 -0.14 0.23 0.26 0.00 0.00 0.00 175.10 176.25 2dbl s TRP 103 N 1.28 3.55 0.73 5.22 0.52 -1.26 -1.50 118.94 127.49 2dbl s TRP 103 Ca -0.04 0.44 -0.11 0.00 0.02 0.00 0.00 56.10 56.40 2dbl s TRP 103 Cb -0.20 -1.89 0.03 0.00 -1.15 0.00 0.00 33.47 30.26 2dbl s TRP 103 CO -0.00 0.62 1.10 0.20 0.02 0.00 0.00 176.95 178.89 2dbl s GLY 104 N -1.94 1.62 0.37 0.98 0.00 -0.02 -4.64 107.32 103.70 2dbl s GLY 104 Ca 0.29 -0.34 0.27 0.00 0.00 0.00 0.00 44.72 44.94 2dbl s GLY 104 CO 0.19 0.05 1.82 0.00 0.00 0.00 0.00 173.10 175.16 2dbl h ALA 105 N -0.76 1.00 0.00 3.20 0.00 -1.90 -3.44 119.26 117.36 2dbl h ALA 105 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2dbl h ALA 105 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2dbl h ALA 105 CO 0.63 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.29 2dbl n GLY 106 N -0.41 1.61 3.05 0.00 0.00 -1.26 -5.05 105.19 103.12 2dbl n GLY 106 Ca 0.00 -1.76 -0.13 0.00 0.00 0.00 0.00 46.02 44.14 2dbl n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dbl s THR 107 N -2.61 -0.30 -0.17 2.61 2.01 -0.92 -4.84 115.64 111.42 2dbl s THR 107 Ca 0.00 0.23 -0.16 0.00 0.31 0.00 0.00 61.69 62.06 2dbl s THR 107 Cb 0.00 -0.45 -0.04 0.00 0.01 0.00 0.00 72.50 72.02 2dbl s THR 107 CO 0.00 0.09 0.41 -0.89 -0.69 0.00 0.00 174.62 173.54 2dbl s THR 108 N 2.05 5.21 -0.14 -0.82 2.01 -1.26 -0.22 115.64 122.47 2dbl s THR 108 Ca -0.03 0.77 -0.04 0.00 0.31 0.00 0.00 61.69 62.70 2dbl s THR 108 Cb -0.11 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.62 2dbl s THR 108 CO -0.09 0.30 0.00 -0.69 -0.69 0.00 0.00 174.62 173.45 2dbl s VAL 109 N 0.93 4.27 -0.15 3.82 1.01 0.93 -1.90 120.40 129.30 2dbl s VAL 109 Ca 0.21 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.97 2dbl s VAL 109 Cb -0.14 -2.87 0.02 0.00 0.00 0.00 0.00 36.38 33.39 2dbl s VAL 109 CO 0.08 0.52 -0.17 -0.89 0.00 0.00 0.00 175.10 174.63 2dbl s THR 110 N 0.01 1.78 -0.15 3.92 2.01 -0.85 -1.71 115.64 120.65 2dbl s THR 110 Ca 0.03 -0.77 -0.01 0.00 0.31 0.00 0.00 61.69 61.24 2dbl s THR 110 Cb -0.13 -1.63 -0.01 0.00 0.01 0.00 0.00 72.50 70.74 2dbl s THR 110 CO 0.02 0.49 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.64 2dbl s VAL 111 N 1.29 3.14 -0.23 3.82 1.01 -1.26 -1.37 120.40 126.81 2dbl s VAL 111 Ca 0.02 -0.62 -0.27 0.00 0.00 0.00 0.00 61.98 61.12 2dbl s VAL 111 Cb -0.13 -2.34 0.11 0.00 0.00 0.00 0.00 36.38 34.02 2dbl s VAL 111 CO -0.10 0.51 0.95 -0.55 0.00 0.00 0.00 175.10 175.91 2dbl s SER 112 N 0.55 -0.49 -0.12 3.32 0.15 -0.55 -4.89 113.70 111.67 2dbl s SER 112 Ca -0.07 0.82 0.13 0.00 0.70 0.00 0.00 55.95 57.52 2dbl s SER 112 Cb -0.15 0.78 0.58 0.00 -1.71 0.00 0.00 66.02 65.52 2dbl s SER 112 CO 0.03 -0.26 1.44 -1.54 1.20 0.00 0.00 173.24 174.11 2dbl n SER 113 N 1.78 4.08 -4.80 5.45 3.41 -1.26 -4.22 113.62 118.07 2dbl n SER 113 Ca -0.13 -2.48 -0.37 0.00 -0.26 0.00 0.00 58.87 55.64 2dbl n SER 113 Cb 0.56 -0.56 -0.06 0.00 -0.26 0.00 0.00 64.21 63.90 2dbl n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dbl s ALA 114 N -1.98 3.33 0.10 7.33 0.00 -1.26 -5.07 121.76 124.21 2dbl s ALA 114 Ca 0.40 0.33 0.02 0.00 0.00 0.00 0.00 51.96 52.72 2dbl s ALA 114 Cb 0.28 -2.99 -0.04 0.00 0.00 0.00 0.00 23.12 20.37 2dbl s ALA 114 CO 0.16 0.26 0.18 0.21 0.00 0.00 0.00 175.76 176.58 2dbl s LYS 115 N -1.92 3.21 0.04 0.00 2.36 -1.26 -5.03 119.74 117.15 2dbl s LYS 115 Ca 0.45 -0.60 -0.38 0.00 -2.55 0.00 0.00 55.97 52.88 2dbl s LYS 115 Cb -0.18 -2.88 -0.19 0.00 -1.05 0.00 0.00 37.83 33.53 2dbl s LYS 115 CO 0.23 0.56 1.18 2.41 1.55 0.00 0.00 175.35 181.28 2dbl n THR 116 N 0.06 0.03 -3.85 3.43 -1.04 -1.26 -4.77 114.28 106.88 2dbl n THR 116 Ca -0.07 -0.01 -0.12 0.00 -2.04 0.00 0.00 64.05 61.82 2dbl n THR 116 Cb 0.52 -0.35 -0.12 0.00 -1.82 0.00 0.00 70.33 68.56 2dbl n THR 116 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2dbl s THR 117 N 0.19 0.03 0.41 12.58 2.01 0.07 -4.97 115.64 125.96 2dbl s THR 117 Ca 0.88 -0.21 -0.14 0.00 0.31 0.00 0.00 61.69 62.53 2dbl s THR 117 Cb -1.13 -0.23 -0.08 0.00 0.01 0.00 0.00 72.50 71.07 2dbl s THR 117 CO 0.53 -0.12 0.83 -2.84 -0.69 0.00 0.00 174.62 172.33 2dbl s PRO 118 N -0.35 3.92 0.76 4.92 0.02 -1.26 -2.90 135.00 140.12 2dbl s PRO 118 Ca -0.04 0.70 -0.08 0.00 0.02 0.00 0.00 61.00 61.60 2dbl s PRO 118 Cb -0.03 -2.32 0.10 0.00 0.02 0.00 0.00 34.50 32.27 2dbl s PRO 118 CO 0.00 -0.05 1.08 -1.25 -0.33 0.00 0.00 177.00 176.46 2dbl s PRO 119 N -3.62 1.80 -0.33 5.54 0.04 -1.26 -4.52 135.00 132.64 2dbl s PRO 119 Ca 0.55 -0.40 -0.03 0.00 0.04 0.00 0.00 61.00 61.16 2dbl s PRO 119 Cb -0.10 -2.12 0.06 0.00 0.04 0.00 0.00 34.50 32.38 2dbl s PRO 119 CO 0.26 -1.52 0.06 -1.12 0.04 0.00 0.00 177.00 174.72 2dbl s SER 120 N -4.63 5.04 -0.83 6.66 0.01 -0.27 -4.94 113.70 114.74 2dbl s SER 120 Ca 0.64 -1.41 -0.24 0.00 1.31 0.00 0.00 55.95 56.25 2dbl s SER 120 Cb -0.09 -1.76 0.06 0.00 0.21 0.00 0.00 66.02 64.44 2dbl s SER 120 CO 0.46 -0.33 1.24 -0.69 0.41 0.00 0.00 173.24 174.34 2dbl s VAL 121 N 1.25 4.05 0.17 3.43 1.01 -1.26 -2.41 120.40 126.64 2dbl s VAL 121 Ca -0.02 -0.38 -0.10 0.00 0.00 0.00 0.00 61.98 61.48 2dbl s VAL 121 Cb -0.20 -4.89 -0.07 0.00 0.00 0.00 0.00 36.38 31.22 2dbl s VAL 121 CO -0.01 -1.75 0.50 -0.31 0.00 0.00 0.00 175.10 173.53 2dbl s TYR 122 N 4.74 3.51 0.26 5.22 2.02 -0.34 -4.87 117.35 127.88 2dbl s TYR 122 Ca 0.35 0.87 -0.01 0.00 -0.37 0.00 0.00 57.07 57.91 2dbl s TYR 122 Cb -0.07 -2.24 -0.04 0.00 -0.40 0.00 0.00 41.96 39.21 2dbl s TYR 122 CO 0.03 0.38 0.46 -1.25 -1.57 0.00 0.00 175.55 173.60 2dbl s PRO 123 N -2.41 3.52 -0.31 -1.71 0.04 -1.26 -0.67 135.00 132.21 2dbl s PRO 123 Ca 0.42 -0.32 -0.02 0.00 0.04 0.00 0.00 61.00 61.12 2dbl s PRO 123 Cb -0.13 -2.76 0.10 0.00 0.04 0.00 0.00 34.50 31.75 2dbl s PRO 123 CO 0.20 0.30 0.11 -0.51 0.04 0.00 0.00 177.00 177.15 2dbl s LEU 124 N -3.69 1.65 0.02 -3.56 1.43 0.58 -4.85 118.68 110.27 2dbl s LEU 124 Ca 0.39 -1.56 -0.01 0.00 -1.03 0.00 0.00 54.13 51.93 2dbl s LEU 124 Cb -0.10 -0.69 -0.04 0.00 0.03 0.00 0.00 46.19 45.39 2dbl s LEU 124 CO 0.31 -0.42 0.14 0.00 0.23 0.00 0.00 176.35 176.61 2dbl s ALA 125 N 1.74 3.79 0.37 4.21 0.00 -1.26 -2.50 121.76 128.10 2dbl s ALA 125 Ca 0.10 -0.85 0.28 0.00 0.00 0.00 0.00 51.96 51.50 2dbl s ALA 125 Cb -0.17 -1.71 1.22 0.00 0.00 0.00 0.00 23.12 22.46 2dbl s ALA 125 CO -0.28 0.74 1.24 -0.35 0.00 0.00 0.00 175.76 177.11 2dbl n PRO 126 N 0.83 -0.02 -2.01 0.00 -0.04 -1.26 -4.83 135.00 127.66 2dbl n PRO 126 Ca -0.10 0.97 -0.09 0.00 -0.04 0.00 0.00 63.50 64.24 2dbl n PRO 126 Cb 0.52 -1.96 -0.01 0.00 -0.04 0.00 0.00 33.50 32.01 2dbl n PRO 126 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dbl n GLY 127 N -1.47 0.18 2.08 0.55 0.00 -1.26 -4.27 105.19 101.00 2dbl n GLY 127 Ca 0.33 -0.53 -0.07 0.00 0.00 0.00 0.00 46.02 45.74 2dbl n GLY 127 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dbl n SER 128 N 0.34 -2.21 -4.92 1.61 7.64 -1.26 -5.08 113.62 109.73 2dbl n SER 128 Ca -0.10 -0.27 -0.26 0.00 1.01 0.00 0.00 58.87 59.24 2dbl n SER 128 Cb 0.53 -2.52 0.01 0.00 -1.01 0.00 0.00 64.21 61.22 2dbl n SER 128 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dbl s ALA 129 N -3.16 3.46 0.83 -0.43 0.00 -1.26 -5.11 121.76 116.10 2dbl s ALA 129 Ca 0.02 -0.66 -0.07 0.00 0.00 0.00 0.00 51.96 51.24 2dbl s ALA 129 Cb -0.00 -2.47 0.16 0.00 0.00 0.00 0.00 23.12 20.81 2dbl s ALA 129 CO 0.32 -0.40 1.14 0.00 0.00 0.00 0.00 175.76 176.82 2dbl s ALA 130 N -2.71 3.07 0.10 0.00 0.00 -1.26 -5.00 121.76 115.97 2dbl s ALA 130 Ca 0.48 -1.54 -0.31 0.00 0.00 0.00 0.00 51.96 50.59 2dbl s ALA 130 Cb -0.10 -2.32 -0.09 0.00 0.00 0.00 0.00 23.12 20.60 2dbl s ALA 130 CO 0.43 -1.91 1.70 1.14 0.00 0.00 0.00 175.76 177.12 2dbl s GLN 133 N -5.48 4.18 0.03 0.00 1.03 -1.26 -4.83 119.66 113.33 2dbl s GLN 133 Ca 0.70 2.43 -0.27 0.00 0.04 0.00 0.00 55.36 58.26 2dbl s GLN 133 Cb -0.04 -3.53 -0.17 0.00 0.03 0.00 0.00 33.01 29.30 2dbl s GLN 133 CO 0.48 -0.76 1.38 1.15 -2.54 0.00 0.00 175.29 175.00 2dbl h THR 134 N 4.65 0.58 -1.43 3.63 2.02 -1.95 -3.40 112.91 117.00 2dbl h THR 134 Ca -0.44 -0.36 -0.16 0.00 0.77 0.00 0.00 66.41 66.22 2dbl h THR 134 Cb 1.21 0.74 -0.25 0.00 -1.74 0.00 0.00 68.15 68.11 2dbl h THR 134 CO 0.94 0.06 -0.53 0.54 0.37 0.00 0.00 175.52 176.90 2dbl s ASN 135 N -4.86 -0.35 -0.92 4.18 4.22 -1.26 -4.95 114.94 111.00 2dbl s ASN 135 Ca -0.15 -0.77 -0.06 0.00 -2.14 0.00 0.00 52.86 49.74 2dbl s ASN 135 Cb 0.03 1.39 0.05 0.00 1.28 0.00 0.00 41.25 44.00 2dbl s ASN 135 CO 0.57 -0.26 0.24 -1.54 -2.04 0.00 0.00 177.10 174.07 2dbl n SER 136 N 4.74 -2.76 -3.99 3.54 3.41 -1.26 -4.96 113.62 112.33 2dbl n SER 136 Ca 0.08 -0.08 -0.12 0.00 -0.26 0.00 0.00 58.87 58.48 2dbl n SER 136 Cb 0.51 -2.37 -0.12 0.00 -0.26 0.00 0.00 64.21 61.97 2dbl n SER 136 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 2dbl s MET 137 N -5.61 0.37 0.12 4.33 0.00 -1.26 -2.43 119.30 114.81 2dbl s MET 137 Ca 0.23 -0.48 0.07 0.00 0.00 0.00 0.00 55.69 55.52 2dbl s MET 137 Cb -0.13 -0.17 -0.04 0.00 0.00 0.00 0.00 34.83 34.49 2dbl s MET 137 CO 0.29 0.03 -0.17 0.14 0.00 0.00 0.00 175.02 175.31 2dbl s VAL 138 N -0.91 1.52 -0.08 10.11 -7.23 0.13 -3.76 120.40 120.18 2dbl s VAL 138 Ca -0.07 -1.64 0.00 0.00 -1.81 0.00 0.00 61.98 58.46 2dbl s VAL 138 Cb -0.07 -1.53 0.02 0.00 0.56 0.00 0.00 36.38 35.36 2dbl s VAL 138 CO -0.00 -0.25 -0.06 -0.89 -0.31 0.00 0.00 175.10 173.59 2dbl s THR 139 N -1.68 0.78 0.54 5.32 2.01 -1.26 -0.32 115.64 121.03 2dbl s THR 139 Ca 0.08 -0.18 0.02 0.00 0.31 0.00 0.00 61.69 61.92 2dbl s THR 139 Cb -0.07 -0.81 0.02 0.00 0.01 0.00 0.00 72.50 71.64 2dbl s THR 139 CO 0.04 0.31 0.18 0.18 -0.69 0.00 0.00 174.62 174.64 2dbl n LEU 140 N 4.61 0.00 -3.62 4.42 7.99 -0.03 -4.68 117.00 125.69 2dbl n LEU 140 Ca -0.16 -3.12 -0.04 0.00 -0.01 0.00 0.00 56.01 52.68 2dbl n LEU 140 Cb 0.50 0.19 -0.04 0.00 -0.11 0.00 0.00 43.42 43.96 2dbl n LEU 140 CO 0.18 -0.52 1.04 -0.83 -1.51 0.00 0.00 177.39 175.75 2dbl s GLY 141 N -4.05 -0.05 0.14 -0.72 0.00 -1.04 -2.02 107.32 99.58 2dbl s GLY 141 Ca 0.14 2.49 0.06 0.00 0.00 0.00 0.00 44.72 47.40 2dbl s GLY 141 CO 0.09 1.02 0.04 0.00 0.00 0.00 0.00 173.10 174.25 2dbl s LEU 143 N -2.72 3.29 -0.55 0.00 0.20 0.16 -2.08 118.68 116.98 2dbl s LEU 143 Ca 0.28 -1.66 -0.23 0.00 0.69 0.00 0.00 54.13 53.21 2dbl s LEU 143 Cb -0.11 -1.27 0.05 0.00 -0.43 0.00 0.00 46.19 44.44 2dbl s LEU 143 CO 0.20 -0.33 0.86 -0.69 -0.29 0.00 0.00 176.35 176.10 2dbl s VAL 144 N 1.27 4.51 0.03 1.68 1.01 0.44 -1.20 120.40 128.14 2dbl s VAL 144 Ca 0.04 0.02 0.08 0.00 0.00 0.00 0.00 61.98 62.12 2dbl s VAL 144 Cb -0.19 -4.49 -0.02 0.00 0.00 0.00 0.00 36.38 31.68 2dbl s VAL 144 CO -0.12 -1.06 -0.23 -0.75 0.00 0.00 0.00 175.10 172.94 2dbl s LYS 145 N 3.61 1.63 0.00 2.72 2.20 -1.01 -0.14 119.74 128.76 2dbl s LYS 145 Ca 0.26 -0.98 0.00 0.00 -0.36 0.00 0.00 55.97 54.89 2dbl s LYS 145 Cb -0.15 -1.74 0.00 0.00 -1.51 0.00 0.00 37.83 34.43 2dbl s LYS 145 CO 0.16 0.45 0.00 0.41 -0.36 0.00 0.00 175.35 176.02 2dbl n GLY 146 N 1.95 0.62 3.97 5.54 0.00 0.18 -1.11 105.19 116.34 2dbl n GLY 146 Ca -0.17 -0.41 -0.21 0.00 0.00 0.00 0.00 46.02 45.23 2dbl n GLY 146 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dbl s TYR 147 N -2.00 2.89 -0.29 1.61 1.13 -0.09 -4.58 117.35 116.02 2dbl s TYR 147 Ca 0.00 -0.02 -0.16 0.00 -1.41 0.00 0.00 57.07 55.48 2dbl s TYR 147 Cb 0.00 -2.68 0.15 0.00 -1.10 0.00 0.00 41.96 38.33 2dbl s TYR 147 CO 0.00 -0.79 0.97 0.12 -2.51 0.00 0.00 175.55 173.35 2dbl s PHE 148 N -2.71 -0.58 0.26 -3.49 2.19 -1.14 0.23 117.98 112.74 2dbl s PHE 148 Ca 0.56 1.16 0.01 0.00 0.33 0.00 0.00 56.93 58.98 2dbl s PHE 148 Cb -0.10 0.35 0.05 0.00 -1.31 0.00 0.00 43.02 42.00 2dbl s PHE 148 CO 0.38 -0.29 0.35 -2.30 1.83 0.00 0.00 175.22 175.19 2dbl n PRO 149 N 3.76 0.44 -2.38 10.12 -0.02 -1.26 -0.75 135.00 144.90 2dbl n PRO 149 Ca -0.18 -1.02 -0.33 0.00 -2.02 0.00 0.00 63.50 59.95 2dbl n PRO 149 Cb 0.57 -0.22 -0.03 0.00 -0.02 0.00 0.00 33.50 33.81 2dbl n PRO 149 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2dbl s GLU 150 N -3.30 3.81 0.54 -0.52 0.41 -1.26 -4.75 118.70 113.63 2dbl s GLU 150 Ca 0.24 1.09 0.04 0.00 -0.41 0.00 0.00 54.97 55.93 2dbl s GLU 150 Cb -0.01 -2.11 0.03 0.00 -1.78 0.00 0.00 34.13 30.26 2dbl s GLU 150 CO 0.16 -0.40 0.30 -1.25 -0.49 0.00 0.00 175.26 173.58 2dbl s PRO 151 N -3.85 2.24 0.10 0.39 0.04 -1.26 -4.95 135.00 127.70 2dbl s PRO 151 Ca 0.62 -2.15 0.07 0.00 0.04 0.00 0.00 61.00 59.57 2dbl s PRO 151 Cb -0.12 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 2dbl s PRO 151 CO 0.29 -0.58 -0.17 0.08 0.04 0.00 0.00 177.00 176.66 2dbl s VAL 152 N -2.82 1.41 -0.07 -0.36 1.01 -1.26 -4.41 120.40 113.91 2dbl s VAL 152 Ca 0.25 -1.52 0.05 0.00 0.00 0.00 0.00 61.98 60.75 2dbl s VAL 152 Cb -0.01 -1.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.96 2dbl s VAL 152 CO 0.16 -0.22 -0.22 -0.89 0.00 0.00 0.00 175.10 173.92 2dbl s THR 153 N -1.49 2.27 -0.12 3.92 2.01 -0.11 -4.97 115.64 117.16 2dbl s THR 153 Ca 0.05 -0.98 0.01 0.00 0.31 0.00 0.00 61.69 61.08 2dbl s THR 153 Cb -0.09 -1.85 0.02 0.00 0.01 0.00 0.00 72.50 70.59 2dbl s THR 153 CO 0.03 0.57 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.70 2dbl s VAL 154 N -0.10 1.43 0.09 3.82 1.01 -1.26 -1.33 120.40 124.06 2dbl s VAL 154 Ca -0.05 -0.58 0.07 0.00 0.00 0.00 0.00 61.98 61.42 2dbl s VAL 154 Cb -0.14 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 2dbl s VAL 154 CO 0.04 0.43 -0.18 0.42 0.00 0.00 0.00 175.10 175.82 2dbl s THR 156 N 1.19 1.43 -0.14 3.92 -4.23 -0.62 -4.94 115.64 112.26 2dbl s THR 156 Ca -0.03 -1.43 -0.06 0.00 -1.18 0.00 0.00 61.69 58.99 2dbl s THR 156 Cb -0.14 -1.33 -0.04 0.00 1.34 0.00 0.00 72.50 72.33 2dbl s THR 156 CO -0.04 -0.14 0.06 0.26 -0.54 0.00 0.00 174.62 174.22 2dbl s TRP 157 N -1.22 3.31 -1.61 3.99 0.52 -1.26 0.67 118.94 123.35 2dbl s TRP 157 Ca 0.02 0.23 -0.16 0.00 0.02 0.00 0.00 56.10 56.21 2dbl s TRP 157 Cb -0.10 -1.95 0.12 0.00 -1.15 0.00 0.00 33.47 30.38 2dbl s TRP 157 CO 0.03 0.40 0.91 0.09 0.02 0.00 0.00 176.95 178.40 2dbl n ASN 162 N 2.71 -4.21 -3.97 2.95 5.03 0.80 -1.76 115.26 116.82 2dbl n ASN 162 Ca -0.18 -0.87 -0.31 0.00 0.87 0.00 0.00 54.58 54.09 2dbl n ASN 162 Cb 0.53 -3.42 0.01 0.00 -1.02 0.00 0.00 39.78 35.89 2dbl n ASN 162 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 2dbl n SER 163 N -2.76 -4.12 0.00 6.41 7.64 -1.26 -2.38 113.62 117.14 2dbl n SER 163 Ca 0.06 -0.84 0.00 0.00 1.01 0.00 0.00 58.87 59.10 2dbl n SER 163 Cb 0.51 -3.63 0.00 0.00 -1.01 0.00 0.00 64.21 60.08 2dbl n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dbl n GLY 164 N -1.64 2.38 0.37 0.23 0.00 -0.72 -4.93 105.19 100.88 2dbl n GLY 164 Ca 0.02 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.16 2dbl n GLY 164 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dbl h SER 165 N 0.50 0.66 -3.39 1.61 0.02 -1.47 -3.37 113.55 108.12 2dbl h SER 165 Ca 0.00 0.05 -0.73 0.00 -0.84 0.00 0.00 61.79 60.27 2dbl h SER 165 Cb 0.00 -0.08 -0.23 0.00 0.14 0.00 0.00 62.40 62.23 2dbl h SER 165 CO 0.00 0.31 -0.38 -0.76 -1.14 0.00 0.00 176.83 174.86 2dbl s LEU 166 N -9.86 5.38 -0.08 5.07 1.43 -1.08 -4.90 118.68 114.64 2dbl s LEU 166 Ca -0.10 -1.24 -0.08 0.00 -1.03 0.00 0.00 54.13 51.68 2dbl s LEU 166 Cb 0.23 -2.14 -0.03 0.00 0.03 0.00 0.00 46.19 44.28 2dbl s LEU 166 CO 0.79 -0.57 -0.16 -1.20 0.23 0.00 0.00 176.35 175.44 2dbl n SER 167 N 5.14 0.91 -4.75 2.29 7.64 -1.26 -4.31 113.62 119.27 2dbl n SER 167 Ca -0.12 0.16 -0.41 0.00 1.01 0.00 0.00 58.87 59.51 2dbl n SER 167 Cb 0.44 -0.61 0.00 0.00 -1.01 0.00 0.00 64.21 63.03 2dbl n SER 167 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dbl n SER 168 N -3.41 3.46 0.00 6.43 7.64 -1.26 -1.81 113.62 124.67 2dbl n SER 168 Ca -0.06 1.21 0.00 0.00 1.01 0.00 0.00 58.87 61.02 2dbl n SER 168 Cb 0.24 -1.58 0.00 0.00 -1.01 0.00 0.00 64.21 61.86 2dbl n SER 168 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dbl n GLY 169 N 0.55 2.36 3.70 0.23 0.00 -1.26 -4.54 105.19 106.23 2dbl n GLY 169 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2dbl n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dbl s VAL 171 N -2.26 4.87 -0.41 1.61 1.01 -0.75 -3.31 120.40 121.15 2dbl s VAL 171 Ca 0.00 1.96 0.01 0.00 0.00 0.00 0.00 61.98 63.95 2dbl s VAL 171 Cb 0.00 -4.27 0.14 0.00 0.00 0.00 0.00 36.38 32.24 2dbl s VAL 171 CO 0.00 0.12 0.23 -1.00 0.00 0.00 0.00 175.10 174.44 2dbl s HIS 172 N 1.35 1.52 -0.30 5.22 3.76 -0.38 -4.95 115.29 121.51 2dbl s HIS 172 Ca 0.48 -2.13 -0.27 0.00 -0.15 0.00 0.00 55.06 53.00 2dbl s HIS 172 Cb -0.20 -1.53 0.01 0.00 1.11 0.00 0.00 32.58 31.98 2dbl s HIS 172 CO 0.23 -0.80 0.97 0.99 -0.85 0.00 0.00 174.74 175.28 2dbl s THR 173 N 0.62 4.64 0.25 1.30 2.01 -1.26 -3.19 115.64 120.01 2dbl s THR 173 Ca 0.18 1.60 -0.25 0.00 0.31 0.00 0.00 61.69 63.53 2dbl s THR 173 Cb -0.24 -4.30 -0.09 0.00 0.01 0.00 0.00 72.50 67.88 2dbl s THR 173 CO 0.01 -0.34 0.85 -0.36 -0.69 0.00 0.00 174.62 174.08 2dbl s PHE 174 N 3.32 3.78 0.24 4.92 0.08 0.63 -4.99 117.98 125.96 2dbl s PHE 174 Ca 0.41 1.67 -0.31 0.00 0.12 0.00 0.00 56.93 58.81 2dbl s PHE 174 Cb -0.13 -2.82 -0.12 0.00 -0.57 0.00 0.00 43.02 39.38 2dbl s PHE 174 CO 0.13 0.35 1.63 -2.30 -0.10 0.00 0.00 175.22 174.93 2dbl n PRO 175 N 0.99 2.61 -1.66 0.24 -0.02 -1.26 -4.07 135.00 131.83 2dbl n PRO 175 Ca -0.02 0.94 -0.45 0.00 -2.02 0.00 0.00 63.50 61.95 2dbl n PRO 175 Cb 0.50 -2.73 -0.03 0.00 -0.02 0.00 0.00 33.50 31.22 2dbl n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2dbl n ALA 176 N 3.02 0.82 -2.44 3.55 0.00 -1.26 -4.87 120.51 119.33 2dbl n ALA 176 Ca 0.13 0.41 -0.21 0.00 0.00 0.00 0.00 53.44 53.77 2dbl n ALA 176 Cb 0.35 -2.23 -0.10 0.00 0.00 0.00 0.00 19.45 17.46 2dbl n ALA 176 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2dbl s VAL 177 N -0.23 1.42 -0.02 0.00 1.01 -0.72 -4.94 120.40 116.92 2dbl s VAL 177 Ca 0.67 -2.05 0.02 0.00 0.00 0.00 0.00 61.98 60.62 2dbl s VAL 177 Cb -0.67 -2.63 -0.03 0.00 0.00 0.00 0.00 36.38 33.05 2dbl s VAL 177 CO 0.52 -0.16 -0.07 -0.22 0.00 0.00 0.00 175.10 175.17 2dbl s LEU 178 N -3.47 3.16 -0.20 3.92 0.20 -1.26 -1.21 118.68 119.82 2dbl s LEU 178 Ca 0.33 -0.10 -0.04 0.00 0.69 0.00 0.00 54.13 55.01 2dbl s LEU 178 Cb 0.07 -1.77 0.08 0.00 -0.43 0.00 0.00 46.19 44.14 2dbl s LEU 178 CO 0.14 0.31 0.15 -1.10 -0.29 0.00 0.00 176.35 175.56 2dbl s GLN 179 N -1.18 0.13 -1.07 1.98 -0.21 0.10 -4.94 119.66 114.47 2dbl s GLN 179 Ca 0.15 -0.02 -0.18 0.00 0.02 0.00 0.00 55.36 55.33 2dbl s GLN 179 Cb -0.11 -1.48 -0.00 0.00 1.00 0.00 0.00 33.01 32.42 2dbl s GLN 179 CO 0.05 -0.71 0.75 0.43 -2.12 0.00 0.00 175.29 173.69 2dbl n SER 180 N 5.29 -5.37 0.00 5.90 7.64 -1.26 -1.16 113.62 124.66 2dbl n SER 180 Ca -0.06 -0.96 0.00 0.00 1.01 0.00 0.00 58.87 58.86 2dbl n SER 180 Cb 0.48 -3.13 0.00 0.00 -1.01 0.00 0.00 64.21 60.55 2dbl n SER 180 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2dbl n ASP 183 N -2.52 0.00 -4.90 6.43 8.00 -1.26 -4.96 116.55 117.33 2dbl n ASP 183 Ca -0.11 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.15 2dbl n ASP 183 Cb 0.59 -0.12 -0.03 0.00 -0.02 0.00 0.00 41.12 41.54 2dbl n ASP 183 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2dbl s LEU 184 N 0.00 4.15 0.07 0.64 1.43 -0.31 -4.86 118.68 119.80 2dbl s LEU 184 Ca 0.00 0.02 -0.13 0.00 -1.03 0.00 0.00 54.13 52.99 2dbl s LEU 184 Cb 0.00 -2.71 -0.06 0.00 0.03 0.00 0.00 46.19 43.45 2dbl s LEU 184 CO 0.00 0.01 0.46 -0.31 0.23 0.00 0.00 176.35 176.73 2dbl s TYR 185 N -1.87 3.65 -0.04 0.29 2.02 0.14 -0.72 117.35 120.82 2dbl s TYR 185 Ca 0.33 0.96 0.00 0.00 -0.37 0.00 0.00 57.07 58.00 2dbl s TYR 185 Cb -0.10 -2.28 0.02 0.00 -0.40 0.00 0.00 41.96 39.21 2dbl s TYR 185 CO 0.27 0.54 -0.02 0.99 -1.57 0.00 0.00 175.55 175.76 2dbl s THR 186 N -1.30 0.36 0.02 -0.71 2.01 -0.35 0.48 115.64 116.15 2dbl s THR 186 Ca 0.31 0.01 -0.14 0.00 0.31 0.00 0.00 61.69 62.19 2dbl s THR 186 Cb -0.15 -0.44 0.02 0.00 0.01 0.00 0.00 72.50 71.93 2dbl s THR 186 CO 0.17 0.20 0.29 -0.22 -0.69 0.00 0.00 174.62 174.37 2dbl s LEU 187 N 1.16 0.94 0.09 4.42 0.20 0.81 -1.75 118.68 124.55 2dbl s LEU 187 Ca -0.07 -0.09 0.00 0.00 0.69 0.00 0.00 54.13 54.66 2dbl s LEU 187 Cb -0.14 1.25 -0.04 0.00 -0.43 0.00 0.00 46.19 46.83 2dbl s LEU 187 CO -0.02 -0.53 -0.03 -0.94 -0.29 0.00 0.00 176.35 174.54 2dbl s SER 188 N -1.73 0.80 0.02 3.68 1.04 -1.26 -0.42 113.70 115.83 2dbl s SER 188 Ca -0.09 -1.04 -0.03 0.00 0.48 0.00 0.00 55.95 55.28 2dbl s SER 188 Cb -0.03 0.16 -0.01 0.00 0.10 0.00 0.00 66.02 66.23 2dbl s SER 188 CO 0.00 -0.55 0.03 -0.55 0.98 0.00 0.00 173.24 173.15 2dbl s SER 189 N -3.00 0.19 0.01 7.02 0.15 -0.88 -0.27 113.70 116.91 2dbl s SER 189 Ca 0.12 -0.46 0.01 0.00 0.70 0.00 0.00 55.95 56.32 2dbl s SER 189 Cb 0.07 0.15 -0.01 0.00 -1.71 0.00 0.00 66.02 64.52 2dbl s SER 189 CO -0.06 -0.37 -0.03 -0.94 1.20 0.00 0.00 173.24 173.04 2dbl s SER 190 N -1.64 0.37 0.05 5.45 1.04 -1.19 -1.86 113.70 115.91 2dbl s SER 190 Ca -0.12 -0.16 0.06 0.00 0.48 0.00 0.00 55.95 56.21 2dbl s SER 190 Cb -0.07 -0.01 -0.03 0.00 0.10 0.00 0.00 66.02 66.01 2dbl s SER 190 CO -0.01 -0.03 -0.17 0.54 0.98 0.00 0.00 173.24 174.54 2dbl s VAL 191 N -0.37 1.38 -0.07 5.02 0.11 -0.85 -1.25 120.40 124.37 2dbl s VAL 191 Ca -0.02 -1.19 0.03 0.00 -2.93 0.00 0.00 61.98 57.87 2dbl s VAL 191 Cb -0.03 -1.24 0.01 0.00 -1.53 0.00 0.00 36.38 33.58 2dbl s VAL 191 CO -0.00 0.03 -0.16 -0.89 -3.33 0.00 0.00 175.10 170.75 2dbl s THR 192 N -0.94 1.41 0.19 5.04 2.01 -1.21 -0.85 115.64 121.28 2dbl s THR 192 Ca 0.04 -0.65 0.02 0.00 0.31 0.00 0.00 61.69 61.40 2dbl s THR 192 Cb -0.09 -1.25 -0.05 0.00 0.01 0.00 0.00 72.50 71.13 2dbl s THR 192 CO 0.02 0.41 0.02 0.68 -0.69 0.00 0.00 174.62 175.06 2dbl s VAL 193 N 0.45 0.64 0.58 3.82 -7.23 0.57 -4.66 120.40 114.56 2dbl s VAL 193 Ca -0.13 -1.98 -0.18 0.00 -1.81 0.00 0.00 61.98 57.87 2dbl s VAL 193 Cb -0.15 -2.21 -0.04 0.00 0.56 0.00 0.00 36.38 34.54 2dbl s VAL 193 CO 0.05 -0.39 1.15 -2.16 -0.31 0.00 0.00 175.10 173.43 2dbl s PRO 194 N -3.94 3.14 0.59 4.82 0.04 -1.26 0.18 135.00 138.57 2dbl s PRO 194 Ca 0.26 1.63 0.29 0.00 0.04 0.00 0.00 61.00 63.23 2dbl s PRO 194 Cb 0.06 -1.97 1.68 0.00 0.04 0.00 0.00 34.50 34.31 2dbl s PRO 194 CO 0.06 -1.02 2.10 0.77 0.04 0.00 0.00 177.00 178.94 2dbl h SER 195 N 0.89 0.00 0.08 6.66 0.02 -1.78 -2.80 113.55 116.62 2dbl h SER 195 Ca -0.50 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.45 2dbl h SER 195 Cb 1.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.81 2dbl h SER 195 CO 0.56 0.00 -0.04 -1.28 -1.14 0.00 0.00 176.83 174.93 2dbl h SER 196 N 0.00 -0.09 0.08 3.07 0.87 -1.91 -3.29 113.55 112.27 2dbl h SER 196 Ca 0.08 -0.15 0.01 0.00 -1.23 0.00 0.00 61.79 60.50 2dbl h SER 196 Cb 0.50 0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.44 2dbl h SER 196 CO -0.00 0.10 -0.43 -0.65 -0.53 0.00 0.00 176.83 175.32 2dbl h PRO 199 N -0.28 -0.57 -5.58 2.24 0.11 -1.85 -3.32 132.00 122.74 2dbl h PRO 199 Ca -0.01 0.04 -0.59 0.00 0.11 0.00 0.00 66.00 65.55 2dbl h PRO 199 Cb 0.24 0.13 -0.09 0.00 0.11 0.00 0.00 31.00 31.39 2dbl h PRO 199 CO 0.02 -0.38 -0.28 0.50 -0.21 0.00 0.00 178.00 177.65 2dbl s ARG 200 N -5.22 4.24 -0.04 1.05 3.00 -1.24 0.23 118.95 120.97 2dbl s ARG 200 Ca -0.13 0.20 0.16 0.00 -1.00 0.00 0.00 55.73 54.95 2dbl s ARG 200 Cb 0.05 -3.41 0.52 0.00 0.00 0.00 0.00 34.95 32.11 2dbl s ARG 200 CO 0.49 0.25 1.42 -2.30 0.00 0.00 0.00 175.30 175.16 2dbl n PRO 202 N 3.48 2.64 -0.33 5.12 -0.02 -1.26 -4.85 135.00 139.78 2dbl n PRO 202 Ca -0.11 -2.10 0.15 0.00 -2.02 0.00 0.00 63.50 59.43 2dbl n PRO 202 Cb 0.52 -1.57 0.35 0.00 -0.02 0.00 0.00 33.50 32.78 2dbl n PRO 202 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2dbl h SER 203 N 3.23 0.59 -4.25 2.55 0.02 -1.14 -3.41 113.55 111.14 2dbl h SER 203 Ca 0.00 0.13 -0.47 0.00 -0.84 0.00 0.00 61.79 60.62 2dbl h SER 203 Cb 0.93 0.05 -0.21 0.00 0.14 0.00 0.00 62.40 63.31 2dbl h SER 203 CO 0.08 0.10 -0.79 -1.61 -1.14 0.00 0.00 176.83 173.47 2dbl s GLU 204 N -5.83 0.98 0.02 3.45 8.01 0.62 -5.08 118.70 120.86 2dbl s GLU 204 Ca -0.11 -1.10 -0.29 0.00 0.01 0.00 0.00 54.97 53.47 2dbl s GLU 204 Cb 0.26 -1.05 -0.04 0.00 -4.31 0.00 0.00 34.13 29.00 2dbl s GLU 204 CO 0.79 0.23 0.95 0.95 0.01 0.00 0.00 175.26 178.20 2dbl s THR 205 N -1.45 4.82 -0.04 3.63 -4.23 -1.26 -4.08 115.64 113.02 2dbl s THR 205 Ca 0.04 2.01 0.05 0.00 -1.18 0.00 0.00 61.69 62.61 2dbl s THR 205 Cb -0.09 -4.30 -0.02 0.00 1.34 0.00 0.00 72.50 69.43 2dbl s THR 205 CO 0.03 0.20 -0.20 0.54 -0.54 0.00 0.00 174.62 174.65 2dbl s VAL 206 N 0.80 2.58 0.01 2.29 0.11 -1.26 -4.99 120.40 119.94 2dbl s VAL 206 Ca 0.50 -0.90 -0.09 0.00 -2.93 0.00 0.00 61.98 58.56 2dbl s VAL 206 Cb -0.21 -1.97 0.00 0.00 -1.53 0.00 0.00 36.38 32.67 2dbl s VAL 206 CO 0.28 0.58 0.17 -0.89 -3.33 0.00 0.00 175.10 171.91 2dbl s THR 207 N -0.56 0.09 -0.07 5.04 2.01 -1.26 -2.16 115.64 118.72 2dbl s THR 207 Ca 0.08 -0.74 0.04 0.00 0.31 0.00 0.00 61.69 61.39 2dbl s THR 207 Cb -0.11 -0.59 -0.02 0.00 0.01 0.00 0.00 72.50 71.80 2dbl s THR 207 CO 0.01 -0.40 -0.20 0.00 -0.69 0.00 0.00 174.62 173.33 2dbl s ASN 209 N -0.24 5.43 -0.33 0.00 -0.87 0.21 -2.88 114.94 116.27 2dbl s ASN 209 Ca -0.00 -1.24 -0.09 0.00 -1.57 0.00 0.00 52.86 49.96 2dbl s ASN 209 Cb -0.13 -1.91 0.01 0.00 -0.02 0.00 0.00 41.25 39.20 2dbl s ASN 209 CO 0.03 -0.39 0.16 -0.69 -2.57 0.00 0.00 177.10 173.64 2dbl s VAL 210 N 1.42 4.44 -0.07 1.60 1.01 0.37 -1.59 120.40 127.58 2dbl s VAL 210 Ca 0.00 -0.65 0.04 0.00 0.00 0.00 0.00 61.98 61.38 2dbl s VAL 210 Cb -0.20 -3.35 -0.02 0.00 0.00 0.00 0.00 36.38 32.81 2dbl s VAL 210 CO 0.03 -0.04 -0.19 0.00 0.00 0.00 0.00 175.10 174.90 2dbl s ALA 211 N 1.56 2.45 -0.44 5.51 0.00 -0.45 0.15 121.76 130.54 2dbl s ALA 211 Ca 0.03 -0.99 0.03 0.00 0.00 0.00 0.00 51.96 51.02 2dbl s ALA 211 Cb -0.18 -0.89 0.13 0.00 0.00 0.00 0.00 23.12 22.18 2dbl s ALA 211 CO 0.06 0.45 0.22 -1.58 0.00 0.00 0.00 175.76 174.90 2dbl s HIS 212 N -0.31 2.44 0.29 0.00 2.46 0.63 -0.94 115.29 119.86 2dbl s HIS 212 Ca 0.02 -2.63 -0.02 0.00 0.47 0.00 0.00 55.06 52.90 2dbl s HIS 212 Cb -0.13 -2.23 0.43 0.00 -0.13 0.00 0.00 32.58 30.53 2dbl s HIS 212 CO 0.02 -0.79 1.95 -1.35 -2.47 0.00 0.00 174.74 172.10 2dbl h PRO 213 N 6.85 1.11 -1.22 2.88 0.11 -1.80 -1.20 132.00 138.72 2dbl h PRO 213 Ca -0.04 -0.07 0.35 0.00 0.11 0.00 0.00 66.00 66.35 2dbl h PRO 213 Cb 0.93 -0.25 -0.09 0.00 0.11 0.00 0.00 31.00 31.70 2dbl h PRO 213 CO 0.54 0.74 0.81 0.00 -0.21 0.00 0.00 178.00 179.88 2dbl h ALA 214 N 1.47 2.69 0.00 -0.75 0.00 -1.90 -1.73 119.26 119.04 2dbl h ALA 214 Ca 0.33 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2dbl h ALA 214 Cb -0.07 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2dbl h ALA 214 CO -0.08 -1.16 -0.03 -1.13 0.00 0.00 0.00 179.25 176.85 2dbl n SER 215 N -4.50 2.00 -3.74 0.00 3.41 -0.89 -4.98 113.62 104.92 2dbl n SER 215 Ca 0.30 -2.53 -0.30 0.00 -0.26 0.00 0.00 58.87 56.09 2dbl n SER 215 Cb 1.20 -0.23 0.03 0.00 -0.26 0.00 0.00 64.21 64.95 2dbl n SER 215 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2dbl n SER 216 N -0.94 -4.02 -3.94 4.04 7.64 -0.51 -4.99 113.62 110.90 2dbl n SER 216 Ca 0.08 -1.01 -0.21 0.00 1.01 0.00 0.00 58.87 58.75 2dbl n SER 216 Cb 0.49 -3.34 -0.16 0.00 -1.01 0.00 0.00 64.21 60.19 2dbl n SER 216 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2dbl s THR 217 N -3.58 0.71 -0.07 0.44 2.01 -1.04 -5.02 115.64 109.08 2dbl s THR 217 Ca 0.35 -0.24 0.04 0.00 0.31 0.00 0.00 61.69 62.15 2dbl s THR 217 Cb -0.13 -0.69 0.00 0.00 0.01 0.00 0.00 72.50 71.70 2dbl s THR 217 CO 0.86 0.26 -0.19 -0.54 -0.69 0.00 0.00 174.62 174.32 2dbl s LYS 218 N 0.73 2.36 -0.03 4.92 1.02 -1.26 -0.27 119.74 127.22 2dbl s LYS 218 Ca -0.11 -0.69 0.04 0.00 0.02 0.00 0.00 55.97 55.23 2dbl s LYS 218 Cb -0.14 -1.88 -0.01 0.00 -0.52 0.00 0.00 37.83 35.28 2dbl s LYS 218 CO 0.01 0.17 -0.15 0.08 -0.92 0.00 0.00 175.35 174.53 2dbl s VAL 219 N 0.33 1.24 -0.25 3.17 1.01 0.12 -4.97 120.40 121.06 2dbl s VAL 219 Ca -0.13 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.22 2dbl s VAL 219 Cb -0.16 -1.06 0.06 0.00 0.00 0.00 0.00 36.38 35.23 2dbl s VAL 219 CO 0.06 0.36 -0.09 -1.81 0.00 0.00 0.00 175.10 173.62 2dbl s ASP 220 N -0.13 4.21 -0.26 3.32 1.01 -1.26 -0.48 116.67 123.07 2dbl s ASP 220 Ca 0.01 -1.31 -0.06 0.00 0.71 0.00 0.00 52.55 51.90 2dbl s ASP 220 Cb -0.08 -1.40 -0.00 0.00 1.01 0.00 0.00 42.92 42.45 2dbl s ASP 220 CO 0.01 -0.21 0.03 -0.54 0.21 0.00 0.00 175.17 174.67 2dbl s LYS 221 N 1.22 3.26 -0.14 8.23 -0.14 -1.14 -4.98 119.74 126.05 2dbl s LYS 221 Ca -0.08 -0.73 -0.25 0.00 -1.36 0.00 0.00 55.97 53.56 2dbl s LYS 221 Cb -0.20 -3.22 -0.02 0.00 -1.68 0.00 0.00 37.83 32.71 2dbl s LYS 221 CO -0.05 -0.32 0.79 0.21 -0.76 0.00 0.00 175.35 175.22 2dbl s LYS 222 N 1.50 4.33 -0.35 1.68 2.20 -1.26 -3.04 119.74 124.80 2dbl s LYS 222 Ca 0.04 0.97 -0.29 0.00 -0.36 0.00 0.00 55.97 56.33 2dbl s LYS 222 Cb -0.16 -3.54 0.00 0.00 -1.51 0.00 0.00 37.83 32.62 2dbl s LYS 222 CO 0.00 -0.23 1.37 0.42 -0.36 0.00 0.00 175.35 176.55 2dbl s ILE 223 N 1.79 4.01 -0.04 5.43 -1.09 -0.92 -4.98 121.20 125.40 2dbl s ILE 223 Ca 0.38 1.08 -0.00 0.00 -2.23 0.00 0.00 60.65 59.88 2dbl s ILE 223 Cb -0.17 -4.17 -0.03 0.00 -1.58 0.00 0.00 42.46 36.51 2dbl s ILE 223 CO 0.14 -0.62 0.01 -0.69 -1.23 0.00 0.00 174.94 172.55 2dbl s VAL 226 N 4.92 4.26 0.79 2.92 1.01 -1.26 -4.68 120.40 128.36 2dbl s VAL 226 Ca 0.59 -0.42 -0.14 0.00 0.00 0.00 0.00 61.98 62.02 2dbl s VAL 226 Cb -0.15 -2.85 0.07 0.00 0.00 0.00 0.00 36.38 33.45 2dbl s VAL 226 CO 0.28 0.49 1.20 -2.16 0.00 0.00 0.00 175.10 174.91 2dbl s PRO 227 N -1.24 1.78 0.00 2.72 0.04 -1.26 -4.81 135.00 132.23 2dbl s PRO 227 Ca 0.17 1.74 0.00 0.00 0.04 0.00 0.00 61.00 62.95 2dbl s PRO 227 Cb -0.11 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2dbl s PRO 227 CO 0.07 -2.10 0.00 -2.13 0.04 0.00 0.00 177.00 172.87