#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lrs s GLU 2 N 0.00 4.55 0.06 -1.09 2.02 -1.26 -4.03 118.70 118.95 3lrs s GLU 2 Ca 0.00 1.16 -0.12 0.00 0.02 0.00 0.00 54.97 56.02 3lrs s GLU 2 Cb 0.00 -3.35 0.01 0.00 0.10 0.00 0.00 34.13 30.89 3lrs s GLU 2 CO 0.00 0.32 0.27 -1.14 0.02 0.00 0.00 175.26 174.73 3lrs s GLN 3 N -0.22 0.83 -0.10 1.61 0.74 -0.19 -4.99 119.66 117.34 3lrs s GLN 3 Ca 0.40 -0.65 -0.09 0.00 0.05 0.00 0.00 55.36 55.07 3lrs s GLN 3 Cb -0.21 0.35 0.03 0.00 1.10 0.00 0.00 33.01 34.28 3lrs s GLN 3 CO 0.25 -0.27 0.27 -0.51 -0.55 0.00 0.00 175.29 174.48 3lrs s LEU 4 N -2.33 0.92 -0.04 3.68 1.43 -1.26 -2.51 118.68 118.57 3lrs s LEU 4 Ca -0.02 0.55 -0.02 0.00 -1.03 0.00 0.00 54.13 53.62 3lrs s LEU 4 Cb 0.01 0.93 0.03 0.00 0.03 0.00 0.00 46.19 47.20 3lrs s LEU 4 CO -0.06 -0.10 0.09 0.54 0.23 0.00 0.00 176.35 177.05 3lrs s VAL 5 N 0.21 -0.08 0.02 -1.59 0.11 -0.91 -4.26 120.40 113.90 3lrs s VAL 5 Ca -0.01 0.24 -0.01 0.00 -2.93 0.00 0.00 61.98 59.28 3lrs s VAL 5 Cb -0.02 -0.16 -0.04 0.00 -1.53 0.00 0.00 36.38 34.62 3lrs s VAL 5 CO -0.00 0.10 0.14 -1.61 -3.33 0.00 0.00 175.10 170.39 3lrs s GLU 6 N 1.33 3.23 0.40 1.54 8.01 -1.26 -0.99 118.70 130.95 3lrs s GLU 6 Ca -0.07 -0.45 0.05 0.00 0.01 0.00 0.00 54.97 54.51 3lrs s GLU 6 Cb -0.12 -2.95 -0.02 0.00 -4.31 0.00 0.00 34.13 26.72 3lrs s GLU 6 CO -0.04 0.64 0.18 -1.12 0.01 0.00 0.00 175.26 174.92 3lrs s SER 7 N -2.03 2.56 0.00 -0.19 0.01 -0.32 -4.74 113.70 108.99 3lrs s SER 7 Ca 0.27 -1.73 0.00 0.00 1.31 0.00 0.00 55.95 55.80 3lrs s SER 7 Cb -0.12 0.57 0.00 0.00 0.21 0.00 0.00 66.02 66.68 3lrs s SER 7 CO 0.19 -1.00 0.00 0.61 0.41 0.00 0.00 173.24 173.45 3lrs n GLY 8 N -0.86 1.72 3.49 3.44 0.00 -1.26 -2.11 105.19 109.60 3lrs n GLY 8 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 3lrs n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3lrs s GLY 9 N -2.41 1.52 0.00 -0.02 0.00 -1.26 -4.85 107.32 100.30 3lrs s GLY 9 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 44.72 44.26 3lrs s GLY 9 CO 0.00 0.34 0.00 0.61 0.00 0.00 0.00 173.10 174.05 3lrs n GLY 10 N 0.37 1.23 3.75 0.20 0.00 -0.36 -4.99 105.19 105.40 3lrs n GLY 10 Ca 0.07 -2.00 -0.41 0.00 0.00 0.00 0.00 46.02 43.68 3lrs n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3lrs s VAL 11 N -1.11 3.62 0.03 1.61 1.01 -1.26 -2.21 120.40 122.10 3lrs s VAL 11 Ca 0.00 1.48 -0.14 0.00 0.00 0.00 0.00 61.98 63.31 3lrs s VAL 11 Cb 0.00 -3.94 0.02 0.00 0.00 0.00 0.00 36.38 32.46 3lrs s VAL 11 CO 0.00 0.29 0.32 0.68 0.00 0.00 0.00 175.10 176.38 3lrs s VAL 12 N -0.56 0.08 0.34 2.92 -7.23 -0.12 -4.95 120.40 110.88 3lrs s VAL 12 Ca 0.48 -0.63 -0.11 0.00 -1.81 0.00 0.00 61.98 59.91 3lrs s VAL 12 Cb -0.31 -0.89 -0.07 0.00 0.56 0.00 0.00 36.38 35.67 3lrs s VAL 12 CO 0.38 -0.34 0.71 -1.10 -0.31 0.00 0.00 175.10 174.43 3lrs s GLN 13 N -2.34 3.84 0.42 4.82 -0.21 -1.26 -2.28 119.66 122.65 3lrs s GLN 13 Ca -0.06 0.47 -0.26 0.00 0.02 0.00 0.00 55.36 55.52 3lrs s GLN 13 Cb -0.02 -2.46 -0.09 0.00 1.00 0.00 0.00 33.01 31.44 3lrs s GLN 13 CO -0.02 0.10 1.44 -2.14 -2.12 0.00 0.00 175.29 172.56 3lrs s PRO 14 N -3.38 3.87 0.00 2.91 0.02 -1.26 -1.50 135.00 135.66 3lrs s PRO 14 Ca 0.51 2.47 0.00 0.00 0.02 0.00 0.00 61.00 64.00 3lrs s PRO 14 Cb -0.10 -2.79 0.00 0.00 0.02 0.00 0.00 34.50 31.63 3lrs s PRO 14 CO 0.25 -0.69 0.00 0.41 -0.33 0.00 0.00 177.00 176.64 3lrs n GLY 15 N 0.54 2.78 3.76 0.52 0.00 0.53 -4.87 105.19 108.43 3lrs n GLY 15 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 3lrs n GLY 15 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3lrs s GLY 16 N -1.18 2.78 0.01 -0.02 0.00 -0.56 -3.07 107.32 105.27 3lrs s GLY 16 Ca 0.00 1.06 -0.13 0.00 0.00 0.00 0.00 44.72 45.65 3lrs s GLY 16 CO 0.00 1.49 0.39 -0.45 0.00 0.00 0.00 173.10 174.53 3lrs s SER 17 N -1.42 6.74 -0.01 1.64 0.15 -1.26 -3.12 113.70 116.43 3lrs s SER 17 Ca 0.74 0.89 0.00 0.00 0.70 0.00 0.00 55.95 58.28 3lrs s SER 17 Cb -0.32 -2.22 0.01 0.00 -1.71 0.00 0.00 66.02 61.78 3lrs s SER 17 CO 0.36 0.30 0.01 -0.22 1.20 0.00 0.00 173.24 174.89 3lrs s LEU 18 N -1.26 1.65 -0.20 3.45 2.96 -1.26 -4.97 118.68 119.05 3lrs s LEU 18 Ca 0.25 0.01 0.01 0.00 -0.22 0.00 0.00 54.13 54.18 3lrs s LEU 18 Cb -0.16 -0.04 0.04 0.00 0.50 0.00 0.00 46.19 46.53 3lrs s LEU 18 CO 0.14 -0.05 -0.14 -0.60 -1.32 0.00 0.00 176.35 174.38 3lrs s ARG 19 N 0.40 2.42 0.20 1.98 3.52 -1.26 0.16 118.95 126.38 3lrs s ARG 19 Ca -0.03 -0.88 -0.03 0.00 -0.13 0.00 0.00 55.73 54.65 3lrs s ARG 19 Cb -0.05 -2.50 -0.05 0.00 -1.56 0.00 0.00 34.95 30.79 3lrs s ARG 19 CO -0.01 -0.35 0.42 -0.51 -0.81 0.00 0.00 175.30 174.04 3lrs s LEU 20 N 1.32 4.20 0.10 -0.88 1.43 -0.18 -4.67 118.68 120.01 3lrs s LEU 20 Ca 0.00 0.54 0.05 0.00 -1.03 0.00 0.00 54.13 53.70 3lrs s LEU 20 Cb -0.15 -3.31 -0.03 0.00 0.03 0.00 0.00 46.19 42.72 3lrs s LEU 20 CO -0.10 -0.04 -0.14 -0.44 0.23 0.00 0.00 176.35 175.86 3lrs s SER 21 N -2.89 1.80 -0.16 2.29 0.01 -0.90 -1.56 113.70 112.29 3lrs s SER 21 Ca 0.41 -0.74 -0.03 0.00 1.31 0.00 0.00 55.95 56.89 3lrs s SER 21 Cb -0.11 -0.05 0.05 0.00 0.21 0.00 0.00 66.02 66.12 3lrs s SER 21 CO 0.27 -0.14 0.05 0.00 0.41 0.00 0.00 173.24 173.84 3lrs s LEU 23 N 2.00 4.16 -0.12 0.00 2.96 -0.16 -1.28 118.68 126.22 3lrs s LEU 23 Ca 0.01 0.87 -0.04 0.00 -0.22 0.00 0.00 54.13 54.76 3lrs s LEU 23 Cb -0.16 -2.92 -0.04 0.00 0.50 0.00 0.00 46.19 43.58 3lrs s LEU 23 CO -0.08 -0.27 0.03 0.00 -1.32 0.00 0.00 176.35 174.71 3lrs s ALA 24 N 1.85 3.36 0.08 5.97 0.00 -0.66 -2.14 121.76 130.22 3lrs s ALA 24 Ca 0.30 -0.77 -0.07 0.00 0.00 0.00 0.00 51.96 51.42 3lrs s ALA 24 Cb -0.16 -1.66 -0.01 0.00 0.00 0.00 0.00 23.12 21.29 3lrs s ALA 24 CO 0.11 0.45 0.13 -1.54 0.00 0.00 0.00 175.76 174.90 3lrs s SER 25 N -0.44 0.22 0.00 0.00 1.04 -1.04 -4.89 113.70 108.59 3lrs s SER 25 Ca 0.09 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 55.78 3lrs s SER 25 Cb -0.12 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.30 3lrs s SER 25 CO 0.02 -0.69 0.00 0.61 0.98 0.00 0.00 173.24 174.16 3lrs n GLY 26 N 0.01 0.72 3.75 7.32 0.00 -1.26 -1.02 105.19 114.72 3lrs n GLY 26 Ca -0.15 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.79 3lrs n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3lrs s PHE 27 N -2.75 0.10 -0.99 1.61 -0.71 -1.26 -4.19 117.98 109.78 3lrs s PHE 27 Ca 0.00 -0.55 -0.23 0.00 -1.04 0.00 0.00 56.93 55.11 3lrs s PHE 27 Cb 0.00 0.53 0.03 0.00 -1.21 0.00 0.00 43.02 42.37 3lrs s PHE 27 CO 0.00 -1.21 1.56 0.99 -1.34 0.00 0.00 175.22 175.21 3lrs s THR 28 N -3.64 3.81 0.27 -4.49 2.01 -1.26 -4.85 115.64 107.48 3lrs s THR 28 Ca 0.16 -0.65 -0.00 0.00 0.31 0.00 0.00 61.69 61.51 3lrs s THR 28 Cb -0.04 -4.82 0.26 0.00 0.01 0.00 0.00 72.50 67.91 3lrs s THR 28 CO 0.09 -1.71 1.72 0.15 -0.69 0.00 0.00 174.62 174.17 3lrs h PHE 29 N 10.16 0.59 0.00 4.92 3.57 -1.95 -1.56 116.94 132.67 3lrs h PHE 29 Ca 0.17 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.70 3lrs h PHE 29 Cb 1.01 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.62 3lrs h PHE 29 CO 1.26 0.02 0.00 -2.39 -2.23 0.00 0.00 178.31 174.98 3lrs n HIS 30 N -5.01 0.00 0.49 0.41 1.44 -1.26 -2.85 115.22 108.44 3lrs n HIS 30 Ca 0.18 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 56.00 3lrs n HIS 30 Cb 0.53 -0.05 -0.02 0.00 0.12 0.00 0.00 29.99 30.56 3lrs n HIS 30 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 3lrs n LYS 31 N -1.05 0.34 -4.44 -1.40 5.02 -0.59 -4.40 118.16 111.64 3lrs n LYS 31 Ca 0.17 -0.02 -0.31 0.00 -2.02 0.00 0.00 58.31 56.13 3lrs n LYS 31 Cb 0.10 -1.59 -0.11 0.00 -0.02 0.00 0.00 35.03 33.41 3lrs n LYS 31 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3lrs s TYR 32 N -3.24 2.73 0.64 2.13 2.02 -1.13 -4.83 117.35 115.67 3lrs s TYR 32 Ca 0.02 -0.15 -0.16 0.00 -0.37 0.00 0.00 57.07 56.41 3lrs s TYR 32 Cb 0.14 -1.50 -0.01 0.00 -0.40 0.00 0.00 41.96 40.19 3lrs s TYR 32 CO 0.82 0.35 1.11 0.20 -1.57 0.00 0.00 175.55 176.46 3lrs s GLY 33 N -1.71 2.21 -0.02 0.71 0.00 -1.26 -3.98 107.32 103.26 3lrs s GLY 33 Ca 0.18 0.57 0.04 0.00 0.00 0.00 0.00 44.72 45.50 3lrs s GLY 33 CO 0.09 0.92 -0.13 1.06 0.00 0.00 0.00 173.10 175.03 3lrs s MET 34 N -4.00 1.26 0.27 2.90 1.00 -0.75 -1.13 119.30 118.85 3lrs s MET 34 Ca 0.67 -0.47 0.07 0.00 0.00 0.00 0.00 55.69 55.96 3lrs s MET 34 Cb -0.21 -1.16 -0.03 0.00 0.00 0.00 0.00 34.83 33.43 3lrs s MET 34 CO 0.39 0.22 0.22 -1.01 0.00 0.00 0.00 175.02 174.85 3lrs s HIS 35 N -0.06 3.09 -0.05 -0.03 3.76 0.38 -1.71 115.29 120.67 3lrs s HIS 35 Ca 0.00 -0.14 0.04 0.00 -0.15 0.00 0.00 55.06 54.81 3lrs s HIS 35 Cb -0.08 -1.48 -0.02 0.00 1.11 0.00 0.00 32.58 32.11 3lrs s HIS 35 CO 0.01 0.46 -0.18 -1.58 -0.85 0.00 0.00 174.74 172.59 3lrs s TRP 36 N -2.16 2.60 -0.02 1.40 0.52 -0.16 -1.63 118.94 119.50 3lrs s TRP 36 Ca 0.34 -0.36 0.01 0.00 0.02 0.00 0.00 56.10 56.11 3lrs s TRP 36 Cb -0.08 -1.63 0.02 0.00 -1.15 0.00 0.00 33.47 30.64 3lrs s TRP 36 CO 0.25 0.03 -0.01 0.08 0.02 0.00 0.00 176.95 177.33 3lrs s VAL 37 N -0.49 0.17 0.44 4.03 1.01 -0.24 -0.90 120.40 124.42 3lrs s VAL 37 Ca 0.06 0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.15 3lrs s VAL 37 Cb -0.12 -0.23 -0.02 0.00 0.00 0.00 0.00 36.38 36.01 3lrs s VAL 37 CO 0.01 0.12 0.32 0.00 0.00 0.00 0.00 175.10 175.54 3lrs s ARG 38 N 0.71 2.37 -0.32 2.72 1.70 0.29 -0.17 118.95 126.26 3lrs s ARG 38 Ca -0.07 -1.74 0.06 0.00 -0.47 0.00 0.00 55.73 53.51 3lrs s ARG 38 Cb -0.10 -2.18 0.19 0.00 -0.57 0.00 0.00 34.95 32.29 3lrs s ARG 38 CO -0.01 -0.25 0.59 -1.14 -1.08 0.00 0.00 175.30 173.40 3lrs s GLN 39 N -4.08 0.61 0.84 3.89 0.74 -0.26 -1.21 119.66 120.19 3lrs s GLN 39 Ca 0.43 0.36 -0.13 0.00 0.05 0.00 0.00 55.36 56.06 3lrs s GLN 39 Cb -0.01 0.19 0.05 0.00 1.10 0.00 0.00 33.01 34.35 3lrs s GLN 39 CO 0.25 -1.08 0.81 0.00 -0.55 0.00 0.00 175.29 174.72 3lrs n ALA 40 N 5.20 -1.19 -1.69 1.58 0.00 -1.26 -1.86 120.51 121.28 3lrs n ALA 40 Ca 0.06 -0.42 -0.43 0.00 0.00 0.00 0.00 53.44 52.66 3lrs n ALA 40 Cb 0.54 -2.02 -0.03 0.00 0.00 0.00 0.00 19.45 17.94 3lrs n ALA 40 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3lrs n PRO 41 N -2.35 2.77 -0.62 0.00 -0.02 -1.26 -1.73 135.00 131.78 3lrs n PRO 41 Ca 0.11 1.01 0.00 0.00 -2.02 0.00 0.00 63.50 62.59 3lrs n PRO 41 Cb 0.51 -2.89 0.00 0.00 -0.02 0.00 0.00 33.50 31.10 3lrs n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3lrs n GLY 42 N 4.19 0.84 0.00 -1.23 0.00 -1.26 -4.98 105.19 102.75 3lrs n GLY 42 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3lrs n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3lrs n LYS 43 N -2.00 1.92 -3.99 1.61 4.76 -0.70 -5.13 118.16 114.63 3lrs n LYS 43 Ca 0.00 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.22 3lrs n LYS 43 Cb 0.00 0.00 -0.05 0.00 -1.84 0.00 0.00 35.03 33.14 3lrs n LYS 43 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3lrs s GLY 44 N -1.49 1.70 0.55 0.72 0.00 -1.26 -4.77 107.32 102.77 3lrs s GLY 44 Ca 0.00 -1.62 -0.21 0.00 0.00 0.00 0.00 44.72 42.89 3lrs s GLY 44 CO 0.00 -1.59 1.28 1.08 0.00 0.00 0.00 173.10 173.87 3lrs s LEU 45 N -3.90 3.80 -0.04 0.66 1.43 -1.26 -4.49 118.68 114.89 3lrs s LEU 45 Ca 0.37 2.58 -0.01 0.00 -1.03 0.00 0.00 54.13 56.04 3lrs s LEU 45 Cb -0.06 -4.39 0.03 0.00 0.03 0.00 0.00 46.19 41.81 3lrs s LEU 45 CO 0.25 -1.52 0.07 -0.70 0.23 0.00 0.00 176.35 174.68 3lrs s GLU 46 N -3.02 -0.03 0.21 1.70 2.12 -0.35 -4.99 118.70 114.34 3lrs s GLU 46 Ca 0.73 0.31 -0.30 0.00 0.36 0.00 0.00 54.97 56.07 3lrs s GLU 46 Cb -0.36 -0.32 -0.09 0.00 0.26 0.00 0.00 34.13 33.62 3lrs s GLU 46 CO 0.41 -0.23 1.24 -0.46 -0.54 0.00 0.00 175.26 175.68 3lrs s TRP 47 N 1.54 3.34 -0.17 5.30 -0.00 -1.26 -0.54 118.94 127.14 3lrs s TRP 47 Ca -0.04 1.37 -0.05 0.00 -0.00 0.00 0.00 56.10 57.38 3lrs s TRP 47 Cb -0.12 -3.51 -0.09 0.00 -0.00 0.00 0.00 33.47 29.75 3lrs s TRP 47 CO -0.04 -1.47 -0.19 0.28 -0.00 0.00 0.00 176.95 175.53 3lrs n VAL 48 N 2.29 0.94 -3.61 5.86 0.31 -0.08 -4.67 118.33 119.37 3lrs n VAL 48 Ca 0.04 -0.29 -0.04 0.00 -0.01 0.00 0.00 64.34 64.05 3lrs n VAL 48 Cb 0.44 -1.47 -0.02 0.00 -0.91 0.00 0.00 33.84 31.87 3lrs n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3lrs s ALA 49 N -2.32 -2.11 0.02 3.52 0.00 -1.10 -1.28 121.76 118.50 3lrs s ALA 49 Ca -0.23 1.71 0.03 0.00 0.00 0.00 0.00 51.96 53.48 3lrs s ALA 49 Cb 0.08 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 3lrs s ALA 49 CO 0.33 -0.55 -0.11 -1.17 0.00 0.00 0.00 175.76 174.27 3lrs s LEU 50 N -2.02 2.13 -0.03 0.00 2.96 0.48 -0.99 118.68 121.23 3lrs s LEU 50 Ca 0.10 -0.37 -0.00 0.00 -0.22 0.00 0.00 54.13 53.64 3lrs s LEU 50 Cb -0.01 -0.45 0.03 0.00 0.50 0.00 0.00 46.19 46.26 3lrs s LEU 50 CO -0.04 0.01 0.02 -0.51 -1.32 0.00 0.00 176.35 174.51 3lrs s ILE 51 N -0.72 0.04 1.03 6.68 2.07 -0.69 -1.28 121.20 128.33 3lrs s ILE 51 Ca -0.00 0.21 -0.13 0.00 -1.41 0.00 0.00 60.65 59.31 3lrs s ILE 51 Cb -0.07 -0.18 0.14 0.00 0.13 0.00 0.00 42.46 42.48 3lrs s ILE 51 CO 0.01 0.13 0.66 -1.54 -1.91 0.00 0.00 174.94 172.29 3lrs n SER 52 N 4.42 -1.43 -0.27 4.50 3.41 0.37 -1.82 113.62 122.80 3lrs n SER 52 Ca -0.22 0.14 0.07 0.00 -0.26 0.00 0.00 58.87 58.60 3lrs n SER 52 Cb 0.50 -1.24 0.22 0.00 -0.26 0.00 0.00 64.21 63.43 3lrs n SER 52 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 3lrs h ASP 52 N -2.03 0.30 -0.34 4.04 3.04 -1.84 0.20 116.42 119.78 3lrs h ASP 52 Ca -0.50 0.12 0.00 0.00 -3.24 0.00 0.00 57.03 53.41 3lrs h ASP 52 Cb 1.31 0.10 0.00 0.00 -1.04 0.00 0.00 39.33 39.70 3lrs h ASP 52 CO 0.40 0.08 0.00 -0.90 -2.04 0.00 0.00 179.24 176.78 3lrs n ASP 53 N -5.01 2.36 -1.58 4.15 5.68 -1.26 -4.71 116.55 116.18 3lrs n ASP 53 Ca 0.17 -1.89 -0.19 0.00 -0.50 0.00 0.00 54.79 52.38 3lrs n ASP 53 Cb 0.48 -0.22 -0.07 0.00 -1.14 0.00 0.00 41.12 40.17 3lrs n ASP 53 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3lrs n GLY 54 N 1.25 1.37 0.02 6.12 0.00 0.06 -4.85 105.19 109.15 3lrs n GLY 54 Ca 0.16 -0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.18 3lrs n GLY 54 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3lrs n MET 55 N -2.53 0.22 -3.96 1.61 2.81 -1.26 -4.86 117.12 109.15 3lrs n MET 55 Ca -0.19 -0.01 -0.30 0.00 -1.81 0.00 0.00 57.70 55.39 3lrs n MET 55 Cb 0.63 -1.57 -0.16 0.00 -0.71 0.00 0.00 33.22 31.41 3lrs n MET 55 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 3lrs s ARG 56 N -3.15 1.87 0.09 0.03 3.52 -1.26 -5.01 118.95 115.02 3lrs s ARG 56 Ca 0.05 -0.69 0.10 0.00 -0.13 0.00 0.00 55.73 55.05 3lrs s ARG 56 Cb 0.15 -2.23 -0.03 0.00 -1.56 0.00 0.00 34.95 31.28 3lrs s ARG 56 CO 0.80 -0.40 -0.25 0.15 -0.81 0.00 0.00 175.30 174.79 3lrs s LYS 57 N 1.49 1.49 -0.05 5.12 1.02 -1.26 -0.48 119.74 127.07 3lrs s LYS 57 Ca 0.00 -1.19 -0.02 0.00 0.02 0.00 0.00 55.97 54.78 3lrs s LYS 57 Cb -0.15 -1.80 0.04 0.00 -0.52 0.00 0.00 37.83 35.39 3lrs s LYS 57 CO -0.08 0.44 0.10 0.71 -0.92 0.00 0.00 175.35 175.60 3lrs s TYR 58 N -0.95 -0.06 0.09 3.18 2.02 -0.40 -5.00 117.35 116.22 3lrs s TYR 58 Ca 0.11 0.38 0.10 0.00 -0.37 0.00 0.00 57.07 57.29 3lrs s TYR 58 Cb -0.10 -0.30 -0.03 0.00 -0.40 0.00 0.00 41.96 41.13 3lrs s TYR 58 CO 0.04 -0.19 -0.25 -1.01 -1.57 0.00 0.00 175.55 172.56 3lrs s HIS 59 N 1.82 2.35 0.25 2.71 3.76 -1.26 -0.38 115.29 124.54 3lrs s HIS 59 Ca -0.01 -0.37 -0.31 0.00 -0.15 0.00 0.00 55.06 54.22 3lrs s HIS 59 Cb -0.12 -1.33 -0.13 0.00 1.11 0.00 0.00 32.58 32.11 3lrs s HIS 59 CO -0.04 0.25 1.46 0.45 -0.85 0.00 0.00 174.74 176.01 3lrs n SER 60 N 1.29 3.06 0.25 1.40 2.88 -0.40 -4.88 113.62 117.22 3lrs n SER 60 Ca -0.17 1.14 0.14 0.00 -1.33 0.00 0.00 58.87 58.65 3lrs n SER 60 Cb 0.52 -1.47 0.59 0.00 -0.75 0.00 0.00 64.21 63.11 3lrs n SER 60 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 3lrs h ASP 61 N 4.43 0.00 -0.03 -3.46 3.32 -1.94 -2.86 116.42 115.88 3lrs h ASP 61 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 3lrs h ASP 61 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 3lrs h ASP 61 CO 0.77 0.09 0.00 -1.54 -1.72 0.00 0.00 179.24 176.84 3lrs n SER 62 N -3.23 0.45 -0.04 6.45 3.41 -1.26 -2.52 113.62 116.88 3lrs n SER 62 Ca 0.00 -1.35 0.11 0.00 -0.26 0.00 0.00 58.87 57.38 3lrs n SER 62 Cb 0.35 -0.02 0.12 0.00 -0.26 0.00 0.00 64.21 64.41 3lrs n SER 62 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3lrs n MET 63 N -0.55 0.11 -4.05 4.33 2.81 -1.08 -4.99 117.12 113.70 3lrs n MET 63 Ca 0.18 -0.08 -0.31 0.00 -1.81 0.00 0.00 57.70 55.69 3lrs n MET 63 Cb 0.16 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.15 3lrs n MET 63 CO 0.00 0.00 0.00 0.91 1.51 0.00 0.00 175.97 178.39 3lrs n TRP 64 N -1.38 -1.80 -1.01 2.03 8.01 -1.05 -2.04 117.44 120.21 3lrs n TRP 64 Ca 0.06 0.80 -0.00 0.00 -1.31 0.00 0.00 57.50 57.04 3lrs n TRP 64 Cb 0.34 -3.47 -0.00 0.00 -2.01 0.00 0.00 31.31 26.17 3lrs n TRP 64 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3lrs n GLY 65 N -1.69 0.45 0.09 6.99 0.00 -1.26 -4.92 105.19 104.86 3lrs n GLY 65 Ca -0.10 -0.11 -0.04 0.00 0.00 0.00 0.00 46.02 45.78 3lrs n GLY 65 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3lrs h ARG 66 N 0.75 0.00 -6.08 1.61 3.08 -1.79 -3.45 114.38 108.49 3lrs h ARG 66 Ca -0.01 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.47 3lrs h ARG 66 Cb 0.15 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.16 3lrs h ARG 66 CO 0.01 0.74 -0.51 0.14 -1.07 0.00 0.00 179.97 179.28 3lrs s VAL 67 N -2.80 5.03 -0.04 2.04 -7.23 -1.26 -4.42 120.40 111.73 3lrs s VAL 67 Ca 0.01 -0.75 -0.02 0.00 -1.81 0.00 0.00 61.98 59.41 3lrs s VAL 67 Cb 0.09 -3.55 0.03 0.00 0.56 0.00 0.00 36.38 33.51 3lrs s VAL 67 CO 0.80 -0.04 0.05 -0.89 -0.31 0.00 0.00 175.10 174.71 3lrs s THR 68 N -1.67 -0.06 0.11 5.32 2.01 0.35 -4.97 115.64 116.72 3lrs s THR 68 Ca 0.33 0.37 -0.08 0.00 0.31 0.00 0.00 61.69 62.62 3lrs s THR 68 Cb -0.11 -0.17 -0.06 0.00 0.01 0.00 0.00 72.50 72.17 3lrs s THR 68 CO 0.26 0.17 0.40 -0.51 -0.69 0.00 0.00 174.62 174.26 3lrs s ILE 69 N 1.99 5.11 0.32 1.82 2.07 -1.26 -0.79 121.20 130.45 3lrs s ILE 69 Ca 0.03 0.32 -0.16 0.00 -1.41 0.00 0.00 60.65 59.43 3lrs s ILE 69 Cb -0.12 -3.63 0.03 0.00 0.13 0.00 0.00 42.46 38.86 3lrs s ILE 69 CO -0.03 0.19 0.68 -0.94 -1.91 0.00 0.00 174.94 172.93 3lrs s SER 70 N -2.00 -0.03 -0.19 4.50 1.04 -1.04 -5.00 113.70 110.98 3lrs s SER 70 Ca 0.36 -0.93 -0.17 0.00 0.48 0.00 0.00 55.95 55.70 3lrs s SER 70 Cb -0.13 0.74 0.05 0.00 0.10 0.00 0.00 66.02 66.78 3lrs s SER 70 CO 0.20 -1.42 0.50 0.00 0.98 0.00 0.00 173.24 173.50 3lrs s ARG 71 N -3.32 0.58 -0.71 4.02 1.70 -1.26 -0.77 118.95 119.18 3lrs s ARG 71 Ca 0.16 0.73 -0.08 0.00 -0.47 0.00 0.00 55.73 56.07 3lrs s ARG 71 Cb -0.04 0.25 0.19 0.00 -0.57 0.00 0.00 34.95 34.77 3lrs s ARG 71 CO 0.10 -0.08 0.59 0.34 -1.08 0.00 0.00 175.30 175.16 3lrs s ASP 72 N 0.43 5.94 0.58 -2.89 -1.08 -0.18 -4.94 116.67 114.53 3lrs s ASP 72 Ca -0.01 -2.76 0.27 0.00 -0.52 0.00 0.00 52.55 49.53 3lrs s ASP 72 Cb -0.04 -2.02 1.65 0.00 -1.46 0.00 0.00 42.92 41.05 3lrs s ASP 72 CO -0.01 -0.47 2.15 0.78 0.52 0.00 0.00 175.17 178.13 3lrs h ASN 73 N 7.41 0.00 1.69 -0.34 2.35 -1.95 0.68 115.58 125.41 3lrs h ASN 73 Ca 0.03 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.78 3lrs h ASN 73 Cb 0.99 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.36 3lrs h ASN 73 CO 0.74 0.00 -0.01 0.77 -1.65 0.00 0.00 177.43 177.28 3lrs h SER 74 N 0.00 0.00 -0.24 5.81 4.64 -1.94 -2.89 113.55 118.93 3lrs h SER 74 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 3lrs h SER 74 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3lrs h SER 74 CO -0.00 0.01 0.00 0.29 -0.87 0.00 0.00 176.83 176.26 3lrs n LYS 75 N -3.10 1.98 -2.05 4.77 5.02 0.10 -4.97 118.16 119.91 3lrs n LYS 75 Ca 0.03 -1.87 -0.15 0.00 -2.02 0.00 0.00 58.31 54.30 3lrs n LYS 75 Cb 0.46 -1.36 -0.03 0.00 -0.02 0.00 0.00 35.03 34.08 3lrs n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3lrs n ASN 76 N 1.01 -4.32 -4.55 4.39 3.02 -0.44 -4.85 115.26 109.52 3lrs n ASN 76 Ca 0.13 0.22 -0.31 0.00 -0.03 0.00 0.00 54.58 54.59 3lrs n ASN 76 Cb 0.47 -3.76 -0.11 0.00 -0.61 0.00 0.00 39.78 35.77 3lrs n ASN 76 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3lrs s THR 77 N -2.57 3.31 0.01 3.41 2.01 -0.97 -1.65 115.64 119.20 3lrs s THR 77 Ca 0.00 -1.03 0.07 0.00 0.31 0.00 0.00 61.69 61.03 3lrs s THR 77 Cb 0.00 -2.46 -0.03 0.00 0.01 0.00 0.00 72.50 70.03 3lrs s THR 77 CO 0.00 0.30 -0.19 -0.22 -0.69 0.00 0.00 174.62 173.83 3lrs s LEU 78 N -1.63 2.55 0.19 4.42 2.96 -0.41 -1.01 118.68 125.75 3lrs s LEU 78 Ca 0.17 -0.39 0.09 0.00 -0.22 0.00 0.00 54.13 53.78 3lrs s LEU 78 Cb -0.11 -1.49 -0.04 0.00 0.50 0.00 0.00 46.19 45.04 3lrs s LEU 78 CO 0.08 0.28 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.92 3lrs s TYR 79 N -0.84 1.82 -0.17 5.38 2.02 0.05 -0.29 117.35 125.32 3lrs s TYR 79 Ca 0.13 -0.49 -0.04 0.00 -0.37 0.00 0.00 57.07 56.30 3lrs s TYR 79 Cb -0.10 -0.88 0.06 0.00 -0.40 0.00 0.00 41.96 40.64 3lrs s TYR 79 CO 0.03 0.37 0.07 -1.17 -1.57 0.00 0.00 175.55 173.29 3lrs s LEU 80 N -2.95 0.62 -0.26 -1.29 2.96 -0.60 -2.50 118.68 114.65 3lrs s LEU 80 Ca 0.19 -0.64 -0.15 0.00 -0.22 0.00 0.00 54.13 53.30 3lrs s LEU 80 Cb -0.04 -0.36 -0.04 0.00 0.50 0.00 0.00 46.19 46.26 3lrs s LEU 80 CO 0.07 -0.33 0.39 -1.58 -1.32 0.00 0.00 176.35 173.59 3lrs s GLN 81 N 2.04 4.05 0.00 1.98 2.00 0.03 -1.01 119.66 128.76 3lrs s GLN 81 Ca 0.01 0.10 0.00 0.00 -2.00 0.00 0.00 55.36 53.47 3lrs s GLN 81 Cb -0.16 -3.63 0.00 0.00 0.80 0.00 0.00 33.01 30.02 3lrs s GLN 81 CO -0.08 -0.24 0.00 1.19 -0.50 0.00 0.00 175.29 175.66 3lrs n PHE 82 N 5.18 0.00 -4.44 1.67 3.72 0.12 -0.50 117.46 123.22 3lrs n PHE 82 Ca -0.08 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.91 3lrs n PHE 82 Cb 0.51 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.97 3lrs n PHE 82 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3lrs n SER 82 N 0.00 -1.79 -4.65 4.37 7.64 -1.18 -4.23 113.62 113.79 3lrs n SER 82 Ca 0.00 -1.16 -0.52 0.00 1.01 0.00 0.00 58.87 58.20 3lrs n SER 82 Cb 0.00 -1.57 -0.06 0.00 -1.01 0.00 0.00 64.21 61.58 3lrs n SER 82 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3lrs n LEU 82 N -3.98 2.36 -4.78 -3.43 4.32 -1.18 -4.48 117.00 105.84 3lrs n LEU 82 Ca 0.11 1.08 -0.22 0.00 -0.02 0.00 0.00 56.01 56.96 3lrs n LEU 82 Cb 0.45 -1.25 -0.05 0.00 -1.62 0.00 0.00 43.42 40.95 3lrs n LEU 82 CO 0.92 -0.61 -0.16 -0.54 -1.22 0.00 0.00 177.39 175.79 3lrs s LYS 83 N 1.84 2.50 0.47 3.23 1.02 -1.26 -0.35 119.74 127.20 3lrs s LYS 83 Ca 0.88 -1.45 0.12 0.00 0.02 0.00 0.00 55.97 55.54 3lrs s LYS 83 Cb -0.90 -2.29 1.09 0.00 -0.52 0.00 0.00 37.83 35.21 3lrs s LYS 83 CO 0.51 0.11 2.10 0.28 -0.92 0.00 0.00 175.35 177.42 3lrs h VAL 84 N 1.44 1.03 0.00 3.17 2.07 -1.92 -1.72 116.25 120.31 3lrs h VAL 84 Ca -0.44 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 66.99 3lrs h VAL 84 Cb 1.25 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.77 3lrs h VAL 84 CO 0.61 0.05 0.00 -0.62 0.02 0.00 0.00 177.57 177.63 3lrs n GLU 85 N -4.50 0.73 0.05 1.57 1.02 -1.26 -2.65 120.64 115.59 3lrs n GLU 85 Ca 0.01 0.01 0.13 0.00 -0.02 0.00 0.00 57.16 57.28 3lrs n GLU 85 Cb 0.11 -1.50 0.34 0.00 -0.02 0.00 0.00 31.44 30.38 3lrs n GLU 85 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3lrs n ASP 86 N -1.10 0.54 -4.41 1.62 8.00 -0.65 -4.86 116.55 115.69 3lrs n ASP 86 Ca 0.19 0.23 -0.57 0.00 0.71 0.00 0.00 54.79 55.35 3lrs n ASP 86 Cb 0.14 -0.19 -0.10 0.00 -0.02 0.00 0.00 41.12 40.95 3lrs n ASP 86 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3lrs n THR 87 N -1.89 0.10 -3.66 -3.53 -1.04 -1.09 -4.87 114.28 98.31 3lrs n THR 87 Ca 0.05 -0.09 -0.05 0.00 -2.04 0.00 0.00 64.05 61.92 3lrs n THR 87 Cb 0.39 -0.96 -0.02 0.00 -1.82 0.00 0.00 70.33 67.92 3lrs n THR 87 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3lrs s ALA 88 N 5.92 -1.77 -0.01 2.41 0.00 -0.30 -4.29 121.76 123.72 3lrs s ALA 88 Ca 1.13 0.50 -0.26 0.00 0.00 0.00 0.00 51.96 53.33 3lrs s ALA 88 Cb -1.24 0.53 -0.04 0.00 0.00 0.00 0.00 23.12 22.37 3lrs s ALA 88 CO 0.62 -0.91 0.80 1.41 0.00 0.00 0.00 175.76 177.68 3lrs s MET 89 N -3.14 4.50 -0.16 0.00 -2.45 -0.78 -0.78 119.30 116.48 3lrs s MET 89 Ca 0.10 1.10 -0.03 0.00 -1.25 0.00 0.00 55.69 55.61 3lrs s MET 89 Cb -0.01 -3.42 -0.02 0.00 1.25 0.00 0.00 34.83 32.63 3lrs s MET 89 CO -0.02 0.11 -0.05 -0.06 1.05 0.00 0.00 175.02 176.05 3lrs s PHE 90 N 0.55 2.98 0.02 4.11 0.08 -0.40 -1.10 117.98 124.22 3lrs s PHE 90 Ca 0.42 -0.43 0.04 0.00 0.12 0.00 0.00 56.93 57.08 3lrs s PHE 90 Cb -0.20 -1.96 -0.03 0.00 -0.57 0.00 0.00 43.02 40.25 3lrs s PHE 90 CO 0.23 -0.13 -0.07 -0.06 -0.10 0.00 0.00 175.22 175.08 3lrs s PHE 91 N 0.53 2.86 -0.11 0.36 0.08 0.76 -1.75 117.98 120.71 3lrs s PHE 91 Ca -0.04 -0.06 -0.03 0.00 0.12 0.00 0.00 56.93 56.92 3lrs s PHE 91 Cb -0.15 -1.58 -0.03 0.00 -0.57 0.00 0.00 43.02 40.69 3lrs s PHE 91 CO 0.03 0.38 0.01 0.00 -0.10 0.00 0.00 175.22 175.53 3lrs s ALA 93 N -0.56 -0.74 0.25 0.00 0.00 -0.64 -2.29 121.76 117.78 3lrs s ALA 93 Ca 0.10 1.06 -0.30 0.00 0.00 0.00 0.00 51.96 52.82 3lrs s ALA 93 Cb -0.12 -0.65 -0.09 0.00 0.00 0.00 0.00 23.12 22.27 3lrs s ALA 93 CO 0.02 -0.19 1.05 0.50 0.00 0.00 0.00 175.76 177.14 3lrs s ARG 94 N 0.88 4.69 -0.42 0.00 3.52 0.76 -0.47 118.95 127.91 3lrs s ARG 94 Ca -0.06 1.69 -0.27 0.00 -0.13 0.00 0.00 55.73 56.96 3lrs s ARG 94 Cb -0.07 -3.23 0.02 0.00 -1.56 0.00 0.00 34.95 30.11 3lrs s ARG 94 CO -0.06 0.27 1.02 -2.00 -0.81 0.00 0.00 175.30 173.73 3lrs s GLU 95 N -1.15 3.76 0.30 5.12 2.56 -0.28 -1.92 118.70 127.09 3lrs s GLU 95 Ca 0.44 0.54 -0.27 0.00 0.00 0.00 0.00 54.97 55.69 3lrs s GLU 95 Cb -0.30 -3.86 -0.15 0.00 2.00 0.00 0.00 34.13 31.83 3lrs s GLU 95 CO 0.37 -1.16 0.75 0.00 -0.56 0.00 0.00 175.26 174.65 3lrs n ALA 96 N 7.27 -1.34 -3.33 6.30 0.00 -0.46 -4.32 120.51 124.62 3lrs n ALA 96 Ca 0.09 0.35 -0.00 0.00 0.00 0.00 0.00 53.44 53.88 3lrs n ALA 96 Cb 0.48 -1.83 0.01 0.00 0.00 0.00 0.00 19.45 18.11 3lrs n ALA 96 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3lrs n GLY 97 N 1.60 1.54 0.00 0.00 0.00 -1.26 -1.39 105.19 105.67 3lrs n GLY 97 Ca 0.13 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 45.04 3lrs n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3lrs n GLY 98 N -0.22 -1.01 0.96 -0.02 0.00 -1.12 -4.93 105.19 98.85 3lrs n GLY 98 Ca -0.03 -1.56 -0.09 0.00 0.00 0.00 0.00 46.02 44.34 3lrs n GLY 98 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3lrs n PRO 99 N -0.91 -2.24 -0.13 1.61 -0.02 -1.26 -0.91 135.00 131.14 3lrs n PRO 99 Ca 0.00 -0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.02 3lrs n PRO 99 Cb 0.00 -0.51 0.00 0.00 -0.02 0.00 0.00 33.50 32.97 3lrs n PRO 99 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3lrs n ILE 100 N -3.51 0.00 -0.02 4.25 5.41 -1.26 -4.64 119.36 119.60 3lrs n ILE 100 Ca 0.04 0.00 0.01 0.00 1.00 0.00 0.00 62.75 63.80 3lrs n ILE 100 Cb 0.17 -0.02 0.02 0.00 -0.71 0.00 0.00 39.64 39.10 3lrs n ILE 100 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 3lrs n ASN 100 N 0.09 0.01 -0.15 4.38 2.85 -1.26 -5.01 115.26 116.18 3lrs n ASN 100 Ca 0.00 0.08 -0.10 0.00 -0.11 0.00 0.00 54.58 54.45 3lrs n ASN 100 Cb 0.00 -0.03 -0.07 0.00 1.24 0.00 0.00 39.78 40.91 3lrs n ASN 100 CO 0.00 0.00 0.00 -2.24 -2.11 0.00 0.00 177.26 172.91 3lrs h ASP 100 N 0.00 -1.45 0.00 1.20 2.03 -2.05 -3.52 116.42 112.63 3lrs h ASP 100 Ca 0.04 0.20 0.00 0.00 -0.73 0.00 0.00 57.03 56.53 3lrs h ASP 100 Cb 0.09 0.60 0.00 0.00 -0.83 0.00 0.00 39.33 39.19 3lrs h ASP 100 CO -0.04 -0.27 0.00 0.61 -1.03 0.00 0.00 179.24 178.51 3lrs n GLY 100 N -1.26 -1.00 3.33 7.15 0.00 -1.26 -5.23 105.19 106.92 3lrs n GLY 100 Ca -0.02 -0.74 -0.13 0.00 0.00 0.00 0.00 46.02 45.13 3lrs n GLY 100 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3lrs s TYR 100 N -3.00 -0.48 0.45 1.61 2.02 -0.08 -4.65 117.35 113.21 3lrs s TYR 100 Ca 0.00 1.17 -0.24 0.00 -0.37 0.00 0.00 57.07 57.62 3lrs s TYR 100 Cb 0.00 0.17 -0.08 0.00 -0.40 0.00 0.00 41.96 41.65 3lrs s TYR 100 CO 0.00 -0.23 1.30 -0.80 -1.57 0.00 0.00 175.55 174.24 3lrs s ASN 100 N 0.28 6.04 0.00 2.29 0.01 -1.26 -2.79 114.94 119.51 3lrs s ASN 100 Ca -0.00 2.63 0.15 0.00 -0.71 0.00 0.00 52.86 54.92 3lrs s ASN 100 Cb -0.03 -2.63 -0.05 0.00 0.41 0.00 0.00 41.25 38.95 3lrs s ASN 100 CO 0.00 -1.03 0.75 -1.22 -1.51 0.00 0.00 177.10 174.09 3lrs n TYR 100 N -0.25 0.00 -1.67 2.20 4.01 -0.49 -4.95 117.16 116.01 3lrs n TYR 100 Ca 0.06 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.76 3lrs n TYR 100 Cb 0.45 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.47 3lrs n TYR 100 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 3lrs n HIS 100 N -0.51 -0.11 -4.16 -0.72 8.25 -1.26 -5.00 115.22 111.70 3lrs n HIS 100 Ca 0.05 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.40 3lrs n HIS 100 Cb 0.29 -1.38 -0.10 0.00 1.12 0.00 0.00 29.99 29.92 3lrs n HIS 100 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 3lrs s TYR 100 N -2.18 0.97 -0.34 4.41 -0.85 -1.26 -5.06 117.35 113.04 3lrs s TYR 100 Ca 0.00 -1.27 -0.08 0.00 -0.52 0.00 0.00 57.07 55.20 3lrs s TYR 100 Cb 0.00 -0.48 0.02 0.00 0.38 0.00 0.00 41.96 41.88 3lrs s TYR 100 CO 0.00 -0.60 0.14 -1.64 -1.52 0.00 0.00 175.55 171.93 3lrs s MET 100 N -4.10 2.89 0.03 -3.49 -1.94 -1.26 -1.36 119.30 110.08 3lrs s MET 100 Ca 0.31 -1.01 0.22 0.00 -1.71 0.00 0.00 55.69 53.50 3lrs s MET 100 Cb 0.07 -3.54 -0.24 0.00 2.01 0.00 0.00 34.83 33.13 3lrs s MET 100 CO 0.07 -0.59 0.63 -0.40 -0.01 0.00 0.00 175.02 174.72 3lrs n ASP 101 N 4.91 0.26 -4.06 3.03 5.75 -0.81 -4.88 116.55 120.75 3lrs n ASP 101 Ca -0.13 0.10 -0.26 0.00 -0.01 0.00 0.00 54.79 54.49 3lrs n ASP 101 Cb 0.46 1.49 -0.17 0.00 -1.03 0.00 0.00 41.12 41.87 3lrs n ASP 101 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3lrs s VAL 102 N -3.42 1.33 0.08 2.12 1.01 -1.25 -4.98 120.40 115.28 3lrs s VAL 102 Ca -0.06 -0.59 0.07 0.00 0.00 0.00 0.00 61.98 61.40 3lrs s VAL 102 Cb 0.12 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 3lrs s VAL 102 CO 0.87 0.40 -0.18 0.26 0.00 0.00 0.00 175.10 176.45 3lrs s TRP 103 N 0.63 1.54 0.45 5.22 0.52 -1.26 -0.17 118.94 125.87 3lrs s TRP 103 Ca -0.15 -0.42 0.02 0.00 0.02 0.00 0.00 56.10 55.58 3lrs s TRP 103 Cb -0.16 -0.87 0.00 0.00 -1.15 0.00 0.00 33.47 31.29 3lrs s TRP 103 CO 0.04 0.12 0.65 0.20 0.02 0.00 0.00 176.95 177.99 3lrs s GLY 104 N -1.65 1.65 1.03 0.98 0.00 -0.97 -4.60 107.32 103.75 3lrs s GLY 104 Ca 0.03 -1.22 -0.14 0.00 0.00 0.00 0.00 44.72 43.39 3lrs s GLY 104 CO 0.03 -1.04 1.11 1.25 0.00 0.00 0.00 173.10 174.44 3lrs s LYS 105 N -4.52 0.20 0.00 2.90 2.47 -1.26 -4.70 119.74 114.84 3lrs s LYS 105 Ca 0.50 0.34 0.00 0.00 -1.56 0.00 0.00 55.97 55.25 3lrs s LYS 105 Cb -0.10 -1.73 0.00 0.00 -1.46 0.00 0.00 37.83 34.54 3lrs s LYS 105 CO 0.36 -2.84 0.00 0.41 0.16 0.00 0.00 175.35 173.44 3lrs n GLY 106 N -1.30 1.54 2.80 5.54 0.00 -1.26 -4.49 105.19 108.02 3lrs n GLY 106 Ca 0.07 -2.01 -0.15 0.00 0.00 0.00 0.00 46.02 43.92 3lrs n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3lrs s THR 107 N 1.42 0.03 0.13 2.61 -1.32 -0.72 -4.63 115.64 113.16 3lrs s THR 107 Ca 0.00 0.15 -0.29 0.00 -1.21 0.00 0.00 61.69 60.34 3lrs s THR 107 Cb 0.00 -0.14 -0.07 0.00 -1.51 0.00 0.00 72.50 70.79 3lrs s THR 107 CO 0.00 0.10 0.91 -0.89 -2.21 0.00 0.00 174.62 172.53 3lrs s THR 108 N 0.92 4.44 -0.13 5.08 2.01 -1.26 -1.27 115.64 125.43 3lrs s THR 108 Ca -0.08 1.97 0.03 0.00 0.31 0.00 0.00 61.69 63.92 3lrs s THR 108 Cb -0.12 -4.28 0.01 0.00 0.01 0.00 0.00 72.50 68.13 3lrs s THR 108 CO -0.02 0.38 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.38 3lrs s VAL 109 N -0.33 1.96 -0.19 3.82 1.01 0.04 -1.23 120.40 125.49 3lrs s VAL 109 Ca 0.43 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.50 3lrs s VAL 109 Cb -0.23 -1.74 0.04 0.00 0.00 0.00 0.00 36.38 34.45 3lrs s VAL 109 CO 0.29 0.53 -0.11 -0.89 0.00 0.00 0.00 175.10 174.92 3lrs s THR 110 N 0.79 1.61 -0.50 3.92 2.01 -0.94 -1.16 115.64 121.39 3lrs s THR 110 Ca -0.08 -0.91 -0.17 0.00 0.31 0.00 0.00 61.69 60.84 3lrs s THR 110 Cb -0.16 -1.65 0.07 0.00 0.01 0.00 0.00 72.50 70.78 3lrs s THR 110 CO -0.01 0.24 0.52 -0.69 -0.69 0.00 0.00 174.62 173.99 3lrs s VAL 111 N 1.42 5.06 -0.04 3.82 1.01 -1.26 -0.95 120.40 129.47 3lrs s VAL 111 Ca 0.00 -0.86 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 3lrs s VAL 111 Cb -0.15 -4.24 0.03 0.00 0.00 0.00 0.00 36.38 32.02 3lrs s VAL 111 CO -0.09 -0.73 0.05 -0.55 0.00 0.00 0.00 175.10 173.79 3lrs s SER 112 N 2.78 0.94 0.18 3.32 0.15 -0.97 -4.62 113.70 115.48 3lrs s SER 112 Ca 0.09 0.07 0.03 0.00 0.70 0.00 0.00 55.95 56.84 3lrs s SER 112 Cb -0.23 -0.13 0.04 0.00 -1.71 0.00 0.00 66.02 63.99 3lrs s SER 112 CO 0.08 -0.23 1.41 -1.28 1.20 0.00 0.00 173.24 174.42 3lrs h SER 113 N 8.23 0.26 -4.18 5.45 0.87 -1.89 -3.40 113.55 118.88 3lrs h SER 113 Ca -0.18 -0.20 -0.50 0.00 -1.23 0.00 0.00 61.79 59.67 3lrs h SER 113 Cb 1.12 -0.08 0.09 0.00 -0.44 0.00 0.00 62.40 63.09 3lrs h SER 113 CO 0.21 0.98 0.38 0.00 -0.53 0.00 0.00 176.83 177.87 3lrs s ALA 114 N -3.30 2.56 0.59 6.23 0.00 -1.26 -4.99 121.76 121.59 3lrs s ALA 114 Ca -0.03 0.56 0.00 0.00 0.00 0.00 0.00 51.96 52.49 3lrs s ALA 114 Cb 0.10 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.92 3lrs s ALA 114 CO 0.82 -1.10 0.00 0.43 0.00 0.00 0.00 175.76 175.91 3lrs n SER 115 N -2.16 0.00 -4.67 0.00 7.64 -1.26 -4.95 113.62 108.22 3lrs n SER 115 Ca 0.10 -0.79 -0.54 0.00 1.01 0.00 0.00 58.87 58.65 3lrs n SER 115 Cb 0.52 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.66 3lrs n SER 115 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 3lrs n THR 116 N -1.26 0.26 -4.01 0.44 -1.04 -1.26 -4.83 114.28 102.57 3lrs n THR 116 Ca 0.00 -0.05 -0.28 0.00 -2.04 0.00 0.00 64.05 61.68 3lrs n THR 116 Cb 0.00 -1.27 -0.17 0.00 -1.82 0.00 0.00 70.33 67.08 3lrs n THR 116 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 3lrs s LYS 117 N 2.67 1.95 0.63 -2.82 2.20 0.45 -4.96 119.74 119.85 3lrs s LYS 117 Ca 0.92 -0.43 -0.14 0.00 -0.36 0.00 0.00 55.97 55.97 3lrs s LYS 117 Cb -0.94 -1.86 -0.02 0.00 -1.51 0.00 0.00 37.83 33.50 3lrs s LYS 117 CO 0.56 -0.23 1.05 0.20 -0.36 0.00 0.00 175.35 176.57 3lrs s GLY 118 N 1.54 1.93 0.62 5.54 0.00 -1.26 -1.52 107.32 114.17 3lrs s GLY 118 Ca 0.04 0.24 -0.08 0.00 0.00 0.00 0.00 44.72 44.92 3lrs s GLY 118 CO -0.09 0.55 0.97 -4.14 0.00 0.00 0.00 173.10 170.39 3lrs s PRO 119 N -4.48 3.03 -0.13 2.90 0.02 -1.26 -4.62 135.00 130.45 3lrs s PRO 119 Ca 0.61 0.26 -0.01 0.00 0.02 0.00 0.00 61.00 61.88 3lrs s PRO 119 Cb -0.14 -2.17 -0.02 0.00 0.02 0.00 0.00 34.50 32.18 3lrs s PRO 119 CO 0.44 -0.76 -0.11 -1.12 -0.33 0.00 0.00 177.00 175.12 3lrs s SER 120 N -4.29 4.22 -0.21 2.53 0.01 -0.85 -4.98 113.70 110.12 3lrs s SER 120 Ca 0.55 -0.27 -0.03 0.00 1.31 0.00 0.00 55.95 57.51 3lrs s SER 120 Cb -0.11 -1.65 -0.00 0.00 0.21 0.00 0.00 66.02 64.47 3lrs s SER 120 CO 0.48 0.17 -0.07 -0.69 0.41 0.00 0.00 173.24 173.54 3lrs s VAL 121 N 0.33 3.16 -0.04 3.43 1.01 -1.26 -1.94 120.40 125.08 3lrs s VAL 121 Ca -0.09 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 61.38 3lrs s VAL 121 Cb -0.15 -2.42 -0.02 0.00 0.00 0.00 0.00 36.38 33.79 3lrs s VAL 121 CO 0.05 0.45 -0.20 -0.36 0.00 0.00 0.00 175.10 175.03 3lrs s PHE 122 N 1.37 2.52 0.37 5.22 0.08 -0.71 -4.96 117.98 121.87 3lrs s PHE 122 Ca 0.05 -0.37 -0.26 0.00 0.12 0.00 0.00 56.93 56.47 3lrs s PHE 122 Cb -0.14 -1.58 -0.09 0.00 -0.57 0.00 0.00 43.02 40.64 3lrs s PHE 122 CO -0.04 0.02 1.15 -2.14 -0.10 0.00 0.00 175.22 174.11 3lrs s PRO 123 N -0.56 4.20 -0.82 0.24 0.02 -1.26 -0.95 135.00 135.87 3lrs s PRO 123 Ca 0.08 1.81 -0.03 0.00 0.02 0.00 0.00 61.00 62.89 3lrs s PRO 123 Cb -0.11 -2.78 0.21 0.00 0.02 0.00 0.00 34.50 31.83 3lrs s PRO 123 CO 0.00 -0.19 0.69 -0.51 -0.33 0.00 0.00 177.00 176.67 3lrs s LEU 124 N -2.27 5.53 0.36 -5.54 1.43 0.22 -4.83 118.68 113.57 3lrs s LEU 124 Ca 0.54 -3.45 -0.28 0.00 -1.03 0.00 0.00 54.13 49.92 3lrs s LEU 124 Cb -0.30 -1.91 -0.10 0.00 0.03 0.00 0.00 46.19 43.91 3lrs s LEU 124 CO 0.39 -0.25 1.30 0.00 0.23 0.00 0.00 176.35 178.01 3lrs s ALA 125 N -0.94 3.41 0.26 4.21 0.00 -1.26 -1.97 121.76 125.47 3lrs s ALA 125 Ca 0.24 1.24 -0.30 0.00 0.00 0.00 0.00 51.96 53.14 3lrs s ALA 125 Cb -0.11 -3.48 -0.09 0.00 0.00 0.00 0.00 23.12 19.44 3lrs s ALA 125 CO -0.10 -0.69 1.03 -1.25 0.00 0.00 0.00 175.76 174.75 3lrs s PRO 126 N -1.95 4.74 0.00 0.00 0.04 -1.26 -4.93 135.00 131.64 3lrs s PRO 126 Ca 0.52 1.67 0.00 0.00 0.04 0.00 0.00 61.00 63.22 3lrs s PRO 126 Cb -0.39 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 30.92 3lrs s PRO 126 CO 0.51 0.35 0.00 0.45 0.04 0.00 0.00 177.00 178.35 3lrs n SER 127 N 1.34 0.00 -4.16 6.66 2.88 -1.26 -4.52 113.62 114.56 3lrs n SER 127 Ca -0.01 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.13 3lrs n SER 127 Cb 0.46 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.85 3lrs n SER 127 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 3lrs s SER 128 N 0.00 5.76 0.00 -3.46 1.04 -1.26 -5.12 113.70 110.66 3lrs s SER 128 Ca 0.00 -2.99 0.00 0.00 0.48 0.00 0.00 55.95 53.44 3lrs s SER 128 Cb 0.00 -1.95 0.00 0.00 0.10 0.00 0.00 66.02 64.17 3lrs s SER 128 CO 0.00 -0.38 0.00 0.35 0.98 0.00 0.00 173.24 174.19 3lrs n THR 135 N 3.37 0.00 -4.35 2.02 -2.24 -1.26 -5.18 114.28 106.64 3lrs n THR 135 Ca 0.12 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.65 3lrs n THR 135 Cb 0.40 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.51 3lrs n THR 135 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3lrs s ALA 136 N 0.00 2.17 -0.16 6.98 0.00 0.10 -4.73 121.76 126.13 3lrs s ALA 136 Ca 0.00 -1.45 -0.00 0.00 0.00 0.00 0.00 51.96 50.51 3lrs s ALA 136 Cb 0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 3lrs s ALA 136 CO 0.00 0.40 -0.13 0.00 0.00 0.00 0.00 175.76 176.03 3lrs s ALA 137 N -1.44 2.58 -0.02 0.00 0.00 -1.26 -1.54 121.76 120.09 3lrs s ALA 137 Ca 0.14 -1.01 -0.08 0.00 0.00 0.00 0.00 51.96 51.01 3lrs s ALA 137 Cb -0.09 -1.29 0.01 0.00 0.00 0.00 0.00 23.12 21.75 3lrs s ALA 137 CO 0.06 0.01 0.16 -0.48 0.00 0.00 0.00 175.76 175.52 3lrs s LEU 138 N 0.74 1.44 0.00 0.00 0.05 -1.12 -4.18 118.68 115.61 3lrs s LEU 138 Ca -0.06 -0.05 0.00 0.00 0.05 0.00 0.00 54.13 54.07 3lrs s LEU 138 Cb -0.15 0.71 0.00 0.00 -2.05 0.00 0.00 46.19 44.70 3lrs s LEU 138 CO 0.01 -0.31 0.00 0.61 -0.55 0.00 0.00 176.35 176.12 3lrs n GLY 139 N 1.79 2.73 3.02 -3.48 0.00 -0.83 -1.38 105.19 107.05 3lrs n GLY 139 Ca -0.20 -0.90 -0.20 0.00 0.00 0.00 0.00 46.02 44.71 3lrs n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lrs s LEU 141 N 0.06 4.29 -0.64 0.00 2.96 -0.12 -1.66 118.68 123.57 3lrs s LEU 141 Ca -0.01 -0.07 -0.11 0.00 -0.22 0.00 0.00 54.13 53.72 3lrs s LEU 141 Cb -0.07 -2.35 0.17 0.00 0.50 0.00 0.00 46.19 44.44 3lrs s LEU 141 CO 0.00 -0.27 0.54 -0.69 -1.32 0.00 0.00 176.35 174.61 3lrs s VAL 142 N 2.02 4.76 0.23 1.68 1.01 0.02 -1.74 120.40 128.38 3lrs s VAL 142 Ca 0.12 -2.24 0.10 0.00 0.00 0.00 0.00 61.98 59.97 3lrs s VAL 142 Cb -0.16 -4.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 3lrs s VAL 142 CO 0.11 -0.90 -0.12 -1.59 0.00 0.00 0.00 175.10 172.60 3lrs s LYS 143 N 0.66 1.96 -0.81 2.72 -2.85 -0.82 -1.22 119.74 119.38 3lrs s LYS 143 Ca 0.12 -1.48 -0.02 0.00 -1.00 0.00 0.00 55.97 53.59 3lrs s LYS 143 Cb -0.20 -2.01 -0.01 0.00 -2.06 0.00 0.00 37.83 33.55 3lrs s LYS 143 CO -0.04 0.38 0.73 -0.25 0.10 0.00 0.00 175.35 176.27 3lrs n ASP 144 N -0.38 -7.32 -4.09 0.03 8.00 -0.20 -2.02 116.55 110.57 3lrs n ASP 144 Ca -0.08 -0.27 -0.08 0.00 0.71 0.00 0.00 54.79 55.07 3lrs n ASP 144 Cb 0.58 -4.94 -0.10 0.00 -0.02 0.00 0.00 41.12 36.63 3lrs n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3lrs s TYR 145 N -3.07 0.57 -0.28 1.24 -0.85 -0.99 -4.27 117.35 109.70 3lrs s TYR 145 Ca 0.08 -0.93 -0.19 0.00 -0.52 0.00 0.00 57.07 55.51 3lrs s TYR 145 Cb -0.01 -0.39 0.11 0.00 0.38 0.00 0.00 41.96 42.05 3lrs s TYR 145 CO 0.76 -0.29 0.89 0.12 -1.52 0.00 0.00 175.55 175.52 3lrs s PHE 146 N -3.38 -0.70 0.60 -3.49 5.36 -0.58 -0.92 117.98 114.88 3lrs s PHE 146 Ca 0.04 1.49 0.09 0.00 -0.96 0.00 0.00 56.93 57.59 3lrs s PHE 146 Cb 0.04 0.41 0.10 0.00 -0.34 0.00 0.00 43.02 43.23 3lrs s PHE 146 CO -0.07 -0.34 0.82 -0.35 -1.46 0.00 0.00 175.22 173.82 3lrs n PRO 147 N 3.35 0.54 -0.89 10.12 -0.04 -1.26 -0.41 135.00 146.41 3lrs n PRO 147 Ca -0.17 -3.11 -0.35 0.00 -0.04 0.00 0.00 63.50 59.84 3lrs n PRO 147 Cb 0.57 -0.28 0.08 0.00 -0.04 0.00 0.00 33.50 33.84 3lrs n PRO 147 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3lrs n GLU 148 N -2.32 -0.24 -3.47 0.54 -0.58 -1.26 -4.76 120.64 108.55 3lrs n GLU 148 Ca 0.17 -0.05 -0.20 0.00 -0.42 0.00 0.00 57.16 56.66 3lrs n GLU 148 Cb 0.60 -1.43 -0.02 0.00 -0.57 0.00 0.00 31.44 30.02 3lrs n GLU 148 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 3lrs s PRO 149 N -2.83 2.61 -0.01 3.49 0.05 -1.26 -4.92 135.00 132.13 3lrs s PRO 149 Ca 0.48 -1.46 0.06 0.00 0.05 0.00 0.00 61.00 60.13 3lrs s PRO 149 Cb -0.17 -2.46 -0.01 0.00 0.05 0.00 0.00 34.50 31.90 3lrs s PRO 149 CO 0.74 -0.19 -0.18 0.08 0.05 0.00 0.00 177.00 177.50 3lrs s VAL 150 N -2.43 1.39 -0.12 -0.36 1.01 -1.26 -4.40 120.40 114.22 3lrs s VAL 150 Ca 0.49 -0.79 -0.02 0.00 0.00 0.00 0.00 61.98 61.66 3lrs s VAL 150 Cb -0.05 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.14 3lrs s VAL 150 CO 0.29 0.37 -0.05 -0.89 0.00 0.00 0.00 175.10 174.81 3lrs s THR 151 N -0.45 3.80 -0.10 3.92 2.01 -0.23 -5.01 115.64 119.59 3lrs s THR 151 Ca 0.07 -0.41 0.00 0.00 0.31 0.00 0.00 61.69 61.66 3lrs s THR 151 Cb -0.07 -2.62 0.02 0.00 0.01 0.00 0.00 72.50 69.84 3lrs s THR 151 CO -0.00 0.53 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.69 3lrs s VAL 152 N -0.07 0.98 0.41 3.82 1.01 -1.26 -0.77 120.40 124.52 3lrs s VAL 152 Ca 0.01 -0.29 0.07 0.00 0.00 0.00 0.00 61.98 61.77 3lrs s VAL 152 Cb -0.13 -0.99 -0.07 0.00 0.00 0.00 0.00 36.38 35.19 3lrs s VAL 152 CO 0.03 0.35 0.04 -0.94 0.00 0.00 0.00 175.10 174.58 3lrs s SER 153 N 1.46 3.99 -0.05 3.32 1.04 -0.71 -4.97 113.70 117.78 3lrs s SER 153 Ca -0.00 -1.31 0.06 0.00 0.48 0.00 0.00 55.95 55.18 3lrs s SER 153 Cb -0.13 -0.42 -0.01 0.00 0.10 0.00 0.00 66.02 65.56 3lrs s SER 153 CO -0.05 -0.47 -0.22 0.26 0.98 0.00 0.00 173.24 173.74 3lrs s TRP 154 N -2.69 2.15 -1.53 5.02 0.52 -1.26 -0.34 118.94 120.81 3lrs s TRP 154 Ca 0.36 -0.60 -0.14 0.00 0.02 0.00 0.00 56.10 55.74 3lrs s TRP 154 Cb 0.09 -1.42 0.10 0.00 -1.15 0.00 0.00 33.47 31.09 3lrs s TRP 154 CO 0.19 -0.17 0.85 0.09 0.02 0.00 0.00 176.95 177.93 3lrs n ASN 155 N 2.95 -4.45 -3.19 2.95 4.13 0.27 -1.14 115.26 116.77 3lrs n ASN 155 Ca -0.17 -0.74 -0.23 0.00 1.68 0.00 0.00 54.58 55.12 3lrs n ASN 155 Cb 0.52 -3.58 0.05 0.00 -1.54 0.00 0.00 39.78 35.23 3lrs n ASN 155 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 3lrs n SER 156 N -2.69 -6.22 0.00 6.41 7.64 -1.26 -1.68 113.62 115.82 3lrs n SER 156 Ca 0.04 -0.36 0.00 0.00 1.01 0.00 0.00 58.87 59.55 3lrs n SER 156 Cb 0.52 -4.98 0.00 0.00 -1.01 0.00 0.00 64.21 58.74 3lrs n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3lrs n GLY 157 N -1.67 2.08 0.33 0.23 0.00 -0.29 -4.89 105.19 100.99 3lrs n GLY 157 Ca -0.08 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.12 3lrs n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lrs h ALA 158 N 0.00 1.47 -3.15 4.61 0.00 -1.21 -3.38 119.26 117.60 3lrs h ALA 158 Ca 0.00 -0.00 -0.67 0.00 0.00 0.00 0.00 54.91 54.24 3lrs h ALA 158 Cb 0.00 0.01 -0.31 0.00 0.00 0.00 0.00 17.79 17.48 3lrs h ALA 158 CO 0.00 -0.16 -0.76 -1.17 0.00 0.00 0.00 179.25 177.17 3lrs s LEU 159 N -6.99 2.94 0.00 0.00 0.20 -1.07 -4.96 118.68 108.80 3lrs s LEU 159 Ca -0.05 -0.69 0.00 0.00 0.69 0.00 0.00 54.13 54.08 3lrs s LEU 159 Cb 0.14 -1.66 0.00 0.00 -0.43 0.00 0.00 46.19 44.24 3lrs s LEU 159 CO 0.48 -0.08 0.00 0.35 -0.29 0.00 0.00 176.35 176.81 3lrs n THR 160 N 4.70 0.00 -1.24 3.68 -2.24 -1.26 -4.28 114.28 113.64 3lrs n THR 160 Ca -0.18 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.30 3lrs n THR 160 Cb 0.49 -0.48 0.11 0.00 -2.10 0.00 0.00 70.33 68.35 3lrs n THR 160 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3lrs s SER 161 N -3.31 4.00 0.00 3.42 0.01 -1.26 -3.65 113.70 112.91 3lrs s SER 161 Ca 0.00 1.65 0.00 0.00 1.31 0.00 0.00 55.95 58.91 3lrs s SER 161 Cb 0.00 -2.34 0.00 0.00 0.21 0.00 0.00 66.02 63.89 3lrs s SER 161 CO 0.00 -2.33 0.00 0.61 0.41 0.00 0.00 173.24 171.93 3lrs n GLY 162 N -1.18 0.50 3.50 3.44 0.00 -1.26 -4.65 105.19 105.54 3lrs n GLY 162 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 3lrs n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3lrs s VAL 163 N -1.64 4.36 -0.23 1.61 1.01 -1.24 -1.28 120.40 122.99 3lrs s VAL 163 Ca 0.00 0.07 -0.06 0.00 0.00 0.00 0.00 61.98 61.98 3lrs s VAL 163 Cb 0.00 -4.59 -0.03 0.00 0.00 0.00 0.00 36.38 31.77 3lrs s VAL 163 CO 0.00 -1.23 0.04 -2.28 0.00 0.00 0.00 175.10 171.63 3lrs s HIS 164 N 4.00 3.07 -0.40 5.22 2.46 -0.26 -4.98 115.29 124.40 3lrs s HIS 164 Ca 0.27 -0.45 -0.11 0.00 0.47 0.00 0.00 55.06 55.25 3lrs s HIS 164 Cb -0.14 -2.18 0.05 0.00 -0.13 0.00 0.00 32.58 30.18 3lrs s HIS 164 CO 0.16 -0.32 0.25 0.99 -2.47 0.00 0.00 174.74 173.35 3lrs s THR 165 N 1.38 4.50 0.37 0.89 2.01 -1.26 -1.57 115.64 121.95 3lrs s THR 165 Ca 0.05 -1.10 -0.25 0.00 0.31 0.00 0.00 61.69 60.70 3lrs s THR 165 Cb -0.15 -3.62 -0.09 0.00 0.01 0.00 0.00 72.50 68.65 3lrs s THR 165 CO 0.02 -0.38 1.03 -0.36 -0.69 0.00 0.00 174.62 174.25 3lrs s PHE 166 N 1.51 3.39 0.41 4.92 0.40 0.05 -4.99 117.98 123.67 3lrs s PHE 166 Ca 0.02 1.68 -0.24 0.00 -0.60 0.00 0.00 56.93 57.79 3lrs s PHE 166 Cb -0.21 -3.10 -0.11 0.00 0.51 0.00 0.00 43.02 40.11 3lrs s PHE 166 CO 0.05 -0.43 0.99 -2.30 0.70 0.00 0.00 175.22 174.23 3lrs n PRO 167 N 0.18 1.32 -0.53 0.24 -0.02 -1.26 -4.12 135.00 130.82 3lrs n PRO 167 Ca 0.04 0.47 -0.17 0.00 -2.02 0.00 0.00 63.50 61.83 3lrs n PRO 167 Cb 0.49 -2.01 0.14 0.00 -0.02 0.00 0.00 33.50 32.11 3lrs n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3lrs n ALA 168 N -0.45 -2.02 -3.61 3.55 0.00 -1.26 -4.79 120.51 111.93 3lrs n ALA 168 Ca 0.09 -0.90 -0.11 0.00 0.00 0.00 0.00 53.44 52.52 3lrs n ALA 168 Cb 0.39 -0.06 -0.08 0.00 0.00 0.00 0.00 19.45 19.70 3lrs n ALA 168 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3lrs s VAL 169 N -2.05 -0.00 -0.57 0.00 0.11 -0.73 -4.96 120.40 112.20 3lrs s VAL 169 Ca 0.39 0.01 -0.27 0.00 -2.93 0.00 0.00 61.98 59.18 3lrs s VAL 169 Cb -0.04 -0.93 0.03 0.00 -1.53 0.00 0.00 36.38 33.91 3lrs s VAL 169 CO 0.30 0.00 1.10 -0.22 -3.33 0.00 0.00 175.10 172.96 3lrs s LEU 170 N 0.91 3.68 1.17 2.54 2.96 -1.26 -2.08 118.68 126.60 3lrs s LEU 170 Ca -0.04 -0.05 -0.13 0.00 -0.22 0.00 0.00 54.13 53.69 3lrs s LEU 170 Cb -0.05 -3.05 0.29 0.00 0.50 0.00 0.00 46.19 43.87 3lrs s LEU 170 CO -0.08 -1.39 1.03 -1.10 -1.32 0.00 0.00 176.35 173.49 3lrs s GLN 171 N 4.59 -0.94 0.53 1.98 -0.21 0.63 -4.83 119.66 121.41 3lrs s GLN 171 Ca 0.39 0.85 0.23 0.00 0.02 0.00 0.00 55.36 56.84 3lrs s GLN 171 Cb -0.09 -1.55 1.37 0.00 1.00 0.00 0.00 33.01 33.74 3lrs s GLN 171 CO 0.23 -3.74 2.03 1.03 -2.12 0.00 0.00 175.29 172.73 3lrs h SER 172 N -2.64 0.00 0.37 5.90 0.87 -1.95 -1.59 113.55 114.51 3lrs h SER 172 Ca -0.61 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 59.95 3lrs h SER 172 Cb 1.33 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.29 3lrs h SER 172 CO 0.50 0.00 0.00 -1.54 -0.53 0.00 0.00 176.83 175.26 3lrs n SER 173 N -4.40 0.23 0.00 6.23 3.41 -1.26 -4.82 113.62 113.02 3lrs n SER 173 Ca 0.07 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.25 3lrs n SER 173 Cb 0.48 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 3lrs n SER 173 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3lrs n GLY 174 N -0.54 0.68 3.58 5.00 0.00 -0.60 -4.89 105.19 108.42 3lrs n GLY 174 Ca 0.02 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 3lrs n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3lrs s LEU 175 N 0.00 2.99 0.42 0.99 1.43 -1.25 -4.86 118.68 118.39 3lrs s LEU 175 Ca 0.00 -0.76 -0.01 0.00 -1.03 0.00 0.00 54.13 52.34 3lrs s LEU 175 Cb 0.00 -1.52 -0.02 0.00 0.03 0.00 0.00 46.19 44.68 3lrs s LEU 175 CO 0.00 0.02 0.65 -0.31 0.23 0.00 0.00 176.35 176.94 3lrs s TYR 176 N -2.32 3.37 -0.15 0.29 1.51 -0.09 -0.27 117.35 119.68 3lrs s TYR 176 Ca 0.30 0.37 -0.17 0.00 -1.01 0.00 0.00 57.07 56.56 3lrs s TYR 176 Cb -0.06 -2.17 0.05 0.00 -0.11 0.00 0.00 41.96 39.66 3lrs s TYR 176 CO 0.18 -0.19 0.47 -1.12 -1.11 0.00 0.00 175.55 173.78 3lrs s SER 177 N -4.14 -0.47 0.31 2.29 0.01 -0.88 -1.03 113.70 109.78 3lrs s SER 177 Ca 0.45 0.84 0.05 0.00 1.31 0.00 0.00 55.95 58.60 3lrs s SER 177 Cb -0.10 0.87 -0.03 0.00 0.21 0.00 0.00 66.02 66.97 3lrs s SER 177 CO 0.38 -0.23 0.22 -1.48 0.41 0.00 0.00 173.24 172.55 3lrs s LEU 178 N -0.02 1.64 0.02 2.44 0.05 -0.36 -1.78 118.68 120.67 3lrs s LEU 178 Ca -0.02 -1.65 0.02 0.00 0.05 0.00 0.00 54.13 52.52 3lrs s LEU 178 Cb -0.03 0.41 -0.02 0.00 -2.05 0.00 0.00 46.19 44.50 3lrs s LEU 178 CO 0.02 -0.98 -0.06 -0.44 -0.55 0.00 0.00 176.35 174.34 3lrs s SER 179 N -3.35 0.63 -0.02 1.48 0.01 -1.26 -0.80 113.70 110.40 3lrs s SER 179 Ca 0.38 -0.39 0.05 0.00 1.31 0.00 0.00 55.95 57.30 3lrs s SER 179 Cb 0.04 0.02 -0.01 0.00 0.21 0.00 0.00 66.02 66.28 3lrs s SER 179 CO 0.22 -0.14 -0.16 -0.55 0.41 0.00 0.00 173.24 173.02 3lrs s SER 180 N -1.10 1.87 -0.01 2.44 0.15 -0.66 -0.77 113.70 115.62 3lrs s SER 180 Ca -0.07 -0.29 0.02 0.00 0.70 0.00 0.00 55.95 56.30 3lrs s SER 180 Cb -0.07 -0.27 -0.00 0.00 -1.71 0.00 0.00 66.02 63.97 3lrs s SER 180 CO -0.00 0.18 -0.05 0.68 1.20 0.00 0.00 173.24 175.25 3lrs s VAL 181 N -0.29 0.44 -0.05 4.45 -7.23 -0.61 -0.58 120.40 116.52 3lrs s VAL 181 Ca 0.04 -0.23 0.02 0.00 -1.81 0.00 0.00 61.98 60.01 3lrs s VAL 181 Cb -0.07 -0.38 -0.03 0.00 0.56 0.00 0.00 36.38 36.47 3lrs s VAL 181 CO -0.00 0.13 -0.11 0.54 -0.31 0.00 0.00 175.10 175.34 3lrs s VAL 182 N -0.08 3.34 -0.19 1.32 0.11 -0.48 -1.10 120.40 123.33 3lrs s VAL 182 Ca 0.02 -0.63 -0.09 0.00 -2.93 0.00 0.00 61.98 58.35 3lrs s VAL 182 Cb -0.03 -2.34 -0.05 0.00 -1.53 0.00 0.00 36.38 32.44 3lrs s VAL 182 CO -0.00 0.59 0.11 -0.89 -3.33 0.00 0.00 175.10 171.57 3lrs s THR 183 N -0.77 5.19 0.03 5.04 2.01 -0.40 -2.78 115.64 123.95 3lrs s THR 183 Ca 0.12 0.11 -0.03 0.00 0.31 0.00 0.00 61.69 62.20 3lrs s THR 183 Cb -0.11 -3.35 -0.02 0.00 0.01 0.00 0.00 72.50 69.04 3lrs s THR 183 CO 0.01 0.47 0.03 0.68 -0.69 0.00 0.00 174.62 175.12 3lrs s VAL 184 N 0.22 0.13 0.27 3.82 -7.23 -0.59 -4.61 120.40 112.42 3lrs s VAL 184 Ca 0.07 -1.07 -0.30 0.00 -1.81 0.00 0.00 61.98 58.87 3lrs s VAL 184 Cb -0.12 -0.66 -0.13 0.00 0.56 0.00 0.00 36.38 36.03 3lrs s VAL 184 CO -0.01 -0.59 1.34 -2.65 -0.31 0.00 0.00 175.10 172.88 3lrs n PRO 185 N 1.11 2.00 0.00 4.82 -0.02 -1.26 0.02 135.00 141.67 3lrs n PRO 185 Ca -0.21 0.71 0.01 0.00 -2.02 0.00 0.00 63.50 61.99 3lrs n PRO 185 Cb 0.57 -2.32 0.32 0.00 -0.02 0.00 0.00 33.50 32.06 3lrs n PRO 185 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3lrs h SER 186 N 3.52 0.48 -0.11 2.55 0.02 -1.91 -2.24 113.55 115.86 3lrs h SER 186 Ca -0.45 -0.07 0.03 0.00 -0.84 0.00 0.00 61.79 60.46 3lrs h SER 186 Cb 1.28 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 63.69 3lrs h SER 186 CO 0.70 0.51 0.10 0.77 -1.14 0.00 0.00 176.83 177.78 3lrs h SER 187 N 0.51 0.00 0.16 3.07 4.64 -2.00 -2.50 113.55 117.43 3lrs h SER 187 Ca 0.12 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.26 3lrs h SER 187 Cb 0.25 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3lrs h SER 187 CO 0.00 0.00 -0.66 0.77 -0.87 0.00 0.00 176.83 176.07 3lrs h SER 188 N 0.00 0.54 -1.59 4.97 4.64 -1.77 -3.43 113.55 116.91 3lrs h SER 188 Ca 0.05 -0.33 -0.71 0.00 -0.47 0.00 0.00 61.79 60.33 3lrs h SER 188 Cb 0.26 -0.16 0.04 0.00 -0.31 0.00 0.00 62.40 62.23 3lrs h SER 188 CO -0.00 1.05 0.65 0.18 -0.87 0.00 0.00 176.83 177.84 3lrs n LEU 189 N -3.89 1.92 0.00 5.97 4.77 -0.94 -0.31 117.00 124.52 3lrs n LEU 189 Ca -0.04 1.10 0.00 0.00 -0.03 0.00 0.00 56.01 57.04 3lrs n LEU 189 Cb 0.66 -1.15 0.00 0.00 -2.33 0.00 0.00 43.42 40.60 3lrs n LEU 189 CO 0.48 -0.79 0.00 0.61 -1.33 0.00 0.00 177.39 176.35 3lrs n GLY 190 N 3.26 3.06 0.09 -0.72 0.00 -1.26 -4.82 105.19 104.80 3lrs n GLY 190 Ca 0.22 -0.87 -0.12 0.00 0.00 0.00 0.00 46.02 45.25 3lrs n GLY 190 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3lrs n THR 191 N 0.00 1.47 -2.20 2.61 -2.24 0.58 -4.93 114.28 109.57 3lrs n THR 191 Ca 0.00 0.09 -0.35 0.00 -2.27 0.00 0.00 64.05 61.52 3lrs n THR 191 Cb 0.00 -2.24 0.01 0.00 -2.10 0.00 0.00 70.33 66.00 3lrs n THR 191 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 3lrs s GLN 192 N -2.36 3.27 -0.09 -0.78 2.00 -0.54 -5.04 119.66 116.12 3lrs s GLN 192 Ca -0.22 1.65 -0.01 0.00 -2.00 0.00 0.00 55.36 54.78 3lrs s GLN 192 Cb 0.04 -1.99 -0.03 0.00 0.80 0.00 0.00 33.01 31.84 3lrs s GLN 192 CO 0.38 -0.93 -0.05 0.99 -0.50 0.00 0.00 175.29 175.19 3lrs s THR 193 N -1.74 3.87 -0.18 -0.34 2.01 -1.26 -4.80 115.64 113.20 3lrs s THR 193 Ca 0.74 -0.40 0.01 0.00 0.31 0.00 0.00 61.69 62.34 3lrs s THR 193 Cb -0.25 -2.62 0.03 0.00 0.01 0.00 0.00 72.50 69.67 3lrs s THR 193 CO 0.28 0.58 -0.16 -0.31 -0.69 0.00 0.00 174.62 174.32 3lrs s TYR 194 N -0.56 2.61 -0.04 4.92 2.02 -1.26 -4.93 117.35 120.09 3lrs s TYR 194 Ca 0.09 -1.58 0.02 0.00 -0.37 0.00 0.00 57.07 55.23 3lrs s TYR 194 Cb -0.12 -1.80 0.01 0.00 -0.40 0.00 0.00 41.96 39.65 3lrs s TYR 194 CO 0.02 -0.77 -0.11 0.42 -1.57 0.00 0.00 175.55 173.54 3lrs s ILE 195 N 1.34 0.96 -0.23 2.71 1.01 -1.26 -0.69 121.20 125.04 3lrs s ILE 195 Ca 0.03 -0.42 -0.09 0.00 0.00 0.00 0.00 60.65 60.17 3lrs s ILE 195 Cb -0.14 -0.87 -0.04 0.00 0.01 0.00 0.00 42.46 41.42 3lrs s ILE 195 CO -0.11 0.30 0.12 0.00 0.00 0.00 0.00 174.94 175.25 3lrs s ASN 197 N 0.98 6.21 -0.37 0.00 -0.87 0.54 -2.12 114.94 119.31 3lrs s ASN 197 Ca 0.06 -1.03 -0.12 0.00 -1.57 0.00 0.00 52.86 50.19 3lrs s ASN 197 Cb -0.14 -2.28 0.01 0.00 -0.02 0.00 0.00 41.25 38.83 3lrs s ASN 197 CO 0.03 -0.89 0.23 -0.69 -2.57 0.00 0.00 177.10 173.21 3lrs s VAL 198 N 2.51 4.89 -0.12 1.60 1.01 -0.28 -1.74 120.40 128.28 3lrs s VAL 198 Ca 0.13 -0.62 -0.02 0.00 0.00 0.00 0.00 61.98 61.48 3lrs s VAL 198 Cb -0.20 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 3lrs s VAL 198 CO 0.10 -0.17 -0.05 0.21 0.00 0.00 0.00 175.10 175.20 3lrs s ASN 199 N 1.63 4.73 -0.43 3.32 3.84 0.05 -1.68 114.94 126.39 3lrs s ASN 199 Ca 0.04 -0.08 0.02 0.00 0.21 0.00 0.00 52.86 53.05 3lrs s ASN 199 Cb -0.18 -1.53 0.13 0.00 -0.55 0.00 0.00 41.25 39.12 3lrs s ASN 199 CO 0.08 0.26 0.22 -2.28 -2.79 0.00 0.00 177.10 172.59 3lrs s HIS 200 N -0.17 2.07 0.35 0.43 5.65 -0.50 -1.06 115.29 122.06 3lrs s HIS 200 Ca 0.03 -2.43 0.03 0.00 0.25 0.00 0.00 55.06 52.94 3lrs s HIS 200 Cb -0.13 -1.96 0.63 0.00 -1.18 0.00 0.00 32.58 29.94 3lrs s HIS 200 CO 0.03 -0.79 1.96 0.87 -0.65 0.00 0.00 174.74 176.16 3lrs h LYS 201 N 6.86 0.73 -0.80 2.88 1.57 -1.85 -2.14 116.57 123.82 3lrs h LYS 201 Ca -0.03 -0.08 0.17 0.00 -1.87 0.00 0.00 60.65 58.85 3lrs h LYS 201 Cb 0.94 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 33.05 3lrs h LYS 201 CO 0.49 0.55 0.54 -1.35 -0.57 0.00 0.00 179.45 179.11 3lrs h PRO 202 N 0.74 0.36 -0.16 3.15 0.11 -1.89 -2.22 132.00 132.08 3lrs h PRO 202 Ca 0.19 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.28 3lrs h PRO 202 Cb 0.05 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.08 3lrs h PRO 202 CO -0.03 0.24 0.00 -1.13 -0.21 0.00 0.00 178.00 176.87 3lrs n SER 203 N -4.47 3.11 -4.06 -2.05 3.41 -0.85 -4.95 113.62 103.76 3lrs n SER 203 Ca 0.16 -2.87 -0.29 0.00 -0.26 0.00 0.00 58.87 55.61 3lrs n SER 203 Cb 0.61 -0.43 -0.04 0.00 -0.26 0.00 0.00 64.21 64.09 3lrs n SER 203 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3lrs n ASN 204 N -0.75 -0.44 -4.08 4.04 3.02 -0.84 -4.84 115.26 111.38 3lrs n ASN 204 Ca 0.17 -1.11 -0.32 0.00 -0.03 0.00 0.00 54.58 53.28 3lrs n ASN 204 Cb 0.71 -2.52 -0.15 0.00 -0.61 0.00 0.00 39.78 37.20 3lrs n ASN 204 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3lrs s THR 205 N -4.04 2.10 -0.42 3.41 2.01 -1.10 -5.02 115.64 112.58 3lrs s THR 205 Ca 0.06 -1.35 0.03 0.00 0.31 0.00 0.00 61.69 60.74 3lrs s THR 205 Cb -0.03 -2.10 0.11 0.00 0.01 0.00 0.00 72.50 70.50 3lrs s THR 205 CO 0.93 0.18 0.15 -0.54 -0.69 0.00 0.00 174.62 174.65 3lrs s LYS 206 N 1.19 1.73 0.04 4.92 1.02 -1.26 -1.41 119.74 125.97 3lrs s LYS 206 Ca -0.04 -2.18 -0.08 0.00 0.02 0.00 0.00 55.97 53.69 3lrs s LYS 206 Cb -0.17 -3.29 -0.05 0.00 -0.52 0.00 0.00 37.83 33.80 3lrs s LYS 206 CO -0.08 -1.02 0.34 0.08 -0.92 0.00 0.00 175.35 173.75 3lrs s VAL 207 N 0.43 5.19 -0.14 3.17 1.01 -0.67 -4.97 120.40 124.43 3lrs s VAL 207 Ca 0.13 0.31 0.02 0.00 0.00 0.00 0.00 61.98 62.45 3lrs s VAL 207 Cb -0.22 -3.61 0.01 0.00 0.00 0.00 0.00 36.38 32.57 3lrs s VAL 207 CO -0.05 0.33 -0.19 -1.81 0.00 0.00 0.00 175.10 173.38 3lrs s ASP 208 N -1.73 2.90 -0.13 3.32 1.01 -1.26 -1.12 116.67 119.66 3lrs s ASP 208 Ca 0.30 -0.55 0.01 0.00 0.71 0.00 0.00 52.55 53.02 3lrs s ASP 208 Cb -0.14 -1.33 -0.01 0.00 1.01 0.00 0.00 42.92 42.45 3lrs s ASP 208 CO 0.17 0.05 -0.16 -0.75 0.21 0.00 0.00 175.17 174.69 3lrs s LYS 209 N 0.95 3.27 0.12 8.23 2.47 -0.90 -4.95 119.74 128.93 3lrs s LYS 209 Ca -0.05 -0.74 -0.18 0.00 -1.56 0.00 0.00 55.97 53.44 3lrs s LYS 209 Cb -0.15 -2.56 -0.07 0.00 -1.46 0.00 0.00 37.83 33.59 3lrs s LYS 209 CO -0.03 0.15 0.58 0.50 0.16 0.00 0.00 175.35 176.71 3lrs s ARG 210 N 0.47 4.14 -0.22 4.03 3.52 -1.26 -1.09 118.95 128.54 3lrs s ARG 210 Ca -0.11 0.67 0.02 0.00 -0.13 0.00 0.00 55.73 56.18 3lrs s ARG 210 Cb -0.16 -3.09 0.04 0.00 -1.56 0.00 0.00 34.95 30.18 3lrs s ARG 210 CO 0.05 0.56 -0.13 0.08 -0.81 0.00 0.00 175.30 175.05 3lrs s VAL 211 N -1.28 1.91 0.18 7.11 1.01 0.13 -4.85 120.40 124.61 3lrs s VAL 211 Ca 0.34 -1.21 0.11 0.00 0.00 0.00 0.00 61.98 61.22 3lrs s VAL 211 Cb -0.18 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 3lrs s VAL 211 CO 0.19 0.18 -0.24 -1.61 0.00 0.00 0.00 175.10 173.62 3lrs s GLU 212 N 1.27 1.51 0.00 2.72 2.02 -1.26 -4.47 118.70 120.50 3lrs s GLU 212 Ca -0.03 -1.48 0.00 0.00 0.02 0.00 0.00 54.97 53.48 3lrs s GLU 212 Cb -0.17 -1.87 0.00 0.00 0.10 0.00 0.00 34.13 32.20 3lrs s GLU 212 CO -0.08 0.41 0.23 -2.30 0.02 0.00 0.00 175.26 173.54