#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q9t s ILE 2 N 0.00 4.28 -0.19 2.12 1.01 -1.26 -4.96 121.20 122.20 1q9t s ILE 2 Ca 0.00 -0.19 -0.13 0.00 0.00 0.00 0.00 60.65 60.32 1q9t s ILE 2 Cb 0.00 -2.97 -0.05 0.00 0.01 0.00 0.00 42.46 39.45 1q9t s ILE 2 CO 0.00 0.38 0.28 -0.69 0.00 0.00 0.00 174.94 174.92 1q9t s VAL 3 N 1.24 5.30 -0.15 2.92 1.01 -1.26 -4.91 120.40 124.54 1q9t s VAL 3 Ca 0.04 0.50 -0.03 0.00 0.00 0.00 0.00 61.98 62.50 1q9t s VAL 3 Cb -0.15 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.59 1q9t s VAL 3 CO 0.03 0.35 -0.06 -0.04 0.00 0.00 0.00 175.10 175.37 1q9t s MET 4 N 0.78 3.57 0.01 2.72 1.00 -1.26 -1.20 119.30 124.92 1q9t s MET 4 Ca 0.15 -0.57 0.06 0.00 0.00 0.00 0.00 55.69 55.33 1q9t s MET 4 Cb -0.13 -2.83 -0.02 0.00 0.00 0.00 0.00 34.83 31.85 1q9t s MET 4 CO 0.04 0.25 -0.17 -1.12 0.00 0.00 0.00 175.02 174.02 1q9t s SER 5 N 0.32 1.99 0.19 3.03 0.01 0.06 -4.28 113.70 115.02 1q9t s SER 5 Ca -0.06 -0.38 0.09 0.00 1.31 0.00 0.00 55.95 56.91 1q9t s SER 5 Cb -0.15 -0.19 -0.04 0.00 0.21 0.00 0.00 66.02 65.85 1q9t s SER 5 CO 0.04 0.15 -0.18 -1.10 0.41 0.00 0.00 173.24 172.56 1q9t s GLN 6 N -0.74 1.35 -0.04 12.44 -0.21 -1.26 -0.14 119.66 131.06 1q9t s GLN 6 Ca 0.05 -1.50 -0.21 0.00 0.02 0.00 0.00 55.36 53.72 1q9t s GLN 6 Cb -0.07 -1.36 0.04 0.00 1.00 0.00 0.00 33.01 32.62 1q9t s GLN 6 CO 0.00 0.26 0.47 -1.54 -2.12 0.00 0.00 175.29 172.36 1q9t s SER 7 N -2.93 -0.39 0.99 5.90 1.04 -0.63 -4.63 113.70 113.05 1q9t s SER 7 Ca 0.19 0.38 -0.16 0.00 0.48 0.00 0.00 55.95 56.85 1q9t s SER 7 Cb -0.05 0.44 0.19 0.00 0.10 0.00 0.00 66.02 66.71 1q9t s SER 7 CO 0.08 -0.50 1.23 -2.16 0.98 0.00 0.00 173.24 172.87 1q9t s PRO 8 N -1.19 0.49 0.19 4.02 0.04 -1.26 -0.60 135.00 136.69 1q9t s PRO 8 Ca -0.12 -0.16 -0.01 0.00 0.04 0.00 0.00 61.00 60.75 1q9t s PRO 8 Cb -0.03 -1.80 0.11 0.00 0.04 0.00 0.00 34.50 32.81 1q9t s PRO 8 CO 0.06 -2.55 1.47 0.77 0.04 0.00 0.00 177.00 176.79 1q9t h SER 9 N -1.75 0.49 -4.93 6.66 0.02 -1.84 -3.41 113.55 108.79 1q9t h SER 9 Ca -0.46 -0.29 0.02 0.00 -0.84 0.00 0.00 61.79 60.22 1q9t h SER 9 Cb 1.27 -0.14 -0.12 0.00 0.14 0.00 0.00 62.40 63.55 1q9t h SER 9 CO 0.45 1.01 0.28 -0.94 -1.14 0.00 0.00 176.83 176.49 1q9t s SER 10 N -6.95 -0.50 0.09 3.07 1.04 -1.26 -0.96 113.70 108.24 1q9t s SER 10 Ca -0.06 -0.05 -0.27 0.00 0.48 0.00 0.00 55.95 56.06 1q9t s SER 10 Cb 0.11 0.56 0.08 0.00 0.10 0.00 0.00 66.02 66.87 1q9t s SER 10 CO 0.83 -0.92 0.96 -1.48 0.98 0.00 0.00 173.24 173.62 1q9t s LEU 11 N -2.71 -0.23 -0.01 2.42 2.34 -0.76 -4.93 118.68 114.81 1q9t s LEU 11 Ca 0.03 -0.26 0.04 0.00 0.06 0.00 0.00 54.13 54.00 1q9t s LEU 11 Cb -0.01 2.07 -0.01 0.00 -0.56 0.00 0.00 46.19 47.67 1q9t s LEU 11 CO -0.10 -0.78 -0.13 0.00 -1.06 0.00 0.00 176.35 174.28 1q9t s ALA 12 N -3.18 1.11 0.04 1.48 0.00 -1.26 -0.46 121.76 119.49 1q9t s ALA 12 Ca 0.10 -0.58 0.02 0.00 0.00 0.00 0.00 51.96 51.50 1q9t s ALA 12 Cb -0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 1q9t s ALA 12 CO -0.02 0.27 -0.07 0.54 0.00 0.00 0.00 175.76 176.48 1q9t s VAL 13 N -0.32 0.51 0.34 0.00 0.11 -0.71 -4.81 120.40 115.52 1q9t s VAL 13 Ca 0.05 -0.97 -0.13 0.00 -2.93 0.00 0.00 61.98 58.00 1q9t s VAL 13 Cb -0.05 -0.56 -0.08 0.00 -1.53 0.00 0.00 36.38 34.16 1q9t s VAL 13 CO -0.00 -0.33 0.73 -0.44 -3.33 0.00 0.00 175.10 171.73 1q9t s SER 14 N -1.40 6.68 0.40 3.54 0.01 -1.26 0.09 113.70 121.76 1q9t s SER 14 Ca -0.09 1.20 -0.25 0.00 1.31 0.00 0.00 55.95 58.13 1q9t s SER 14 Cb -0.09 -2.34 -0.11 0.00 0.21 0.00 0.00 66.02 63.68 1q9t s SER 14 CO 0.00 -0.26 0.95 0.00 0.41 0.00 0.00 173.24 174.35 1q9t n ALA 15 N -0.65 -0.11 -0.17 1.44 0.00 -1.25 -1.74 120.51 118.03 1q9t n ALA 15 Ca 0.03 0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1q9t n ALA 15 Cb 0.53 -2.03 0.00 0.00 0.00 0.00 0.00 19.45 17.95 1q9t n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q9t n GLY 16 N 1.27 1.97 4.00 0.00 0.00 0.63 -4.90 105.19 108.15 1q9t n GLY 16 Ca 0.10 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.92 1q9t n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q9t s GLU 17 N -0.24 2.41 -0.01 1.61 0.41 -0.71 -4.11 118.70 118.06 1q9t s GLU 17 Ca 0.00 -1.14 -0.11 0.00 -0.41 0.00 0.00 54.97 53.30 1q9t s GLU 17 Cb 0.00 -2.57 -0.05 0.00 -1.78 0.00 0.00 34.13 29.73 1q9t s GLU 17 CO 0.00 -0.76 0.34 0.21 -0.49 0.00 0.00 175.26 174.56 1q9t s LYS 18 N -4.70 3.75 -0.05 1.61 2.20 -1.26 -1.19 119.74 120.10 1q9t s LYS 18 Ca 0.59 0.20 0.06 0.00 -0.36 0.00 0.00 55.97 56.46 1q9t s LYS 18 Cb -0.08 -3.15 -0.02 0.00 -1.51 0.00 0.00 37.83 33.07 1q9t s LYS 18 CO 0.38 0.68 -0.22 0.08 -0.36 0.00 0.00 175.35 175.91 1q9t s VAL 19 N -1.16 2.33 -0.05 4.02 1.01 0.85 -4.98 120.40 122.43 1q9t s VAL 19 Ca 0.24 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.26 1q9t s VAL 19 Cb -0.15 -1.86 0.02 0.00 0.00 0.00 0.00 36.38 34.39 1q9t s VAL 19 CO 0.13 0.57 -0.07 -0.89 0.00 0.00 0.00 175.10 174.84 1q9t s THR 20 N -0.38 0.72 0.03 3.92 2.01 -1.26 -0.67 115.64 120.02 1q9t s THR 20 Ca 0.03 -0.25 -0.04 0.00 0.31 0.00 0.00 61.69 61.75 1q9t s THR 20 Cb -0.12 -0.70 -0.02 0.00 0.01 0.00 0.00 72.50 71.67 1q9t s THR 20 CO 0.02 0.26 0.05 0.00 -0.69 0.00 0.00 174.62 174.26 1q9t s MET 21 N 0.76 0.52 0.23 4.92 0.23 -0.69 -4.78 119.30 120.48 1q9t s MET 21 Ca -0.12 -0.76 0.06 0.00 -1.03 0.00 0.00 55.69 53.83 1q9t s MET 21 Cb -0.14 0.20 -0.05 0.00 -1.53 0.00 0.00 34.83 33.30 1q9t s MET 21 CO 0.01 -0.12 -0.06 -1.54 -2.03 0.00 0.00 175.02 171.29 1q9t s SER 22 N -2.03 2.30 -0.05 -1.18 1.04 0.24 -1.10 113.70 112.92 1q9t s SER 22 Ca -0.07 -1.14 -0.03 0.00 0.48 0.00 0.00 55.95 55.19 1q9t s SER 22 Cb -0.02 -0.08 0.03 0.00 0.10 0.00 0.00 66.02 66.04 1q9t s SER 22 CO -0.04 -0.36 0.13 0.00 0.98 0.00 0.00 173.24 173.94 1q9t s LYS 24 N 0.81 1.84 0.04 0.00 2.20 0.80 -0.61 119.74 124.82 1q9t s LYS 24 Ca -0.06 -0.81 0.05 0.00 -0.36 0.00 0.00 55.97 54.79 1q9t s LYS 24 Cb -0.08 -1.78 -0.03 0.00 -1.51 0.00 0.00 37.83 34.42 1q9t s LYS 24 CO -0.04 0.49 -0.12 -1.54 -0.36 0.00 0.00 175.35 173.78 1q9t s SER 25 N -0.53 4.27 0.06 1.43 1.04 -0.44 -0.76 113.70 118.77 1q9t s SER 25 Ca 0.09 -0.30 0.19 0.00 0.48 0.00 0.00 55.95 56.40 1q9t s SER 25 Cb -0.09 -0.85 0.79 0.00 0.10 0.00 0.00 66.02 65.97 1q9t s SER 25 CO -0.01 0.25 1.60 -1.54 0.98 0.00 0.00 173.24 174.52 1q9t n SER 26 N 1.36 0.16 -3.93 7.02 3.41 -0.34 -4.72 113.62 116.58 1q9t n SER 26 Ca -0.15 0.53 -0.10 0.00 -0.26 0.00 0.00 58.87 58.89 1q9t n SER 26 Cb 0.52 -0.57 -0.11 0.00 -0.26 0.00 0.00 64.21 63.79 1q9t n SER 26 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1q9t s GLN 27 N -3.06 0.33 0.32 4.33 -0.21 -1.26 -4.96 119.66 115.15 1q9t s GLN 27 Ca 0.08 -0.45 -0.29 0.00 0.02 0.00 0.00 55.36 54.72 1q9t s GLN 27 Cb 0.11 0.13 -0.12 0.00 1.00 0.00 0.00 33.01 34.13 1q9t s GLN 27 CO 0.35 -0.07 1.33 0.45 -2.12 0.00 0.00 175.29 175.23 1q9t n SER 28 N 1.74 2.86 -1.11 5.90 2.88 -1.26 -4.68 113.62 119.96 1q9t n SER 28 Ca -0.22 1.20 0.10 0.00 -1.33 0.00 0.00 58.87 58.61 1q9t n SER 28 Cb 0.56 -1.49 0.26 0.00 -0.75 0.00 0.00 64.21 62.80 1q9t n SER 28 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1q9t n LEU 29 N 1.06 3.60 -4.57 2.46 4.77 -0.18 -4.91 117.00 119.22 1q9t n LEU 29 Ca 0.06 -2.00 -0.43 0.00 -0.03 0.00 0.00 56.01 53.61 1q9t n LEU 29 Cb 0.35 -0.40 -0.03 0.00 -2.33 0.00 0.00 43.42 41.01 1q9t n LEU 29 CO 0.62 0.90 0.85 -0.22 -1.33 0.00 0.00 177.39 178.21 1q9t s LEU 30 N -1.00 3.87 -0.26 2.23 2.96 -1.26 -1.37 118.68 123.84 1q9t s LEU 30 Ca 0.40 0.17 -0.29 0.00 -0.22 0.00 0.00 54.13 54.19 1q9t s LEU 30 Cb 0.21 -3.26 0.01 0.00 0.50 0.00 0.00 46.19 43.64 1q9t s LEU 30 CO 0.27 -1.16 1.16 0.21 -1.32 0.00 0.00 176.35 175.52 1q9t s ASN 30 N 2.42 6.91 0.49 3.68 3.84 0.00 -4.91 114.94 127.38 1q9t s ASN 30 Ca 0.40 1.30 0.21 0.00 0.21 0.00 0.00 52.86 54.97 1q9t s ASN 30 Cb -0.09 -2.54 1.25 0.00 -0.55 0.00 0.00 41.25 39.32 1q9t s ASN 30 CO 0.27 -0.85 2.05 0.77 -2.79 0.00 0.00 177.10 176.55 1q9t h SER 30 N 8.24 0.00 0.00 -4.21 4.64 -1.95 0.47 113.55 120.74 1q9t h SER 30 Ca -0.23 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.04 1q9t h SER 30 Cb 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1q9t h SER 30 CO 1.01 0.14 -0.21 -0.09 -0.87 0.00 0.00 176.83 176.81 1q9t h ARG 30 N 0.00 0.13 0.00 4.77 2.43 -1.97 -3.34 114.38 116.40 1q9t h ARG 30 Ca -0.00 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 1q9t h ARG 30 Cb 0.30 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1q9t h ARG 30 CO 0.02 0.92 -0.68 0.25 -1.51 0.00 0.00 179.97 178.96 1q9t n THR 30 N -4.54 0.03 -3.04 0.20 -2.24 -1.19 -4.97 114.28 98.54 1q9t n THR 30 Ca -0.10 -0.04 -0.22 0.00 -2.27 0.00 0.00 64.05 61.43 1q9t n THR 30 Cb 0.49 0.41 0.02 0.00 -2.10 0.00 0.00 70.33 69.16 1q9t n THR 30 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1q9t n ARG 30 N -1.57 -4.25 -4.34 -0.78 3.00 0.16 -4.99 116.66 103.89 1q9t n ARG 30 Ca 0.05 0.80 -0.25 0.00 -0.01 0.00 0.00 57.85 58.44 1q9t n ARG 30 Cb 0.35 -5.61 -0.12 0.00 0.00 0.00 0.00 32.46 27.08 1q9t n ARG 30 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1q9t s LYS 30 N -5.71 1.27 -0.28 5.56 1.02 -1.22 -4.91 119.74 115.47 1q9t s LYS 30 Ca 0.30 -1.31 -0.14 0.00 0.02 0.00 0.00 55.97 54.84 1q9t s LYS 30 Cb -0.14 -1.52 -0.04 0.00 -0.52 0.00 0.00 37.83 35.61 1q9t s LYS 30 CO 0.37 0.34 0.33 -0.80 -0.92 0.00 0.00 175.35 174.66 1q9t s ASN 31 N -2.24 6.19 -1.37 2.83 -0.87 -1.26 -0.82 114.94 117.40 1q9t s ASN 31 Ca 0.12 0.19 -0.14 0.00 -1.57 0.00 0.00 52.86 51.46 1q9t s ASN 31 Cb -0.09 -2.19 0.08 0.00 -0.02 0.00 0.00 41.25 39.04 1q9t s ASN 31 CO 0.06 -0.16 1.99 -1.22 -2.57 0.00 0.00 177.10 175.20 1q9t n TYR 32 N 5.27 3.76 -4.09 2.20 0.53 -0.47 -3.17 117.16 121.18 1q9t n TYR 32 Ca -0.10 -2.94 -0.19 0.00 -1.02 0.00 0.00 57.90 53.65 1q9t n TYR 32 Cb 0.51 -2.42 -0.16 0.00 -1.03 0.00 0.00 39.34 36.24 1q9t n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.02 0.00 0.00 176.86 174.67 1q9t s LEU 33 N 2.08 1.27 0.16 7.72 1.98 -1.26 -1.62 118.68 129.01 1q9t s LEU 33 Ca 0.47 -0.10 0.08 0.00 -2.89 0.00 0.00 54.13 51.69 1q9t s LEU 33 Cb 0.10 -0.39 -0.04 0.00 0.66 0.00 0.00 46.19 46.51 1q9t s LEU 33 CO -0.03 -0.07 -0.17 0.00 -1.89 0.00 0.00 176.35 174.19 1q9t s ALA 34 N 0.97 1.94 -0.06 5.97 0.00 -0.20 -0.31 121.76 130.08 1q9t s ALA 34 Ca -0.10 -1.48 0.05 0.00 0.00 0.00 0.00 51.96 50.43 1q9t s ALA 34 Cb -0.14 -0.16 -0.02 0.00 0.00 0.00 0.00 23.12 22.80 1q9t s ALA 34 CO -0.00 0.20 -0.20 -1.58 0.00 0.00 0.00 175.76 174.18 1q9t s TRP 35 N -2.13 2.54 0.13 0.00 0.52 -0.29 -0.07 118.94 119.64 1q9t s TRP 35 Ca 0.15 -0.47 0.09 0.00 0.02 0.00 0.00 56.10 55.90 1q9t s TRP 35 Cb -0.05 -1.62 -0.04 0.00 -1.15 0.00 0.00 33.47 30.61 1q9t s TRP 35 CO 0.06 -0.04 -0.22 0.71 0.02 0.00 0.00 176.95 177.48 1q9t s TYR 36 N -0.39 1.97 -0.13 -1.98 1.51 0.14 -1.08 117.35 117.39 1q9t s TYR 36 Ca 0.04 -0.41 0.03 0.00 -1.01 0.00 0.00 57.07 55.71 1q9t s TYR 36 Cb -0.12 -1.05 0.01 0.00 -0.11 0.00 0.00 41.96 40.69 1q9t s TYR 36 CO 0.02 0.29 -0.22 -1.14 -1.11 0.00 0.00 175.55 173.39 1q9t s GLN 37 N -2.19 3.01 -0.32 -0.62 0.74 0.15 -1.04 119.66 119.39 1q9t s GLN 37 Ca 0.11 -0.85 0.02 0.00 0.05 0.00 0.00 55.36 54.69 1q9t s GLN 37 Cb -0.09 -2.39 0.09 0.00 1.10 0.00 0.00 33.01 31.73 1q9t s GLN 37 CO 0.06 0.03 0.05 -1.14 -0.55 0.00 0.00 175.29 173.74 1q9t s GLN 38 N 0.70 1.28 0.73 1.67 0.74 0.52 -0.68 119.66 124.62 1q9t s GLN 38 Ca -0.10 -1.52 -0.11 0.00 0.05 0.00 0.00 55.36 53.68 1q9t s GLN 38 Cb -0.16 -2.76 0.03 0.00 1.10 0.00 0.00 33.01 31.22 1q9t s GLN 38 CO 0.01 -0.91 1.07 0.15 -0.55 0.00 0.00 175.29 175.06 1q9t s LYS 39 N 1.18 2.65 -0.01 1.67 1.02 -1.26 -1.58 119.74 123.40 1q9t s LYS 39 Ca 0.08 0.97 -0.36 0.00 0.02 0.00 0.00 55.97 56.68 1q9t s LYS 39 Cb -0.18 -1.96 -0.14 0.00 -0.52 0.00 0.00 37.83 35.03 1q9t s LYS 39 CO -0.13 -1.31 1.63 -2.30 -0.92 0.00 0.00 175.35 172.31 1q9t n PRO 40 N -3.27 1.71 -0.93 -1.68 -0.02 -1.26 -1.65 135.00 127.89 1q9t n PRO 40 Ca 0.08 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1q9t n PRO 40 Cb 0.54 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 1q9t n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1q9t n GLY 41 N 3.58 0.49 3.74 -1.23 0.00 -1.26 -5.00 105.19 105.51 1q9t n GLY 41 Ca 0.21 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.98 1q9t n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1q9t s GLN 42 N -0.51 2.22 0.54 1.61 -0.21 -0.66 -5.13 119.66 117.53 1q9t s GLN 42 Ca 0.00 -1.84 -0.14 0.00 0.02 0.00 0.00 55.36 53.40 1q9t s GLN 42 Cb 0.00 -1.98 -0.06 0.00 1.00 0.00 0.00 33.01 31.97 1q9t s GLN 42 CO 0.00 -0.11 0.98 -1.12 -2.12 0.00 0.00 175.29 172.91 1q9t s SER 43 N -3.90 6.47 0.64 5.90 0.01 -1.26 -4.64 113.70 116.92 1q9t s SER 43 Ca 0.41 1.46 -0.18 0.00 1.31 0.00 0.00 55.95 58.95 1q9t s SER 43 Cb 0.04 -2.47 -0.01 0.00 0.21 0.00 0.00 66.02 63.78 1q9t s SER 43 CO 0.23 -0.67 1.22 -2.84 0.41 0.00 0.00 173.24 171.59 1q9t s PRO 44 N -4.45 2.70 -0.06 12.44 0.02 -1.26 -4.60 135.00 139.79 1q9t s PRO 44 Ca 0.57 1.85 0.02 0.00 0.02 0.00 0.00 61.00 63.46 1q9t s PRO 44 Cb -0.10 -1.89 0.01 0.00 0.02 0.00 0.00 34.50 32.54 1q9t s PRO 44 CO 0.39 -1.43 -0.12 0.21 -0.33 0.00 0.00 177.00 175.73 1q9t s LYS 45 N -3.50 1.58 0.12 5.54 2.20 0.14 -4.94 119.74 120.88 1q9t s LYS 45 Ca 0.78 -0.39 -0.31 0.00 -0.36 0.00 0.00 55.97 55.69 1q9t s LYS 45 Cb -0.31 -1.33 -0.08 0.00 -1.51 0.00 0.00 37.83 34.60 1q9t s LYS 45 CO 0.37 0.04 1.33 -1.17 -0.36 0.00 0.00 175.35 175.56 1q9t s LEU 46 N 0.61 4.38 -0.15 5.43 2.96 -1.26 -0.67 118.68 129.98 1q9t s LEU 46 Ca -0.13 2.27 -0.06 0.00 -0.22 0.00 0.00 54.13 56.00 1q9t s LEU 46 Cb -0.15 -3.59 -0.07 0.00 0.50 0.00 0.00 46.19 42.88 1q9t s LEU 46 CO 0.03 -0.58 -0.18 0.18 -1.32 0.00 0.00 176.35 174.47 1q9t n LEU 47 N 3.67 1.55 -4.01 -0.68 4.77 -0.24 -4.88 117.00 117.18 1q9t n LEU 47 Ca 0.10 0.12 -0.13 0.00 -0.03 0.00 0.00 56.01 56.07 1q9t n LEU 47 Cb 0.43 -0.47 -0.12 0.00 -2.33 0.00 0.00 43.42 40.93 1q9t n LEU 47 CO 0.58 0.43 -0.39 -0.63 -1.33 0.00 0.00 177.39 176.04 1q9t s ILE 48 N -2.29 0.41 0.16 -0.08 -1.09 -1.12 -1.51 121.20 115.67 1q9t s ILE 48 Ca -0.21 -0.75 -0.00 0.00 -2.23 0.00 0.00 60.65 57.46 1q9t s ILE 48 Cb 0.08 -0.45 -0.04 0.00 -1.58 0.00 0.00 42.46 40.46 1q9t s ILE 48 CO 0.29 -0.23 0.06 -0.72 -1.23 0.00 0.00 174.94 173.10 1q9t s TYR 49 N -0.95 1.01 -1.47 3.97 1.13 -0.04 -1.14 117.35 119.86 1q9t s TYR 49 Ca -0.07 -1.22 -0.11 0.00 -1.41 0.00 0.00 57.07 54.26 1q9t s TYR 49 Cb -0.07 -0.56 0.07 0.00 -1.10 0.00 0.00 41.96 40.30 1q9t s TYR 49 CO 0.00 -0.47 0.81 0.91 -2.51 0.00 0.00 175.55 174.29 1q9t n TRP 50 N -0.17 -2.15 0.00 -3.49 8.01 -0.98 -1.17 117.44 117.50 1q9t n TRP 50 Ca -0.04 0.74 0.00 0.00 -1.31 0.00 0.00 57.50 56.89 1q9t n TRP 50 Cb 0.64 -3.82 0.00 0.00 -2.01 0.00 0.00 31.31 26.12 1q9t n TRP 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1q9t n ALA 51 N -4.24 0.00 -0.73 6.99 0.00 0.58 -4.00 120.51 119.11 1q9t n ALA 51 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1q9t n ALA 51 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1q9t n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1q9t n SER 52 N 1.06 0.29 -4.62 0.00 3.41 -1.18 -3.39 113.62 109.19 1q9t n SER 52 Ca 0.00 -1.01 -0.43 0.00 -0.26 0.00 0.00 58.87 57.17 1q9t n SER 52 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1q9t n SER 52 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1q9t s THR 53 N -0.01 4.61 -0.05 6.66 2.01 -0.32 -4.63 115.64 123.91 1q9t s THR 53 Ca 0.00 1.47 -0.30 0.00 0.31 0.00 0.00 61.69 63.18 1q9t s THR 53 Cb 0.00 -4.32 -0.02 0.00 0.01 0.00 0.00 72.50 68.16 1q9t s THR 53 CO 0.00 -0.42 1.04 -0.60 -0.69 0.00 0.00 174.62 173.94 1q9t s ARG 54 N 3.42 4.46 0.36 4.92 3.52 -1.26 -0.86 118.95 133.51 1q9t s ARG 54 Ca 0.40 1.47 -0.27 0.00 -0.13 0.00 0.00 55.73 57.20 1q9t s ARG 54 Cb -0.13 -3.50 -0.09 0.00 -1.56 0.00 0.00 34.95 29.67 1q9t s ARG 54 CO 0.15 -0.23 1.25 -2.00 -0.81 0.00 0.00 175.30 173.66 1q9t s GLU 55 N 1.61 4.20 0.29 5.12 2.56 -0.57 -4.93 118.70 126.98 1q9t s GLU 55 Ca 0.51 2.06 -0.29 0.00 0.00 0.00 0.00 54.97 57.25 1q9t s GLU 55 Cb -0.21 -2.90 -0.13 0.00 2.00 0.00 0.00 34.13 32.89 1q9t s GLU 55 CO 0.23 -0.26 1.33 0.43 -0.56 0.00 0.00 175.26 176.43 1q9t n SER 56 N 0.48 2.70 0.00 -1.70 7.64 -1.26 -1.53 113.62 119.94 1q9t n SER 56 Ca 0.02 1.18 0.00 0.00 1.01 0.00 0.00 58.87 61.08 1q9t n SER 56 Cb 0.44 -1.45 0.00 0.00 -1.01 0.00 0.00 64.21 62.19 1q9t n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1q9t n GLY 57 N 1.41 2.17 3.68 0.23 0.00 -1.26 -5.03 105.19 106.38 1q9t n GLY 57 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1q9t n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1q9t s VAL 58 N -2.32 4.77 0.17 1.61 1.01 -0.58 -4.98 120.40 120.07 1q9t s VAL 58 Ca 0.00 1.95 -0.32 0.00 0.00 0.00 0.00 61.98 63.62 1q9t s VAL 58 Cb 0.00 -4.28 -0.17 0.00 0.00 0.00 0.00 36.38 31.94 1q9t s VAL 58 CO 0.00 -0.05 0.86 -2.65 0.00 0.00 0.00 175.10 173.26 1q9t n PRO 59 N 5.45 0.48 0.27 2.72 -0.02 -1.26 -4.82 135.00 137.82 1q9t n PRO 59 Ca 0.09 0.17 0.18 0.00 -2.02 0.00 0.00 63.50 61.92 1q9t n PRO 59 Cb 0.48 -1.45 0.97 0.00 -0.02 0.00 0.00 33.50 33.49 1q9t n PRO 59 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1q9t h ASP 60 N 2.12 0.00 0.43 2.55 -0.00 -1.99 -2.41 116.42 117.12 1q9t h ASP 60 Ca -0.38 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.65 1q9t h ASP 60 Cb 1.40 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.73 1q9t h ASP 60 CO 0.62 0.00 0.00 -2.11 -0.00 0.00 0.00 179.24 177.75 1q9t n ARG 61 N -2.78 0.02 -3.49 0.28 1.85 -1.26 -4.57 116.66 106.71 1q9t n ARG 61 Ca -0.02 0.26 -0.38 0.00 -1.00 0.00 0.00 57.85 56.70 1q9t n ARG 61 Cb 0.07 -1.50 -0.09 0.00 -1.05 0.00 0.00 32.46 29.89 1q9t n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1q9t s PHE 62 N -2.95 3.27 -0.06 2.89 0.40 -0.91 -1.62 117.98 119.00 1q9t s PHE 62 Ca 0.07 0.33 0.01 0.00 -0.60 0.00 0.00 56.93 56.73 1q9t s PHE 62 Cb 0.09 -2.47 0.02 0.00 0.51 0.00 0.00 43.02 41.17 1q9t s PHE 62 CO 0.24 -0.14 -0.05 0.99 0.70 0.00 0.00 175.22 176.96 1q9t s THR 63 N 1.73 0.68 -0.12 0.64 2.01 -0.04 -4.97 115.64 115.58 1q9t s THR 63 Ca 0.12 -0.16 -0.07 0.00 0.31 0.00 0.00 61.69 61.89 1q9t s THR 63 Cb -0.15 -0.71 -0.04 0.00 0.01 0.00 0.00 72.50 71.60 1q9t s THR 63 CO 0.09 0.28 0.13 -0.83 -0.69 0.00 0.00 174.62 173.60 1q9t s GLY 64 N 1.20 2.15 0.34 4.40 0.00 -1.26 -0.52 107.32 113.62 1q9t s GLY 64 Ca -0.06 -0.65 0.02 0.00 0.00 0.00 0.00 44.72 44.03 1q9t s GLY 64 CO -0.02 -0.39 0.39 -1.35 0.00 0.00 0.00 173.10 171.73 1q9t s SER 65 N -1.03 1.23 0.00 1.64 1.04 -0.13 -4.20 113.70 112.25 1q9t s SER 65 Ca 0.15 -1.60 0.00 0.00 0.48 0.00 0.00 55.95 54.98 1q9t s SER 65 Cb -0.12 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.62 1q9t s SER 65 CO 0.04 -1.20 0.00 0.61 0.98 0.00 0.00 173.24 173.67 1q9t n GLY 66 N -0.59 1.40 3.51 7.32 0.00 -1.26 -1.43 105.19 114.14 1q9t n GLY 66 Ca 0.04 -2.05 -0.10 0.00 0.00 0.00 0.00 46.02 43.91 1q9t n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1q9t s SER 67 N 0.00 -0.46 0.90 1.61 0.15 -0.76 -4.91 113.70 110.23 1q9t s SER 67 Ca 0.00 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.57 1q9t s SER 67 Cb 0.00 0.54 0.00 0.00 -1.71 0.00 0.00 66.02 64.85 1q9t s SER 67 CO 0.00 -0.89 0.00 0.61 1.20 0.00 0.00 173.24 174.16 1q9t n GLY 68 N -0.35 1.21 0.27 9.45 0.00 -1.26 -2.74 105.19 111.76 1q9t n GLY 68 Ca -0.13 0.25 0.05 0.00 0.00 0.00 0.00 46.02 46.20 1q9t n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1q9t n THR 69 N 0.00 0.00 -4.26 2.61 -2.24 -1.26 -1.01 114.28 108.11 1q9t n THR 69 Ca 0.00 -0.40 -0.22 0.00 -2.27 0.00 0.00 64.05 61.15 1q9t n THR 69 Cb 0.00 1.14 -0.17 0.00 -2.10 0.00 0.00 70.33 69.20 1q9t n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1q9t s ASP 70 N -1.34 1.40 0.10 3.42 1.01 -1.11 -1.32 116.67 118.83 1q9t s ASP 70 Ca 0.09 -0.20 0.03 0.00 0.71 0.00 0.00 52.55 53.18 1q9t s ASP 70 Cb 0.09 -0.62 -0.04 0.00 1.01 0.00 0.00 42.92 43.36 1q9t s ASP 70 CO 0.25 -0.04 -0.10 -0.36 0.21 0.00 0.00 175.17 175.14 1q9t s PHE 71 N 0.97 1.04 0.01 4.23 0.40 0.22 -1.83 117.98 123.02 1q9t s PHE 71 Ca -0.10 -0.69 0.01 0.00 -0.60 0.00 0.00 56.93 55.55 1q9t s PHE 71 Cb -0.15 -0.57 -0.01 0.00 0.51 0.00 0.00 43.02 42.81 1q9t s PHE 71 CO 0.00 -0.01 -0.03 0.99 0.70 0.00 0.00 175.22 176.86 1q9t s THR 72 N -2.63 0.23 -0.18 0.64 2.01 -0.51 -1.10 115.64 114.10 1q9t s THR 72 Ca 0.07 -0.33 -0.00 0.00 0.31 0.00 0.00 61.69 61.74 1q9t s THR 72 Cb -0.02 -0.24 0.00 0.00 0.01 0.00 0.00 72.50 72.26 1q9t s THR 72 CO -0.01 -0.06 -0.14 -0.22 -0.69 0.00 0.00 174.62 173.50 1q9t s LEU 73 N -0.41 2.45 -0.07 4.42 2.96 -0.25 -0.95 118.68 126.81 1q9t s LEU 73 Ca -0.02 -0.52 0.04 0.00 -0.22 0.00 0.00 54.13 53.41 1q9t s LEU 73 Cb -0.03 -1.57 -0.02 0.00 0.50 0.00 0.00 46.19 45.07 1q9t s LEU 73 CO -0.00 0.03 -0.19 -0.89 -1.32 0.00 0.00 176.35 173.98 1q9t s THR 74 N 1.14 2.62 -0.20 3.68 2.01 0.32 -1.70 115.64 123.51 1q9t s THR 74 Ca 0.01 -0.86 0.01 0.00 0.31 0.00 0.00 61.69 61.16 1q9t s THR 74 Cb -0.14 -2.02 0.05 0.00 0.01 0.00 0.00 72.50 70.39 1q9t s THR 74 CO -0.05 0.57 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.72 1q9t s ILE 75 N -0.21 1.63 0.42 1.82 1.01 0.15 -0.86 121.20 125.17 1q9t s ILE 75 Ca -0.01 -1.05 -0.02 0.00 0.00 0.00 0.00 60.65 59.58 1q9t s ILE 75 Cb -0.13 -1.73 -0.03 0.00 0.01 0.00 0.00 42.46 40.57 1q9t s ILE 75 CO 0.03 0.13 0.67 0.42 0.00 0.00 0.00 174.94 176.18 1q9t s THR 76 N 1.39 4.88 -1.04 2.92 -4.23 -0.64 -0.10 115.64 118.82 1q9t s THR 76 Ca -0.02 -0.19 -0.29 0.00 -1.18 0.00 0.00 61.69 60.01 1q9t s THR 76 Cb -0.17 -3.82 0.04 0.00 1.34 0.00 0.00 72.50 69.90 1q9t s THR 76 CO -0.08 -0.65 0.59 -1.20 -0.54 0.00 0.00 174.62 172.74 1q9t n SER 77 N -2.03 -3.58 -4.72 3.99 7.64 -1.17 -4.79 113.62 108.96 1q9t n SER 77 Ca -0.02 -1.13 -0.41 0.00 1.01 0.00 0.00 58.87 58.33 1q9t n SER 77 Cb 0.56 -1.37 0.01 0.00 -1.01 0.00 0.00 64.21 62.40 1q9t n SER 77 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 1q9t n VAL 78 N -4.44 2.59 -4.24 0.44 3.14 -0.33 -4.51 118.33 110.98 1q9t n VAL 78 Ca -0.11 -0.50 -0.26 0.00 -2.96 0.00 0.00 64.34 60.51 1q9t n VAL 78 Cb 0.49 -1.67 -0.08 0.00 -1.06 0.00 0.00 33.84 31.52 1q9t n VAL 78 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 1q9t s GLN 79 N -2.27 2.30 0.44 1.45 -0.21 -1.26 -0.27 119.66 119.84 1q9t s GLN 79 Ca 0.60 -1.18 0.20 0.00 0.02 0.00 0.00 55.36 55.01 1q9t s GLN 79 Cb -0.49 -2.28 1.17 0.00 1.00 0.00 0.00 33.01 32.40 1q9t s GLN 79 CO 0.58 0.44 1.86 0.00 -2.12 0.00 0.00 175.29 176.05 1q9t h ALA 80 N 2.66 2.34 0.00 6.09 0.00 -1.90 0.17 119.26 128.62 1q9t h ALA 80 Ca -0.47 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1q9t h ALA 80 Cb 1.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1q9t h ALA 80 CO 0.57 -0.63 0.00 -0.85 0.00 0.00 0.00 179.25 178.35 1q9t n GLU 81 N -4.47 0.22 0.00 0.00 0.00 -1.11 -2.97 120.64 112.31 1q9t n GLU 81 Ca 0.20 0.11 0.15 0.00 0.00 0.00 0.00 57.16 57.62 1q9t n GLU 81 Cb 0.76 -1.50 0.84 0.00 0.00 0.00 0.00 31.44 31.54 1q9t n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1q9t n ASP 82 N -1.34 0.08 -4.67 -1.84 8.00 0.60 -4.83 116.55 112.55 1q9t n ASP 82 Ca 0.09 -0.64 -0.48 0.00 0.71 0.00 0.00 54.79 54.46 1q9t n ASP 82 Cb 0.18 -0.12 -0.05 0.00 -0.02 0.00 0.00 41.12 41.11 1q9t n ASP 82 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1q9t n LEU 83 N -1.08 3.17 0.00 0.64 7.94 -1.16 -4.88 117.00 121.64 1q9t n LEU 83 Ca 0.19 1.02 0.00 0.00 -1.11 0.00 0.00 56.01 56.12 1q9t n LEU 83 Cb 0.18 -1.37 0.00 0.00 0.53 0.00 0.00 43.42 42.77 1q9t n LEU 83 CO 0.20 -0.21 0.00 0.00 -1.11 0.00 0.00 177.39 176.28 1q9t n ALA 84 N 5.27 0.00 -2.92 1.96 0.00 -1.14 -4.51 120.51 119.18 1q9t n ALA 84 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.31 1q9t n ALA 84 Cb 0.28 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.60 1q9t n ALA 84 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1q9t s VAL 85 N -2.00 3.79 -0.16 0.00 1.01 -0.62 -0.95 120.40 121.47 1q9t s VAL 85 Ca 0.00 -0.40 -0.05 0.00 0.00 0.00 0.00 61.98 61.53 1q9t s VAL 85 Cb 0.00 -2.64 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 1q9t s VAL 85 CO 0.00 0.51 -0.01 -0.31 0.00 0.00 0.00 175.10 175.29 1q9t s TYR 86 N 0.19 3.08 0.01 5.22 2.02 -0.20 -0.35 117.35 127.32 1q9t s TYR 86 Ca -0.03 -0.19 0.08 0.00 -0.37 0.00 0.00 57.07 56.56 1q9t s TYR 86 Cb -0.14 -1.98 -0.02 0.00 -0.40 0.00 0.00 41.96 39.42 1q9t s TYR 86 CO 0.03 0.03 -0.25 0.71 -1.57 0.00 0.00 175.55 174.50 1q9t s TYR 87 N 0.33 2.21 0.19 2.71 1.51 -0.21 -0.99 117.35 123.10 1q9t s TYR 87 Ca -0.02 -0.41 0.05 0.00 -1.01 0.00 0.00 57.07 55.68 1q9t s TYR 87 Cb -0.14 -1.38 -0.04 0.00 -0.11 0.00 0.00 41.96 40.30 1q9t s TYR 87 CO 0.02 0.03 0.23 0.00 -1.11 0.00 0.00 175.55 174.72 1q9t s LYS 89 N -3.45 0.16 0.22 0.00 2.20 0.90 -1.08 119.74 118.69 1q9t s LYS 89 Ca 0.33 0.59 -0.12 0.00 -0.36 0.00 0.00 55.97 56.40 1q9t s LYS 89 Cb -0.10 -0.12 -0.07 0.00 -1.51 0.00 0.00 37.83 36.03 1q9t s LYS 89 CO 0.26 -0.22 0.59 1.14 -0.36 0.00 0.00 175.35 176.76 1q9t s GLN 90 N 1.74 3.91 -0.04 4.03 1.03 -0.18 -1.03 119.66 129.11 1q9t s GLN 90 Ca -0.05 0.43 0.10 0.00 0.04 0.00 0.00 55.36 55.89 1q9t s GLN 90 Cb -0.11 -2.70 0.18 0.00 0.03 0.00 0.00 33.01 30.40 1q9t s GLN 90 CO -0.08 0.34 1.08 -1.13 -2.54 0.00 0.00 175.29 172.96 1q9t n SER 91 N 0.14 0.81 -0.08 12.60 3.41 -0.64 -2.25 113.62 127.61 1q9t n SER 91 Ca -0.01 -2.37 -0.14 0.00 -0.26 0.00 0.00 58.87 56.09 1q9t n SER 91 Cb 0.52 -0.29 -0.05 0.00 -0.26 0.00 0.00 64.21 64.13 1q9t n SER 91 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1q9t h TYR 92 N 0.27 0.83 -2.93 7.33 3.20 -1.91 -3.41 116.97 120.36 1q9t h TYR 92 Ca -0.05 -0.27 -0.55 0.00 3.14 0.00 0.00 58.73 61.00 1q9t h TYR 92 Cb 1.39 -0.17 -0.40 0.00 1.54 0.00 0.00 36.73 39.09 1q9t h TYR 92 CO 0.15 1.03 -0.77 1.21 -1.64 0.00 0.00 178.16 178.13 1q9t s ASN 93 N -6.60 3.72 1.02 -2.11 3.04 -1.26 -5.05 114.94 107.69 1q9t s ASN 93 Ca -0.12 -1.47 0.00 0.00 0.04 0.00 0.00 52.86 51.31 1q9t s ASN 93 Cb 0.08 -0.56 0.00 0.00 -1.54 0.00 0.00 41.25 39.23 1q9t s ASN 93 CO 0.83 -0.43 0.00 0.18 -3.04 0.00 0.00 177.10 174.65 1q9t n LEU 94 N 5.04 0.00 -3.85 3.21 4.77 -1.26 -4.71 117.00 120.20 1q9t n LEU 94 Ca -0.04 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.83 1q9t n LEU 94 Cb 0.42 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.40 1q9t n LEU 94 CO 0.07 0.00 -0.19 -0.13 -1.33 0.00 0.00 177.39 175.81 1q9t s ARG 95 N 0.00 0.32 -0.08 3.23 3.00 -1.26 -4.14 118.95 120.01 1q9t s ARG 95 Ca 0.00 -0.10 -0.06 0.00 0.00 0.00 0.00 55.73 55.56 1q9t s ARG 95 Cb 0.00 0.14 0.03 0.00 0.00 0.00 0.00 34.95 35.12 1q9t s ARG 95 CO 0.00 -0.06 0.21 0.99 0.00 0.00 0.00 175.30 176.44 1q9t s THR 96 N -0.65 -0.01 0.05 0.02 2.01 -0.96 -4.98 115.64 111.12 1q9t s THR 96 Ca -0.07 0.05 -0.00 0.00 0.31 0.00 0.00 61.69 61.97 1q9t s THR 96 Cb -0.04 -0.31 -0.04 0.00 0.01 0.00 0.00 72.50 72.12 1q9t s THR 96 CO 0.01 0.02 0.18 -0.36 -0.69 0.00 0.00 174.62 173.78 1q9t s PHE 97 N 0.45 3.48 0.97 4.92 0.08 -1.26 -1.01 117.98 125.61 1q9t s PHE 97 Ca -0.03 0.25 -0.16 0.00 0.12 0.00 0.00 56.93 57.11 1q9t s PHE 97 Cb -0.04 -1.76 0.20 0.00 -0.57 0.00 0.00 43.02 40.85 1q9t s PHE 97 CO -0.02 0.59 1.27 0.20 -0.10 0.00 0.00 175.22 177.16 1q9t s GLY 98 N -2.35 1.73 0.01 4.36 0.00 -0.24 -4.68 107.32 106.16 1q9t s GLY 98 Ca 0.32 -1.08 0.26 0.00 0.00 0.00 0.00 44.72 44.22 1q9t s GLY 98 CO 0.25 -0.34 1.84 0.61 0.00 0.00 0.00 173.10 175.46 1q9t n GLY 99 N -3.31 -1.42 0.00 0.20 0.00 -1.26 -4.76 105.19 94.64 1q9t n GLY 99 Ca 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1q9t n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q9t n GLY 100 N 1.22 0.46 3.01 -0.02 0.00 -1.26 -5.01 105.19 103.59 1q9t n GLY 100 Ca 0.06 -1.61 -0.28 0.00 0.00 0.00 0.00 46.02 44.19 1q9t n GLY 100 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1q9t s THR 101 N -2.75 1.41 -0.25 2.61 2.01 -0.16 -4.70 115.64 113.81 1q9t s THR 101 Ca 0.00 -0.56 -0.19 0.00 0.31 0.00 0.00 61.69 61.25 1q9t s THR 101 Cb 0.00 -1.32 -0.02 0.00 0.01 0.00 0.00 72.50 71.16 1q9t s THR 101 CO 0.00 0.43 0.58 -0.54 -0.69 0.00 0.00 174.62 174.40 1q9t s LYS 102 N 1.28 4.11 -0.26 4.92 1.02 -0.14 -1.04 119.74 129.64 1q9t s LYS 102 Ca -0.01 0.47 -0.09 0.00 0.02 0.00 0.00 55.97 56.37 1q9t s LYS 102 Cb -0.14 -3.64 -0.04 0.00 -0.52 0.00 0.00 37.83 33.50 1q9t s LYS 102 CO -0.06 -0.36 0.11 -1.17 -0.92 0.00 0.00 175.35 172.95 1q9t s LEU 103 N 2.34 3.64 0.25 3.17 2.96 -0.13 -1.82 118.68 129.10 1q9t s LEU 103 Ca 0.25 -0.14 0.08 0.00 -0.22 0.00 0.00 54.13 54.09 1q9t s LEU 103 Cb -0.16 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.51 1q9t s LEU 103 CO 0.09 -0.04 0.13 -1.61 -1.32 0.00 0.00 176.35 173.60 1q9t s GLU 104 N 1.66 2.74 -0.12 1.98 0.41 0.40 -2.87 118.70 122.89 1q9t s GLU 104 Ca 0.07 -1.15 -0.03 0.00 -0.41 0.00 0.00 54.97 53.45 1q9t s GLU 104 Cb -0.15 -2.45 -0.03 0.00 -1.78 0.00 0.00 34.13 29.72 1q9t s GLU 104 CO 0.06 0.39 -0.03 0.42 -0.49 0.00 0.00 175.26 175.62 1q9t s ILE 105 N -2.17 3.99 -0.05 -1.63 -1.09 -1.26 -1.75 121.20 117.25 1q9t s ILE 105 Ca 0.32 -0.34 -0.14 0.00 -2.23 0.00 0.00 60.65 58.27 1q9t s ILE 105 Cb -0.08 -2.71 -0.05 0.00 -1.58 0.00 0.00 42.46 38.04 1q9t s ILE 105 CO 0.23 0.54 0.35 -0.75 -1.23 0.00 0.00 174.94 174.08 1q9t s LYS 106 N -0.14 3.91 0.34 2.79 2.20 0.11 -4.80 119.74 124.15 1q9t s LYS 106 Ca 0.03 0.28 0.03 0.00 -0.36 0.00 0.00 55.97 55.96 1q9t s LYS 106 Cb -0.13 -3.26 -0.02 0.00 -1.51 0.00 0.00 37.83 32.92 1q9t s LYS 106 CO 0.02 0.61 0.36 -0.98 -0.36 0.00 0.00 175.35 175.01 1q9t s ARG 107 N -0.76 1.82 0.42 4.03 1.70 -1.26 -3.95 118.95 120.95 1q9t s ARG 107 Ca 0.21 -1.91 -0.24 0.00 -0.47 0.00 0.00 55.73 53.32 1q9t s ARG 107 Cb -0.15 0.37 -0.08 0.00 -0.57 0.00 0.00 34.95 34.52 1q9t s ARG 107 CO 0.10 -0.71 1.16 0.00 -1.08 0.00 0.00 175.30 174.77 1q9t s ALA 108 N -3.27 3.08 0.46 7.88 0.00 -1.26 -4.95 121.76 123.70 1q9t s ALA 108 Ca 0.37 0.94 -0.24 0.00 0.00 0.00 0.00 51.96 53.03 1q9t s ALA 108 Cb 0.01 -3.37 -0.09 0.00 0.00 0.00 0.00 23.12 19.67 1q9t s ALA 108 CO 0.25 -0.56 1.17 -0.25 0.00 0.00 0.00 175.76 176.37 1q9t n ASP 109 N -0.15 2.00 -3.76 0.00 10.43 -1.26 -4.81 116.55 119.00 1q9t n ASP 109 Ca 0.05 1.03 -0.13 0.00 2.57 0.00 0.00 54.79 58.32 1q9t n ASP 109 Cb 0.47 -1.46 -0.14 0.00 1.84 0.00 0.00 41.12 41.84 1q9t n ASP 109 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1q9t s ALA 110 N -1.27 -0.38 0.47 2.24 0.00 -0.18 -4.92 121.76 117.71 1q9t s ALA 110 Ca 0.65 0.70 -0.21 0.00 0.00 0.00 0.00 51.96 53.10 1q9t s ALA 110 Cb -0.50 -0.45 -0.09 0.00 0.00 0.00 0.00 23.12 22.08 1q9t s ALA 110 CO 0.55 -0.14 1.01 0.00 0.00 0.00 0.00 175.76 177.18 1q9t s ALA 111 N 0.89 2.93 0.55 0.00 0.00 -1.26 -1.43 121.76 123.44 1q9t s ALA 111 Ca -0.07 0.55 -0.17 0.00 0.00 0.00 0.00 51.96 52.28 1q9t s ALA 111 Cb -0.08 -3.22 -0.06 0.00 0.00 0.00 0.00 23.12 19.76 1q9t s ALA 111 CO -0.05 -0.18 1.03 -1.25 0.00 0.00 0.00 175.76 175.31 1q9t s PRO 112 N -3.19 3.60 -0.24 0.00 0.04 -1.26 -4.52 135.00 129.43 1q9t s PRO 112 Ca 0.65 1.13 -0.07 0.00 0.04 0.00 0.00 61.00 62.75 1q9t s PRO 112 Cb -0.14 -2.08 -0.03 0.00 0.04 0.00 0.00 34.50 32.29 1q9t s PRO 112 CO 0.18 -0.57 0.06 0.99 0.04 0.00 0.00 177.00 177.70 1q9t s THR 113 N -2.46 4.31 -0.12 1.26 2.01 -0.50 -4.88 115.64 115.26 1q9t s THR 113 Ca 0.62 -0.18 -0.02 0.00 0.31 0.00 0.00 61.69 62.42 1q9t s THR 113 Cb -0.14 -3.00 -0.03 0.00 0.01 0.00 0.00 72.50 69.34 1q9t s THR 113 CO 0.33 0.36 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.90 1q9t s VAL 114 N 1.40 4.01 -0.02 3.82 1.01 -1.26 -0.45 120.40 128.91 1q9t s VAL 114 Ca 0.05 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.72 1q9t s VAL 114 Cb -0.15 -2.71 0.00 0.00 0.00 0.00 0.00 36.38 33.52 1q9t s VAL 114 CO 0.03 0.55 -0.08 -0.44 0.00 0.00 0.00 175.10 175.16 1q9t s SER 115 N -0.28 1.10 0.02 3.32 0.01 -0.14 -4.95 113.70 112.77 1q9t s SER 115 Ca 0.05 -0.17 0.07 0.00 1.31 0.00 0.00 55.95 57.21 1q9t s SER 115 Cb -0.12 -0.25 -0.03 0.00 0.21 0.00 0.00 66.02 65.82 1q9t s SER 115 CO 0.02 0.07 -0.20 -0.51 0.41 0.00 0.00 173.24 173.03 1q9t s ILE 116 N 0.11 2.59 -0.07 1.44 2.07 -1.26 -0.70 121.20 125.38 1q9t s ILE 116 Ca -0.01 -1.14 0.00 0.00 -1.41 0.00 0.00 60.65 58.09 1q9t s ILE 116 Cb -0.07 -2.04 0.02 0.00 0.13 0.00 0.00 42.46 40.51 1q9t s ILE 116 CO 0.00 0.42 -0.05 -0.36 -1.91 0.00 0.00 174.94 173.04 1q9t s PHE 117 N -0.82 1.02 0.86 3.50 0.40 0.61 -5.00 117.98 118.54 1q9t s PHE 117 Ca 0.13 -0.38 -0.12 0.00 -0.60 0.00 0.00 56.93 55.96 1q9t s PHE 117 Cb -0.10 -0.91 0.11 0.00 0.51 0.00 0.00 43.02 42.62 1q9t s PHE 117 CO 0.03 -0.33 1.11 -2.14 0.70 0.00 0.00 175.22 174.59 1q9t s PRO 118 N 1.40 1.56 0.43 0.24 0.02 -1.26 -1.83 135.00 135.56 1q9t s PRO 118 Ca -0.03 0.55 -0.26 0.00 0.02 0.00 0.00 61.00 61.29 1q9t s PRO 118 Cb -0.13 -1.87 -0.09 0.00 0.02 0.00 0.00 34.50 32.43 1q9t s PRO 118 CO -0.03 -1.97 1.39 -2.14 -0.33 0.00 0.00 177.00 173.92 1q9t s PRO 119 N -5.15 3.81 0.57 5.54 0.02 -1.21 -4.83 135.00 133.76 1q9t s PRO 119 Ca 0.62 2.33 -0.15 0.00 0.02 0.00 0.00 61.00 63.83 1q9t s PRO 119 Cb -0.15 -2.71 -0.05 0.00 0.02 0.00 0.00 34.50 31.60 1q9t s PRO 119 CO 0.55 -0.68 1.02 -1.54 -0.33 0.00 0.00 177.00 176.02 1q9t s SER 120 N -0.57 6.16 0.37 2.53 1.04 -1.26 -4.93 113.70 117.04 1q9t s SER 120 Ca 0.59 1.64 0.11 0.00 0.48 0.00 0.00 55.95 58.77 1q9t s SER 120 Cb -0.42 -2.51 0.71 0.00 0.10 0.00 0.00 66.02 63.90 1q9t s SER 120 CO 0.54 -0.90 1.84 0.77 0.98 0.00 0.00 173.24 176.46 1q9t h SER 121 N 0.44 0.10 0.38 7.02 4.64 -1.99 -1.98 113.55 122.16 1q9t h SER 121 Ca -0.46 -0.03 -0.06 0.00 -0.47 0.00 0.00 61.79 60.77 1q9t h SER 121 Cb 1.20 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 1q9t h SER 121 CO 0.60 0.41 -0.27 1.05 -0.87 0.00 0.00 176.83 177.75 1q9t h GLU 122 N 0.09 0.00 0.23 4.77 9.09 -1.99 -1.37 114.58 125.40 1q9t h GLU 122 Ca 0.01 0.00 -0.34 0.00 0.05 0.00 0.00 59.36 59.08 1q9t h GLU 122 Cb 0.59 0.00 0.03 0.00 -1.65 0.00 0.00 28.75 27.72 1q9t h GLU 122 CO 0.04 0.27 -1.56 0.37 0.05 0.00 0.00 179.01 178.18 1q9t h GLN 123 N 0.00 0.50 -0.95 1.06 4.15 -1.74 -3.32 115.11 114.81 1q9t h GLN 123 Ca -0.00 -0.85 -0.00 0.00 0.77 0.00 0.00 58.65 58.57 1q9t h GLN 123 Cb 0.53 0.32 -0.05 0.00 0.21 0.00 0.00 27.48 28.49 1q9t h GLN 123 CO 0.04 1.40 0.58 -0.07 -1.93 0.00 0.00 178.83 178.85 1q9t h LEU 124 N 0.14 1.13 -1.99 -2.39 3.38 -1.20 -0.66 115.31 113.71 1q9t h LEU 124 Ca -0.28 -0.06 0.12 0.00 0.09 0.00 0.00 57.88 57.75 1q9t h LEU 124 Cb 2.15 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 42.60 1q9t h LEU 124 CO 0.25 0.86 0.30 0.74 0.09 0.00 0.00 178.44 180.67 1q9t h THR 125 N 1.30 0.80 0.00 0.22 2.02 -1.36 0.20 112.91 116.09 1q9t h THR 125 Ca 0.34 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.52 1q9t h THR 125 Cb -0.08 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 67.11 1q9t h THR 125 CO -0.07 0.00 0.00 -0.24 0.37 0.00 0.00 175.52 175.59 1q9t n SER 126 N -4.42 0.48 0.00 4.18 2.88 -0.27 -4.91 113.62 111.56 1q9t n SER 126 Ca 0.07 0.56 0.00 0.00 -1.33 0.00 0.00 58.87 58.17 1q9t n SER 126 Cb 0.49 -0.68 0.00 0.00 -0.75 0.00 0.00 64.21 63.26 1q9t n SER 126 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1q9t n GLY 127 N 1.13 0.64 3.52 0.46 0.00 0.70 -5.07 105.19 106.58 1q9t n GLY 127 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.82 1q9t n GLY 127 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1q9t s GLY 128 N -1.21 2.10 -0.24 -0.02 0.00 -1.15 -0.97 107.32 105.84 1q9t s GLY 128 Ca 0.00 -2.03 -0.03 0.00 0.00 0.00 0.00 44.72 42.66 1q9t s GLY 128 CO 0.00 -2.01 0.34 0.00 0.00 0.00 0.00 173.10 171.43 1q9t s ALA 129 N -2.59 -0.88 -0.14 3.20 0.00 0.04 -3.13 121.76 118.26 1q9t s ALA 129 Ca 0.32 0.67 -0.04 0.00 0.00 0.00 0.00 51.96 52.92 1q9t s ALA 129 Cb 0.00 -1.62 -0.03 0.00 0.00 0.00 0.00 23.12 21.48 1q9t s ALA 129 CO 0.16 -1.29 -0.03 -1.12 0.00 0.00 0.00 175.76 173.48 1q9t s SER 130 N 2.49 4.92 -0.20 0.00 0.01 -1.26 -0.65 113.70 119.01 1q9t s SER 130 Ca 0.11 -0.07 -0.05 0.00 1.31 0.00 0.00 55.95 57.25 1q9t s SER 130 Cb -0.15 -1.73 -0.03 0.00 0.21 0.00 0.00 66.02 64.32 1q9t s SER 130 CO -0.16 0.21 0.01 -0.69 0.41 0.00 0.00 173.24 173.01 1q9t s VAL 131 N 0.14 4.11 -0.03 3.43 1.01 0.56 -3.32 120.40 126.31 1q9t s VAL 131 Ca -0.01 -0.26 0.03 0.00 0.00 0.00 0.00 61.98 61.75 1q9t s VAL 131 Cb -0.13 -2.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.36 1q9t s VAL 131 CO 0.02 0.43 -0.11 -0.69 0.00 0.00 0.00 175.10 174.76 1q9t s VAL 132 N 0.87 3.32 -0.08 2.92 1.01 -0.76 -0.55 120.40 127.13 1q9t s VAL 132 Ca 0.01 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.25 1q9t s VAL 132 Cb -0.14 -2.37 0.02 0.00 0.00 0.00 0.00 36.38 33.89 1q9t s VAL 132 CO 0.02 0.50 -0.10 0.00 0.00 0.00 0.00 175.10 175.53 1q9t s PHE 134 N 1.12 3.23 -0.32 0.00 0.08 0.12 -0.64 117.98 121.57 1q9t s PHE 134 Ca -0.06 0.18 0.02 0.00 0.12 0.00 0.00 56.93 57.19 1q9t s PHE 134 Cb -0.14 -1.87 0.10 0.00 -0.57 0.00 0.00 43.02 40.53 1q9t s PHE 134 CO -0.02 0.41 0.06 -0.51 -0.10 0.00 0.00 175.22 175.07 1q9t s LEU 135 N -0.59 3.67 0.09 -0.37 2.01 -0.02 -0.96 118.68 122.51 1q9t s LEU 135 Ca 0.10 -1.89 0.05 0.00 0.01 0.00 0.00 54.13 52.40 1q9t s LEU 135 Cb -0.12 -1.31 -0.04 0.00 0.01 0.00 0.00 46.19 44.73 1q9t s LEU 135 CO 0.02 -0.38 0.00 0.20 1.01 0.00 0.00 176.35 177.20 1q9t s ASN 136 N 1.20 5.04 -1.13 2.29 0.02 0.40 -0.66 114.94 122.10 1q9t s ASN 136 Ca 0.09 -0.18 -0.15 0.00 -1.02 0.00 0.00 52.86 51.61 1q9t s ASN 136 Cb -0.18 -1.20 -0.03 0.00 0.02 0.00 0.00 41.25 39.86 1q9t s ASN 136 CO -0.14 0.17 0.82 0.59 0.02 0.00 0.00 177.10 178.56 1q9t n ASN 137 N 0.55 -5.28 -4.59 -1.22 4.13 -0.82 -1.41 115.26 106.62 1q9t n ASN 137 Ca -0.11 -0.91 -0.27 0.00 1.68 0.00 0.00 54.58 54.97 1q9t n ASN 137 Cb 0.52 -3.97 -0.11 0.00 -1.54 0.00 0.00 39.78 34.68 1q9t n ASN 137 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1q9t s PHE 138 N -3.47 2.46 -0.28 3.10 -0.71 0.22 -4.56 117.98 114.75 1q9t s PHE 138 Ca 0.42 -0.64 -0.23 0.00 -1.04 0.00 0.00 56.93 55.45 1q9t s PHE 138 Cb -0.12 -1.66 0.10 0.00 -1.21 0.00 0.00 43.02 40.13 1q9t s PHE 138 CO 0.82 0.46 0.86 -0.47 -1.34 0.00 0.00 175.22 175.56 1q9t s TYR 139 N -2.71 -0.69 1.10 3.49 6.14 -0.51 -0.35 117.35 123.82 1q9t s TYR 139 Ca 0.34 1.58 -0.17 0.00 0.64 0.00 0.00 57.07 59.46 1q9t s TYR 139 Cb 0.08 0.37 0.24 0.00 0.42 0.00 0.00 41.96 43.07 1q9t s TYR 139 CO 0.17 -0.34 1.17 -1.25 0.64 0.00 0.00 175.55 175.95 1q9t s PRO 140 N 0.63 -0.42 0.38 4.97 0.04 -1.26 -1.02 135.00 138.32 1q9t s PRO 140 Ca -0.01 -0.10 0.06 0.00 0.04 0.00 0.00 61.00 60.98 1q9t s PRO 140 Cb -0.05 -1.69 0.74 0.00 0.04 0.00 0.00 34.50 33.53 1q9t s PRO 140 CO -0.07 -3.17 1.98 -0.22 0.04 0.00 0.00 177.00 175.56 1q9t h LYS 141 N -2.19 0.56 -6.55 4.56 3.64 -1.99 -3.44 116.57 111.17 1q9t h LYS 141 Ca -0.46 -0.07 -0.52 0.00 -1.27 0.00 0.00 60.65 58.33 1q9t h LYS 141 Cb 1.28 -0.11 0.04 0.00 -0.41 0.00 0.00 32.23 33.03 1q9t h LYS 141 CO 0.39 0.45 1.04 -0.51 -2.27 0.00 0.00 179.45 178.56 1q9t s ASP 142 N -6.68 6.45 0.03 4.20 1.01 -1.26 -4.97 116.67 115.45 1q9t s ASP 142 Ca -0.08 2.74 -0.22 0.00 0.71 0.00 0.00 52.55 55.69 1q9t s ASP 142 Cb 0.17 -2.58 0.05 0.00 1.01 0.00 0.00 42.92 41.57 1q9t s ASP 142 CO 0.75 -0.96 0.50 -0.51 0.21 0.00 0.00 175.17 175.16 1q9t s ILE 143 N 2.12 0.03 -0.12 0.77 2.07 -1.26 -4.72 121.20 120.10 1q9t s ILE 143 Ca 0.77 -0.27 0.03 0.00 -1.41 0.00 0.00 60.65 59.77 1q9t s ILE 143 Cb -0.46 -0.94 0.01 0.00 0.13 0.00 0.00 42.46 41.20 1q9t s ILE 143 CO 0.34 -0.15 -0.20 0.21 -1.91 0.00 0.00 174.94 173.23 1q9t s ASN 144 N -1.83 2.86 -0.09 4.50 3.84 -0.58 -5.00 114.94 118.65 1q9t s ASN 144 Ca -0.07 -0.53 0.04 0.00 0.21 0.00 0.00 52.86 52.51 1q9t s ASN 144 Cb -0.01 -1.31 0.00 0.00 -0.55 0.00 0.00 41.25 39.38 1q9t s ASN 144 CO 0.00 0.09 -0.21 -0.69 -2.79 0.00 0.00 177.10 173.50 1q9t s VAL 145 N 0.69 1.84 0.06 -5.21 1.01 -1.26 -0.21 120.40 117.33 1q9t s VAL 145 Ca -0.11 -0.90 0.07 0.00 0.00 0.00 0.00 61.98 61.04 1q9t s VAL 145 Cb -0.16 -1.60 -0.03 0.00 0.00 0.00 0.00 36.38 34.59 1q9t s VAL 145 CO 0.02 0.51 -0.19 -1.59 0.00 0.00 0.00 175.10 173.85 1q9t s LYS 146 N 0.36 1.17 -0.14 2.72 -2.85 -0.32 -4.96 119.74 115.71 1q9t s LYS 146 Ca -0.16 -0.96 -0.03 0.00 -1.00 0.00 0.00 55.97 53.82 1q9t s LYS 146 Cb -0.17 -1.29 -0.03 0.00 -2.06 0.00 0.00 37.83 34.28 1q9t s LYS 146 CO 0.07 0.32 -0.03 -1.58 0.10 0.00 0.00 175.35 174.22 1q9t s TRP 147 N -0.94 3.03 -0.10 1.78 0.52 -1.26 -0.80 118.94 121.17 1q9t s TRP 147 Ca 0.05 -0.22 0.02 0.00 0.02 0.00 0.00 56.10 55.97 1q9t s TRP 147 Cb -0.09 -1.92 0.01 0.00 -1.15 0.00 0.00 33.47 30.32 1q9t s TRP 147 CO 0.02 0.05 -0.15 0.15 0.02 0.00 0.00 176.95 177.05 1q9t s LYS 148 N 0.14 2.12 -0.21 4.98 1.02 -0.25 -0.98 119.74 126.57 1q9t s LYS 148 Ca -0.01 -0.53 -0.04 0.00 0.02 0.00 0.00 55.97 55.41 1q9t s LYS 148 Cb -0.14 -1.81 -0.01 0.00 -0.52 0.00 0.00 37.83 35.35 1q9t s LYS 148 CO 0.03 -0.06 -0.04 0.42 -0.92 0.00 0.00 175.35 174.78 1q9t s ILE 149 N 0.97 3.48 -1.26 2.17 1.01 -0.16 -0.72 121.20 126.69 1q9t s ILE 149 Ca -0.07 -0.47 -0.08 0.00 0.00 0.00 0.00 60.65 60.03 1q9t s ILE 149 Cb -0.15 -2.57 0.06 0.00 0.01 0.00 0.00 42.46 39.81 1q9t s ILE 149 CO -0.01 0.43 0.44 0.47 0.00 0.00 0.00 174.94 176.27 1q9t n ASP 150 N 4.60 -3.88 0.00 3.58 8.00 0.25 -1.51 116.55 127.58 1q9t n ASP 150 Ca -0.18 -0.30 0.00 0.00 0.71 0.00 0.00 54.79 55.02 1q9t n ASP 150 Cb 0.51 -3.22 0.00 0.00 -0.02 0.00 0.00 41.12 38.39 1q9t n ASP 150 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1q9t n GLY 151 N -1.15 1.75 3.53 0.44 0.00 -1.26 -5.02 105.19 103.48 1q9t n GLY 151 Ca -0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 1q9t n GLY 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1q9t s SER 152 N -2.47 4.31 0.39 1.61 1.04 -0.57 -5.00 113.70 113.02 1q9t s SER 152 Ca 0.00 -0.16 -0.26 0.00 0.48 0.00 0.00 55.95 56.01 1q9t s SER 152 Cb 0.00 -0.96 -0.09 0.00 0.10 0.00 0.00 66.02 65.07 1q9t s SER 152 CO 0.00 0.32 1.24 -0.70 0.98 0.00 0.00 173.24 175.08 1q9t s GLU 153 N -1.01 4.05 -0.05 4.02 2.12 -1.26 -0.99 118.70 125.58 1q9t s GLU 153 Ca 0.14 2.01 0.03 0.00 0.36 0.00 0.00 54.97 57.50 1q9t s GLU 153 Cb -0.11 -2.76 0.01 0.00 0.26 0.00 0.00 34.13 31.53 1q9t s GLU 153 CO 0.03 -0.37 -0.12 0.50 -0.54 0.00 0.00 175.26 174.76 1q9t s ARG 154 N -2.20 1.51 -0.07 4.30 3.52 -0.15 -4.90 118.95 120.95 1q9t s ARG 154 Ca 0.56 -0.40 0.08 0.00 -0.13 0.00 0.00 55.73 55.84 1q9t s ARG 154 Cb -0.35 -1.29 -0.12 0.00 -1.56 0.00 0.00 34.95 31.64 1q9t s ARG 154 CO 0.44 0.07 0.07 1.04 -0.81 0.00 0.00 175.30 176.11 1q9t n GLN 155 N 3.62 2.08 -2.29 5.12 6.02 -1.26 -4.22 117.38 126.45 1q9t n GLN 155 Ca -0.21 -0.02 -0.41 0.00 -0.01 0.00 0.00 57.00 56.35 1q9t n GLN 155 Cb 0.52 -1.22 -0.03 0.00 1.02 0.00 0.00 30.24 30.53 1q9t n GLN 155 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1q9t s ASN 156 N -3.85 7.01 0.00 1.08 2.47 -1.26 -3.54 114.94 116.85 1q9t s ASN 156 Ca -0.04 2.42 0.00 0.00 0.42 0.00 0.00 52.86 55.66 1q9t s ASN 156 Cb 0.03 -2.63 0.00 0.00 -1.45 0.00 0.00 41.25 37.21 1q9t s ASN 156 CO 0.36 -0.38 0.00 0.61 -3.72 0.00 0.00 177.10 173.97 1q9t n GLY 157 N 1.48 0.65 3.81 1.21 0.00 -1.26 -4.84 105.19 106.23 1q9t n GLY 157 Ca 0.02 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.27 1q9t n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1q9t s VAL 158 N -2.00 5.35 -0.21 1.61 1.01 -1.23 -0.94 120.40 123.98 1q9t s VAL 158 Ca 0.00 0.42 0.02 0.00 0.00 0.00 0.00 61.98 62.42 1q9t s VAL 158 Cb 0.00 -3.53 0.04 0.00 0.00 0.00 0.00 36.38 32.89 1q9t s VAL 158 CO 0.00 0.53 -0.16 -0.76 0.00 0.00 0.00 175.10 174.71 1q9t s LEU 159 N -0.46 2.62 -0.05 3.92 2.01 0.51 -4.95 118.68 122.28 1q9t s LEU 159 Ca 0.16 -0.95 0.03 0.00 0.01 0.00 0.00 54.13 53.38 1q9t s LEU 159 Cb -0.13 -1.48 -0.03 0.00 0.01 0.00 0.00 46.19 44.57 1q9t s LEU 159 CO 0.05 -0.08 -0.13 0.20 1.01 0.00 0.00 176.35 177.40 1q9t s ASN 160 N 1.23 4.15 -0.12 2.29 0.02 -1.26 -0.40 114.94 120.85 1q9t s ASN 160 Ca -0.01 -0.16 -0.06 0.00 -1.02 0.00 0.00 52.86 51.62 1q9t s ASN 160 Cb -0.16 -0.92 0.06 0.00 0.02 0.00 0.00 41.25 40.25 1q9t s ASN 160 CO -0.10 0.35 0.28 -0.55 0.02 0.00 0.00 177.10 177.10 1q9t s SER 161 N -0.74 -0.06 -0.02 -1.22 0.15 -0.27 -4.98 113.70 106.56 1q9t s SER 161 Ca 0.11 0.61 -0.02 0.00 0.70 0.00 0.00 55.95 57.35 1q9t s SER 161 Cb -0.11 0.59 -0.04 0.00 -1.71 0.00 0.00 66.02 64.75 1q9t s SER 161 CO 0.01 -0.20 0.13 0.26 1.20 0.00 0.00 173.24 174.64 1q9t s TRP 162 N 1.76 3.44 0.65 3.44 0.51 -1.26 -0.56 118.94 126.91 1q9t s TRP 162 Ca -0.05 0.31 -0.06 0.00 -2.12 0.00 0.00 56.10 54.17 1q9t s TRP 162 Cb -0.11 -1.80 0.03 0.00 -0.81 0.00 0.00 33.47 30.78 1q9t s TRP 162 CO -0.09 0.61 0.96 0.95 -0.51 0.00 0.00 176.95 178.87 1q9t s THR 163 N -1.23 3.01 0.76 2.01 -4.23 -0.65 -5.00 115.64 110.30 1q9t s THR 163 Ca 0.24 -0.11 -0.11 0.00 -1.18 0.00 0.00 61.69 60.53 1q9t s THR 163 Cb -0.12 -3.24 0.05 0.00 1.34 0.00 0.00 72.50 70.52 1q9t s THR 163 CO 0.15 -0.26 1.08 -1.81 -0.54 0.00 0.00 174.62 173.24 1q9t s ASP 164 N -4.40 4.80 0.60 3.99 -0.00 -1.26 -4.64 116.67 115.76 1q9t s ASP 164 Ca 0.57 1.47 -0.19 0.00 -0.00 0.00 0.00 52.55 54.40 1q9t s ASP 164 Cb -0.11 -2.25 -0.04 0.00 -0.00 0.00 0.00 42.92 40.52 1q9t s ASP 164 CO 0.45 -1.80 1.09 1.67 -0.00 0.00 0.00 175.17 176.59 1q9t n GLN 165 N -3.34 1.05 -2.55 8.23 7.27 -1.26 -4.77 117.38 122.01 1q9t n GLN 165 Ca 0.07 0.40 -0.42 0.00 0.07 0.00 0.00 57.00 57.13 1q9t n GLN 165 Cb 0.55 -2.30 -0.03 0.00 2.41 0.00 0.00 30.24 30.87 1q9t n GLN 165 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1q9t s ASP 166 N -1.23 7.20 0.17 1.69 2.15 0.06 -4.92 116.67 121.78 1q9t s ASP 166 Ca 0.77 1.84 0.19 0.00 0.43 0.00 0.00 52.55 55.77 1q9t s ASP 166 Cb -0.41 -2.57 0.81 0.00 -0.30 0.00 0.00 42.92 40.45 1q9t s ASP 166 CO 0.46 -0.39 1.57 -1.20 -0.17 0.00 0.00 175.17 175.43 1q9t n SER 167 N 4.06 0.40 -0.08 -0.34 7.64 -1.26 -1.36 113.62 122.67 1q9t n SER 167 Ca 0.08 0.61 -0.14 0.00 1.01 0.00 0.00 58.87 60.44 1q9t n SER 167 Cb 0.48 -0.69 -0.05 0.00 -1.01 0.00 0.00 64.21 62.94 1q9t n SER 167 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1q9t n LYS 168 N -1.96 0.43 -0.09 1.43 4.81 -1.26 -2.75 118.16 118.78 1q9t n LYS 168 Ca 0.02 0.18 0.10 0.00 -0.87 0.00 0.00 58.31 57.74 1q9t n LYS 168 Cb 0.17 -1.24 0.14 0.00 0.02 0.00 0.00 35.03 34.11 1q9t n LYS 168 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1q9t n ASP 169 N -4.13 2.96 -1.84 3.14 3.85 -1.25 -4.89 116.55 114.39 1q9t n ASP 169 Ca -0.24 -1.89 -0.21 0.00 -0.71 0.00 0.00 54.79 51.75 1q9t n ASP 169 Cb 0.57 -0.11 -0.06 0.00 -1.35 0.00 0.00 41.12 40.16 1q9t n ASP 169 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 1q9t n SER 170 N 1.20 -5.62 -5.01 -1.12 7.64 -0.46 -4.96 113.62 105.30 1q9t n SER 170 Ca 0.14 0.34 -0.19 0.00 1.01 0.00 0.00 58.87 60.17 1q9t n SER 170 Cb 0.53 -4.83 0.03 0.00 -1.01 0.00 0.00 64.21 58.92 1q9t n SER 170 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1q9t s THR 171 N -2.85 2.53 0.34 0.44 -4.23 -1.26 -4.64 115.64 105.96 1q9t s THR 171 Ca 0.00 -1.05 0.10 0.00 -1.18 0.00 0.00 61.69 59.56 1q9t s THR 171 Cb 0.00 -2.58 -0.06 0.00 1.34 0.00 0.00 72.50 71.20 1q9t s THR 171 CO 0.00 0.00 -0.07 -0.31 -0.54 0.00 0.00 174.62 173.70 1q9t s TYR 172 N -2.52 2.45 0.04 3.99 1.51 0.53 -0.76 117.35 122.59 1q9t s TYR 172 Ca 0.56 -0.46 -0.01 0.00 -1.01 0.00 0.00 57.07 56.15 1q9t s TYR 172 Cb -0.07 -1.39 -0.04 0.00 -0.11 0.00 0.00 41.96 40.36 1q9t s TYR 172 CO 0.35 0.56 -0.03 -1.12 -1.11 0.00 0.00 175.55 174.20 1q9t s SER 173 N -3.64 0.44 -0.02 2.29 0.01 -1.26 -0.61 113.70 110.91 1q9t s SER 173 Ca 0.33 -0.90 -0.09 0.00 1.31 0.00 0.00 55.95 56.60 1q9t s SER 173 Cb 0.01 0.18 0.01 0.00 0.21 0.00 0.00 66.02 66.43 1q9t s SER 173 CO 0.17 -0.54 0.19 -0.32 0.41 0.00 0.00 173.24 173.16 1q9t s MET 174 N -3.44 0.48 -0.03 12.44 0.00 0.16 -1.64 119.30 127.27 1q9t s MET 174 Ca 0.03 -0.21 0.07 0.00 0.00 0.00 0.00 55.69 55.58 1q9t s MET 174 Cb 0.04 0.21 -0.02 0.00 0.00 0.00 0.00 34.83 35.07 1q9t s MET 174 CO -0.08 -0.11 -0.25 0.45 0.00 0.00 0.00 175.02 175.02 1q9t s SER 175 N -1.07 3.03 -0.09 1.11 0.15 0.27 -0.84 113.70 116.27 1q9t s SER 175 Ca -0.11 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.06 1q9t s SER 175 Cb -0.06 -0.53 0.02 0.00 -1.71 0.00 0.00 66.02 63.74 1q9t s SER 175 CO 0.02 0.29 -0.08 -0.55 1.20 0.00 0.00 173.24 174.12 1q9t s SER 176 N -0.43 1.92 -0.13 5.45 0.15 0.18 -1.11 113.70 119.73 1q9t s SER 176 Ca 0.05 -0.27 0.02 0.00 0.70 0.00 0.00 55.95 56.45 1q9t s SER 176 Cb -0.11 -0.77 0.01 0.00 -1.71 0.00 0.00 66.02 63.44 1q9t s SER 176 CO 0.01 -0.08 -0.19 -0.89 1.20 0.00 0.00 173.24 173.28 1q9t s THR 177 N 1.41 1.83 -0.26 6.45 2.01 0.46 -0.25 115.64 127.29 1q9t s THR 177 Ca -0.01 -0.84 -0.09 0.00 0.31 0.00 0.00 61.69 61.06 1q9t s THR 177 Cb -0.13 -1.64 -0.04 0.00 0.01 0.00 0.00 72.50 70.70 1q9t s THR 177 CO -0.04 0.51 0.12 -0.22 -0.69 0.00 0.00 174.62 174.29 1q9t s LEU 178 N 0.88 3.66 -0.18 4.42 2.96 0.29 -0.36 118.68 130.35 1q9t s LEU 178 Ca -0.07 -0.14 -0.03 0.00 -0.22 0.00 0.00 54.13 53.68 1q9t s LEU 178 Cb -0.15 -2.00 -0.02 0.00 0.50 0.00 0.00 46.19 44.52 1q9t s LEU 178 CO -0.02 -0.04 -0.06 -0.89 -1.32 0.00 0.00 176.35 174.02 1q9t s THR 179 N 1.67 3.51 0.34 3.68 2.01 -0.12 -0.32 115.64 126.40 1q9t s THR 179 Ca 0.07 -0.48 0.04 0.00 0.31 0.00 0.00 61.69 61.63 1q9t s THR 179 Cb -0.15 -2.55 -0.06 0.00 0.01 0.00 0.00 72.50 69.75 1q9t s THR 179 CO 0.06 0.47 0.07 -0.76 -0.69 0.00 0.00 174.62 173.77 1q9t s LEU 180 N 0.81 2.15 0.47 4.42 1.43 0.18 -4.74 118.68 123.40 1q9t s LEU 180 Ca -0.02 -1.42 -0.07 0.00 -1.03 0.00 0.00 54.13 51.59 1q9t s LEU 180 Cb -0.15 -0.35 -0.04 0.00 0.03 0.00 0.00 46.19 45.68 1q9t s LEU 180 CO 0.02 -0.66 0.80 0.42 0.23 0.00 0.00 176.35 177.16 1q9t s THR 181 N -3.28 4.86 0.31 5.49 -4.23 -1.26 -0.78 115.64 116.75 1q9t s THR 181 Ca 0.34 0.38 -0.01 0.00 -1.18 0.00 0.00 61.69 61.22 1q9t s THR 181 Cb 0.08 -3.83 0.26 0.00 1.34 0.00 0.00 72.50 70.35 1q9t s THR 181 CO 0.15 -0.78 1.97 0.50 -0.54 0.00 0.00 174.62 175.92 1q9t h LYS 182 N 0.48 1.01 -0.62 3.99 3.64 -1.30 -0.97 116.57 122.81 1q9t h LYS 182 Ca -0.47 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 1q9t h LYS 182 Cb 1.20 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 32.76 1q9t h LYS 182 CO 0.62 0.68 0.40 -0.44 -2.27 0.00 0.00 179.45 178.44 1q9t h ASP 183 N 1.03 0.72 -0.30 4.20 3.32 -1.93 -1.22 116.42 122.25 1q9t h ASP 183 Ca 0.28 -0.03 -0.17 0.00 0.02 0.00 0.00 57.03 57.13 1q9t h ASP 183 Cb -0.10 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.27 1q9t h ASP 183 CO -0.06 0.53 -0.46 -0.08 -1.72 0.00 0.00 179.24 177.46 1q9t h GLU 184 N 0.84 0.83 -0.93 3.56 4.57 -1.83 -3.10 114.58 118.52 1q9t h GLU 184 Ca 0.23 -0.50 0.06 0.00 -1.18 0.00 0.00 59.36 57.97 1q9t h GLU 184 Cb -0.08 0.05 -0.06 0.00 -0.16 0.00 0.00 28.75 28.50 1q9t h GLU 184 CO -0.05 1.14 0.59 -0.92 -1.18 0.00 0.00 179.01 178.59 1q9t h TYR 185 N 0.61 1.09 0.00 0.92 3.20 -0.95 -1.86 116.97 119.99 1q9t h TYR 185 Ca 0.03 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1q9t h TYR 185 Cb 1.06 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 38.98 1q9t h TYR 185 CO 0.07 0.56 0.00 0.39 -1.64 0.00 0.00 178.16 177.54 1q9t n GLU 186 N -4.56 0.52 0.00 1.82 1.02 -0.48 -2.92 120.64 116.04 1q9t n GLU 186 Ca 0.14 0.04 0.12 0.00 -0.02 0.00 0.00 57.16 57.43 1q9t n GLU 186 Cb 0.18 -1.50 0.18 0.00 -0.02 0.00 0.00 31.44 30.28 1q9t n GLU 186 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1q9t n ARG 187 N -1.16 0.00 -4.36 3.49 1.74 -0.70 -4.93 116.66 110.75 1q9t n ARG 187 Ca 0.14 -0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 57.03 1q9t n ARG 187 Cb 0.14 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 29.98 1q9t n ARG 187 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1q9t s HIS 188 N -3.00 1.74 -0.05 -1.55 3.76 -1.15 -5.09 115.29 109.95 1q9t s HIS 188 Ca 0.10 -0.61 -0.08 0.00 -0.15 0.00 0.00 55.06 54.33 1q9t s HIS 188 Cb 0.17 -0.85 -0.03 0.00 1.11 0.00 0.00 32.58 32.99 1q9t s HIS 188 CO 0.73 0.33 -0.15 -1.71 -0.85 0.00 0.00 174.74 173.09 1q9t n ASN 189 N -0.41 1.08 -4.67 1.40 4.05 -1.26 -4.68 115.26 110.77 1q9t n ASN 189 Ca -0.07 0.17 -0.43 0.00 0.45 0.00 0.00 54.58 54.70 1q9t n ASN 189 Cb 0.61 -0.50 -0.02 0.00 1.23 0.00 0.00 39.78 41.09 1q9t n ASN 189 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 1q9t s SER 190 N -5.40 7.06 -0.18 1.20 0.15 -1.26 0.15 113.70 115.42 1q9t s SER 190 Ca -0.12 1.61 0.01 0.00 0.70 0.00 0.00 55.95 58.15 1q9t s SER 190 Cb 0.02 -2.55 0.03 0.00 -1.71 0.00 0.00 66.02 61.81 1q9t s SER 190 CO 0.18 -0.64 -0.18 -0.31 1.20 0.00 0.00 173.24 173.49 1q9t s TYR 191 N 2.85 2.72 -0.01 3.44 2.02 0.03 -0.59 117.35 127.82 1q9t s TYR 191 Ca 0.51 -1.65 0.04 0.00 -0.37 0.00 0.00 57.07 55.60 1q9t s TYR 191 Cb -0.20 -1.86 -0.01 0.00 -0.40 0.00 0.00 41.96 39.49 1q9t s TYR 191 CO 0.15 -0.79 -0.13 0.99 -1.57 0.00 0.00 175.55 174.19 1q9t s THR 192 N 1.30 1.03 -0.26 -0.71 2.01 0.10 -1.58 115.64 117.53 1q9t s THR 192 Ca 0.03 -0.56 -0.03 0.00 0.31 0.00 0.00 61.69 61.44 1q9t s THR 192 Cb -0.14 -0.86 0.02 0.00 0.01 0.00 0.00 72.50 71.53 1q9t s THR 192 CO -0.12 0.29 -0.01 0.00 -0.69 0.00 0.00 174.62 174.09 1q9t s GLU 194 N 1.39 3.06 -0.24 0.00 2.02 0.02 -1.54 118.70 123.41 1q9t s GLU 194 Ca 0.01 -0.83 -0.07 0.00 0.02 0.00 0.00 54.97 54.10 1q9t s GLU 194 Cb -0.17 -2.99 -0.03 0.00 0.10 0.00 0.00 34.13 31.04 1q9t s GLU 194 CO -0.02 -0.32 0.05 0.00 0.02 0.00 0.00 175.26 174.99 1q9t s ALA 195 N 1.39 3.11 -0.22 5.21 0.00 0.59 -1.18 121.76 130.67 1q9t s ALA 195 Ca 0.03 -1.11 -0.04 0.00 0.00 0.00 0.00 51.96 50.84 1q9t s ALA 195 Cb -0.16 -2.00 -0.01 0.00 0.00 0.00 0.00 23.12 20.95 1q9t s ALA 195 CO -0.04 -0.43 -0.04 0.99 0.00 0.00 0.00 175.76 176.24 1q9t s THR 196 N 1.51 3.45 0.07 0.00 2.01 0.71 -0.53 115.64 122.87 1q9t s THR 196 Ca 0.06 -0.47 0.04 0.00 0.31 0.00 0.00 61.69 61.63 1q9t s THR 196 Cb -0.15 -2.57 -0.03 0.00 0.01 0.00 0.00 72.50 69.77 1q9t s THR 196 CO 0.03 0.43 -0.13 -2.28 -0.69 0.00 0.00 174.62 171.98 1q9t s HIS 197 N 1.38 1.11 0.07 4.92 2.46 -1.26 -1.52 115.29 122.45 1q9t s HIS 197 Ca 0.05 -0.50 0.25 0.00 0.47 0.00 0.00 55.06 55.33 1q9t s HIS 197 Cb -0.14 -0.62 1.38 0.00 -0.13 0.00 0.00 32.58 33.06 1q9t s HIS 197 CO -0.02 0.03 1.76 1.57 -2.47 0.00 0.00 174.74 175.61 1q9t h LYS 198 N 4.18 0.00 0.00 2.88 2.10 -1.95 -2.10 116.57 121.69 1q9t h LYS 198 Ca -0.39 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.26 1q9t h LYS 198 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1q9t h LYS 198 CO 0.43 0.00 0.00 0.25 -2.00 0.00 0.00 179.45 178.13 1q9t n THR 199 N -2.43 1.02 -3.60 0.07 -2.24 -1.26 -4.76 114.28 101.09 1q9t n THR 199 Ca -0.02 0.26 -0.16 0.00 -2.27 0.00 0.00 64.05 61.86 1q9t n THR 199 Cb 0.11 -1.02 -0.07 0.00 -2.10 0.00 0.00 70.33 67.25 1q9t n THR 199 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1q9t s SER 200 N -2.96 -0.66 0.19 3.42 0.15 -0.79 -4.97 113.70 108.08 1q9t s SER 200 Ca 0.07 1.03 0.26 0.00 0.70 0.00 0.00 55.95 58.01 1q9t s SER 200 Cb 0.09 0.98 0.87 0.00 -1.71 0.00 0.00 66.02 66.25 1q9t s SER 200 CO 0.25 -0.40 1.79 0.35 1.20 0.00 0.00 173.24 176.43 1q9t n THR 201 N 1.90 0.54 -3.45 6.45 -2.24 -1.26 -4.50 114.28 111.72 1q9t n THR 201 Ca -0.16 -0.22 -0.38 0.00 -2.27 0.00 0.00 64.05 61.02 1q9t n THR 201 Cb 0.56 -0.61 -0.08 0.00 -2.10 0.00 0.00 70.33 68.10 1q9t n THR 201 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1q9t s SER 202 N -4.33 6.39 0.66 3.42 0.01 -1.26 -5.07 113.70 113.51 1q9t s SER 202 Ca 0.11 0.45 -0.14 0.00 1.31 0.00 0.00 55.95 57.68 1q9t s SER 202 Cb 0.13 -2.20 -0.00 0.00 0.21 0.00 0.00 66.02 64.15 1q9t s SER 202 CO 0.58 -0.02 1.09 -2.84 0.41 0.00 0.00 173.24 172.46 1q9t s PRO 203 N 1.12 2.86 -0.19 12.44 0.02 -1.26 -4.85 135.00 145.14 1q9t s PRO 203 Ca 0.17 1.31 -0.17 0.00 0.02 0.00 0.00 61.00 62.33 1q9t s PRO 203 Cb -0.14 -1.96 -0.04 0.00 0.02 0.00 0.00 34.50 32.38 1q9t s PRO 203 CO 0.07 -1.19 0.43 0.42 -0.33 0.00 0.00 177.00 176.40 1q9t s ILE 204 N -2.45 5.18 -0.13 2.83 1.09 0.31 -4.89 121.20 123.14 1q9t s ILE 204 Ca 0.65 0.79 0.02 0.00 -1.10 0.00 0.00 60.65 61.01 1q9t s ILE 204 Cb -0.19 -3.76 -0.00 0.00 -1.06 0.00 0.00 42.46 37.45 1q9t s ILE 204 CO 0.43 0.25 -0.19 -0.69 -0.10 0.00 0.00 174.94 174.63 1q9t s VAL 205 N 1.27 2.43 -0.03 2.92 1.01 -1.26 -0.30 120.40 126.44 1q9t s VAL 205 Ca 0.21 -0.87 0.05 0.00 0.00 0.00 0.00 61.98 61.36 1q9t s VAL 205 Cb -0.15 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.24 1q9t s VAL 205 CO 0.08 0.54 -0.17 -0.54 0.00 0.00 0.00 175.10 175.02 1q9t s LYS 206 N 0.55 1.57 0.21 2.72 -0.14 -0.59 -5.01 119.74 119.07 1q9t s LYS 206 Ca -0.11 -0.59 -0.14 0.00 -1.36 0.00 0.00 55.97 53.77 1q9t s LYS 206 Cb -0.16 -1.43 0.01 0.00 -1.68 0.00 0.00 37.83 34.57 1q9t s LYS 206 CO 0.04 0.29 0.46 0.45 -0.76 0.00 0.00 175.35 175.82 1q9t s SER 207 N -0.13 -0.12 0.07 2.83 0.15 -1.26 -0.81 113.70 114.43 1q9t s SER 207 Ca 0.00 -0.77 -0.21 0.00 0.70 0.00 0.00 55.95 55.68 1q9t s SER 207 Cb -0.09 0.56 0.05 0.00 -1.71 0.00 0.00 66.02 64.82 1q9t s SER 207 CO 0.01 -1.07 0.49 0.72 1.20 0.00 0.00 173.24 174.60 1q9t s PHE 208 N -3.96 -0.38 -0.14 3.44 -0.71 -0.61 -5.01 117.98 110.61 1q9t s PHE 208 Ca 0.17 0.31 -0.02 0.00 -1.04 0.00 0.00 56.93 56.35 1q9t s PHE 208 Cb -0.00 0.34 -0.02 0.00 -1.21 0.00 0.00 43.02 42.12 1q9t s PHE 208 CO 0.03 -0.67 -0.07 -0.80 -1.34 0.00 0.00 175.22 172.37 1q9t s ASN 209 N -2.23 4.52 0.17 1.98 0.01 -1.26 -0.79 114.94 117.35 1q9t s ASN 209 Ca -0.03 -0.19 -0.14 0.00 -0.71 0.00 0.00 52.86 51.79 1q9t s ASN 209 Cb -0.00 -1.69 0.10 0.00 0.41 0.00 0.00 41.25 40.06 1q9t s ASN 209 CO -0.05 0.18 1.81 -0.09 -1.51 0.00 0.00 177.10 177.44 1q9t h ARG 210 N 6.62 0.56 0.00 -0.60 2.43 -0.57 -2.23 114.38 120.59 1q9t h ARG 210 Ca -0.30 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.84 1q9t h ARG 210 Cb 1.20 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 1q9t h ARG 210 CO 0.60 0.37 0.00 0.27 -1.51 0.00 0.00 179.97 179.70 1q9t n ASN 211 N -4.82 0.02 -0.91 -3.80 0.23 -1.26 -1.07 115.26 103.66 1q9t n ASN 211 Ca 0.03 0.51 0.08 0.00 -0.53 0.00 0.00 54.58 54.67 1q9t n ASN 211 Cb 0.08 -0.51 0.24 0.00 -2.08 0.00 0.00 39.78 37.51 1q9t n ASN 211 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1q9t n GLU 212 N -1.53 3.06 0.00 -3.83 1.02 -0.84 -5.24 120.64 113.27 1q9t n GLU 212 Ca 0.01 -2.65 0.15 0.00 -0.02 0.00 0.00 57.16 54.66 1q9t n GLU 212 Cb 0.08 -1.71 0.71 0.00 -0.02 0.00 0.00 31.44 30.49 1q9t n GLU 212 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31