#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q0x s ALA 2 N 0.00 2.05 -0.17 2.24 0.00 -1.26 -5.01 121.76 119.61 1q0x s ALA 2 Ca 0.00 0.77 -0.02 0.00 0.00 0.00 0.00 51.96 52.71 1q0x s ALA 2 Cb 0.00 -3.44 -0.01 0.00 0.00 0.00 0.00 23.12 19.67 1q0x s ALA 2 CO 0.00 -1.96 -0.10 0.08 0.00 0.00 0.00 175.76 173.78 1q0x s VAL 3 N -2.18 3.08 -0.21 0.00 1.01 -1.26 -4.98 120.40 115.87 1q0x s VAL 3 Ca 0.72 -0.62 -0.08 0.00 0.00 0.00 0.00 61.98 62.00 1q0x s VAL 3 Cb -0.27 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 1q0x s VAL 3 CO 0.48 0.49 0.08 -0.69 0.00 0.00 0.00 175.10 175.46 1q0x s VAL 4 N 0.91 4.81 -0.07 2.92 1.01 -1.26 -1.20 120.40 127.51 1q0x s VAL 4 Ca -0.02 -0.02 0.04 0.00 0.00 0.00 0.00 61.98 61.98 1q0x s VAL 4 Cb -0.15 -3.20 -0.02 0.00 0.00 0.00 0.00 36.38 33.02 1q0x s VAL 4 CO -0.00 0.41 -0.19 -0.89 0.00 0.00 0.00 175.10 174.43 1q0x s THR 5 N 0.77 2.59 0.19 3.92 2.01 0.64 -3.90 115.64 121.86 1q0x s THR 5 Ca 0.04 -0.87 0.06 0.00 0.31 0.00 0.00 61.69 61.24 1q0x s THR 5 Cb -0.13 -2.01 -0.05 0.00 0.01 0.00 0.00 72.50 70.32 1q0x s THR 5 CO 0.02 0.56 -0.12 -1.10 -0.69 0.00 0.00 174.62 173.29 1q0x s GLN 6 N -0.18 1.24 0.46 4.92 -0.21 -1.26 -0.80 119.66 123.82 1q0x s GLN 6 Ca -0.02 -1.55 -0.25 0.00 0.02 0.00 0.00 55.36 53.57 1q0x s GLN 6 Cb -0.14 -0.93 -0.08 0.00 1.00 0.00 0.00 33.01 32.87 1q0x s GLN 6 CO 0.03 0.14 1.39 -1.21 -2.12 0.00 0.00 175.29 173.52 1q0x s GLU 7 N -3.69 3.65 0.12 2.91 8.01 -1.26 -4.88 118.70 123.56 1q0x s GLU 7 Ca 0.21 2.34 -0.10 0.00 0.01 0.00 0.00 54.97 57.43 1q0x s GLU 7 Cb 0.01 -2.61 -0.12 0.00 -4.31 0.00 0.00 34.13 27.10 1q0x s GLU 7 CO 0.05 -0.82 1.32 0.66 0.01 0.00 0.00 175.26 176.48 1q0x h SER 8 N 2.25 0.85 -4.98 -0.19 4.64 -1.96 -3.32 113.55 110.83 1q0x h SER 8 Ca -0.51 -0.57 -0.08 0.00 -0.47 0.00 0.00 61.79 60.16 1q0x h SER 8 Cb 1.27 -0.25 -0.19 0.00 -0.31 0.00 0.00 62.40 62.91 1q0x h SER 8 CO 0.61 1.36 -0.01 0.00 -0.87 0.00 0.00 176.83 177.92 1q0x s ALA 9 N -3.68 -1.36 -0.01 5.18 0.00 -1.26 -1.59 121.76 119.04 1q0x s ALA 9 Ca -0.09 0.91 -0.09 0.00 0.00 0.00 0.00 51.96 52.69 1q0x s ALA 9 Cb 0.09 0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.23 1q0x s ALA 9 CO 0.89 -0.32 0.19 -0.51 0.00 0.00 0.00 175.76 176.01 1q0x s LEU 11 N -1.22 1.34 -0.01 0.00 1.43 -0.75 -4.92 118.68 114.54 1q0x s LEU 11 Ca -0.12 -0.05 0.06 0.00 -1.03 0.00 0.00 54.13 52.99 1q0x s LEU 11 Cb -0.02 0.82 -0.02 0.00 0.03 0.00 0.00 46.19 47.00 1q0x s LEU 11 CO 0.07 -0.35 -0.21 -0.89 0.23 0.00 0.00 176.35 175.21 1q0x s THR 12 N -1.17 1.63 0.26 5.49 2.01 -1.26 -1.13 115.64 121.47 1q0x s THR 12 Ca -0.12 -0.89 -0.05 0.00 0.31 0.00 0.00 61.69 60.93 1q0x s THR 12 Cb -0.06 -1.35 -0.01 0.00 0.01 0.00 0.00 72.50 71.08 1q0x s THR 12 CO 0.02 0.45 0.37 0.28 -0.69 0.00 0.00 174.62 175.05 1q0x s THR 13 N -0.49 0.00 0.24 -0.82 -1.32 -0.33 -4.97 115.64 107.95 1q0x s THR 13 Ca 0.08 -1.66 0.09 0.00 -1.21 0.00 0.00 61.69 58.99 1q0x s THR 13 Cb -0.08 -2.43 -0.05 0.00 -1.51 0.00 0.00 72.50 68.43 1q0x s THR 13 CO -0.01 0.00 -0.16 -0.44 -2.21 0.00 0.00 174.62 171.80 1q0x s SER 14 N -3.14 3.04 0.24 8.08 0.01 -1.26 -1.24 113.70 119.43 1q0x s SER 14 Ca 0.30 -1.04 -0.31 0.00 1.31 0.00 0.00 55.95 56.22 1q0x s SER 14 Cb 0.02 -0.21 -0.14 0.00 0.21 0.00 0.00 66.02 65.90 1q0x s SER 14 CO 0.14 -0.10 1.30 -2.65 0.41 0.00 0.00 173.24 172.34 1q0x n PRO 15 N -0.50 1.79 0.00 12.44 -0.02 -1.26 -1.94 135.00 145.51 1q0x n PRO 15 Ca -0.06 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 1q0x n PRO 15 Cb 0.60 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 1q0x n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1q0x n GLY 16 N 1.86 2.42 3.93 -1.23 0.00 0.84 -4.88 105.19 108.13 1q0x n GLY 16 Ca 0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 1q0x n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q0x s GLU 17 N -0.46 2.46 -0.15 1.61 2.02 -0.82 -3.94 118.70 119.41 1q0x s GLU 17 Ca 0.00 -0.24 -0.06 0.00 0.02 0.00 0.00 54.97 54.69 1q0x s GLU 17 Cb 0.00 -2.24 -0.04 0.00 0.10 0.00 0.00 34.13 31.95 1q0x s GLU 17 CO 0.00 -1.01 0.06 0.99 0.02 0.00 0.00 175.26 175.32 1q0x s THR 18 N -3.11 4.81 0.02 3.63 2.01 -1.26 -0.59 115.64 121.15 1q0x s THR 18 Ca 0.58 -0.04 0.04 0.00 0.31 0.00 0.00 61.69 62.58 1q0x s THR 18 Cb -0.11 -3.13 -0.02 0.00 0.01 0.00 0.00 72.50 69.26 1q0x s THR 18 CO 0.44 0.51 -0.12 0.54 -0.69 0.00 0.00 174.62 175.30 1q0x s VAL 19 N -0.08 0.96 -0.11 3.82 0.11 -0.63 -5.00 120.40 119.48 1q0x s VAL 19 Ca 0.07 -0.80 0.01 0.00 -2.93 0.00 0.00 61.98 58.33 1q0x s VAL 19 Cb -0.12 -0.86 0.02 0.00 -1.53 0.00 0.00 36.38 33.89 1q0x s VAL 19 CO 0.01 0.06 -0.14 -0.89 -3.33 0.00 0.00 175.10 170.81 1q0x s THR 20 N -0.66 1.40 -0.02 5.04 2.01 -1.26 -1.42 115.64 120.73 1q0x s THR 20 Ca 0.02 -0.58 -0.00 0.00 0.31 0.00 0.00 61.69 61.43 1q0x s THR 20 Cb -0.07 -1.30 -0.04 0.00 0.01 0.00 0.00 72.50 71.11 1q0x s THR 20 CO 0.01 0.42 0.05 -0.76 -0.69 0.00 0.00 174.62 173.65 1q0x s LEU 21 N 1.07 3.76 0.28 4.42 1.02 0.06 -4.95 118.68 124.34 1q0x s LEU 21 Ca -0.05 0.12 0.10 0.00 0.02 0.00 0.00 54.13 54.32 1q0x s LEU 21 Cb -0.15 -2.12 -0.05 0.00 0.02 0.00 0.00 46.19 43.89 1q0x s LEU 21 CO -0.02 0.30 -0.16 0.42 0.02 0.00 0.00 176.35 176.91 1q0x s THR 22 N -1.11 2.24 -0.16 5.49 -4.23 -1.26 -0.91 115.64 115.70 1q0x s THR 22 Ca 0.20 -2.31 -0.05 0.00 -1.18 0.00 0.00 61.69 58.35 1q0x s THR 22 Cb -0.12 -2.35 0.06 0.00 1.34 0.00 0.00 72.50 71.43 1q0x s THR 22 CO 0.11 -0.38 0.09 0.00 -0.54 0.00 0.00 174.62 173.90 1q0x s ARG 24 N 2.15 2.78 -0.07 0.00 3.52 0.02 -1.59 118.95 125.76 1q0x s ARG 24 Ca 0.02 -0.70 0.01 0.00 -0.13 0.00 0.00 55.73 54.93 1q0x s ARG 24 Cb -0.16 -2.67 -0.03 0.00 -1.56 0.00 0.00 34.95 30.53 1q0x s ARG 24 CO -0.09 0.57 -0.09 0.45 -0.81 0.00 0.00 175.30 175.34 1q0x s SER 25 N -2.18 4.44 0.40 -2.12 0.15 -1.26 -0.26 113.70 112.87 1q0x s SER 25 Ca 0.26 -0.10 0.26 0.00 0.70 0.00 0.00 55.95 57.07 1q0x s SER 25 Cb -0.12 -1.16 0.69 0.00 -1.71 0.00 0.00 66.02 63.73 1q0x s SER 25 CO 0.18 0.33 1.73 0.77 1.20 0.00 0.00 173.24 177.45 1q0x h SER 26 N 5.49 0.00 0.62 5.45 4.64 -1.54 -3.16 113.55 125.05 1q0x h SER 26 Ca -0.45 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 60.70 1q0x h SER 26 Cb 1.17 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.24 1q0x h SER 26 CO 0.53 0.00 -0.77 0.74 -0.87 0.00 0.00 176.83 176.45 1q0x h THR 27 N 0.00 1.50 0.00 2.95 2.02 -1.95 -3.48 112.91 113.95 1q0x h THR 27 Ca 0.00 -2.49 0.00 0.00 0.77 0.00 0.00 66.41 64.69 1q0x h THR 27 Cb 0.80 2.35 0.00 0.00 -1.74 0.00 0.00 68.15 69.57 1q0x h THR 27 CO 0.00 0.72 0.00 0.61 0.37 0.00 0.00 175.52 177.22 1q0x n GLY 27 N 0.66 -0.48 3.76 2.16 0.00 -1.19 -5.12 105.19 104.98 1q0x n GLY 27 Ca -0.02 -0.98 -0.41 0.00 0.00 0.00 0.00 46.02 44.61 1q0x n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q0x s ALA 27 N -1.00 3.45 0.13 4.61 0.00 -1.26 -4.13 121.76 123.56 1q0x s ALA 27 Ca 0.00 1.05 -0.30 0.00 0.00 0.00 0.00 51.96 52.71 1q0x s ALA 27 Cb 0.00 -3.39 -0.06 0.00 0.00 0.00 0.00 23.12 19.66 1q0x s ALA 27 CO 0.00 -0.37 0.97 0.08 0.00 0.00 0.00 175.76 176.44 1q0x s VAL 27 N -1.06 4.39 0.33 0.00 1.01 -0.10 -5.00 120.40 119.96 1q0x s VAL 27 Ca 0.47 2.03 0.04 0.00 0.00 0.00 0.00 61.98 64.52 1q0x s VAL 27 Cb -0.35 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 31.69 1q0x s VAL 27 CO 0.45 0.34 0.15 0.42 0.00 0.00 0.00 175.10 176.46 1q0x s THR 28 N -0.16 0.42 0.16 3.92 -4.23 -1.26 -4.51 115.64 109.97 1q0x s THR 28 Ca 0.46 -2.00 0.32 0.00 -1.18 0.00 0.00 61.69 59.29 1q0x s THR 28 Cb -0.24 -2.50 0.32 0.00 1.34 0.00 0.00 72.50 71.42 1q0x s THR 28 CO 0.31 0.00 1.98 0.71 -0.54 0.00 0.00 174.62 177.07 1q0x h THR 29 N 2.12 0.00 0.00 3.99 1.35 -1.98 -0.01 112.91 118.38 1q0x h THR 29 Ca -0.34 -0.04 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 1q0x h THR 29 Cb 1.25 0.78 0.00 0.00 -1.73 0.00 0.00 68.15 68.45 1q0x h THR 29 CO 0.53 0.00 0.00 -1.20 -0.25 0.00 0.00 175.52 174.60 1q0x n SER 30 N -2.64 0.00 -0.70 5.36 7.64 -1.26 -2.34 113.62 119.68 1q0x n SER 30 Ca -0.02 -0.18 0.11 0.00 1.01 0.00 0.00 58.87 59.80 1q0x n SER 30 Cb 0.07 -0.24 0.04 0.00 -1.01 0.00 0.00 64.21 63.08 1q0x n SER 30 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1q0x n ASN 31 N -1.24 2.47 -4.14 6.43 4.13 -0.02 -4.85 115.26 118.03 1q0x n ASN 31 Ca 0.13 -1.73 -0.34 0.00 1.68 0.00 0.00 54.58 54.32 1q0x n ASN 31 Cb 0.18 0.27 -0.05 0.00 -1.54 0.00 0.00 39.78 38.63 1q0x n ASN 31 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1q0x n TYR 32 N 0.59 -1.19 -1.58 3.10 4.02 -0.99 -0.77 117.16 120.35 1q0x n TYR 32 Ca 0.11 0.38 -0.52 0.00 -0.01 0.00 0.00 57.90 57.86 1q0x n TYR 32 Cb 0.53 -2.56 -0.06 0.00 -0.02 0.00 0.00 39.34 37.23 1q0x n TYR 32 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1q0x n ALA 33 N -4.46 -1.20 -2.59 -0.72 0.00 -1.26 -3.81 120.51 106.46 1q0x n ALA 33 Ca -0.23 0.52 -0.28 0.00 0.00 0.00 0.00 53.44 53.45 1q0x n ALA 33 Cb 0.60 -2.04 -0.09 0.00 0.00 0.00 0.00 19.45 17.92 1q0x n ALA 33 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1q0x s ASN 34 N 0.35 4.39 -0.05 0.00 0.02 -0.12 -1.31 114.94 118.23 1q0x s ASN 34 Ca 0.83 -0.49 0.00 0.00 -1.02 0.00 0.00 52.86 52.18 1q0x s ASN 34 Cb -0.97 -0.81 0.03 0.00 0.02 0.00 0.00 41.25 39.52 1q0x s ASN 34 CO 0.49 0.12 -0.01 0.26 0.02 0.00 0.00 177.10 177.98 1q0x s TRP 35 N -1.56 0.55 0.17 2.20 0.52 -0.46 -1.33 118.94 119.03 1q0x s TRP 35 Ca 0.24 -0.11 0.07 0.00 0.02 0.00 0.00 56.10 56.33 1q0x s TRP 35 Cb -0.10 -0.61 -0.04 0.00 -1.15 0.00 0.00 33.47 31.57 1q0x s TRP 35 CO 0.15 -0.21 -0.15 0.14 0.02 0.00 0.00 176.95 176.90 1q0x s VAL 36 N 1.29 1.63 -0.12 4.03 -7.23 -0.13 -0.79 120.40 119.07 1q0x s VAL 36 Ca -0.06 -1.99 0.03 0.00 -1.81 0.00 0.00 61.98 58.16 1q0x s VAL 36 Cb -0.13 -1.84 0.00 0.00 0.56 0.00 0.00 36.38 34.97 1q0x s VAL 36 CO -0.02 -0.47 -0.23 -1.58 -0.31 0.00 0.00 175.10 172.49 1q0x s GLN 37 N -3.14 3.03 -0.24 4.82 0.74 0.54 -1.26 119.66 124.16 1q0x s GLN 37 Ca 0.17 -0.87 -0.03 0.00 0.05 0.00 0.00 55.36 54.68 1q0x s GLN 37 Cb -0.03 -2.35 0.00 0.00 1.10 0.00 0.00 33.01 31.73 1q0x s GLN 37 CO 0.05 0.09 -0.04 -2.00 -0.55 0.00 0.00 175.29 172.85 1q0x s GLU 38 N 0.55 3.18 0.33 1.67 2.12 0.26 -0.86 118.70 125.96 1q0x s GLU 38 Ca -0.14 -0.76 0.07 0.00 0.36 0.00 0.00 54.97 54.51 1q0x s GLU 38 Cb -0.17 -3.03 -0.02 0.00 0.26 0.00 0.00 34.13 31.17 1q0x s GLU 38 CO 0.04 -0.28 0.34 0.15 -0.54 0.00 0.00 175.26 174.97 1q0x s LYS 39 N 1.43 2.86 0.30 4.30 1.02 0.31 -1.34 119.74 128.62 1q0x s LYS 39 Ca 0.04 -1.20 -0.24 0.00 0.02 0.00 0.00 55.97 54.59 1q0x s LYS 39 Cb -0.15 -2.58 -0.16 0.00 -0.52 0.00 0.00 37.83 34.41 1q0x s LYS 39 CO -0.03 0.10 0.30 -2.30 -0.92 0.00 0.00 175.35 172.49 1q0x n PRO 40 N -1.45 0.00 -2.90 -1.68 -0.02 -1.26 -1.07 135.00 126.62 1q0x n PRO 40 Ca -0.02 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.37 1q0x n PRO 40 Cb 0.59 -0.99 0.03 0.00 -0.02 0.00 0.00 33.50 33.12 1q0x n PRO 40 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1q0x n ASP 41 N 2.15 -3.57 -4.00 2.55 4.64 -1.26 -3.93 116.55 113.12 1q0x n ASP 41 Ca 0.14 -0.22 -0.36 0.00 -1.38 0.00 0.00 54.79 52.98 1q0x n ASP 41 Cb 0.32 -2.34 0.01 0.00 -1.04 0.00 0.00 41.12 38.08 1q0x n ASP 41 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1q0x n HIS 42 N -3.37 -1.01 -3.46 -0.67 1.44 -1.12 -4.92 115.22 102.12 1q0x n HIS 42 Ca -0.01 0.03 -0.43 0.00 -2.01 0.00 0.00 57.72 55.30 1q0x n HIS 42 Cb 0.53 -2.04 -0.08 0.00 0.12 0.00 0.00 29.99 28.52 1q0x n HIS 42 CO 0.00 0.00 0.00 -1.17 -2.81 0.00 0.00 176.34 172.36 1q0x s LEU 43 N -6.87 5.51 0.05 2.39 2.96 -0.23 -4.92 118.68 117.56 1q0x s LEU 43 Ca 0.37 -1.42 -0.10 0.00 -0.22 0.00 0.00 54.13 52.76 1q0x s LEU 43 Cb -0.21 -2.12 -0.05 0.00 0.50 0.00 0.00 46.19 44.31 1q0x s LEU 43 CO 0.73 -0.63 0.37 -0.36 -1.32 0.00 0.00 176.35 175.14 1q0x s PHE 44 N 1.56 3.60 -0.04 5.38 0.40 -1.26 -0.53 117.98 127.10 1q0x s PHE 44 Ca 0.04 0.76 -0.02 0.00 -0.60 0.00 0.00 56.93 57.11 1q0x s PHE 44 Cb -0.24 -2.13 0.02 0.00 0.51 0.00 0.00 43.02 41.18 1q0x s PHE 44 CO 0.05 0.56 0.09 0.99 0.70 0.00 0.00 175.22 177.60 1q0x s THR 45 N -1.33 -0.03 0.19 0.64 2.01 -0.04 -4.97 115.64 112.10 1q0x s THR 45 Ca 0.30 0.12 -0.30 0.00 0.31 0.00 0.00 61.69 62.12 1q0x s THR 45 Cb -0.14 -0.15 -0.08 0.00 0.01 0.00 0.00 72.50 72.15 1q0x s THR 45 CO 0.17 0.05 0.95 -0.83 -0.69 0.00 0.00 174.62 174.26 1q0x s GLY 46 N 0.69 3.07 -0.09 4.40 0.00 -1.26 -0.34 107.32 113.79 1q0x s GLY 46 Ca -0.05 0.60 -0.04 0.00 0.00 0.00 0.00 44.72 45.23 1q0x s GLY 46 CO -0.03 1.30 -0.11 1.04 0.00 0.00 0.00 173.10 175.30 1q0x n LEU 47 N 2.03 0.76 -4.07 0.66 4.77 0.03 -4.67 117.00 116.51 1q0x n LEU 47 Ca -0.00 0.10 -0.18 0.00 -0.03 0.00 0.00 56.01 55.90 1q0x n LEU 47 Cb 0.48 -0.26 -0.13 0.00 -2.33 0.00 0.00 43.42 41.17 1q0x n LEU 47 CO 0.50 0.21 -0.43 -0.63 -1.33 0.00 0.00 177.39 175.71 1q0x s ILE 48 N -2.16 0.78 0.05 -0.08 -1.09 -0.59 -1.07 121.20 117.04 1q0x s ILE 48 Ca -0.12 -0.74 -0.01 0.00 -2.23 0.00 0.00 60.65 57.55 1q0x s ILE 48 Cb 0.05 -0.72 -0.04 0.00 -1.58 0.00 0.00 42.46 40.17 1q0x s ILE 48 CO 0.16 -0.01 -0.03 -0.83 -1.23 0.00 0.00 174.94 172.99 1q0x s GLY 49 N -0.84 0.44 -1.53 6.18 0.00 -0.19 -1.36 107.32 110.02 1q0x s GLY 49 Ca -0.00 -1.11 -0.13 0.00 0.00 0.00 0.00 44.72 43.47 1q0x s GLY 49 CO 0.00 -1.22 0.94 0.61 0.00 0.00 0.00 173.10 173.44 1q0x n GLY 50 N 0.34 -0.47 4.95 0.20 0.00 -1.20 -0.69 105.19 108.32 1q0x n GLY 50 Ca -0.16 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1q0x n GLY 50 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1q0x n THR 51 N -4.64 0.00 -1.22 2.61 -1.04 -0.43 -4.09 114.28 105.47 1q0x n THR 51 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 1q0x n THR 51 Cb 0.54 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.05 1q0x n THR 51 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 1q0x n ASN 52 N 1.84 0.22 -4.67 8.00 2.04 -1.19 -3.21 115.26 118.29 1q0x n ASN 52 Ca 0.00 -1.43 -0.41 0.00 -0.44 0.00 0.00 54.58 52.30 1q0x n ASN 52 Cb 0.00 -0.07 -0.05 0.00 -2.53 0.00 0.00 39.78 37.13 1q0x n ASN 52 CO 0.00 0.00 0.00 0.20 -0.44 0.00 0.00 177.26 177.02 1q0x s ASN 53 N -0.46 6.84 0.04 0.53 0.01 0.13 -4.62 114.94 117.42 1q0x s ASN 53 Ca 0.01 1.03 -0.24 0.00 -0.71 0.00 0.00 52.86 52.94 1q0x s ASN 53 Cb 0.01 -2.40 -0.05 0.00 0.41 0.00 0.00 41.25 39.21 1q0x s ASN 53 CO 0.00 -0.30 0.75 -0.60 -1.51 0.00 0.00 177.10 175.43 1q0x s ARG 54 N 1.86 4.48 0.76 -0.60 3.52 -1.26 -1.02 118.95 126.68 1q0x s ARG 54 Ca 0.34 1.03 -0.12 0.00 -0.13 0.00 0.00 55.73 56.85 1q0x s ARG 54 Cb -0.16 -3.36 0.06 0.00 -1.56 0.00 0.00 34.95 29.92 1q0x s ARG 54 CO 0.12 0.29 1.12 0.00 -0.81 0.00 0.00 175.30 176.02 1q0x s ALA 55 N -0.07 2.17 0.12 6.12 0.00 -0.23 -4.94 121.76 124.93 1q0x s ALA 55 Ca 0.38 0.45 -0.31 0.00 0.00 0.00 0.00 51.96 52.48 1q0x s ALA 55 Cb -0.20 -3.33 -0.10 0.00 0.00 0.00 0.00 23.12 19.49 1q0x s ALA 55 CO 0.22 -1.82 1.76 -2.14 0.00 0.00 0.00 175.76 173.78 1q0x s PRO 56 N -4.56 4.16 0.00 0.00 0.02 -1.26 -2.30 135.00 131.05 1q0x s PRO 56 Ca 0.65 2.52 0.00 0.00 0.02 0.00 0.00 61.00 64.18 1q0x s PRO 56 Cb -0.20 -3.51 0.00 0.00 0.02 0.00 0.00 34.50 30.81 1q0x s PRO 56 CO 0.52 -0.79 0.00 0.41 -0.33 0.00 0.00 177.00 176.81 1q0x n GLY 57 N 4.12 1.44 3.72 0.52 0.00 -1.26 -5.03 105.19 108.69 1q0x n GLY 57 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1q0x n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1q0x s VAL 58 N -2.79 4.46 0.45 1.61 1.01 -0.97 -4.99 120.40 119.16 1q0x s VAL 58 Ca 0.00 1.88 -0.23 0.00 0.00 0.00 0.00 61.98 63.64 1q0x s VAL 58 Cb 0.00 -4.20 -0.11 0.00 0.00 0.00 0.00 36.38 32.07 1q0x s VAL 58 CO 0.00 0.21 0.82 -2.65 0.00 0.00 0.00 175.10 173.48 1q0x n PRO 59 N 3.37 0.98 0.18 2.72 -0.02 -1.26 -4.87 135.00 136.11 1q0x n PRO 59 Ca 0.05 0.36 0.14 0.00 -2.02 0.00 0.00 63.50 62.02 1q0x n PRO 59 Cb 0.49 -1.85 0.62 0.00 -0.02 0.00 0.00 33.50 32.74 1q0x n PRO 59 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1q0x h ALA 60 N 1.10 1.00 0.00 3.55 0.00 -2.00 -2.84 119.26 120.08 1q0x h ALA 60 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1q0x h ALA 60 Cb 1.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1q0x h ALA 60 CO 0.54 0.00 0.00 2.89 0.00 0.00 0.00 179.25 182.68 1q0x n ARG 61 N -2.45 0.00 -3.63 0.00 1.85 -1.26 -4.63 116.66 106.53 1q0x n ARG 61 Ca 0.00 0.22 -0.36 0.00 -1.00 0.00 0.00 57.85 56.72 1q0x n ARG 61 Cb 0.16 -1.50 -0.08 0.00 -1.05 0.00 0.00 32.46 30.00 1q0x n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1q0x s PHE 62 N -3.00 3.43 -0.01 2.89 0.40 -1.07 -1.49 117.98 119.13 1q0x s PHE 62 Ca 0.08 0.46 -0.09 0.00 -0.60 0.00 0.00 56.93 56.78 1q0x s PHE 62 Cb 0.10 -2.25 0.01 0.00 0.51 0.00 0.00 43.02 41.39 1q0x s PHE 62 CO 0.29 0.26 0.17 -1.54 0.70 0.00 0.00 175.22 175.11 1q0x s SER 63 N 0.42 -0.03 0.12 1.36 1.04 -0.45 -4.97 113.70 111.19 1q0x s SER 63 Ca 0.12 -0.10 0.07 0.00 0.48 0.00 0.00 55.95 56.52 1q0x s SER 63 Cb -0.12 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.20 1q0x s SER 63 CO 0.01 -0.36 -0.07 -0.83 0.98 0.00 0.00 173.24 172.97 1q0x s GLY 64 N -1.23 1.80 0.15 7.32 0.00 -1.26 -0.47 107.32 113.63 1q0x s GLY 64 Ca -0.13 -1.26 -0.07 0.00 0.00 0.00 0.00 44.72 43.26 1q0x s GLY 64 CO 0.02 -1.24 0.39 -1.14 0.00 0.00 0.00 173.10 171.12 1q0x n SER 65 N 0.54 -0.97 -4.26 1.64 3.41 -0.20 -4.40 113.62 109.38 1q0x n SER 65 Ca -0.12 -1.64 -0.32 0.00 -0.26 0.00 0.00 58.87 56.53 1q0x n SER 65 Cb 0.53 1.61 -0.16 0.00 -0.26 0.00 0.00 64.21 65.93 1q0x n SER 65 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1q0x s LEU 66 N 0.00 2.22 -0.27 1.04 1.43 -1.26 -0.20 118.68 121.64 1q0x s LEU 66 Ca 0.08 -0.50 0.02 0.00 -1.03 0.00 0.00 54.13 52.70 1q0x s LEU 66 Cb -0.02 -1.44 0.07 0.00 0.03 0.00 0.00 46.19 44.83 1q0x s LEU 66 CO 0.05 0.18 -0.03 -0.63 0.23 0.00 0.00 176.35 176.14 1q0x s ILE 67 N 0.25 1.80 0.00 -0.59 1.01 0.47 -4.91 121.20 119.24 1q0x s ILE 67 Ca -0.15 -1.60 0.00 0.00 0.00 0.00 0.00 60.65 58.90 1q0x s ILE 67 Cb -0.17 -2.11 0.00 0.00 0.01 0.00 0.00 42.46 40.19 1q0x s ILE 67 CO 0.08 -0.25 0.00 0.61 0.00 0.00 0.00 174.94 175.38 1q0x n GLY 68 N 4.53 2.49 2.04 6.18 0.00 -1.26 -1.90 105.19 117.28 1q0x n GLY 68 Ca -0.08 -0.30 -0.11 0.00 0.00 0.00 0.00 46.02 45.53 1q0x n GLY 68 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1q0x n ASP 69 N 5.84 4.48 -4.27 1.61 5.75 -1.26 -4.88 116.55 123.82 1q0x n ASP 69 Ca 0.00 -3.35 -0.15 0.00 -0.01 0.00 0.00 54.79 51.28 1q0x n ASP 69 Cb 0.00 -0.77 -0.10 0.00 -1.03 0.00 0.00 41.12 39.22 1q0x n ASP 69 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1q0x s LYS 70 N -3.09 1.12 0.27 0.11 1.02 -0.80 -0.93 119.74 117.45 1q0x s LYS 70 Ca 0.56 -1.49 -0.07 0.00 0.02 0.00 0.00 55.97 54.99 1q0x s LYS 70 Cb 0.45 -0.72 -0.06 0.00 -0.52 0.00 0.00 37.83 36.99 1q0x s LYS 70 CO 0.12 0.09 0.56 0.00 -0.92 0.00 0.00 175.35 175.21 1q0x s ALA 71 N -3.26 3.58 0.01 5.17 0.00 -0.62 -0.40 121.76 126.24 1q0x s ALA 71 Ca 0.18 -0.42 -0.03 0.00 0.00 0.00 0.00 51.96 51.70 1q0x s ALA 71 Cb 0.02 -2.38 -0.01 0.00 0.00 0.00 0.00 23.12 20.75 1q0x s ALA 71 CO 0.02 0.34 0.04 0.00 0.00 0.00 0.00 175.76 176.15 1q0x s ALA 72 N -1.99 -0.06 -0.14 0.00 0.00 0.73 -0.50 121.76 119.79 1q0x s ALA 72 Ca 0.46 -0.36 0.02 0.00 0.00 0.00 0.00 51.96 52.08 1q0x s ALA 72 Cb -0.11 0.11 0.01 0.00 0.00 0.00 0.00 23.12 23.13 1q0x s ALA 72 CO 0.26 -0.16 -0.22 -1.17 0.00 0.00 0.00 175.76 174.48 1q0x s LEU 73 N -1.28 2.10 -0.10 0.00 2.96 -0.08 -1.03 118.68 121.24 1q0x s LEU 73 Ca -0.14 -0.60 0.00 0.00 -0.22 0.00 0.00 54.13 53.17 1q0x s LEU 73 Cb -0.08 -1.44 -0.02 0.00 0.50 0.00 0.00 46.19 45.15 1q0x s LEU 73 CO -0.00 0.07 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.11 1q0x s THR 74 N 0.85 3.35 -0.27 3.68 2.01 0.38 -0.76 115.64 124.88 1q0x s THR 74 Ca -0.06 -0.58 0.02 0.00 0.31 0.00 0.00 61.69 61.38 1q0x s THR 74 Cb -0.15 -2.39 0.06 0.00 0.01 0.00 0.00 72.50 70.02 1q0x s THR 74 CO -0.03 0.55 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.74 1q0x s ILE 75 N -0.15 2.35 -0.12 1.82 1.01 -0.50 -1.34 121.20 124.27 1q0x s ILE 75 Ca 0.00 -1.59 -0.12 0.00 0.00 0.00 0.00 60.65 58.94 1q0x s ILE 75 Cb -0.13 -2.38 -0.05 0.00 0.01 0.00 0.00 42.46 39.91 1q0x s ILE 75 CO 0.03 -0.06 0.27 0.42 0.00 0.00 0.00 174.94 175.61 1q0x s THR 76 N 1.13 5.30 -0.76 2.92 -4.23 -0.56 -1.60 115.64 117.84 1q0x s THR 76 Ca -0.08 0.51 -0.03 0.00 -1.18 0.00 0.00 61.69 60.91 1q0x s THR 76 Cb -0.20 -3.58 -0.03 0.00 1.34 0.00 0.00 72.50 70.02 1q0x s THR 76 CO -0.04 0.49 0.66 0.61 -0.54 0.00 0.00 174.62 175.80 1q0x n GLY 77 N 2.71 -0.41 3.64 3.99 0.00 -0.83 -4.75 105.19 109.54 1q0x n GLY 77 Ca -0.15 0.21 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1q0x n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q0x n ALA 78 N -2.84 0.57 -2.44 4.61 0.00 0.24 -4.47 120.51 116.19 1q0x n ALA 78 Ca -0.09 0.26 -0.27 0.00 0.00 0.00 0.00 53.44 53.34 1q0x n ALA 78 Cb 0.59 -2.15 -0.11 0.00 0.00 0.00 0.00 19.45 17.78 1q0x n ALA 78 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1q0x s GLN 79 N -2.03 1.57 0.36 0.00 -0.21 -1.26 -0.11 119.66 117.98 1q0x s GLN 79 Ca 0.62 -1.50 0.11 0.00 0.02 0.00 0.00 55.36 54.60 1q0x s GLN 79 Cb -0.55 -1.88 0.88 0.00 1.00 0.00 0.00 33.01 32.46 1q0x s GLN 79 CO 0.58 0.40 1.83 1.79 -2.12 0.00 0.00 175.29 177.77 1q0x h THR 80 N 3.15 0.73 0.00 -0.19 1.35 -1.94 0.34 112.91 116.35 1q0x h THR 80 Ca -0.46 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.18 1q0x h THR 80 Cb 1.21 0.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.68 1q0x h THR 80 CO 0.49 0.11 0.00 -1.84 -0.25 0.00 0.00 175.52 174.03 1q0x n GLU 81 N -4.62 0.13 0.00 4.72 0.28 -1.26 -2.34 120.64 117.55 1q0x n GLU 81 Ca 0.21 0.47 0.15 0.00 -0.16 0.00 0.00 57.16 57.83 1q0x n GLU 81 Cb 0.60 -1.80 0.81 0.00 1.43 0.00 0.00 31.44 32.47 1q0x n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1q0x n ASP 82 N -2.05 0.00 -4.68 -1.84 8.00 0.11 -4.78 116.55 111.30 1q0x n ASP 82 Ca 0.01 -0.44 -0.42 0.00 0.71 0.00 0.00 54.79 54.65 1q0x n ASP 82 Cb 0.14 -0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 41.03 1q0x n ASP 82 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1q0x s GLU 83 N -2.37 4.18 0.01 -1.24 2.12 -0.99 -4.87 118.70 115.55 1q0x s GLU 83 Ca 0.35 2.37 -0.15 0.00 0.36 0.00 0.00 54.97 57.89 1q0x s GLU 83 Cb 0.20 -3.73 0.05 0.00 0.26 0.00 0.00 34.13 30.91 1q0x s GLU 83 CO 0.42 -0.79 0.70 0.00 -0.54 0.00 0.00 175.26 175.05 1q0x n ALA 84 N 6.10 -1.94 -3.13 6.30 0.00 -1.02 -4.89 120.51 121.93 1q0x n ALA 84 Ca 0.17 -0.48 -0.35 0.00 0.00 0.00 0.00 53.44 52.78 1q0x n ALA 84 Cb 0.41 0.13 -0.13 0.00 0.00 0.00 0.00 19.45 19.86 1q0x n ALA 84 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1q0x s ILE 85 N -2.12 3.99 -0.19 0.00 1.01 -0.45 -0.52 121.20 122.92 1q0x s ILE 85 Ca 0.16 -0.30 -0.06 0.00 0.00 0.00 0.00 60.65 60.45 1q0x s ILE 85 Cb -0.01 -2.82 -0.04 0.00 0.01 0.00 0.00 42.46 39.61 1q0x s ILE 85 CO 0.00 0.41 0.04 -0.31 0.00 0.00 0.00 174.94 175.08 1q0x s TYR 86 N 1.19 3.17 0.01 3.97 1.51 0.08 -0.57 117.35 126.71 1q0x s TYR 86 Ca 0.03 -0.09 0.06 0.00 -1.01 0.00 0.00 57.07 56.06 1q0x s TYR 86 Cb -0.14 -2.07 -0.03 0.00 -0.11 0.00 0.00 41.96 39.60 1q0x s TYR 86 CO 0.02 0.03 -0.16 -0.06 -1.11 0.00 0.00 175.55 174.27 1q0x s PHE 87 N 0.55 2.62 0.22 2.71 0.40 -0.39 -0.57 117.98 123.51 1q0x s PHE 87 Ca 0.02 -0.22 0.08 0.00 -0.60 0.00 0.00 56.93 56.21 1q0x s PHE 87 Cb -0.13 -1.53 -0.04 0.00 0.51 0.00 0.00 43.02 41.83 1q0x s PHE 87 CO 0.01 0.22 0.01 0.00 0.70 0.00 0.00 175.22 176.17 1q0x s ALA 89 N -2.01 0.18 0.03 0.00 0.00 -0.44 -0.50 121.76 119.02 1q0x s ALA 89 Ca 0.29 0.01 0.09 0.00 0.00 0.00 0.00 51.96 52.35 1q0x s ALA 89 Cb -0.08 -0.11 -0.03 0.00 0.00 0.00 0.00 23.12 22.90 1q0x s ALA 89 CO 0.20 0.00 -0.26 -0.51 0.00 0.00 0.00 175.76 175.19 1q0x s LEU 90 N 0.27 2.15 -0.39 0.00 1.43 0.58 -0.94 118.68 121.78 1q0x s LEU 90 Ca -0.02 -0.57 -0.16 0.00 -1.03 0.00 0.00 54.13 52.35 1q0x s LEU 90 Cb -0.04 -1.30 0.01 0.00 0.03 0.00 0.00 46.19 44.89 1q0x s LEU 90 CO -0.01 0.27 0.39 0.86 0.23 0.00 0.00 176.35 178.09 1q0x s TRP 91 N -0.77 3.19 -0.08 0.29 -0.00 0.05 -0.85 118.94 120.78 1q0x s TRP 91 Ca 0.11 -0.29 -0.04 0.00 -0.00 0.00 0.00 56.10 55.88 1q0x s TRP 91 Cb -0.10 -2.77 0.04 0.00 -0.00 0.00 0.00 33.47 30.64 1q0x s TRP 91 CO 0.01 -0.59 0.19 -1.54 -0.00 0.00 0.00 176.95 175.02 1q0x s SER 92 N 1.77 -0.18 -1.19 5.86 1.04 0.38 -4.37 113.70 117.01 1q0x s SER 92 Ca 0.11 0.39 -0.03 0.00 0.48 0.00 0.00 55.95 56.90 1q0x s SER 92 Cb -0.17 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.24 1q0x s SER 92 CO 0.12 -0.15 1.01 0.59 0.98 0.00 0.00 173.24 175.80 1q0x n ASN 93 N 4.09 -3.39 -3.30 7.02 3.02 -1.26 -1.77 115.26 119.67 1q0x n ASN 93 Ca -0.25 -0.57 -0.22 0.00 -0.03 0.00 0.00 54.58 53.52 1q0x n ASN 93 Cb 0.53 -4.89 -0.01 0.00 -0.61 0.00 0.00 39.78 34.81 1q0x n ASN 93 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1q0x n ASN 94 N -2.96 -3.46 -4.05 6.41 4.13 -1.26 -4.93 115.26 109.14 1q0x n ASN 94 Ca -0.18 -0.33 -0.14 0.00 1.68 0.00 0.00 54.58 55.60 1q0x n ASN 94 Cb 0.63 -2.89 -0.12 0.00 -1.54 0.00 0.00 39.78 35.86 1q0x n ASN 94 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1q0x s LYS 95 N -5.94 0.53 -0.32 3.52 -0.14 -0.73 -5.12 119.74 111.54 1q0x s LYS 95 Ca 0.37 -0.64 -0.10 0.00 -1.36 0.00 0.00 55.97 54.24 1q0x s LYS 95 Cb -0.20 -0.36 0.00 0.00 -1.68 0.00 0.00 37.83 35.60 1q0x s LYS 95 CO 0.45 0.07 0.15 -1.17 -0.76 0.00 0.00 175.35 174.10 1q0x s LEU 96 N -1.25 4.18 -0.13 3.17 2.96 -1.26 -0.47 118.68 125.87 1q0x s LEU 96 Ca -0.07 -0.62 0.00 0.00 -0.22 0.00 0.00 54.13 53.22 1q0x s LEU 96 Cb -0.08 -1.99 -0.01 0.00 0.50 0.00 0.00 46.19 44.60 1q0x s LEU 96 CO 0.00 -0.23 -0.14 -0.69 -1.32 0.00 0.00 176.35 173.98 1q0x s VAL 97 N 1.59 2.92 0.11 1.68 1.01 -0.03 -4.95 120.40 122.74 1q0x s VAL 97 Ca 0.04 -0.70 -0.04 0.00 0.00 0.00 0.00 61.98 61.28 1q0x s VAL 97 Cb -0.17 -2.22 -0.05 0.00 0.00 0.00 0.00 36.38 33.93 1q0x s VAL 97 CO 0.06 0.52 0.33 -0.36 0.00 0.00 0.00 175.10 175.65 1q0x s PHE 98 N 0.44 3.49 0.87 5.22 0.08 -1.26 -0.30 117.98 126.51 1q0x s PHE 98 Ca -0.11 0.48 -0.12 0.00 0.12 0.00 0.00 56.93 57.30 1q0x s PHE 98 Cb -0.16 -1.94 0.15 0.00 -0.57 0.00 0.00 43.02 40.50 1q0x s PHE 98 CO 0.05 0.49 1.22 0.20 -0.10 0.00 0.00 175.22 177.07 1q0x s GLY 99 N -2.41 1.73 0.00 4.36 0.00 0.34 -4.52 107.32 106.83 1q0x s GLY 99 Ca 0.39 -1.13 0.28 0.00 0.00 0.00 0.00 44.72 44.25 1q0x s GLY 99 CO 0.25 -0.49 1.92 0.61 0.00 0.00 0.00 173.10 175.40 1q0x n GLY 100 N -3.46 -1.31 0.00 0.20 0.00 -1.25 -4.73 105.19 94.64 1q0x n GLY 100 Ca 0.13 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1q0x n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q0x n GLY 101 N 1.19 -0.76 3.19 -0.02 0.00 -1.26 -5.02 105.19 102.52 1q0x n GLY 101 Ca 0.10 -1.42 -0.33 0.00 0.00 0.00 0.00 46.02 44.37 1q0x n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1q0x s THR 102 N -2.47 2.33 -0.50 2.61 2.01 0.26 -4.53 115.64 115.36 1q0x s THR 102 Ca 0.00 -0.87 -0.26 0.00 0.31 0.00 0.00 61.69 60.86 1q0x s THR 102 Cb 0.00 -1.97 0.03 0.00 0.01 0.00 0.00 72.50 70.57 1q0x s THR 102 CO 0.00 0.53 1.01 -0.54 -0.69 0.00 0.00 174.62 174.92 1q0x s LYS 103 N 0.99 3.53 -0.29 4.92 1.02 -0.62 -0.74 119.74 128.56 1q0x s LYS 103 Ca -0.02 0.18 -0.15 0.00 0.02 0.00 0.00 55.97 55.99 1q0x s LYS 103 Cb -0.15 -3.96 -0.03 0.00 -0.52 0.00 0.00 37.83 33.17 1q0x s LYS 103 CO -0.04 -1.36 0.37 -1.17 -0.92 0.00 0.00 175.35 172.23 1q0x s LEU 104 N 4.09 4.12 -0.18 3.17 2.96 0.32 -1.82 118.68 131.35 1q0x s LEU 104 Ca 0.39 0.17 -0.10 0.00 -0.22 0.00 0.00 54.13 54.37 1q0x s LEU 104 Cb -0.10 -2.41 -0.05 0.00 0.50 0.00 0.00 46.19 44.14 1q0x s LEU 104 CO 0.26 -0.22 0.15 -0.89 -1.32 0.00 0.00 176.35 174.32 1q0x s THR 105 N 2.07 5.42 -0.24 3.68 2.01 -0.28 -2.44 115.64 125.86 1q0x s THR 105 Ca 0.14 0.23 0.01 0.00 0.31 0.00 0.00 61.69 62.38 1q0x s THR 105 Cb -0.16 -3.47 0.04 0.00 0.01 0.00 0.00 72.50 68.93 1q0x s THR 105 CO 0.10 0.48 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.71 1q0x s VAL 106 N 0.02 2.36 -0.44 3.82 1.01 -1.26 -1.19 120.40 124.73 1q0x s VAL 106 Ca 0.10 -1.32 -0.27 0.00 0.00 0.00 0.00 61.98 60.49 1q0x s VAL 106 Cb -0.11 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 1q0x s VAL 106 CO -0.00 0.15 2.03 -0.76 0.00 0.00 0.00 175.10 176.52 1q0x s LEU 106 N 1.21 3.41 0.00 3.92 1.43 -0.37 -4.80 118.68 123.47 1q0x s LEU 106 Ca -0.03 1.05 0.19 0.00 -1.03 0.00 0.00 54.13 54.31 1q0x s LEU 106 Cb -0.18 -2.97 0.23 0.00 0.03 0.00 0.00 46.19 43.31 1q0x s LEU 106 CO -0.07 -2.24 1.18 0.61 0.23 0.00 0.00 176.35 176.06 1q0x n GLY 107 N 5.70 0.95 3.68 -3.19 0.00 -1.26 -4.22 105.19 106.84 1q0x n GLY 107 Ca 0.27 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.63 1q0x n GLY 107 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1q0x s GLN 108 N -1.47 1.58 0.53 1.61 -2.07 -1.26 -5.11 119.66 113.47 1q0x s GLN 108 Ca 0.26 -0.84 -0.22 0.00 -1.82 0.00 0.00 55.36 52.74 1q0x s GLN 108 Cb 0.17 0.59 -0.05 0.00 -1.09 0.00 0.00 33.01 32.62 1q0x s GLN 108 CO 0.25 -0.71 1.35 -2.30 -1.32 0.00 0.00 175.29 172.57 1q0x n PRO 109 N -0.42 1.74 -1.98 9.60 -0.02 -1.26 -4.96 135.00 137.72 1q0x n PRO 109 Ca -0.08 0.64 -0.35 0.00 -2.02 0.00 0.00 63.50 61.68 1q0x n PRO 109 Cb 0.61 -2.57 0.04 0.00 -0.02 0.00 0.00 33.50 31.56 1q0x n PRO 109 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1q0x s LYS 110 N -2.81 2.94 -0.13 -0.52 1.02 -1.26 -4.80 119.74 114.18 1q0x s LYS 110 Ca 0.70 1.75 -0.06 0.00 0.02 0.00 0.00 55.97 58.39 1q0x s LYS 110 Cb -0.42 -1.93 0.06 0.00 -0.52 0.00 0.00 37.83 35.01 1q0x s LYS 110 CO 0.50 -1.21 0.29 0.45 -0.92 0.00 0.00 175.35 174.46 1q0x s SER 111 N -1.74 -0.09 0.60 2.83 0.15 0.34 -4.90 113.70 110.89 1q0x s SER 111 Ca 0.76 0.65 -0.16 0.00 0.70 0.00 0.00 55.95 57.89 1q0x s SER 111 Cb -0.28 0.65 -0.03 0.00 -1.71 0.00 0.00 66.02 64.65 1q0x s SER 111 CO 0.34 -0.20 1.09 -0.94 1.20 0.00 0.00 173.24 174.73 1q0x s SER 112 N 1.80 5.54 0.53 5.45 1.04 -1.26 -1.20 113.70 125.60 1q0x s SER 112 Ca -0.05 1.96 -0.18 0.00 0.48 0.00 0.00 55.95 58.15 1q0x s SER 112 Cb -0.11 -2.55 -0.06 0.00 0.10 0.00 0.00 66.02 63.40 1q0x s SER 112 CO -0.10 -1.34 1.06 -2.16 0.98 0.00 0.00 173.24 171.68 1q0x s PRO 113 N -3.90 3.57 -0.23 4.02 0.04 -1.26 -4.48 135.00 132.76 1q0x s PRO 113 Ca 0.67 1.33 -0.09 0.00 0.04 0.00 0.00 61.00 62.95 1q0x s PRO 113 Cb -0.19 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 1q0x s PRO 113 CO 0.36 -0.62 0.11 0.99 0.04 0.00 0.00 177.00 177.88 1q0x s THR 114 N -2.13 4.99 -0.07 1.26 2.01 -0.31 -4.94 115.64 116.44 1q0x s THR 114 Ca 0.66 0.05 0.03 0.00 0.31 0.00 0.00 61.69 62.74 1q0x s THR 114 Cb -0.17 -3.31 -0.02 0.00 0.01 0.00 0.00 72.50 69.01 1q0x s THR 114 CO 0.27 0.37 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.73 1q0x s VAL 115 N 0.98 2.96 -0.05 3.82 1.01 -1.26 -1.46 120.40 126.39 1q0x s VAL 115 Ca 0.06 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.31 1q0x s VAL 115 Cb -0.14 -2.17 0.02 0.00 0.00 0.00 0.00 36.38 34.09 1q0x s VAL 115 CO 0.03 0.58 -0.08 -0.89 0.00 0.00 0.00 175.10 174.74 1q0x s THR 116 N -0.45 0.81 -0.15 3.92 2.01 -0.73 -4.93 115.64 116.13 1q0x s THR 116 Ca 0.06 -0.30 0.01 0.00 0.31 0.00 0.00 61.69 61.77 1q0x s THR 116 Cb -0.12 -0.78 -0.00 0.00 0.01 0.00 0.00 72.50 71.61 1q0x s THR 116 CO 0.02 0.28 -0.16 -0.22 -0.69 0.00 0.00 174.62 173.85 1q0x s LEU 117 N 0.75 2.43 -0.08 4.42 2.96 -1.26 -0.78 118.68 127.12 1q0x s LEU 117 Ca -0.13 -0.48 0.00 0.00 -0.22 0.00 0.00 54.13 53.31 1q0x s LEU 117 Cb -0.15 -1.55 -0.03 0.00 0.50 0.00 0.00 46.19 44.97 1q0x s LEU 117 CO 0.02 0.09 -0.07 -0.36 -1.32 0.00 0.00 176.35 174.71 1q0x s PHE 118 N 0.78 2.95 0.65 5.38 0.08 0.18 -4.99 117.98 123.01 1q0x s PHE 118 Ca -0.06 -0.02 -0.06 0.00 0.12 0.00 0.00 56.93 56.92 1q0x s PHE 118 Cb -0.15 -1.74 0.04 0.00 -0.57 0.00 0.00 43.02 40.60 1q0x s PHE 118 CO 0.00 0.29 0.96 -1.25 -0.10 0.00 0.00 175.22 175.12 1q0x s PRO 119 N -0.69 2.46 0.42 0.24 0.04 -1.26 -2.01 135.00 134.21 1q0x s PRO 119 Ca 0.10 -0.22 -0.26 0.00 0.04 0.00 0.00 61.00 60.66 1q0x s PRO 119 Cb -0.11 -2.23 -0.09 0.00 0.04 0.00 0.00 34.50 32.11 1q0x s PRO 119 CO 0.02 -1.02 1.38 -2.14 0.04 0.00 0.00 177.00 175.28 1q0x s PRO 120 N -5.12 3.88 0.48 0.56 0.02 -1.25 -4.81 135.00 128.77 1q0x s PRO 120 Ca 0.58 2.32 -0.19 0.00 0.02 0.00 0.00 61.00 63.72 1q0x s PRO 120 Cb -0.11 -2.75 -0.09 0.00 0.02 0.00 0.00 34.50 31.57 1q0x s PRO 120 CO 0.44 -0.62 1.00 -1.54 -0.33 0.00 0.00 177.00 175.94 1q0x s SER 121 N -0.56 6.58 0.33 2.53 1.04 -1.26 -4.91 113.70 117.44 1q0x s SER 121 Ca 0.58 1.76 0.03 0.00 0.48 0.00 0.00 55.95 58.80 1q0x s SER 121 Cb -0.41 -2.54 0.64 0.00 0.10 0.00 0.00 66.02 63.80 1q0x s SER 121 CO 0.54 -0.61 1.92 0.28 0.98 0.00 0.00 173.24 176.35 1q0x h SER 122 N 1.49 0.79 -0.74 7.02 0.02 -1.99 -1.49 113.55 118.65 1q0x h SER 122 Ca -0.49 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.46 1q0x h SER 122 Cb 1.20 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 63.54 1q0x h SER 122 CO 0.60 0.50 0.42 -0.08 -1.14 0.00 0.00 176.83 177.12 1q0x h GLU 123 N 0.89 1.03 -0.24 3.45 4.81 -1.99 -2.51 114.58 120.02 1q0x h GLU 123 Ca 0.37 -0.12 -0.18 0.00 -0.13 0.00 0.00 59.36 59.31 1q0x h GLU 123 Cb 0.29 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.46 1q0x h GLU 123 CO -0.14 0.76 -0.54 1.49 -0.73 0.00 0.00 179.01 179.85 1q0x h GLU 124 N 1.03 0.79 -0.50 1.92 4.81 -1.68 -3.09 114.58 117.86 1q0x h GLU 124 Ca 0.26 -0.53 0.14 0.00 -0.13 0.00 0.00 59.36 59.10 1q0x h GLU 124 Cb 0.02 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 1q0x h GLU 124 CO -0.04 1.16 0.35 -0.07 -0.73 0.00 0.00 179.01 179.68 1q0x h LEU 125 N 0.54 0.04 -1.06 1.64 3.38 -1.02 0.10 115.31 118.92 1q0x h LEU 125 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1q0x h LEU 125 Cb 1.15 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1q0x h LEU 125 CO 0.12 0.02 0.00 0.28 0.09 0.00 0.00 178.44 178.95 1q0x h SER 126 N 0.04 0.00 -0.56 -0.43 0.02 -1.36 -1.42 113.55 109.84 1q0x h SER 126 Ca 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 1q0x h SER 126 Cb 0.89 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.43 1q0x h SER 126 CO -0.01 0.00 0.00 0.35 -1.14 0.00 0.00 176.83 176.03 1q0x n THR 127 N -2.46 0.74 -2.41 -2.27 -2.24 0.35 -4.91 114.28 101.08 1q0x n THR 127 Ca 0.01 -0.79 -0.12 0.00 -2.27 0.00 0.00 64.05 60.89 1q0x n THR 127 Cb 0.21 0.51 0.01 0.00 -2.10 0.00 0.00 70.33 68.96 1q0x n THR 127 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1q0x n ALA 128 N 1.29 -0.42 -2.71 6.98 0.00 -0.53 -4.96 120.51 120.16 1q0x n ALA 128 Ca 0.20 0.12 -0.17 0.00 0.00 0.00 0.00 53.44 53.59 1q0x n ALA 128 Cb 0.53 -1.82 -0.12 0.00 0.00 0.00 0.00 19.45 18.04 1q0x n ALA 128 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1q0x s LYS 129 N -4.82 0.78 -0.12 0.00 -0.14 -1.21 -1.93 119.74 112.31 1q0x s LYS 129 Ca 0.07 -0.95 -0.04 0.00 -1.36 0.00 0.00 55.97 53.70 1q0x s LYS 129 Cb -0.03 -0.73 0.06 0.00 -1.68 0.00 0.00 37.83 35.44 1q0x s LYS 129 CO 0.09 0.16 0.20 0.00 -0.76 0.00 0.00 175.35 175.03 1q0x s ALA 130 N -1.38 -0.27 -0.15 5.17 0.00 0.13 -2.97 121.76 122.29 1q0x s ALA 130 Ca -0.02 0.59 0.01 0.00 0.00 0.00 0.00 51.96 52.53 1q0x s ALA 130 Cb -0.09 -0.96 0.02 0.00 0.00 0.00 0.00 23.12 22.09 1q0x s ALA 130 CO 0.02 -0.70 -0.16 0.99 0.00 0.00 0.00 175.76 175.91 1q0x s THR 131 N 2.33 1.73 0.00 0.00 2.01 -1.26 -0.59 115.64 119.87 1q0x s THR 131 Ca 0.03 -0.74 -0.14 0.00 0.31 0.00 0.00 61.69 61.16 1q0x s THR 131 Cb -0.13 -1.59 -0.06 0.00 0.01 0.00 0.00 72.50 70.73 1q0x s THR 131 CO -0.08 0.49 0.39 -0.76 -0.69 0.00 0.00 174.62 173.97 1q0x s LEU 132 N 1.37 4.45 -0.15 4.42 1.02 -0.02 -3.74 118.68 126.03 1q0x s LEU 132 Ca 0.04 0.91 0.01 0.00 0.02 0.00 0.00 54.13 55.11 1q0x s LEU 132 Cb -0.13 -2.61 0.01 0.00 0.02 0.00 0.00 46.19 43.48 1q0x s LEU 132 CO -0.10 0.31 -0.19 -0.69 0.02 0.00 0.00 176.35 175.70 1q0x s VAL 133 N -1.12 2.28 -0.33 -1.59 1.01 -0.85 -2.08 120.40 117.72 1q0x s VAL 133 Ca 0.24 -0.90 -0.04 0.00 0.00 0.00 0.00 61.98 61.29 1q0x s VAL 133 Cb -0.16 -1.94 0.06 0.00 0.00 0.00 0.00 36.38 34.34 1q0x s VAL 133 CO 0.13 0.53 0.07 0.00 0.00 0.00 0.00 175.10 175.84 1q0x s THR 135 N 1.28 4.95 -0.14 0.00 -4.23 0.04 -1.03 115.64 116.51 1q0x s THR 135 Ca -0.02 0.82 -0.01 0.00 -1.18 0.00 0.00 61.69 61.30 1q0x s THR 135 Cb -0.20 -3.74 0.04 0.00 1.34 0.00 0.00 72.50 69.94 1q0x s THR 135 CO -0.00 0.43 -0.04 -0.63 -0.54 0.00 0.00 174.62 173.84 1q0x s ILE 136 N -1.25 0.89 0.27 2.99 1.01 0.43 -1.76 121.20 123.77 1q0x s ILE 136 Ca 0.30 -0.40 0.02 0.00 0.00 0.00 0.00 60.65 60.57 1q0x s ILE 136 Cb -0.16 -1.06 -0.05 0.00 0.01 0.00 0.00 42.46 41.19 1q0x s ILE 136 CO 0.17 0.17 0.06 0.42 0.00 0.00 0.00 174.94 175.76 1q0x s THR 137 N 1.74 0.82 -1.48 2.92 -4.23 -0.54 -0.14 115.64 114.74 1q0x s THR 137 Ca 0.02 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.45 1q0x s THR 137 Cb -0.14 -2.60 0.06 0.00 1.34 0.00 0.00 72.50 71.15 1q0x s THR 137 CO -0.07 -0.08 0.73 0.47 -0.54 0.00 0.00 174.62 175.12 1q0x n ASP 138 N -0.50 -2.44 -4.57 3.99 8.00 -0.76 -1.16 116.55 119.11 1q0x n ASP 138 Ca -0.02 -0.89 -0.28 0.00 0.71 0.00 0.00 54.79 54.31 1q0x n ASP 138 Cb 0.66 -3.50 -0.10 0.00 -0.02 0.00 0.00 41.12 38.16 1q0x n ASP 138 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1q0x s PHE 139 N -3.57 2.66 -0.26 1.24 -0.71 -0.90 -4.45 117.98 111.99 1q0x s PHE 139 Ca 0.34 -0.21 -0.16 0.00 -1.04 0.00 0.00 56.93 55.86 1q0x s PHE 139 Cb -0.18 -1.33 0.07 0.00 -1.21 0.00 0.00 43.02 40.38 1q0x s PHE 139 CO 0.86 0.48 0.64 -0.47 -1.34 0.00 0.00 175.22 175.39 1q0x s TYR 140 N -1.52 -0.94 1.21 3.49 5.04 -0.34 -0.33 117.35 123.95 1q0x s TYR 140 Ca 0.23 1.95 -0.17 0.00 -2.44 0.00 0.00 57.07 56.65 1q0x s TYR 140 Cb -0.10 0.52 0.29 0.00 0.35 0.00 0.00 41.96 43.02 1q0x s TYR 140 CO 0.14 -0.47 1.04 -2.14 -1.34 0.00 0.00 175.55 172.78 1q0x s PRO 141 N 1.37 -1.25 -0.97 4.97 0.02 -1.26 -0.50 135.00 137.38 1q0x s PRO 141 Ca -0.08 0.35 -0.06 0.00 0.02 0.00 0.00 61.00 61.23 1q0x s PRO 141 Cb -0.05 -1.56 -0.02 0.00 0.02 0.00 0.00 34.50 32.89 1q0x s PRO 141 CO -0.15 -3.82 2.85 0.41 -0.33 0.00 0.00 177.00 175.96 1q0x n GLY 142 N 0.09 4.38 2.70 0.52 0.00 -1.26 -4.84 105.19 106.78 1q0x n GLY 142 Ca 0.08 -1.72 -0.22 0.00 0.00 0.00 0.00 46.02 44.16 1q0x n GLY 142 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1q0x s VAL 143 N -0.14 0.08 0.09 1.61 1.01 -1.26 -4.77 120.40 117.02 1q0x s VAL 143 Ca 0.62 0.26 -0.03 0.00 0.00 0.00 0.00 61.98 62.83 1q0x s VAL 143 Cb 0.25 -0.33 -0.03 0.00 0.00 0.00 0.00 36.38 36.27 1q0x s VAL 143 CO -0.10 0.17 0.06 0.68 0.00 0.00 0.00 175.10 175.92 1q0x s VAL 144 N 2.09 0.16 0.02 2.92 -7.23 -1.26 -4.53 120.40 112.57 1q0x s VAL 144 Ca 0.05 -1.71 0.05 0.00 -1.81 0.00 0.00 61.98 58.56 1q0x s VAL 144 Cb -0.12 -1.69 -0.02 0.00 0.56 0.00 0.00 36.38 35.10 1q0x s VAL 144 CO -0.04 -0.71 -0.15 0.42 -0.31 0.00 0.00 175.10 174.31 1q0x s THR 145 N -3.96 1.18 -0.02 5.32 -4.23 -0.75 -4.99 115.64 108.20 1q0x s THR 145 Ca 0.13 -0.89 0.08 0.00 -1.18 0.00 0.00 61.69 59.84 1q0x s THR 145 Cb 0.07 -1.04 -0.02 0.00 1.34 0.00 0.00 72.50 72.85 1q0x s THR 145 CO -0.05 0.14 -0.26 -0.69 -0.54 0.00 0.00 174.62 173.22 1q0x s VAL 146 N -0.66 2.07 -0.03 2.29 1.01 -1.26 -0.96 120.40 122.86 1q0x s VAL 146 Ca 0.04 -1.11 0.02 0.00 0.00 0.00 0.00 61.98 60.93 1q0x s VAL 146 Cb -0.07 -1.71 0.01 0.00 0.00 0.00 0.00 36.38 34.60 1q0x s VAL 146 CO 0.01 0.58 -0.07 -1.81 0.00 0.00 0.00 175.10 173.80 1q0x s ASP 147 N -0.63 1.03 0.03 3.32 1.01 0.04 -5.00 116.67 116.47 1q0x s ASP 147 Ca 0.10 -0.15 0.04 0.00 0.71 0.00 0.00 52.55 53.25 1q0x s ASP 147 Cb -0.10 -0.30 -0.03 0.00 1.01 0.00 0.00 42.92 43.49 1q0x s ASP 147 CO -0.01 0.04 -0.08 0.26 0.21 0.00 0.00 175.17 175.59 1q0x s TRP 148 N 0.30 2.84 -0.02 4.23 0.52 -1.26 -0.31 118.94 125.24 1q0x s TRP 148 Ca -0.04 -0.08 0.00 0.00 0.02 0.00 0.00 56.10 56.01 1q0x s TRP 148 Cb -0.09 -1.56 0.02 0.00 -1.15 0.00 0.00 33.47 30.69 1q0x s TRP 148 CO 0.00 0.38 -0.00 0.15 0.02 0.00 0.00 176.95 177.50 1q0x s LYS 149 N -1.61 0.19 -0.28 4.98 1.02 -0.34 -1.42 119.74 122.29 1q0x s LYS 149 Ca 0.18 0.04 -0.03 0.00 0.02 0.00 0.00 55.97 56.18 1q0x s LYS 149 Cb -0.11 -0.33 0.03 0.00 -0.52 0.00 0.00 37.83 36.91 1q0x s LYS 149 CO 0.09 -0.08 -0.01 0.08 -0.92 0.00 0.00 175.35 174.52 1q0x s VAL 150 N 0.64 3.13 -1.46 3.17 1.01 -0.15 -0.21 120.40 126.53 1q0x s VAL 150 Ca -0.06 -1.11 -0.12 0.00 0.00 0.00 0.00 61.98 60.69 1q0x s VAL 150 Cb -0.09 -2.68 0.06 0.00 0.00 0.00 0.00 36.38 33.67 1q0x s VAL 150 CO -0.01 0.05 1.05 0.47 0.00 0.00 0.00 175.10 176.66 1q0x n ASP 151 N 4.69 -5.26 0.00 3.32 8.00 0.14 -2.06 116.55 125.38 1q0x n ASP 151 Ca -0.15 -0.69 0.00 0.00 0.71 0.00 0.00 54.79 54.66 1q0x n ASP 151 Cb 0.46 -4.32 0.00 0.00 -0.02 0.00 0.00 41.12 37.24 1q0x n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1q0x n GLY 152 N -1.80 2.44 3.74 0.44 0.00 -1.26 -5.03 105.19 103.72 1q0x n GLY 152 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 1q0x n GLY 152 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1q0x s THR 153 N -2.24 5.29 0.39 2.61 -4.23 -0.87 -5.00 115.64 111.59 1q0x s THR 153 Ca 0.00 0.14 -0.27 0.00 -1.18 0.00 0.00 61.69 60.38 1q0x s THR 153 Cb 0.00 -3.38 -0.11 0.00 1.34 0.00 0.00 72.50 70.36 1q0x s THR 153 CO 0.00 0.49 1.41 -2.65 -0.54 0.00 0.00 174.62 173.33 1q0x n PRO 154 N 3.14 2.38 -3.85 3.99 -0.02 -1.26 -0.98 135.00 138.41 1q0x n PRO 154 Ca -0.17 0.84 -0.16 0.00 -2.02 0.00 0.00 63.50 61.99 1q0x n PRO 154 Cb 0.53 -2.55 -0.16 0.00 -0.02 0.00 0.00 33.50 31.30 1q0x n PRO 154 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1q0x s VAL 155 N -1.14 0.04 0.00 -1.45 0.11 -0.51 -4.86 120.40 112.60 1q0x s VAL 155 Ca 0.56 0.14 0.00 0.00 -2.93 0.00 0.00 61.98 59.75 1q0x s VAL 155 Cb -0.49 -0.15 0.00 0.00 -1.53 0.00 0.00 36.38 34.20 1q0x s VAL 155 CO 0.62 0.10 0.00 0.35 -3.33 0.00 0.00 175.10 172.84 1q0x n THR 156 N 4.05 0.00 -2.02 5.04 -2.24 -1.26 -4.21 114.28 113.65 1q0x n THR 156 Ca -0.26 -0.15 -0.42 0.00 -2.27 0.00 0.00 64.05 60.95 1q0x n THR 156 Cb 0.51 0.62 -0.03 0.00 -2.10 0.00 0.00 70.33 69.33 1q0x n THR 156 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1q0x s ALA 157 N -1.29 3.70 -0.06 6.98 0.00 -1.26 -1.98 121.76 127.85 1q0x s ALA 157 Ca 0.00 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.22 1q0x s ALA 157 Cb 0.00 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.52 1q0x s ALA 157 CO 0.00 -0.77 0.00 0.41 0.00 0.00 0.00 175.76 175.40 1q0x n GLY 158 N 3.70 0.47 3.67 0.00 0.00 -1.26 -4.73 105.19 107.04 1q0x n GLY 158 Ca 0.13 -0.25 -0.35 0.00 0.00 0.00 0.00 46.02 45.55 1q0x n GLY 158 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1q0x s MET 159 N -0.73 3.10 -0.01 1.61 0.00 -0.84 -0.77 119.30 121.66 1q0x s MET 159 Ca 0.00 -0.40 -0.01 0.00 0.00 0.00 0.00 55.69 55.28 1q0x s MET 159 Cb 0.00 -2.84 0.00 0.00 0.00 0.00 0.00 34.83 32.00 1q0x s MET 159 CO 0.00 0.65 0.03 -1.21 0.00 0.00 0.00 175.02 174.49 1q0x s GLU 160 N -0.73 0.03 -0.03 4.11 0.41 -0.34 -4.99 118.70 117.16 1q0x s GLU 160 Ca 0.11 0.05 0.04 0.00 -0.41 0.00 0.00 54.97 54.76 1q0x s GLU 160 Cb -0.12 0.00 -0.00 0.00 -1.78 0.00 0.00 34.13 32.23 1q0x s GLU 160 CO 0.02 -0.01 -0.14 0.99 -0.49 0.00 0.00 175.26 175.63 1q0x s THR 161 N 0.08 1.20 0.86 3.63 2.01 -1.26 0.00 115.64 122.15 1q0x s THR 161 Ca -0.01 -0.60 -0.12 0.00 0.31 0.00 0.00 61.69 61.28 1q0x s THR 161 Cb -0.01 -1.03 0.11 0.00 0.01 0.00 0.00 72.50 71.58 1q0x s THR 161 CO -0.00 0.35 1.16 0.42 -0.69 0.00 0.00 174.62 175.86 1q0x s THR 162 N 0.03 2.00 0.54 -0.82 -4.23 0.15 -5.00 115.64 108.32 1q0x s THR 162 Ca -0.02 0.00 -0.11 0.00 -1.18 0.00 0.00 61.69 60.38 1q0x s THR 162 Cb -0.10 -2.88 -0.05 0.00 1.34 0.00 0.00 72.50 70.82 1q0x s THR 162 CO 0.01 -0.00 0.94 -1.10 -0.54 0.00 0.00 174.62 173.93 1q0x s GLN 163 N -5.43 3.67 0.45 3.99 -1.52 -1.26 -4.69 119.66 114.88 1q0x s GLN 163 Ca 0.63 0.64 -0.21 0.00 -1.95 0.00 0.00 55.36 54.46 1q0x s GLN 163 Cb -0.13 -2.19 -0.09 0.00 -0.22 0.00 0.00 33.01 30.38 1q0x s GLN 163 CO 0.51 -0.37 1.01 -1.25 -0.25 0.00 0.00 175.29 174.94 1q0x s PRO 164 N -4.72 4.01 0.06 2.91 0.04 -1.26 -4.72 135.00 131.32 1q0x s PRO 164 Ca 0.54 1.29 0.02 0.00 0.04 0.00 0.00 61.00 62.90 1q0x s PRO 164 Cb -0.11 -2.19 -0.03 0.00 0.04 0.00 0.00 34.50 32.22 1q0x s PRO 164 CO 0.45 -0.25 -0.08 -1.54 0.04 0.00 0.00 177.00 175.62 1q0x s SER 165 N -1.99 1.02 0.19 6.66 1.04 -0.22 -4.95 113.70 115.45 1q0x s SER 165 Ca 0.64 -0.65 -0.30 0.00 0.48 0.00 0.00 55.95 56.12 1q0x s SER 165 Cb -0.14 0.04 -0.08 0.00 0.10 0.00 0.00 66.02 65.93 1q0x s SER 165 CO 0.18 -0.24 1.09 -0.75 0.98 0.00 0.00 173.24 174.50 1q0x s LYS 166 N -2.06 4.62 0.60 4.02 2.20 -1.26 -1.04 119.74 126.82 1q0x s LYS 166 Ca -0.05 1.71 0.00 0.00 -0.36 0.00 0.00 55.97 57.27 1q0x s LYS 166 Cb -0.07 -3.27 0.06 0.00 -1.51 0.00 0.00 37.83 33.04 1q0x s LYS 166 CO -0.00 0.12 0.84 -0.65 -0.36 0.00 0.00 175.35 175.30 1q0x s GLN 167 N -0.52 2.32 0.46 4.03 -0.21 0.80 -4.90 119.66 121.64 1q0x s GLN 167 Ca 0.48 -0.82 0.14 0.00 0.02 0.00 0.00 55.36 55.18 1q0x s GLN 167 Cb -0.29 -2.43 1.04 0.00 1.00 0.00 0.00 33.01 32.33 1q0x s GLN 167 CO 0.35 -0.93 2.03 0.66 -2.12 0.00 0.00 175.29 175.28 1q0x h SER 168 N -0.12 0.04 -0.26 5.90 4.64 -1.97 -1.47 113.55 120.30 1q0x h SER 168 Ca -0.41 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1q0x h SER 168 Cb 1.29 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1q0x h SER 168 CO 0.50 0.16 0.00 -0.46 -0.87 0.00 0.00 176.83 176.16 1q0x n ASN 169 N -4.38 1.50 0.00 4.97 0.23 -1.26 -4.89 115.26 111.42 1q0x n ASN 169 Ca -0.02 -2.02 0.00 0.00 -0.53 0.00 0.00 54.58 52.01 1q0x n ASN 169 Cb 0.20 -0.20 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1q0x n ASN 169 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1q0x n ASN 170 N 0.27 -0.16 -3.47 0.53 3.02 -0.55 -5.02 115.26 109.88 1q0x n ASN 170 Ca 0.09 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.48 1q0x n ASN 170 Cb 0.25 -0.46 0.10 0.00 -0.61 0.00 0.00 39.78 39.05 1q0x n ASN 170 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1q0x n LYS 172 N -2.01 -0.22 -4.35 3.52 5.02 -1.26 -4.74 118.16 114.11 1q0x n LYS 172 Ca 0.00 -1.58 -0.24 0.00 -2.02 0.00 0.00 58.31 54.47 1q0x n LYS 172 Cb 0.00 -0.59 -0.09 0.00 -0.02 0.00 0.00 35.03 34.33 1q0x n LYS 172 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1q0x s TYR 173 N -2.25 2.54 0.07 2.13 1.51 0.56 -0.14 117.35 121.75 1q0x s TYR 173 Ca 0.45 -0.26 0.02 0.00 -1.01 0.00 0.00 57.07 56.26 1q0x s TYR 173 Cb -0.02 -1.15 -0.03 0.00 -0.11 0.00 0.00 41.96 40.65 1q0x s TYR 173 CO 0.30 0.62 -0.07 0.00 -1.11 0.00 0.00 175.55 175.29 1q0x s MET 174 N -3.36 0.66 0.26 -0.62 0.23 -0.21 -1.82 119.30 114.44 1q0x s MET 174 Ca 0.29 -1.01 -0.19 0.00 -1.03 0.00 0.00 55.69 53.75 1q0x s MET 174 Cb -0.07 -0.24 0.02 0.00 -1.53 0.00 0.00 34.83 33.01 1q0x s MET 174 CO 0.17 0.02 0.65 0.00 -2.03 0.00 0.00 175.02 173.82 1q0x s ALA 175 N -2.38 -1.05 0.02 3.16 0.00 0.81 -1.05 121.76 121.27 1q0x s ALA 175 Ca -0.01 -0.34 -0.02 0.00 0.00 0.00 0.00 51.96 51.59 1q0x s ALA 175 Cb -0.03 0.89 -0.02 0.00 0.00 0.00 0.00 23.12 23.96 1q0x s ALA 175 CO -0.02 -0.97 0.00 -1.12 0.00 0.00 0.00 175.76 173.66 1q0x s SER 176 N -2.92 0.24 0.02 0.00 0.01 -1.26 -0.43 113.70 109.36 1q0x s SER 176 Ca 0.12 -0.53 0.02 0.00 1.31 0.00 0.00 55.95 56.87 1q0x s SER 176 Cb -0.04 0.14 -0.01 0.00 0.21 0.00 0.00 66.02 66.31 1q0x s SER 176 CO 0.05 -0.37 -0.08 -0.55 0.41 0.00 0.00 173.24 172.70 1q0x s SER 177 N -1.71 0.92 -0.01 2.44 0.15 -0.20 -0.67 113.70 114.62 1q0x s SER 177 Ca -0.12 -0.34 0.04 0.00 0.70 0.00 0.00 55.95 56.24 1q0x s SER 177 Cb -0.06 -0.04 -0.01 0.00 -1.71 0.00 0.00 66.02 64.20 1q0x s SER 177 CO -0.02 -0.04 -0.14 -0.31 1.20 0.00 0.00 173.24 173.93 1q0x s TYR 178 N -0.73 1.25 -0.20 3.44 2.02 0.10 -0.71 117.35 122.52 1q0x s TYR 178 Ca -0.03 -0.25 0.01 0.00 -0.37 0.00 0.00 57.07 56.44 1q0x s TYR 178 Cb -0.06 -0.81 0.04 0.00 -0.40 0.00 0.00 41.96 40.72 1q0x s TYR 178 CO 0.00 -0.03 -0.12 -1.17 -1.57 0.00 0.00 175.55 172.65 1q0x s LEU 179 N -0.27 2.34 -0.11 -1.29 2.96 -0.88 -1.19 118.68 120.23 1q0x s LEU 179 Ca 0.04 -0.87 0.00 0.00 -0.22 0.00 0.00 54.13 53.09 1q0x s LEU 179 Cb -0.06 -1.31 -0.02 0.00 0.50 0.00 0.00 46.19 45.30 1q0x s LEU 179 CO -0.00 -0.12 -0.12 -0.89 -1.32 0.00 0.00 176.35 173.90 1q0x s THR 180 N 1.35 3.20 0.32 3.68 2.01 0.05 -0.84 115.64 125.40 1q0x s THR 180 Ca -0.00 -0.63 0.06 0.00 0.31 0.00 0.00 61.69 61.43 1q0x s THR 180 Cb -0.16 -2.33 -0.03 0.00 0.01 0.00 0.00 72.50 69.99 1q0x s THR 180 CO -0.09 0.54 0.27 -0.76 -0.69 0.00 0.00 174.62 173.89 1q0x s LEU 181 N 0.06 1.66 0.62 4.42 1.02 0.25 -4.51 118.68 122.20 1q0x s LEU 181 Ca -0.04 -1.71 -0.10 0.00 0.02 0.00 0.00 54.13 52.30 1q0x s LEU 181 Cb -0.14 0.56 -0.02 0.00 0.02 0.00 0.00 46.19 46.61 1q0x s LEU 181 CO 0.04 -1.04 1.00 0.42 0.02 0.00 0.00 176.35 176.79 1q0x s THR 182 N -3.51 4.30 0.26 5.49 -4.23 -1.26 -0.69 115.64 116.00 1q0x s THR 182 Ca 0.40 0.58 -0.04 0.00 -1.18 0.00 0.00 61.69 61.46 1q0x s THR 182 Cb 0.03 -3.72 0.18 0.00 1.34 0.00 0.00 72.50 70.33 1q0x s THR 182 CO 0.26 -0.90 1.84 0.00 -0.54 0.00 0.00 174.62 175.28 1q0x h ALA 183 N -0.32 1.19 -0.60 3.99 0.00 -1.59 -1.31 119.26 120.63 1q0x h ALA 183 Ca -0.45 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.28 1q0x h ALA 183 Cb 1.22 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1q0x h ALA 183 CO 0.62 0.59 0.31 0.00 0.00 0.00 0.00 179.25 180.78 1q0x h ARG 184 N 1.02 0.85 -0.44 0.00 2.47 -1.92 -2.39 114.38 113.96 1q0x h ARG 184 Ca 0.24 -0.11 -0.10 0.00 -1.26 0.00 0.00 59.98 58.75 1q0x h ARG 184 Cb 0.17 -0.16 -0.02 0.00 -1.65 0.00 0.00 29.97 28.31 1q0x h ARG 184 CO -0.02 0.66 -0.14 0.00 0.56 0.00 0.00 179.97 181.03 1q0x h ALA 185 N 1.14 0.92 -0.65 0.04 0.00 -1.84 -2.60 119.26 116.27 1q0x h ALA 185 Ca 0.21 -0.34 0.04 0.00 0.00 0.00 0.00 54.91 54.82 1q0x h ALA 185 Cb 0.08 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 1q0x h ALA 185 CO -0.03 0.62 0.43 2.35 0.00 0.00 0.00 179.25 182.62 1q0x h TRP 186 N 0.73 0.73 0.00 0.00 2.91 -0.89 -1.02 115.95 118.42 1q0x h TRP 186 Ca 0.12 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.15 1q0x h TRP 186 Cb 0.64 -0.24 0.00 0.00 -0.51 0.00 0.00 29.16 29.05 1q0x h TRP 186 CO 0.03 0.42 0.00 0.39 -1.03 0.00 0.00 178.44 178.26 1q0x n GLU 187 N -4.46 0.13 -0.16 2.65 1.02 -0.93 -3.03 120.64 115.86 1q0x n GLU 187 Ca 0.08 0.16 0.06 0.00 -0.02 0.00 0.00 57.16 57.45 1q0x n GLU 187 Cb 0.15 -1.67 0.19 0.00 -0.02 0.00 0.00 31.44 30.09 1q0x n GLU 187 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1q0x n ARG 188 N -1.90 1.78 -4.18 3.49 1.74 -0.39 -4.86 116.66 112.35 1q0x n ARG 188 Ca 0.06 -1.21 -0.12 0.00 -0.77 0.00 0.00 57.85 55.80 1q0x n ARG 188 Cb 0.35 -1.29 -0.10 0.00 -1.02 0.00 0.00 32.46 30.40 1q0x n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1q0x s HIS 189 N -1.58 0.98 -0.03 -1.55 3.76 -1.17 -5.10 115.29 110.60 1q0x s HIS 189 Ca 0.24 -0.79 -0.05 0.00 -0.15 0.00 0.00 55.06 54.32 1q0x s HIS 189 Cb 0.13 -0.54 -0.02 0.00 1.11 0.00 0.00 32.58 33.26 1q0x s HIS 189 CO 0.17 -0.07 -0.09 0.43 -0.85 0.00 0.00 174.74 174.34 1q0x n SER 190 N 0.19 0.70 -4.77 1.40 7.64 -1.26 -4.75 113.62 112.77 1q0x n SER 190 Ca -0.14 0.11 -0.37 0.00 1.01 0.00 0.00 58.87 59.49 1q0x n SER 190 Cb 0.60 -0.41 -0.07 0.00 -1.01 0.00 0.00 64.21 63.31 1q0x n SER 190 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1q0x s SER 191 N -5.09 6.48 -0.06 6.43 0.15 -1.26 -1.17 113.70 119.17 1q0x s SER 191 Ca -0.07 0.56 0.06 0.00 0.70 0.00 0.00 55.95 57.19 1q0x s SER 191 Cb 0.01 -2.17 -0.01 0.00 -1.71 0.00 0.00 66.02 62.15 1q0x s SER 191 CO 0.11 0.20 -0.24 -0.31 1.20 0.00 0.00 173.24 174.20 1q0x s TYR 192 N -0.08 2.39 -0.02 3.44 1.51 0.01 0.26 117.35 124.86 1q0x s TYR 192 Ca 0.17 -0.76 0.02 0.00 -1.01 0.00 0.00 57.07 55.48 1q0x s TYR 192 Cb -0.13 -1.58 0.01 0.00 -0.11 0.00 0.00 41.96 40.15 1q0x s TYR 192 CO 0.05 -0.25 -0.06 0.45 -1.11 0.00 0.00 175.55 174.62 1q0x s SER 193 N -0.05 0.93 -0.19 2.29 0.15 0.71 -1.13 113.70 116.41 1q0x s SER 193 Ca -0.07 -0.14 -0.02 0.00 0.70 0.00 0.00 55.95 56.42 1q0x s SER 193 Cb -0.14 -0.26 -0.01 0.00 -1.71 0.00 0.00 66.02 63.89 1q0x s SER 193 CO 0.05 0.03 -0.09 0.00 1.20 0.00 0.00 173.24 174.43 1q0x s GLN 195 N 1.13 2.73 -0.25 0.00 -0.21 0.57 -1.73 119.66 121.90 1q0x s GLN 195 Ca 0.01 -0.74 -0.04 0.00 0.02 0.00 0.00 55.36 54.61 1q0x s GLN 195 Cb -0.14 -2.29 0.00 0.00 1.00 0.00 0.00 33.01 31.58 1q0x s GLN 195 CO -0.02 -0.10 -0.00 0.08 -2.12 0.00 0.00 175.29 173.13 1q0x s VAL 196 N 1.05 3.48 -0.22 1.09 1.01 0.54 -0.78 120.40 126.57 1q0x s VAL 196 Ca -0.03 -0.66 -0.10 0.00 0.00 0.00 0.00 61.98 61.19 1q0x s VAL 196 Cb -0.14 -2.70 -0.05 0.00 0.00 0.00 0.00 36.38 33.49 1q0x s VAL 196 CO -0.05 0.26 0.15 -0.89 0.00 0.00 0.00 175.10 174.57 1q0x s THR 197 N 1.46 5.38 -0.11 3.92 2.01 -0.14 -0.27 115.64 127.89 1q0x s THR 197 Ca 0.03 0.20 -0.02 0.00 0.31 0.00 0.00 61.69 62.22 1q0x s THR 197 Cb -0.16 -3.49 0.04 0.00 0.01 0.00 0.00 72.50 68.90 1q0x s THR 197 CO -0.01 0.39 0.01 -2.28 -0.69 0.00 0.00 174.62 172.04 1q0x s HIS 198 N 0.69 0.79 -1.42 4.92 5.04 0.71 -1.81 115.29 124.21 1q0x s HIS 198 Ca 0.08 -0.41 -0.02 0.00 -1.54 0.00 0.00 55.06 53.18 1q0x s HIS 198 Cb -0.12 -0.88 0.02 0.00 0.04 0.00 0.00 32.58 31.63 1q0x s HIS 198 CO 0.01 -0.43 0.49 0.39 -2.34 0.00 0.00 174.74 172.86 1q0x n GLU 199 N 5.11 -3.51 0.00 2.88 1.02 -1.26 -1.49 120.64 123.39 1q0x n GLU 199 Ca -0.08 0.43 0.00 0.00 -0.02 0.00 0.00 57.16 57.49 1q0x n GLU 199 Cb 0.49 -4.66 0.00 0.00 -0.02 0.00 0.00 31.44 27.25 1q0x n GLU 199 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1q0x n GLY 200 N -1.89 2.73 3.60 0.62 0.00 -1.26 -5.01 105.19 103.97 1q0x n GLY 200 Ca -0.27 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 1q0x n GLY 200 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1q0x s HIS 201 N -2.72 3.13 -0.19 1.61 5.04 -0.56 -5.10 115.29 116.50 1q0x s HIS 201 Ca 0.00 -0.02 -0.06 0.00 -1.54 0.00 0.00 55.06 53.44 1q0x s HIS 201 Cb 0.00 -1.91 -0.03 0.00 0.04 0.00 0.00 32.58 30.68 1q0x s HIS 201 CO 0.00 0.21 0.01 -1.12 -2.34 0.00 0.00 174.74 171.50 1q0x s SER 202 N -0.14 5.04 -0.17 9.88 0.01 -1.26 -0.21 113.70 126.86 1q0x s SER 202 Ca 0.04 -0.12 -0.05 0.00 1.31 0.00 0.00 55.95 57.14 1q0x s SER 202 Cb -0.13 -1.86 -0.03 0.00 0.21 0.00 0.00 66.02 64.22 1q0x s SER 202 CO 0.02 0.10 -0.01 -0.44 0.41 0.00 0.00 173.24 173.32 1q0x s SER 203 N 0.79 4.93 0.12 2.44 0.01 0.62 -4.93 113.70 117.69 1q0x s SER 203 Ca 0.01 -0.11 0.09 0.00 1.31 0.00 0.00 55.95 57.25 1q0x s SER 203 Cb -0.14 -1.82 -0.04 0.00 0.21 0.00 0.00 66.02 64.23 1q0x s SER 203 CO 0.02 0.15 -0.21 0.21 0.41 0.00 0.00 173.24 173.82 1q0x s ASN 204 N 0.48 2.65 -0.01 2.44 3.84 -1.26 -0.34 114.94 122.74 1q0x s ASN 204 Ca -0.02 -0.74 -0.00 0.00 0.21 0.00 0.00 52.86 52.31 1q0x s ASN 204 Cb -0.14 -0.15 0.01 0.00 -0.55 0.00 0.00 41.25 40.42 1q0x s ASN 204 CO 0.02 0.04 0.02 -0.54 -2.79 0.00 0.00 177.10 173.86 1q0x s LYS 207 N -2.16 0.01 0.15 0.43 -0.14 -0.70 -5.02 119.74 112.30 1q0x s LYS 207 Ca 0.10 0.06 -0.00 0.00 -1.36 0.00 0.00 55.97 54.76 1q0x s LYS 207 Cb -0.09 -0.05 -0.04 0.00 -1.68 0.00 0.00 37.83 35.97 1q0x s LYS 207 CO 0.05 -0.04 0.04 0.95 -0.76 0.00 0.00 175.35 175.59 1q0x s THR 208 N 0.25 0.28 0.14 2.17 -4.23 -1.26 -0.93 115.64 112.06 1q0x s THR 208 Ca -0.02 -1.93 -0.16 0.00 -1.18 0.00 0.00 61.69 58.40 1q0x s THR 208 Cb -0.03 -2.08 0.03 0.00 1.34 0.00 0.00 72.50 71.76 1q0x s THR 208 CO -0.01 -0.45 0.42 -1.48 -0.54 0.00 0.00 174.62 172.55 1q0x s LEU 209 N -3.09 0.39 -0.11 4.79 0.05 -0.28 -4.99 118.68 115.44 1q0x s LEU 209 Ca 0.24 -0.41 0.01 0.00 0.05 0.00 0.00 54.13 54.02 1q0x s LEU 209 Cb 0.07 1.84 -0.02 0.00 -2.05 0.00 0.00 46.19 46.03 1q0x s LEU 209 CO 0.03 -0.90 -0.14 -0.44 -0.55 0.00 0.00 176.35 174.35 1q0x s SER 210 N -2.84 3.98 0.24 1.48 0.01 -1.26 -0.81 113.70 114.51 1q0x s SER 210 Ca 0.06 -0.30 -0.04 0.00 1.31 0.00 0.00 55.95 56.97 1q0x s SER 210 Cb 0.01 -1.41 0.42 0.00 0.21 0.00 0.00 66.02 65.26 1q0x s SER 210 CO -0.09 0.21 1.78 -0.09 0.41 0.00 0.00 173.24 175.46 1q0x h ARG 211 N 6.36 0.63 0.00 12.44 2.43 -1.44 -3.50 114.38 131.31 1q0x h ARG 211 Ca -0.31 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 1q0x h ARG 211 Cb 1.20 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 1q0x h ARG 211 CO 0.54 0.42 0.00 0.00 -1.51 0.00 0.00 179.97 179.42