#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n1s n ALA 2 N 0.00 2.57 -3.64 0.00 0.00 -1.26 -0.93 120.51 117.25 1n1s n ALA 2 Ca 0.00 -0.21 -0.07 0.00 0.00 0.00 0.00 53.44 53.16 1n1s n ALA 2 Cb 0.00 -1.21 -0.02 0.00 0.00 0.00 0.00 19.45 18.22 1n1s n ALA 2 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1n1s s SER 3 N -1.49 -0.32 -0.25 0.00 0.15 -1.25 -4.68 113.70 105.87 1n1s s SER 3 Ca 0.25 -0.25 -0.35 0.00 0.70 0.00 0.00 55.95 56.31 1n1s s SER 3 Cb 0.12 0.52 -0.16 0.00 -1.71 0.00 0.00 66.02 64.79 1n1s s SER 3 CO 0.20 -0.91 1.11 -0.11 1.20 0.00 0.00 173.24 174.73 1n1s n LEU 4 N -0.39 0.60 -4.72 3.45 7.94 -0.88 -4.67 117.00 118.33 1n1s n LEU 4 Ca -0.08 0.93 -0.34 0.00 -1.11 0.00 0.00 56.01 55.41 1n1s n LEU 4 Cb 0.61 -0.71 0.10 0.00 0.53 0.00 0.00 43.42 43.96 1n1s n LEU 4 CO 0.13 -0.98 0.79 0.00 -1.11 0.00 0.00 177.39 176.22 1n1s s ALA 5 N 1.48 2.06 0.29 1.96 0.00 -1.26 -4.89 121.76 121.40 1n1s s ALA 5 Ca 0.79 0.86 -0.30 0.00 0.00 0.00 0.00 51.96 53.30 1n1s s ALA 5 Cb -1.11 -3.47 -0.12 0.00 0.00 0.00 0.00 23.12 18.41 1n1s s ALA 5 CO 0.57 -1.96 1.50 -2.30 0.00 0.00 0.00 175.76 173.57 1n1s n PRO 6 N -2.87 2.44 0.00 0.00 -0.02 -1.26 -1.43 135.00 131.87 1n1s n PRO 6 Ca 0.13 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 1n1s n PRO 6 Cb 0.50 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 1n1s n PRO 6 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n1s n GLY 7 N 1.90 3.20 3.91 -1.23 0.00 -1.26 -3.98 105.19 107.73 1n1s n GLY 7 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 1n1s n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1n1s s SER 8 N -0.44 5.85 0.27 1.61 0.01 -0.51 -4.66 113.70 115.83 1n1s s SER 8 Ca 0.00 0.85 -0.21 0.00 1.31 0.00 0.00 55.95 57.90 1n1s s SER 8 Cb 0.00 -1.94 0.02 0.00 0.21 0.00 0.00 66.02 64.31 1n1s s SER 8 CO 0.00 -0.91 0.70 -0.94 0.41 0.00 0.00 173.24 172.51 1n1s s SER 9 N -4.23 -0.26 0.14 2.44 1.04 -1.11 -4.90 113.70 106.82 1n1s s SER 9 Ca 0.52 -0.60 -0.15 0.00 0.48 0.00 0.00 55.95 56.19 1n1s s SER 9 Cb -0.10 0.72 0.03 0.00 0.10 0.00 0.00 66.02 66.76 1n1s s SER 9 CO 0.46 -1.33 0.40 0.00 0.98 0.00 0.00 173.24 173.76 1n1s s ARG 10 N -3.92 1.13 0.14 4.02 1.70 -1.26 -0.34 118.95 120.42 1n1s s ARG 10 Ca 0.11 -0.80 0.07 0.00 -0.47 0.00 0.00 55.73 54.64 1n1s s ARG 10 Cb -0.06 0.47 -0.04 0.00 -0.57 0.00 0.00 34.95 34.75 1n1s s ARG 10 CO 0.06 -0.45 -0.15 0.14 -1.08 0.00 0.00 175.30 173.83 1n1s s VAL 11 N -3.84 1.50 -1.10 4.99 -7.23 -0.63 -4.97 120.40 109.12 1n1s s VAL 11 Ca 0.06 -1.82 -0.18 0.00 -1.81 0.00 0.00 61.98 58.22 1n1s s VAL 11 Cb 0.02 -1.67 0.11 0.00 0.56 0.00 0.00 36.38 35.39 1n1s s VAL 11 CO -0.09 -0.41 1.42 -0.70 -0.31 0.00 0.00 175.10 175.01 1n1s s GLU 12 N -2.81 3.80 0.03 4.82 2.12 -1.26 -0.81 118.70 124.59 1n1s s GLU 12 Ca 0.12 -1.84 -0.24 0.00 0.36 0.00 0.00 54.97 53.37 1n1s s GLU 12 Cb -0.05 -5.21 -0.17 0.00 0.26 0.00 0.00 34.13 28.97 1n1s s GLU 12 CO 0.04 -2.00 1.48 1.25 -0.54 0.00 0.00 175.26 175.49 1n1s h LEU 13 N 11.36 0.06 -7.94 2.70 5.85 -1.60 -3.35 115.31 122.39 1n1s h LEU 13 Ca 0.27 -0.28 -0.72 0.00 0.84 0.00 0.00 57.88 57.99 1n1s h LEU 13 Cb 0.95 -0.02 -0.30 0.00 0.37 0.00 0.00 40.66 41.66 1n1s h LEU 13 CO 1.30 0.32 -0.40 -0.36 -0.34 0.00 0.00 178.44 178.97 1n1s s PHE 14 N -5.08 3.45 -0.28 1.25 0.08 -0.85 -5.00 117.98 111.55 1n1s s PHE 14 Ca -0.15 -1.94 -0.17 0.00 0.12 0.00 0.00 56.93 54.79 1n1s s PHE 14 Cb 0.04 -3.48 -0.03 0.00 -0.57 0.00 0.00 43.02 38.99 1n1s s PHE 14 CO 0.68 -0.99 0.47 0.15 -0.10 0.00 0.00 175.22 175.42 1n1s s LYS 15 N 1.31 3.96 0.38 0.44 1.02 -1.26 -1.26 119.74 124.33 1n1s s LYS 15 Ca 0.06 0.13 -0.26 0.00 0.02 0.00 0.00 55.97 55.92 1n1s s LYS 15 Cb -0.26 -3.69 -0.11 0.00 -0.52 0.00 0.00 37.83 33.25 1n1s s LYS 15 CO -0.01 -0.39 1.14 2.89 -0.92 0.00 0.00 175.35 178.06 1n1s n ARG 16 N 5.51 1.69 -3.94 1.68 1.85 -1.26 -0.95 116.66 121.25 1n1s n ARG 16 Ca -0.06 0.60 -0.32 0.00 -1.00 0.00 0.00 57.85 57.08 1n1s n ARG 16 Cb 0.50 -2.16 -0.01 0.00 -1.05 0.00 0.00 32.46 29.73 1n1s n ARG 16 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1n1s n LYS 17 N 0.33 -3.50 0.21 2.89 5.02 0.41 -4.61 118.16 118.91 1n1s n LYS 17 Ca 0.07 0.42 0.00 0.00 -2.02 0.00 0.00 58.31 56.78 1n1s n LYS 17 Cb 0.37 -5.16 0.00 0.00 -0.02 0.00 0.00 35.03 30.22 1n1s n LYS 17 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1n1s n ASN 18 N -2.55 -3.43 -4.76 4.39 2.85 -1.04 -4.95 115.26 105.77 1n1s n ASN 18 Ca 0.05 0.81 -0.41 0.00 -0.11 0.00 0.00 54.58 54.92 1n1s n ASN 18 Cb 0.51 3.24 -0.01 0.00 1.24 0.00 0.00 39.78 44.75 1n1s n ASN 18 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1n1s s SER 19 N -2.45 6.44 0.24 1.20 0.01 -0.12 -4.82 113.70 114.20 1n1s s SER 19 Ca 0.00 2.90 0.07 0.00 1.31 0.00 0.00 55.95 60.23 1n1s s SER 19 Cb 0.00 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.55 1n1s s SER 19 CO 0.00 -0.84 0.17 0.42 0.41 0.00 0.00 173.24 173.40 1n1s s THR 20 N -0.28 4.38 0.10 1.44 -4.23 -1.26 -2.75 115.64 113.05 1n1s s THR 20 Ca 0.60 -1.38 0.07 0.00 -1.18 0.00 0.00 61.69 59.79 1n1s s THR 20 Cb -0.46 -3.35 -0.03 0.00 1.34 0.00 0.00 72.50 70.00 1n1s s THR 20 CO 0.50 -0.31 -0.17 0.68 -0.54 0.00 0.00 174.62 174.79 1n1s s VAL 21 N -2.08 1.41 -1.07 2.29 -7.23 -0.56 -4.88 120.40 108.29 1n1s s VAL 21 Ca 0.32 -1.53 -0.22 0.00 -1.81 0.00 0.00 61.98 58.74 1n1s s VAL 21 Cb -0.08 -1.40 0.00 0.00 0.56 0.00 0.00 36.38 35.47 1n1s s VAL 21 CO 0.24 -0.23 1.73 -2.16 -0.31 0.00 0.00 175.10 174.37 1n1s s PRO 22 N -2.10 3.20 0.03 4.82 0.04 -1.26 -1.21 135.00 138.51 1n1s s PRO 22 Ca 0.05 -1.07 -0.30 0.00 0.04 0.00 0.00 61.00 59.72 1n1s s PRO 22 Cb -0.08 -5.29 -0.05 0.00 0.04 0.00 0.00 34.50 29.12 1n1s s PRO 22 CO 0.03 -2.84 1.12 0.12 0.04 0.00 0.00 177.00 175.47 1n1s s PHE 23 N 7.27 3.51 -0.30 0.56 5.36 -0.13 -4.58 117.98 129.67 1n1s s PHE 23 Ca 0.58 1.44 -0.13 0.00 -0.96 0.00 0.00 56.93 57.86 1n1s s PHE 23 Cb -0.01 -3.31 -0.03 0.00 -0.34 0.00 0.00 43.02 39.33 1n1s s PHE 23 CO 0.00 -0.81 0.30 -2.00 -1.46 0.00 0.00 175.22 171.25 1n1s s GLU 24 N 1.11 3.82 0.85 10.12 2.12 -1.26 -1.04 118.70 134.42 1n1s s GLU 24 Ca 0.56 -0.27 -0.11 0.00 0.36 0.00 0.00 54.97 55.51 1n1s s GLU 24 Cb -0.26 -3.71 0.10 0.00 0.26 0.00 0.00 34.13 30.52 1n1s s GLU 24 CO 0.28 -0.33 1.09 -1.21 -0.54 0.00 0.00 175.26 174.56 1n1s s GLU 25 N 1.92 1.60 0.49 4.30 0.41 0.13 -4.90 118.70 122.65 1n1s s GLU 25 Ca 0.11 0.85 0.20 0.00 -0.41 0.00 0.00 54.97 55.71 1n1s s GLU 25 Cb -0.16 -1.85 1.25 0.00 -1.78 0.00 0.00 34.13 31.59 1n1s s GLU 25 CO 0.11 -2.01 2.01 1.03 -0.49 0.00 0.00 175.26 175.90 1n1s h SER 26 N -1.38 0.13 -0.33 -0.19 0.87 -1.98 -0.92 113.55 109.75 1n1s h SER 26 Ca -0.48 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.04 1n1s h SER 26 Cb 1.27 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 63.18 1n1s h SER 26 CO 0.55 0.08 0.06 -0.46 -0.53 0.00 0.00 176.83 176.53 1n1s n ASN 27 N -4.44 3.40 0.00 6.23 2.04 -1.26 -4.89 115.26 116.34 1n1s n ASN 27 Ca 0.08 -2.53 0.00 0.00 -0.44 0.00 0.00 54.58 51.69 1n1s n ASN 27 Cb 0.46 -0.61 0.00 0.00 -2.53 0.00 0.00 39.78 37.10 1n1s n ASN 27 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1n1s n GLY 28 N 0.20 2.97 3.78 4.83 0.00 -0.35 -5.01 105.19 111.61 1n1s n GLY 28 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 1n1s n GLY 28 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1n1s s THR 29 N -2.22 3.45 -0.13 2.61 -1.32 -1.26 -4.72 115.64 112.05 1n1s s THR 29 Ca 0.00 1.00 -0.00 0.00 -1.21 0.00 0.00 61.69 61.48 1n1s s THR 29 Cb 0.00 -3.46 -0.02 0.00 -1.51 0.00 0.00 72.50 67.51 1n1s s THR 29 CO 0.00 -0.10 -0.12 -0.63 -2.21 0.00 0.00 174.62 171.56 1n1s s ILE 30 N -1.74 3.14 0.01 5.08 1.01 -1.26 0.19 121.20 127.64 1n1s s ILE 30 Ca 0.65 -0.63 0.04 0.00 0.00 0.00 0.00 60.65 60.71 1n1s s ILE 30 Cb -0.23 -2.32 -0.01 0.00 0.01 0.00 0.00 42.46 39.91 1n1s s ILE 30 CO 0.27 0.52 -0.13 0.00 0.00 0.00 0.00 174.94 175.60 1n1s s ARG 31 N 0.30 1.00 -0.36 2.79 1.70 -0.21 -4.96 118.95 119.22 1n1s s ARG 31 Ca -0.09 -0.58 -0.29 0.00 -0.47 0.00 0.00 55.73 54.30 1n1s s ARG 31 Cb -0.16 -0.98 0.01 0.00 -0.57 0.00 0.00 34.95 33.25 1n1s s ARG 31 CO 0.05 0.26 1.27 -1.21 -1.08 0.00 0.00 175.30 174.60 1n1s s GLU 32 N -0.63 3.81 -0.14 3.89 0.41 -1.26 -0.95 118.70 123.83 1n1s s GLU 32 Ca 0.04 1.03 -0.01 0.00 -0.41 0.00 0.00 54.97 55.61 1n1s s GLU 32 Cb -0.06 -3.90 -0.02 0.00 -1.78 0.00 0.00 34.13 28.37 1n1s s GLU 32 CO 0.00 -1.25 -0.11 0.50 -0.49 0.00 0.00 175.26 173.91 1n1s s ARG 33 N 4.35 3.45 0.41 1.61 3.52 -0.35 -4.88 118.95 127.07 1n1s s ARG 33 Ca 0.55 -0.64 -0.25 0.00 -0.13 0.00 0.00 55.73 55.26 1n1s s ARG 33 Cb -0.14 -2.71 -0.08 0.00 -1.56 0.00 0.00 34.95 30.47 1n1s s ARG 33 CO 0.26 0.23 1.14 0.08 -0.81 0.00 0.00 175.30 176.20 1n1s s VAL 34 N 0.33 3.26 -0.10 7.11 1.01 -1.26 -1.50 120.40 129.25 1n1s s VAL 34 Ca -0.09 1.02 0.02 0.00 0.00 0.00 0.00 61.98 62.94 1n1s s VAL 34 Cb -0.15 -3.56 -0.01 0.00 0.00 0.00 0.00 36.38 32.66 1n1s s VAL 34 CO 0.05 0.06 -0.19 -0.69 0.00 0.00 0.00 175.10 174.33 1n1s s VAL 35 N -1.48 2.57 0.06 2.92 1.01 -1.11 -4.91 120.40 119.46 1n1s s VAL 35 Ca 0.58 -0.85 -0.33 0.00 0.00 0.00 0.00 61.98 61.39 1n1s s VAL 35 Cb -0.29 -2.03 -0.19 0.00 0.00 0.00 0.00 36.38 33.88 1n1s s VAL 35 CO 0.36 0.55 1.55 -0.74 0.00 0.00 0.00 175.10 176.81 1n1s h HIS 36 N 6.51 -0.88 -3.90 5.22 6.17 -0.98 0.12 115.15 127.42 1n1s h HIS 36 Ca -0.26 -0.02 -0.25 0.00 0.71 0.00 0.00 60.37 60.55 1n1s h HIS 36 Cb 1.21 0.29 -0.25 0.00 2.52 0.00 0.00 27.41 31.19 1n1s h HIS 36 CO 0.48 -0.53 -0.73 -1.12 0.71 0.00 0.00 177.93 176.74 1n1s s SER 37 N -4.39 0.44 -0.17 3.26 0.01 -0.69 -2.64 113.70 109.53 1n1s s SER 37 Ca -0.17 -0.29 -0.01 0.00 1.31 0.00 0.00 55.95 56.78 1n1s s SER 37 Cb 0.03 0.02 -0.01 0.00 0.21 0.00 0.00 66.02 66.27 1n1s s SER 37 CO 0.59 -0.11 -0.11 -0.36 0.41 0.00 0.00 173.24 173.67 1n1s s PHE 38 N -0.75 2.86 0.28 2.43 0.40 -0.32 -0.69 117.98 122.19 1n1s s PHE 38 Ca -0.06 -0.92 0.02 0.00 -0.60 0.00 0.00 56.93 55.37 1n1s s PHE 38 Cb -0.06 -1.96 -0.05 0.00 0.51 0.00 0.00 43.02 41.47 1n1s s PHE 38 CO -0.00 -0.44 0.11 1.03 0.70 0.00 0.00 175.22 176.62 1n1s s ARG 39 N 0.94 1.50 -0.94 0.44 0.52 -0.83 -4.15 118.95 116.42 1n1s s ARG 39 Ca -0.02 -1.83 -0.06 0.00 -0.52 0.00 0.00 55.73 53.31 1n1s s ARG 39 Cb -0.15 -0.31 -0.03 0.00 0.52 0.00 0.00 34.95 34.97 1n1s s ARG 39 CO -0.01 -0.32 0.81 -0.89 0.02 0.00 0.00 175.30 174.92 1n1s n ILE 40 N -0.53 -8.90 -2.84 1.52 2.08 -1.26 -0.24 119.36 109.19 1n1s n ILE 40 Ca -0.00 -0.86 -0.37 0.00 0.56 0.00 0.00 62.75 62.08 1n1s n ILE 40 Cb 0.66 -6.26 -0.06 0.00 -0.75 0.00 0.00 39.64 33.23 1n1s n ILE 40 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 1n1s s PRO 41 N -4.12 4.54 -0.02 0.38 0.04 -1.26 -4.21 135.00 130.35 1n1s s PRO 41 Ca 0.28 1.25 0.00 0.00 0.04 0.00 0.00 61.00 62.57 1n1s s PRO 41 Cb -0.05 -2.83 0.02 0.00 0.04 0.00 0.00 34.50 31.68 1n1s s PRO 41 CO 0.77 0.31 0.02 0.99 0.04 0.00 0.00 177.00 179.13 1n1s s THR 42 N -1.58 -0.03 -0.11 1.26 2.01 -0.33 -4.41 115.64 112.44 1n1s s THR 42 Ca 0.48 0.16 0.02 0.00 0.31 0.00 0.00 61.69 62.67 1n1s s THR 42 Cb -0.19 -0.07 0.01 0.00 0.01 0.00 0.00 72.50 72.26 1n1s s THR 42 CO 0.24 0.07 -0.18 -0.51 -0.69 0.00 0.00 174.62 173.55 1n1s s ILE 43 N 0.82 1.67 0.34 1.82 2.07 -1.26 -0.16 121.20 126.50 1n1s s ILE 43 Ca -0.07 -0.75 0.03 0.00 -1.41 0.00 0.00 60.65 58.45 1n1s s ILE 43 Cb -0.10 -1.50 -0.05 0.00 0.13 0.00 0.00 42.46 40.95 1n1s s ILE 43 CO -0.02 0.47 0.09 0.68 -1.91 0.00 0.00 174.94 174.25 1n1s s VAL 44 N 0.84 0.87 -0.22 4.00 -7.23 -0.11 -4.64 120.40 113.91 1n1s s VAL 44 Ca -0.09 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.07 1n1s s VAL 44 Cb -0.15 -2.61 0.02 0.00 0.56 0.00 0.00 36.38 34.20 1n1s s VAL 44 CO 0.00 0.00 -0.11 0.21 -0.31 0.00 0.00 175.10 174.89 1n1s s ASN 45 N -3.50 3.93 -0.34 4.85 2.47 -1.26 -0.57 114.94 120.51 1n1s s ASN 45 Ca 0.32 -0.77 -0.00 0.00 0.42 0.00 0.00 52.86 52.83 1n1s s ASN 45 Cb 0.06 -1.60 0.08 0.00 -1.45 0.00 0.00 41.25 38.34 1n1s s ASN 45 CO 0.15 -0.07 0.06 -0.69 -3.72 0.00 0.00 177.10 172.83 1n1s s VAL 46 N 1.32 2.81 -1.43 -5.21 1.01 0.31 -4.76 120.40 114.44 1n1s s VAL 46 Ca 0.02 -1.88 -0.08 0.00 0.00 0.00 0.00 61.98 60.04 1n1s s VAL 46 Cb -0.15 -2.83 0.04 0.00 0.00 0.00 0.00 36.38 33.44 1n1s s VAL 46 CO -0.07 -0.41 0.64 0.47 0.00 0.00 0.00 175.10 175.73 1n1s n ASP 47 N 4.50 -4.99 0.00 3.32 9.92 -1.26 -0.67 116.55 127.37 1n1s n ASP 47 Ca -0.05 -0.41 0.00 0.00 -0.53 0.00 0.00 54.79 53.80 1n1s n ASP 47 Cb 0.42 -4.04 0.00 0.00 -0.64 0.00 0.00 41.12 36.86 1n1s n ASP 47 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1n1s n GLY 48 N -1.43 0.95 3.60 0.44 0.00 -1.26 -5.04 105.19 102.44 1n1s n GLY 48 Ca -0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.61 1n1s n GLY 48 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n1s s VAL 49 N -2.68 4.97 0.10 1.61 1.01 0.16 -4.79 120.40 120.77 1n1s s VAL 49 Ca 0.00 0.04 -0.30 0.00 0.00 0.00 0.00 61.98 61.72 1n1s s VAL 49 Cb 0.00 -3.30 -0.06 0.00 0.00 0.00 0.00 36.38 33.02 1n1s s VAL 49 CO 0.00 0.37 1.12 -0.04 0.00 0.00 0.00 175.10 176.55 1n1s s MET 50 N 1.02 4.52 -0.15 2.72 -1.94 -0.14 -0.53 119.30 124.80 1n1s s MET 50 Ca 0.06 1.69 -0.00 0.00 -1.71 0.00 0.00 55.69 55.72 1n1s s MET 50 Cb -0.14 -3.34 0.03 0.00 2.01 0.00 0.00 34.83 33.39 1n1s s MET 50 CO 0.04 -0.08 -0.10 0.08 -0.01 0.00 0.00 175.02 174.95 1n1s s VAL 51 N 0.53 1.31 -0.20 -6.03 1.01 0.26 -1.02 120.40 116.26 1n1s s VAL 51 Ca 0.54 -0.58 -0.06 0.00 0.00 0.00 0.00 61.98 61.88 1n1s s VAL 51 Cb -0.28 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 34.74 1n1s s VAL 51 CO 0.31 0.32 0.02 0.00 0.00 0.00 0.00 175.10 175.75 1n1s s ALA 52 N 1.58 3.13 -0.04 5.51 0.00 0.69 -0.93 121.76 131.70 1n1s s ALA 52 Ca 0.03 -0.93 0.05 0.00 0.00 0.00 0.00 51.96 51.11 1n1s s ALA 52 Cb -0.14 -1.83 -0.02 0.00 0.00 0.00 0.00 23.12 21.13 1n1s s ALA 52 CO -0.09 -0.08 -0.18 0.42 0.00 0.00 0.00 175.76 175.83 1n1s s ILE 53 N 0.87 2.71 0.18 0.00 1.09 0.78 -1.04 121.20 125.79 1n1s s ILE 53 Ca 0.02 -0.86 -0.22 0.00 -1.10 0.00 0.00 60.65 58.49 1n1s s ILE 53 Cb -0.14 -2.03 0.06 0.00 -1.06 0.00 0.00 42.46 39.29 1n1s s ILE 53 CO 0.02 0.59 0.61 0.00 -0.10 0.00 0.00 174.94 176.06 1n1s s ALA 54 N -0.66 -1.47 -0.04 9.38 0.00 -0.65 -1.19 121.76 127.14 1n1s s ALA 54 Ca 0.10 0.29 -0.30 0.00 0.00 0.00 0.00 51.96 52.05 1n1s s ALA 54 Cb -0.11 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 23.86 1n1s s ALA 54 CO 0.00 -0.81 1.11 -0.51 0.00 0.00 0.00 175.76 175.55 1n1s s ASP 55 N -2.79 7.16 -0.53 0.00 1.11 0.66 -0.72 116.67 121.57 1n1s s ASP 55 Ca 0.03 1.75 -0.17 0.00 0.18 0.00 0.00 52.55 54.34 1n1s s ASP 55 Cb -0.02 -2.56 0.10 0.00 1.07 0.00 0.00 42.92 41.50 1n1s s ASP 55 CO -0.09 -0.47 0.55 0.00 1.18 0.00 0.00 175.17 176.34 1n1s s ALA 56 N 1.75 3.52 -0.81 5.23 0.00 0.46 -1.97 121.76 129.94 1n1s s ALA 56 Ca 0.54 -2.20 -0.18 0.00 0.00 0.00 0.00 51.96 50.12 1n1s s ALA 56 Cb -0.23 -3.30 0.15 0.00 0.00 0.00 0.00 23.12 19.73 1n1s s ALA 56 CO 0.23 -2.03 0.92 1.03 0.00 0.00 0.00 175.76 175.91 1n1s s ARG 57 N 2.08 3.45 0.23 0.00 0.52 0.13 -2.27 118.95 123.10 1n1s s ARG 57 Ca 0.08 -1.82 -0.06 0.00 -0.52 0.00 0.00 55.73 53.41 1n1s s ARG 57 Cb -0.25 -4.60 0.34 0.00 0.52 0.00 0.00 34.95 30.96 1n1s s ARG 57 CO 0.06 -1.58 1.81 1.88 0.02 0.00 0.00 175.30 177.49 1n1s h TYR 58 N 8.65 0.79 0.00 -0.53 -1.99 -1.73 -1.78 116.97 120.38 1n1s h TYR 58 Ca 0.02 0.03 -0.09 0.00 2.00 0.00 0.00 58.73 60.68 1n1s h TYR 58 Cb 1.05 -0.24 -0.02 0.00 2.00 0.00 0.00 36.73 39.52 1n1s h TYR 58 CO 1.04 0.34 -1.56 0.39 -0.00 0.00 0.00 178.16 178.37 1n1s n GLU 59 N -4.76 1.47 -3.68 4.88 -0.58 -1.26 -1.22 120.64 115.49 1n1s n GLU 59 Ca 0.12 -0.05 -0.06 0.00 -0.42 0.00 0.00 57.16 56.75 1n1s n GLU 59 Cb 0.23 -1.24 -0.02 0.00 -0.57 0.00 0.00 31.44 29.85 1n1s n GLU 59 CO 0.00 0.00 0.00 -0.08 -0.48 0.00 0.00 177.13 176.57 1n1s s THR 60 N -2.45 0.00 -0.92 2.62 -1.32 -1.25 -4.86 115.64 107.45 1n1s s THR 60 Ca -0.04 -0.52 0.26 0.00 -1.21 0.00 0.00 61.69 60.19 1n1s s THR 60 Cb 0.04 -1.65 0.12 0.00 -1.51 0.00 0.00 72.50 69.50 1n1s s THR 60 CO 0.40 0.00 1.62 -1.54 -2.21 0.00 0.00 174.62 172.89 1n1s n SER 61 N -0.41 0.37 -4.74 8.08 3.41 -1.26 -4.66 113.62 114.41 1n1s n SER 61 Ca -0.08 0.15 -0.38 0.00 -0.26 0.00 0.00 58.87 58.31 1n1s n SER 61 Cb 0.61 -0.13 0.05 0.00 -0.26 0.00 0.00 64.21 64.48 1n1s n SER 61 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1n1s s PHE 62 N -3.03 2.19 0.20 7.33 0.08 -1.26 -4.93 117.98 118.56 1n1s s PHE 62 Ca 0.11 1.43 -0.11 0.00 0.12 0.00 0.00 56.93 58.49 1n1s s PHE 62 Cb 0.17 -3.74 0.14 0.00 -0.57 0.00 0.00 43.02 39.02 1n1s s PHE 62 CO 0.63 -2.89 1.86 -0.44 -0.10 0.00 0.00 175.22 174.28 1n1s h ASP 63 N 1.01 0.85 -1.08 1.36 3.45 -2.00 -3.31 116.42 116.69 1n1s h ASP 63 Ca -0.51 -0.04 -0.74 0.00 0.43 0.00 0.00 57.03 56.17 1n1s h ASP 63 Cb 1.32 -0.21 -0.12 0.00 -0.56 0.00 0.00 39.33 39.75 1n1s h ASP 63 CO 0.55 0.64 2.25 0.59 -1.57 0.00 0.00 179.24 181.70 1n1s n ASN 64 N -4.55 4.79 -3.17 6.45 3.02 -1.26 -4.86 115.26 115.68 1n1s n ASN 64 Ca 0.06 -3.03 -0.12 0.00 -0.03 0.00 0.00 54.58 51.47 1n1s n ASN 64 Cb 0.04 -1.54 -0.02 0.00 -0.61 0.00 0.00 39.78 37.65 1n1s n ASN 64 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1n1s s SER 65 N 1.72 0.51 -0.36 6.41 1.04 -1.25 -4.88 113.70 116.90 1n1s s SER 65 Ca 0.42 -1.32 -0.29 0.00 0.48 0.00 0.00 55.95 55.25 1n1s s SER 65 Cb 0.09 0.73 -0.00 0.00 0.10 0.00 0.00 66.02 66.94 1n1s s SER 65 CO -0.02 -1.44 1.54 0.12 0.98 0.00 0.00 173.24 174.43 1n1s s PHE 66 N -2.84 2.20 0.00 5.02 5.36 -1.17 -4.42 117.98 122.14 1n1s s PHE 66 Ca 0.24 0.65 0.02 0.00 -0.96 0.00 0.00 56.93 56.88 1n1s s PHE 66 Cb -0.02 -4.20 -0.01 0.00 -0.34 0.00 0.00 43.02 38.45 1n1s s PHE 66 CO 0.16 -2.36 -0.06 0.42 -1.46 0.00 0.00 175.22 171.92 1n1s s ILE 67 N 5.79 0.43 0.16 3.12 1.01 -1.05 -2.46 121.20 128.20 1n1s s ILE 67 Ca 0.68 -0.31 0.03 0.00 0.00 0.00 0.00 60.65 61.05 1n1s s ILE 67 Cb -0.18 -0.38 -0.05 0.00 0.01 0.00 0.00 42.46 41.87 1n1s s ILE 67 CO 0.32 0.07 -0.05 -1.61 0.00 0.00 0.00 174.94 173.66 1n1s s GLU 68 N -0.28 1.09 -0.35 2.79 2.02 -0.96 -1.80 118.70 121.22 1n1s s GLU 68 Ca 0.01 -1.50 -0.21 0.00 0.02 0.00 0.00 54.97 53.29 1n1s s GLU 68 Cb -0.03 -0.48 0.00 0.00 0.10 0.00 0.00 34.13 33.72 1n1s s GLU 68 CO -0.00 -0.02 0.68 0.99 0.02 0.00 0.00 175.26 176.93 1n1s s THR 69 N -3.46 4.85 0.23 3.63 2.01 -0.59 -0.40 115.64 121.91 1n1s s THR 69 Ca 0.20 0.71 -0.01 0.00 0.31 0.00 0.00 61.69 62.90 1n1s s THR 69 Cb 0.04 -4.11 -0.04 0.00 0.01 0.00 0.00 72.50 68.41 1n1s s THR 69 CO 0.02 -0.33 0.43 0.00 -0.69 0.00 0.00 174.62 174.06 1n1s s ALA 70 N 2.81 3.79 -0.00 7.40 0.00 0.11 -0.23 121.76 135.63 1n1s s ALA 70 Ca 0.27 -0.82 0.00 0.00 0.00 0.00 0.00 51.96 51.41 1n1s s ALA 70 Cb -0.14 -2.04 0.00 0.00 0.00 0.00 0.00 23.12 20.94 1n1s s ALA 70 CO 0.15 0.34 -0.01 0.08 0.00 0.00 0.00 175.76 176.32 1n1s s VAL 71 N -1.96 0.12 -0.06 0.00 1.01 -0.20 -1.64 120.40 117.67 1n1s s VAL 71 Ca 0.39 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.35 1n1s s VAL 71 Cb -0.11 -0.12 0.00 0.00 0.00 0.00 0.00 36.38 36.16 1n1s s VAL 71 CO 0.30 0.04 -0.18 -0.54 0.00 0.00 0.00 175.10 174.72 1n1s s LYS 72 N 0.02 2.05 0.09 2.72 1.02 -0.20 -0.42 119.74 125.02 1n1s s LYS 72 Ca 0.00 -0.64 0.05 0.00 0.02 0.00 0.00 55.97 55.40 1n1s s LYS 72 Cb -0.01 -1.70 -0.03 0.00 -0.52 0.00 0.00 37.83 35.56 1n1s s LYS 72 CO -0.00 0.20 -0.12 1.52 -0.92 0.00 0.00 175.35 176.02 1n1s s TYR 73 N 0.21 1.19 -0.04 3.18 1.13 -0.20 -0.22 117.35 122.60 1n1s s TYR 73 Ca -0.09 -0.56 -0.02 0.00 -1.41 0.00 0.00 57.07 54.99 1n1s s TYR 73 Cb -0.14 -0.65 0.02 0.00 -1.10 0.00 0.00 41.96 40.10 1n1s s TYR 73 CO 0.04 0.06 0.09 0.45 -2.51 0.00 0.00 175.55 173.67 1n1s s SER 74 N -2.19 -0.06 0.00 -0.18 0.15 -0.19 -1.01 113.70 110.22 1n1s s SER 74 Ca 0.03 0.18 0.25 0.00 0.70 0.00 0.00 55.95 57.11 1n1s s SER 74 Cb -0.06 0.12 0.41 0.00 -1.71 0.00 0.00 66.02 64.78 1n1s s SER 74 CO 0.02 -0.08 1.36 1.33 1.20 0.00 0.00 173.24 177.06 1n1s n VAL 75 N 3.60 0.00 -2.38 4.45 0.24 -1.26 -0.96 118.33 122.01 1n1s n VAL 75 Ca -0.19 -0.27 -0.16 0.00 -2.04 0.00 0.00 64.34 61.68 1n1s n VAL 75 Cb 0.55 0.95 0.03 0.00 -1.47 0.00 0.00 33.84 33.90 1n1s n VAL 75 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1n1s n ASP 76 N 0.11 3.59 -3.37 -1.34 5.68 -1.26 -4.93 116.55 115.04 1n1s n ASP 76 Ca 0.13 -3.14 -0.24 0.00 -0.50 0.00 0.00 54.79 51.04 1n1s n ASP 76 Cb 0.44 -0.41 0.00 0.00 -1.14 0.00 0.00 41.12 40.01 1n1s n ASP 76 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1n1s n ASP 77 N -0.59 -4.13 0.00 -1.12 10.43 -1.26 -2.40 116.55 117.48 1n1s n ASP 77 Ca 0.29 -0.41 0.00 0.00 2.57 0.00 0.00 54.79 57.24 1n1s n ASP 77 Cb 0.86 -3.39 0.00 0.00 1.84 0.00 0.00 41.12 40.43 1n1s n ASP 77 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1n1s n GLY 78 N -1.26 0.57 0.05 0.44 0.00 -1.26 -4.98 105.19 98.75 1n1s n GLY 78 Ca -0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 1n1s n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1s h ALA 79 N 0.00 -0.00 -3.21 4.61 0.00 -1.90 -3.45 119.26 115.31 1n1s h ALA 79 Ca 0.00 -0.12 -0.39 0.00 0.00 0.00 0.00 54.91 54.40 1n1s h ALA 79 Cb 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 17.59 1n1s h ALA 79 CO 0.00 -0.38 -0.77 0.95 0.00 0.00 0.00 179.25 179.06 1n1s s THR 80 N -5.20 1.07 0.01 0.00 -4.23 -1.26 -5.11 115.64 100.91 1n1s s THR 80 Ca -0.14 -1.40 0.02 0.00 -1.18 0.00 0.00 61.69 58.98 1n1s s THR 80 Cb 0.04 -1.14 -0.01 0.00 1.34 0.00 0.00 72.50 72.73 1n1s s THR 80 CO 0.67 -0.32 -0.06 0.26 -0.54 0.00 0.00 174.62 174.64 1n1s s TRP 81 N -1.58 0.49 0.05 3.99 0.52 -1.26 -4.39 118.94 116.76 1n1s s TRP 81 Ca 0.00 -0.19 0.01 0.00 0.02 0.00 0.00 56.10 55.95 1n1s s TRP 81 Cb -0.08 -0.31 -0.04 0.00 -1.15 0.00 0.00 33.47 31.89 1n1s s TRP 81 CO 0.02 -0.03 0.11 -0.80 0.02 0.00 0.00 176.95 176.27 1n1s s ASN 82 N -0.48 5.78 -0.04 2.95 0.01 -0.18 -4.90 114.94 118.09 1n1s s ASN 82 Ca -0.01 0.10 0.07 0.00 -0.71 0.00 0.00 52.86 52.31 1n1s s ASN 82 Cb -0.04 -1.64 -0.02 0.00 0.41 0.00 0.00 41.25 39.96 1n1s s ASN 82 CO -0.00 0.20 -0.24 -0.89 -1.51 0.00 0.00 177.10 174.66 1n1s s THR 83 N -1.37 2.22 0.14 1.60 2.01 -1.26 -1.03 115.64 117.96 1n1s s THR 83 Ca 0.29 -1.03 -0.03 0.00 0.31 0.00 0.00 61.69 61.22 1n1s s THR 83 Cb -0.12 -1.80 -0.03 0.00 0.01 0.00 0.00 72.50 70.56 1n1s s THR 83 CO 0.21 0.58 0.13 -1.10 -0.69 0.00 0.00 174.62 173.75 1n1s s GLN 84 N -0.47 1.00 -0.35 4.92 -0.21 0.44 -4.78 119.66 120.20 1n1s s GLN 84 Ca 0.06 -1.36 -0.06 0.00 0.02 0.00 0.00 55.36 54.02 1n1s s GLN 84 Cb -0.11 0.29 0.05 0.00 1.00 0.00 0.00 33.01 34.23 1n1s s GLN 84 CO 0.01 -0.31 0.13 0.42 -2.12 0.00 0.00 175.29 173.41 1n1s s ILE 85 N -4.02 3.74 0.11 1.08 -1.09 -1.26 -1.04 121.20 118.72 1n1s s ILE 85 Ca 0.22 -1.27 0.00 0.00 -2.23 0.00 0.00 60.65 57.38 1n1s s ILE 85 Cb 0.06 -3.18 -0.22 0.00 -1.58 0.00 0.00 42.46 37.53 1n1s s ILE 85 CO 0.01 -0.26 1.25 0.00 -1.23 0.00 0.00 174.94 174.71 1n1s h ALA 86 N 8.22 0.29 -3.29 9.38 0.00 -0.91 -3.44 119.26 129.49 1n1s h ALA 86 Ca -0.22 -0.84 -0.41 0.00 0.00 0.00 0.00 54.91 53.44 1n1s h ALA 86 Cb 1.08 -0.06 -0.38 0.00 0.00 0.00 0.00 17.79 18.43 1n1s h ALA 86 CO 0.63 1.01 -0.76 0.42 0.00 0.00 0.00 179.25 180.55 1n1s s ILE 87 N -2.85 0.25 0.42 0.00 1.01 -1.11 -4.89 121.20 114.02 1n1s s ILE 87 Ca -0.03 0.19 -0.07 0.00 0.00 0.00 0.00 60.65 60.74 1n1s s ILE 87 Cb 0.09 -0.42 -0.05 0.00 0.01 0.00 0.00 42.46 42.09 1n1s s ILE 87 CO 0.85 0.23 0.74 -0.54 0.00 0.00 0.00 174.94 176.22 1n1s s LYS 88 N 1.91 3.65 0.76 2.79 1.02 -1.26 -1.54 119.74 127.07 1n1s s LYS 88 Ca 0.03 0.27 -0.02 0.00 0.02 0.00 0.00 55.97 56.27 1n1s s LYS 88 Cb -0.12 -2.43 0.15 0.00 -0.52 0.00 0.00 37.83 34.90 1n1s s LYS 88 CO -0.04 -0.06 1.05 0.54 -0.92 0.00 0.00 175.35 175.91 1n1s s ASN 89 N -3.56 4.11 0.49 2.83 6.03 -1.26 -4.84 114.94 118.74 1n1s s ASN 89 Ca 0.48 -0.37 0.31 0.00 -1.03 0.00 0.00 52.86 52.25 1n1s s ASN 89 Cb -0.10 0.09 1.20 0.00 -3.03 0.00 0.00 41.25 39.40 1n1s s ASN 89 CO 0.37 -2.03 1.91 0.77 -2.03 0.00 0.00 177.10 176.08 1n1s h SER 90 N -0.70 0.00 -1.51 3.54 4.64 -1.89 -3.47 113.55 114.16 1n1s h SER 90 Ca -0.36 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.60 1n1s h SER 90 Cb 1.26 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.26 1n1s h SER 90 CO 0.38 0.00 -0.38 0.54 -0.87 0.00 0.00 176.83 176.50 1n1s n ARG 91 N -2.95 -1.29 0.17 4.77 5.12 -1.26 -4.87 116.66 116.34 1n1s n ARG 91 Ca 0.01 1.01 0.05 0.00 -1.93 0.00 0.00 57.85 56.99 1n1s n ARG 91 Cb 0.32 -5.34 0.19 0.00 -1.16 0.00 0.00 32.46 26.47 1n1s n ARG 91 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1n1s h ALA 92 N 0.34 0.83 -2.86 7.54 0.00 -1.90 -3.48 119.26 119.73 1n1s h ALA 92 Ca -0.38 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.18 1n1s h ALA 92 Cb 1.21 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1n1s h ALA 92 CO 0.51 0.52 0.37 -1.54 0.00 0.00 0.00 179.25 179.11 1n1s s SER 93 N -6.41 0.00 0.00 0.00 1.04 -1.25 -4.98 113.70 102.10 1n1s s SER 93 Ca 0.02 -1.00 0.14 0.00 0.48 0.00 0.00 55.95 55.60 1n1s s SER 93 Cb 0.09 0.74 0.66 0.00 0.10 0.00 0.00 66.02 67.62 1n1s s SER 93 CO 0.71 -1.48 1.42 -1.54 0.98 0.00 0.00 173.24 173.33 1n1s n SER 94 N -1.34 0.00 -0.13 7.02 3.41 -1.26 -2.29 113.62 119.03 1n1s n SER 94 Ca -0.07 0.29 0.04 0.00 -0.26 0.00 0.00 58.87 58.87 1n1s n SER 94 Cb 0.60 -0.39 0.06 0.00 -0.26 0.00 0.00 64.21 64.22 1n1s n SER 94 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1n1s n VAL 95 N -1.39 1.29 -1.81 -3.33 0.24 -1.26 -3.04 118.33 109.03 1n1s n VAL 95 Ca 0.05 -1.37 -0.41 0.00 -2.04 0.00 0.00 64.34 60.57 1n1s n VAL 95 Cb 0.14 0.27 -0.01 0.00 -1.47 0.00 0.00 33.84 32.77 1n1s n VAL 95 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1n1s s SER 96 N -1.53 6.37 -0.18 -1.34 0.01 -0.97 -4.26 113.70 111.79 1n1s s SER 96 Ca 0.13 3.01 -0.22 0.00 1.31 0.00 0.00 55.95 60.18 1n1s s SER 96 Cb 0.10 -2.66 0.06 0.00 0.21 0.00 0.00 66.02 63.73 1n1s s SER 96 CO 0.03 -0.87 0.60 0.00 0.41 0.00 0.00 173.24 173.41 1n1s s ARG 97 N -1.72 0.76 -0.13 12.44 1.70 -0.46 -2.52 118.95 129.01 1n1s s ARG 97 Ca 0.55 0.68 0.02 0.00 -0.47 0.00 0.00 55.73 56.50 1n1s s ARG 97 Cb -0.46 0.36 0.00 0.00 -0.57 0.00 0.00 34.95 34.28 1n1s s ARG 97 CO 0.59 -0.13 -0.19 0.14 -1.08 0.00 0.00 175.30 174.63 1n1s s VAL 98 N -0.03 2.36 0.29 4.99 -7.23 -0.74 -0.82 120.40 119.22 1n1s s VAL 98 Ca -0.03 -0.89 -0.16 0.00 -1.81 0.00 0.00 61.98 59.09 1n1s s VAL 98 Cb -0.04 -1.96 0.02 0.00 0.56 0.00 0.00 36.38 34.96 1n1s s VAL 98 CO 0.03 0.54 0.64 0.00 -0.31 0.00 0.00 175.10 175.99 1n1s s MET 99 N 0.66 1.80 -1.14 4.82 0.00 -0.51 -4.05 119.30 120.88 1n1s s MET 99 Ca -0.10 -1.21 -0.03 0.00 0.00 0.00 0.00 55.69 54.36 1n1s s MET 99 Cb -0.16 0.56 -0.03 0.00 0.00 0.00 0.00 34.83 35.20 1n1s s MET 99 CO 0.02 -0.80 0.95 -0.25 0.00 0.00 0.00 175.02 174.94 1n1s n ASP 100 N -0.66 -4.00 -4.76 -1.18 8.00 -1.26 -1.37 116.55 111.32 1n1s n ASP 100 Ca -0.04 -0.67 -0.41 0.00 0.71 0.00 0.00 54.79 54.38 1n1s n ASP 100 Cb 0.60 -5.10 -0.02 0.00 -0.02 0.00 0.00 41.12 36.58 1n1s n ASP 100 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1n1s s ALA 101 N -3.38 3.64 -0.09 2.24 0.00 -1.26 -4.56 121.76 118.35 1n1s s ALA 101 Ca 0.20 1.45 0.04 0.00 0.00 0.00 0.00 51.96 53.65 1n1s s ALA 101 Cb -0.03 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.50 1n1s s ALA 101 CO 0.74 -0.87 -0.22 0.99 0.00 0.00 0.00 175.76 176.40 1n1s s THR 102 N -0.33 1.87 -0.03 0.00 2.01 -0.50 -1.52 115.64 117.14 1n1s s THR 102 Ca 0.58 -0.92 0.06 0.00 0.31 0.00 0.00 61.69 61.72 1n1s s THR 102 Cb -0.44 -1.62 -0.01 0.00 0.01 0.00 0.00 72.50 70.44 1n1s s THR 102 CO 0.49 0.52 -0.20 -0.69 -0.69 0.00 0.00 174.62 174.05 1n1s s VAL 103 N 0.32 1.63 -0.05 3.82 1.01 0.57 -1.23 120.40 126.47 1n1s s VAL 103 Ca -0.16 -0.85 0.04 0.00 0.00 0.00 0.00 61.98 61.01 1n1s s VAL 103 Cb -0.17 -1.37 -0.00 0.00 0.00 0.00 0.00 36.38 34.84 1n1s s VAL 103 CO 0.07 0.46 -0.17 -0.63 0.00 0.00 0.00 175.10 174.83 1n1s s ILE 104 N -0.24 1.44 -0.16 2.22 1.01 -0.11 -0.08 121.20 125.29 1n1s s ILE 104 Ca 0.02 -0.71 -0.04 0.00 0.00 0.00 0.00 60.65 59.91 1n1s s ILE 104 Cb -0.10 -1.25 -0.03 0.00 0.01 0.00 0.00 42.46 41.09 1n1s s ILE 104 CO 0.01 0.42 -0.01 -0.69 0.00 0.00 0.00 174.94 174.67 1n1s s VAL 105 N 0.14 4.12 -0.09 2.92 1.01 -1.26 -0.28 120.40 126.95 1n1s s VAL 105 Ca -0.06 -0.28 -0.03 0.00 0.00 0.00 0.00 61.98 61.60 1n1s s VAL 105 Cb -0.13 -2.81 0.04 0.00 0.00 0.00 0.00 36.38 33.49 1n1s s VAL 105 CO 0.03 0.49 0.08 -0.75 0.00 0.00 0.00 175.10 174.96 1n1s s LYS 106 N 0.28 -0.01 7.69 2.72 2.20 -0.43 -4.64 119.74 127.55 1n1s s LYS 106 Ca -0.02 0.23 0.00 0.00 -0.36 0.00 0.00 55.97 55.82 1n1s s LYS 106 Cb -0.14 -0.98 0.00 0.00 -1.51 0.00 0.00 37.83 35.21 1n1s s LYS 106 CO 0.02 -0.46 0.00 0.41 -0.36 0.00 0.00 175.35 174.96 1n1s n GLY 107 N 5.30 3.15 1.81 5.54 0.00 -1.26 -1.56 105.19 118.16 1n1s n GLY 107 Ca -0.05 -0.18 0.07 0.00 0.00 0.00 0.00 46.02 45.87 1n1s n GLY 107 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1n1s n ASN 108 N 5.83 5.45 -4.53 1.61 6.94 -1.26 -4.37 115.26 124.92 1n1s n ASN 108 Ca 0.00 -2.82 -0.31 0.00 -0.02 0.00 0.00 54.58 51.43 1n1s n ASN 108 Cb 0.00 -0.66 -0.11 0.00 -2.36 0.00 0.00 39.78 36.64 1n1s n ASN 108 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1n1s s LYS 109 N -2.56 2.26 -0.13 -3.83 1.02 -0.60 -0.51 119.74 115.39 1n1s s LYS 109 Ca 0.53 -0.90 0.00 0.00 0.02 0.00 0.00 55.97 55.62 1n1s s LYS 109 Cb 0.39 -2.33 -0.01 0.00 -0.52 0.00 0.00 37.83 35.36 1n1s s LYS 109 CO 0.17 0.56 -0.15 -0.51 -0.92 0.00 0.00 175.35 174.50 1n1s s LEU 110 N -1.60 2.61 -0.25 3.17 1.43 0.27 -1.31 118.68 123.00 1n1s s LEU 110 Ca 0.17 -0.37 -0.05 0.00 -1.03 0.00 0.00 54.13 52.85 1n1s s LEU 110 Cb -0.11 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.52 1n1s s LEU 110 CO 0.08 0.16 0.02 -0.31 0.23 0.00 0.00 176.35 176.53 1n1s s TYR 111 N 0.37 3.04 -0.13 0.29 2.02 0.61 -0.48 117.35 123.07 1n1s s TYR 111 Ca -0.12 -0.81 0.01 0.00 -0.37 0.00 0.00 57.07 55.78 1n1s s TYR 111 Cb -0.16 -2.18 -0.00 0.00 -0.40 0.00 0.00 41.96 39.22 1n1s s TYR 111 CO 0.06 -0.50 -0.18 0.42 -1.57 0.00 0.00 175.55 173.78 1n1s s ILE 112 N 1.52 2.56 -0.17 2.71 1.01 0.43 -0.94 121.20 128.32 1n1s s ILE 112 Ca 0.05 -0.83 -0.01 0.00 0.00 0.00 0.00 60.65 59.86 1n1s s ILE 112 Cb -0.15 -2.05 -0.01 0.00 0.01 0.00 0.00 42.46 40.26 1n1s s ILE 112 CO -0.00 0.53 -0.11 -0.22 0.00 0.00 0.00 174.94 175.15 1n1s s LEU 113 N 0.56 2.72 0.15 2.97 2.96 -0.36 -0.64 118.68 127.03 1n1s s LEU 113 Ca -0.11 -0.38 0.04 0.00 -0.22 0.00 0.00 54.13 53.46 1n1s s LEU 113 Cb -0.16 -1.64 -0.04 0.00 0.50 0.00 0.00 46.19 44.84 1n1s s LEU 113 CO 0.04 0.08 -0.08 0.68 -1.32 0.00 0.00 176.35 175.75 1n1s s VAL 114 N 0.85 1.04 -0.07 1.68 -7.23 -0.34 -1.41 120.40 114.92 1n1s s VAL 114 Ca -0.03 -2.03 -0.16 0.00 -1.81 0.00 0.00 61.98 57.94 1n1s s VAL 114 Cb -0.15 -1.87 -0.05 0.00 0.56 0.00 0.00 36.38 34.87 1n1s s VAL 114 CO 0.00 -0.72 0.43 -0.83 -0.31 0.00 0.00 175.10 173.67 1n1s s GLY 115 N -3.16 2.41 -0.11 2.32 0.00 -0.47 -1.09 107.32 107.23 1n1s s GLY 115 Ca 0.17 -0.23 0.02 0.00 0.00 0.00 0.00 44.72 44.68 1n1s s GLY 115 CO 0.00 0.47 -0.18 -0.45 0.00 0.00 0.00 173.10 172.94 1n1s s SER 116 N -0.13 3.59 0.03 1.64 0.15 0.41 -1.42 113.70 117.98 1n1s s SER 116 Ca 0.24 -0.42 0.04 0.00 0.70 0.00 0.00 55.95 56.51 1n1s s SER 116 Cb -0.16 -1.40 -0.02 0.00 -1.71 0.00 0.00 66.02 62.73 1n1s s SER 116 CO 0.11 0.19 -0.12 -0.36 1.20 0.00 0.00 173.24 174.25 1n1s s PHE 117 N 0.21 1.09 -0.23 3.44 0.40 0.00 -1.30 117.98 121.59 1n1s s PHE 117 Ca -0.11 -0.34 -0.16 0.00 -0.60 0.00 0.00 56.93 55.71 1n1s s PHE 117 Cb -0.16 -0.65 -0.10 0.00 0.51 0.00 0.00 43.02 42.62 1n1s s PHE 117 CO 0.06 0.01 -0.32 0.09 0.70 0.00 0.00 175.22 175.76 1n1s n ASN 118 N 1.96 1.94 0.00 1.36 3.02 -1.02 -1.36 115.26 121.16 1n1s n ASN 118 Ca -0.18 0.35 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 1n1s n ASN 118 Cb 0.55 -0.80 0.00 0.00 -0.61 0.00 0.00 39.78 38.92 1n1s n ASN 118 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1n1s n LYS 119 N -4.35 1.69 -2.16 3.52 5.02 -1.26 -3.14 118.16 117.48 1n1s n LYS 119 Ca -0.36 -0.01 -0.40 0.00 -2.02 0.00 0.00 58.31 55.51 1n1s n LYS 119 Cb 0.71 -0.17 -0.02 0.00 -0.02 0.00 0.00 35.03 35.53 1n1s n LYS 119 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1n1s s THR 120 N -0.24 2.82 -1.63 -0.18 -4.23 -1.26 -4.91 115.64 106.01 1n1s s THR 120 Ca 0.00 0.80 0.19 0.00 -1.18 0.00 0.00 61.69 61.50 1n1s s THR 120 Cb 0.00 -3.50 -0.04 0.00 1.34 0.00 0.00 72.50 70.30 1n1s s THR 120 CO 0.00 0.17 0.95 0.54 -0.54 0.00 0.00 174.62 175.74 1n1s n ARG 121 N 0.69 1.36 -3.46 3.99 1.74 -1.26 -4.89 116.66 114.83 1n1s n ARG 121 Ca 0.01 -0.76 -0.20 0.00 -0.77 0.00 0.00 57.85 56.12 1n1s n ARG 121 Cb 0.43 -1.38 -0.02 0.00 -1.02 0.00 0.00 32.46 30.47 1n1s n ARG 121 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1n1s s ASN 122 N -2.29 5.24 0.58 0.55 4.22 -1.26 -4.84 114.94 117.14 1n1s s ASN 122 Ca 0.15 -0.63 -0.14 0.00 -2.14 0.00 0.00 52.86 50.10 1n1s s ASN 122 Cb 0.15 -0.65 -0.05 0.00 1.28 0.00 0.00 41.25 41.98 1n1s s ASN 122 CO 0.54 -0.64 1.02 -0.94 -2.04 0.00 0.00 177.10 175.03 1n1s s SER 123 N -4.17 6.25 0.34 3.54 1.04 -1.26 -4.92 113.70 114.52 1n1s s SER 123 Ca 0.49 1.55 0.08 0.00 0.48 0.00 0.00 55.95 58.55 1n1s s SER 123 Cb -0.05 -2.50 0.77 0.00 0.10 0.00 0.00 66.02 64.35 1n1s s SER 123 CO 0.29 -0.85 1.86 4.11 0.98 0.00 0.00 173.24 179.63 1n1s h TRP 124 N 0.24 0.88 0.00 5.02 5.08 -1.99 -0.51 115.95 124.67 1n1s h TRP 124 Ca -0.45 0.03 0.00 0.00 1.08 0.00 0.00 58.89 59.54 1n1s h TRP 124 Cb 1.19 -0.28 0.00 0.00 -3.00 0.00 0.00 29.16 27.08 1n1s h TRP 124 CO 0.64 0.32 0.00 1.79 -1.28 0.00 0.00 178.44 179.91 1n1s h THR 125 N 0.74 0.00 -0.00 0.12 1.35 -1.93 -2.92 112.91 110.27 1n1s h THR 125 Ca 0.47 -0.66 0.00 0.00 -0.55 0.00 0.00 66.41 65.66 1n1s h THR 125 Cb 0.71 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 1n1s h THR 125 CO -0.23 0.00 -0.25 0.00 -0.25 0.00 0.00 175.52 174.79 1n1s n GLN 126 N -3.03 0.41 -1.93 4.72 3.00 -0.21 -4.40 117.38 115.93 1n1s n GLN 126 Ca 0.02 -0.19 -0.41 0.00 -0.01 0.00 0.00 57.00 56.41 1n1s n GLN 126 Cb 0.38 -1.50 -0.01 0.00 0.00 0.00 0.00 30.24 29.12 1n1s n GLN 126 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.06 176.05 1n1s s HIS 127 N -2.72 2.80 0.21 1.08 3.76 -1.10 -4.92 115.29 114.40 1n1s s HIS 127 Ca 0.20 1.22 -0.10 0.00 -0.15 0.00 0.00 55.06 56.23 1n1s s HIS 127 Cb 0.19 -3.88 0.19 0.00 1.11 0.00 0.00 32.58 30.18 1n1s s HIS 127 CO 0.57 -2.59 1.87 0.07 -0.85 0.00 0.00 174.74 173.80 1n1s h ARG 128 N 3.46 0.94 0.00 1.40 -0.00 -1.91 -3.46 114.38 114.81 1n1s h ARG 128 Ca -0.49 -0.06 0.00 0.00 -0.00 0.00 0.00 59.98 59.43 1n1s h ARG 128 Cb 1.23 -0.21 0.00 0.00 -0.00 0.00 0.00 29.97 30.99 1n1s h ARG 128 CO 0.67 0.62 0.00 -0.40 -0.00 0.00 0.00 179.97 180.86 1n1s n ASP 129 N -4.60 0.00 -1.53 0.08 5.68 -1.26 -5.06 116.55 109.86 1n1s n ASP 129 Ca 0.08 -0.90 0.08 0.00 -0.50 0.00 0.00 54.79 53.55 1n1s n ASP 129 Cb 0.05 0.00 0.33 0.00 -1.14 0.00 0.00 41.12 40.37 1n1s n ASP 129 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1n1s n GLY 130 N 0.00 2.53 0.30 6.12 0.00 -1.26 -4.61 105.19 108.27 1n1s n GLY 130 Ca 0.00 -0.78 0.18 0.00 0.00 0.00 0.00 46.02 45.42 1n1s n GLY 130 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1n1s h SER 131 N 3.66 0.00 0.15 1.61 4.64 -1.97 -2.21 113.55 119.42 1n1s h SER 131 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1n1s h SER 131 Cb 1.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.54 1n1s h SER 131 CO 0.27 0.03 -0.18 -0.67 -0.87 0.00 0.00 176.83 175.42 1n1s n ASP 132 N -3.25 1.22 -4.45 4.97 2.03 -1.26 -4.95 116.55 110.85 1n1s n ASP 132 Ca -0.01 -1.10 -0.30 0.00 0.52 0.00 0.00 54.79 53.89 1n1s n ASP 132 Cb 0.20 0.10 -0.12 0.00 -0.72 0.00 0.00 41.12 40.58 1n1s n ASP 132 CO 0.00 0.00 0.00 0.86 -1.92 0.00 0.00 177.20 176.14 1n1s s TRP 133 N -2.34 2.51 -0.04 -0.67 -0.00 -0.83 -2.44 118.94 115.12 1n1s s TRP 133 Ca 0.28 -0.28 -0.04 0.00 -0.00 0.00 0.00 56.10 56.06 1n1s s TRP 133 Cb 0.20 -1.40 0.01 0.00 -0.00 0.00 0.00 33.47 32.28 1n1s s TRP 133 CO 0.46 0.30 0.12 -1.21 -0.00 0.00 0.00 176.95 176.62 1n1s s GLU 134 N -1.74 0.16 -0.33 5.86 2.02 -0.42 -4.99 118.70 119.25 1n1s s GLU 134 Ca 0.16 0.15 -0.19 0.00 0.02 0.00 0.00 54.97 55.11 1n1s s GLU 134 Cb -0.10 0.07 -0.01 0.00 0.10 0.00 0.00 34.13 34.19 1n1s s GLU 134 CO 0.07 -0.02 0.57 -1.25 0.02 0.00 0.00 175.26 174.64 1n1s s PRO 135 N 0.02 3.75 -0.13 0.39 0.04 -1.26 -0.44 135.00 137.36 1n1s s PRO 135 Ca -0.01 0.04 -0.05 0.00 0.04 0.00 0.00 61.00 61.03 1n1s s PRO 135 Cb -0.01 -3.77 -0.04 0.00 0.04 0.00 0.00 34.50 30.72 1n1s s PRO 135 CO 0.00 -0.61 0.06 -0.51 0.04 0.00 0.00 177.00 175.97 1n1s s LEU 136 N 2.50 3.85 -0.14 -3.56 1.43 -0.25 -0.81 118.68 121.70 1n1s s LEU 136 Ca 0.22 0.19 -0.02 0.00 -1.03 0.00 0.00 54.13 53.49 1n1s s LEU 136 Cb -0.15 -1.93 -0.02 0.00 0.03 0.00 0.00 46.19 44.12 1n1s s LEU 136 CO 0.13 0.30 -0.09 -0.22 0.23 0.00 0.00 176.35 176.70 1n1s s LEU 137 N -0.40 2.94 -0.05 1.79 2.96 0.07 -1.20 118.68 124.80 1n1s s LEU 137 Ca 0.09 -0.25 0.04 0.00 -0.22 0.00 0.00 54.13 53.80 1n1s s LEU 137 Cb -0.12 -1.69 -0.00 0.00 0.50 0.00 0.00 46.19 44.88 1n1s s LEU 137 CO 0.02 0.16 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.35 1n1s s VAL 138 N 0.39 1.41 -0.15 1.68 1.01 0.19 -1.04 120.40 123.89 1n1s s VAL 138 Ca -0.08 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 1n1s s VAL 138 Cb -0.15 -1.22 -0.02 0.00 0.00 0.00 0.00 36.38 34.99 1n1s s VAL 138 CO 0.04 0.41 -0.08 -0.69 0.00 0.00 0.00 175.10 174.78 1n1s s VAL 139 N 0.09 3.44 0.09 2.92 1.01 -1.26 -0.43 120.40 126.26 1n1s s VAL 139 Ca -0.05 -0.51 0.07 0.00 0.00 0.00 0.00 61.98 61.49 1n1s s VAL 139 Cb -0.12 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 1n1s s VAL 139 CO 0.02 0.50 -0.12 -0.83 0.00 0.00 0.00 175.10 174.67 1n1s s GLY 140 N 0.52 1.75 -0.14 4.51 0.00 0.37 -1.26 107.32 113.07 1n1s s GLY 140 Ca -0.06 -1.23 0.01 0.00 0.00 0.00 0.00 44.72 43.44 1n1s s GLY 140 CO 0.03 -1.18 -0.15 1.85 0.00 0.00 0.00 173.10 173.65 1n1s s GLU 141 N -2.02 2.30 -0.13 2.90 2.12 -0.43 -0.57 118.70 122.87 1n1s s GLU 141 Ca 0.20 -0.56 -0.20 0.00 0.36 0.00 0.00 54.97 54.76 1n1s s GLU 141 Cb -0.11 -2.06 -0.04 0.00 0.26 0.00 0.00 34.13 32.18 1n1s s GLU 141 CO 0.12 -0.19 0.56 0.08 -0.54 0.00 0.00 175.26 175.28 1n1s s VAL 142 N 1.36 5.12 -0.12 3.70 1.01 0.33 -1.79 120.40 130.01 1n1s s VAL 142 Ca 0.02 1.10 0.02 0.00 0.00 0.00 0.00 61.98 63.13 1n1s s VAL 142 Cb -0.13 -3.89 0.01 0.00 0.00 0.00 0.00 36.38 32.37 1n1s s VAL 142 CO -0.08 0.25 -0.20 -0.89 0.00 0.00 0.00 175.10 174.18 1n1s s THR 143 N 1.03 1.86 -0.06 3.92 2.01 -0.41 -4.87 115.64 119.13 1n1s s THR 143 Ca 0.29 -0.87 -0.03 0.00 0.31 0.00 0.00 61.69 61.39 1n1s s THR 143 Cb -0.16 -1.65 -0.04 0.00 0.01 0.00 0.00 72.50 70.66 1n1s s THR 143 CO 0.12 0.51 0.11 -0.54 -0.69 0.00 0.00 174.62 174.14 1n1s s LYS 144 N 0.80 3.27 0.00 4.92 1.02 -1.26 -1.64 119.74 126.85 1n1s s LYS 144 Ca -0.09 -0.31 0.00 0.00 0.02 0.00 0.00 55.97 55.59 1n1s s LYS 144 Cb -0.16 -3.02 0.00 0.00 -0.52 0.00 0.00 37.83 34.13 1n1s s LYS 144 CO -0.00 0.71 0.00 -1.13 -0.92 0.00 0.00 175.35 174.01 1n1s n SER 145 N 1.53 0.30 0.00 2.83 3.41 -0.21 -5.00 113.62 116.48 1n1s n SER 145 Ca -0.16 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 1n1s n SER 145 Cb 0.54 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 1n1s n SER 145 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n1s n ALA 146 N -3.00 0.00 -1.00 7.33 0.00 -1.26 -2.93 120.51 119.64 1n1s n ALA 146 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1n1s n ALA 146 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1n1s n ALA 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n1s n ALA 147 N 0.00 0.00 -2.76 0.00 0.00 0.97 -4.84 120.51 113.88 1n1s n ALA 147 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 1n1s n ALA 147 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1n1s n ALA 147 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1n1s s ASN 148 N -1.62 6.31 0.00 0.00 6.03 -1.26 -4.13 114.94 120.27 1n1s s ASN 148 Ca 0.00 -1.16 0.00 0.00 -1.03 0.00 0.00 52.86 50.67 1n1s s ASN 148 Cb 0.00 -2.47 0.00 0.00 -3.03 0.00 0.00 41.25 35.75 1n1s s ASN 148 CO 0.00 -1.46 0.00 0.61 -2.03 0.00 0.00 177.10 174.22 1n1s n GLY 149 N 5.61 3.12 3.32 0.45 0.00 -1.26 -5.02 105.19 111.41 1n1s n GLY 149 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 1n1s n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n1s s LYS 150 N -0.38 3.34 0.30 1.61 3.01 -1.26 -5.11 119.74 121.26 1n1s s LYS 150 Ca 0.00 -0.68 -0.27 0.00 -1.01 0.00 0.00 55.97 54.01 1n1s s LYS 150 Cb 0.00 -2.75 -0.10 0.00 -1.01 0.00 0.00 37.83 33.97 1n1s s LYS 150 CO 0.00 0.03 0.94 0.99 0.51 0.00 0.00 175.35 177.82 1n1s s THR 151 N 0.83 4.17 0.27 2.17 2.01 -1.26 -0.02 115.64 123.80 1n1s s THR 151 Ca -0.04 1.89 0.07 0.00 0.31 0.00 0.00 61.69 63.93 1n1s s THR 151 Cb -0.15 -4.09 -0.05 0.00 0.01 0.00 0.00 72.50 68.22 1n1s s THR 151 CO 0.01 0.23 -0.08 0.42 -0.69 0.00 0.00 174.62 174.50 1n1s s THR 152 N -1.51 1.72 0.03 -0.82 -4.23 -1.15 -4.89 115.64 104.79 1n1s s THR 152 Ca 0.48 -2.16 -0.10 0.00 -1.18 0.00 0.00 61.69 58.73 1n1s s THR 152 Cb -0.20 -2.36 0.01 0.00 1.34 0.00 0.00 72.50 71.28 1n1s s THR 152 CO 0.26 -0.37 0.20 0.00 -0.54 0.00 0.00 174.62 174.17 1n1s s ALA 153 N -2.97 -0.41 0.10 3.99 0.00 -1.26 -1.05 121.76 120.17 1n1s s ALA 153 Ca 0.28 -0.18 0.03 0.00 0.00 0.00 0.00 51.96 52.10 1n1s s ALA 153 Cb 0.02 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.33 1n1s s ALA 153 CO 0.11 -0.32 -0.09 0.95 0.00 0.00 0.00 175.76 176.41 1n1s s THR 154 N -2.19 0.89 -0.10 0.00 -4.23 -0.65 -5.00 115.64 104.36 1n1s s THR 154 Ca -0.08 -1.73 0.01 0.00 -1.18 0.00 0.00 61.69 58.72 1n1s s THR 154 Cb -0.03 -1.45 0.02 0.00 1.34 0.00 0.00 72.50 72.38 1n1s s THR 154 CO -0.02 -0.64 -0.14 -0.63 -0.54 0.00 0.00 174.62 172.65 1n1s s ILE 155 N -2.76 1.37 -0.23 2.99 1.01 -1.26 -1.28 121.20 121.04 1n1s s ILE 155 Ca 0.07 -0.56 -0.09 0.00 0.00 0.00 0.00 60.65 60.07 1n1s s ILE 155 Cb -0.01 -1.27 -0.05 0.00 0.01 0.00 0.00 42.46 41.15 1n1s s ILE 155 CO -0.01 0.42 0.13 -0.44 0.00 0.00 0.00 174.94 175.03 1n1s s SER 156 N 1.05 5.89 -0.21 3.58 0.01 -0.74 -4.92 113.70 118.37 1n1s s SER 156 Ca -0.06 0.06 -0.09 0.00 1.31 0.00 0.00 55.95 57.18 1n1s s SER 156 Cb -0.15 -2.05 -0.04 0.00 0.21 0.00 0.00 66.02 63.99 1n1s s SER 156 CO -0.02 0.08 0.10 0.26 0.41 0.00 0.00 173.24 174.06 1n1s s TRP 157 N 0.97 3.27 0.84 2.43 0.52 -1.26 -1.31 118.94 124.40 1n1s s TRP 157 Ca 0.06 0.09 -0.12 0.00 0.02 0.00 0.00 56.10 56.15 1n1s s TRP 157 Cb -0.13 -2.16 0.10 0.00 -1.15 0.00 0.00 33.47 30.13 1n1s s TRP 157 CO 0.03 0.09 1.16 0.20 0.02 0.00 0.00 176.95 178.45 1n1s s GLY 158 N 0.68 1.59 0.38 0.98 0.00 -0.39 -5.02 107.32 105.55 1n1s s GLY 158 Ca 0.05 -0.57 -0.25 0.00 0.00 0.00 0.00 44.72 43.95 1n1s s GLY 158 CO 0.01 -0.06 1.10 0.54 0.00 0.00 0.00 173.10 174.69 1n1s s LYS 159 N -5.44 4.19 0.52 2.90 1.02 -1.26 -4.65 119.74 117.02 1n1s s LYS 159 Ca 0.62 1.66 -0.22 0.00 0.02 0.00 0.00 55.97 58.06 1n1s s LYS 159 Cb -0.13 -2.67 -0.05 0.00 -0.52 0.00 0.00 37.83 34.46 1n1s s LYS 159 CO 0.51 -0.16 1.28 -2.14 -0.92 0.00 0.00 175.35 173.92 1n1s s PRO 160 N -2.29 3.31 -0.08 -1.68 0.02 -1.26 -4.75 135.00 128.28 1n1s s PRO 160 Ca 0.56 2.04 0.03 0.00 0.02 0.00 0.00 61.00 63.65 1n1s s PRO 160 Cb -0.26 -2.26 0.01 0.00 0.02 0.00 0.00 34.50 32.00 1n1s s PRO 160 CO 0.33 -0.99 -0.17 0.08 -0.33 0.00 0.00 177.00 175.92 1n1s s VAL 161 N -1.41 1.48 0.15 3.83 1.01 -0.21 -4.93 120.40 120.32 1n1s s VAL 161 Ca 0.70 -0.68 -0.30 0.00 0.00 0.00 0.00 61.98 61.70 1n1s s VAL 161 Cb -0.36 -1.32 -0.07 0.00 0.00 0.00 0.00 36.38 34.64 1n1s s VAL 161 CO 0.42 0.43 0.95 -0.55 0.00 0.00 0.00 175.10 176.35 1n1s s SER 162 N 0.54 7.54 -0.05 3.32 0.15 -1.26 -0.75 113.70 123.19 1n1s s SER 162 Ca -0.16 1.83 0.20 0.00 0.70 0.00 0.00 55.95 58.52 1n1s s SER 162 Cb -0.17 -2.59 0.65 0.00 -1.71 0.00 0.00 66.02 62.20 1n1s s SER 162 CO 0.06 0.00 1.56 0.18 1.20 0.00 0.00 173.24 176.24 1n1s n LEU 163 N 2.40 4.22 -0.21 3.45 4.77 0.01 -4.56 117.00 127.08 1n1s n LEU 163 Ca 0.01 -2.20 -0.02 0.00 -0.03 0.00 0.00 56.01 53.77 1n1s n LEU 163 Cb 0.49 -0.51 0.09 0.00 -2.33 0.00 0.00 43.42 41.16 1n1s n LEU 163 CO 0.51 0.90 1.06 0.50 -1.33 0.00 0.00 177.39 179.02 1n1s h LYS 164 N 4.01 0.58 0.00 3.23 3.64 -1.92 -1.01 116.57 125.09 1n1s h LYS 164 Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1n1s h LYS 164 Cb 1.17 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 1n1s h LYS 164 CO 0.10 0.38 0.01 -1.35 -2.27 0.00 0.00 179.45 176.31 1n1s h PRO 165 N 0.59 0.00 -0.02 1.90 0.11 -1.98 -1.52 132.00 131.09 1n1s h PRO 165 Ca 0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.39 1n1s h PRO 165 Cb 0.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.32 1n1s h PRO 165 CO -0.20 0.00 -0.24 1.28 -0.21 0.00 0.00 178.00 178.63 1n1s n LEU 166 N -2.37 2.04 -4.57 2.35 4.77 -0.39 -4.89 117.00 113.93 1n1s n LEU 166 Ca -0.02 -0.70 -0.42 0.00 -0.03 0.00 0.00 56.01 54.84 1n1s n LEU 166 Cb 0.04 -0.02 -0.05 0.00 -2.33 0.00 0.00 43.42 41.06 1n1s n LEU 166 CO 0.11 0.36 0.56 0.12 -1.33 0.00 0.00 177.39 177.21 1n1s s PHE 167 N -2.28 3.08 0.56 -1.77 5.36 -0.57 -4.92 117.98 117.44 1n1s s PHE 167 Ca 0.25 0.44 -0.20 0.00 -0.96 0.00 0.00 56.93 56.46 1n1s s PHE 167 Cb 0.19 -3.45 -0.05 0.00 -0.34 0.00 0.00 43.02 39.38 1n1s s PHE 167 CO 0.45 -0.79 1.15 -2.30 -1.46 0.00 0.00 175.22 172.28 1n1s n PRO 168 N 6.46 1.27 0.09 10.12 -0.02 -1.26 -4.89 135.00 146.77 1n1s n PRO 168 Ca 0.02 0.48 0.13 0.00 -2.02 0.00 0.00 63.50 62.11 1n1s n PRO 168 Cb 0.48 -2.35 0.41 0.00 -0.02 0.00 0.00 33.50 32.03 1n1s n PRO 168 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n1s n ALA 169 N -1.34 2.35 -3.28 3.55 0.00 -1.26 -4.67 120.51 115.86 1n1s n ALA 169 Ca 0.12 -0.05 -0.14 0.00 0.00 0.00 0.00 53.44 53.37 1n1s n ALA 169 Cb 0.45 -1.44 -0.08 0.00 0.00 0.00 0.00 19.45 18.38 1n1s n ALA 169 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1n1s s GLU 170 N -3.09 0.79 -0.22 0.00 1.03 -1.26 -1.35 118.70 114.60 1n1s s GLU 170 Ca 0.11 -0.13 0.00 0.00 0.03 0.00 0.00 54.97 54.98 1n1s s GLU 170 Cb 0.13 0.36 0.06 0.00 -0.80 0.00 0.00 34.13 33.88 1n1s s GLU 170 CO 0.60 -0.24 -0.05 -0.06 -1.33 0.00 0.00 175.26 174.19 1n1s s PHE 171 N -1.50 2.16 -1.54 4.83 2.99 0.16 -4.82 117.98 120.25 1n1s s PHE 171 Ca -0.12 -1.56 -0.04 0.00 0.00 0.00 0.00 56.93 55.21 1n1s s PHE 171 Cb -0.03 -1.49 0.04 0.00 0.00 0.00 0.00 43.02 41.53 1n1s s PHE 171 CO 0.04 -0.74 0.28 -3.47 -0.00 0.00 0.00 175.22 171.34 1n1s n ASP 172 N 4.74 -0.17 0.00 1.36 4.64 -1.26 0.36 116.55 126.23 1n1s n ASP 172 Ca -0.12 -1.15 0.00 0.00 -1.38 0.00 0.00 54.79 52.14 1n1s n ASP 172 Cb 0.45 -2.26 0.00 0.00 -1.04 0.00 0.00 41.12 38.27 1n1s n ASP 172 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1n1s n GLY 173 N -2.12 2.90 3.65 0.27 0.00 -1.26 -5.01 105.19 103.62 1n1s n GLY 173 Ca -0.25 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 1n1s n GLY 173 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n1s s ILE 174 N -2.09 3.85 -0.15 -0.61 1.01 0.16 -4.97 121.20 118.40 1n1s s ILE 174 Ca 0.00 1.01 -0.28 0.00 0.00 0.00 0.00 60.65 61.38 1n1s s ILE 174 Cb 0.00 -3.72 -0.01 0.00 0.01 0.00 0.00 42.46 38.75 1n1s s ILE 174 CO 0.00 -0.16 0.96 -0.76 0.00 0.00 0.00 174.94 174.99 1n1s s LEU 175 N 4.16 4.19 0.57 2.97 1.43 -1.26 0.37 118.68 131.11 1n1s s LEU 175 Ca 0.66 1.39 -0.08 0.00 -1.03 0.00 0.00 54.13 55.07 1n1s s LEU 175 Cb -0.27 -3.46 -0.03 0.00 0.03 0.00 0.00 46.19 42.46 1n1s s LEU 175 CO 0.24 -0.49 0.93 0.42 0.23 0.00 0.00 176.35 177.68 1n1s s THR 176 N 2.34 4.61 0.16 5.49 -4.23 -0.46 -0.52 115.64 123.04 1n1s s THR 176 Ca 0.44 0.50 0.00 0.00 -1.18 0.00 0.00 61.69 61.45 1n1s s THR 176 Cb -0.17 -3.80 0.00 0.00 1.34 0.00 0.00 72.50 69.87 1n1s s THR 176 CO 0.13 -0.93 0.00 1.17 -0.54 0.00 0.00 174.62 174.45 1n1s n LYS 177 N -2.56 0.00 -3.86 3.99 4.81 -0.34 -4.40 118.16 115.80 1n1s n LYS 177 Ca 0.04 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.38 1n1s n LYS 177 Cb 0.55 -0.30 -0.07 0.00 0.02 0.00 0.00 35.03 35.23 1n1s n LYS 177 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1n1s s GLU 178 N -2.00 1.02 0.02 1.64 2.02 -1.04 -4.21 118.70 116.13 1n1s s GLU 178 Ca 0.00 -1.00 -0.05 0.00 0.02 0.00 0.00 54.97 53.94 1n1s s GLU 178 Cb 0.00 0.38 -0.01 0.00 0.10 0.00 0.00 34.13 34.60 1n1s s GLU 178 CO 0.00 -0.36 0.09 -0.59 0.02 0.00 0.00 175.26 174.42 1n1s s PHE 179 N -3.89 0.13 0.09 1.61 -0.12 -1.26 -0.89 117.98 113.65 1n1s s PHE 179 Ca 0.09 -0.32 0.02 0.00 -0.05 0.00 0.00 56.93 56.68 1n1s s PHE 179 Cb 0.04 -0.11 -0.04 0.00 -0.63 0.00 0.00 43.02 42.28 1n1s s PHE 179 CO -0.07 -0.28 -0.07 0.08 -0.05 0.00 0.00 175.22 174.83 1n1s s VAL 180 N -1.70 0.71 0.91 -2.49 1.01 -0.69 -4.69 120.40 113.47 1n1s s VAL 180 Ca -0.13 -1.76 -0.11 0.00 0.00 0.00 0.00 61.98 59.98 1n1s s VAL 180 Cb -0.07 -1.46 0.14 0.00 0.00 0.00 0.00 36.38 34.99 1n1s s VAL 180 CO -0.00 -0.75 1.09 -0.83 0.00 0.00 0.00 175.10 174.61 1n1s s GLY 181 N -2.72 1.63 0.00 4.51 0.00 -1.26 -1.00 107.32 108.47 1n1s s GLY 181 Ca 0.07 0.12 0.20 0.00 0.00 0.00 0.00 44.72 45.11 1n1s s GLY 181 CO -0.03 0.60 1.63 0.61 0.00 0.00 0.00 173.10 175.91 1n1s n GLY 182 N -0.61 -0.90 0.05 0.20 0.00 -0.03 -4.50 105.19 99.40 1n1s n GLY 182 Ca 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1n1s n GLY 182 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1n1s n VAL 183 N -1.24 -1.06 -0.47 1.61 0.31 -1.26 -3.68 118.33 112.54 1n1s n VAL 183 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 1n1s n VAL 183 Cb 0.15 -1.06 0.00 0.00 -0.91 0.00 0.00 33.84 32.02 1n1s n VAL 183 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1n1s n GLY 184 N -0.27 -1.85 3.68 2.92 0.00 -0.57 -4.85 105.19 104.26 1n1s n GLY 184 Ca 0.00 -1.94 -0.43 0.00 0.00 0.00 0.00 46.02 43.66 1n1s n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1s s ALA 185 N -1.88 3.51 0.00 4.61 0.00 -1.26 -0.31 121.76 126.42 1n1s s ALA 185 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 51.96 52.23 1n1s s ALA 185 Cb 0.00 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.67 1n1s s ALA 185 CO 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 175.76 175.00 1n1s n ALA 186 N 5.46 0.00 -2.18 0.00 0.00 0.89 -4.68 120.51 120.00 1n1s n ALA 186 Ca 0.09 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.42 1n1s n ALA 186 Cb 0.48 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.83 1n1s n ALA 186 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1n1s s ILE 187 N 1.51 0.25 -0.23 0.00 -4.36 -1.14 -4.70 121.20 112.52 1n1s s ILE 187 Ca 0.00 -1.94 -0.07 0.00 -0.26 0.00 0.00 60.65 58.38 1n1s s ILE 187 Cb 0.00 -2.12 -0.03 0.00 1.25 0.00 0.00 42.46 41.56 1n1s s ILE 187 CO 0.00 -0.41 0.06 -0.69 0.24 0.00 0.00 174.94 174.14 1n1s s VAL 188 N -3.95 4.39 0.92 8.37 1.01 -1.26 -0.93 120.40 128.95 1n1s s VAL 188 Ca 0.26 -0.15 -0.12 0.00 0.00 0.00 0.00 61.98 61.97 1n1s s VAL 188 Cb 0.07 -3.03 0.14 0.00 0.00 0.00 0.00 36.38 33.56 1n1s s VAL 188 CO 0.03 0.37 1.09 0.00 0.00 0.00 0.00 175.10 176.60 1n1s s ALA 189 N 1.31 1.44 0.58 5.51 0.00 -0.03 -4.87 121.76 125.70 1n1s s ALA 189 Ca 0.05 -0.17 0.37 0.00 0.00 0.00 0.00 51.96 52.20 1n1s s ALA 189 Cb -0.15 -3.16 2.04 0.00 0.00 0.00 0.00 23.12 21.85 1n1s s ALA 189 CO 0.03 -2.44 2.27 0.66 0.00 0.00 0.00 175.76 176.29 1n1s h SER 190 N -1.61 0.00 -0.19 0.00 4.64 -2.00 0.80 113.55 115.20 1n1s h SER 190 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 1n1s h SER 190 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1n1s h SER 190 CO 0.56 0.01 0.00 -0.46 -0.87 0.00 0.00 176.83 176.07 1n1s n ASN 191 N -3.43 1.58 0.00 4.97 0.23 -1.26 -4.91 115.26 112.43 1n1s n ASN 191 Ca -0.03 -1.75 0.00 0.00 -0.53 0.00 0.00 54.58 52.28 1n1s n ASN 191 Cb 0.11 -0.12 0.00 0.00 -2.08 0.00 0.00 39.78 37.69 1n1s n ASN 191 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1n1s n GLY 192 N 1.09 1.38 3.77 4.83 0.00 0.28 -5.04 105.19 111.49 1n1s n GLY 192 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 1n1s n GLY 192 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1n1s s ASN 193 N -3.04 6.18 -0.08 1.61 -0.87 -1.26 -4.70 114.94 112.79 1n1s s ASN 193 Ca 0.00 2.79 -0.28 0.00 -1.57 0.00 0.00 52.86 53.80 1n1s s ASN 193 Cb 0.00 -2.65 -0.02 0.00 -0.02 0.00 0.00 41.25 38.56 1n1s s ASN 193 CO 0.00 -0.95 0.91 -0.76 -2.57 0.00 0.00 177.10 173.72 1n1s s LEU 194 N -2.47 4.28 -0.22 0.60 1.43 -0.39 -0.85 118.68 121.07 1n1s s LEU 194 Ca 0.58 1.44 0.01 0.00 -1.03 0.00 0.00 54.13 55.12 1n1s s LEU 194 Cb -0.41 -3.41 0.05 0.00 0.03 0.00 0.00 46.19 42.45 1n1s s LEU 194 CO 0.53 -0.32 -0.07 -0.69 0.23 0.00 0.00 176.35 176.03 1n1s s VAL 195 N 1.50 1.56 -0.18 -1.59 1.01 -0.10 -1.22 120.40 121.37 1n1s s VAL 195 Ca 0.46 -1.14 -0.06 0.00 0.00 0.00 0.00 61.98 61.24 1n1s s VAL 195 Cb -0.19 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.40 1n1s s VAL 195 CO 0.20 -0.01 0.02 -0.31 0.00 0.00 0.00 175.10 175.00 1n1s s TYR 196 N 1.40 3.14 0.16 5.22 4.12 -0.05 -2.90 117.35 128.45 1n1s s TYR 196 Ca -0.04 -0.12 -0.29 0.00 0.02 0.00 0.00 57.07 56.64 1n1s s TYR 196 Cb -0.18 -2.04 -0.07 0.00 -1.52 0.00 0.00 41.96 38.15 1n1s s TYR 196 CO -0.07 0.04 0.90 -1.25 0.02 0.00 0.00 175.55 175.19 1n1s s PRO 197 N 0.45 4.71 0.16 -1.71 0.04 -1.26 -0.30 135.00 137.09 1n1s s PRO 197 Ca 0.00 1.37 0.08 0.00 0.04 0.00 0.00 61.00 62.48 1n1s s PRO 197 Cb -0.13 -3.32 -0.04 0.00 0.04 0.00 0.00 34.50 31.05 1n1s s PRO 197 CO 0.02 0.41 -0.16 0.14 0.04 0.00 0.00 177.00 177.44 1n1s s VAL 198 N -0.67 1.69 -0.13 -0.36 -7.23 0.08 -0.85 120.40 112.94 1n1s s VAL 198 Ca 0.42 -1.93 -0.00 0.00 -1.81 0.00 0.00 61.98 58.65 1n1s s VAL 198 Cb -0.24 -1.81 -0.02 0.00 0.56 0.00 0.00 36.38 34.87 1n1s s VAL 198 CO 0.29 -0.40 -0.12 0.00 -0.31 0.00 0.00 175.10 174.57 1n1s s GLN 199 N -2.94 3.37 -0.08 4.82 -2.07 -0.17 -1.71 119.66 120.87 1n1s s GLN 199 Ca 0.15 -0.66 0.04 0.00 -1.82 0.00 0.00 55.36 53.08 1n1s s GLN 199 Cb -0.04 -2.66 -0.01 0.00 -1.09 0.00 0.00 33.01 29.21 1n1s s GLN 199 CO 0.06 0.25 -0.22 0.42 -1.32 0.00 0.00 175.29 174.48 1n1s s ILE 200 N 0.26 2.26 -0.19 3.63 1.01 0.53 -1.71 121.20 127.00 1n1s s ILE 200 Ca -0.08 -0.98 -0.08 0.00 0.00 0.00 0.00 60.65 59.51 1n1s s ILE 200 Cb -0.15 -1.86 -0.04 0.00 0.01 0.00 0.00 42.46 40.42 1n1s s ILE 200 CO 0.05 0.56 0.08 0.00 0.00 0.00 0.00 174.94 175.63 1n1s s ALA 201 N 0.01 3.46 0.65 9.38 0.00 -0.07 -1.53 121.76 133.66 1n1s s ALA 201 Ca -0.08 -0.77 -0.01 0.00 0.00 0.00 0.00 51.96 51.10 1n1s s ALA 201 Cb -0.15 -2.01 0.07 0.00 0.00 0.00 0.00 23.12 21.04 1n1s s ALA 201 CO 0.05 0.11 0.91 0.16 0.00 0.00 0.00 175.76 176.99 1n1s s ASP 202 N 0.48 4.82 0.21 0.00 1.47 0.03 -1.20 116.67 122.48 1n1s s ASP 202 Ca 0.04 -0.05 -0.09 0.00 1.18 0.00 0.00 52.55 53.64 1n1s s ASP 202 Cb -0.12 -0.60 0.26 0.00 -0.34 0.00 0.00 42.92 42.12 1n1s s ASP 202 CO 0.00 -1.51 1.78 0.24 0.68 0.00 0.00 175.17 176.36 1n1s h MET 203 N -0.29 0.54 -1.78 2.11 2.86 -1.01 -2.80 114.93 114.55 1n1s h MET 203 Ca -0.41 -0.03 -0.19 0.00 -2.06 0.00 0.00 59.70 57.01 1n1s h MET 203 Cb 1.29 -0.12 -0.08 0.00 0.06 0.00 0.00 31.60 32.75 1n1s h MET 203 CO 0.49 0.36 0.19 0.41 1.06 0.00 0.00 176.91 179.41 1n1s n GLY 204 N -1.29 3.37 3.79 8.32 0.00 -1.26 -4.85 105.19 113.27 1n1s n GLY 204 Ca 0.09 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1n1s n GLY 204 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n1s n GLY 205 N 1.01 1.75 3.84 -0.02 0.00 -1.06 -5.00 105.19 105.71 1n1s n GLY 205 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1n1s n GLY 205 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n1s s ARG 206 N -0.02 4.06 0.02 1.61 0.52 -1.26 -4.81 118.95 119.06 1n1s s ARG 206 Ca 0.00 0.98 0.08 0.00 -0.52 0.00 0.00 55.73 56.26 1n1s s ARG 206 Cb 0.00 -2.19 -0.02 0.00 0.52 0.00 0.00 34.95 33.26 1n1s s ARG 206 CO 0.00 -0.13 -0.23 0.08 0.02 0.00 0.00 175.30 175.03 1n1s s VAL 207 N -2.39 1.87 0.24 3.52 1.01 -1.26 -0.79 120.40 122.60 1n1s s VAL 207 Ca 0.59 -1.15 -0.13 0.00 0.00 0.00 0.00 61.98 61.29 1n1s s VAL 207 Cb -0.10 -1.58 -0.00 0.00 0.00 0.00 0.00 36.38 34.70 1n1s s VAL 207 CO 0.23 0.39 0.47 0.72 0.00 0.00 0.00 175.10 176.91 1n1s s PHE 208 N -0.68 0.36 0.21 5.22 -0.12 -0.58 -0.59 117.98 121.79 1n1s s PHE 208 Ca 0.09 -0.72 0.11 0.00 -0.05 0.00 0.00 56.93 56.36 1n1s s PHE 208 Cb -0.09 0.18 -0.04 0.00 -0.63 0.00 0.00 43.02 42.43 1n1s s PHE 208 CO 0.01 -0.98 -0.18 0.95 -0.05 0.00 0.00 175.22 174.97 1n1s s THR 209 N -4.01 2.66 0.29 -4.49 -4.23 -1.26 -0.34 115.64 104.25 1n1s s THR 209 Ca 0.22 -1.99 -0.06 0.00 -1.18 0.00 0.00 61.69 58.68 1n1s s THR 209 Cb -0.00 -2.32 -0.01 0.00 1.34 0.00 0.00 72.50 71.51 1n1s s THR 209 CO 0.08 -0.18 0.42 -0.54 -0.54 0.00 0.00 174.62 173.87 1n1s s LYS 210 N -2.91 1.68 -0.14 3.99 1.02 -0.70 -1.65 119.74 121.02 1n1s s LYS 210 Ca 0.24 -1.56 -0.04 0.00 0.02 0.00 0.00 55.97 54.63 1n1s s LYS 210 Cb -0.08 0.43 -0.03 0.00 -0.52 0.00 0.00 37.83 37.63 1n1s s LYS 210 CO 0.13 -0.68 0.00 0.42 -0.92 0.00 0.00 175.35 174.30 1n1s s ILE 211 N -3.56 4.28 -0.17 2.17 -1.09 -1.26 -0.74 121.20 120.83 1n1s s ILE 211 Ca 0.29 -0.23 0.01 0.00 -2.23 0.00 0.00 60.65 58.49 1n1s s ILE 211 Cb 0.01 -2.87 0.02 0.00 -1.58 0.00 0.00 42.46 38.03 1n1s s ILE 211 CO 0.15 0.52 -0.20 -0.32 -1.23 0.00 0.00 174.94 173.86 1n1s s MET 212 N -0.01 2.98 0.18 2.79 -2.45 0.59 -1.04 119.30 122.33 1n1s s MET 212 Ca 0.03 -0.83 0.03 0.00 -1.25 0.00 0.00 55.69 53.67 1n1s s MET 212 Cb -0.13 -2.54 -0.05 0.00 1.25 0.00 0.00 34.83 33.37 1n1s s MET 212 CO 0.02 -0.18 -0.04 1.52 1.05 0.00 0.00 175.02 177.39 1n1s s TYR 213 N 1.22 1.31 -0.03 4.11 1.13 0.32 -0.87 117.35 124.54 1n1s s TYR 213 Ca 0.03 -0.90 0.02 0.00 -1.41 0.00 0.00 57.07 54.81 1n1s s TYR 213 Cb -0.13 -0.73 0.01 0.00 -1.10 0.00 0.00 41.96 40.01 1n1s s TYR 213 CO -0.11 -0.06 -0.07 0.45 -2.51 0.00 0.00 175.55 173.25 1n1s s SER 214 N -3.20 1.05 0.00 -0.18 0.15 -0.36 -0.48 113.70 110.68 1n1s s SER 214 Ca 0.22 -0.16 0.24 0.00 0.70 0.00 0.00 55.95 56.96 1n1s s SER 214 Cb 0.05 -0.38 0.27 0.00 -1.71 0.00 0.00 66.02 64.25 1n1s s SER 214 CO 0.04 0.01 1.29 -0.62 1.20 0.00 0.00 173.24 175.16 1n1s n GLU 215 N 3.59 1.85 -2.17 5.44 1.02 -1.26 -1.26 120.64 127.86 1n1s n GLU 215 Ca -0.21 -1.47 -0.11 0.00 -0.02 0.00 0.00 57.16 55.35 1n1s n GLU 215 Cb 0.53 -1.47 0.05 0.00 -0.02 0.00 0.00 31.44 30.53 1n1s n GLU 215 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1n1s n ASP 216 N 0.71 3.21 -3.28 1.62 3.85 -1.26 -4.92 116.55 116.47 1n1s n ASP 216 Ca 0.13 -3.03 -0.24 0.00 -0.71 0.00 0.00 54.79 50.94 1n1s n ASP 216 Cb 0.52 -0.40 0.05 0.00 -1.35 0.00 0.00 41.12 39.93 1n1s n ASP 216 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 1n1s n ASP 217 N -0.63 -5.98 0.00 -1.12 10.43 -1.26 -2.98 116.55 115.01 1n1s n ASP 217 Ca 0.26 -0.41 0.00 0.00 2.57 0.00 0.00 54.79 57.22 1n1s n ASP 217 Cb 0.90 -4.79 0.00 0.00 1.84 0.00 0.00 41.12 39.07 1n1s n ASP 217 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1n1s n GLY 218 N -1.67 0.67 0.24 0.44 0.00 -1.26 -4.96 105.19 98.65 1n1s n GLY 218 Ca -0.06 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.80 1n1s n GLY 218 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1n1s h ASN 219 N 0.00 0.97 -4.41 1.61 2.35 -1.95 -3.45 115.58 110.70 1n1s h ASN 219 Ca 0.00 -0.57 -0.35 0.00 -0.55 0.00 0.00 56.30 54.83 1n1s h ASN 219 Cb 0.00 -0.28 -0.19 0.00 0.05 0.00 0.00 38.32 37.90 1n1s h ASN 219 CO 0.00 1.37 -0.75 0.42 -1.65 0.00 0.00 177.43 176.82 1n1s s THR 220 N -3.98 0.99 0.02 2.81 -4.23 -1.26 -5.11 115.64 104.88 1n1s s THR 220 Ca -0.10 -1.49 0.04 0.00 -1.18 0.00 0.00 61.69 58.96 1n1s s THR 220 Cb 0.10 -1.21 -0.02 0.00 1.34 0.00 0.00 72.50 72.71 1n1s s THR 220 CO 0.90 -0.42 -0.13 0.26 -0.54 0.00 0.00 174.62 174.69 1n1s s TRP 221 N -1.94 1.13 -0.01 3.99 0.52 -1.26 -4.36 118.94 117.01 1n1s s TRP 221 Ca 0.02 -0.31 0.05 0.00 0.02 0.00 0.00 56.10 55.89 1n1s s TRP 221 Cb -0.06 -0.69 -0.01 0.00 -1.15 0.00 0.00 33.47 31.55 1n1s s TRP 221 CO 0.01 0.01 -0.17 0.15 0.02 0.00 0.00 176.95 176.97 1n1s s LYS 222 N -0.86 1.38 -0.28 4.98 1.02 0.37 -4.95 119.74 121.41 1n1s s LYS 222 Ca 0.02 -0.63 -0.14 0.00 0.02 0.00 0.00 55.97 55.24 1n1s s LYS 222 Cb -0.07 -1.34 -0.04 0.00 -0.52 0.00 0.00 37.83 35.86 1n1s s LYS 222 CO 0.01 0.37 0.35 -0.06 -0.92 0.00 0.00 175.35 175.09 1n1s s PHE 223 N -0.43 3.24 0.71 3.18 0.40 -1.26 -0.52 117.98 123.29 1n1s s PHE 223 Ca 0.07 0.33 -0.13 0.00 -0.60 0.00 0.00 56.93 56.59 1n1s s PHE 223 Cb -0.07 -2.56 0.02 0.00 0.51 0.00 0.00 43.02 40.93 1n1s s PHE 223 CO -0.01 -0.24 1.10 0.00 0.70 0.00 0.00 175.22 176.78 1n1s s ALA 224 N 2.03 2.39 0.30 5.36 0.00 -0.21 -4.96 121.76 126.65 1n1s s ALA 224 Ca 0.14 0.42 0.03 0.00 0.00 0.00 0.00 51.96 52.55 1n1s s ALA 224 Cb -0.16 -3.30 0.46 0.00 0.00 0.00 0.00 23.12 20.13 1n1s s ALA 224 CO 0.10 -1.48 1.75 0.93 0.00 0.00 0.00 175.76 177.07 1n1s h GLU 225 N -0.47 0.45 -7.36 0.00 5.08 -1.75 -3.43 114.58 107.10 1n1s h GLU 225 Ca -0.45 -0.16 -0.49 0.00 -1.00 0.00 0.00 59.36 57.26 1n1s h GLU 225 Cb 1.24 -0.03 0.13 0.00 0.50 0.00 0.00 28.75 30.58 1n1s h GLU 225 CO 0.53 0.65 0.30 0.20 -1.00 0.00 0.00 179.01 179.69 1n1s s GLY 226 N -4.00 1.63 0.18 -3.84 0.00 -0.08 -4.98 107.32 96.23 1n1s s GLY 226 Ca -0.07 -0.08 -0.17 0.00 0.00 0.00 0.00 44.72 44.41 1n1s s GLY 226 CO 0.78 0.36 0.49 1.09 0.00 0.00 0.00 173.10 175.82 1n1s s ARG 227 N -5.03 1.31 0.86 2.90 1.70 -1.26 -4.57 118.95 114.86 1n1s s ARG 227 Ca 0.62 -0.84 -0.13 0.00 -0.47 0.00 0.00 55.73 54.91 1n1s s ARG 227 Cb -0.16 0.51 0.13 0.00 -0.57 0.00 0.00 34.95 34.86 1n1s s ARG 227 CO 0.56 -0.55 1.21 -1.54 -1.08 0.00 0.00 175.30 173.90 1n1s s SER 228 N -2.86 3.90 0.88 -2.89 1.04 -0.66 -4.87 113.70 108.24 1n1s s SER 228 Ca 0.08 0.44 -0.11 0.00 0.48 0.00 0.00 55.95 56.85 1n1s s SER 228 Cb -0.00 -0.74 0.12 0.00 0.10 0.00 0.00 66.02 65.49 1n1s s SER 228 CO -0.05 -2.24 1.11 -0.54 0.98 0.00 0.00 173.24 172.50 1n1s s LYS 229 N -5.66 1.37 0.56 4.02 1.02 -1.26 -4.63 119.74 115.16 1n1s s LYS 229 Ca 0.67 1.25 -0.19 0.00 0.02 0.00 0.00 55.97 57.72 1n1s s LYS 229 Cb -0.07 -1.79 -0.05 0.00 -0.52 0.00 0.00 37.83 35.40 1n1s s LYS 229 CO 0.50 -2.29 1.17 -0.06 -0.92 0.00 0.00 175.35 173.75 1n1s s PHE 230 N -2.77 2.55 0.00 3.18 0.40 -1.26 -3.48 117.98 116.60 1n1s s PHE 230 Ca 0.64 1.53 0.00 0.00 -0.60 0.00 0.00 56.93 58.50 1n1s s PHE 230 Cb -0.20 -3.39 0.00 0.00 0.51 0.00 0.00 43.02 39.94 1n1s s PHE 230 CO 0.58 -1.87 0.00 0.41 0.70 0.00 0.00 175.22 175.04 1n1s n GLY 231 N 0.33 0.37 3.83 4.36 0.00 0.24 -5.00 105.19 109.32 1n1s n GLY 231 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 1n1s n GLY 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1s n SER 233 N 2.16 -0.63 -3.70 0.00 3.41 -0.09 -3.28 113.62 111.50 1n1s n SER 233 Ca -0.15 -2.62 -0.16 0.00 -0.26 0.00 0.00 58.87 55.67 1n1s n SER 233 Cb 0.53 1.39 0.01 0.00 -0.26 0.00 0.00 64.21 65.87 1n1s n SER 233 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1n1s n GLU 234 N -0.47 -0.71 -2.44 4.33 1.02 -1.26 -1.14 120.64 119.98 1n1s n GLU 234 Ca 0.05 -0.20 -0.39 0.00 -0.02 0.00 0.00 57.16 56.60 1n1s n GLU 234 Cb 0.46 -0.42 -0.04 0.00 -0.02 0.00 0.00 31.44 31.42 1n1s n GLU 234 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1n1s s PRO 235 N -5.39 4.42 -0.01 3.49 0.04 -1.24 -3.79 135.00 132.51 1n1s s PRO 235 Ca 0.15 1.77 0.07 0.00 0.04 0.00 0.00 61.00 63.03 1n1s s PRO 235 Cb -0.08 -2.95 -0.03 0.00 0.04 0.00 0.00 34.50 31.48 1n1s s PRO 235 CO 0.36 0.02 -0.21 0.00 0.04 0.00 0.00 177.00 177.21 1n1s s ALA 236 N -1.32 2.40 0.05 8.56 0.00 -0.34 -4.30 121.76 126.82 1n1s s ALA 236 Ca 0.50 -1.11 0.06 0.00 0.00 0.00 0.00 51.96 51.40 1n1s s ALA 236 Cb -0.30 -0.70 -0.02 0.00 0.00 0.00 0.00 23.12 22.10 1n1s s ALA 236 CO 0.38 0.55 -0.16 0.54 0.00 0.00 0.00 175.76 177.07 1n1s s VAL 237 N -0.73 1.27 0.18 0.00 0.11 -1.26 -0.72 120.40 119.25 1n1s s VAL 237 Ca 0.12 -1.10 -0.03 0.00 -2.93 0.00 0.00 61.98 58.04 1n1s s VAL 237 Cb -0.10 -1.14 -0.03 0.00 -1.53 0.00 0.00 36.38 33.57 1n1s s VAL 237 CO 0.01 0.03 0.16 -1.48 -3.33 0.00 0.00 175.10 170.49 1n1s s LEU 238 N -1.23 1.24 -0.14 2.54 0.05 -0.90 -4.65 118.68 115.59 1n1s s LEU 238 Ca 0.03 -1.23 -0.05 0.00 0.05 0.00 0.00 54.13 52.93 1n1s s LEU 238 Cb -0.08 0.58 -0.03 0.00 -2.05 0.00 0.00 46.19 44.60 1n1s s LEU 238 CO 0.02 -0.84 0.02 -0.70 -0.55 0.00 0.00 176.35 174.30 1n1s s GLU 239 N -4.09 3.55 -0.06 1.48 2.12 -1.26 -0.86 118.70 119.58 1n1s s GLU 239 Ca 0.30 -0.40 -0.03 0.00 0.36 0.00 0.00 54.97 55.21 1n1s s GLU 239 Cb 0.06 -3.00 0.04 0.00 0.26 0.00 0.00 34.13 31.49 1n1s s GLU 239 CO 0.07 0.43 0.09 -0.46 -0.54 0.00 0.00 175.26 174.85 1n1s s TRP 240 N -0.11 0.01 -1.45 5.30 -0.11 0.84 -4.90 118.94 118.53 1n1s s TRP 240 Ca 0.05 0.29 -0.02 0.00 1.22 0.00 0.00 56.10 57.63 1n1s s TRP 240 Cb -0.12 -0.45 0.02 0.00 -1.50 0.00 0.00 33.47 31.42 1n1s s TRP 240 CO 0.02 -0.24 0.44 0.39 -4.62 0.00 0.00 176.95 172.94 1n1s n GLU 241 N 5.30 -3.17 -1.00 5.86 1.02 -1.26 -1.08 120.64 126.32 1n1s n GLU 241 Ca -0.04 0.38 0.00 0.00 -0.02 0.00 0.00 57.16 57.49 1n1s n GLU 241 Cb 0.50 -4.55 0.00 0.00 -0.02 0.00 0.00 31.44 27.37 1n1s n GLU 241 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1n1s n GLY 242 N -1.95 0.47 3.35 0.62 0.00 -1.26 -5.02 105.19 101.40 1n1s n GLY 242 Ca -0.26 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.56 1n1s n GLY 242 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n1s s LYS 243 N -0.24 1.34 -0.07 1.61 1.02 -0.24 -4.76 119.74 118.40 1n1s s LYS 243 Ca 0.00 -1.54 -0.16 0.00 0.02 0.00 0.00 55.97 54.28 1n1s s LYS 243 Cb 0.00 -1.25 -0.05 0.00 -0.52 0.00 0.00 37.83 36.01 1n1s s LYS 243 CO 0.00 0.23 0.44 -0.51 -0.92 0.00 0.00 175.35 174.58 1n1s s LEU 244 N -3.11 4.36 -0.21 3.17 1.43 0.06 -0.11 118.68 124.27 1n1s s LEU 244 Ca 0.21 0.86 -0.02 0.00 -1.03 0.00 0.00 54.13 54.14 1n1s s LEU 244 Cb -0.03 -2.63 -0.00 0.00 0.03 0.00 0.00 46.19 43.56 1n1s s LEU 244 CO 0.08 0.15 -0.09 -0.63 0.23 0.00 0.00 176.35 176.09 1n1s s ILE 245 N -0.12 2.99 -0.27 -0.59 1.01 -0.04 -1.09 121.20 123.09 1n1s s ILE 245 Ca 0.24 -0.62 -0.06 0.00 0.00 0.00 0.00 60.65 60.21 1n1s s ILE 245 Cb -0.16 -2.34 0.01 0.00 0.01 0.00 0.00 42.46 39.98 1n1s s ILE 245 CO 0.11 0.46 0.04 -0.63 0.00 0.00 0.00 174.94 174.92 1n1s s ILE 246 N 1.41 3.72 -0.29 2.92 1.01 0.16 -2.11 121.20 128.01 1n1s s ILE 246 Ca 0.05 -0.70 -0.07 0.00 0.00 0.00 0.00 60.65 59.94 1n1s s ILE 246 Cb -0.14 -2.88 0.01 0.00 0.01 0.00 0.00 42.46 39.46 1n1s s ILE 246 CO -0.06 0.16 0.09 0.21 0.00 0.00 0.00 174.94 175.33 1n1s s ASN 247 N 1.47 5.16 -0.05 3.58 3.84 0.10 -0.98 114.94 128.07 1n1s s ASN 247 Ca 0.03 -0.67 -0.02 0.00 0.21 0.00 0.00 52.86 52.41 1n1s s ASN 247 Cb -0.17 -1.89 -0.04 0.00 -0.55 0.00 0.00 41.25 38.61 1n1s s ASN 247 CO 0.01 -0.19 0.05 0.20 -2.79 0.00 0.00 177.10 174.38 1n1s s ASN 248 N 1.51 5.57 0.28 -4.21 0.01 -0.67 -1.19 114.94 116.23 1n1s s ASN 248 Ca 0.03 0.18 -0.29 0.00 -0.71 0.00 0.00 52.86 52.06 1n1s s ASN 248 Cb -0.17 -1.61 -0.10 0.00 0.41 0.00 0.00 41.25 39.79 1n1s s ASN 248 CO 0.03 0.33 1.15 -0.60 -1.51 0.00 0.00 177.10 176.50 1n1s s ARG 249 N -1.31 4.56 -0.27 -0.60 3.52 -0.29 -3.98 118.95 120.58 1n1s s ARG 249 Ca 0.18 1.90 -0.04 0.00 -0.13 0.00 0.00 55.73 57.64 1n1s s ARG 249 Cb -0.12 -3.17 0.09 0.00 -1.56 0.00 0.00 34.95 30.20 1n1s s ARG 249 CO 0.08 0.09 0.12 0.08 -0.81 0.00 0.00 175.30 174.87 1n1s s VAL 250 N -1.02 -0.07 0.14 7.11 1.01 -1.26 -0.91 120.40 125.39 1n1s s VAL 250 Ca 0.46 -0.68 -0.31 0.00 0.00 0.00 0.00 61.98 61.46 1n1s s VAL 250 Cb -0.34 -0.92 -0.09 0.00 0.00 0.00 0.00 36.38 35.03 1n1s s VAL 250 CO 0.43 -0.67 1.46 -1.81 0.00 0.00 0.00 175.10 174.51 1n1s s ASP 251 N 2.11 6.73 0.00 3.32 -0.00 -1.26 -3.23 116.67 124.34 1n1s s ASP 251 Ca 0.08 2.45 0.00 0.00 -0.00 0.00 0.00 52.55 55.09 1n1s s ASP 251 Cb -0.16 -2.59 0.00 0.00 -0.00 0.00 0.00 42.92 40.17 1n1s s ASP 251 CO -0.33 -0.72 0.00 0.61 -0.00 0.00 0.00 175.17 174.73 1n1s n GLY 252 N 3.51 0.74 3.74 0.21 0.00 -0.02 -4.90 105.19 108.46 1n1s n GLY 252 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 1n1s n GLY 252 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1n1s s ASN 253 N -2.47 0.09 0.69 1.61 3.04 -0.85 -4.39 114.94 112.67 1n1s s ASN 253 Ca 0.00 -1.06 -0.13 0.00 0.04 0.00 0.00 52.86 51.71 1n1s s ASN 253 Cb 0.00 0.76 0.02 0.00 -1.54 0.00 0.00 41.25 40.49 1n1s s ASN 253 CO 0.00 -1.48 1.10 -0.13 -3.04 0.00 0.00 177.10 173.55 1n1s s ARG 254 N -3.02 2.64 -0.05 0.43 0.52 -1.26 -4.49 118.95 113.72 1n1s s ARG 254 Ca 0.18 1.30 -0.30 0.00 -0.52 0.00 0.00 55.73 56.40 1n1s s ARG 254 Cb -0.04 -1.94 -0.03 0.00 0.52 0.00 0.00 34.95 33.46 1n1s s ARG 254 CO 0.12 -1.36 1.18 1.03 0.02 0.00 0.00 175.30 176.29 1n1s s ARG 255 N -4.37 4.37 0.03 3.54 0.52 -0.11 -4.76 118.95 118.16 1n1s s ARG 255 Ca 0.65 1.65 -0.22 0.00 -0.52 0.00 0.00 55.73 57.29 1n1s s ARG 255 Cb -0.19 -3.54 -0.06 0.00 0.52 0.00 0.00 34.95 31.68 1n1s s ARG 255 CO 0.46 -0.42 0.66 -0.51 0.02 0.00 0.00 175.30 175.51 1n1s s LEU 256 N 2.11 4.45 -0.03 2.53 1.43 -1.26 -0.84 118.68 127.07 1n1s s LEU 256 Ca 0.55 1.29 0.06 0.00 -1.03 0.00 0.00 54.13 55.01 1n1s s LEU 256 Cb -0.24 -3.04 -0.01 0.00 0.03 0.00 0.00 46.19 42.92 1n1s s LEU 256 CO 0.22 0.10 -0.22 -0.69 0.23 0.00 0.00 176.35 175.99 1n1s s VAL 257 N -0.31 1.79 0.20 -1.59 1.01 -1.26 -1.67 120.40 118.57 1n1s s VAL 257 Ca 0.33 -0.94 0.09 0.00 0.00 0.00 0.00 61.98 61.46 1n1s s VAL 257 Cb -0.19 -1.50 -0.05 0.00 0.00 0.00 0.00 36.38 34.64 1n1s s VAL 257 CO 0.20 0.50 -0.17 -0.31 0.00 0.00 0.00 175.10 175.33 1n1s s TYR 258 N -0.31 1.85 0.05 5.22 1.51 -0.15 0.01 117.35 125.52 1n1s s TYR 258 Ca 0.03 -0.50 0.09 0.00 -1.01 0.00 0.00 57.07 55.68 1n1s s TYR 258 Cb -0.11 -0.87 -0.03 0.00 -0.11 0.00 0.00 41.96 40.85 1n1s s TYR 258 CO 0.01 0.41 -0.25 -1.21 -1.11 0.00 0.00 175.55 173.40 1n1s s GLU 259 N -3.34 1.70 -0.03 -0.62 2.02 0.27 -0.67 118.70 118.04 1n1s s GLU 259 Ca 0.21 -1.09 -0.01 0.00 0.02 0.00 0.00 54.97 54.11 1n1s s GLU 259 Cb -0.03 -1.88 0.03 0.00 0.10 0.00 0.00 34.13 32.35 1n1s s GLU 259 CO 0.08 0.48 0.04 0.45 0.02 0.00 0.00 175.26 176.33 1n1s s SER 260 N -1.27 0.65 0.00 -0.19 0.15 -0.25 -1.22 113.70 111.57 1n1s s SER 260 Ca 0.11 0.05 0.25 0.00 0.70 0.00 0.00 55.95 57.06 1n1s s SER 260 Cb -0.10 -0.13 0.52 0.00 -1.71 0.00 0.00 66.02 64.60 1n1s s SER 260 CO 0.02 -0.18 1.44 -1.20 1.20 0.00 0.00 173.24 174.51 1n1s n SER 261 N 4.73 2.13 -2.56 5.45 7.64 -1.26 -0.76 113.62 128.99 1n1s n SER 261 Ca -0.16 -1.64 -0.18 0.00 1.01 0.00 0.00 58.87 57.91 1n1s n SER 261 Cb 0.50 0.08 0.02 0.00 -1.01 0.00 0.00 64.21 63.80 1n1s n SER 261 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1n1s n ASP 262 N 0.53 3.12 -3.76 6.43 3.85 -1.26 -4.91 116.55 120.55 1n1s n ASP 262 Ca 0.15 -3.20 -0.28 0.00 -0.71 0.00 0.00 54.79 50.75 1n1s n ASP 262 Cb 0.47 -0.49 0.04 0.00 -1.35 0.00 0.00 41.12 39.79 1n1s n ASP 262 CO 0.00 0.00 0.00 0.80 -1.01 0.00 0.00 177.20 176.99 1n1s n MET 263 N -0.31 -5.94 -0.59 0.11 0.00 -1.26 -2.07 117.12 107.07 1n1s n MET 263 Ca 0.24 0.66 0.00 0.00 -0.00 0.00 0.00 57.70 58.61 1n1s n MET 263 Cb 0.75 -5.58 0.00 0.00 0.00 0.00 0.00 33.22 28.39 1n1s n MET 263 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1n1s n GLY 264 N -1.73 0.89 0.19 -5.12 0.00 -1.26 -4.78 105.19 93.39 1n1s n GLY 264 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 1n1s n GLY 264 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1n1s h LYS 265 N 3.65 0.58 -5.85 1.61 3.64 -1.76 -0.18 116.57 118.27 1n1s h LYS 265 Ca 0.00 -0.11 -0.58 0.00 -1.27 0.00 0.00 60.65 58.68 1n1s h LYS 265 Cb 0.00 -0.09 -0.30 0.00 -0.41 0.00 0.00 32.23 31.43 1n1s h LYS 265 CO 0.00 0.57 -0.85 0.95 -2.27 0.00 0.00 179.45 177.85 1n1s s THR 266 N -5.49 1.55 0.01 1.00 -4.23 -1.26 -1.70 115.64 105.52 1n1s s THR 266 Ca -0.13 -0.83 0.08 0.00 -1.18 0.00 0.00 61.69 59.63 1n1s s THR 266 Cb 0.10 -1.29 -0.03 0.00 1.34 0.00 0.00 72.50 72.62 1n1s s THR 266 CO 0.75 0.44 -0.24 0.26 -0.54 0.00 0.00 174.62 175.29 1n1s s TRP 267 N -0.40 2.40 -0.02 3.99 0.52 -1.26 -4.33 118.94 119.83 1n1s s TRP 267 Ca 0.06 -0.37 0.04 0.00 0.02 0.00 0.00 56.10 55.84 1n1s s TRP 267 Cb -0.08 -1.46 -0.00 0.00 -1.15 0.00 0.00 33.47 30.77 1n1s s TRP 267 CO -0.00 0.09 -0.13 0.14 0.02 0.00 0.00 176.95 177.07 1n1s s VAL 268 N -0.75 1.05 0.31 4.03 -7.23 -0.36 -4.96 120.40 112.49 1n1s s VAL 268 Ca 0.12 -0.54 -0.29 0.00 -1.81 0.00 0.00 61.98 59.46 1n1s s VAL 268 Cb -0.10 -0.90 -0.10 0.00 0.56 0.00 0.00 36.38 35.83 1n1s s VAL 268 CO 0.01 0.31 1.40 -0.70 -0.31 0.00 0.00 175.10 175.81 1n1s s GLU 269 N -0.07 4.26 -1.60 4.82 2.12 -1.26 -0.56 118.70 126.41 1n1s s GLU 269 Ca 0.00 2.34 -0.10 0.00 0.36 0.00 0.00 54.97 57.57 1n1s s GLU 269 Cb -0.08 -3.06 -0.07 0.00 0.26 0.00 0.00 34.13 31.18 1n1s s GLU 269 CO 0.00 -0.36 2.91 0.00 -0.54 0.00 0.00 175.26 177.28 1n1s n ALA 270 N 1.34 7.50 0.23 6.30 0.00 0.10 -4.67 120.51 131.30 1n1s n ALA 270 Ca 0.03 -3.58 0.06 0.00 0.00 0.00 0.00 53.44 49.95 1n1s n ALA 270 Cb 0.40 -3.33 0.52 0.00 0.00 0.00 0.00 19.45 17.04 1n1s n ALA 270 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1n1s h LEU 271 N 6.92 0.00 -1.26 0.00 3.38 -1.89 -0.91 115.31 121.55 1n1s h LEU 271 Ca 0.86 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.83 1n1s h LEU 271 Cb 0.29 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1n1s h LEU 271 CO 1.77 0.16 0.00 0.61 0.09 0.00 0.00 178.44 181.07 1n1s n GLY 272 N -1.07 0.47 1.28 0.83 0.00 -1.26 -4.22 105.19 101.21 1n1s n GLY 272 Ca -0.02 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1n1s n GLY 272 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1n1s n THR 273 N 0.47 0.00 0.06 2.61 -2.24 -0.99 -4.80 114.28 109.39 1n1s n THR 273 Ca 0.16 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.96 1n1s n THR 273 Cb 0.36 -0.03 -0.02 0.00 -2.10 0.00 0.00 70.33 68.54 1n1s n THR 273 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1n1s n LEU 274 N -1.98 0.06 -4.76 3.22 4.77 -1.05 -4.66 117.00 112.60 1n1s n LEU 274 Ca 0.00 -0.17 -0.41 0.00 -0.03 0.00 0.00 56.01 55.40 1n1s n LEU 274 Cb 0.00 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 1n1s n LEU 274 CO 0.00 0.01 1.05 -0.55 -1.33 0.00 0.00 177.39 176.57 1n1s s SER 275 N -2.04 6.67 0.00 -1.43 0.15 -0.38 -2.39 113.70 114.27 1n1s s SER 275 Ca -0.00 2.74 0.00 0.00 0.70 0.00 0.00 55.95 59.38 1n1s s SER 275 Cb 0.02 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 1n1s s SER 275 CO 0.15 -0.64 0.00 1.41 1.20 0.00 0.00 173.24 175.35 1n1s n HIS 276 N 1.27 0.00 -0.03 3.44 8.25 -0.02 -4.82 115.22 123.30 1n1s n HIS 276 Ca 0.02 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.36 1n1s n HIS 276 Cb 0.41 -1.27 -0.08 0.00 1.12 0.00 0.00 29.99 30.17 1n1s n HIS 276 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1n1s h VAL 277 N 0.00 1.33 -2.32 1.59 2.07 -1.68 -3.42 116.25 113.82 1n1s h VAL 277 Ca 0.00 -1.09 -0.50 0.00 0.82 0.00 0.00 66.70 65.94 1n1s h VAL 277 Cb 0.52 1.87 -0.03 0.00 -1.52 0.00 0.00 31.29 32.14 1n1s h VAL 277 CO 0.00 0.30 -0.47 0.26 0.02 0.00 0.00 177.57 177.68 1n1s s TRP 278 N -4.51 3.36 0.36 1.57 0.51 -1.26 -1.03 118.94 117.94 1n1s s TRP 278 Ca -0.15 -0.01 -0.05 0.00 -2.12 0.00 0.00 56.10 53.77 1n1s s TRP 278 Cb 0.04 -1.55 0.02 0.00 -0.81 0.00 0.00 33.47 31.17 1n1s s TRP 278 CO 0.71 0.48 0.56 -0.08 -0.51 0.00 0.00 176.95 178.11 1n1s s THR 279 N -1.94 0.00 -0.59 2.01 -1.32 -1.26 -0.94 115.64 111.60 1n1s s THR 279 Ca 0.34 -1.45 0.24 0.00 -1.21 0.00 0.00 61.69 59.61 1n1s s THR 279 Cb -0.09 -2.74 0.13 0.00 -1.51 0.00 0.00 72.50 68.29 1n1s s THR 279 CO 0.28 0.00 1.42 -0.55 -2.21 0.00 0.00 174.62 173.56 1n1s h ASN 280 N 2.06 0.00 -5.88 8.08 -1.07 -1.88 -3.48 115.58 113.41 1n1s h ASN 280 Ca -0.29 -0.12 0.36 0.00 0.07 0.00 0.00 56.30 56.32 1n1s h ASN 280 Cb 1.24 0.00 -0.13 0.00 -2.07 0.00 0.00 38.32 37.36 1n1s h ASN 280 CO 0.39 0.06 0.91 -0.94 0.07 0.00 0.00 177.43 177.92 1n1s s SER 281 N -4.62 -0.03 0.37 6.14 1.04 -1.26 -4.57 113.70 110.77 1n1s s SER 281 Ca 0.07 -0.07 0.11 0.00 0.48 0.00 0.00 55.95 56.53 1n1s s SER 281 Cb 0.12 0.08 0.89 0.00 0.10 0.00 0.00 66.02 67.21 1n1s s SER 281 CO 0.70 -0.16 1.88 -0.65 0.98 0.00 0.00 173.24 175.98 1n1s h PRO 282 N 2.00 0.59 -0.02 4.02 0.11 -1.81 -2.33 132.00 134.57 1n1s h PRO 282 Ca -0.32 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1n1s h PRO 282 Cb 1.20 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1n1s h PRO 282 CO 0.29 0.39 -0.27 0.25 -0.21 0.00 0.00 178.00 178.45 1n1s n THR 283 N -4.54 0.00 -0.90 -1.15 -2.24 -1.26 -4.68 114.28 99.50 1n1s n THR 283 Ca 0.17 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1n1s n THR 283 Cb 0.51 0.92 0.00 0.00 -2.10 0.00 0.00 70.33 69.66 1n1s n THR 283 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1n1s n SER 284 N 0.01 -4.19 -1.02 3.42 7.64 -0.88 -4.82 113.62 113.78 1n1s n SER 284 Ca 0.12 0.00 0.02 0.00 1.01 0.00 0.00 58.87 60.02 1n1s n SER 284 Cb 0.44 -2.77 0.23 0.00 -1.01 0.00 0.00 64.21 61.10 1n1s n SER 284 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1n1s n ASN 285 N -0.63 3.25 -4.77 6.43 6.94 -1.26 -2.00 115.26 123.22 1n1s n ASN 285 Ca 0.00 -3.35 -0.23 0.00 -0.02 0.00 0.00 54.58 50.97 1n1s n ASN 285 Cb 0.32 -0.59 -0.06 0.00 -2.36 0.00 0.00 39.78 37.09 1n1s n ASN 285 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 1n1s s GLN 286 N -3.02 2.36 0.27 -3.83 -1.52 -1.26 -4.65 119.66 108.01 1n1s s GLN 286 Ca 0.43 -1.65 -0.30 0.00 -1.95 0.00 0.00 55.36 51.89 1n1s s GLN 286 Cb 0.37 -2.16 -0.13 0.00 -0.22 0.00 0.00 33.01 30.88 1n1s s GLN 286 CO 0.05 -0.05 1.42 0.94 -0.25 0.00 0.00 175.29 177.40 1n1s n GLN 287 N -1.29 2.17 -1.00 2.91 7.27 -1.26 -0.84 117.38 125.34 1n1s n GLN 287 Ca -0.01 0.77 -0.06 0.00 0.07 0.00 0.00 57.00 57.78 1n1s n GLN 287 Cb 0.63 -2.43 0.03 0.00 2.41 0.00 0.00 30.24 30.87 1n1s n GLN 287 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1n1s n ASP 288 N 1.91 0.28 -3.88 1.69 2.03 -1.26 -4.74 116.55 112.59 1n1s n ASP 288 Ca 0.10 -1.25 -0.10 0.00 0.52 0.00 0.00 54.79 54.06 1n1s n ASP 288 Cb 0.33 -0.16 -0.09 0.00 -0.72 0.00 0.00 41.12 40.48 1n1s n ASP 288 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1n1s n GLN 290 N 0.89 1.17 -4.09 0.00 0.00 -1.26 -4.77 117.38 109.31 1n1s n GLN 290 Ca -0.20 0.45 -0.14 0.00 -0.00 0.00 0.00 57.00 57.12 1n1s n GLN 290 Cb 0.58 -2.54 -0.13 0.00 0.00 0.00 0.00 30.24 28.15 1n1s n GLN 290 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 1n1s s SER 291 N -1.34 0.67 0.24 1.69 0.01 -1.26 -4.61 113.70 109.10 1n1s s SER 291 Ca 0.82 -0.32 -0.10 0.00 1.31 0.00 0.00 55.95 57.66 1n1s s SER 291 Cb -0.38 -0.01 -0.07 0.00 0.21 0.00 0.00 66.02 65.77 1n1s s SER 291 CO 0.41 -0.08 0.56 -0.94 0.41 0.00 0.00 173.24 173.60 1n1s s SER 292 N -0.87 6.62 -0.27 2.44 1.04 -1.22 -4.81 113.70 116.63 1n1s s SER 292 Ca -0.05 0.93 -0.01 0.00 0.48 0.00 0.00 55.95 57.31 1n1s s SER 292 Cb -0.06 -2.23 0.14 0.00 0.10 0.00 0.00 66.02 63.97 1n1s s SER 292 CO 0.00 -0.09 0.36 0.12 0.98 0.00 0.00 173.24 174.61 1n1s s PHE 293 N -1.85 -0.78 0.00 5.02 5.36 -1.25 -1.93 117.98 122.55 1n1s s PHE 293 Ca 0.48 0.39 0.01 0.00 -0.96 0.00 0.00 56.93 56.85 1n1s s PHE 293 Cb -0.11 -0.17 -0.01 0.00 -0.34 0.00 0.00 43.02 42.39 1n1s s PHE 293 CO 0.22 -0.85 -0.03 0.14 -1.46 0.00 0.00 175.22 173.23 1n1s s VAL 294 N 2.49 0.24 -0.04 3.12 -7.23 -0.49 -4.58 120.40 113.92 1n1s s VAL 294 Ca 0.10 -0.26 -0.18 0.00 -1.81 0.00 0.00 61.98 59.83 1n1s s VAL 294 Cb -0.14 -0.23 -0.05 0.00 0.56 0.00 0.00 36.38 36.51 1n1s s VAL 294 CO -0.25 -0.02 0.49 0.00 -0.31 0.00 0.00 175.10 175.01 1n1s s ALA 295 N -0.29 3.56 0.16 1.32 0.00 -1.26 -0.13 121.76 125.12 1n1s s ALA 295 Ca -0.01 -0.14 -0.01 0.00 0.00 0.00 0.00 51.96 51.80 1n1s s ALA 295 Cb -0.03 -2.58 -0.04 0.00 0.00 0.00 0.00 23.12 20.47 1n1s s ALA 295 CO -0.00 0.22 0.09 0.14 0.00 0.00 0.00 175.76 176.21 1n1s s VAL 296 N -0.24 0.06 -0.20 0.00 -7.23 -0.32 -4.98 120.40 107.49 1n1s s VAL 296 Ca 0.26 -1.94 0.00 0.00 -1.81 0.00 0.00 61.98 58.50 1n1s s VAL 296 Cb -0.17 -2.23 0.02 0.00 0.56 0.00 0.00 36.38 34.56 1n1s s VAL 296 CO 0.13 -0.27 -0.16 -0.89 -0.31 0.00 0.00 175.10 173.60 1n1s s THR 297 N -4.09 2.33 -0.09 5.32 2.01 -1.26 -0.97 115.64 118.89 1n1s s THR 297 Ca 0.30 -0.91 0.04 0.00 0.31 0.00 0.00 61.69 61.42 1n1s s THR 297 Cb 0.07 -2.03 0.00 0.00 0.01 0.00 0.00 72.50 70.55 1n1s s THR 297 CO 0.06 0.47 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.62 1n1s s ILE 298 N 1.31 1.83 -1.37 1.82 1.01 -0.05 -4.68 121.20 121.07 1n1s s ILE 298 Ca 0.04 -0.89 -0.06 0.00 0.00 0.00 0.00 60.65 59.75 1n1s s ILE 298 Cb -0.14 -1.59 0.03 0.00 0.01 0.00 0.00 42.46 40.77 1n1s s ILE 298 CO -0.10 0.51 0.42 -0.62 0.00 0.00 0.00 174.94 175.15 1n1s n GLU 299 N 3.57 -3.63 -0.96 2.79 -0.58 -1.26 -0.51 120.64 120.06 1n1s n GLU 299 Ca -0.20 0.68 0.00 0.00 -0.42 0.00 0.00 57.16 57.22 1n1s n GLU 299 Cb 0.53 -5.42 0.00 0.00 -0.57 0.00 0.00 31.44 25.98 1n1s n GLU 299 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1n1s n GLY 300 N -1.23 0.69 3.39 0.62 0.00 -1.26 -4.99 105.19 102.42 1n1s n GLY 300 Ca -0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 1n1s n GLY 300 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1n1s s LYS 301 N -0.19 3.05 0.12 1.61 2.20 0.33 -5.09 119.74 121.78 1n1s s LYS 301 Ca 0.00 -0.71 -0.30 0.00 -0.36 0.00 0.00 55.97 54.60 1n1s s LYS 301 Cb 0.00 -2.51 -0.06 0.00 -1.51 0.00 0.00 37.83 33.74 1n1s s LYS 301 CO 0.00 0.35 1.07 0.50 -0.36 0.00 0.00 175.35 176.91 1n1s s ARG 302 N -0.01 4.59 0.17 4.03 6.06 -1.26 -0.87 118.95 131.66 1n1s s ARG 302 Ca -0.04 1.63 -0.05 0.00 -2.50 0.00 0.00 55.73 54.76 1n1s s ARG 302 Cb -0.14 -3.34 -0.02 0.00 0.06 0.00 0.00 34.95 31.51 1n1s s ARG 302 CO 0.04 0.03 0.21 0.14 -2.50 0.00 0.00 175.30 173.22 1n1s s VAL 303 N 0.21 0.05 -0.08 7.11 -7.23 -0.14 -4.81 120.40 115.51 1n1s s VAL 303 Ca 0.51 -1.69 0.01 0.00 -1.81 0.00 0.00 61.98 59.00 1n1s s VAL 303 Cb -0.27 -2.11 -0.03 0.00 0.56 0.00 0.00 36.38 34.54 1n1s s VAL 303 CO 0.32 -0.23 -0.10 -0.04 -0.31 0.00 0.00 175.10 174.73 1n1s s MET 304 N -4.04 2.83 -0.08 4.82 1.00 0.65 -1.17 119.30 123.31 1n1s s MET 304 Ca 0.25 -0.62 -0.00 0.00 0.00 0.00 0.00 55.69 55.32 1n1s s MET 304 Cb 0.05 -2.54 -0.03 0.00 0.00 0.00 0.00 34.83 32.30 1n1s s MET 304 CO 0.05 0.55 -0.04 -0.51 0.00 0.00 0.00 175.02 175.06 1n1s s LEU 305 N -0.51 3.34 -0.03 -0.03 1.43 0.81 -1.03 118.68 122.65 1n1s s LEU 305 Ca 0.07 0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.22 1n1s s LEU 305 Cb -0.12 -1.74 0.03 0.00 0.03 0.00 0.00 46.19 44.38 1n1s s LEU 305 CO 0.02 0.36 -0.00 0.12 0.23 0.00 0.00 176.35 177.08 1n1s s PHE 306 N -0.80 0.34 -0.03 0.29 5.36 -0.28 -1.39 117.98 121.46 1n1s s PHE 306 Ca 0.12 -0.01 0.07 0.00 -0.96 0.00 0.00 56.93 56.15 1n1s s PHE 306 Cb -0.11 -0.42 -0.02 0.00 -0.34 0.00 0.00 43.02 42.13 1n1s s PHE 306 CO 0.02 -0.13 -0.23 0.95 -1.46 0.00 0.00 175.22 174.37 1n1s s THR 307 N 0.98 2.29 -0.25 0.12 -4.23 -0.81 -0.31 115.64 113.42 1n1s s THR 307 Ca -0.10 -1.02 -0.26 0.00 -1.18 0.00 0.00 61.69 59.13 1n1s s THR 307 Cb -0.14 -1.82 0.10 0.00 1.34 0.00 0.00 72.50 71.99 1n1s s THR 307 CO -0.02 0.58 0.91 -2.28 -0.54 0.00 0.00 174.62 173.27 1n1s s HIS 308 N -0.64 -0.57 0.48 3.99 5.04 -0.68 -3.46 115.29 119.45 1n1s s HIS 308 Ca 0.10 1.34 -0.21 0.00 -1.54 0.00 0.00 55.06 54.75 1n1s s HIS 308 Cb -0.10 0.35 -0.08 0.00 0.04 0.00 0.00 32.58 32.79 1n1s s HIS 308 CO -0.01 -0.31 1.07 -2.14 -2.34 0.00 0.00 174.74 171.01 1n1s s PRO 309 N 0.03 3.76 0.28 2.88 0.02 -1.26 -1.02 135.00 139.69 1n1s s PRO 309 Ca 0.01 1.48 0.14 0.00 0.02 0.00 0.00 61.00 62.65 1n1s s PRO 309 Cb -0.04 -2.18 0.30 0.00 0.02 0.00 0.00 34.50 32.60 1n1s s PRO 309 CO -0.02 -0.49 1.55 -0.07 -0.33 0.00 0.00 177.00 177.64 1n1s h LEU 310 N 1.68 0.00 -1.60 -5.54 3.38 -0.54 -3.46 115.31 109.23 1n1s h LEU 310 Ca -0.49 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.08 1n1s h LEU 310 Cb 1.23 0.00 0.09 0.00 0.09 0.00 0.00 40.66 42.07 1n1s h LEU 310 CO 0.59 0.59 -0.80 -3.20 0.09 0.00 0.00 178.44 175.71 1n1s n ASN 311 N -3.50 -2.11 0.27 -0.43 5.15 -0.62 -4.07 115.26 109.93 1n1s n ASN 311 Ca 0.00 -0.74 0.13 0.00 -0.60 0.00 0.00 54.58 53.37 1n1s n ASN 311 Cb 0.67 -4.42 0.74 0.00 -0.53 0.00 0.00 39.78 36.24 1n1s n ASN 311 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1n1s h LEU 312 N -1.96 0.00 -0.14 1.20 3.38 -1.92 -2.23 115.31 113.65 1n1s h LEU 312 Ca -0.60 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.27 1n1s h LEU 312 Cb 1.36 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.09 1n1s h LEU 312 CO 0.56 0.11 -0.50 0.11 0.09 0.00 0.00 178.44 178.81 1n1s h LYS 313 N 0.00 0.00 0.00 1.13 1.57 -1.92 -3.48 116.57 113.87 1n1s h LYS 313 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1n1s h LYS 313 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1n1s h LYS 313 CO 0.01 0.50 0.00 0.41 -0.57 0.00 0.00 179.45 179.80 1n1s n GLY 314 N 1.09 -0.70 7.00 3.86 0.00 -0.84 -4.93 105.19 110.67 1n1s n GLY 314 Ca 0.02 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.32 1n1s n GLY 314 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n1s n ARG 315 N -0.75 0.00 -0.09 1.61 1.74 -1.26 -2.13 116.66 115.78 1n1s n ARG 315 Ca 0.00 0.00 0.11 0.00 -0.77 0.00 0.00 57.85 57.19 1n1s n ARG 315 Cb 0.00 0.00 0.36 0.00 -1.02 0.00 0.00 32.46 31.80 1n1s n ARG 315 CO 0.00 0.00 0.00 -2.67 -1.52 0.00 0.00 177.63 173.44 1n1s n TRP 316 N 14.00 0.23 -0.02 -1.55 2.14 -1.26 -4.43 117.44 126.55 1n1s n TRP 316 Ca 0.00 -0.12 -0.11 0.00 2.07 0.00 0.00 57.50 59.34 1n1s n TRP 316 Cb 0.00 0.00 -0.05 0.00 -0.81 0.00 0.00 31.31 30.45 1n1s n TRP 316 CO 0.00 0.00 0.00 0.52 2.07 0.00 0.00 177.69 180.28 1n1s h MET 317 N 2.54 0.17 -5.96 -2.67 0.00 -1.79 -3.47 114.93 103.74 1n1s h MET 317 Ca 0.00 -0.02 -0.40 0.00 0.00 0.00 0.00 59.70 59.29 1n1s h MET 317 Cb 0.56 -0.03 0.09 0.00 0.00 0.00 0.00 31.60 32.21 1n1s h MET 317 CO 0.00 0.17 -0.79 0.54 0.00 0.00 0.00 176.91 176.83 1n1s n ARG 318 N -4.97 -5.81 -1.37 1.72 1.74 -1.26 -3.44 116.66 103.26 1n1s n ARG 318 Ca -0.05 0.71 -0.31 0.00 -0.77 0.00 0.00 57.85 57.43 1n1s n ARG 318 Cb 0.06 -5.50 0.08 0.00 -1.02 0.00 0.00 32.46 26.09 1n1s n ARG 318 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 1n1s s ASP 319 N -4.13 4.72 -0.68 0.55 1.47 -1.26 -0.76 116.67 116.58 1n1s s ASP 319 Ca 0.14 1.71 -0.01 0.00 1.18 0.00 0.00 52.55 55.58 1n1s s ASP 319 Cb -0.07 -2.47 -0.01 0.00 -0.34 0.00 0.00 42.92 40.03 1n1s s ASP 319 CO 0.78 -1.88 0.63 0.54 0.68 0.00 0.00 175.17 175.92 1n1s n ARG 320 N -3.42 -1.28 -2.21 2.11 1.74 -1.23 -1.59 116.66 110.79 1n1s n ARG 320 Ca 0.08 1.22 -0.42 0.00 -0.77 0.00 0.00 57.85 57.96 1n1s n ARG 320 Cb 0.53 -5.11 -0.03 0.00 -1.02 0.00 0.00 32.46 26.83 1n1s n ARG 320 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1n1s s LEU 321 N -3.96 4.31 0.19 0.55 2.96 -1.26 -0.78 118.68 120.69 1n1s s LEU 321 Ca 0.08 2.12 0.08 0.00 -0.22 0.00 0.00 54.13 56.19 1n1s s LEU 321 Cb -0.01 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.08 1n1s s LEU 321 CO 0.63 -0.73 -0.01 -1.00 -1.32 0.00 0.00 176.35 173.92 1n1s s HIS 322 N 2.50 2.79 -0.14 5.38 3.76 -0.18 -0.07 115.29 129.34 1n1s s HIS 322 Ca 0.64 -0.17 0.02 0.00 -0.15 0.00 0.00 55.06 55.40 1n1s s HIS 322 Cb -0.31 -1.33 0.00 0.00 1.11 0.00 0.00 32.58 32.05 1n1s s HIS 322 CO 0.26 0.54 -0.19 -1.17 -0.85 0.00 0.00 174.74 173.33 1n1s s LEU 323 N -3.09 2.31 0.16 0.89 2.96 -0.60 -1.69 118.68 119.61 1n1s s LEU 323 Ca 0.28 -0.51 0.10 0.00 -0.22 0.00 0.00 54.13 53.78 1n1s s LEU 323 Cb -0.09 -1.50 -0.04 0.00 0.50 0.00 0.00 46.19 45.06 1n1s s LEU 323 CO 0.18 0.11 -0.20 0.26 -1.32 0.00 0.00 176.35 175.38 1n1s s TRP 324 N 0.66 2.43 -0.07 5.38 0.51 0.57 -0.70 118.94 127.71 1n1s s TRP 324 Ca -0.09 -0.31 0.02 0.00 -2.12 0.00 0.00 56.10 53.59 1n1s s TRP 324 Cb -0.16 -1.25 0.02 0.00 -0.81 0.00 0.00 33.47 31.27 1n1s s TRP 324 CO 0.02 0.43 -0.11 1.41 -0.51 0.00 0.00 176.95 178.20 1n1s s MET 325 N -2.41 1.60 0.03 4.98 -2.45 0.08 -1.13 119.30 120.00 1n1s s MET 325 Ca 0.19 -0.36 0.01 0.00 -1.25 0.00 0.00 55.69 54.29 1n1s s MET 325 Cb -0.09 -1.40 -0.02 0.00 1.25 0.00 0.00 34.83 34.57 1n1s s MET 325 CO 0.10 -0.04 -0.06 -0.08 1.05 0.00 0.00 175.02 175.99 1n1s s THR 326 N 0.89 0.37 -0.27 10.11 -1.32 -0.20 -0.63 115.64 124.59 1n1s s THR 326 Ca -0.10 -0.89 0.11 0.00 -1.21 0.00 0.00 61.69 59.60 1n1s s THR 326 Cb -0.15 -0.45 0.57 0.00 -1.51 0.00 0.00 72.50 70.96 1n1s s THR 326 CO 0.01 -0.34 1.55 -0.90 -2.21 0.00 0.00 174.62 172.72 1n1s n ASP 327 N 1.74 3.44 0.00 8.08 3.85 -1.11 -0.25 116.55 132.30 1n1s n ASP 327 Ca -0.22 -3.42 0.00 0.00 -0.71 0.00 0.00 54.79 50.44 1n1s n ASP 327 Cb 0.55 -0.64 0.00 0.00 -1.35 0.00 0.00 41.12 39.68 1n1s n ASP 327 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 1n1s n ASN 328 N -0.77 -3.66 0.04 -1.12 4.05 -1.26 -4.72 115.26 107.81 1n1s n ASN 328 Ca 0.33 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.36 1n1s n ASN 328 Cb 1.11 -1.32 0.00 0.00 1.23 0.00 0.00 39.78 40.80 1n1s n ASN 328 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1n1s n GLN 329 N -1.88 0.00 -3.36 1.20 6.02 -1.26 -4.90 117.38 113.21 1n1s n GLN 329 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.67 1n1s n GLN 329 Cb 0.13 -0.05 -0.05 0.00 1.02 0.00 0.00 30.24 31.29 1n1s n GLN 329 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1n1s s ARG 330 N -1.32 3.81 -0.17 -1.09 3.00 -1.26 -4.80 118.95 117.12 1n1s s ARG 330 Ca 0.00 0.31 -0.01 0.00 0.00 0.00 0.00 55.73 56.03 1n1s s ARG 330 Cb 0.00 -2.61 0.05 0.00 0.00 0.00 0.00 34.95 32.39 1n1s s ARG 330 CO 0.00 0.28 -0.02 0.42 0.00 0.00 0.00 175.30 175.98 1n1s s ILE 331 N -1.88 0.88 -0.15 1.52 1.01 -1.26 -2.74 121.20 118.58 1n1s s ILE 331 Ca 0.48 -0.60 -0.05 0.00 0.00 0.00 0.00 60.65 60.48 1n1s s ILE 331 Cb -0.11 -1.18 -0.03 0.00 0.01 0.00 0.00 42.46 41.14 1n1s s ILE 331 CO 0.22 0.00 0.02 0.12 0.00 0.00 0.00 174.94 175.30 1n1s s PHE 332 N 1.72 3.17 -0.62 3.97 5.36 0.19 -4.81 117.98 126.96 1n1s s PHE 332 Ca -0.00 -0.02 -0.24 0.00 -0.96 0.00 0.00 56.93 55.71 1n1s s PHE 332 Cb -0.16 -1.98 0.05 0.00 -0.34 0.00 0.00 43.02 40.59 1n1s s PHE 332 CO -0.07 0.16 0.98 0.34 -1.46 0.00 0.00 175.22 175.17 1n1s s ASP 333 N 0.12 6.25 0.38 6.13 2.15 -1.26 -0.74 116.67 129.69 1n1s s ASP 333 Ca 0.02 -0.64 0.08 0.00 0.43 0.00 0.00 52.55 52.44 1n1s s ASP 333 Cb -0.13 -2.44 0.76 0.00 -0.30 0.00 0.00 42.92 40.81 1n1s s ASP 333 CO 0.02 -1.38 1.93 0.58 -0.17 0.00 0.00 175.17 176.14 1n1s h VAL 334 N 6.00 1.17 0.00 1.11 2.07 -1.26 -3.46 116.25 121.88 1n1s h VAL 334 Ca -0.27 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 66.56 1n1s h VAL 334 Cb 1.07 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1n1s h VAL 334 CO 1.15 0.22 0.00 0.61 0.02 0.00 0.00 177.57 179.57 1n1s n GLY 335 N -0.97 0.89 3.71 2.17 0.00 -1.18 -3.43 105.19 106.37 1n1s n GLY 335 Ca 0.00 -2.06 -0.41 0.00 0.00 0.00 0.00 46.02 43.56 1n1s n GLY 335 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1n1s s GLN 336 N -1.14 4.49 -0.01 1.61 0.74 -0.11 -1.56 119.66 123.68 1n1s s GLN 336 Ca 0.00 1.15 0.15 0.00 0.05 0.00 0.00 55.36 56.72 1n1s s GLN 336 Cb 0.00 -3.46 -0.20 0.00 1.10 0.00 0.00 33.01 30.45 1n1s s GLN 336 CO 0.00 -0.01 0.50 0.44 -0.55 0.00 0.00 175.29 175.67 1n1s n ILE 337 N 3.89 0.00 -1.97 -2.34 -5.35 0.91 -2.08 119.36 112.41 1n1s n ILE 337 Ca 0.03 -0.25 -0.29 0.00 -0.27 0.00 0.00 62.75 61.97 1n1s n ILE 337 Cb 0.51 0.59 0.15 0.00 -1.74 0.00 0.00 39.64 39.15 1n1s n ILE 337 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1n1s s SER 338 N -3.09 3.69 -0.21 7.28 1.04 -1.20 -4.23 113.70 116.97 1n1s s SER 338 Ca 0.00 0.40 -0.06 0.00 0.48 0.00 0.00 55.95 56.77 1n1s s SER 338 Cb 0.11 -0.63 -0.03 0.00 0.10 0.00 0.00 66.02 65.57 1n1s s SER 338 CO 0.64 -2.38 0.03 -0.63 0.98 0.00 0.00 173.24 171.88 1n1s s ILE 339 N -3.72 4.16 0.00 -1.02 1.01 -1.26 -2.11 121.20 118.26 1n1s s ILE 339 Ca 0.69 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 61.10 1n1s s ILE 339 Cb -0.06 -2.90 0.00 0.00 0.01 0.00 0.00 42.46 39.51 1n1s s ILE 339 CO 0.51 0.40 0.00 0.61 0.00 0.00 0.00 174.94 176.46 1n1s n GLY 340 N 4.37 2.92 1.85 6.18 0.00 -1.26 -2.41 105.19 116.84 1n1s n GLY 340 Ca -0.17 -0.23 0.06 0.00 0.00 0.00 0.00 46.02 45.68 1n1s n GLY 340 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1n1s n ASP 341 N 1.87 5.54 -4.75 1.61 5.75 -1.26 -4.58 116.55 120.73 1n1s n ASP 341 Ca 0.00 -2.91 -0.36 0.00 -0.01 0.00 0.00 54.79 51.51 1n1s n ASP 341 Cb 0.00 -0.68 0.04 0.00 -1.03 0.00 0.00 41.12 39.45 1n1s n ASP 341 CO 0.00 0.00 0.00 -1.83 -0.11 0.00 0.00 177.20 175.26 1n1s s GLU 342 N -2.71 2.89 0.10 0.11 -1.05 -1.01 -4.80 118.70 112.24 1n1s s GLU 342 Ca 0.52 1.92 -0.30 0.00 -0.15 0.00 0.00 54.97 56.97 1n1s s GLU 342 Cb 0.40 -1.94 -0.06 0.00 -0.44 0.00 0.00 34.13 32.09 1n1s s GLU 342 CO 0.15 -1.29 1.13 -0.80 0.95 0.00 0.00 175.26 175.40 1n1s s ASN 343 N -1.48 7.20 0.00 0.83 0.01 -1.26 -3.47 114.94 116.77 1n1s s ASN 343 Ca 0.78 2.00 0.00 0.00 -0.71 0.00 0.00 52.86 54.93 1n1s s ASN 343 Cb -0.33 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 38.74 1n1s s ASN 343 CO 0.36 -0.33 0.00 -1.54 -1.51 0.00 0.00 177.10 174.07 1n1s n SER 344 N 3.26 0.00 0.00 -1.22 3.41 0.06 -1.56 113.62 117.57 1n1s n SER 344 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 1n1s n SER 344 Cb 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 1n1s n SER 344 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n1s n GLY 345 N 5.00 0.13 3.73 5.00 0.00 -1.22 -4.38 105.19 113.44 1n1s n GLY 345 Ca 0.00 -0.87 -0.35 0.00 0.00 0.00 0.00 46.02 44.80 1n1s n GLY 345 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1n1s s TYR 346 N -2.78 2.10 0.18 1.61 1.51 -1.26 -4.71 117.35 113.99 1n1s s TYR 346 Ca 0.00 1.57 -0.13 0.00 -1.01 0.00 0.00 57.07 57.50 1n1s s TYR 346 Cb 0.00 -3.51 0.01 0.00 -0.11 0.00 0.00 41.96 38.35 1n1s s TYR 346 CO 0.00 -2.61 0.40 -1.54 -1.11 0.00 0.00 175.55 170.69 1n1s s SER 347 N -1.86 -0.10 -0.09 2.29 1.04 -1.26 -1.45 113.70 112.26 1n1s s SER 347 Ca 0.76 -0.68 -0.11 0.00 0.48 0.00 0.00 55.95 56.40 1n1s s SER 347 Cb -0.31 0.50 0.03 0.00 0.10 0.00 0.00 66.02 66.34 1n1s s SER 347 CO 0.43 -0.97 0.30 -0.55 0.98 0.00 0.00 173.24 173.43 1n1s s SER 348 N -2.92 -0.28 0.00 7.02 0.15 0.04 -4.09 113.70 113.62 1n1s s SER 348 Ca 0.13 0.49 0.05 0.00 0.70 0.00 0.00 55.95 57.33 1n1s s SER 348 Cb 0.01 0.55 -0.02 0.00 -1.71 0.00 0.00 66.02 64.86 1n1s s SER 348 CO -0.01 -0.17 -0.17 0.54 1.20 0.00 0.00 173.24 174.63 1n1s s VAL 349 N -0.14 1.31 -0.02 4.45 0.11 -1.26 -1.10 120.40 123.75 1n1s s VAL 349 Ca -0.03 -0.82 0.01 0.00 -2.93 0.00 0.00 61.98 58.21 1n1s s VAL 349 Cb -0.03 -1.12 0.02 0.00 -1.53 0.00 0.00 36.38 33.72 1n1s s VAL 349 CO 0.01 0.28 -0.01 -0.22 -3.33 0.00 0.00 175.10 171.83 1n1s s LEU 350 N -0.63 1.44 -0.26 2.54 2.96 0.06 -4.93 118.68 119.85 1n1s s LEU 350 Ca 0.06 -0.04 -0.02 0.00 -0.22 0.00 0.00 54.13 53.91 1n1s s LEU 350 Cb -0.07 -0.20 0.03 0.00 0.50 0.00 0.00 46.19 46.45 1n1s s LEU 350 CO 0.00 -0.06 -0.03 -0.47 -1.32 0.00 0.00 176.35 174.48 1n1s s TYR 351 N 0.66 3.11 -0.04 5.38 5.04 -1.26 -0.55 117.35 129.70 1n1s s TYR 351 Ca -0.07 -1.53 -0.01 0.00 -2.44 0.00 0.00 57.07 53.03 1n1s s TYR 351 Cb -0.10 -2.09 0.03 0.00 0.35 0.00 0.00 41.96 40.15 1n1s s TYR 351 CO -0.01 -0.72 0.03 0.21 -1.34 0.00 0.00 175.55 173.72 1n1s s LYS 352 N 1.34 0.11 -1.39 4.97 2.20 0.05 -4.87 119.74 122.13 1n1s s LYS 352 Ca -0.00 0.24 -0.03 0.00 -0.36 0.00 0.00 55.97 55.81 1n1s s LYS 352 Cb -0.17 -0.51 0.02 0.00 -1.51 0.00 0.00 37.83 35.66 1n1s s LYS 352 CO -0.03 -0.25 0.62 -0.25 -0.36 0.00 0.00 175.35 175.09 1n1s n ASP 353 N 4.79 -1.35 -2.31 1.43 8.00 -1.26 -1.22 116.55 124.63 1n1s n ASP 353 Ca -0.14 -0.90 -0.21 0.00 0.71 0.00 0.00 54.79 54.25 1n1s n ASP 353 Cb 0.50 -3.57 -0.02 0.00 -0.02 0.00 0.00 41.12 38.01 1n1s n ASP 353 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1n1s n ASP 354 N -2.98 -5.83 -4.11 -2.24 4.64 -1.26 -4.99 116.55 99.78 1n1s n ASP 354 Ca -0.24 0.05 -0.22 0.00 -1.38 0.00 0.00 54.79 52.99 1n1s n ASP 354 Cb 0.65 -4.88 -0.15 0.00 -1.04 0.00 0.00 41.12 35.70 1n1s n ASP 354 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 1n1s s LYS 355 N -4.90 1.14 -0.12 -0.67 1.02 -0.35 -5.14 119.74 110.71 1n1s s LYS 355 Ca 0.00 -0.50 -0.03 0.00 0.02 0.00 0.00 55.97 55.46 1n1s s LYS 355 Cb 0.00 -1.10 -0.03 0.00 -0.52 0.00 0.00 37.83 36.18 1n1s s LYS 355 CO 0.00 0.30 -0.02 -1.17 -0.92 0.00 0.00 175.35 173.54 1n1s s LEU 356 N -0.33 3.38 0.09 3.17 2.96 -1.26 -0.77 118.68 125.91 1n1s s LEU 356 Ca 0.05 -0.01 0.01 0.00 -0.22 0.00 0.00 54.13 53.97 1n1s s LEU 356 Cb -0.05 -1.79 -0.04 0.00 0.50 0.00 0.00 46.19 44.80 1n1s s LEU 356 CO -0.01 0.27 -0.06 -0.31 -1.32 0.00 0.00 176.35 174.92 1n1s s TYR 357 N -0.22 0.81 0.04 5.38 1.51 0.29 -0.85 117.35 124.32 1n1s s TYR 357 Ca 0.04 -0.91 0.02 0.00 -1.01 0.00 0.00 57.07 55.21 1n1s s TYR 357 Cb -0.13 -0.49 -0.02 0.00 -0.11 0.00 0.00 41.96 41.21 1n1s s TYR 357 CO 0.02 -0.18 -0.08 0.45 -1.11 0.00 0.00 175.55 174.65 1n1s s SER 358 N -2.93 0.90 -0.18 2.29 0.15 -0.59 -0.76 113.70 112.58 1n1s s SER 358 Ca 0.10 -0.55 0.00 0.00 0.70 0.00 0.00 55.95 56.20 1n1s s SER 358 Cb 0.05 0.03 0.04 0.00 -1.71 0.00 0.00 66.02 64.43 1n1s s SER 358 CO -0.05 -0.20 -0.10 -0.22 1.20 0.00 0.00 173.24 173.87 1n1s s LEU 359 N -1.59 1.99 0.10 3.45 0.20 -0.26 -0.20 118.68 122.37 1n1s s LEU 359 Ca -0.10 -0.73 -0.07 0.00 0.69 0.00 0.00 54.13 53.92 1n1s s LEU 359 Cb -0.10 -1.16 -0.01 0.00 -0.43 0.00 0.00 46.19 44.49 1n1s s LEU 359 CO 0.01 -0.13 0.18 -1.38 -0.29 0.00 0.00 176.35 174.73 1n1s s HIS 360 N 1.47 0.28 0.40 5.38 -3.43 -0.73 -0.78 115.29 117.88 1n1s s HIS 360 Ca 0.01 -0.71 -0.24 0.00 -0.80 0.00 0.00 55.06 53.32 1n1s s HIS 360 Cb -0.15 -0.12 -0.09 0.00 -1.43 0.00 0.00 32.58 30.79 1n1s s HIS 360 CO -0.09 -0.56 1.06 -1.21 -2.00 0.00 0.00 174.74 171.94 1n1s s GLU 361 N -3.90 4.15 0.04 -0.38 2.02 -0.53 -1.15 118.70 118.95 1n1s s GLU 361 Ca 0.09 1.53 0.06 0.00 0.02 0.00 0.00 54.97 56.66 1n1s s GLU 361 Cb 0.05 -2.54 -0.02 0.00 0.10 0.00 0.00 34.13 31.71 1n1s s GLU 361 CO -0.08 -0.16 -0.17 0.96 0.02 0.00 0.00 175.26 175.84 1n1s s ILE 362 N -1.65 1.33 -0.07 -1.63 -4.36 -0.37 -3.77 121.20 110.68 1n1s s ILE 362 Ca 0.58 -1.10 -0.02 0.00 -0.26 0.00 0.00 60.65 59.85 1n1s s ILE 362 Cb -0.22 -1.19 0.03 0.00 1.25 0.00 0.00 42.46 42.33 1n1s s ILE 362 CO 0.28 0.06 0.02 0.21 0.24 0.00 0.00 174.94 175.75 1n1s s ASN 363 N -1.20 1.57 -0.12 4.36 3.04 -0.60 -1.71 114.94 120.27 1n1s s ASN 363 Ca 0.04 -0.09 0.01 0.00 0.04 0.00 0.00 52.86 52.85 1n1s s ASN 363 Cb -0.08 -0.37 0.02 0.00 -1.54 0.00 0.00 41.25 39.27 1n1s s ASN 363 CO 0.02 -0.22 -0.15 -0.89 -3.04 0.00 0.00 177.10 172.82 1n1s s THR 364 N 2.02 1.53 -1.44 -5.21 2.01 -1.03 -4.14 115.64 109.37 1n1s s THR 364 Ca 0.05 -0.64 -0.02 0.00 0.31 0.00 0.00 61.69 61.38 1n1s s THR 364 Cb -0.12 -1.41 0.01 0.00 0.01 0.00 0.00 72.50 70.99 1n1s s THR 364 CO -0.05 0.45 0.21 0.59 -0.69 0.00 0.00 174.62 175.13 1n1s n ASN 365 N 4.41 -5.07 -2.83 3.53 3.02 -1.26 -1.67 115.26 115.39 1n1s n ASN 365 Ca -0.18 -0.07 -0.22 0.00 -0.03 0.00 0.00 54.58 54.08 1n1s n ASN 365 Cb 0.51 -4.20 0.02 0.00 -0.61 0.00 0.00 39.78 35.50 1n1s n ASN 365 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1n1s n ASP 366 N -2.11 -6.07 -4.26 6.41 8.00 -1.26 -4.99 116.55 112.26 1n1s n ASP 366 Ca -0.15 -0.22 -0.33 0.00 0.71 0.00 0.00 54.79 54.79 1n1s n ASP 366 Cb 0.63 -4.93 -0.15 0.00 -0.02 0.00 0.00 41.12 36.65 1n1s n ASP 366 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1n1s s VAL 367 N -3.15 2.71 -0.08 2.53 1.01 -0.67 -4.49 120.40 118.27 1n1s s VAL 367 Ca 0.23 -0.74 0.02 0.00 0.00 0.00 0.00 61.98 61.48 1n1s s VAL 367 Cb -0.10 -2.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.10 1n1s s VAL 367 CO 0.28 0.50 -0.13 -0.31 0.00 0.00 0.00 175.10 175.45 1n1s s TYR 368 N 0.95 2.77 0.37 5.22 1.51 -1.26 -2.45 117.35 124.45 1n1s s TYR 368 Ca -0.02 -0.29 0.08 0.00 -1.01 0.00 0.00 57.07 55.83 1n1s s TYR 368 Cb -0.15 -1.71 -0.06 0.00 -0.11 0.00 0.00 41.96 39.93 1n1s s TYR 368 CO -0.02 0.07 0.01 -1.12 -1.11 0.00 0.00 175.55 173.38 1n1s s SER 369 N -0.37 4.04 -0.16 2.29 0.01 -0.69 -1.17 113.70 117.64 1n1s s SER 369 Ca 0.04 -1.13 -0.00 0.00 1.31 0.00 0.00 55.95 56.17 1n1s s SER 369 Cb -0.12 -0.45 -0.00 0.00 0.21 0.00 0.00 66.02 65.65 1n1s s SER 369 CO 0.02 -0.32 -0.14 -0.76 0.41 0.00 0.00 173.24 172.45 1n1s s LEU 370 N -3.71 2.50 -0.08 2.44 1.43 -0.39 -1.23 118.68 119.63 1n1s s LEU 370 Ca 0.35 -0.47 -0.06 0.00 -1.03 0.00 0.00 54.13 52.91 1n1s s LEU 370 Cb 0.03 -1.58 -0.04 0.00 0.03 0.00 0.00 46.19 44.63 1n1s s LEU 370 CO 0.19 0.07 0.17 0.68 0.23 0.00 0.00 176.35 177.69 1n1s s VAL 371 N 0.93 5.45 -0.30 -1.59 -7.23 -0.30 -1.49 120.40 115.87 1n1s s VAL 371 Ca -0.03 0.15 -0.07 0.00 -1.81 0.00 0.00 61.98 60.21 1n1s s VAL 371 Cb -0.15 -3.46 0.01 0.00 0.56 0.00 0.00 36.38 33.34 1n1s s VAL 371 CO -0.02 0.53 0.10 0.12 -0.31 0.00 0.00 175.10 175.52 1n1s s PHE 372 N -1.12 3.15 -0.11 2.82 5.36 0.01 -1.77 117.98 126.31 1n1s s PHE 372 Ca 0.19 -0.89 -0.00 0.00 -0.96 0.00 0.00 56.93 55.27 1n1s s PHE 372 Cb -0.12 -2.28 -0.02 0.00 -0.34 0.00 0.00 43.02 40.26 1n1s s PHE 372 CO 0.09 -0.55 -0.10 0.08 -1.46 0.00 0.00 175.22 173.28 1n1s s VAL 373 N 1.52 3.38 -0.51 3.12 1.01 0.73 -1.60 120.40 128.05 1n1s s VAL 373 Ca 0.03 -0.56 -0.17 0.00 0.00 0.00 0.00 61.98 61.27 1n1s s VAL 373 Cb -0.17 -2.41 0.08 0.00 0.00 0.00 0.00 36.38 33.87 1n1s s VAL 373 CO 0.03 0.54 0.54 -0.13 0.00 0.00 0.00 175.10 176.09 1n1s s ARG 374 N -0.04 3.05 -1.37 2.72 0.52 0.54 -1.54 118.95 122.82 1n1s s ARG 374 Ca -0.01 -1.20 -0.12 0.00 -0.52 0.00 0.00 55.73 53.88 1n1s s ARG 374 Cb -0.14 -4.16 0.10 0.00 0.52 0.00 0.00 34.95 31.28 1n1s s ARG 374 CO 0.03 -1.21 2.06 1.28 0.02 0.00 0.00 175.30 177.48 1n1s n LEU 375 N 5.76 6.78 0.06 2.53 4.77 -0.03 -2.74 117.00 134.13 1n1s n LEU 375 Ca -0.10 -4.38 -0.09 0.00 -0.03 0.00 0.00 56.01 51.41 1n1s n LEU 375 Cb 0.44 -1.57 -0.06 0.00 -2.33 0.00 0.00 43.42 39.89 1n1s n LEU 375 CO 0.52 1.24 0.30 0.40 -1.33 0.00 0.00 177.39 178.53 1n1s h ILE 376 N 3.87 0.59 -0.63 -0.08 1.08 -1.83 -2.42 117.51 118.08 1n1s h ILE 376 Ca 0.49 -1.06 -0.05 0.00 -0.39 0.00 0.00 64.86 63.85 1n1s h ILE 376 Cb 0.63 1.01 -0.03 0.00 -3.07 0.00 0.00 36.82 35.36 1n1s h ILE 376 CO 1.77 0.16 0.21 1.23 -0.69 0.00 0.00 178.15 180.83 1n1s h GLY 377 N -0.96 1.01 0.94 5.37 0.00 -1.83 -2.37 103.07 105.24 1n1s h GLY 377 Ca -0.03 -0.56 -0.00 0.00 0.00 0.00 0.00 47.33 46.74 1n1s h GLY 377 CO 0.04 0.53 0.09 0.83 0.00 0.00 0.00 176.54 178.03 1n1s h GLU 378 N 0.92 0.22 -0.79 4.80 3.07 -1.88 -2.43 114.58 118.49 1n1s h GLU 378 Ca 0.21 -0.03 -0.00 0.00 -0.50 0.00 0.00 59.36 59.04 1n1s h GLU 378 Cb 0.24 -0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 28.07 1n1s h GLU 378 CO -0.01 0.23 0.48 1.25 -1.40 0.00 0.00 179.01 179.56 1n1s h LEU 379 N 0.16 0.93 -0.48 1.33 5.85 -1.20 0.11 115.31 122.02 1n1s h LEU 379 Ca 0.06 -0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.74 1n1s h LEU 379 Cb 0.07 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 1n1s h LEU 379 CO -0.01 0.71 0.30 -0.61 -0.34 0.00 0.00 178.44 178.49 1n1s h GLN 380 N 1.08 0.58 -0.46 1.25 4.15 -1.20 0.02 115.11 120.53 1n1s h GLN 380 Ca 0.28 -0.03 -0.09 0.00 0.77 0.00 0.00 58.65 59.58 1n1s h GLN 380 Cb -0.05 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.49 1n1s h GLN 380 CO -0.05 0.38 -0.07 1.25 -1.93 0.00 0.00 178.83 178.41 1n1s h LEU 381 N 0.60 0.86 -0.62 -2.39 5.85 -0.94 -2.34 115.31 116.34 1n1s h LEU 381 Ca 0.19 -0.34 0.03 0.00 0.84 0.00 0.00 57.88 58.59 1n1s h LEU 381 Cb -0.02 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.74 1n1s h LEU 381 CO -0.07 1.00 0.38 0.24 -0.34 0.00 0.00 178.44 179.65 1n1s h MET 382 N 0.70 0.72 -0.73 1.25 2.86 -0.57 -0.67 114.93 118.49 1n1s h MET 382 Ca 0.12 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.67 1n1s h MET 382 Cb 0.60 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 32.07 1n1s h MET 382 CO 0.04 0.48 0.29 0.87 1.06 0.00 0.00 176.91 179.64 1n1s h LYS 383 N 0.74 1.10 -0.49 1.72 1.57 -0.87 -0.70 116.57 119.65 1n1s h LYS 383 Ca 0.25 -0.21 0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1n1s h LYS 383 Cb 0.02 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.13 1n1s h LYS 383 CO -0.10 0.91 0.31 1.03 -0.57 0.00 0.00 179.45 181.03 1n1s h SER 384 N 1.06 0.53 -0.46 0.86 0.87 -0.82 -1.00 113.55 114.58 1n1s h SER 384 Ca 0.24 -0.01 -0.11 0.00 -1.23 0.00 0.00 61.79 60.69 1n1s h SER 384 Cb 0.23 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 1n1s h SER 384 CO -0.02 0.38 -0.15 0.58 -0.53 0.00 0.00 176.83 177.09 1n1s h VAL 385 N 0.63 1.27 -0.87 2.23 2.07 -0.82 -1.82 116.25 118.95 1n1s h VAL 385 Ca 0.18 -1.28 -0.03 0.00 0.82 0.00 0.00 66.70 66.39 1n1s h VAL 385 Cb -0.04 1.14 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 1n1s h VAL 385 CO -0.06 0.44 0.43 0.58 0.02 0.00 0.00 177.57 178.98 1n1s h VAL 386 N 0.75 1.26 -0.75 2.57 2.07 -0.89 -0.77 116.25 120.49 1n1s h VAL 386 Ca 0.11 -0.72 -0.03 0.00 0.82 0.00 0.00 66.70 66.89 1n1s h VAL 386 Cb 0.70 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 1n1s h VAL 386 CO 0.05 0.31 0.37 0.03 0.02 0.00 0.00 177.57 178.35 1n1s h ARG 387 N 1.23 1.08 -0.18 1.57 3.08 -0.97 0.03 114.38 120.23 1n1s h ARG 387 Ca 0.30 -0.16 0.02 0.00 0.07 0.00 0.00 59.98 60.21 1n1s h ARG 387 Cb 0.10 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 1n1s h ARG 387 CO -0.04 0.84 0.06 1.15 -1.07 0.00 0.00 179.97 180.91 1n1s h THR 388 N 1.06 0.96 -0.28 2.04 2.02 -0.64 -0.07 112.91 118.00 1n1s h THR 388 Ca 0.26 -0.05 0.01 0.00 0.77 0.00 0.00 66.41 67.40 1n1s h THR 388 Cb 0.11 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 1n1s h THR 388 CO -0.03 0.03 0.16 -0.50 0.37 0.00 0.00 175.52 175.54 1n1s h TRP 389 N 0.15 0.29 -0.23 3.16 6.55 -0.74 -0.90 115.95 124.23 1n1s h TRP 389 Ca 0.08 0.01 -0.00 0.00 0.95 0.00 0.00 58.89 59.92 1n1s h TRP 389 Cb 0.04 -0.09 -0.01 0.00 -0.86 0.00 0.00 29.16 28.24 1n1s h TRP 389 CO -0.11 0.17 0.13 0.87 -1.05 0.00 0.00 178.44 178.45 1n1s h LYS 390 N 0.32 0.32 -0.38 0.49 1.57 -0.88 -1.58 116.57 116.43 1n1s h LYS 390 Ca 0.11 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 1n1s h LYS 390 Cb 0.01 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 1n1s h LYS 390 CO -0.06 0.28 0.02 0.93 -0.57 0.00 0.00 179.45 180.05 1n1s h GLU 391 N 0.28 0.66 -0.31 3.15 5.08 -0.80 0.09 114.58 122.73 1n1s h GLU 391 Ca 0.08 -0.20 -0.09 0.00 -1.00 0.00 0.00 59.36 58.16 1n1s h GLU 391 Cb 0.04 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1n1s h GLU 391 CO -0.01 0.74 -0.14 1.49 -1.00 0.00 0.00 179.01 180.09 1n1s h GLU 392 N 0.49 0.64 -0.43 2.33 4.57 -1.16 -0.67 114.58 120.35 1n1s h GLU 392 Ca 0.11 -0.28 -0.01 0.00 -1.18 0.00 0.00 59.36 58.01 1n1s h GLU 392 Cb 0.43 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.98 1n1s h GLU 392 CO 0.01 0.86 0.24 -0.44 -1.18 0.00 0.00 179.01 178.50 1n1s h ASP 393 N 0.40 0.54 -0.71 1.04 3.32 -1.21 -0.95 116.42 118.85 1n1s h ASP 393 Ca 0.07 -0.09 -0.07 0.00 0.02 0.00 0.00 57.03 56.96 1n1s h ASP 393 Cb 0.66 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.05 1n1s h ASP 393 CO 0.04 0.47 0.17 0.78 -1.72 0.00 0.00 179.24 178.98 1n1s h ASN 394 N 0.56 1.09 0.02 6.45 2.35 -0.93 -1.13 115.58 124.00 1n1s h ASN 394 Ca 0.15 -0.24 -0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1n1s h ASN 394 Cb 0.05 -0.29 0.00 0.00 0.05 0.00 0.00 38.32 38.13 1n1s h ASN 394 CO -0.02 1.04 -0.01 -0.74 -1.65 0.00 0.00 177.43 176.05 1n1s h HIS 395 N 1.08 -0.03 -0.80 1.19 -0.00 -0.84 -2.03 115.15 113.73 1n1s h HIS 395 Ca 0.22 -0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.56 1n1s h HIS 395 Cb 0.38 0.01 -0.04 0.00 -0.00 0.00 0.00 27.41 27.77 1n1s h HIS 395 CO 0.03 0.06 0.37 -0.07 -0.00 0.00 0.00 177.93 178.32 1n1s h LEU 396 N -0.10 1.05 -0.20 0.26 3.38 -1.04 -2.29 115.31 116.35 1n1s h LEU 396 Ca -0.00 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1n1s h LEU 396 Cb 0.10 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1n1s h LEU 396 CO 0.00 0.89 0.00 0.00 0.09 0.00 0.00 178.44 179.42 1n1s n ALA 397 N -2.43 1.90 1.05 1.53 0.00 -0.44 -2.80 120.51 119.31 1n1s n ALA 397 Ca 0.08 -0.02 0.11 0.00 0.00 0.00 0.00 53.44 53.61 1n1s n ALA 397 Cb 0.14 -1.36 0.06 0.00 0.00 0.00 0.00 19.45 18.29 1n1s n ALA 397 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1n1s n SER 398 N -1.84 1.49 -4.73 0.00 7.64 -0.78 -4.78 113.62 110.62 1n1s n SER 398 Ca 0.04 -1.19 -0.42 0.00 1.01 0.00 0.00 58.87 58.32 1n1s n SER 398 Cb 0.26 0.52 -0.03 0.00 -1.01 0.00 0.00 64.21 63.96 1n1s n SER 398 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1n1s s ILE 399 N -2.64 3.04 -0.74 0.44 1.01 -1.12 -4.95 121.20 116.23 1n1s s ILE 399 Ca 0.17 0.81 -0.24 0.00 0.00 0.00 0.00 60.65 61.38 1n1s s ILE 399 Cb 0.18 -3.52 0.06 0.00 0.01 0.00 0.00 42.46 39.19 1n1s s ILE 399 CO 0.64 0.10 1.13 0.00 0.00 0.00 0.00 174.94 176.81 1n1s s THR 401 N 4.64 4.32 0.33 0.00 -4.23 -1.26 -4.88 115.64 114.56 1n1s s THR 401 Ca 0.30 0.57 -0.29 0.00 -1.18 0.00 0.00 61.69 61.09 1n1s s THR 401 Cb -0.11 -3.73 -0.11 0.00 1.34 0.00 0.00 72.50 69.89 1n1s s THR 401 CO 0.09 -0.90 1.44 -2.84 -0.54 0.00 0.00 174.62 171.87 1n1s s PRO 402 N -5.13 4.21 0.08 3.99 0.02 -1.26 -0.67 135.00 136.23 1n1s s PRO 402 Ca 0.54 2.43 -0.30 0.00 0.02 0.00 0.00 61.00 63.69 1n1s s PRO 402 Cb -0.11 -3.03 -0.05 0.00 0.02 0.00 0.00 34.50 31.33 1n1s s PRO 402 CO 0.51 -0.43 1.03 0.08 -0.33 0.00 0.00 177.00 177.86 1n1s s VAL 403 N -0.78 4.44 0.02 3.83 1.01 -1.26 -3.87 120.40 123.80 1n1s s VAL 403 Ca 0.54 1.90 -0.10 0.00 0.00 0.00 0.00 61.98 64.32 1n1s s VAL 403 Cb -0.44 -4.21 -0.05 0.00 0.00 0.00 0.00 36.38 31.67 1n1s s VAL 403 CO 0.55 0.23 0.34 -0.69 0.00 0.00 0.00 175.10 175.53 1n1s s VAL 404 N 0.45 5.17 0.14 2.92 1.01 -1.26 -4.98 120.40 123.85 1n1s s VAL 404 Ca 0.51 0.44 -0.33 0.00 0.00 0.00 0.00 61.98 62.60 1n1s s VAL 404 Cb -0.25 -3.62 -0.13 0.00 0.00 0.00 0.00 36.38 32.39 1n1s s VAL 404 CO 0.30 0.40 1.66 -2.65 0.00 0.00 0.00 175.10 174.81 1n1s n PRO 405 N 1.26 2.32 0.00 2.72 -0.02 -1.26 -5.13 135.00 134.90 1n1s n PRO 405 Ca -0.11 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 1n1s n PRO 405 Cb 0.53 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 1n1s n PRO 405 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n1s n ALA 406 N 4.05 2.53 -0.20 3.55 0.00 -1.26 -5.31 120.51 123.87 1n1s n ALA 406 Ca 0.17 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.62 1n1s n ALA 406 Cb 0.31 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.86 1n1s n ALA 406 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1n1s h GLY 413 N 0.00 0.73 -2.12 0.00 0.00 -2.04 -3.57 103.07 96.07 1n1s h GLY 413 Ca 0.00 -0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.77 1n1s h GLY 413 CO 0.00 -0.13 -0.69 0.00 0.00 0.00 0.00 176.54 175.72 1n1s n GLY 415 N -0.67 -0.45 3.69 0.00 0.00 0.16 -4.77 105.19 103.15 1n1s n GLY 415 Ca -0.05 -1.78 -0.37 0.00 0.00 0.00 0.00 46.02 43.81 1n1s n GLY 415 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1s n ALA 416 N -3.04 0.86 -1.77 4.61 0.00 -1.26 -4.55 120.51 115.36 1n1s n ALA 416 Ca -0.02 0.01 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 1n1s n ALA 416 Cb 0.05 -2.26 0.01 0.00 0.00 0.00 0.00 19.45 17.25 1n1s n ALA 416 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n1s s ALA 417 N -1.42 2.66 0.12 0.00 0.00 -1.26 -4.57 121.76 117.29 1n1s s ALA 417 Ca 0.79 0.92 -0.32 0.00 0.00 0.00 0.00 51.96 53.35 1n1s s ALA 417 Cb -0.40 -3.40 -0.11 0.00 0.00 0.00 0.00 23.12 19.21 1n1s s ALA 417 CO 0.43 -0.93 1.79 0.28 0.00 0.00 0.00 175.76 177.33 1n1s n VAL 418 N -1.35 0.29 -1.68 0.00 0.31 -1.26 -4.87 118.33 109.77 1n1s n VAL 418 Ca 0.12 -0.05 -0.46 0.00 -0.01 0.00 0.00 64.34 63.94 1n1s n VAL 418 Cb 0.50 -2.00 -0.04 0.00 -0.91 0.00 0.00 33.84 31.39 1n1s n VAL 418 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1n1s n PRO 419 N 5.22 2.39 0.00 5.55 -0.02 -1.26 -4.55 135.00 142.34 1n1s n PRO 419 Ca 0.18 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.53 1n1s n PRO 419 Cb 0.35 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.11 1n1s n PRO 419 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1n1s n THR 420 N 4.64 0.00 -2.05 3.45 -2.24 -1.26 -4.84 114.28 111.97 1n1s n THR 420 Ca 0.20 -0.09 -0.42 0.00 -2.27 0.00 0.00 64.05 61.46 1n1s n THR 420 Cb 0.32 0.56 -0.03 0.00 -2.10 0.00 0.00 70.33 69.08 1n1s n THR 420 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1n1s s ALA 421 N -1.58 3.63 0.00 6.98 0.00 -1.26 -1.70 121.76 127.83 1n1s s ALA 421 Ca 0.00 1.01 0.00 0.00 0.00 0.00 0.00 51.96 52.97 1n1s s ALA 421 Cb 0.00 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1n1s s ALA 421 CO 0.00 -1.13 0.00 0.41 0.00 0.00 0.00 175.76 175.04 1n1s n GLY 422 N 3.92 0.71 3.61 0.00 0.00 -1.26 -4.93 105.19 107.24 1n1s n GLY 422 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 1n1s n GLY 422 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1n1s s LEU 423 N 0.00 3.70 -0.22 0.99 0.20 -0.69 -1.14 118.68 121.52 1n1s s LEU 423 Ca 0.00 0.95 -0.08 0.00 0.69 0.00 0.00 54.13 55.70 1n1s s LEU 423 Cb 0.00 -3.54 -0.19 0.00 -0.43 0.00 0.00 46.19 42.03 1n1s s LEU 423 CO 0.00 -1.30 -0.02 0.52 -0.29 0.00 0.00 176.35 175.26 1n1s n VAL 424 N 6.74 1.59 -3.89 1.68 0.31 0.59 -4.68 118.33 120.66 1n1s n VAL 424 Ca 0.16 -0.47 -0.09 0.00 -0.01 0.00 0.00 64.34 63.93 1n1s n VAL 424 Cb 0.47 -1.71 -0.08 0.00 -0.91 0.00 0.00 33.84 31.61 1n1s n VAL 424 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1n1s s GLY 425 N -5.77 0.13 -0.21 2.92 0.00 -1.06 -4.61 107.32 98.73 1n1s s GLY 425 Ca -0.31 -0.60 -0.09 0.00 0.00 0.00 0.00 44.72 43.71 1n1s s GLY 425 CO 0.62 -0.77 0.48 -0.12 0.00 0.00 0.00 173.10 173.31 1n1s s PHE 426 N -3.40 -0.84 -0.21 1.90 5.99 -1.26 -1.22 117.98 118.94 1n1s s PHE 426 Ca 0.02 1.62 -0.03 0.00 0.00 0.00 0.00 56.93 58.54 1n1s s PHE 426 Cb 0.03 0.39 -0.01 0.00 0.00 0.00 0.00 43.02 43.44 1n1s s PHE 426 CO -0.08 -0.47 -0.07 -0.51 -0.00 0.00 0.00 175.22 174.09 1n1s s LEU 427 N 2.15 2.80 0.00 6.12 1.43 0.22 -0.25 118.68 131.15 1n1s s LEU 427 Ca -0.06 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 52.63 1n1s s LEU 427 Cb -0.10 -1.70 0.00 0.00 0.03 0.00 0.00 46.19 44.42 1n1s s LEU 427 CO -0.14 -0.00 0.00 -0.24 0.23 0.00 0.00 176.35 176.19 1n1s n SER 428 N 4.69 0.00 -0.19 2.29 2.88 -1.26 -1.11 113.62 120.92 1n1s n SER 428 Ca -0.18 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.27 1n1s n SER 428 Cb 0.51 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.98 1n1s n SER 428 CO 0.00 0.00 0.00 -0.74 -1.23 0.00 0.00 175.04 173.07 1n1s h HIS 429 N 0.00 0.92 -2.81 0.66 2.76 -1.90 -3.26 115.15 111.51 1n1s h HIS 429 Ca 0.00 -0.11 -0.56 0.00 -2.20 0.00 0.00 60.37 57.50 1n1s h HIS 429 Cb 0.00 -0.26 -0.03 0.00 1.55 0.00 0.00 27.41 28.67 1n1s h HIS 429 CO 0.00 0.80 1.07 0.45 -1.30 0.00 0.00 177.93 178.94 1n1s s SER 430 N -6.21 6.55 -0.10 3.26 0.15 -1.26 -4.62 113.70 111.47 1n1s s SER 430 Ca -0.13 1.67 -0.11 0.00 0.70 0.00 0.00 55.95 58.08 1n1s s SER 430 Cb 0.12 -2.53 0.03 0.00 -1.71 0.00 0.00 66.02 61.93 1n1s s SER 430 CO 0.81 -1.11 0.30 0.00 1.20 0.00 0.00 173.24 174.44 1n1s s ALA 431 N 4.65 -0.75 -0.16 5.45 0.00 -1.26 -1.90 121.76 127.80 1n1s s ALA 431 Ca 0.67 0.74 -0.08 0.00 0.00 0.00 0.00 51.96 53.29 1n1s s ALA 431 Cb -0.25 -0.39 0.06 0.00 0.00 0.00 0.00 23.12 22.54 1n1s s ALA 431 CO 0.26 -0.17 0.38 1.21 0.00 0.00 0.00 175.76 177.45 1n1s s ASN 432 N -0.13 -0.44 1.97 0.00 2.47 -0.19 -4.99 114.94 113.63 1n1s s ASN 432 Ca -0.03 0.83 0.00 0.00 0.42 0.00 0.00 52.86 54.08 1n1s s ASN 432 Cb -0.03 0.74 0.00 0.00 -1.45 0.00 0.00 41.25 40.51 1n1s s ASN 432 CO 0.01 -0.19 0.00 0.61 -3.72 0.00 0.00 177.10 173.81 1n1s n GLY 433 N 4.35 3.62 1.83 1.21 0.00 -1.26 -1.71 105.19 113.23 1n1s n GLY 433 Ca -0.23 -0.09 -0.07 0.00 0.00 0.00 0.00 46.02 45.64 1n1s n GLY 433 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1n1s n SER 434 N 5.60 4.29 -4.10 1.61 3.41 -1.26 -4.89 113.62 118.28 1n1s n SER 434 Ca 0.00 -3.05 -0.26 0.00 -0.26 0.00 0.00 58.87 55.31 1n1s n SER 434 Cb 0.00 -0.72 -0.16 0.00 -0.26 0.00 0.00 64.21 63.07 1n1s n SER 434 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1n1s s VAL 435 N -2.59 1.35 -0.28 -3.33 1.01 -0.70 -0.48 120.40 115.38 1n1s s VAL 435 Ca 0.46 -0.65 -0.06 0.00 0.00 0.00 0.00 61.98 61.73 1n1s s VAL 435 Cb 0.37 -1.18 0.01 0.00 0.00 0.00 0.00 36.38 35.58 1n1s s VAL 435 CO 0.11 0.39 0.06 0.86 0.00 0.00 0.00 175.10 176.52 1n1s s TRP 436 N 0.23 3.13 0.10 5.22 -0.11 0.11 -1.02 118.94 126.60 1n1s s TRP 436 Ca -0.08 -1.03 -0.29 0.00 1.22 0.00 0.00 56.10 55.92 1n1s s TRP 436 Cb -0.13 -2.22 -0.06 0.00 -1.50 0.00 0.00 33.47 29.56 1n1s s TRP 436 CO 0.03 -0.59 0.93 -1.21 -4.62 0.00 0.00 176.95 171.49 1n1s s GLU 437 N 1.48 4.66 0.01 5.86 0.41 -0.80 -1.24 118.70 129.08 1n1s s GLU 437 Ca 0.02 1.39 -0.30 0.00 -0.41 0.00 0.00 54.97 55.67 1n1s s GLU 437 Cb -0.17 -3.38 -0.06 0.00 -1.78 0.00 0.00 34.13 28.74 1n1s s GLU 437 CO 0.01 0.22 1.49 0.34 -0.49 0.00 0.00 175.26 176.83 1n1s s ASP 438 N 0.01 6.77 0.49 -0.19 2.15 -1.26 -4.31 116.67 120.33 1n1s s ASP 438 Ca 0.46 2.21 0.15 0.00 0.43 0.00 0.00 52.55 55.79 1n1s s ASP 438 Cb -0.23 -2.56 1.15 0.00 -0.30 0.00 0.00 42.92 40.98 1n1s s ASP 438 CO 0.29 -0.79 2.09 0.58 -0.17 0.00 0.00 175.17 177.17 1n1s h VAL 439 N 4.98 1.05 -0.10 1.11 2.07 -1.00 -0.50 116.25 123.88 1n1s h VAL 439 Ca -0.39 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1n1s h VAL 439 Cb 1.18 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 1n1s h VAL 439 CO 0.92 0.07 0.00 -1.22 0.02 0.00 0.00 177.57 177.36 1n1s n TYR 440 N -4.46 0.12 -1.60 1.57 4.02 -1.26 -4.93 117.16 110.62 1n1s n TYR 440 Ca -0.02 -0.06 -0.13 0.00 -0.01 0.00 0.00 57.90 57.67 1n1s n TYR 440 Cb 0.14 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.42 1n1s n TYR 440 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1n1s n ARG 441 N -0.00 -0.96 -0.07 -0.72 1.74 -0.20 -4.90 116.66 111.56 1n1s n ARG 441 Ca 0.17 0.89 -0.14 0.00 -0.77 0.00 0.00 57.85 57.99 1n1s n ARG 441 Cb 0.27 -5.00 -0.05 0.00 -1.02 0.00 0.00 32.46 26.66 1n1s n ARG 441 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1n1s s VAL 443 N -2.38 0.73 0.69 0.00 1.01 -1.26 -4.90 120.40 114.28 1n1s s VAL 443 Ca -0.22 -0.95 -0.11 0.00 0.00 0.00 0.00 61.98 60.69 1n1s s VAL 443 Cb 0.07 -1.35 0.00 0.00 0.00 0.00 0.00 36.38 35.11 1n1s s VAL 443 CO 0.29 -0.40 1.08 -1.81 0.00 0.00 0.00 175.10 174.26 1n1s s ASP 444 N 1.73 5.61 0.00 3.32 1.01 -1.26 -4.26 116.67 122.83 1n1s s ASP 444 Ca 0.03 1.20 -0.00 0.00 0.71 0.00 0.00 52.55 54.49 1n1s s ASP 444 Cb -0.17 -2.06 -0.04 0.00 1.01 0.00 0.00 42.92 41.66 1n1s s ASP 444 CO -0.16 -1.24 0.09 0.00 0.21 0.00 0.00 175.17 174.07 1n1s s ALA 445 N -3.31 3.62 -0.03 5.23 0.00 -0.37 -4.54 121.76 122.36 1n1s s ALA 445 Ca 0.57 -0.88 -0.14 0.00 0.00 0.00 0.00 51.96 51.51 1n1s s ALA 445 Cb -0.11 -1.59 -0.05 0.00 0.00 0.00 0.00 23.12 21.36 1n1s s ALA 445 CO 0.52 0.70 0.39 -0.80 0.00 0.00 0.00 175.76 176.58 1n1s s ASN 446 N -1.83 6.75 0.12 0.00 0.01 -0.12 -0.71 114.94 119.16 1n1s s ASN 446 Ca 0.24 0.90 0.08 0.00 -0.71 0.00 0.00 52.86 53.36 1n1s s ASN 446 Cb -0.12 -2.24 -0.04 0.00 0.41 0.00 0.00 41.25 39.26 1n1s s ASN 446 CO 0.15 0.29 -0.18 -0.69 -1.51 0.00 0.00 177.10 175.16 1n1s s VAL 447 N -0.85 1.61 0.00 1.60 1.01 0.37 -0.53 120.40 123.62 1n1s s VAL 447 Ca 0.23 -1.66 -0.05 0.00 0.00 0.00 0.00 61.98 60.50 1n1s s VAL 447 Cb -0.16 -1.58 -0.00 0.00 0.00 0.00 0.00 36.38 34.63 1n1s s VAL 447 CO 0.12 -0.21 0.09 0.00 0.00 0.00 0.00 175.10 175.10 1n1s s ALA 448 N -1.59 -0.19 -1.31 5.51 0.00 -0.80 -4.66 121.76 118.72 1n1s s ALA 448 Ca 0.09 -0.23 -0.14 0.00 0.00 0.00 0.00 51.96 51.67 1n1s s ALA 448 Cb -0.08 0.10 0.01 0.00 0.00 0.00 0.00 23.12 23.15 1n1s s ALA 448 CO 0.05 -0.18 0.53 0.09 0.00 0.00 0.00 175.76 176.24 1n1s n ASN 449 N 1.60 -2.42 -4.30 0.00 3.02 -1.26 -1.94 115.26 109.96 1n1s n ASN 449 Ca -0.22 -1.11 -0.19 0.00 -0.03 0.00 0.00 54.58 53.02 1n1s n ASN 449 Cb 0.56 -2.64 -0.11 0.00 -0.61 0.00 0.00 39.78 36.98 1n1s n ASN 449 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n1s s ALA 450 N -3.78 1.80 -0.02 5.41 0.00 -1.26 -1.23 121.76 122.68 1n1s s ALA 450 Ca 0.25 -1.45 0.03 0.00 0.00 0.00 0.00 51.96 50.79 1n1s s ALA 450 Cb -0.11 -0.12 -0.00 0.00 0.00 0.00 0.00 23.12 22.89 1n1s s ALA 450 CO 0.92 0.14 -0.10 -2.00 0.00 0.00 0.00 175.76 174.72 1n1s s GLU 451 N -2.94 1.00 0.26 0.00 2.12 -0.13 -4.96 118.70 114.06 1n1s s GLU 451 Ca 0.14 -0.35 -0.29 0.00 0.36 0.00 0.00 54.97 54.83 1n1s s GLU 451 Cb -0.04 -0.93 -0.09 0.00 0.26 0.00 0.00 34.13 33.32 1n1s s GLU 451 CO 0.05 0.15 1.16 1.03 -0.54 0.00 0.00 175.26 177.12 1n1s s ARG 452 N 0.07 4.55 0.20 4.30 0.52 -1.26 -0.64 118.95 126.70 1n1s s ARG 452 Ca -0.01 1.90 0.03 0.00 -0.52 0.00 0.00 55.73 57.12 1n1s s ARG 452 Cb -0.08 -3.18 -0.05 0.00 0.52 0.00 0.00 34.95 32.16 1n1s s ARG 452 CO 0.00 0.06 -0.01 0.14 0.02 0.00 0.00 175.30 175.51 1n1s s VAL 453 N -0.82 0.91 -0.03 3.52 -7.23 -0.72 -4.85 120.40 111.18 1n1s s VAL 453 Ca 0.48 -2.02 -0.35 0.00 -1.81 0.00 0.00 61.98 58.28 1n1s s VAL 453 Cb -0.33 -2.24 -0.13 0.00 0.56 0.00 0.00 36.38 34.24 1n1s s VAL 453 CO 0.42 -0.40 1.73 -2.65 -0.31 0.00 0.00 175.10 173.89 1n1s n PRO 454 N -0.34 1.94 -1.08 4.82 -0.02 -1.26 -1.81 135.00 137.24 1n1s n PRO 454 Ca -0.06 0.71 -0.03 0.00 -2.02 0.00 0.00 63.50 62.10 1n1s n PRO 454 Cb 0.63 -2.49 -0.01 0.00 -0.02 0.00 0.00 33.50 31.61 1n1s n PRO 454 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1n1s n ASN 455 N 5.17 -4.59 0.00 2.55 3.02 -1.26 -4.86 115.26 115.29 1n1s n ASN 455 Ca 0.21 0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.83 1n1s n ASN 455 Cb 0.26 -2.35 0.00 0.00 -0.61 0.00 0.00 39.78 37.09 1n1s n ASN 455 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1n1s n GLY 456 N -0.99 -0.87 2.94 7.41 0.00 -0.75 -1.72 105.19 111.21 1n1s n GLY 456 Ca -0.03 -0.19 -0.10 0.00 0.00 0.00 0.00 46.02 45.70 1n1s n GLY 456 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n1s s LEU 457 N 0.00 2.11 -0.14 0.99 1.43 -0.61 -1.75 118.68 120.71 1n1s s LEU 457 Ca 0.00 -0.26 -0.03 0.00 -1.03 0.00 0.00 54.13 52.81 1n1s s LEU 457 Cb 0.00 0.08 -0.03 0.00 0.03 0.00 0.00 46.19 46.27 1n1s s LEU 457 CO 0.00 -0.17 -0.04 -0.75 0.23 0.00 0.00 176.35 175.63 1n1s s LYS 458 N -0.79 3.54 -0.15 1.70 2.20 0.19 -1.12 119.74 125.31 1n1s s LYS 458 Ca -0.09 -0.51 -0.06 0.00 -0.36 0.00 0.00 55.97 54.95 1n1s s LYS 458 Cb -0.05 -2.87 -0.04 0.00 -1.51 0.00 0.00 37.83 33.35 1n1s s LYS 458 CO -0.00 0.32 0.06 -0.06 -0.36 0.00 0.00 175.35 175.31 1n1s s PHE 459 N 0.16 3.31 -0.27 4.03 0.40 -0.20 -0.95 117.98 124.45 1n1s s PHE 459 Ca -0.01 0.20 -0.02 0.00 -0.60 0.00 0.00 56.93 56.49 1n1s s PHE 459 Cb -0.14 -1.98 0.16 0.00 0.51 0.00 0.00 43.02 41.57 1n1s s PHE 459 CO 0.03 0.35 0.49 1.21 0.70 0.00 0.00 175.22 178.00 1n1s s ASN 460 N -0.22 -0.58 0.00 1.36 3.84 -0.36 -3.91 114.94 115.07 1n1s s ASN 460 Ca 0.08 0.59 0.00 0.00 0.21 0.00 0.00 52.86 53.74 1n1s s ASN 460 Cb -0.12 1.65 0.00 0.00 -0.55 0.00 0.00 41.25 42.23 1n1s s ASN 460 CO 0.01 -0.28 0.00 0.61 -2.79 0.00 0.00 177.10 174.66 1n1s n GLY 461 N 5.40 3.67 3.68 1.21 0.00 -1.26 -4.66 105.19 113.23 1n1s n GLY 461 Ca -0.03 -1.72 -0.43 0.00 0.00 0.00 0.00 46.02 43.84 1n1s n GLY 461 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1n1s n VAL 462 N -1.70 0.40 -1.06 1.61 0.31 -1.26 -0.96 118.33 115.67 1n1s n VAL 462 Ca 0.00 -0.07 -0.02 0.00 -0.01 0.00 0.00 64.34 64.24 1n1s n VAL 462 Cb 0.00 -2.07 -0.01 0.00 -0.91 0.00 0.00 33.84 30.86 1n1s n VAL 462 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1n1s n GLY 463 N 4.22 0.55 3.66 2.92 0.00 0.51 -4.83 105.19 112.22 1n1s n GLY 463 Ca 0.19 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 1n1s n GLY 463 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n1s s GLY 464 N -2.52 1.46 0.00 -0.02 0.00 -0.14 -4.09 107.32 102.02 1n1s s GLY 464 Ca 0.00 1.28 0.00 0.00 0.00 0.00 0.00 44.72 46.00 1n1s s GLY 464 CO 0.00 3.41 0.00 0.61 0.00 0.00 0.00 173.10 177.12 1n1s n GLY 465 N 4.48 -1.48 3.04 0.20 0.00 -0.82 -1.60 105.19 109.02 1n1s n GLY 465 Ca 0.19 -1.36 -0.15 0.00 0.00 0.00 0.00 46.02 44.70 1n1s n GLY 465 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1s s ALA 466 N -1.28 0.64 -0.22 4.61 0.00 0.40 -1.90 121.76 124.02 1n1s s ALA 466 Ca 0.00 -0.57 -0.02 0.00 0.00 0.00 0.00 51.96 51.37 1n1s s ALA 466 Cb 0.00 -0.06 0.01 0.00 0.00 0.00 0.00 23.12 23.07 1n1s s ALA 466 CO 0.00 0.08 -0.09 0.08 0.00 0.00 0.00 175.76 175.83 1n1s s VAL 467 N -0.80 2.89 -0.48 0.00 1.01 0.31 -1.42 120.40 121.91 1n1s s VAL 467 Ca -0.03 -0.74 -0.12 0.00 0.00 0.00 0.00 61.98 61.09 1n1s s VAL 467 Cb -0.07 -2.33 0.11 0.00 0.00 0.00 0.00 36.38 34.09 1n1s s VAL 467 CO 0.00 0.40 0.38 0.86 0.00 0.00 0.00 175.10 176.74 1n1s s TRP 468 N 1.39 3.34 0.33 5.22 -0.11 0.08 -0.95 118.94 128.23 1n1s s TRP 468 Ca 0.04 -1.51 -0.29 0.00 1.22 0.00 0.00 56.10 55.56 1n1s s TRP 468 Cb -0.14 -3.42 -0.10 0.00 -1.50 0.00 0.00 33.47 28.31 1n1s s TRP 468 CO -0.06 -0.94 1.34 -1.25 -4.62 0.00 0.00 176.95 171.41 1n1s s PRO 469 N 1.48 4.32 0.00 5.86 0.04 -1.26 -0.85 135.00 144.60 1n1s s PRO 469 Ca 0.04 2.25 0.00 0.00 0.04 0.00 0.00 61.00 63.34 1n1s s PRO 469 Cb -0.26 -3.07 0.00 0.00 0.04 0.00 0.00 34.50 31.21 1n1s s PRO 469 CO 0.02 -0.24 0.00 0.28 0.04 0.00 0.00 177.00 177.10 1n1s n VAL 470 N 0.94 0.00 0.25 -0.36 0.31 -0.39 -4.58 118.33 114.51 1n1s n VAL 470 Ca 0.01 0.00 0.08 0.00 -0.01 0.00 0.00 64.34 64.41 1n1s n VAL 470 Cb 0.41 -0.08 0.62 0.00 -0.91 0.00 0.00 33.84 33.89 1n1s n VAL 470 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1n1s h ALA 471 N 0.26 1.97 0.00 3.52 0.00 -0.70 -0.95 119.26 123.37 1n1s h ALA 471 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1n1s h ALA 471 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1n1s h ALA 471 CO 0.00 0.02 0.00 0.54 0.00 0.00 0.00 179.25 179.81 1n1s n ARG 472 N -4.52 0.02 0.30 0.00 1.74 -0.82 -1.26 116.66 112.12 1n1s n ARG 472 Ca -0.03 0.36 0.18 0.00 -0.77 0.00 0.00 57.85 57.60 1n1s n ARG 472 Cb 0.10 -1.50 0.92 0.00 -1.02 0.00 0.00 32.46 30.96 1n1s n ARG 472 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1n1s h GLN 473 N 0.00 0.00 0.00 5.56 4.20 -1.41 -3.48 115.11 119.97 1n1s h GLN 473 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1n1s h GLN 473 Cb 0.06 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.84 1n1s h GLN 473 CO 0.00 0.03 0.00 0.41 -0.67 0.00 0.00 178.83 178.60 1n1s n GLY 474 N -0.60 1.07 0.18 3.46 0.00 -0.39 -4.50 105.19 104.42 1n1s n GLY 474 Ca -0.01 -1.07 -0.14 0.00 0.00 0.00 0.00 46.02 44.79 1n1s n GLY 474 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1n1s h GLN 475 N 0.00 -0.36 -4.93 1.61 4.15 -1.88 -3.40 115.11 110.30 1n1s h GLN 475 Ca 0.00 0.02 -0.65 0.00 0.77 0.00 0.00 58.65 58.80 1n1s h GLN 475 Cb 0.00 0.08 -0.17 0.00 0.21 0.00 0.00 27.48 27.60 1n1s h GLN 475 CO 0.00 -0.14 -0.42 0.99 -1.93 0.00 0.00 178.83 177.33 1n1s s THR 476 N -5.54 5.26 -0.79 2.39 2.01 -1.26 -4.57 115.64 113.13 1n1s s THR 476 Ca -0.15 0.17 -0.05 0.00 0.31 0.00 0.00 61.69 61.97 1n1s s THR 476 Cb 0.04 -3.64 0.20 0.00 0.01 0.00 0.00 72.50 69.11 1n1s s THR 476 CO 0.62 0.14 0.66 -0.13 -0.69 0.00 0.00 174.62 175.22 1n1s s ARG 477 N 1.85 3.12 0.34 4.92 0.52 -0.20 -4.78 118.95 124.72 1n1s s ARG 477 Ca 0.09 -2.83 0.27 0.00 -0.52 0.00 0.00 55.73 52.74 1n1s s ARG 477 Cb -0.16 -4.00 0.96 0.00 0.52 0.00 0.00 34.95 32.27 1n1s s ARG 477 CO 0.11 -1.23 1.78 0.00 0.02 0.00 0.00 175.30 175.98 1n1s h ARG 478 N 6.79 0.00 -0.45 3.54 3.08 -1.86 -2.44 114.38 123.04 1n1s h ARG 478 Ca 0.08 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.07 1n1s h ARG 478 Cb 0.92 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.93 1n1s h ARG 478 CO 0.79 0.00 0.05 0.66 -1.07 0.00 0.00 179.97 180.40 1n1s n TYR 479 N -2.55 1.56 0.09 3.04 0.53 -1.26 -4.60 117.16 113.98 1n1s n TYR 479 Ca 0.03 -0.97 0.17 0.00 -1.02 0.00 0.00 57.90 56.11 1n1s n TYR 479 Cb 0.33 -0.46 0.71 0.00 -1.03 0.00 0.00 39.34 38.90 1n1s n TYR 479 CO 0.00 0.00 0.00 0.37 -1.02 0.00 0.00 176.86 176.21 1n1s h GLN 480 N 2.48 0.00 -0.30 -0.72 5.75 -1.78 -1.35 115.11 119.19 1n1s h GLN 480 Ca 0.07 0.00 0.09 0.00 -0.15 0.00 0.00 58.65 58.66 1n1s h GLN 480 Cb 1.79 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 30.33 1n1s h GLN 480 CO 0.41 0.00 0.27 0.27 -2.65 0.00 0.00 178.83 177.14 1n1s h PHE 481 N 0.00 0.00 0.00 3.99 -0.00 -1.81 -2.68 116.94 116.43 1n1s h PHE 481 Ca 0.17 0.00 -0.01 0.00 -0.00 0.00 0.00 57.97 58.13 1n1s h PHE 481 Cb 0.72 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.67 1n1s h PHE 481 CO 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 178.31 178.26 1n1s h ALA 482 N 1.74 1.48 0.00 12.09 0.00 -1.35 -0.38 119.26 132.83 1n1s h ALA 482 Ca 0.14 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1n1s h ALA 482 Cb 0.68 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1n1s h ALA 482 CO -0.00 0.07 0.00 -0.91 0.00 0.00 0.00 179.25 178.40 1n1s h ASN 483 N 0.00 0.00 0.01 0.00 2.35 -1.69 -3.20 115.58 113.05 1n1s h ASN 483 Ca -0.00 0.00 -0.40 0.00 -0.55 0.00 0.00 56.30 55.35 1n1s h ASN 483 Cb 0.13 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.44 1n1s h ASN 483 CO 0.01 0.00 -2.32 0.00 -1.65 0.00 0.00 177.43 173.47 1n1s n TYR 484 N -3.07 0.26 -3.57 1.19 9.36 -0.26 -4.35 117.16 116.71 1n1s n TYR 484 Ca 0.00 0.08 -0.11 0.00 3.32 0.00 0.00 57.90 61.20 1n1s n TYR 484 Cb 0.28 -1.03 -0.05 0.00 -0.63 0.00 0.00 39.34 37.91 1n1s n TYR 484 CO 0.00 0.00 0.00 -0.98 0.22 0.00 0.00 176.86 176.10 1n1s s ARG 485 N -2.50 0.61 0.10 2.98 1.70 -0.55 -4.29 118.95 116.99 1n1s s ARG 485 Ca -0.35 0.13 -0.26 0.00 -0.47 0.00 0.00 55.73 54.79 1n1s s ARG 485 Cb 0.11 0.29 0.08 0.00 -0.57 0.00 0.00 34.95 34.86 1n1s s ARG 485 CO 0.57 -0.19 0.81 -0.59 -1.08 0.00 0.00 175.30 174.82 1n1s s PHE 486 N -1.19 -0.34 -0.07 5.89 -0.12 -0.49 -3.87 117.98 117.80 1n1s s PHE 486 Ca -0.02 0.12 0.01 0.00 -0.05 0.00 0.00 56.93 56.99 1n1s s PHE 486 Cb -0.00 0.58 0.02 0.00 -0.63 0.00 0.00 43.02 42.98 1n1s s PHE 486 CO 0.01 -0.75 -0.09 0.99 -0.05 0.00 0.00 175.22 175.34 1n1s s THR 487 N -3.39 0.92 -0.12 -4.49 2.01 -0.78 -1.36 115.64 108.42 1n1s s THR 487 Ca 0.06 -0.31 0.03 0.00 0.31 0.00 0.00 61.69 61.77 1n1s s THR 487 Cb -0.02 -0.89 0.01 0.00 0.01 0.00 0.00 72.50 71.61 1n1s s THR 487 CO -0.06 0.32 -0.21 -0.22 -0.69 0.00 0.00 174.62 173.76 1n1s s LEU 488 N 1.03 2.02 0.03 4.42 2.96 0.07 -0.93 118.68 128.27 1n1s s LEU 488 Ca -0.08 -0.55 0.07 0.00 -0.22 0.00 0.00 54.13 53.35 1n1s s LEU 488 Cb -0.15 -1.35 -0.02 0.00 0.50 0.00 0.00 46.19 45.17 1n1s s LEU 488 CO -0.00 0.08 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.21 1n1s s VAL 489 N 0.75 1.71 0.05 1.68 1.01 0.19 -0.18 120.40 125.61 1n1s s VAL 489 Ca -0.10 -1.13 -0.27 0.00 0.00 0.00 0.00 61.98 60.48 1n1s s VAL 489 Cb -0.16 -1.47 0.07 0.00 0.00 0.00 0.00 36.38 34.82 1n1s s VAL 489 CO 0.01 0.30 0.62 0.00 0.00 0.00 0.00 175.10 176.03 1n1s s ALA 490 N -0.71 -1.64 -0.16 5.51 0.00 -0.26 -0.57 121.76 123.93 1n1s s ALA 490 Ca 0.08 0.89 -0.06 0.00 0.00 0.00 0.00 51.96 52.87 1n1s s ALA 490 Cb -0.09 0.40 -0.04 0.00 0.00 0.00 0.00 23.12 23.40 1n1s s ALA 490 CO 0.01 -0.54 0.05 0.99 0.00 0.00 0.00 175.76 176.26 1n1s s THR 491 N -2.37 4.67 0.09 0.00 2.01 -0.51 -0.49 115.64 119.04 1n1s s THR 491 Ca -0.06 -0.09 0.02 0.00 0.31 0.00 0.00 61.69 61.88 1n1s s THR 491 Cb -0.00 -3.07 -0.04 0.00 0.01 0.00 0.00 72.50 69.40 1n1s s THR 491 CO -0.01 0.51 -0.08 0.68 -0.69 0.00 0.00 174.62 175.03 1n1s s VAL 492 N -0.00 0.71 -0.00 3.82 -7.23 0.07 -0.81 120.40 116.96 1n1s s VAL 492 Ca 0.05 -1.68 0.02 0.00 -1.81 0.00 0.00 61.98 58.56 1n1s s VAL 492 Cb -0.12 -1.37 -0.01 0.00 0.56 0.00 0.00 36.38 35.44 1n1s s VAL 492 CO 0.01 -0.70 -0.08 0.42 -0.31 0.00 0.00 175.10 174.45 1n1s s THR 493 N -2.87 0.61 -0.24 5.32 -4.23 -0.37 -0.51 115.64 113.35 1n1s s THR 493 Ca 0.06 -0.39 -0.15 0.00 -1.18 0.00 0.00 61.69 60.03 1n1s s THR 493 Cb 0.00 -0.52 -0.04 0.00 1.34 0.00 0.00 72.50 73.28 1n1s s THR 493 CO -0.03 0.13 0.35 -0.63 -0.54 0.00 0.00 174.62 173.91 1n1s s ILE 494 N -0.27 5.21 -0.11 2.99 1.01 -1.26 -1.27 121.20 127.50 1n1s s ILE 494 Ca 0.02 0.56 0.10 0.00 0.00 0.00 0.00 60.65 61.33 1n1s s ILE 494 Cb -0.03 -3.68 -0.24 0.00 0.01 0.00 0.00 42.46 38.52 1n1s s ILE 494 CO -0.00 0.21 0.42 0.47 0.00 0.00 0.00 174.94 176.04 1n1s n ASP 495 N 4.94 0.93 -3.87 3.58 8.00 0.56 -0.79 116.55 129.89 1n1s n ASP 495 Ca -0.09 0.25 -0.11 0.00 0.71 0.00 0.00 54.79 55.54 1n1s n ASP 495 Cb 0.51 0.05 -0.12 0.00 -0.02 0.00 0.00 41.12 41.54 1n1s n ASP 495 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1n1s s GLU 496 N -2.56 0.27 0.39 -1.24 2.02 -1.11 -4.79 118.70 111.68 1n1s s GLU 496 Ca -0.11 -0.17 -0.27 0.00 0.02 0.00 0.00 54.97 54.45 1n1s s GLU 496 Cb 0.07 0.11 -0.09 0.00 0.10 0.00 0.00 34.13 34.32 1n1s s GLU 496 CO 0.80 -0.05 1.35 -0.51 0.02 0.00 0.00 175.26 176.87 1n1s s LEU 497 N -0.68 4.27 0.66 1.80 1.43 -1.26 -4.64 118.68 120.25 1n1s s LEU 497 Ca -0.08 2.76 -0.09 0.00 -1.03 0.00 0.00 54.13 55.70 1n1s s LEU 497 Cb -0.05 -3.81 0.02 0.00 0.03 0.00 0.00 46.19 42.38 1n1s s LEU 497 CO 0.00 -0.83 1.01 -2.16 0.23 0.00 0.00 176.35 174.61 1n1s s PRO 498 N -2.14 2.77 0.08 1.29 0.04 -1.26 -5.00 135.00 130.78 1n1s s PRO 498 Ca 0.55 0.18 -0.17 0.00 0.04 0.00 0.00 61.00 61.60 1n1s s PRO 498 Cb -0.41 -2.14 -0.10 0.00 0.04 0.00 0.00 34.50 31.90 1n1s s PRO 498 CO 0.53 -0.95 1.40 -0.22 0.04 0.00 0.00 177.00 177.81 1n1s h LYS 499 N -0.47 0.59 0.00 4.56 3.64 -1.96 -3.38 116.57 119.55 1n1s h LYS 499 Ca -0.45 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 58.62 1n1s h LYS 499 Cb 1.26 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 1n1s h LYS 499 CO 0.62 0.90 0.00 0.41 -2.27 0.00 0.00 179.45 179.11 1n1s n GLY 500 N 0.15 1.06 3.37 5.01 0.00 -1.26 -4.70 105.19 108.81 1n1s n GLY 500 Ca -0.04 -0.10 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 1n1s n GLY 500 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n1s s THR 501 N 0.50 2.11 -0.04 2.61 2.01 -1.26 -1.01 115.64 120.56 1n1s s THR 501 Ca 0.00 -1.78 -0.10 0.00 0.31 0.00 0.00 61.69 60.11 1n1s s THR 501 Cb 0.00 -1.91 0.02 0.00 0.01 0.00 0.00 72.50 70.62 1n1s s THR 501 CO 0.00 -0.03 0.24 -0.55 -0.69 0.00 0.00 174.62 173.59 1n1s s SER 502 N -2.21 -0.15 0.51 3.53 0.15 -0.44 -4.98 113.70 110.11 1n1s s SER 502 Ca 0.14 0.14 -0.19 0.00 0.70 0.00 0.00 55.95 56.74 1n1s s SER 502 Cb -0.09 0.35 -0.07 0.00 -1.71 0.00 0.00 66.02 64.50 1n1s s SER 502 CO 0.06 -0.30 1.06 -2.16 1.20 0.00 0.00 173.24 173.10 1n1s s PRO 503 N -0.84 3.65 0.00 5.44 0.04 -1.26 -1.48 135.00 140.55 1n1s s PRO 503 Ca -0.09 1.37 0.00 0.00 0.04 0.00 0.00 61.00 62.32 1n1s s PRO 503 Cb -0.05 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.42 1n1s s PRO 503 CO 0.02 -0.56 0.00 -0.11 0.04 0.00 0.00 177.00 176.39 1n1s n LEU 504 N -1.20 0.51 -3.63 -3.56 7.94 -0.64 -4.16 117.00 112.26 1n1s n LEU 504 Ca 0.10 0.00 -0.13 0.00 -1.11 0.00 0.00 56.01 54.86 1n1s n LEU 504 Cb 0.52 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.40 1n1s n LEU 504 CO 0.41 -0.05 0.43 -0.22 -1.11 0.00 0.00 177.39 176.85 1n1s s LEU 505 N -5.23 -0.76 0.00 -1.96 2.96 -0.97 -0.23 118.68 112.49 1n1s s LEU 505 Ca 0.00 1.43 0.00 0.00 -0.22 0.00 0.00 54.13 55.34 1n1s s LEU 505 Cb 0.00 2.43 0.00 0.00 0.50 0.00 0.00 46.19 49.12 1n1s s LEU 505 CO 0.00 -0.24 0.00 0.61 -1.32 0.00 0.00 176.35 175.40 1n1s n GLY 506 N 2.83 -1.61 3.20 7.98 0.00 -0.76 0.09 105.19 116.92 1n1s n GLY 506 Ca -0.15 -1.09 -0.34 0.00 0.00 0.00 0.00 46.02 44.45 1n1s n GLY 506 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1s s ALA 507 N -1.90 2.59 0.34 4.61 0.00 0.09 -0.73 121.76 126.77 1n1s s ALA 507 Ca 0.00 -1.28 -0.06 0.00 0.00 0.00 0.00 51.96 50.62 1n1s s ALA 507 Cb 0.00 -1.49 -0.05 0.00 0.00 0.00 0.00 23.12 21.57 1n1s s ALA 507 CO 0.00 -0.51 0.64 0.20 0.00 0.00 0.00 175.76 176.08 1n1s s GLY 508 N 1.36 1.83 0.09 0.00 0.00 0.25 -1.00 107.32 109.85 1n1s s GLY 508 Ca 0.04 -0.46 0.06 0.00 0.00 0.00 0.00 44.72 44.36 1n1s s GLY 508 CO -0.07 -0.33 -0.06 1.08 0.00 0.00 0.00 173.10 173.72 1n1s s LEU 509 N -3.76 3.23 0.72 0.66 1.43 -0.30 -0.37 118.68 120.29 1n1s s LEU 509 Ca 0.46 -0.29 -0.13 0.00 -1.03 0.00 0.00 54.13 53.15 1n1s s LEU 509 Cb -0.10 -1.98 0.03 0.00 0.03 0.00 0.00 46.19 44.16 1n1s s LEU 509 CO 0.32 0.18 1.11 -1.61 0.23 0.00 0.00 176.35 176.57 1n1s s GLU 510 N -2.21 2.46 0.00 1.70 0.41 -0.34 -4.59 118.70 116.13 1n1s s GLU 510 Ca 0.23 1.31 0.00 0.00 -0.41 0.00 0.00 54.97 56.10 1n1s s GLU 510 Cb -0.11 -1.91 0.00 0.00 -1.78 0.00 0.00 34.13 30.32 1n1s s GLU 510 CO 0.15 -1.51 0.00 0.41 -0.49 0.00 0.00 175.26 173.83 1n1s n GLY 511 N -0.77 1.17 3.69 -1.39 0.00 -1.26 -4.95 105.19 101.67 1n1s n GLY 511 Ca 0.10 -2.14 -0.38 0.00 0.00 0.00 0.00 46.02 43.60 1n1s n GLY 511 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1n1s n PRO 512 N 0.10 1.23 0.00 1.61 -0.04 -1.26 -4.68 135.00 131.96 1n1s n PRO 512 Ca 0.00 0.47 0.00 0.00 -0.04 0.00 0.00 63.50 63.93 1n1s n PRO 512 Cb 0.00 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.06 1n1s n PRO 512 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1n1s n GLY 513 N 1.01 0.00 2.50 0.55 0.00 -1.26 -4.46 105.19 103.54 1n1s n GLY 513 Ca 0.13 -1.34 -0.12 0.00 0.00 0.00 0.00 46.02 44.69 1n1s n GLY 513 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1n1s n ASP 514 N 1.14 -0.43 -4.79 1.61 4.64 -1.26 -5.12 116.55 112.34 1n1s n ASP 514 Ca 0.00 -3.11 -0.36 0.00 -1.38 0.00 0.00 54.79 49.94 1n1s n ASP 514 Cb 0.00 0.41 -0.05 0.00 -1.04 0.00 0.00 41.12 40.44 1n1s n ASP 514 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1n1s s ALA 515 N -1.35 3.12 0.06 -1.67 0.00 -1.26 -4.98 121.76 115.68 1n1s s ALA 515 Ca 0.30 0.59 0.08 0.00 0.00 0.00 0.00 51.96 52.93 1n1s s ALA 515 Cb 0.36 -3.22 -0.03 0.00 0.00 0.00 0.00 23.12 20.23 1n1s s ALA 515 CO -0.05 -0.02 -0.21 0.15 0.00 0.00 0.00 175.76 175.62 1n1s s LYS 516 N -2.45 1.34 -0.10 0.00 1.02 -1.26 -1.15 119.74 117.13 1n1s s LYS 516 Ca 0.56 -1.01 -0.17 0.00 0.02 0.00 0.00 55.97 55.37 1n1s s LYS 516 Cb -0.19 -1.50 -0.27 0.00 -0.52 0.00 0.00 37.83 35.35 1n1s s LYS 516 CO 0.24 0.37 0.60 1.25 -0.92 0.00 0.00 175.35 176.89 1n1s h LEU 517 N 4.66 0.36 -7.00 3.17 5.85 -1.37 -3.35 115.31 117.63 1n1s h LEU 517 Ca -0.44 -0.86 -0.01 0.00 0.84 0.00 0.00 57.88 57.42 1n1s h LEU 517 Cb 1.16 -0.12 -0.22 0.00 0.37 0.00 0.00 40.66 41.86 1n1s h LEU 517 CO 0.43 1.56 0.14 -0.22 -0.34 0.00 0.00 178.44 180.01 1n1s s LEU 518 N -7.64 -0.77 0.11 2.25 2.96 -1.24 -1.06 118.68 113.29 1n1s s LEU 518 Ca -0.19 1.38 -0.25 0.00 -0.22 0.00 0.00 54.13 54.85 1n1s s LEU 518 Cb 0.04 2.35 0.08 0.00 0.50 0.00 0.00 46.19 49.16 1n1s s LEU 518 CO 0.76 -0.23 1.12 -0.83 -1.32 0.00 0.00 176.35 175.86 1n1s s GLY 519 N 0.78 -0.02 -0.04 7.98 0.00 -0.49 -0.73 107.32 114.81 1n1s s GLY 519 Ca -0.03 -0.12 -0.00 0.00 0.00 0.00 0.00 44.72 44.56 1n1s s GLY 519 CO -0.07 3.04 0.01 -2.27 0.00 0.00 0.00 173.10 173.81 1n1s s LEU 520 N -3.46 0.96 0.47 0.66 2.96 0.11 -0.23 118.68 120.16 1n1s s LEU 520 Ca 0.23 -0.03 0.03 0.00 -0.22 0.00 0.00 54.13 54.14 1n1s s LEU 520 Cb -0.01 -0.26 -0.04 0.00 0.50 0.00 0.00 46.19 46.38 1n1s s LEU 520 CO 0.03 -0.13 0.02 -0.44 -1.32 0.00 0.00 176.35 174.51 1n1s s SER 521 N 1.30 4.07 0.04 3.68 0.01 0.12 -1.62 113.70 121.30 1n1s s SER 521 Ca -0.06 -1.53 -0.01 0.00 1.31 0.00 0.00 55.95 55.67 1n1s s SER 521 Cb -0.13 0.17 -0.03 0.00 0.21 0.00 0.00 66.02 66.23 1n1s s SER 521 CO -0.02 -0.71 -0.03 -0.72 0.41 0.00 0.00 173.24 172.17 1n1s s TYR 522 N -2.81 0.46 0.37 2.43 -0.85 -0.55 -0.74 117.35 115.66 1n1s s TYR 522 Ca 0.18 -0.94 0.04 0.00 -0.52 0.00 0.00 57.07 55.82 1n1s s TYR 522 Cb 0.05 -0.34 -0.04 0.00 0.38 0.00 0.00 41.96 42.01 1n1s s TYR 522 CO 0.09 -0.34 0.11 0.16 -1.52 0.00 0.00 175.55 174.05 1n1s s ASP 523 N -2.59 2.53 0.31 -0.18 1.47 -0.78 -1.32 116.67 116.11 1n1s s ASP 523 Ca 0.02 -1.57 0.24 0.00 1.18 0.00 0.00 52.55 52.42 1n1s s ASP 523 Cb 0.04 0.32 1.12 0.00 -0.34 0.00 0.00 42.92 44.05 1n1s s ASP 523 CO -0.08 -0.83 1.74 0.07 0.68 0.00 0.00 175.17 176.75 1n1s h LYS 524 N 1.93 0.00 -0.57 2.11 2.10 -1.26 -1.55 116.57 119.33 1n1s h LYS 524 Ca -0.37 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.28 1n1s h LYS 524 Cb 1.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 1n1s h LYS 524 CO 0.61 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 178.15 1n1s n ASN 525 N -2.33 3.10 -3.43 7.07 3.02 -1.26 -4.93 115.26 116.49 1n1s n ASN 525 Ca 0.01 -2.05 -0.23 0.00 -0.03 0.00 0.00 54.58 52.28 1n1s n ASN 525 Cb 0.17 -0.39 0.07 0.00 -0.61 0.00 0.00 39.78 39.02 1n1s n ASN 525 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1n1s n ARG 526 N 1.09 -7.33 -4.28 3.52 1.74 -0.58 -4.94 116.66 105.89 1n1s n ARG 526 Ca 0.19 0.83 -0.25 0.00 -0.77 0.00 0.00 57.85 57.84 1n1s n ARG 526 Cb 0.50 -5.80 -0.08 0.00 -1.02 0.00 0.00 32.46 26.07 1n1s n ARG 526 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1n1s s GLN 527 N -6.19 2.23 0.34 5.56 -0.21 -1.26 -1.09 119.66 119.04 1n1s s GLN 527 Ca 0.53 -1.32 -0.18 0.00 0.02 0.00 0.00 55.36 54.41 1n1s s GLN 527 Cb -0.23 -2.19 -0.10 0.00 1.00 0.00 0.00 33.01 31.49 1n1s s GLN 527 CO 0.66 0.40 0.82 -1.58 -2.12 0.00 0.00 175.29 173.47 1n1s s TRP 528 N -2.01 3.41 -0.53 0.91 0.52 0.28 -1.86 118.94 119.66 1n1s s TRP 528 Ca 0.28 1.40 0.04 0.00 0.02 0.00 0.00 56.10 57.85 1n1s s TRP 528 Cb -0.08 -2.67 0.16 0.00 -1.15 0.00 0.00 33.47 29.73 1n1s s TRP 528 CO 0.18 0.07 0.37 1.03 0.02 0.00 0.00 176.95 178.62 1n1s s ARG 529 N -2.84 1.57 0.47 4.98 1.81 0.08 -0.59 118.95 124.43 1n1s s ARG 529 Ca 0.55 -2.53 -0.22 0.00 -1.72 0.00 0.00 55.73 51.81 1n1s s ARG 529 Cb -0.11 -2.38 -0.07 0.00 -0.45 0.00 0.00 34.95 31.93 1n1s s ARG 529 CO 0.17 -1.29 1.14 -1.25 -0.68 0.00 0.00 175.30 173.38 1n1s s PRO 530 N -0.41 3.72 -0.19 3.54 0.04 -1.26 -0.70 135.00 139.73 1n1s s PRO 530 Ca 0.26 1.68 -0.01 0.00 0.04 0.00 0.00 61.00 62.98 1n1s s PRO 530 Cb -0.07 -2.32 0.01 0.00 0.04 0.00 0.00 34.50 32.16 1n1s s PRO 530 CO -0.13 -0.56 -0.14 -0.51 0.04 0.00 0.00 177.00 175.69 1n1s s LEU 531 N -3.17 2.41 -0.66 -3.56 1.43 0.68 -4.47 118.68 111.34 1n1s s LEU 531 Ca 0.65 -0.55 0.05 0.00 -1.03 0.00 0.00 54.13 53.25 1n1s s LEU 531 Cb -0.26 -1.57 0.26 0.00 0.03 0.00 0.00 46.19 44.65 1n1s s LEU 531 CO 0.31 -0.00 0.80 -1.22 0.23 0.00 0.00 176.35 176.47 1n1s n TYR 532 N 4.65 3.60 -4.04 0.29 4.02 -1.26 -1.39 117.16 123.03 1n1s n TYR 532 Ca -0.20 -4.06 0.00 0.00 -0.01 0.00 0.00 57.90 53.63 1n1s n TYR 532 Cb 0.50 -0.60 0.00 0.00 -0.02 0.00 0.00 39.34 39.23 1n1s n TYR 532 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1n1s n GLY 533 N 0.82 0.18 0.19 2.72 0.00 -0.22 -3.80 105.19 105.08 1n1s n GLY 533 Ca 0.30 -0.97 0.14 0.00 0.00 0.00 0.00 46.02 45.48 1n1s n GLY 533 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1s h ALA 534 N -0.04 1.00 -2.74 4.61 0.00 -1.79 -3.45 119.26 116.85 1n1s h ALA 534 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.35 1n1s h ALA 534 Cb 0.00 0.00 0.13 0.00 0.00 0.00 0.00 17.79 17.92 1n1s h ALA 534 CO 0.00 0.00 0.49 0.00 0.00 0.00 0.00 179.25 179.74 1n1s n ALA 535 N -1.91 1.28 -1.67 0.00 0.00 -1.25 -4.91 120.51 112.04 1n1s n ALA 535 Ca 0.02 0.24 -0.46 0.00 0.00 0.00 0.00 53.44 53.25 1n1s n ALA 535 Cb 0.29 -2.27 -0.04 0.00 0.00 0.00 0.00 19.45 17.44 1n1s n ALA 535 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1n1s n PRO 536 N -0.07 2.16 -2.19 0.00 -0.04 -1.26 -4.56 135.00 129.04 1n1s n PRO 536 Ca 0.07 0.78 -0.37 0.00 -0.04 0.00 0.00 63.50 63.94 1n1s n PRO 536 Cb 0.40 -2.53 -0.03 0.00 -0.04 0.00 0.00 33.50 31.30 1n1s n PRO 536 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1n1s n ALA 537 N 3.16 3.06 -2.34 0.55 0.00 -1.26 -4.94 120.51 118.74 1n1s n ALA 537 Ca 0.16 -3.50 -0.42 0.00 0.00 0.00 0.00 53.44 49.68 1n1s n ALA 537 Cb 0.30 -3.56 -0.03 0.00 0.00 0.00 0.00 19.45 16.16 1n1s n ALA 537 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1n1s s SER 538 N 5.04 7.00 0.49 0.00 1.04 -1.26 -4.86 113.70 121.16 1n1s s SER 538 Ca 0.59 2.11 -0.22 0.00 0.48 0.00 0.00 55.95 58.91 1n1s s SER 538 Cb 0.04 -2.58 -0.07 0.00 0.10 0.00 0.00 66.02 63.51 1n1s s SER 538 CO 0.09 -0.53 1.16 -2.84 0.98 0.00 0.00 173.24 172.11 1n1s s PRO 539 N 1.07 3.57 0.00 4.02 0.02 -1.26 -4.49 135.00 137.94 1n1s s PRO 539 Ca 0.60 1.75 -0.18 0.00 0.02 0.00 0.00 61.00 63.19 1n1s s PRO 539 Cb -0.32 -2.26 0.03 0.00 0.02 0.00 0.00 34.50 31.98 1n1s s PRO 539 CO 0.29 -0.70 0.40 -0.08 -0.33 0.00 0.00 177.00 176.59 1n1s s THR 540 N -1.61 0.05 0.00 0.99 -1.32 0.24 -4.96 115.64 109.03 1n1s s THR 540 Ca 0.67 -0.41 0.00 0.00 -1.21 0.00 0.00 61.69 60.75 1n1s s THR 540 Cb -0.28 -0.81 0.00 0.00 -1.51 0.00 0.00 72.50 69.91 1n1s s THR 540 CO 0.33 -0.22 0.00 0.61 -2.21 0.00 0.00 174.62 173.12 1n1s n GLY 541 N 0.92 0.30 3.54 6.08 0.00 -1.26 -0.56 105.19 114.22 1n1s n GLY 541 Ca -0.20 -0.94 -0.12 0.00 0.00 0.00 0.00 46.02 44.76 1n1s n GLY 541 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1n1s s SER 542 N -4.00 -0.71 0.21 1.61 0.15 -1.26 -4.43 113.70 105.28 1n1s s SER 542 Ca 0.00 1.30 0.02 0.00 0.70 0.00 0.00 55.95 57.98 1n1s s SER 542 Cb 0.00 1.29 -0.05 0.00 -1.71 0.00 0.00 66.02 65.55 1n1s s SER 542 CO 0.00 -0.22 0.02 -1.66 1.20 0.00 0.00 173.24 172.57 1n1s s TRP 543 N 0.63 1.41 -0.01 3.44 1.48 -0.25 -4.95 118.94 120.68 1n1s s TRP 543 Ca -0.02 -1.01 0.07 0.00 -1.06 0.00 0.00 56.10 54.08 1n1s s TRP 543 Cb -0.05 -0.81 -0.02 0.00 -1.16 0.00 0.00 33.47 31.43 1n1s s TRP 543 CO -0.04 -0.17 -0.23 -1.21 -4.06 0.00 0.00 176.95 171.25 1n1s s GLU 544 N -3.92 2.14 0.40 3.25 2.02 -1.26 -4.84 118.70 116.49 1n1s s GLU 544 Ca 0.28 -0.92 -0.27 0.00 0.02 0.00 0.00 54.97 54.08 1n1s s GLU 544 Cb 0.06 -2.11 -0.10 0.00 0.10 0.00 0.00 34.13 32.08 1n1s s GLU 544 CO 0.08 0.56 1.46 1.28 0.02 0.00 0.00 175.26 178.66 1n1s n LEU 545 N 2.24 4.80 0.00 1.80 4.77 -1.26 -2.73 117.00 126.63 1n1s n LEU 545 Ca -0.16 1.19 0.00 0.00 -0.03 0.00 0.00 56.01 57.01 1n1s n LEU 545 Cb 0.51 -1.61 0.00 0.00 -2.33 0.00 0.00 43.42 40.00 1n1s n LEU 545 CO 0.24 0.02 0.00 1.41 -1.33 0.00 0.00 177.39 177.72 1n1s n HIS 546 N 0.22 0.00 -3.01 -1.77 8.25 0.03 -4.99 115.22 113.94 1n1s n HIS 546 Ca 0.03 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.09 1n1s n HIS 546 Cb 0.39 -0.42 -0.06 0.00 1.12 0.00 0.00 29.99 31.02 1n1s n HIS 546 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1n1s s LYS 547 N -0.21 4.52 -0.04 -0.41 2.20 -1.10 -4.90 119.74 119.80 1n1s s LYS 547 Ca 0.00 1.10 -0.30 0.00 -0.36 0.00 0.00 55.97 56.42 1n1s s LYS 547 Cb 0.00 -3.27 -0.03 0.00 -1.51 0.00 0.00 37.83 33.01 1n1s s LYS 547 CO 0.00 0.54 1.14 -1.59 -0.36 0.00 0.00 175.35 175.08 1n1s s LYS 548 N -0.99 4.40 0.03 4.03 0.00 -1.26 -4.39 119.74 121.56 1n1s s LYS 548 Ca 0.35 1.61 0.09 0.00 0.00 0.00 0.00 55.97 58.02 1n1s s LYS 548 Cb -0.22 -3.51 -0.03 0.00 0.00 0.00 0.00 37.83 34.07 1n1s s LYS 548 CO 0.25 -0.35 -0.25 0.71 0.00 0.00 0.00 175.35 175.71 1n1s s TYR 549 N 1.86 2.24 -0.21 1.78 1.51 0.34 -4.96 117.35 119.91 1n1s s TYR 549 Ca 0.55 -0.41 -0.14 0.00 -1.01 0.00 0.00 57.07 56.05 1n1s s TYR 549 Cb -0.24 -1.37 -0.04 0.00 -0.11 0.00 0.00 41.96 40.20 1n1s s TYR 549 CO 0.23 0.08 0.33 -1.58 -1.11 0.00 0.00 175.55 173.50 1n1s s HIS 550 N -0.75 3.36 -0.09 2.71 5.65 -1.26 -0.75 115.29 124.15 1n1s s HIS 550 Ca 0.11 0.50 0.04 0.00 0.25 0.00 0.00 55.06 55.95 1n1s s HIS 550 Cb -0.10 -2.45 -0.01 0.00 -1.18 0.00 0.00 32.58 28.85 1n1s s HIS 550 CO 0.01 0.02 -0.21 0.08 -0.65 0.00 0.00 174.74 173.99 1n1s s VAL 551 N 1.23 2.41 -0.05 0.89 1.01 0.36 -0.39 120.40 125.86 1n1s s VAL 551 Ca 0.16 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.24 1n1s s VAL 551 Cb -0.14 -1.94 0.02 0.00 0.00 0.00 0.00 36.38 34.32 1n1s s VAL 551 CO 0.07 0.56 -0.07 -0.69 0.00 0.00 0.00 175.10 174.96 1n1s s VAL 552 N 0.09 0.76 -0.17 2.92 1.01 -0.60 -1.11 120.40 123.30 1n1s s VAL 552 Ca -0.09 -0.25 -0.03 0.00 0.00 0.00 0.00 61.98 61.60 1n1s s VAL 552 Cb -0.15 -0.74 -0.02 0.00 0.00 0.00 0.00 36.38 35.46 1n1s s VAL 552 CO 0.06 0.27 -0.05 -0.76 0.00 0.00 0.00 175.10 174.62 1n1s s LEU 553 N 0.85 3.09 -0.03 3.92 1.43 0.75 -0.49 118.68 128.20 1n1s s LEU 553 Ca -0.12 -0.22 0.06 0.00 -1.03 0.00 0.00 54.13 52.82 1n1s s LEU 553 Cb -0.15 -1.75 -0.01 0.00 0.03 0.00 0.00 46.19 44.31 1n1s s LEU 553 CO 0.01 0.12 -0.22 0.42 0.23 0.00 0.00 176.35 176.91 1n1s s THR 554 N 0.65 1.78 -0.06 5.49 -4.23 -0.62 -0.75 115.64 117.90 1n1s s THR 554 Ca -0.03 -0.94 -0.01 0.00 -1.18 0.00 0.00 61.69 59.54 1n1s s THR 554 Cb -0.15 -1.49 0.03 0.00 1.34 0.00 0.00 72.50 72.23 1n1s s THR 554 CO 0.02 0.50 -0.01 -0.32 -0.54 0.00 0.00 174.62 174.28 1n1s s MET 555 N -0.32 0.57 0.00 3.99 0.00 -0.46 -1.12 119.30 121.96 1n1s s MET 555 Ca 0.03 0.07 -0.28 0.00 0.00 0.00 0.00 55.69 55.51 1n1s s MET 555 Cb -0.11 -0.85 0.09 0.00 0.00 0.00 0.00 34.83 33.97 1n1s s MET 555 CO 0.01 -0.23 0.76 0.00 0.00 0.00 0.00 175.02 175.56 1n1s s ALA 556 N 1.62 -1.76 -1.45 4.11 0.00 -0.79 -1.39 121.76 122.10 1n1s s ALA 556 Ca -0.01 1.06 -0.11 0.00 0.00 0.00 0.00 51.96 52.91 1n1s s ALA 556 Cb -0.13 0.22 0.07 0.00 0.00 0.00 0.00 23.12 23.28 1n1s s ALA 556 CO -0.03 -0.55 0.72 -0.25 0.00 0.00 0.00 175.76 175.65 1n1s n ASP 557 N 0.24 -4.61 -0.51 0.00 8.00 -1.26 -0.47 116.55 117.95 1n1s n ASP 557 Ca -0.14 -0.54 -0.07 0.00 0.71 0.00 0.00 54.79 54.75 1n1s n ASP 557 Cb 0.61 -3.73 -0.03 0.00 -0.02 0.00 0.00 41.12 37.95 1n1s n ASP 557 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1n1s n ARG 558 N -4.19 -1.54 -4.30 -1.24 1.74 -1.26 -4.97 116.66 100.91 1n1s n ARG 558 Ca -0.01 0.69 -0.24 0.00 -0.77 0.00 0.00 57.85 57.52 1n1s n ARG 558 Cb 0.55 -4.96 -0.08 0.00 -1.02 0.00 0.00 32.46 26.95 1n1s n ARG 558 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1n1s s GLN 559 N -2.38 2.24 0.01 5.56 -0.21 0.38 -0.23 119.66 125.04 1n1s s GLN 559 Ca 0.00 -1.39 0.00 0.00 0.02 0.00 0.00 55.36 53.99 1n1s s GLN 559 Cb 0.00 -2.15 -0.01 0.00 1.00 0.00 0.00 33.01 31.85 1n1s s GLN 559 CO 0.00 0.38 -0.02 0.20 -2.12 0.00 0.00 175.29 173.73 1n1s s GLY 560 N -3.50 0.13 0.07 3.09 0.00 -0.61 -1.89 107.32 104.61 1n1s s GLY 560 Ca 0.30 -0.28 0.03 0.00 0.00 0.00 0.00 44.72 44.77 1n1s s GLY 560 CO 0.19 -0.30 -0.09 -0.56 0.00 0.00 0.00 173.10 172.33 1n1s s SER 561 N -0.64 1.20 -0.11 1.64 0.01 -0.27 -0.59 113.70 114.94 1n1s s SER 561 Ca -0.06 -0.69 0.01 0.00 1.31 0.00 0.00 55.95 56.52 1n1s s SER 561 Cb -0.04 0.02 0.02 0.00 0.21 0.00 0.00 66.02 66.22 1n1s s SER 561 CO -0.00 -0.23 -0.14 -0.69 0.41 0.00 0.00 173.24 172.59 1n1s s VAL 562 N -1.90 1.40 -0.11 3.43 1.01 -1.26 -1.58 120.40 121.39 1n1s s VAL 562 Ca -0.02 -0.57 -0.02 0.00 0.00 0.00 0.00 61.98 61.37 1n1s s VAL 562 Cb -0.06 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.99 1n1s s VAL 562 CO 0.00 0.42 -0.04 -0.31 0.00 0.00 0.00 175.10 175.18 1n1s s TYR 563 N 1.11 3.03 -0.13 5.22 1.51 0.36 0.18 117.35 128.63 1n1s s TYR 563 Ca -0.04 -0.06 0.03 0.00 -1.01 0.00 0.00 57.07 55.98 1n1s s TYR 563 Cb -0.14 -1.83 0.00 0.00 -0.11 0.00 0.00 41.96 39.88 1n1s s TYR 563 CO -0.03 0.22 -0.22 0.08 -1.11 0.00 0.00 175.55 174.50 1n1s s VAL 564 N -0.37 2.15 -1.49 0.71 1.01 0.21 -1.56 120.40 121.06 1n1s s VAL 564 Ca 0.06 -0.96 -0.09 0.00 0.00 0.00 0.00 61.98 60.99 1n1s s VAL 564 Cb -0.12 -1.85 0.07 0.00 0.00 0.00 0.00 36.38 34.47 1n1s s VAL 564 CO 0.02 0.55 0.79 0.47 0.00 0.00 0.00 175.10 176.93 1n1s n ASP 565 N 3.88 -2.95 0.00 3.32 8.00 0.48 -1.82 116.55 127.46 1n1s n ASP 565 Ca -0.20 -0.87 0.00 0.00 0.71 0.00 0.00 54.79 54.44 1n1s n ASP 565 Cb 0.52 -3.58 0.00 0.00 -0.02 0.00 0.00 41.12 38.04 1n1s n ASP 565 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1n1s n GLY 566 N -1.67 0.75 3.25 0.44 0.00 -1.26 -5.01 105.19 101.69 1n1s n GLY 566 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 1n1s n GLY 566 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n1s s GLN 567 N -0.17 2.45 0.24 1.61 -1.52 -0.75 -4.85 119.66 116.66 1n1s s GLN 567 Ca 0.00 -0.87 -0.30 0.00 -1.95 0.00 0.00 55.36 52.24 1n1s s GLN 567 Cb 0.00 -2.08 -0.09 0.00 -0.22 0.00 0.00 33.01 30.61 1n1s s GLN 567 CO 0.00 0.37 1.35 -1.25 -0.25 0.00 0.00 175.29 175.51 1n1s s PRO 568 N -0.14 4.35 0.54 2.91 0.04 -1.26 -0.62 135.00 140.81 1n1s s PRO 568 Ca -0.03 2.16 -0.16 0.00 0.04 0.00 0.00 61.00 63.01 1n1s s PRO 568 Cb -0.13 -3.14 -0.07 0.00 0.04 0.00 0.00 34.50 31.20 1n1s s PRO 568 CO 0.03 -0.29 1.01 -0.51 0.04 0.00 0.00 177.00 177.28 1n1s s LEU 569 N -0.51 3.58 0.24 -3.56 1.43 0.13 -4.89 118.68 115.09 1n1s s LEU 569 Ca 0.56 1.63 -0.30 0.00 -1.03 0.00 0.00 54.13 54.99 1n1s s LEU 569 Cb -0.39 -4.51 -0.15 0.00 0.03 0.00 0.00 46.19 41.17 1n1s s LEU 569 CO 0.42 -0.74 1.10 0.00 0.23 0.00 0.00 176.35 177.36 1n1s n ALA 570 N -1.74 -0.36 0.00 4.21 0.00 -1.26 -1.95 120.51 119.42 1n1s n ALA 570 Ca 0.07 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.93 1n1s n ALA 570 Cb 0.54 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 17.95 1n1s n ALA 570 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n1s n GLY 571 N 1.62 0.56 3.77 0.00 0.00 -1.26 -4.95 105.19 104.93 1n1s n GLY 571 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 1n1s n GLY 571 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1n1s s SER 572 N -2.12 6.38 0.00 1.61 0.01 -0.82 -2.66 113.70 116.10 1n1s s SER 572 Ca 0.00 2.77 0.00 0.00 1.31 0.00 0.00 55.95 60.03 1n1s s SER 572 Cb 0.00 -2.65 0.00 0.00 0.21 0.00 0.00 66.02 63.58 1n1s s SER 572 CO 0.00 -0.81 0.00 0.61 0.41 0.00 0.00 173.24 173.45 1n1s n GLY 573 N 0.65 0.32 3.77 3.44 0.00 0.25 -4.97 105.19 108.65 1n1s n GLY 573 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 1n1s n GLY 573 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1n1s s ASN 574 N -2.41 5.73 0.05 1.61 0.02 -1.09 -4.59 114.94 114.27 1n1s s ASN 574 Ca 0.00 2.26 -0.31 0.00 -1.02 0.00 0.00 52.86 53.79 1n1s s ASN 574 Cb 0.00 -2.59 -0.07 0.00 0.02 0.00 0.00 41.25 38.61 1n1s s ASN 574 CO 0.00 -1.22 1.46 -0.89 0.02 0.00 0.00 177.10 176.48 1n1s s THR 575 N -1.67 3.40 -0.24 1.60 2.01 -1.26 -1.57 115.64 117.91 1n1s s THR 575 Ca 0.71 0.89 0.15 0.00 0.31 0.00 0.00 61.69 63.75 1n1s s THR 575 Cb -0.27 -3.57 -0.21 0.00 0.01 0.00 0.00 72.50 68.46 1n1s s THR 575 CO 0.30 0.02 0.42 1.33 -0.69 0.00 0.00 174.62 176.01 1n1s n VAL 576 N 4.45 0.00 -4.26 3.82 0.24 0.68 -4.81 118.33 118.45 1n1s n VAL 576 Ca 0.13 -0.28 -0.20 0.00 -2.04 0.00 0.00 64.34 61.95 1n1s n VAL 576 Cb 0.42 0.43 -0.16 0.00 -1.47 0.00 0.00 33.84 33.06 1n1s n VAL 576 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1n1s s VAL 577 N -2.83 0.64 -0.10 3.34 0.11 -1.19 -4.41 120.40 115.96 1n1s s VAL 577 Ca -0.02 -0.22 -0.05 0.00 -2.93 0.00 0.00 61.98 58.76 1n1s s VAL 577 Cb 0.10 -0.62 -0.04 0.00 -1.53 0.00 0.00 36.38 34.29 1n1s s VAL 577 CO 0.62 0.23 0.12 -0.13 -3.33 0.00 0.00 175.10 172.61 1n1s s ARG 578 N 0.63 3.34 0.00 1.54 3.00 -1.26 -4.91 118.95 121.28 1n1s s ARG 578 Ca -0.09 -0.22 0.00 0.00 0.00 0.00 0.00 55.73 55.42 1n1s s ARG 578 Cb -0.12 -3.09 0.00 0.00 0.00 0.00 0.00 34.95 31.73 1n1s s ARG 578 CO 0.01 0.75 0.00 0.41 0.00 0.00 0.00 175.30 176.46 1n1s n GLY 579 N 1.85 0.89 0.56 -3.53 0.00 -1.26 -4.74 105.19 98.96 1n1s n GLY 579 Ca -0.18 -2.07 0.12 0.00 0.00 0.00 0.00 46.02 43.89 1n1s n GLY 579 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1s n ALA 580 N 1.36 3.06 -2.57 4.61 0.00 -1.26 -4.90 120.51 120.82 1n1s n ALA 580 Ca 0.00 -0.58 -0.40 0.00 0.00 0.00 0.00 53.44 52.46 1n1s n ALA 580 Cb 0.00 -0.92 -0.04 0.00 0.00 0.00 0.00 19.45 18.49 1n1s n ALA 580 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1n1s s THR 581 N -2.30 4.86 0.37 0.00 2.01 -1.26 -5.02 115.64 114.30 1n1s s THR 581 Ca 0.25 1.65 -0.28 0.00 0.31 0.00 0.00 61.69 63.62 1n1s s THR 581 Cb 0.19 -4.13 -0.11 0.00 0.01 0.00 0.00 72.50 68.46 1n1s s THR 581 CO 0.46 0.28 1.47 -0.76 -0.69 0.00 0.00 174.62 175.39 1n1s s LEU 582 N 0.45 4.33 1.16 4.42 1.43 -1.26 -4.97 118.68 124.24 1n1s s LEU 582 Ca 0.41 3.01 -0.16 0.00 -1.03 0.00 0.00 54.13 56.36 1n1s s LEU 582 Cb -0.20 -3.67 0.26 0.00 0.03 0.00 0.00 46.19 42.62 1n1s s LEU 582 CO 0.22 -0.84 1.06 -2.16 0.23 0.00 0.00 176.35 174.86 1n1s s PRO 583 N -2.02 -0.84 -0.49 1.29 0.04 -1.26 -5.01 135.00 126.71 1n1s s PRO 583 Ca 0.53 0.34 0.03 0.00 0.04 0.00 0.00 61.00 61.94 1n1s s PRO 583 Cb -0.46 -1.60 0.15 0.00 0.04 0.00 0.00 34.50 32.63 1n1s s PRO 583 CO 0.62 -3.54 0.33 0.34 0.04 0.00 0.00 177.00 174.78 1n1s s ASP 584 N -3.36 3.31 0.09 6.66 2.15 -1.26 -4.82 116.67 119.45 1n1s s ASP 584 Ca 0.68 -3.03 -0.31 0.00 0.43 0.00 0.00 52.55 50.32 1n1s s ASP 584 Cb -0.17 -1.00 -0.08 0.00 -0.30 0.00 0.00 42.92 41.38 1n1s s ASP 584 CO 0.59 -0.20 1.47 -0.63 -0.17 0.00 0.00 175.17 176.23 1n1s s ILE 585 N -0.15 3.23 -0.02 4.11 1.01 -1.26 -1.20 121.20 126.92 1n1s s ILE 585 Ca 0.24 0.80 -0.20 0.00 0.00 0.00 0.00 60.65 61.48 1n1s s ILE 585 Cb -0.12 -3.51 -0.28 0.00 0.01 0.00 0.00 42.46 38.56 1n1s s ILE 585 CO -0.09 0.03 0.99 0.77 0.00 0.00 0.00 174.94 176.65 1n1s h SER 586 N 7.35 0.53 -4.90 3.58 4.64 -0.96 -1.05 113.55 122.72 1n1s h SER 586 Ca -0.41 -0.87 0.21 0.00 -0.47 0.00 0.00 61.79 60.25 1n1s h SER 586 Cb 1.20 -0.17 -0.14 0.00 -0.31 0.00 0.00 62.40 62.98 1n1s h SER 586 CO 0.89 1.34 0.65 -1.38 -0.87 0.00 0.00 176.83 177.46 1n1s s HIS 587 N -2.79 -0.18 -0.05 4.77 -3.43 -1.23 -1.26 115.29 111.11 1n1s s HIS 587 Ca -0.13 0.04 -0.13 0.00 -0.80 0.00 0.00 55.06 54.04 1n1s s HIS 587 Cb 0.02 0.56 -0.05 0.00 -1.43 0.00 0.00 32.58 31.68 1n1s s HIS 587 CO 0.84 -0.46 0.32 -0.06 -2.00 0.00 0.00 174.74 173.38 1n1s s PHE 588 N -2.82 3.66 0.00 0.38 0.40 -0.02 -0.59 117.98 118.99 1n1s s PHE 588 Ca 0.10 0.82 0.04 0.00 -0.60 0.00 0.00 56.93 57.28 1n1s s PHE 588 Cb 0.00 -2.20 -0.03 0.00 0.51 0.00 0.00 43.02 41.29 1n1s s PHE 588 CO -0.04 0.62 -0.09 1.52 0.70 0.00 0.00 175.22 177.93 1n1s s TYR 589 N -0.86 2.83 -0.11 0.36 -0.85 0.09 -0.74 117.35 118.07 1n1s s TYR 589 Ca 0.21 -0.07 0.00 0.00 -0.52 0.00 0.00 57.07 56.68 1n1s s TYR 589 Cb -0.15 -1.59 0.02 0.00 0.38 0.00 0.00 41.96 40.62 1n1s s TYR 589 CO 0.10 0.34 -0.09 0.42 -1.52 0.00 0.00 175.55 174.80 1n1s s ILE 590 N -0.97 1.08 0.00 -3.49 1.01 -0.51 -1.83 121.20 116.50 1n1s s ILE 590 Ca 0.16 -0.34 0.00 0.00 0.00 0.00 0.00 60.65 60.47 1n1s s ILE 590 Cb -0.11 -1.07 0.00 0.00 0.01 0.00 0.00 42.46 41.29 1n1s s ILE 590 CO 0.07 0.37 0.00 0.61 0.00 0.00 0.00 174.94 175.99 1n1s n GLY 591 N 4.73 0.30 2.56 6.18 0.00 0.68 -0.45 105.19 119.19 1n1s n GLY 591 Ca -0.15 -0.95 -0.24 0.00 0.00 0.00 0.00 46.02 44.69 1n1s n GLY 591 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n1s n GLY 592 N 0.00 4.60 3.77 -0.02 0.00 -0.62 -3.83 105.19 109.09 1n1s n GLY 592 Ca 0.00 -2.32 -0.37 0.00 0.00 0.00 0.00 46.02 43.34 1n1s n GLY 592 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1n1s s PRO 593 N -2.79 3.52 -0.21 1.61 0.04 -1.24 -3.94 135.00 132.00 1n1s s PRO 593 Ca 0.44 1.80 -0.29 0.00 0.04 0.00 0.00 61.00 62.98 1n1s s PRO 593 Cb 0.27 -2.26 0.15 0.00 0.04 0.00 0.00 34.50 32.71 1n1s s PRO 593 CO -0.10 -0.75 1.12 -0.98 0.04 0.00 0.00 177.00 176.32 1n1s s ARG 594 N -2.91 0.42 0.00 4.56 1.04 -1.26 -4.95 118.95 115.85 1n1s s ARG 594 Ca 0.68 0.12 0.01 0.00 -1.04 0.00 0.00 55.73 55.50 1n1s s ARG 594 Cb -0.29 0.20 0.02 0.00 -2.04 0.00 0.00 34.95 32.83 1n1s s ARG 594 CO 0.34 -0.13 0.63 -1.13 -0.04 0.00 0.00 175.30 174.97 1n1s n SER 595 N 0.75 1.29 -3.16 -2.89 3.41 -1.26 -4.57 113.62 107.18 1n1s n SER 595 Ca -0.07 -1.22 -0.07 0.00 -0.26 0.00 0.00 58.87 57.25 1n1s n SER 595 Cb 0.58 -0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.54 1n1s n SER 595 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1n1s s LYS 596 N -0.27 1.88 2.71 4.33 -2.85 -1.26 -5.14 119.74 119.14 1n1s s LYS 596 Ca 0.02 -1.19 0.00 0.00 -1.00 0.00 0.00 55.97 53.80 1n1s s LYS 596 Cb 0.01 0.54 0.00 0.00 -2.06 0.00 0.00 37.83 36.32 1n1s s LYS 596 CO 0.02 -0.88 0.00 0.41 0.10 0.00 0.00 175.35 175.00 1n1s n GLY 597 N -0.57 -0.58 3.71 0.59 0.00 -1.26 -4.85 105.19 102.22 1n1s n GLY 597 Ca -0.06 -1.12 -0.39 0.00 0.00 0.00 0.00 46.02 44.45 1n1s n GLY 597 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1s n ALA 598 N 3.57 1.30 -1.47 4.61 0.00 -1.26 -4.85 120.51 122.40 1n1s n ALA 598 Ca 0.00 0.16 -0.39 0.00 0.00 0.00 0.00 53.44 53.21 1n1s n ALA 598 Cb 0.00 -2.29 -0.02 0.00 0.00 0.00 0.00 19.45 17.14 1n1s n ALA 598 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1n1s n PRO 599 N -0.62 3.79 -1.64 0.00 -0.04 -1.26 -4.94 135.00 130.29 1n1s n PRO 599 Ca 0.09 -2.46 -0.44 0.00 -0.04 0.00 0.00 63.50 60.65 1n1s n PRO 599 Cb 0.43 -2.81 -0.02 0.00 -0.04 0.00 0.00 33.50 31.06 1n1s n PRO 599 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1n1s n THR 600 N 3.38 1.77 -3.18 0.52 -1.04 -1.26 -4.73 114.28 109.74 1n1s n THR 600 Ca 0.73 -0.44 -0.19 0.00 -2.04 0.00 0.00 64.05 62.11 1n1s n THR 600 Cb 0.25 -1.26 -0.06 0.00 -1.82 0.00 0.00 70.33 67.43 1n1s n THR 600 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1n1s s ASP 601 N -0.31 0.43 -0.37 8.00 -1.08 -1.26 -0.36 116.67 121.72 1n1s s ASP 601 Ca 0.60 -2.61 -0.29 0.00 -0.52 0.00 0.00 52.55 49.73 1n1s s ASP 601 Cb -0.66 0.37 0.02 0.00 -1.46 0.00 0.00 42.92 41.19 1n1s s ASP 601 CO 0.59 -0.13 1.08 -0.44 0.52 0.00 0.00 175.17 176.79 1n1s s SER 602 N 0.34 6.83 -1.07 -0.34 0.01 -1.26 -4.91 113.70 113.30 1n1s s SER 602 Ca 0.32 0.86 -0.14 0.00 1.31 0.00 0.00 55.95 58.29 1n1s s SER 602 Cb 0.03 -2.54 0.18 0.00 0.21 0.00 0.00 66.02 63.90 1n1s s SER 602 CO -0.15 -0.98 1.21 -0.13 0.41 0.00 0.00 173.24 173.61 1n1s s ARG 603 N 3.86 3.92 0.08 12.44 1.81 -1.26 -4.60 118.95 135.19 1n1s s ARG 603 Ca 0.46 -2.45 -0.01 0.00 -1.72 0.00 0.00 55.73 52.00 1n1s s ARG 603 Cb -0.11 -4.86 -0.04 0.00 -0.45 0.00 0.00 34.95 29.50 1n1s s ARG 603 CO 0.20 -1.62 0.01 0.14 -0.68 0.00 0.00 175.30 173.35 1n1s s VAL 604 N 1.21 0.18 -0.10 3.52 -7.23 -1.25 -0.32 120.40 116.41 1n1s s VAL 604 Ca 0.35 -1.83 0.02 0.00 -1.81 0.00 0.00 61.98 58.71 1n1s s VAL 604 Cb -0.05 -1.70 0.01 0.00 0.56 0.00 0.00 36.38 35.19 1n1s s VAL 604 CO -0.05 -0.80 -0.16 -0.89 -0.31 0.00 0.00 175.10 172.89 1n1s s THR 605 N -3.96 1.48 -0.06 5.32 2.01 -0.40 -1.04 115.64 119.00 1n1s s THR 605 Ca 0.13 -0.65 0.04 0.00 0.31 0.00 0.00 61.69 61.52 1n1s s THR 605 Cb 0.08 -1.34 0.00 0.00 0.01 0.00 0.00 72.50 71.25 1n1s s THR 605 CO -0.06 0.44 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.45 1n1s s VAL 606 N 0.82 1.46 0.10 3.82 1.01 -0.28 -1.23 120.40 126.10 1n1s s VAL 606 Ca -0.10 -0.71 0.04 0.00 0.00 0.00 0.00 61.98 61.21 1n1s s VAL 606 Cb -0.16 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 1n1s s VAL 606 CO 0.01 0.42 -0.10 0.42 0.00 0.00 0.00 175.10 175.85 1n1s s THR 607 N 0.24 0.97 -0.93 3.92 -4.23 0.01 -1.57 115.64 114.05 1n1s s THR 607 Ca -0.09 -1.67 -0.08 0.00 -1.18 0.00 0.00 61.69 58.67 1n1s s THR 607 Cb -0.14 -1.39 -0.01 0.00 1.34 0.00 0.00 72.50 72.30 1n1s s THR 607 CO 0.04 -0.56 0.72 0.59 -0.54 0.00 0.00 174.62 174.86 1n1s n ASN 608 N 0.52 -5.98 -4.65 3.99 5.03 -0.70 -1.43 115.26 112.03 1n1s n ASN 608 Ca -0.16 -0.71 -0.41 0.00 0.87 0.00 0.00 54.58 54.18 1n1s n ASN 608 Cb 0.58 -3.53 -0.06 0.00 -1.02 0.00 0.00 39.78 35.76 1n1s n ASN 608 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1n1s s VAL 609 N -3.19 4.97 -0.02 2.41 1.01 -0.26 -4.13 120.40 121.19 1n1s s VAL 609 Ca 0.20 1.28 0.08 0.00 0.00 0.00 0.00 61.98 63.54 1n1s s VAL 609 Cb -0.07 -3.99 -0.02 0.00 0.00 0.00 0.00 36.38 32.30 1n1s s VAL 609 CO 0.83 0.05 -0.26 -0.69 0.00 0.00 0.00 175.10 175.04 1n1s s VAL 610 N 2.22 2.02 -0.09 2.92 1.01 0.27 -0.61 120.40 128.14 1n1s s VAL 610 Ca 0.30 -1.09 0.03 0.00 0.00 0.00 0.00 61.98 61.22 1n1s s VAL 610 Cb -0.16 -1.67 0.01 0.00 0.00 0.00 0.00 36.38 34.56 1n1s s VAL 610 CO 0.10 0.57 -0.17 -0.22 0.00 0.00 0.00 175.10 175.37 1n1s s LEU 611 N -0.58 1.84 0.09 3.92 2.96 -0.35 -0.64 118.68 125.92 1n1s s LEU 611 Ca 0.09 -0.44 0.10 0.00 -0.22 0.00 0.00 54.13 53.67 1n1s s LEU 611 Cb -0.10 -1.12 -0.04 0.00 0.50 0.00 0.00 46.19 45.43 1n1s s LEU 611 CO -0.01 0.07 -0.25 -0.31 -1.32 0.00 0.00 176.35 174.54 1n1s s TYR 612 N 0.64 2.37 -0.33 5.38 1.51 -0.10 -0.30 117.35 126.51 1n1s s TYR 612 Ca -0.14 -0.36 0.04 0.00 -1.01 0.00 0.00 57.07 55.60 1n1s s TYR 612 Cb -0.16 -1.33 0.46 0.00 -0.11 0.00 0.00 41.96 40.82 1n1s s TYR 612 CO 0.04 0.27 1.57 0.27 -1.11 0.00 0.00 175.55 176.59 1n1s n ASN 613 N 1.23 3.61 -3.88 2.29 0.23 -0.30 -1.86 115.26 116.58 1n1s n ASN 613 Ca -0.17 -3.00 -0.09 0.00 -0.53 0.00 0.00 54.58 50.78 1n1s n ASN 613 Cb 0.53 -0.71 -0.04 0.00 -2.08 0.00 0.00 39.78 37.47 1n1s n ASN 613 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1n1s s ARG 614 N -2.20 1.64 -0.51 -3.83 1.70 -1.26 -4.76 118.95 109.74 1n1s s ARG 614 Ca 0.38 -1.25 -0.22 0.00 -0.47 0.00 0.00 55.73 54.17 1n1s s ARG 614 Cb 0.31 0.50 0.04 0.00 -0.57 0.00 0.00 34.95 35.23 1n1s s ARG 614 CO 0.08 -0.70 0.77 0.50 -1.08 0.00 0.00 175.30 174.87 1n1s s ARG 615 N -3.86 3.26 0.37 3.89 3.00 -1.26 -2.88 118.95 121.46 1n1s s ARG 615 Ca 0.21 -0.48 -0.27 0.00 -1.00 0.00 0.00 55.73 54.18 1n1s s ARG 615 Cb -0.02 -4.04 -0.10 0.00 0.00 0.00 0.00 34.95 30.80 1n1s s ARG 615 CO 0.10 -1.28 1.34 -0.51 0.00 0.00 0.00 175.30 174.95 1n1s s LEU 616 N 3.24 4.32 0.85 -0.88 1.43 -1.26 -5.00 118.68 121.38 1n1s s LEU 616 Ca 0.24 2.75 -0.12 0.00 -1.03 0.00 0.00 54.13 55.97 1n1s s LEU 616 Cb -0.15 -3.75 0.10 0.00 0.03 0.00 0.00 46.19 42.42 1n1s s LEU 616 CO 0.17 -0.73 1.14 0.54 0.23 0.00 0.00 176.35 177.69 1n1s s ASN 617 N -0.51 4.09 0.43 2.29 2.20 -1.26 -4.80 114.94 117.38 1n1s s ASN 617 Ca 0.53 1.01 0.10 0.00 -0.94 0.00 0.00 52.86 53.55 1n1s s ASN 617 Cb -0.41 -1.61 0.95 0.00 -2.00 0.00 0.00 41.25 38.19 1n1s s ASN 617 CO 0.54 -2.19 2.05 0.77 -2.94 0.00 0.00 177.10 175.32 1n1s h SER 618 N -1.25 0.29 -0.51 3.54 4.64 -1.99 -0.62 113.55 117.65 1n1s h SER 618 Ca -0.48 -0.02 -0.10 0.00 -0.47 0.00 0.00 61.79 60.72 1n1s h SER 618 Cb 1.31 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 63.31 1n1s h SER 618 CO 0.62 0.26 -0.07 -1.28 -0.87 0.00 0.00 176.83 175.49 1n1s h SER 619 N 0.33 0.94 -0.52 4.97 0.87 -1.99 -0.93 113.55 117.22 1n1s h SER 619 Ca 0.09 -0.34 -0.10 0.00 -1.23 0.00 0.00 61.79 60.21 1n1s h SER 619 Cb 0.05 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.74 1n1s h SER 619 CO -0.01 1.06 -0.06 -0.33 -0.53 0.00 0.00 176.83 176.96 1n1s h GLU 620 N 0.81 0.98 -0.56 2.24 5.08 -1.66 -1.16 114.58 120.31 1n1s h GLU 620 Ca 0.14 -0.33 -0.02 0.00 -1.00 0.00 0.00 59.36 58.15 1n1s h GLU 620 Cb 0.62 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 1n1s h GLU 620 CO 0.04 1.00 0.27 0.82 -1.00 0.00 0.00 179.01 180.14 1n1s h ILE 621 N 0.89 1.21 -0.60 3.13 2.04 -1.02 -1.52 117.51 121.63 1n1s h ILE 621 Ca 0.15 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.41 1n1s h ILE 621 Cb 0.60 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 1n1s h ILE 621 CO 0.04 0.24 0.35 -0.09 0.00 0.00 0.00 178.15 178.68 1n1s h ARG 622 N 0.76 0.83 -0.36 2.37 2.43 -0.92 -0.31 114.38 119.18 1n1s h ARG 622 Ca 0.19 -0.09 0.03 0.00 -0.81 0.00 0.00 59.98 59.30 1n1s h ARG 622 Cb 0.13 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 1n1s h ARG 622 CO -0.02 0.62 0.18 1.15 -1.51 0.00 0.00 179.97 180.39 1n1s h THR 623 N 0.82 0.99 -0.64 0.20 2.02 -0.93 0.29 112.91 115.66 1n1s h THR 623 Ca 0.21 -0.13 -0.02 0.00 0.77 0.00 0.00 66.41 67.24 1n1s h THR 623 Cb 0.02 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 66.97 1n1s h THR 623 CO -0.04 0.07 0.31 -0.07 0.37 0.00 0.00 175.52 176.16 1n1s h LEU 624 N 0.38 0.83 -0.25 2.58 3.38 -0.93 -1.28 115.31 120.02 1n1s h LEU 624 Ca 0.15 -0.13 0.02 0.00 0.09 0.00 0.00 57.88 58.01 1n1s h LEU 624 Cb 0.06 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1n1s h LEU 624 CO -0.10 0.73 0.12 0.15 0.09 0.00 0.00 178.44 179.42 1n1s h PHE 625 N 0.87 0.21 0.00 1.13 3.57 -0.56 -2.08 116.94 120.09 1n1s h PHE 625 Ca 0.22 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.72 1n1s h PHE 625 Cb 0.12 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 38.80 1n1s h PHE 625 CO 0.00 0.12 -0.04 -0.07 -2.23 0.00 0.00 178.31 176.09 1n1s h LEU 626 N 0.25 0.00 -3.00 0.59 3.38 -0.68 -3.16 115.31 112.69 1n1s h LEU 626 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1n1s h LEU 626 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1n1s h LEU 626 CO -0.08 0.04 0.00 -1.54 0.09 0.00 0.00 178.44 176.94 1n1s n SER 627 N -3.15 3.28 0.30 -0.43 3.41 -0.51 -4.70 113.62 111.83 1n1s n SER 627 Ca 0.00 -2.32 0.16 0.00 -0.26 0.00 0.00 58.87 56.46 1n1s n SER 627 Cb 0.32 -0.34 0.94 0.00 -0.26 0.00 0.00 64.21 64.87 1n1s n SER 627 CO 0.00 0.00 0.00 0.06 -0.16 0.00 0.00 175.04 174.94 1n1s h GLN 628 N 2.04 0.00 -0.09 4.33 3.07 -1.35 0.21 115.11 123.32 1n1s h GLN 628 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1n1s h GLN 628 Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.53 1n1s h GLN 628 CO 0.07 0.01 0.00 -0.25 0.09 0.00 0.00 178.83 178.76 1n1s n ASP 629 N -3.71 1.33 -0.00 0.06 8.00 -1.26 -3.98 116.55 116.98 1n1s n ASP 629 Ca -0.03 -1.57 0.05 0.00 0.71 0.00 0.00 54.79 53.96 1n1s n ASP 629 Cb 0.10 -0.06 -0.07 0.00 -0.02 0.00 0.00 41.12 41.07 1n1s n ASP 629 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1n1s n MET 630 N 0.07 2.06 0.01 -1.24 2.81 0.06 -4.74 117.12 116.15 1n1s n MET 630 Ca 0.17 -0.04 0.11 0.00 -1.81 0.00 0.00 57.70 56.13 1n1s n MET 630 Cb 0.29 -1.13 0.12 0.00 -0.71 0.00 0.00 33.22 31.79 1n1s n MET 630 CO 0.00 0.00 0.00 0.44 1.51 0.00 0.00 175.97 177.92 1n1s n ILE 631 N -1.53 0.07 -1.26 2.02 -5.35 -1.21 -4.99 119.36 107.12 1n1s n ILE 631 Ca 0.00 -0.08 -0.33 0.00 -0.27 0.00 0.00 62.75 62.07 1n1s n ILE 631 Cb 0.23 0.34 0.11 0.00 -1.74 0.00 0.00 39.64 38.58 1n1s n ILE 631 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1n1s s GLY 632 N -3.22 2.14 0.00 3.28 0.00 -1.26 -4.94 107.32 103.32 1n1s s GLY 632 Ca 0.08 0.76 0.28 0.00 0.00 0.00 0.00 44.72 45.84 1n1s s GLY 632 CO 0.76 1.17 1.73 -1.30 0.00 0.00 0.00 173.10 175.45 1n1s n THR 633 N -3.12 0.00 0.00 0.90 -2.24 -1.26 -5.02 114.28 103.54 1n1s n THR 633 Ca 0.13 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1n1s n THR 633 Cb 0.51 0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.88 1n1s n THR 633 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60