#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n1t n ALA 2 N 0.00 2.36 -3.72 0.00 0.00 -1.26 -1.03 120.51 116.85 1n1t n ALA 2 Ca 0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 53.44 53.28 1n1t n ALA 2 Cb 0.00 -1.31 -0.01 0.00 0.00 0.00 0.00 19.45 18.13 1n1t n ALA 2 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1n1t s SER 3 N -1.85 -0.21 -0.04 0.00 0.15 -1.25 -4.69 113.70 105.81 1n1t s SER 3 Ca 0.29 -0.36 -0.40 0.00 0.70 0.00 0.00 55.95 56.18 1n1t s SER 3 Cb 0.13 0.49 -0.20 0.00 -1.71 0.00 0.00 66.02 64.73 1n1t s SER 3 CO 0.22 -0.89 1.16 -0.11 1.20 0.00 0.00 173.24 174.82 1n1t n LEU 4 N -0.44 0.31 -4.82 3.45 7.94 -0.89 -4.61 117.00 117.94 1n1t n LEU 4 Ca -0.06 1.16 -0.33 0.00 -1.11 0.00 0.00 56.01 55.67 1n1t n LEU 4 Cb 0.61 -0.95 -0.03 0.00 0.53 0.00 0.00 43.42 43.58 1n1t n LEU 4 CO 0.13 -1.70 0.69 0.00 -1.11 0.00 0.00 177.39 175.40 1n1t s ALA 5 N 0.38 2.96 0.18 1.96 0.00 -1.26 -4.92 121.76 121.05 1n1t s ALA 5 Ca 0.92 0.35 -0.33 0.00 0.00 0.00 0.00 51.96 52.89 1n1t s ALA 5 Cb -1.26 -3.17 -0.15 0.00 0.00 0.00 0.00 23.12 18.54 1n1t s ALA 5 CO 0.58 -0.27 1.34 -2.30 0.00 0.00 0.00 175.76 175.11 1n1t n PRO 6 N -1.33 1.59 0.00 0.00 -0.02 -1.26 -1.00 135.00 132.97 1n1t n PRO 6 Ca 0.08 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1n1t n PRO 6 Cb 0.54 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 1n1t n PRO 6 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n1t n GLY 7 N 2.38 2.76 3.95 -1.23 0.00 -1.26 -4.04 105.19 107.74 1n1t n GLY 7 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 1n1t n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1n1t s SER 8 N -0.05 5.39 0.20 1.61 0.01 -0.17 -4.51 113.70 116.16 1n1t s SER 8 Ca 0.00 0.28 -0.23 0.00 1.31 0.00 0.00 55.95 57.31 1n1t s SER 8 Cb 0.00 -1.23 0.06 0.00 0.21 0.00 0.00 66.02 65.06 1n1t s SER 8 CO 0.00 -1.10 0.94 -0.94 0.41 0.00 0.00 173.24 172.55 1n1t s SER 9 N -4.37 -0.12 0.20 2.44 1.04 -1.13 -4.90 113.70 106.86 1n1t s SER 9 Ca 0.55 -0.57 -0.14 0.00 0.48 0.00 0.00 55.95 56.27 1n1t s SER 9 Cb -0.10 0.55 0.01 0.00 0.10 0.00 0.00 66.02 66.58 1n1t s SER 9 CO 0.41 -1.05 0.45 0.00 0.98 0.00 0.00 173.24 174.03 1n1t s ARG 10 N -2.98 1.37 0.11 4.02 1.70 -1.26 -0.88 118.95 121.03 1n1t s ARG 10 Ca 0.15 -1.04 0.06 0.00 -0.47 0.00 0.00 55.73 54.42 1n1t s ARG 10 Cb -0.02 0.47 -0.04 0.00 -0.57 0.00 0.00 34.95 34.79 1n1t s ARG 10 CO 0.04 -0.56 -0.14 0.14 -1.08 0.00 0.00 175.30 173.70 1n1t s VAL 11 N -3.93 1.26 -0.60 4.99 -7.23 -0.61 -4.99 120.40 109.28 1n1t s VAL 11 Ca 0.14 -1.60 -0.26 0.00 -1.81 0.00 0.00 61.98 58.46 1n1t s VAL 11 Cb 0.00 -1.40 0.04 0.00 0.56 0.00 0.00 36.38 35.58 1n1t s VAL 11 CO 0.01 -0.36 1.09 -0.70 -0.31 0.00 0.00 175.10 174.83 1n1t s GLU 12 N -2.41 3.35 -0.14 4.82 2.12 -1.26 -0.83 118.70 124.35 1n1t s GLU 12 Ca 0.06 -0.13 -0.22 0.00 0.36 0.00 0.00 54.97 55.04 1n1t s GLU 12 Cb -0.06 -4.08 -0.25 0.00 0.26 0.00 0.00 34.13 30.01 1n1t s GLU 12 CO 0.03 -1.70 0.53 1.25 -0.54 0.00 0.00 175.26 174.83 1n1t h LEU 13 N 11.70 0.15 -8.01 2.70 5.85 -1.55 -3.41 115.31 122.74 1n1t h LEU 13 Ca -0.26 -0.79 -0.72 0.00 0.84 0.00 0.00 57.88 56.95 1n1t h LEU 13 Cb 1.06 -0.05 -0.30 0.00 0.37 0.00 0.00 40.66 41.75 1n1t h LEU 13 CO 1.17 1.38 -0.46 -0.36 -0.34 0.00 0.00 178.44 179.83 1n1t s PHE 14 N -2.36 3.41 -0.31 1.25 0.08 -0.81 -5.00 117.98 114.24 1n1t s PHE 14 Ca -0.22 -1.80 -0.15 0.00 0.12 0.00 0.00 56.93 54.87 1n1t s PHE 14 Cb 0.02 -3.17 -0.02 0.00 -0.57 0.00 0.00 43.02 39.28 1n1t s PHE 14 CO 0.69 -0.92 0.37 0.15 -0.10 0.00 0.00 175.22 175.42 1n1t s LYS 15 N 1.35 3.79 0.36 0.44 1.02 -1.26 -1.47 119.74 123.97 1n1t s LYS 15 Ca 0.04 -0.18 -0.26 0.00 0.02 0.00 0.00 55.97 55.59 1n1t s LYS 15 Cb -0.24 -3.73 -0.12 0.00 -0.52 0.00 0.00 37.83 33.22 1n1t s LYS 15 CO -0.00 -0.41 1.07 2.89 -0.92 0.00 0.00 175.35 177.98 1n1t n ARG 16 N 5.38 1.53 -4.02 1.68 1.85 -1.26 -1.14 116.66 120.69 1n1t n ARG 16 Ca -0.09 0.54 -0.31 0.00 -1.00 0.00 0.00 57.85 57.00 1n1t n ARG 16 Cb 0.50 -2.04 -0.00 0.00 -1.05 0.00 0.00 32.46 29.86 1n1t n ARG 16 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1n1t n LYS 17 N 0.43 -4.04 0.08 2.89 5.02 -0.23 -4.61 118.16 117.70 1n1t n LYS 17 Ca 0.08 0.47 0.00 0.00 -2.02 0.00 0.00 58.31 56.84 1n1t n LYS 17 Cb 0.36 -5.08 0.00 0.00 -0.02 0.00 0.00 35.03 30.29 1n1t n LYS 17 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1n1t n ASN 18 N -2.83 -1.41 -4.71 4.39 2.85 -1.08 -4.99 115.26 107.49 1n1t n ASN 18 Ca -0.06 0.33 -0.42 0.00 -0.11 0.00 0.00 54.58 54.32 1n1t n ASN 18 Cb 0.57 1.59 -0.03 0.00 1.24 0.00 0.00 39.78 43.15 1n1t n ASN 18 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1n1t s SER 19 N -1.37 6.49 0.31 1.20 0.01 -0.29 -4.86 113.70 115.18 1n1t s SER 19 Ca 0.00 2.71 0.05 0.00 1.31 0.00 0.00 55.95 60.01 1n1t s SER 19 Cb 0.00 -2.58 -0.02 0.00 0.21 0.00 0.00 66.02 63.63 1n1t s SER 19 CO 0.00 -0.92 0.45 0.42 0.41 0.00 0.00 173.24 173.60 1n1t s THR 20 N 1.73 4.64 0.14 1.44 -4.23 -1.26 -3.68 115.64 114.41 1n1t s THR 20 Ca 0.74 -0.90 0.07 0.00 -1.18 0.00 0.00 61.69 60.43 1n1t s THR 20 Cb -0.46 -3.64 -0.04 0.00 1.34 0.00 0.00 72.50 69.71 1n1t s THR 20 CO 0.33 -0.28 -0.15 0.68 -0.54 0.00 0.00 174.62 174.65 1n1t s VAL 21 N -2.15 1.47 -1.21 2.29 -7.23 -0.59 -4.87 120.40 108.12 1n1t s VAL 21 Ca 0.40 -1.79 -0.19 0.00 -1.81 0.00 0.00 61.98 58.59 1n1t s VAL 21 Cb -0.09 -1.64 0.07 0.00 0.56 0.00 0.00 36.38 35.27 1n1t s VAL 21 CO 0.31 -0.40 1.64 -2.16 -0.31 0.00 0.00 175.10 174.18 1n1t s PRO 22 N -2.75 3.87 0.07 4.82 0.04 -1.26 -0.93 135.00 138.85 1n1t s PRO 22 Ca 0.11 -1.76 -0.31 0.00 0.04 0.00 0.00 61.00 59.09 1n1t s PRO 22 Cb -0.05 -5.47 -0.07 0.00 0.04 0.00 0.00 34.50 28.95 1n1t s PRO 22 CO 0.04 -2.22 1.44 0.12 0.04 0.00 0.00 177.00 176.42 1n1t s PHE 23 N 4.35 2.97 -0.32 0.56 5.36 -0.18 -4.53 117.98 126.18 1n1t s PHE 23 Ca 0.51 0.79 -0.16 0.00 -0.96 0.00 0.00 56.93 57.11 1n1t s PHE 23 Cb 0.03 -3.73 -0.02 0.00 -0.34 0.00 0.00 43.02 38.96 1n1t s PHE 23 CO 0.02 -2.69 0.40 -2.00 -1.46 0.00 0.00 175.22 169.49 1n1t s GLU 24 N 1.81 3.69 0.83 10.12 2.12 -1.26 -0.34 118.70 135.67 1n1t s GLU 24 Ca 0.66 -0.25 -0.11 0.00 0.36 0.00 0.00 54.97 55.63 1n1t s GLU 24 Cb -0.36 -3.77 0.09 0.00 0.26 0.00 0.00 34.13 30.35 1n1t s GLU 24 CO 0.29 -0.49 1.09 -1.21 -0.54 0.00 0.00 175.26 174.41 1n1t s GLU 25 N 2.11 1.82 0.46 4.30 0.41 0.88 -4.89 118.70 123.79 1n1t s GLU 25 Ca 0.14 0.97 0.16 0.00 -0.41 0.00 0.00 54.97 55.83 1n1t s GLU 25 Cb -0.16 -1.86 1.13 0.00 -1.78 0.00 0.00 34.13 31.46 1n1t s GLU 25 CO 0.12 -1.89 2.00 0.77 -0.49 0.00 0.00 175.26 175.76 1n1t h SER 26 N -1.30 0.25 -0.03 -0.19 0.02 -1.98 0.11 113.55 110.43 1n1t h SER 26 Ca -0.46 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 1n1t h SER 26 Cb 1.26 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1n1t h SER 26 CO 0.53 0.15 0.00 -0.46 -1.14 0.00 0.00 176.83 175.92 1n1t n ASN 27 N -4.46 0.43 0.00 3.07 0.23 -1.26 -4.89 115.26 108.38 1n1t n ASN 27 Ca 0.08 -1.37 0.00 0.00 -0.53 0.00 0.00 54.58 52.77 1n1t n ASN 27 Cb 0.39 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 38.07 1n1t n ASN 27 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1n1t n GLY 28 N 0.94 1.08 3.77 4.83 0.00 0.37 -5.05 105.19 111.14 1n1t n GLY 28 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1n1t n GLY 28 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1n1t s THR 29 N -2.38 3.27 -0.15 2.61 -1.32 -1.26 -4.70 115.64 111.72 1n1t s THR 29 Ca 0.00 1.00 -0.08 0.00 -1.21 0.00 0.00 61.69 61.40 1n1t s THR 29 Cb 0.00 -3.53 -0.04 0.00 -1.51 0.00 0.00 72.50 67.42 1n1t s THR 29 CO 0.00 0.03 0.12 -0.63 -2.21 0.00 0.00 174.62 171.93 1n1t s ILE 30 N -1.53 5.33 -0.04 5.08 -1.09 -1.26 -0.08 121.20 127.61 1n1t s ILE 30 Ca 0.60 0.15 0.02 0.00 -2.23 0.00 0.00 60.65 59.19 1n1t s ILE 30 Cb -0.28 -3.36 0.01 0.00 -1.58 0.00 0.00 42.46 37.26 1n1t s ILE 30 CO 0.34 0.55 -0.07 -0.60 -1.23 0.00 0.00 174.94 173.93 1n1t s ARG 31 N -0.44 1.03 -0.32 2.79 3.52 0.54 -4.96 118.95 121.10 1n1t s ARG 31 Ca 0.12 -0.22 -0.29 0.00 -0.13 0.00 0.00 55.73 55.20 1n1t s ARG 31 Cb -0.12 -0.95 -0.01 0.00 -1.56 0.00 0.00 34.95 32.31 1n1t s ARG 31 CO 0.02 0.00 1.67 -1.21 -0.81 0.00 0.00 175.30 174.96 1n1t s GLU 32 N 0.62 3.50 -0.10 5.12 0.41 -1.26 -1.01 118.70 125.98 1n1t s GLU 32 Ca -0.10 1.37 0.01 0.00 -0.41 0.00 0.00 54.97 55.84 1n1t s GLU 32 Cb -0.13 -4.12 -0.02 0.00 -1.78 0.00 0.00 34.13 28.08 1n1t s GLU 32 CO 0.01 -1.66 -0.13 0.50 -0.49 0.00 0.00 175.26 173.49 1n1t s ARG 33 N 5.27 3.08 0.47 1.61 3.52 -0.11 -4.87 118.95 127.92 1n1t s ARG 33 Ca 0.74 -0.69 -0.21 0.00 -0.13 0.00 0.00 55.73 55.44 1n1t s ARG 33 Cb -0.21 -2.54 -0.08 0.00 -1.56 0.00 0.00 34.95 30.55 1n1t s ARG 33 CO 0.33 0.36 1.05 0.08 -0.81 0.00 0.00 175.30 176.31 1n1t s VAL 34 N -0.03 3.70 -0.13 7.11 1.01 -1.26 -1.54 120.40 129.25 1n1t s VAL 34 Ca -0.03 1.11 0.01 0.00 0.00 0.00 0.00 61.98 63.07 1n1t s VAL 34 Cb -0.14 -3.48 0.02 0.00 0.00 0.00 0.00 36.38 32.78 1n1t s VAL 34 CO 0.04 -0.18 -0.17 -0.69 0.00 0.00 0.00 175.10 174.10 1n1t s VAL 35 N -1.88 1.70 0.10 2.92 1.01 -1.24 -4.89 120.40 118.12 1n1t s VAL 35 Ca 0.66 -0.74 -0.31 0.00 0.00 0.00 0.00 61.98 61.59 1n1t s VAL 35 Cb -0.18 -1.55 -0.11 0.00 0.00 0.00 0.00 36.38 34.53 1n1t s VAL 35 CO 0.22 0.48 1.60 -0.74 0.00 0.00 0.00 175.10 176.67 1n1t h HIS 36 N 7.62 -1.01 -3.88 5.22 6.17 -1.07 -0.60 115.15 127.61 1n1t h HIS 36 Ca -0.35 0.02 -0.20 0.00 0.71 0.00 0.00 60.37 60.54 1n1t h HIS 36 Cb 1.16 0.41 -0.24 0.00 2.52 0.00 0.00 27.41 31.27 1n1t h HIS 36 CO 0.47 -0.49 -0.71 -1.12 0.71 0.00 0.00 177.93 176.79 1n1t s SER 37 N -4.66 0.18 -0.16 3.26 0.01 -0.79 -3.03 113.70 108.51 1n1t s SER 37 Ca -0.16 -0.29 -0.01 0.00 1.31 0.00 0.00 55.95 56.80 1n1t s SER 37 Cb 0.07 0.05 -0.01 0.00 0.21 0.00 0.00 66.02 66.34 1n1t s SER 37 CO 0.63 -0.16 -0.12 -0.36 0.41 0.00 0.00 173.24 173.64 1n1t s PHE 38 N -0.82 2.84 0.29 2.43 0.40 -0.21 -0.56 117.98 122.35 1n1t s PHE 38 Ca -0.09 -0.91 0.02 0.00 -0.60 0.00 0.00 56.93 55.35 1n1t s PHE 38 Cb -0.06 -1.93 -0.05 0.00 0.51 0.00 0.00 43.02 41.50 1n1t s PHE 38 CO -0.01 -0.42 0.11 1.03 0.70 0.00 0.00 175.22 176.64 1n1t s ARG 39 N 0.84 1.54 -0.97 0.44 0.52 -0.71 -4.13 118.95 116.48 1n1t s ARG 39 Ca -0.04 -1.86 -0.04 0.00 -0.52 0.00 0.00 55.73 53.26 1n1t s ARG 39 Cb -0.15 -0.32 -0.05 0.00 0.52 0.00 0.00 34.95 34.95 1n1t s ARG 39 CO 0.00 -0.34 0.86 -0.89 0.02 0.00 0.00 175.30 174.95 1n1t n ILE 40 N -0.57 -9.47 -2.51 1.52 2.08 -1.26 0.08 119.36 109.23 1n1t n ILE 40 Ca -0.00 -1.06 -0.38 0.00 0.56 0.00 0.00 62.75 61.87 1n1t n ILE 40 Cb 0.66 -6.64 -0.04 0.00 -0.75 0.00 0.00 39.64 32.87 1n1t n ILE 40 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 1n1t s PRO 41 N -4.02 4.27 -0.06 0.38 0.04 -1.26 -4.08 135.00 130.27 1n1t s PRO 41 Ca 0.34 1.60 -0.03 0.00 0.04 0.00 0.00 61.00 62.95 1n1t s PRO 41 Cb -0.04 -2.71 0.03 0.00 0.04 0.00 0.00 34.50 31.81 1n1t s PRO 41 CO 0.74 -0.07 0.13 0.99 0.04 0.00 0.00 177.00 178.84 1n1t s THR 42 N -1.52 -0.03 -0.10 1.26 2.01 -0.24 -4.45 115.64 112.57 1n1t s THR 42 Ca 0.54 0.09 0.01 0.00 0.31 0.00 0.00 61.69 62.65 1n1t s THR 42 Cb -0.25 -0.21 0.02 0.00 0.01 0.00 0.00 72.50 72.07 1n1t s THR 42 CO 0.32 0.04 -0.13 -0.51 -0.69 0.00 0.00 174.62 173.64 1n1t s ILE 43 N 0.64 1.32 0.26 1.82 2.07 -1.26 0.22 121.20 126.26 1n1t s ILE 43 Ca -0.05 -0.53 0.02 0.00 -1.41 0.00 0.00 60.65 58.68 1n1t s ILE 43 Cb -0.06 -1.23 -0.05 0.00 0.13 0.00 0.00 42.46 41.25 1n1t s ILE 43 CO -0.03 0.41 0.08 0.68 -1.91 0.00 0.00 174.94 174.16 1n1t s VAL 44 N 1.05 0.68 -0.19 4.00 -7.23 -0.37 -4.62 120.40 113.71 1n1t s VAL 44 Ca -0.06 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.06 1n1t s VAL 44 Cb -0.15 -2.58 -0.02 0.00 0.56 0.00 0.00 36.38 34.19 1n1t s VAL 44 CO -0.02 -0.07 -0.02 0.21 -0.31 0.00 0.00 175.10 174.89 1n1t s ASN 45 N -3.32 4.70 -0.29 4.85 2.47 -1.26 -0.63 114.94 121.46 1n1t s ASN 45 Ca 0.36 -0.23 0.02 0.00 0.42 0.00 0.00 52.86 53.43 1n1t s ASN 45 Cb 0.08 -1.80 0.08 0.00 -1.45 0.00 0.00 41.25 38.16 1n1t s ASN 45 CO 0.13 0.07 -0.01 -0.69 -3.72 0.00 0.00 177.10 172.87 1n1t s VAL 46 N 0.96 1.92 -1.58 -5.21 1.01 0.45 -4.80 120.40 113.15 1n1t s VAL 46 Ca 0.01 -1.80 -0.13 0.00 0.00 0.00 0.00 61.98 60.07 1n1t s VAL 46 Cb -0.14 -2.26 0.10 0.00 0.00 0.00 0.00 36.38 34.07 1n1t s VAL 46 CO 0.01 -0.34 0.75 -0.67 0.00 0.00 0.00 175.10 174.86 1n1t n ASP 47 N 4.46 -2.95 0.00 3.32 2.03 -1.26 -0.53 116.55 121.63 1n1t n ASP 47 Ca -0.05 -0.94 0.00 0.00 0.52 0.00 0.00 54.79 54.32 1n1t n ASP 47 Cb 0.42 -3.17 0.00 0.00 -0.72 0.00 0.00 41.12 37.66 1n1t n ASP 47 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1n1t n GLY 48 N -1.61 1.11 3.51 0.27 0.00 -1.26 -5.03 105.19 102.17 1n1t n GLY 48 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 1n1t n GLY 48 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n1t s VAL 49 N -2.57 4.79 0.14 1.61 1.01 0.32 -4.80 120.40 120.90 1n1t s VAL 49 Ca 0.00 -0.04 -0.31 0.00 0.00 0.00 0.00 61.98 61.64 1n1t s VAL 49 Cb 0.00 -3.28 -0.08 0.00 0.00 0.00 0.00 36.38 33.02 1n1t s VAL 49 CO 0.00 0.27 1.31 -0.04 0.00 0.00 0.00 175.10 176.65 1n1t s MET 50 N 1.68 4.38 -0.13 2.72 -1.94 -0.56 -0.41 119.30 125.04 1n1t s MET 50 Ca 0.07 2.00 0.01 0.00 -1.71 0.00 0.00 55.69 56.06 1n1t s MET 50 Cb -0.16 -3.24 0.02 0.00 2.01 0.00 0.00 34.83 33.46 1n1t s MET 50 CO 0.07 -0.31 -0.13 0.08 -0.01 0.00 0.00 175.02 174.72 1n1t s VAL 51 N 0.62 1.44 -0.17 -6.03 1.01 0.20 -0.90 120.40 116.58 1n1t s VAL 51 Ca 0.60 -0.57 -0.04 0.00 0.00 0.00 0.00 61.98 61.96 1n1t s VAL 51 Cb -0.35 -1.35 -0.03 0.00 0.00 0.00 0.00 36.38 34.65 1n1t s VAL 51 CO 0.34 0.43 -0.02 0.00 0.00 0.00 0.00 175.10 175.85 1n1t s ALA 52 N 1.33 3.04 -0.01 5.51 0.00 0.82 -1.24 121.76 131.22 1n1t s ALA 52 Ca 0.00 -0.85 0.08 0.00 0.00 0.00 0.00 51.96 51.20 1n1t s ALA 52 Cb -0.14 -1.63 -0.02 0.00 0.00 0.00 0.00 23.12 21.34 1n1t s ALA 52 CO -0.07 0.14 -0.24 0.42 0.00 0.00 0.00 175.76 176.01 1n1t s ILE 53 N 0.48 2.22 0.03 0.00 1.01 0.13 -0.97 121.20 124.11 1n1t s ILE 53 Ca -0.02 -1.13 -0.21 0.00 0.00 0.00 0.00 60.65 59.29 1n1t s ILE 53 Cb -0.14 -1.81 0.05 0.00 0.01 0.00 0.00 42.46 40.57 1n1t s ILE 53 CO 0.02 0.52 0.48 0.00 0.00 0.00 0.00 174.94 175.97 1n1t s ALA 54 N -0.68 -1.21 0.05 9.38 0.00 -0.49 -1.08 121.76 127.73 1n1t s ALA 54 Ca 0.11 0.53 -0.31 0.00 0.00 0.00 0.00 51.96 52.29 1n1t s ALA 54 Cb -0.10 0.32 -0.05 0.00 0.00 0.00 0.00 23.12 23.29 1n1t s ALA 54 CO 0.00 -0.46 1.19 -0.51 0.00 0.00 0.00 175.76 175.98 1n1t s ASP 55 N -1.88 7.09 -0.49 0.00 1.11 0.11 -0.36 116.67 122.25 1n1t s ASP 55 Ca -0.06 1.99 -0.16 0.00 0.18 0.00 0.00 52.55 54.50 1n1t s ASP 55 Cb -0.01 -2.58 0.08 0.00 1.07 0.00 0.00 42.92 41.48 1n1t s ASP 55 CO -0.01 -0.47 0.43 0.00 1.18 0.00 0.00 175.17 176.31 1n1t s ALA 56 N 1.10 3.56 -0.70 5.23 0.00 0.63 -1.74 121.76 129.84 1n1t s ALA 56 Ca 0.58 -2.17 -0.17 0.00 0.00 0.00 0.00 51.96 50.21 1n1t s ALA 56 Cb -0.29 -3.13 0.15 0.00 0.00 0.00 0.00 23.12 19.85 1n1t s ALA 56 CO 0.29 -1.81 0.74 1.03 0.00 0.00 0.00 175.76 176.01 1n1t s ARG 57 N 1.71 3.28 0.25 0.00 0.52 0.28 -2.06 118.95 122.93 1n1t s ARG 57 Ca 0.05 -1.83 -0.06 0.00 -0.52 0.00 0.00 55.73 53.37 1n1t s ARG 57 Cb -0.25 -4.41 0.26 0.00 0.52 0.00 0.00 34.95 31.07 1n1t s ARG 57 CO 0.06 -1.45 1.87 1.88 0.02 0.00 0.00 175.30 177.69 1n1t h TYR 58 N 8.63 1.19 0.00 -0.53 -1.99 -1.70 -2.05 116.97 120.52 1n1t h TYR 58 Ca -0.11 -0.03 -0.15 0.00 2.00 0.00 0.00 58.73 60.44 1n1t h TYR 58 Cb 1.07 -0.38 -0.03 0.00 2.00 0.00 0.00 36.73 39.39 1n1t h TYR 58 CO 0.92 0.82 -1.60 0.39 -0.00 0.00 0.00 178.16 178.69 1n1t n GLU 59 N -4.34 2.44 -3.73 4.88 -0.58 -1.26 -1.61 120.64 116.44 1n1t n GLU 59 Ca 0.09 -0.01 -0.09 0.00 -0.42 0.00 0.00 57.16 56.73 1n1t n GLU 59 Cb 0.09 -1.23 -0.03 0.00 -0.57 0.00 0.00 31.44 29.71 1n1t n GLU 59 CO 0.00 0.00 0.00 -0.08 -0.48 0.00 0.00 177.13 176.57 1n1t s THR 60 N -2.24 0.01 -2.43 2.62 -1.32 -1.26 -4.84 115.64 106.19 1n1t s THR 60 Ca -0.04 -0.74 0.27 0.00 -1.21 0.00 0.00 61.69 59.96 1n1t s THR 60 Cb 0.03 -1.62 0.54 0.00 -1.51 0.00 0.00 72.50 69.94 1n1t s THR 60 CO 0.37 -0.07 1.72 -1.54 -2.21 0.00 0.00 174.62 172.89 1n1t n SER 61 N -0.37 1.47 -4.76 8.08 3.41 -1.26 -4.71 113.62 115.48 1n1t n SER 61 Ca -0.09 -1.53 -0.39 0.00 -0.26 0.00 0.00 58.87 56.60 1n1t n SER 61 Cb 0.62 -0.02 0.02 0.00 -0.26 0.00 0.00 64.21 64.56 1n1t n SER 61 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1n1t s PHE 62 N -1.96 2.54 0.25 7.33 5.99 -1.26 -4.91 117.98 125.96 1n1t s PHE 62 Ca 0.37 1.38 -0.05 0.00 0.00 0.00 0.00 56.93 58.63 1n1t s PHE 62 Cb 0.20 -3.74 0.28 0.00 0.00 0.00 0.00 43.02 39.77 1n1t s PHE 62 CO 0.32 -2.51 1.91 -0.44 -0.00 0.00 0.00 175.22 174.50 1n1t h ASP 63 N 2.05 1.10 -2.98 6.13 3.45 -1.99 -3.29 116.42 120.89 1n1t h ASP 63 Ca -0.50 -0.05 -0.81 0.00 0.43 0.00 0.00 57.03 56.10 1n1t h ASP 63 Cb 1.27 -0.28 -0.27 0.00 -0.56 0.00 0.00 39.33 39.49 1n1t h ASP 63 CO 0.60 0.83 0.78 0.59 -1.57 0.00 0.00 179.24 180.47 1n1t n ASN 64 N -4.37 6.20 -2.99 6.45 3.02 -1.26 -4.89 115.26 117.42 1n1t n ASN 64 Ca 0.11 -3.33 -0.16 0.00 -0.03 0.00 0.00 54.58 51.17 1n1t n ASN 64 Cb 0.05 -1.30 -0.04 0.00 -0.61 0.00 0.00 39.78 37.87 1n1t n ASN 64 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1n1t n SER 65 N 1.72 -1.11 -4.61 6.41 3.41 -1.24 -4.90 113.62 113.30 1n1t n SER 65 Ca 0.26 -2.91 -0.43 0.00 -0.26 0.00 0.00 58.87 55.53 1n1t n SER 65 Cb 0.34 2.17 -0.02 0.00 -0.26 0.00 0.00 64.21 66.44 1n1t n SER 65 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1n1t s PHE 66 N -3.09 2.58 -0.00 7.33 5.36 -1.24 -4.43 117.98 124.49 1n1t s PHE 66 Ca 0.31 0.73 0.02 0.00 -0.96 0.00 0.00 56.93 57.03 1n1t s PHE 66 Cb -0.00 -4.27 -0.01 0.00 -0.34 0.00 0.00 43.02 38.40 1n1t s PHE 66 CO 0.22 -1.70 -0.06 0.42 -1.46 0.00 0.00 175.22 172.64 1n1t s ILE 67 N 4.94 0.49 0.23 3.12 1.01 -1.06 -2.22 121.20 127.71 1n1t s ILE 67 Ca 0.56 -0.33 0.04 0.00 0.00 0.00 0.00 60.65 60.92 1n1t s ILE 67 Cb -0.12 -0.43 -0.05 0.00 0.01 0.00 0.00 42.46 41.87 1n1t s ILE 67 CO 0.30 0.09 -0.03 -1.61 0.00 0.00 0.00 174.94 173.70 1n1t s GLU 68 N -0.27 1.35 -0.36 2.79 2.02 -0.87 -2.13 118.70 121.23 1n1t s GLU 68 Ca 0.01 -1.67 -0.20 0.00 0.02 0.00 0.00 54.97 53.13 1n1t s GLU 68 Cb -0.03 -0.74 0.00 0.00 0.10 0.00 0.00 34.13 33.46 1n1t s GLU 68 CO -0.00 -0.04 0.63 0.99 0.02 0.00 0.00 175.26 176.86 1n1t s THR 69 N -3.31 4.89 0.23 3.63 2.01 -0.75 -0.27 115.64 122.07 1n1t s THR 69 Ca 0.27 0.58 -0.02 0.00 0.31 0.00 0.00 61.69 62.83 1n1t s THR 69 Cb 0.05 -4.08 -0.05 0.00 0.01 0.00 0.00 72.50 68.43 1n1t s THR 69 CO 0.08 -0.31 0.44 0.00 -0.69 0.00 0.00 174.62 174.14 1n1t s ALA 70 N 2.70 3.76 -0.01 7.40 0.00 0.51 -0.79 121.76 135.33 1n1t s ALA 70 Ca 0.24 -0.71 0.01 0.00 0.00 0.00 0.00 51.96 51.50 1n1t s ALA 70 Cb -0.14 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 20.87 1n1t s ALA 70 CO 0.15 0.39 -0.04 0.08 0.00 0.00 0.00 175.76 176.33 1n1t s VAL 71 N -1.92 0.37 -0.03 0.00 1.01 0.05 -1.39 120.40 118.48 1n1t s VAL 71 Ca 0.40 -0.17 0.07 0.00 0.00 0.00 0.00 61.98 62.28 1n1t s VAL 71 Cb -0.11 -0.34 -0.01 0.00 0.00 0.00 0.00 36.38 35.92 1n1t s VAL 71 CO 0.29 0.12 -0.23 -0.54 0.00 0.00 0.00 175.10 174.73 1n1t s LYS 72 N 0.07 2.13 0.03 2.72 1.02 -0.14 -0.67 119.74 124.90 1n1t s LYS 72 Ca -0.00 -0.84 0.02 0.00 0.02 0.00 0.00 55.97 55.16 1n1t s LYS 72 Cb -0.04 -1.93 -0.02 0.00 -0.52 0.00 0.00 37.83 35.32 1n1t s LYS 72 CO -0.00 0.44 -0.06 1.52 -0.92 0.00 0.00 175.35 176.32 1n1t s TYR 73 N -0.35 0.55 -0.01 3.18 1.13 0.27 -0.12 117.35 121.99 1n1t s TYR 73 Ca 0.03 -0.48 0.01 0.00 -1.41 0.00 0.00 57.07 55.22 1n1t s TYR 73 Cb -0.11 -0.34 0.01 0.00 -1.10 0.00 0.00 41.96 40.42 1n1t s TYR 73 CO 0.01 -0.11 -0.01 0.45 -2.51 0.00 0.00 175.55 173.38 1n1t s SER 74 N -1.46 0.26 0.00 -0.18 0.15 -0.08 -1.11 113.70 111.28 1n1t s SER 74 Ca -0.11 -0.03 0.22 0.00 0.70 0.00 0.00 55.95 56.73 1n1t s SER 74 Cb -0.10 -0.07 0.17 0.00 -1.71 0.00 0.00 66.02 64.32 1n1t s SER 74 CO 0.00 -0.01 1.19 1.33 1.20 0.00 0.00 173.24 176.95 1n1t n VAL 75 N 3.33 0.00 -2.16 4.45 0.24 -1.26 -1.49 118.33 121.45 1n1t n VAL 75 Ca -0.16 -0.50 -0.15 0.00 -2.04 0.00 0.00 64.34 61.48 1n1t n VAL 75 Cb 0.57 1.45 0.05 0.00 -1.47 0.00 0.00 33.84 34.44 1n1t n VAL 75 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1n1t n ASP 76 N 1.23 3.78 -3.38 -1.34 5.68 -1.26 -4.96 116.55 116.31 1n1t n ASP 76 Ca 0.13 -3.36 -0.24 0.00 -0.50 0.00 0.00 54.79 50.82 1n1t n ASP 76 Cb 0.55 -0.39 0.01 0.00 -1.14 0.00 0.00 41.12 40.15 1n1t n ASP 76 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1n1t n ASP 77 N -0.69 -4.49 0.00 -1.12 10.43 -1.26 -2.42 116.55 117.00 1n1t n ASP 77 Ca 0.33 -0.43 0.00 0.00 2.57 0.00 0.00 54.79 57.25 1n1t n ASP 77 Cb 0.91 -3.66 0.00 0.00 1.84 0.00 0.00 41.12 40.21 1n1t n ASP 77 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1n1t n GLY 78 N -1.35 0.55 0.19 0.44 0.00 -1.26 -4.95 105.19 98.80 1n1t n GLY 78 Ca -0.03 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.91 1n1t n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1t h ALA 79 N 0.00 0.53 -2.62 4.61 0.00 -1.90 -3.44 119.26 116.43 1n1t h ALA 79 Ca 0.00 -0.08 -0.24 0.00 0.00 0.00 0.00 54.91 54.60 1n1t h ALA 79 Cb 0.00 -0.16 -0.18 0.00 0.00 0.00 0.00 17.79 17.45 1n1t h ALA 79 CO 0.00 0.04 -0.71 0.95 0.00 0.00 0.00 179.25 179.53 1n1t s THR 80 N -5.89 0.59 0.03 0.00 -4.23 -1.26 -5.11 115.64 99.76 1n1t s THR 80 Ca -0.13 -1.56 0.01 0.00 -1.18 0.00 0.00 61.69 58.82 1n1t s THR 80 Cb 0.11 -1.21 -0.02 0.00 1.34 0.00 0.00 72.50 72.72 1n1t s THR 80 CO 0.74 -0.68 -0.04 0.26 -0.54 0.00 0.00 174.62 174.36 1n1t s TRP 81 N -2.70 0.37 0.07 3.99 0.52 -1.26 -4.42 118.94 115.52 1n1t s TRP 81 Ca 0.02 -0.50 0.05 0.00 0.02 0.00 0.00 56.10 55.69 1n1t s TRP 81 Cb -0.01 -0.25 -0.04 0.00 -1.15 0.00 0.00 33.47 32.02 1n1t s TRP 81 CO -0.03 -0.15 -0.03 -0.80 0.02 0.00 0.00 176.95 175.96 1n1t s ASN 82 N -1.43 4.86 -0.03 2.95 0.01 -0.27 -4.91 114.94 116.12 1n1t s ASN 82 Ca -0.13 -0.20 0.06 0.00 -0.71 0.00 0.00 52.86 51.88 1n1t s ASN 82 Cb -0.10 -1.12 -0.01 0.00 0.41 0.00 0.00 41.25 40.43 1n1t s ASN 82 CO -0.01 0.20 -0.23 -0.89 -1.51 0.00 0.00 177.10 174.67 1n1t s THR 83 N -1.23 1.81 0.10 1.60 2.01 -1.26 -0.57 115.64 118.10 1n1t s THR 83 Ca 0.23 -0.96 -0.03 0.00 0.31 0.00 0.00 61.69 61.24 1n1t s THR 83 Cb -0.11 -1.52 -0.03 0.00 0.01 0.00 0.00 72.50 70.85 1n1t s THR 83 CO 0.15 0.51 0.07 -1.10 -0.69 0.00 0.00 174.62 173.56 1n1t s GLN 84 N -0.36 0.82 -0.42 4.92 -0.21 0.15 -4.79 119.66 119.78 1n1t s GLN 84 Ca 0.04 -1.26 -0.12 0.00 0.02 0.00 0.00 55.36 54.04 1n1t s GLN 84 Cb -0.10 0.26 0.05 0.00 1.00 0.00 0.00 33.01 34.22 1n1t s GLN 84 CO 0.01 -0.23 0.29 0.42 -2.12 0.00 0.00 175.29 173.66 1n1t s ILE 85 N -3.96 4.79 0.09 1.08 -1.09 -1.26 -0.77 121.20 120.07 1n1t s ILE 85 Ca 0.14 -1.03 -0.14 0.00 -2.23 0.00 0.00 60.65 57.40 1n1t s ILE 85 Cb 0.07 -3.79 -0.16 0.00 -1.58 0.00 0.00 42.46 36.99 1n1t s ILE 85 CO -0.05 -0.42 1.29 0.00 -1.23 0.00 0.00 174.94 174.53 1n1t h ALA 86 N 8.55 0.28 -3.29 9.38 0.00 -1.27 -3.44 119.26 129.47 1n1t h ALA 86 Ca -0.26 -0.59 -0.48 0.00 0.00 0.00 0.00 54.91 53.58 1n1t h ALA 86 Cb 1.10 -0.01 -0.36 0.00 0.00 0.00 0.00 17.79 18.52 1n1t h ALA 86 CO 0.76 0.64 -0.79 0.42 0.00 0.00 0.00 179.25 180.28 1n1t s ILE 87 N -3.72 0.77 0.38 0.00 1.01 -1.12 -4.92 121.20 113.60 1n1t s ILE 87 Ca -0.11 -0.17 -0.12 0.00 0.00 0.00 0.00 60.65 60.26 1n1t s ILE 87 Cb 0.08 -0.81 -0.07 0.00 0.01 0.00 0.00 42.46 41.67 1n1t s ILE 87 CO 0.90 0.31 0.76 -0.54 0.00 0.00 0.00 174.94 176.36 1n1t s LYS 88 N 1.48 3.83 0.85 2.79 1.02 -1.26 -1.81 119.74 126.64 1n1t s LYS 88 Ca -0.01 0.51 -0.10 0.00 0.02 0.00 0.00 55.97 56.39 1n1t s LYS 88 Cb -0.13 -2.40 0.15 0.00 -0.52 0.00 0.00 37.83 34.93 1n1t s LYS 88 CO -0.04 0.01 1.18 0.54 -0.92 0.00 0.00 175.35 176.13 1n1t s ASN 89 N -2.94 3.76 0.18 2.83 6.03 -1.26 -4.83 114.94 118.71 1n1t s ASN 89 Ca 0.52 0.16 0.23 0.00 -1.03 0.00 0.00 52.86 52.74 1n1t s ASN 89 Cb -0.10 -0.40 0.90 0.00 -3.03 0.00 0.00 41.25 38.62 1n1t s ASN 89 CO 0.28 -2.29 1.71 -1.54 -2.03 0.00 0.00 177.10 173.23 1n1t n SER 90 N -3.38 0.55 -2.12 3.54 3.41 -1.26 -4.89 113.62 109.47 1n1t n SER 90 Ca 0.14 0.60 -0.19 0.00 -0.26 0.00 0.00 58.87 59.16 1n1t n SER 90 Cb 0.60 -0.73 -0.03 0.00 -0.26 0.00 0.00 64.21 63.79 1n1t n SER 90 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1n1t n ARG 91 N -2.06 -1.67 0.10 4.33 5.12 -1.26 -4.87 116.66 116.35 1n1t n ARG 91 Ca 0.04 1.00 -0.05 0.00 -1.93 0.00 0.00 57.85 56.90 1n1t n ARG 91 Cb 0.29 -5.55 0.07 0.00 -1.16 0.00 0.00 32.46 26.10 1n1t n ARG 91 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1n1t h ALA 92 N 0.72 0.72 -3.41 7.54 0.00 -1.90 -3.48 119.26 119.45 1n1t h ALA 92 Ca -0.43 -0.65 -0.13 0.00 0.00 0.00 0.00 54.91 53.70 1n1t h ALA 92 Cb 1.31 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1n1t h ALA 92 CO 0.55 0.85 0.10 -1.13 0.00 0.00 0.00 179.25 179.63 1n1t n SER 93 N -3.73 -1.90 0.03 0.00 3.41 -1.24 -5.00 113.62 105.19 1n1t n SER 93 Ca -0.02 -2.70 0.07 0.00 -0.26 0.00 0.00 58.87 55.95 1n1t n SER 93 Cb 0.71 3.28 0.29 0.00 -0.26 0.00 0.00 64.21 68.23 1n1t n SER 93 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1n1t n SER 94 N -1.56 0.16 -0.06 4.04 3.41 -1.26 -2.34 113.62 116.00 1n1t n SER 94 Ca -0.05 0.55 0.07 0.00 -0.26 0.00 0.00 58.87 59.18 1n1t n SER 94 Cb 0.59 -0.58 0.10 0.00 -0.26 0.00 0.00 64.21 64.06 1n1t n SER 94 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1n1t n VAL 95 N -1.68 1.60 -1.77 -3.33 0.24 -1.26 -3.69 118.33 108.43 1n1t n VAL 95 Ca 0.02 -1.87 -0.40 0.00 -2.04 0.00 0.00 64.34 60.06 1n1t n VAL 95 Cb 0.13 -0.02 0.02 0.00 -1.47 0.00 0.00 33.84 32.50 1n1t n VAL 95 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1n1t s SER 96 N -2.33 5.80 -0.21 -1.34 0.01 -0.99 -4.27 113.70 110.37 1n1t s SER 96 Ca 0.23 2.94 -0.25 0.00 1.31 0.00 0.00 55.95 60.17 1n1t s SER 96 Cb 0.20 -2.65 0.07 0.00 0.21 0.00 0.00 66.02 63.84 1n1t s SER 96 CO 0.02 -1.23 0.68 0.00 0.41 0.00 0.00 173.24 173.12 1n1t s ARG 97 N -2.50 0.85 -0.12 12.44 1.70 -0.61 -2.57 118.95 128.15 1n1t s ARG 97 Ca 0.62 0.81 0.01 0.00 -0.47 0.00 0.00 55.73 56.69 1n1t s ARG 97 Cb -0.44 0.41 -0.01 0.00 -0.57 0.00 0.00 34.95 34.34 1n1t s ARG 97 CO 0.56 -0.14 -0.15 0.14 -1.08 0.00 0.00 175.30 174.63 1n1t s VAL 98 N 0.04 2.90 0.22 4.99 -7.23 -0.90 -0.83 120.40 119.58 1n1t s VAL 98 Ca -0.02 -0.72 -0.12 0.00 -1.81 0.00 0.00 61.98 59.30 1n1t s VAL 98 Cb -0.04 -2.19 -0.00 0.00 0.56 0.00 0.00 36.38 34.70 1n1t s VAL 98 CO 0.03 0.53 0.42 0.00 -0.31 0.00 0.00 175.10 175.77 1n1t s MET 99 N 0.26 1.43 -1.06 4.82 0.00 -0.10 -4.23 119.30 120.42 1n1t s MET 99 Ca -0.10 -1.22 -0.02 0.00 0.00 0.00 0.00 55.69 54.35 1n1t s MET 99 Cb -0.16 0.44 -0.02 0.00 0.00 0.00 0.00 34.83 35.09 1n1t s MET 99 CO 0.06 -0.58 0.90 -0.25 0.00 0.00 0.00 175.02 175.15 1n1t n ASP 100 N -0.34 -3.62 -4.75 -1.18 9.92 -1.26 -1.47 116.55 113.85 1n1t n ASP 100 Ca -0.03 -0.61 -0.42 0.00 -0.53 0.00 0.00 54.79 53.20 1n1t n ASP 100 Cb 0.62 -4.83 -0.02 0.00 -0.64 0.00 0.00 41.12 36.26 1n1t n ASP 100 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1n1t s ALA 101 N -3.34 3.76 -0.07 2.24 0.00 -1.26 -4.47 121.76 118.62 1n1t s ALA 101 Ca 0.16 1.56 0.05 0.00 0.00 0.00 0.00 51.96 53.73 1n1t s ALA 101 Cb -0.02 -3.65 -0.00 0.00 0.00 0.00 0.00 23.12 19.45 1n1t s ALA 101 CO 0.68 -0.97 -0.22 0.99 0.00 0.00 0.00 175.76 176.24 1n1t s THR 102 N 0.11 1.84 -0.03 0.00 2.01 -0.52 -1.39 115.64 117.65 1n1t s THR 102 Ca 0.64 -0.93 0.05 0.00 0.31 0.00 0.00 61.69 61.76 1n1t s THR 102 Cb -0.48 -1.58 -0.01 0.00 0.01 0.00 0.00 72.50 70.45 1n1t s THR 102 CO 0.46 0.52 -0.16 -0.69 -0.69 0.00 0.00 174.62 174.05 1n1t s VAL 103 N 0.09 1.34 -0.05 3.82 1.01 0.35 -1.10 120.40 125.86 1n1t s VAL 103 Ca -0.09 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.24 1n1t s VAL 103 Cb -0.15 -1.14 0.00 0.00 0.00 0.00 0.00 36.38 35.09 1n1t s VAL 103 CO 0.05 0.39 -0.17 -0.63 0.00 0.00 0.00 175.10 174.73 1n1t s ILE 104 N -0.14 1.46 -0.19 2.22 1.01 -0.25 -0.19 121.20 125.12 1n1t s ILE 104 Ca 0.01 -0.71 -0.07 0.00 0.00 0.00 0.00 60.65 59.87 1n1t s ILE 104 Cb -0.09 -1.26 -0.04 0.00 0.01 0.00 0.00 42.46 41.07 1n1t s ILE 104 CO 0.01 0.42 0.06 -0.69 0.00 0.00 0.00 174.94 174.74 1n1t s VAL 105 N 0.19 4.70 -0.13 2.92 1.01 -1.26 -0.29 120.40 127.54 1n1t s VAL 105 Ca -0.08 -0.06 -0.04 0.00 0.00 0.00 0.00 61.98 61.80 1n1t s VAL 105 Cb -0.13 -3.12 0.05 0.00 0.00 0.00 0.00 36.38 33.18 1n1t s VAL 105 CO 0.03 0.45 0.10 -0.75 0.00 0.00 0.00 175.10 174.93 1n1t s LYS 106 N 0.47 0.03 7.50 2.72 2.20 -0.48 -4.63 119.74 127.55 1n1t s LYS 106 Ca 0.03 0.12 0.00 0.00 -0.36 0.00 0.00 55.97 55.76 1n1t s LYS 106 Cb -0.13 -1.28 0.00 0.00 -1.51 0.00 0.00 37.83 34.91 1n1t s LYS 106 CO 0.01 -0.54 0.00 0.41 -0.36 0.00 0.00 175.35 174.86 1n1t n GLY 107 N 5.29 2.79 1.76 5.54 0.00 -1.26 -1.88 105.19 117.43 1n1t n GLY 107 Ca -0.06 -0.25 0.08 0.00 0.00 0.00 0.00 46.02 45.80 1n1t n GLY 107 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1n1t n ASN 108 N 5.64 5.36 -4.70 1.61 6.94 -1.26 -4.29 115.26 124.57 1n1t n ASN 108 Ca 0.00 -2.76 -0.33 0.00 -0.02 0.00 0.00 54.58 51.47 1n1t n ASN 108 Cb 0.00 -0.65 -0.09 0.00 -2.36 0.00 0.00 39.78 36.69 1n1t n ASN 108 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1n1t s LYS 109 N -2.43 2.87 -0.13 -3.83 -0.14 -0.79 -0.52 119.74 114.78 1n1t s LYS 109 Ca 0.53 -0.55 0.01 0.00 -1.36 0.00 0.00 55.97 54.61 1n1t s LYS 109 Cb 0.38 -2.73 -0.01 0.00 -1.68 0.00 0.00 37.83 33.80 1n1t s LYS 109 CO 0.19 0.64 -0.17 -0.51 -0.76 0.00 0.00 175.35 174.75 1n1t s LEU 110 N -1.45 2.49 -0.29 3.17 1.43 -0.04 -1.38 118.68 122.62 1n1t s LEU 110 Ca 0.19 -0.42 -0.07 0.00 -1.03 0.00 0.00 54.13 52.80 1n1t s LEU 110 Cb -0.12 -1.55 0.01 0.00 0.03 0.00 0.00 46.19 44.57 1n1t s LEU 110 CO 0.09 0.15 0.07 -0.31 0.23 0.00 0.00 176.35 176.58 1n1t s TYR 111 N 0.44 3.14 -0.14 0.29 2.02 0.61 -0.23 117.35 123.48 1n1t s TYR 111 Ca -0.12 -0.95 -0.00 0.00 -0.37 0.00 0.00 57.07 55.63 1n1t s TYR 111 Cb -0.16 -2.25 -0.01 0.00 -0.40 0.00 0.00 41.96 39.14 1n1t s TYR 111 CO 0.05 -0.56 -0.13 0.42 -1.57 0.00 0.00 175.55 173.76 1n1t s ILE 112 N 1.50 2.92 -0.18 2.71 1.01 0.29 -1.09 121.20 128.37 1n1t s ILE 112 Ca 0.03 -0.69 -0.04 0.00 0.00 0.00 0.00 60.65 59.95 1n1t s ILE 112 Cb -0.17 -2.24 -0.02 0.00 0.01 0.00 0.00 42.46 40.04 1n1t s ILE 112 CO 0.02 0.51 -0.03 -0.22 0.00 0.00 0.00 174.94 175.22 1n1t s LEU 113 N 0.60 3.15 0.13 2.97 2.96 -0.26 -0.38 118.68 127.85 1n1t s LEU 113 Ca -0.08 -0.21 0.04 0.00 -0.22 0.00 0.00 54.13 53.67 1n1t s LEU 113 Cb -0.16 -1.77 -0.04 0.00 0.50 0.00 0.00 46.19 44.72 1n1t s LEU 113 CO 0.03 0.11 -0.11 0.68 -1.32 0.00 0.00 176.35 175.74 1n1t s VAL 114 N 0.71 1.12 -0.15 1.68 -7.23 -0.10 -1.44 120.40 114.99 1n1t s VAL 114 Ca -0.02 -1.89 -0.20 0.00 -1.81 0.00 0.00 61.98 58.05 1n1t s VAL 114 Cb -0.14 -1.67 -0.03 0.00 0.56 0.00 0.00 36.38 35.10 1n1t s VAL 114 CO 0.02 -0.65 0.59 -0.83 -0.31 0.00 0.00 175.10 173.93 1n1t s GLY 115 N -2.86 2.26 -0.14 2.32 0.00 -0.54 -0.82 107.32 107.53 1n1t s GLY 115 Ca 0.12 -0.18 -0.02 0.00 0.00 0.00 0.00 44.72 44.64 1n1t s GLY 115 CO 0.01 1.12 -0.09 -0.45 0.00 0.00 0.00 173.10 173.69 1n1t s SER 116 N 0.97 4.36 0.05 1.64 0.15 0.52 -0.92 113.70 120.46 1n1t s SER 116 Ca 0.29 -0.24 0.05 0.00 0.70 0.00 0.00 55.95 56.76 1n1t s SER 116 Cb -0.16 -1.69 -0.02 0.00 -1.71 0.00 0.00 66.02 62.44 1n1t s SER 116 CO 0.12 0.17 -0.15 -0.36 1.20 0.00 0.00 173.24 174.22 1n1t s PHE 117 N 0.35 1.26 -0.26 3.44 0.40 -0.01 -1.09 117.98 122.07 1n1t s PHE 117 Ca -0.08 -0.38 -0.14 0.00 -0.60 0.00 0.00 56.93 55.73 1n1t s PHE 117 Cb -0.15 -0.74 -0.14 0.00 0.51 0.00 0.00 43.02 42.50 1n1t s PHE 117 CO 0.05 0.05 -0.23 0.09 0.70 0.00 0.00 175.22 175.87 1n1t n ASN 118 N 1.73 1.95 0.00 1.36 3.02 -0.94 -1.57 115.26 120.80 1n1t n ASN 118 Ca -0.19 0.31 0.00 0.00 -0.03 0.00 0.00 54.58 54.67 1n1t n ASN 118 Cb 0.54 -0.81 0.00 0.00 -0.61 0.00 0.00 39.78 38.91 1n1t n ASN 118 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1n1t n LYS 119 N -4.17 0.00 -2.24 3.52 2.85 -1.26 -3.43 118.16 113.42 1n1t n LYS 119 Ca -0.50 0.00 -0.38 0.00 -1.05 0.00 0.00 58.31 56.38 1n1t n LYS 119 Cb 0.87 -0.33 -0.01 0.00 -0.65 0.00 0.00 35.03 34.90 1n1t n LYS 119 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1n1t s THR 120 N 0.00 3.04 -1.37 0.58 -4.23 -1.26 -4.93 115.64 107.47 1n1t s THR 120 Ca 0.00 0.87 0.16 0.00 -1.18 0.00 0.00 61.69 61.54 1n1t s THR 120 Cb 0.00 -3.48 -0.03 0.00 1.34 0.00 0.00 72.50 70.33 1n1t s THR 120 CO 0.00 0.07 0.83 0.54 -0.54 0.00 0.00 174.62 175.52 1n1t n ARG 121 N -0.01 1.71 -3.64 3.99 1.74 -1.26 -4.88 116.66 114.30 1n1t n ARG 121 Ca 0.05 -0.69 -0.21 0.00 -0.77 0.00 0.00 57.85 56.22 1n1t n ARG 121 Cb 0.46 -1.27 -0.04 0.00 -1.02 0.00 0.00 32.46 30.60 1n1t n ARG 121 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1n1t s ASN 122 N -1.98 5.01 0.36 0.55 4.22 -1.26 -4.84 114.94 117.00 1n1t s ASN 122 Ca 0.12 -0.75 -0.26 0.00 -2.14 0.00 0.00 52.86 49.83 1n1t s ASN 122 Cb 0.13 -0.60 -0.09 0.00 1.28 0.00 0.00 41.25 41.96 1n1t s ASN 122 CO 0.44 -0.61 1.14 -0.55 -2.04 0.00 0.00 177.10 175.48 1n1t s SER 123 N -4.09 6.79 0.29 3.54 0.15 -1.26 -4.91 113.70 114.21 1n1t s SER 123 Ca 0.47 2.30 0.04 0.00 0.70 0.00 0.00 55.95 59.46 1n1t s SER 123 Cb -0.03 -2.62 0.68 0.00 -1.71 0.00 0.00 66.02 62.35 1n1t s SER 123 CO 0.27 -0.48 1.77 4.11 1.20 0.00 0.00 173.24 180.11 1n1t h TRP 124 N 3.00 0.99 0.00 3.44 5.08 -1.99 0.36 115.95 126.82 1n1t h TRP 124 Ca -0.48 0.03 0.00 0.00 1.08 0.00 0.00 58.89 59.52 1n1t h TRP 124 Cb 1.22 -0.29 0.00 0.00 -3.00 0.00 0.00 29.16 27.09 1n1t h TRP 124 CO 0.57 0.22 0.00 1.79 -1.28 0.00 0.00 178.44 179.74 1n1t h THR 125 N 0.73 0.00 -0.28 0.12 1.35 -1.92 -2.80 112.91 110.11 1n1t h THR 125 Ca 0.55 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 66.17 1n1t h THR 125 Cb 0.83 0.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.23 1n1t h THR 125 CO -0.38 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 174.89 1n1t n GLN 126 N -2.40 2.12 -1.53 4.72 3.00 0.11 -4.04 117.38 119.37 1n1t n GLN 126 Ca 0.01 -1.96 -0.35 0.00 -0.01 0.00 0.00 57.00 54.69 1n1t n GLN 126 Cb 0.21 -1.38 0.08 0.00 0.00 0.00 0.00 30.24 29.15 1n1t n GLN 126 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.06 176.05 1n1t s HIS 127 N -1.24 2.09 0.24 1.08 3.76 -1.06 -4.93 115.29 115.24 1n1t s HIS 127 Ca 0.29 1.58 -0.02 0.00 -0.15 0.00 0.00 55.06 56.75 1n1t s HIS 127 Cb 0.17 -3.50 0.29 0.00 1.11 0.00 0.00 32.58 30.65 1n1t s HIS 127 CO 0.24 -2.61 1.71 0.07 -0.85 0.00 0.00 174.74 173.30 1n1t h ARG 128 N -0.07 0.76 0.00 1.40 -0.00 -1.93 -3.47 114.38 111.07 1n1t h ARG 128 Ca -0.48 -0.24 0.00 0.00 -0.00 0.00 0.00 59.98 59.25 1n1t h ARG 128 Cb 1.30 -0.07 0.00 0.00 -0.00 0.00 0.00 29.97 31.20 1n1t h ARG 128 CO 0.51 0.84 0.00 -0.40 -0.00 0.00 0.00 179.97 180.91 1n1t n ASP 129 N -4.17 0.00 -1.73 0.08 5.68 -1.26 -5.05 116.55 110.09 1n1t n ASP 129 Ca 0.01 -0.96 0.06 0.00 -0.50 0.00 0.00 54.79 53.40 1n1t n ASP 129 Cb 0.35 0.00 0.36 0.00 -1.14 0.00 0.00 41.12 40.70 1n1t n ASP 129 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1n1t n GLY 130 N 0.00 2.81 0.27 6.12 0.00 -1.26 -4.62 105.19 108.52 1n1t n GLY 130 Ca 0.00 -0.82 0.16 0.00 0.00 0.00 0.00 46.02 45.36 1n1t n GLY 130 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1n1t h SER 131 N 3.56 0.00 0.10 1.61 4.64 -1.97 -2.07 113.55 119.42 1n1t h SER 131 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1n1t h SER 131 Cb 1.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.89 1n1t h SER 131 CO 0.43 0.06 -0.12 -0.67 -0.87 0.00 0.00 176.83 175.67 1n1t n ASP 132 N -3.25 1.32 -4.39 4.97 2.03 -1.26 -4.95 116.55 111.02 1n1t n ASP 132 Ca -0.00 -1.24 -0.30 0.00 0.52 0.00 0.00 54.79 53.76 1n1t n ASP 132 Cb 0.28 0.06 -0.14 0.00 -0.72 0.00 0.00 41.12 40.61 1n1t n ASP 132 CO 0.00 0.00 0.00 0.86 -1.92 0.00 0.00 177.20 176.14 1n1t s TRP 133 N -2.22 2.39 -0.00 -0.67 -0.00 -0.78 -2.22 118.94 115.44 1n1t s TRP 133 Ca 0.32 -0.36 -0.01 0.00 -0.00 0.00 0.00 56.10 56.05 1n1t s TRP 133 Cb 0.20 -1.38 -0.00 0.00 -0.00 0.00 0.00 33.47 32.29 1n1t s TRP 133 CO 0.42 0.22 0.01 -1.21 -0.00 0.00 0.00 176.95 176.38 1n1t s GLU 134 N -1.51 0.07 -0.25 5.86 2.02 -0.25 -4.99 118.70 119.66 1n1t s GLU 134 Ca 0.13 -0.07 -0.19 0.00 0.02 0.00 0.00 54.97 54.86 1n1t s GLU 134 Cb -0.10 0.03 -0.02 0.00 0.10 0.00 0.00 34.13 34.13 1n1t s GLU 134 CO 0.04 -0.01 0.56 -1.25 0.02 0.00 0.00 175.26 174.62 1n1t s PRO 135 N -0.22 4.11 -0.14 0.39 0.04 -1.26 -0.36 135.00 137.56 1n1t s PRO 135 Ca -0.02 0.43 -0.02 0.00 0.04 0.00 0.00 61.00 61.43 1n1t s PRO 135 Cb -0.02 -3.64 -0.02 0.00 0.04 0.00 0.00 34.50 30.87 1n1t s PRO 135 CO -0.00 -0.34 -0.09 -0.51 0.04 0.00 0.00 177.00 176.10 1n1t s LEU 136 N 2.27 2.96 -0.15 -3.56 1.43 -0.00 -0.45 118.68 121.18 1n1t s LEU 136 Ca 0.24 -0.24 -0.05 0.00 -1.03 0.00 0.00 54.13 53.05 1n1t s LEU 136 Cb -0.16 -1.69 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 1n1t s LEU 136 CO 0.09 0.17 0.00 -0.22 0.23 0.00 0.00 176.35 176.62 1n1t s LEU 137 N 0.36 3.50 -0.03 1.79 2.96 0.02 -0.93 118.68 126.35 1n1t s LEU 137 Ca -0.08 -0.01 0.03 0.00 -0.22 0.00 0.00 54.13 53.85 1n1t s LEU 137 Cb -0.15 -1.85 0.00 0.00 0.50 0.00 0.00 46.19 44.69 1n1t s LEU 137 CO 0.04 0.21 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.48 1n1t s VAL 138 N 0.14 0.99 -0.17 1.68 1.01 0.49 -1.29 120.40 123.26 1n1t s VAL 138 Ca 0.01 -0.48 -0.03 0.00 0.00 0.00 0.00 61.98 61.49 1n1t s VAL 138 Cb -0.13 -0.87 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 1n1t s VAL 138 CO 0.02 0.30 -0.07 -0.69 0.00 0.00 0.00 175.10 174.66 1n1t s VAL 139 N 0.13 3.45 -0.03 2.92 1.01 -1.26 -0.55 120.40 126.07 1n1t s VAL 139 Ca -0.03 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.45 1n1t s VAL 139 Cb -0.09 -2.51 -0.03 0.00 0.00 0.00 0.00 36.38 33.74 1n1t s VAL 139 CO 0.01 0.48 0.00 -0.83 0.00 0.00 0.00 175.10 174.76 1n1t s GLY 140 N 0.73 1.86 -0.14 4.51 0.00 0.69 -0.70 107.32 114.28 1n1t s GLY 140 Ca -0.03 -0.91 0.02 0.00 0.00 0.00 0.00 44.72 43.80 1n1t s GLY 140 CO 0.02 -0.74 -0.21 1.85 0.00 0.00 0.00 173.10 174.02 1n1t s GLU 141 N -1.34 3.07 -0.22 2.90 2.12 0.25 -0.86 118.70 124.63 1n1t s GLU 141 Ca 0.18 -0.83 -0.13 0.00 0.36 0.00 0.00 54.97 54.54 1n1t s GLU 141 Cb -0.11 -2.47 -0.04 0.00 0.26 0.00 0.00 34.13 31.77 1n1t s GLU 141 CO 0.08 0.02 0.28 0.08 -0.54 0.00 0.00 175.26 175.18 1n1t s VAL 142 N 0.76 5.28 -0.15 3.70 1.01 0.32 -1.52 120.40 129.80 1n1t s VAL 142 Ca -0.08 0.46 0.01 0.00 0.00 0.00 0.00 61.98 62.37 1n1t s VAL 142 Cb -0.16 -3.62 0.02 0.00 0.00 0.00 0.00 36.38 32.62 1n1t s VAL 142 CO -0.00 0.30 -0.19 -0.89 0.00 0.00 0.00 175.10 174.32 1n1t s THR 143 N 1.13 1.90 0.03 3.92 2.01 -0.33 -4.85 115.64 119.46 1n1t s THR 143 Ca 0.14 -0.86 -0.04 0.00 0.31 0.00 0.00 61.69 61.24 1n1t s THR 143 Cb -0.14 -1.72 -0.04 0.00 0.01 0.00 0.00 72.50 70.61 1n1t s THR 143 CO 0.06 0.52 0.24 -0.54 -0.69 0.00 0.00 174.62 174.21 1n1t s LYS 144 N 1.12 3.51 0.31 4.92 1.02 -1.26 -1.31 119.74 128.05 1n1t s LYS 144 Ca -0.01 -0.23 0.03 0.00 0.02 0.00 0.00 55.97 55.78 1n1t s LYS 144 Cb -0.14 -3.05 -0.05 0.00 -0.52 0.00 0.00 37.83 34.07 1n1t s LYS 144 CO -0.07 0.62 0.09 -1.54 -0.92 0.00 0.00 175.35 173.53 1n1t s SER 145 N -2.04 1.93 -0.12 2.83 1.04 -0.24 -5.00 113.70 112.10 1n1t s SER 145 Ca 0.31 -1.42 -0.04 0.00 0.48 0.00 0.00 55.95 55.28 1n1t s SER 145 Cb -0.13 0.10 0.05 0.00 0.10 0.00 0.00 66.02 66.14 1n1t s SER 145 CO 0.21 -0.70 0.10 0.00 0.98 0.00 0.00 173.24 173.82 1n1t s ALA 146 N -3.48 0.25 -0.22 5.32 0.00 -1.26 -2.77 121.76 119.60 1n1t s ALA 146 Ca 0.36 -0.02 0.01 0.00 0.00 0.00 0.00 51.96 52.31 1n1t s ALA 146 Cb 0.08 -0.89 0.03 0.00 0.00 0.00 0.00 23.12 22.34 1n1t s ALA 146 CO 0.15 -0.89 -0.14 0.00 0.00 0.00 0.00 175.76 174.89 1n1t s ALA 147 N 2.18 2.50 -0.23 0.00 0.00 0.05 -4.86 121.76 121.39 1n1t s ALA 147 Ca 0.03 -1.45 -0.01 0.00 0.00 0.00 0.00 51.96 50.54 1n1t s ALA 147 Cb -0.14 -1.44 0.00 0.00 0.00 0.00 0.00 23.12 21.54 1n1t s ALA 147 CO -0.07 -0.73 0.18 0.27 0.00 0.00 0.00 175.76 175.41 1n1t n ASN 148 N 4.58 -1.42 0.00 0.00 2.04 -1.26 -0.50 115.26 118.69 1n1t n ASN 148 Ca -0.18 -0.27 0.00 0.00 -0.44 0.00 0.00 54.58 53.69 1n1t n ASN 148 Cb 0.47 -0.47 0.00 0.00 -2.53 0.00 0.00 39.78 37.25 1n1t n ASN 148 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1n1t n GLY 149 N -0.77 2.93 3.67 4.83 0.00 -1.26 -5.01 105.19 109.59 1n1t n GLY 149 Ca -0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 1n1t n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n1t s LYS 150 N -0.19 4.04 -0.11 1.61 3.01 0.34 -5.08 119.74 123.36 1n1t s LYS 150 Ca 0.00 -0.29 -0.13 0.00 -1.01 0.00 0.00 55.97 54.54 1n1t s LYS 150 Cb 0.00 -3.29 -0.05 0.00 -1.01 0.00 0.00 37.83 33.49 1n1t s LYS 150 CO 0.00 0.30 0.29 0.99 0.51 0.00 0.00 175.35 177.44 1n1t s THR 151 N 0.33 5.27 0.28 2.17 2.01 -1.26 -0.77 115.64 123.66 1n1t s THR 151 Ca 0.05 0.56 0.02 0.00 0.31 0.00 0.00 61.69 62.64 1n1t s THR 151 Cb -0.12 -3.61 -0.06 0.00 0.01 0.00 0.00 72.50 68.72 1n1t s THR 151 CO -0.01 0.47 0.07 0.42 -0.69 0.00 0.00 174.62 174.88 1n1t s THR 152 N -0.16 0.85 0.04 -0.82 -4.23 -1.12 -4.96 115.64 105.24 1n1t s THR 152 Ca 0.18 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.65 1n1t s THR 152 Cb -0.14 -2.64 -0.02 0.00 1.34 0.00 0.00 72.50 71.04 1n1t s THR 152 CO 0.06 -0.06 0.03 0.00 -0.54 0.00 0.00 174.62 174.12 1n1t s ALA 153 N -3.55 0.17 0.13 3.99 0.00 -1.26 -1.08 121.76 120.16 1n1t s ALA 153 Ca 0.36 -0.80 0.06 0.00 0.00 0.00 0.00 51.96 51.57 1n1t s ALA 153 Cb 0.08 0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.41 1n1t s ALA 153 CO 0.13 -0.32 -0.13 0.95 0.00 0.00 0.00 175.76 176.39 1n1t s THR 154 N -2.96 1.32 -0.10 0.00 -4.23 -0.42 -4.99 115.64 104.25 1n1t s THR 154 Ca -0.02 -1.83 -0.00 0.00 -1.18 0.00 0.00 61.69 58.66 1n1t s THR 154 Cb 0.01 -1.63 0.02 0.00 1.34 0.00 0.00 72.50 72.24 1n1t s THR 154 CO -0.06 -0.51 -0.07 -0.63 -0.54 0.00 0.00 174.62 172.81 1n1t s ILE 155 N -2.47 0.93 -0.15 2.99 1.01 -1.26 -1.18 121.20 121.06 1n1t s ILE 155 Ca 0.12 -0.24 -0.08 0.00 0.00 0.00 0.00 60.65 60.45 1n1t s ILE 155 Cb -0.03 -0.96 -0.04 0.00 0.01 0.00 0.00 42.46 41.44 1n1t s ILE 155 CO 0.03 0.35 0.13 -0.94 0.00 0.00 0.00 174.94 174.51 1n1t s SER 156 N 1.66 6.29 -0.15 3.58 1.04 -0.58 -4.91 113.70 120.63 1n1t s SER 156 Ca 0.03 0.36 -0.03 0.00 0.48 0.00 0.00 55.95 56.80 1n1t s SER 156 Cb -0.13 -2.07 -0.02 0.00 0.10 0.00 0.00 66.02 63.90 1n1t s SER 156 CO -0.07 0.31 -0.07 0.26 0.98 0.00 0.00 173.24 174.65 1n1t s TRP 157 N -0.43 2.95 0.96 5.02 0.52 -1.26 -0.58 118.94 126.11 1n1t s TRP 157 Ca 0.12 -0.48 -0.15 0.00 0.02 0.00 0.00 56.10 55.61 1n1t s TRP 157 Cb -0.12 -1.94 0.18 0.00 -1.15 0.00 0.00 33.47 30.45 1n1t s TRP 157 CO 0.01 -0.15 1.25 0.20 0.02 0.00 0.00 176.95 178.29 1n1t s GLY 158 N 0.48 1.70 0.17 0.98 0.00 0.13 -5.01 107.32 105.76 1n1t s GLY 158 Ca -0.05 -0.99 -0.30 0.00 0.00 0.00 0.00 44.72 43.38 1n1t s GLY 158 CO 0.03 -0.28 1.20 1.25 0.00 0.00 0.00 173.10 175.30 1n1t s LYS 159 N -5.70 4.48 0.46 2.90 2.47 -1.26 -4.66 119.74 118.43 1n1t s LYS 159 Ca 0.70 1.86 -0.25 0.00 -1.56 0.00 0.00 55.97 56.72 1n1t s LYS 159 Cb -0.07 -3.26 -0.08 0.00 -1.46 0.00 0.00 37.83 32.96 1n1t s LYS 159 CO 0.53 -0.11 1.43 -2.30 0.16 0.00 0.00 175.35 175.05 1n1t n PRO 160 N 2.72 2.22 -4.93 4.03 -0.02 -1.26 -4.77 135.00 132.99 1n1t n PRO 160 Ca 0.05 0.79 -0.30 0.00 -2.02 0.00 0.00 63.50 62.02 1n1t n PRO 160 Cb 0.45 -2.62 -0.17 0.00 -0.02 0.00 0.00 33.50 31.14 1n1t n PRO 160 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1n1t s VAL 161 N -1.20 1.75 0.03 -1.45 1.01 -0.41 -4.93 120.40 115.20 1n1t s VAL 161 Ca 0.62 -0.83 -0.30 0.00 0.00 0.00 0.00 61.98 61.47 1n1t s VAL 161 Cb -0.45 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 1n1t s VAL 161 CO 0.57 0.49 0.99 -0.55 0.00 0.00 0.00 175.10 176.60 1n1t s SER 162 N 0.52 7.38 0.00 3.32 0.15 -1.26 -0.80 113.70 123.01 1n1t s SER 162 Ca -0.16 1.71 0.17 0.00 0.70 0.00 0.00 55.95 58.37 1n1t s SER 162 Cb -0.17 -2.57 0.49 0.00 -1.71 0.00 0.00 66.02 62.06 1n1t s SER 162 CO 0.06 -0.23 1.40 0.18 1.20 0.00 0.00 173.24 175.84 1n1t n LEU 163 N 3.68 2.56 -0.36 3.45 4.77 0.40 -4.51 117.00 126.99 1n1t n LEU 163 Ca 0.05 -1.23 0.04 0.00 -0.03 0.00 0.00 56.01 54.84 1n1t n LEU 163 Cb 0.50 -0.28 0.19 0.00 -2.33 0.00 0.00 43.42 41.50 1n1t n LEU 163 CO 0.52 0.61 1.25 0.50 -1.33 0.00 0.00 177.39 178.94 1n1t h LYS 164 N 2.95 1.07 0.00 3.23 3.64 -1.92 -1.41 116.57 124.12 1n1t h LYS 164 Ca 0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1n1t h LYS 164 Cb 0.67 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1n1t h LYS 164 CO 0.00 0.71 0.00 -1.35 -2.27 0.00 0.00 179.45 176.54 1n1t h PRO 165 N 1.10 0.00 -0.01 1.90 0.11 -1.98 -2.40 132.00 130.72 1n1t h PRO 165 Ca 0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.56 1n1t h PRO 165 Cb 0.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.38 1n1t h PRO 165 CO -0.20 0.00 -0.34 1.28 -0.21 0.00 0.00 178.00 178.52 1n1t n LEU 166 N -2.70 1.63 -4.64 2.35 4.77 -0.53 -4.88 117.00 113.01 1n1t n LEU 166 Ca -0.02 -0.55 -0.42 0.00 -0.03 0.00 0.00 56.01 54.99 1n1t n LEU 166 Cb 0.09 -0.05 -0.04 0.00 -2.33 0.00 0.00 43.42 41.09 1n1t n LEU 166 CO 0.16 0.30 0.70 0.12 -1.33 0.00 0.00 177.39 177.35 1n1t s PHE 167 N -2.44 3.27 0.62 -1.77 5.36 -0.91 -4.93 117.98 117.18 1n1t s PHE 167 Ca 0.22 1.10 -0.19 0.00 -0.96 0.00 0.00 56.93 57.11 1n1t s PHE 167 Cb 0.19 -3.19 -0.02 0.00 -0.34 0.00 0.00 43.02 39.65 1n1t s PHE 167 CO 0.53 -0.49 1.29 -2.14 -1.46 0.00 0.00 175.22 172.94 1n1t s PRO 168 N 3.01 2.74 0.22 10.12 0.02 -1.26 -4.91 135.00 144.93 1n1t s PRO 168 Ca 0.37 2.05 0.26 0.00 0.02 0.00 0.00 61.00 63.69 1n1t s PRO 168 Cb -0.15 -1.93 0.72 0.00 0.02 0.00 0.00 34.50 33.16 1n1t s PRO 168 CO 0.09 -1.45 1.72 0.00 -0.33 0.00 0.00 177.00 177.03 1n1t h ALA 169 N 0.77 0.96 -2.39 -1.55 0.00 -1.95 -3.43 119.26 111.67 1n1t h ALA 169 Ca -0.51 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.31 1n1t h ALA 169 Cb 1.32 0.00 -0.19 0.00 0.00 0.00 0.00 17.79 18.92 1n1t h ALA 169 CO 0.54 0.00 -0.13 -1.83 0.00 0.00 0.00 179.25 177.84 1n1t s GLU 170 N -3.12 0.82 0.02 0.00 1.03 -1.26 -1.27 118.70 114.92 1n1t s GLU 170 Ca 0.10 -0.13 0.07 0.00 0.03 0.00 0.00 54.97 55.04 1n1t s GLU 170 Cb 0.12 0.37 -0.02 0.00 -0.80 0.00 0.00 34.13 33.80 1n1t s GLU 170 CO 0.62 -0.25 -0.21 -0.06 -1.33 0.00 0.00 175.26 174.03 1n1t s PHE 171 N -1.58 1.84 0.00 4.83 0.40 0.30 -4.93 117.98 118.84 1n1t s PHE 171 Ca -0.11 -0.36 0.00 0.00 -0.60 0.00 0.00 56.93 55.86 1n1t s PHE 171 Cb -0.03 -1.14 0.00 0.00 0.51 0.00 0.00 43.02 42.36 1n1t s PHE 171 CO 0.04 0.04 0.00 -0.25 0.70 0.00 0.00 175.22 175.75 1n1t n ASP 172 N 2.17 0.00 0.00 1.36 10.43 -1.26 0.21 116.55 129.46 1n1t n ASP 172 Ca -0.16 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.20 1n1t n ASP 172 Cb 0.53 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.49 1n1t n ASP 172 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1n1t n GLY 173 N 0.00 2.13 3.64 0.44 0.00 -1.26 -5.01 105.19 105.12 1n1t n GLY 173 Ca 0.00 -0.34 -0.59 0.00 0.00 0.00 0.00 46.02 45.09 1n1t n GLY 173 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1n1t n ILE 174 N 0.00 0.07 -3.19 -0.61 5.41 0.58 -4.95 119.36 116.67 1n1t n ILE 174 Ca 0.00 -0.01 -0.39 0.00 1.00 0.00 0.00 62.75 63.34 1n1t n ILE 174 Cb 0.00 -0.61 -0.06 0.00 -0.71 0.00 0.00 39.64 38.26 1n1t n ILE 174 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1n1t s LEU 175 N 1.74 4.18 0.48 1.39 1.43 -1.26 -0.54 118.68 126.08 1n1t s LEU 175 Ca 0.95 0.80 -0.09 0.00 -1.03 0.00 0.00 54.13 54.76 1n1t s LEU 175 Cb -1.21 -2.81 -0.05 0.00 0.03 0.00 0.00 46.19 42.15 1n1t s LEU 175 CO 0.63 -0.19 0.83 0.42 0.23 0.00 0.00 176.35 178.28 1n1t s THR 176 N 1.54 4.80 0.11 5.49 -4.23 -0.40 -1.26 115.64 121.69 1n1t s THR 176 Ca 0.27 0.56 0.00 0.00 -1.18 0.00 0.00 61.69 61.34 1n1t s THR 176 Cb -0.16 -3.80 0.00 0.00 1.34 0.00 0.00 72.50 69.88 1n1t s THR 176 CO 0.11 -0.75 0.00 1.17 -0.54 0.00 0.00 174.62 174.61 1n1t n LYS 177 N -1.89 0.00 -3.93 3.99 4.81 -0.09 -4.49 118.16 116.56 1n1t n LYS 177 Ca 0.03 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.37 1n1t n LYS 177 Cb 0.54 -0.35 -0.07 0.00 0.02 0.00 0.00 35.03 35.17 1n1t n LYS 177 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1n1t s GLU 178 N -1.83 1.01 0.03 1.64 2.02 -1.09 -4.11 118.70 116.36 1n1t s GLU 178 Ca 0.00 -1.10 -0.02 0.00 0.02 0.00 0.00 54.97 53.87 1n1t s GLU 178 Cb 0.00 0.35 -0.02 0.00 0.10 0.00 0.00 34.13 34.56 1n1t s GLU 178 CO 0.00 -0.35 0.01 -0.59 0.02 0.00 0.00 175.26 174.36 1n1t s PHE 179 N -3.93 0.29 0.12 1.61 -0.12 -1.26 -0.67 117.98 114.02 1n1t s PHE 179 Ca 0.12 -0.62 0.02 0.00 -0.05 0.00 0.00 56.93 56.40 1n1t s PHE 179 Cb 0.04 -0.21 -0.04 0.00 -0.63 0.00 0.00 43.02 42.18 1n1t s PHE 179 CO -0.05 -0.28 -0.05 0.08 -0.05 0.00 0.00 175.22 174.88 1n1t s VAL 180 N -2.28 0.69 1.00 -2.49 1.01 -0.52 -4.71 120.40 113.12 1n1t s VAL 180 Ca -0.08 -1.95 -0.12 0.00 0.00 0.00 0.00 61.98 59.83 1n1t s VAL 180 Cb -0.04 -1.81 0.19 0.00 0.00 0.00 0.00 36.38 34.73 1n1t s VAL 180 CO -0.04 -0.76 1.08 -0.83 0.00 0.00 0.00 175.10 174.55 1n1t s GLY 181 N -3.08 1.60 0.00 4.51 0.00 -1.26 -0.94 107.32 108.14 1n1t s GLY 181 Ca 0.15 -0.00 0.19 0.00 0.00 0.00 0.00 44.72 45.06 1n1t s GLY 181 CO -0.02 0.57 1.61 0.61 0.00 0.00 0.00 173.10 175.86 1n1t n GLY 182 N -0.23 -1.14 0.00 0.20 0.00 0.02 -4.49 105.19 99.55 1n1t n GLY 182 Ca 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1n1t n GLY 182 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1n1t n VAL 183 N -1.49 -0.68 -0.47 1.61 0.31 -1.26 -3.60 118.33 112.75 1n1t n VAL 183 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 1n1t n VAL 183 Cb 0.22 -0.59 0.00 0.00 -0.91 0.00 0.00 33.84 32.56 1n1t n VAL 183 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1n1t n GLY 184 N 0.52 -1.86 3.67 2.92 0.00 -0.49 -4.85 105.19 105.10 1n1t n GLY 184 Ca 0.00 -1.93 -0.42 0.00 0.00 0.00 0.00 46.02 43.67 1n1t n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1t s ALA 185 N -1.88 3.53 0.00 4.61 0.00 -1.26 -0.50 121.76 126.26 1n1t s ALA 185 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.03 1n1t s ALA 185 Cb 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.84 1n1t s ALA 185 CO 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 175.76 175.07 1n1t n ALA 186 N 5.34 0.00 -2.12 0.00 0.00 0.73 -4.67 120.51 119.79 1n1t n ALA 186 Ca 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.41 1n1t n ALA 186 Cb 0.48 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.83 1n1t n ALA 186 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1n1t s ILE 187 N 1.60 0.25 -0.22 0.00 -4.36 -1.17 -4.70 121.20 112.60 1n1t s ILE 187 Ca 0.00 -1.86 -0.08 0.00 -0.26 0.00 0.00 60.65 58.44 1n1t s ILE 187 Cb 0.00 -1.73 -0.04 0.00 1.25 0.00 0.00 42.46 41.94 1n1t s ILE 187 CO 0.00 -0.79 0.10 -0.69 0.24 0.00 0.00 174.94 173.79 1n1t s VAL 188 N -3.92 4.84 0.92 8.37 1.01 -1.26 -1.23 120.40 129.13 1n1t s VAL 188 Ca 0.14 -0.00 -0.12 0.00 0.00 0.00 0.00 61.98 61.99 1n1t s VAL 188 Cb 0.07 -3.23 0.14 0.00 0.00 0.00 0.00 36.38 33.36 1n1t s VAL 188 CO -0.05 0.38 1.11 0.00 0.00 0.00 0.00 175.10 176.54 1n1t s ALA 189 N 0.96 1.56 0.42 5.51 0.00 -0.09 -4.89 121.76 125.22 1n1t s ALA 189 Ca 0.05 -0.33 0.29 0.00 0.00 0.00 0.00 51.96 51.97 1n1t s ALA 189 Cb -0.14 -3.10 1.52 0.00 0.00 0.00 0.00 23.12 21.40 1n1t s ALA 189 CO 0.03 -2.37 2.09 0.66 0.00 0.00 0.00 175.76 176.17 1n1t h SER 190 N -1.56 0.00 -0.04 0.00 4.64 -2.00 0.47 113.55 115.07 1n1t h SER 190 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 1n1t h SER 190 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 1n1t h SER 190 CO 0.59 0.10 0.00 -0.46 -0.87 0.00 0.00 176.83 176.19 1n1t n ASN 191 N -3.57 0.56 0.00 4.97 0.23 -1.26 -4.91 115.26 111.28 1n1t n ASN 191 Ca -0.02 -1.42 0.00 0.00 -0.53 0.00 0.00 54.58 52.61 1n1t n ASN 191 Cb 0.23 -0.03 0.00 0.00 -2.08 0.00 0.00 39.78 37.90 1n1t n ASN 191 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1n1t n GLY 192 N 0.95 0.88 3.77 4.83 0.00 0.16 -5.04 105.19 110.74 1n1t n GLY 192 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 1n1t n GLY 192 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1n1t s ASN 193 N -2.61 6.48 -0.11 1.61 -0.87 -1.26 -4.67 114.94 113.52 1n1t s ASN 193 Ca 0.00 2.75 -0.28 0.00 -1.57 0.00 0.00 52.86 53.75 1n1t s ASN 193 Cb 0.00 -2.65 -0.02 0.00 -0.02 0.00 0.00 41.25 38.57 1n1t s ASN 193 CO 0.00 -0.75 0.96 -0.76 -2.57 0.00 0.00 177.10 173.98 1n1t s LEU 194 N -2.14 4.25 -0.26 0.60 1.43 -0.11 -0.92 118.68 121.54 1n1t s LEU 194 Ca 0.53 1.46 0.02 0.00 -1.03 0.00 0.00 54.13 55.12 1n1t s LEU 194 Cb -0.40 -3.47 0.06 0.00 0.03 0.00 0.00 46.19 42.40 1n1t s LEU 194 CO 0.53 -0.41 -0.09 -0.69 0.23 0.00 0.00 176.35 175.93 1n1t s VAL 195 N 1.89 2.00 -0.16 -1.59 1.01 -0.36 -0.79 120.40 122.39 1n1t s VAL 195 Ca 0.46 -1.56 -0.06 0.00 0.00 0.00 0.00 61.98 60.82 1n1t s VAL 195 Cb -0.18 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 1n1t s VAL 195 CO 0.18 -0.08 0.04 -0.31 0.00 0.00 0.00 175.10 174.93 1n1t s TYR 196 N 1.17 3.22 0.07 5.22 4.12 -0.18 -3.06 117.35 127.91 1n1t s TYR 196 Ca -0.07 0.05 -0.26 0.00 0.02 0.00 0.00 57.07 56.81 1n1t s TYR 196 Cb -0.20 -2.01 -0.06 0.00 -1.52 0.00 0.00 41.96 38.17 1n1t s TYR 196 CO -0.06 0.19 0.79 -1.25 0.02 0.00 0.00 175.55 175.25 1n1t s PRO 197 N 0.13 4.53 0.17 -1.71 0.04 -1.26 -0.84 135.00 136.06 1n1t s PRO 197 Ca 0.04 1.12 0.09 0.00 0.04 0.00 0.00 61.00 62.29 1n1t s PRO 197 Cb -0.12 -3.35 -0.04 0.00 0.04 0.00 0.00 34.50 31.02 1n1t s PRO 197 CO 0.01 0.31 -0.20 0.14 0.04 0.00 0.00 177.00 177.30 1n1t s VAL 198 N -0.19 2.00 -0.13 -0.36 -7.23 0.45 -0.80 120.40 114.15 1n1t s VAL 198 Ca 0.39 -1.93 -0.00 0.00 -1.81 0.00 0.00 61.98 58.62 1n1t s VAL 198 Cb -0.21 -1.92 -0.02 0.00 0.56 0.00 0.00 36.38 34.79 1n1t s VAL 198 CO 0.24 -0.23 -0.12 0.00 -0.31 0.00 0.00 175.10 174.68 1n1t s GLN 199 N -2.69 3.38 -0.05 4.82 -2.07 -0.12 -1.46 119.66 121.46 1n1t s GLN 199 Ca 0.17 -0.67 0.06 0.00 -1.82 0.00 0.00 55.36 53.10 1n1t s GLN 199 Cb -0.07 -2.65 -0.01 0.00 -1.09 0.00 0.00 33.01 29.19 1n1t s GLN 199 CO 0.08 0.23 -0.25 0.42 -1.32 0.00 0.00 175.29 174.45 1n1t s ILE 200 N 0.30 2.02 -0.14 3.63 1.01 0.70 -1.43 121.20 127.30 1n1t s ILE 200 Ca -0.10 -1.06 -0.05 0.00 0.00 0.00 0.00 60.65 59.45 1n1t s ILE 200 Cb -0.16 -1.70 -0.04 0.00 0.01 0.00 0.00 42.46 40.58 1n1t s ILE 200 CO 0.05 0.56 0.04 0.00 0.00 0.00 0.00 174.94 175.60 1n1t s ALA 201 N -0.25 3.39 0.73 9.38 0.00 0.15 -1.31 121.76 133.85 1n1t s ALA 201 Ca -0.01 -0.76 -0.02 0.00 0.00 0.00 0.00 51.96 51.17 1n1t s ALA 201 Cb -0.13 -1.73 0.12 0.00 0.00 0.00 0.00 23.12 21.39 1n1t s ALA 201 CO 0.03 0.39 1.01 0.16 0.00 0.00 0.00 175.76 177.35 1n1t s ASP 202 N -0.28 4.32 0.28 0.00 1.47 0.20 -0.91 116.67 121.74 1n1t s ASP 202 Ca 0.08 -0.26 0.01 0.00 1.18 0.00 0.00 52.55 53.56 1n1t s ASP 202 Cb -0.12 -0.13 0.55 0.00 -0.34 0.00 0.00 42.92 42.88 1n1t s ASP 202 CO 0.02 -1.88 1.84 0.24 0.68 0.00 0.00 175.17 176.06 1n1t h MET 203 N -0.59 0.97 0.00 2.11 2.86 -1.41 -1.50 114.93 117.38 1n1t h MET 203 Ca -0.38 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.21 1n1t h MET 203 Cb 1.27 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 32.71 1n1t h MET 203 CO 0.42 0.64 0.00 0.41 1.06 0.00 0.00 176.91 179.44 1n1t n GLY 204 N -1.35 -1.46 0.00 8.32 0.00 -1.26 -4.89 105.19 104.55 1n1t n GLY 204 Ca 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1n1t n GLY 204 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n1t n GLY 205 N 0.95 0.71 3.77 -0.02 0.00 -0.57 -5.00 105.19 105.02 1n1t n GLY 205 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1n1t n GLY 205 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n1t s ARG 206 N -0.69 3.86 0.02 1.61 0.52 -1.26 -4.73 118.95 118.28 1n1t s ARG 206 Ca 0.00 1.78 0.08 0.00 -0.52 0.00 0.00 55.73 57.07 1n1t s ARG 206 Cb 0.00 -2.49 -0.03 0.00 0.52 0.00 0.00 34.95 32.96 1n1t s ARG 206 CO 0.00 -0.47 -0.24 0.54 0.02 0.00 0.00 175.30 175.16 1n1t s VAL 207 N -1.52 2.32 0.28 3.52 0.11 -1.26 -0.63 120.40 123.22 1n1t s VAL 207 Ca 0.61 -1.23 -0.13 0.00 -2.93 0.00 0.00 61.98 58.30 1n1t s VAL 207 Cb -0.29 -1.90 0.00 0.00 -1.53 0.00 0.00 36.38 32.67 1n1t s VAL 207 CO 0.35 0.43 0.54 0.72 -3.33 0.00 0.00 175.10 173.81 1n1t s PHE 208 N -0.78 0.35 0.23 1.54 -0.12 -0.42 -0.82 117.98 117.96 1n1t s PHE 208 Ca 0.12 -0.74 0.11 0.00 -0.05 0.00 0.00 56.93 56.37 1n1t s PHE 208 Cb -0.10 0.28 -0.05 0.00 -0.63 0.00 0.00 43.02 42.52 1n1t s PHE 208 CO 0.02 -1.09 -0.21 0.95 -0.05 0.00 0.00 175.22 174.83 1n1t s THR 209 N -3.74 2.33 0.18 -4.49 -4.23 -1.26 -0.21 115.64 104.22 1n1t s THR 209 Ca 0.21 -2.19 -0.13 0.00 -1.18 0.00 0.00 61.69 58.39 1n1t s THR 209 Cb -0.02 -2.17 0.01 0.00 1.34 0.00 0.00 72.50 71.66 1n1t s THR 209 CO 0.10 -0.28 0.41 -0.54 -0.54 0.00 0.00 174.62 173.77 1n1t s LYS 210 N -3.09 1.26 -0.15 3.99 1.02 -0.54 -1.49 119.74 120.75 1n1t s LYS 210 Ca 0.24 -1.00 -0.11 0.00 0.02 0.00 0.00 55.97 55.12 1n1t s LYS 210 Cb -0.06 0.45 -0.05 0.00 -0.52 0.00 0.00 37.83 37.65 1n1t s LYS 210 CO 0.12 -0.50 0.22 0.42 -0.92 0.00 0.00 175.35 174.68 1n1t s ILE 211 N -3.91 5.36 -0.20 2.17 -1.09 -1.26 -0.41 121.20 121.85 1n1t s ILE 211 Ca 0.12 0.39 0.00 0.00 -2.23 0.00 0.00 60.65 58.94 1n1t s ILE 211 Cb 0.01 -3.54 0.02 0.00 -1.58 0.00 0.00 42.46 37.37 1n1t s ILE 211 CO -0.02 0.47 -0.16 -0.32 -1.23 0.00 0.00 174.94 173.68 1n1t s MET 212 N -0.01 2.94 0.14 2.79 -2.45 -0.02 -0.73 119.30 121.97 1n1t s MET 212 Ca 0.14 -0.88 0.03 0.00 -1.25 0.00 0.00 55.69 53.74 1n1t s MET 212 Cb -0.12 -2.71 -0.04 0.00 1.25 0.00 0.00 34.83 33.21 1n1t s MET 212 CO 0.03 -0.27 -0.08 1.52 1.05 0.00 0.00 175.02 177.27 1n1t s TYR 213 N 1.30 1.18 -0.02 4.11 1.13 -0.17 -1.01 117.35 123.86 1n1t s TYR 213 Ca 0.03 -0.83 0.03 0.00 -1.41 0.00 0.00 57.07 54.88 1n1t s TYR 213 Cb -0.14 -0.63 0.00 0.00 -1.10 0.00 0.00 41.96 40.09 1n1t s TYR 213 CO -0.10 -0.01 -0.09 0.45 -2.51 0.00 0.00 175.55 173.29 1n1t s SER 214 N -3.14 1.17 0.00 -0.18 0.15 0.03 -0.94 113.70 110.79 1n1t s SER 214 Ca 0.17 -0.18 0.24 0.00 0.70 0.00 0.00 55.95 56.88 1n1t s SER 214 Cb 0.04 -0.27 0.22 0.00 -1.71 0.00 0.00 66.02 64.30 1n1t s SER 214 CO -0.00 0.07 1.27 -0.62 1.20 0.00 0.00 173.24 175.17 1n1t n GLU 215 N 3.20 2.19 -2.63 5.44 1.02 -1.26 -0.93 120.64 127.67 1n1t n GLU 215 Ca -0.17 -1.79 -0.08 0.00 -0.02 0.00 0.00 57.16 55.10 1n1t n GLU 215 Cb 0.55 -1.46 0.04 0.00 -0.02 0.00 0.00 31.44 30.54 1n1t n GLU 215 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1n1t n ASP 216 N 1.16 2.36 -2.98 1.62 3.85 -1.26 -4.89 116.55 116.42 1n1t n ASP 216 Ca 0.14 -2.56 -0.22 0.00 -0.71 0.00 0.00 54.79 51.44 1n1t n ASP 216 Cb 0.57 -0.46 0.03 0.00 -1.35 0.00 0.00 41.12 39.91 1n1t n ASP 216 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 1n1t n ASP 217 N -0.52 -5.97 0.00 -1.12 10.43 -1.26 -2.74 116.55 115.36 1n1t n ASP 217 Ca 0.16 -0.26 0.00 0.00 2.57 0.00 0.00 54.79 57.26 1n1t n ASP 217 Cb 0.83 -4.85 0.00 0.00 1.84 0.00 0.00 41.12 38.94 1n1t n ASP 217 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1n1t n GLY 218 N -1.45 0.75 0.22 0.44 0.00 -1.26 -4.95 105.19 98.94 1n1t n GLY 218 Ca -0.12 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.77 1n1t n GLY 218 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1n1t h ASN 219 N 0.00 0.80 -3.95 1.61 -1.24 -1.94 -3.45 115.58 107.42 1n1t h ASN 219 Ca 0.00 -0.46 -0.35 0.00 0.71 0.00 0.00 56.30 56.20 1n1t h ASN 219 Cb 0.00 -0.22 -0.15 0.00 0.73 0.00 0.00 38.32 38.67 1n1t h ASN 219 CO 0.00 1.10 -0.72 0.42 -1.29 0.00 0.00 177.43 176.93 1n1t s THR 220 N -4.39 1.22 0.02 -3.57 -4.23 -1.26 -5.11 115.64 98.32 1n1t s THR 220 Ca -0.12 -1.98 0.01 0.00 -1.18 0.00 0.00 61.69 58.42 1n1t s THR 220 Cb 0.09 -1.77 -0.01 0.00 1.34 0.00 0.00 72.50 72.15 1n1t s THR 220 CO 0.84 -0.66 -0.05 0.26 -0.54 0.00 0.00 174.62 174.46 1n1t s TRP 221 N -3.02 0.46 0.01 3.99 0.52 -1.26 -4.40 118.94 115.24 1n1t s TRP 221 Ca 0.15 -0.31 0.05 0.00 0.02 0.00 0.00 56.10 56.00 1n1t s TRP 221 Cb 0.01 -0.29 -0.02 0.00 -1.15 0.00 0.00 33.47 32.02 1n1t s TRP 221 CO 0.01 -0.07 -0.14 0.15 0.02 0.00 0.00 176.95 176.93 1n1t s LYS 222 N -0.91 1.03 -0.29 4.98 -0.14 -0.11 -4.96 119.74 119.34 1n1t s LYS 222 Ca -0.06 -0.61 -0.16 0.00 -1.36 0.00 0.00 55.97 53.79 1n1t s LYS 222 Cb -0.06 -1.02 -0.03 0.00 -1.68 0.00 0.00 37.83 35.04 1n1t s LYS 222 CO -0.00 0.27 0.40 -0.06 -0.76 0.00 0.00 175.35 175.20 1n1t s PHE 223 N -0.55 3.23 0.75 3.18 0.40 -1.26 -1.00 117.98 122.73 1n1t s PHE 223 Ca 0.04 0.32 -0.11 0.00 -0.60 0.00 0.00 56.93 56.57 1n1t s PHE 223 Cb -0.06 -2.65 0.05 0.00 0.51 0.00 0.00 43.02 40.87 1n1t s PHE 223 CO 0.00 -0.31 1.10 0.00 0.70 0.00 0.00 175.22 176.71 1n1t s ALA 224 N 2.12 2.28 0.15 5.36 0.00 0.10 -4.96 121.76 126.81 1n1t s ALA 224 Ca 0.15 0.33 0.13 0.00 0.00 0.00 0.00 51.96 52.58 1n1t s ALA 224 Cb -0.16 -3.29 0.34 0.00 0.00 0.00 0.00 23.12 20.01 1n1t s ALA 224 CO 0.11 -1.69 1.58 0.93 0.00 0.00 0.00 175.76 176.68 1n1t h GLU 225 N -0.92 0.00 -7.32 0.00 5.08 -1.74 -3.43 114.58 106.25 1n1t h GLU 225 Ca -0.44 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.41 1n1t h GLU 225 Cb 1.23 0.00 0.11 0.00 0.50 0.00 0.00 28.75 30.59 1n1t h GLU 225 CO 0.52 0.58 0.35 0.20 -1.00 0.00 0.00 179.01 179.65 1n1t s GLY 226 N -4.47 1.70 0.20 -3.84 0.00 0.18 -4.98 107.32 96.11 1n1t s GLY 226 Ca 0.00 0.18 -0.15 0.00 0.00 0.00 0.00 44.72 44.76 1n1t s GLY 226 CO 0.74 0.51 0.45 1.09 0.00 0.00 0.00 173.10 175.89 1n1t s ARG 227 N -4.93 1.35 0.80 2.90 1.70 -1.26 -4.59 118.95 114.92 1n1t s ARG 227 Ca 0.60 -1.01 -0.11 0.00 -0.47 0.00 0.00 55.73 54.74 1n1t s ARG 227 Cb -0.16 0.48 0.08 0.00 -0.57 0.00 0.00 34.95 34.78 1n1t s ARG 227 CO 0.54 -0.55 1.16 -1.54 -1.08 0.00 0.00 175.30 173.83 1n1t s SER 228 N -2.92 4.52 0.87 -2.89 1.04 -0.55 -4.87 113.70 108.90 1n1t s SER 228 Ca 0.13 0.73 -0.12 0.00 0.48 0.00 0.00 55.95 57.17 1n1t s SER 228 Cb 0.00 -1.23 0.10 0.00 0.10 0.00 0.00 66.02 64.98 1n1t s SER 228 CO -0.00 -1.88 1.03 0.29 0.98 0.00 0.00 173.24 173.65 1n1t n LYS 229 N -3.28 -0.15 -2.01 4.02 5.02 -1.26 -4.62 118.16 115.88 1n1t n LYS 229 Ca 0.08 0.03 -0.37 0.00 -2.02 0.00 0.00 58.31 56.02 1n1t n LYS 229 Cb 0.61 -2.29 0.02 0.00 -0.02 0.00 0.00 35.03 33.35 1n1t n LYS 229 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1n1t s PHE 230 N -2.36 2.53 0.00 2.13 0.40 -1.26 -3.39 117.98 116.02 1n1t s PHE 230 Ca 0.68 1.46 0.00 0.00 -0.60 0.00 0.00 56.93 58.47 1n1t s PHE 230 Cb -0.26 -3.58 0.00 0.00 0.51 0.00 0.00 43.02 39.70 1n1t s PHE 230 CO 0.57 -2.23 0.00 0.41 0.70 0.00 0.00 175.22 174.66 1n1t n GLY 231 N 0.58 0.45 3.86 4.36 0.00 0.00 -5.00 105.19 109.43 1n1t n GLY 231 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 1n1t n GLY 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1t n SER 233 N 1.96 -0.79 -3.70 0.00 3.41 -0.12 -3.25 113.62 111.13 1n1t n SER 233 Ca -0.18 -2.97 -0.22 0.00 -0.26 0.00 0.00 58.87 55.24 1n1t n SER 233 Cb 0.54 1.73 0.01 0.00 -0.26 0.00 0.00 64.21 66.23 1n1t n SER 233 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1n1t n GLU 234 N -0.58 -0.67 -2.61 4.33 1.02 -1.26 -0.92 120.64 119.96 1n1t n GLU 234 Ca 0.06 -0.03 -0.38 0.00 -0.02 0.00 0.00 57.16 56.79 1n1t n GLU 234 Cb 0.56 -0.97 -0.05 0.00 -0.02 0.00 0.00 31.44 30.96 1n1t n GLU 234 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1n1t s PRO 235 N -5.51 4.49 -0.03 3.49 0.04 -1.24 -3.68 135.00 132.57 1n1t s PRO 235 Ca 0.19 1.54 0.05 0.00 0.04 0.00 0.00 61.00 62.82 1n1t s PRO 235 Cb -0.10 -2.88 -0.03 0.00 0.04 0.00 0.00 34.50 31.53 1n1t s PRO 235 CO 0.51 0.15 -0.17 0.00 0.04 0.00 0.00 177.00 177.53 1n1t s ALA 236 N -1.45 2.57 0.01 8.56 0.00 -0.31 -4.25 121.76 126.89 1n1t s ALA 236 Ca 0.50 -1.03 0.05 0.00 0.00 0.00 0.00 51.96 51.48 1n1t s ALA 236 Cb -0.24 -0.86 -0.02 0.00 0.00 0.00 0.00 23.12 22.00 1n1t s ALA 236 CO 0.31 0.55 -0.15 0.54 0.00 0.00 0.00 175.76 177.01 1n1t s VAL 237 N -0.73 1.20 0.22 0.00 0.11 -1.26 -0.27 120.40 119.67 1n1t s VAL 237 Ca 0.12 -0.83 -0.00 0.00 -2.93 0.00 0.00 61.98 58.34 1n1t s VAL 237 Cb -0.10 -1.04 -0.04 0.00 -1.53 0.00 0.00 36.38 33.66 1n1t s VAL 237 CO 0.01 0.20 0.12 -1.48 -3.33 0.00 0.00 175.10 170.62 1n1t s LEU 238 N -0.73 1.30 -0.13 2.54 0.05 -0.82 -4.66 118.68 116.23 1n1t s LEU 238 Ca 0.04 -1.39 -0.03 0.00 0.05 0.00 0.00 54.13 52.80 1n1t s LEU 238 Cb -0.07 0.28 -0.03 0.00 -2.05 0.00 0.00 46.19 44.32 1n1t s LEU 238 CO 0.00 -0.81 -0.04 -0.70 -0.55 0.00 0.00 176.35 174.25 1n1t s GLU 239 N -4.11 3.46 -0.06 1.48 2.12 -1.26 -0.58 118.70 119.75 1n1t s GLU 239 Ca 0.39 -0.51 -0.02 0.00 0.36 0.00 0.00 54.97 55.18 1n1t s GLU 239 Cb 0.07 -2.85 0.03 0.00 0.26 0.00 0.00 34.13 31.64 1n1t s GLU 239 CO 0.13 0.35 0.06 -0.46 -0.54 0.00 0.00 175.26 174.80 1n1t s TRP 240 N 0.06 0.13 -1.48 5.30 -0.11 0.36 -4.91 118.94 118.29 1n1t s TRP 240 Ca -0.00 0.16 -0.03 0.00 1.22 0.00 0.00 56.10 57.45 1n1t s TRP 240 Cb -0.13 -0.53 0.03 0.00 -1.50 0.00 0.00 33.47 31.33 1n1t s TRP 240 CO 0.03 -0.24 0.40 0.39 -4.62 0.00 0.00 176.95 172.92 1n1t n GLU 241 N 5.28 -2.86 -0.91 5.86 1.02 -1.26 -0.85 120.64 126.93 1n1t n GLU 241 Ca -0.04 0.34 0.00 0.00 -0.02 0.00 0.00 57.16 57.45 1n1t n GLU 241 Cb 0.50 -4.46 0.00 0.00 -0.02 0.00 0.00 31.44 27.46 1n1t n GLU 241 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1n1t n GLY 242 N -1.99 0.81 3.30 0.62 0.00 -1.26 -5.03 105.19 101.64 1n1t n GLY 242 Ca -0.25 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.51 1n1t n GLY 242 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n1t s LYS 243 N -0.09 1.29 0.14 1.61 1.02 -0.03 -4.67 119.74 119.01 1n1t s LYS 243 Ca 0.00 -1.13 -0.30 0.00 0.02 0.00 0.00 55.97 54.56 1n1t s LYS 243 Cb 0.00 -1.55 -0.06 0.00 -0.52 0.00 0.00 37.83 35.70 1n1t s LYS 243 CO 0.00 0.37 0.98 -0.51 -0.92 0.00 0.00 175.35 175.27 1n1t s LEU 244 N -1.69 4.52 -0.21 3.17 1.43 0.42 -0.49 118.68 125.82 1n1t s LEU 244 Ca 0.08 1.86 -0.03 0.00 -1.03 0.00 0.00 54.13 55.01 1n1t s LEU 244 Cb -0.10 -3.59 -0.00 0.00 0.03 0.00 0.00 46.19 42.53 1n1t s LEU 244 CO 0.04 -0.06 -0.07 -0.63 0.23 0.00 0.00 176.35 175.86 1n1t s ILE 245 N -0.19 3.14 -0.25 -0.59 1.01 0.25 -0.83 121.20 123.75 1n1t s ILE 245 Ca 0.47 -0.57 -0.04 0.00 0.00 0.00 0.00 60.65 60.50 1n1t s ILE 245 Cb -0.25 -2.42 0.01 0.00 0.01 0.00 0.00 42.46 39.82 1n1t s ILE 245 CO 0.31 0.44 -0.01 -0.63 0.00 0.00 0.00 174.94 175.05 1n1t s ILE 246 N 1.44 3.42 -0.27 2.92 1.09 0.30 -1.95 121.20 128.14 1n1t s ILE 246 Ca 0.06 -0.71 -0.07 0.00 -1.10 0.00 0.00 60.65 58.83 1n1t s ILE 246 Cb -0.14 -2.67 -0.01 0.00 -1.06 0.00 0.00 42.46 38.58 1n1t s ILE 246 CO -0.05 0.25 0.08 0.21 -0.10 0.00 0.00 174.94 175.33 1n1t s ASN 247 N 1.44 5.12 -0.05 3.58 3.84 0.63 -1.03 114.94 128.46 1n1t s ASN 247 Ca 0.03 -0.47 -0.00 0.00 0.21 0.00 0.00 52.86 52.63 1n1t s ASN 247 Cb -0.16 -1.90 -0.03 0.00 -0.55 0.00 0.00 41.25 38.61 1n1t s ASN 247 CO -0.02 -0.12 -0.00 0.20 -2.79 0.00 0.00 177.10 174.37 1n1t s ASN 248 N 1.56 5.16 0.28 -4.21 0.01 -0.59 -1.16 114.94 115.99 1n1t s ASN 248 Ca 0.05 0.08 -0.29 0.00 -0.71 0.00 0.00 52.86 51.98 1n1t s ASN 248 Cb -0.16 -1.40 -0.10 0.00 0.41 0.00 0.00 41.25 40.00 1n1t s ASN 248 CO 0.03 0.34 1.33 -0.60 -1.51 0.00 0.00 177.10 176.69 1n1t s ARG 249 N -1.15 4.36 -0.31 -0.60 3.52 -0.09 -3.95 118.95 120.72 1n1t s ARG 249 Ca 0.16 2.18 -0.02 0.00 -0.13 0.00 0.00 55.73 57.91 1n1t s ARG 249 Cb -0.11 -3.11 0.11 0.00 -1.56 0.00 0.00 34.95 30.27 1n1t s ARG 249 CO 0.05 -0.24 0.14 0.08 -0.81 0.00 0.00 175.30 174.53 1n1t s VAL 250 N -0.59 0.26 0.21 7.11 1.01 -1.26 -0.94 120.40 126.19 1n1t s VAL 250 Ca 0.53 -1.14 -0.31 0.00 0.00 0.00 0.00 61.98 61.07 1n1t s VAL 250 Cb -0.39 -1.21 -0.10 0.00 0.00 0.00 0.00 36.38 34.67 1n1t s VAL 250 CO 0.47 -0.76 1.52 -1.81 0.00 0.00 0.00 175.10 174.51 1n1t s ASP 251 N 1.75 6.60 0.00 3.32 -0.00 -1.26 -2.97 116.67 124.11 1n1t s ASP 251 Ca 0.11 2.66 0.00 0.00 -0.00 0.00 0.00 52.55 55.32 1n1t s ASP 251 Cb -0.18 -2.61 0.00 0.00 -0.00 0.00 0.00 42.92 40.13 1n1t s ASP 251 CO -0.27 -0.78 0.00 0.61 -0.00 0.00 0.00 175.17 174.73 1n1t n GLY 252 N 2.99 0.58 3.67 0.21 0.00 -0.28 -4.90 105.19 107.47 1n1t n GLY 252 Ca 0.10 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 1n1t n GLY 252 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1n1t s ASN 253 N -2.37 0.15 0.66 1.61 3.04 -0.99 -4.43 114.94 112.61 1n1t s ASN 253 Ca 0.00 -1.07 -0.15 0.00 0.04 0.00 0.00 52.86 51.68 1n1t s ASN 253 Cb 0.00 0.70 0.00 0.00 -1.54 0.00 0.00 41.25 40.41 1n1t s ASN 253 CO 0.00 -1.36 1.12 -0.13 -3.04 0.00 0.00 177.10 173.68 1n1t s ARG 254 N -3.31 2.77 0.03 0.43 0.52 -1.26 -4.54 118.95 113.58 1n1t s ARG 254 Ca 0.21 1.41 -0.30 0.00 -0.52 0.00 0.00 55.73 56.52 1n1t s ARG 254 Cb -0.03 -1.94 -0.05 0.00 0.52 0.00 0.00 34.95 33.44 1n1t s ARG 254 CO 0.12 -1.28 1.27 1.03 0.02 0.00 0.00 175.30 176.46 1n1t s ARG 255 N -4.08 4.37 0.07 3.54 0.52 -0.04 -4.76 118.95 118.57 1n1t s ARG 255 Ca 0.67 1.83 -0.22 0.00 -0.52 0.00 0.00 55.73 57.50 1n1t s ARG 255 Cb -0.21 -3.43 -0.07 0.00 0.52 0.00 0.00 34.95 31.77 1n1t s ARG 255 CO 0.42 -0.39 0.65 -0.51 0.02 0.00 0.00 175.30 175.49 1n1t s LEU 256 N 1.59 4.51 -0.04 2.53 1.43 -1.25 -0.81 118.68 126.64 1n1t s LEU 256 Ca 0.60 1.36 0.04 0.00 -1.03 0.00 0.00 54.13 55.11 1n1t s LEU 256 Cb -0.30 -3.05 -0.00 0.00 0.03 0.00 0.00 46.19 42.87 1n1t s LEU 256 CO 0.27 0.18 -0.18 -0.69 0.23 0.00 0.00 176.35 176.17 1n1t s VAL 257 N -0.76 1.47 0.25 -1.59 1.01 -1.26 -1.54 120.40 117.98 1n1t s VAL 257 Ca 0.32 -0.74 0.10 0.00 0.00 0.00 0.00 61.98 61.66 1n1t s VAL 257 Cb -0.20 -1.26 -0.05 0.00 0.00 0.00 0.00 36.38 34.86 1n1t s VAL 257 CO 0.21 0.42 -0.17 -0.31 0.00 0.00 0.00 175.10 175.25 1n1t s TYR 258 N 0.01 2.03 0.05 5.22 1.51 -0.20 -0.77 117.35 125.20 1n1t s TYR 258 Ca -0.03 -0.45 0.06 0.00 -1.01 0.00 0.00 57.07 55.64 1n1t s TYR 258 Cb -0.12 -0.91 -0.02 0.00 -0.11 0.00 0.00 41.96 40.80 1n1t s TYR 258 CO 0.02 0.55 -0.18 -1.21 -1.11 0.00 0.00 175.55 173.62 1n1t s GLU 259 N -3.58 1.18 -0.03 -0.62 2.02 0.84 -0.54 118.70 117.96 1n1t s GLU 259 Ca 0.27 -0.89 0.00 0.00 0.02 0.00 0.00 54.97 54.36 1n1t s GLU 259 Cb -0.03 -1.26 0.03 0.00 0.10 0.00 0.00 34.13 32.97 1n1t s GLU 259 CO 0.11 0.32 0.01 0.45 0.02 0.00 0.00 175.26 176.17 1n1t s SER 260 N -1.25 0.55 0.00 -0.19 0.15 -0.01 -1.03 113.70 111.93 1n1t s SER 260 Ca 0.05 -0.02 0.24 0.00 0.70 0.00 0.00 55.95 56.92 1n1t s SER 260 Cb -0.09 -0.22 0.32 0.00 -1.71 0.00 0.00 66.02 64.32 1n1t s SER 260 CO 0.02 -0.12 1.31 -1.20 1.20 0.00 0.00 173.24 174.44 1n1t n SER 261 N 4.30 2.08 -2.56 5.45 7.64 -1.26 -0.44 113.62 128.83 1n1t n SER 261 Ca -0.23 -1.55 -0.18 0.00 1.01 0.00 0.00 58.87 57.91 1n1t n SER 261 Cb 0.50 0.22 0.02 0.00 -1.01 0.00 0.00 64.21 63.93 1n1t n SER 261 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1n1t n ASP 262 N 0.31 3.15 -3.82 6.43 3.85 -1.26 -4.91 116.55 120.29 1n1t n ASP 262 Ca 0.12 -3.22 -0.29 0.00 -0.71 0.00 0.00 54.79 50.70 1n1t n ASP 262 Cb 0.47 -0.49 0.04 0.00 -1.35 0.00 0.00 41.12 39.79 1n1t n ASP 262 CO 0.00 0.00 0.00 0.80 -1.01 0.00 0.00 177.20 176.99 1n1t n MET 263 N -0.30 -5.98 -0.55 0.11 0.00 -1.26 -1.85 117.12 107.29 1n1t n MET 263 Ca 0.25 0.65 0.00 0.00 -0.00 0.00 0.00 57.70 58.60 1n1t n MET 263 Cb 0.74 -5.57 0.00 0.00 0.00 0.00 0.00 33.22 28.39 1n1t n MET 263 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1n1t n GLY 264 N -1.75 1.02 0.23 -5.12 0.00 -1.26 -4.78 105.19 93.53 1n1t n GLY 264 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 1n1t n GLY 264 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1n1t h LYS 265 N 3.52 0.74 -4.92 1.61 3.64 -1.71 0.55 116.57 119.99 1n1t h LYS 265 Ca 0.00 -0.17 -0.60 0.00 -1.27 0.00 0.00 60.65 58.61 1n1t h LYS 265 Cb 0.00 -0.10 -0.34 0.00 -0.41 0.00 0.00 32.23 31.38 1n1t h LYS 265 CO 0.00 0.71 -0.85 0.99 -2.27 0.00 0.00 179.45 178.04 1n1t s THR 266 N -5.36 1.60 -0.08 1.00 2.01 -1.26 -1.79 115.64 111.76 1n1t s THR 266 Ca -0.13 -0.74 0.02 0.00 0.31 0.00 0.00 61.69 61.15 1n1t s THR 266 Cb 0.11 -1.42 -0.02 0.00 0.01 0.00 0.00 72.50 71.17 1n1t s THR 266 CO 0.78 0.46 -0.12 0.26 -0.69 0.00 0.00 174.62 175.31 1n1t s TRP 267 N 0.61 2.80 -0.08 4.92 0.52 -1.26 -4.32 118.94 122.12 1n1t s TRP 267 Ca -0.14 -0.24 0.03 0.00 0.02 0.00 0.00 56.10 55.76 1n1t s TRP 267 Cb -0.16 -1.72 0.01 0.00 -1.15 0.00 0.00 33.47 30.45 1n1t s TRP 267 CO 0.04 0.11 -0.16 0.08 0.02 0.00 0.00 176.95 177.05 1n1t s VAL 268 N -0.43 1.46 0.30 4.03 1.01 -0.20 -4.94 120.40 121.63 1n1t s VAL 268 Ca 0.05 -0.66 -0.29 0.00 0.00 0.00 0.00 61.98 61.08 1n1t s VAL 268 Cb -0.12 -1.31 -0.10 0.00 0.00 0.00 0.00 36.38 34.85 1n1t s VAL 268 CO 0.02 0.43 1.28 -0.70 0.00 0.00 0.00 175.10 176.13 1n1t s GLU 269 N 0.64 4.40 -1.52 2.72 2.12 -1.26 -0.12 118.70 125.68 1n1t s GLU 269 Ca -0.14 2.14 -0.09 0.00 0.36 0.00 0.00 54.97 57.23 1n1t s GLU 269 Cb -0.16 -3.11 -0.01 0.00 0.26 0.00 0.00 34.13 31.11 1n1t s GLU 269 CO 0.04 -0.15 2.71 0.00 -0.54 0.00 0.00 175.26 177.32 1n1t n ALA 270 N 1.22 7.13 0.24 6.30 0.00 0.05 -4.69 120.51 130.76 1n1t n ALA 270 Ca 0.01 -3.74 0.08 0.00 0.00 0.00 0.00 53.44 49.80 1n1t n ALA 270 Cb 0.42 -3.22 0.59 0.00 0.00 0.00 0.00 19.45 17.25 1n1t n ALA 270 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1n1t h LEU 271 N 6.91 0.00 -0.62 0.00 3.38 -1.89 -1.13 115.31 121.95 1n1t h LEU 271 Ca 0.79 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.76 1n1t h LEU 271 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1n1t h LEU 271 CO 1.71 0.17 -0.04 0.61 0.09 0.00 0.00 178.44 180.98 1n1t n GLY 272 N -0.84 -0.39 0.45 0.83 0.00 -1.26 -4.22 105.19 99.76 1n1t n GLY 272 Ca -0.02 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1n1t n GLY 272 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1n1t n THR 273 N -0.30 0.00 0.16 2.61 -2.24 -0.97 -4.75 114.28 108.79 1n1t n THR 273 Ca 0.19 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 62.01 1n1t n THR 273 Cb 0.29 -0.03 -0.07 0.00 -2.10 0.00 0.00 70.33 68.43 1n1t n THR 273 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1n1t n LEU 274 N -1.35 0.16 -4.75 3.22 4.77 -1.09 -4.57 117.00 113.39 1n1t n LEU 274 Ca 0.00 -0.19 -0.41 0.00 -0.03 0.00 0.00 56.01 55.38 1n1t n LEU 274 Cb 0.00 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 1n1t n LEU 274 CO 0.00 0.04 1.04 -0.55 -1.33 0.00 0.00 177.39 176.59 1n1t s SER 275 N -2.62 6.74 0.00 -1.43 0.15 -0.47 -2.46 113.70 113.61 1n1t s SER 275 Ca -0.01 2.63 0.00 0.00 0.70 0.00 0.00 55.95 59.27 1n1t s SER 275 Cb 0.06 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 1n1t s SER 275 CO 0.39 -0.61 0.00 1.41 1.20 0.00 0.00 173.24 175.63 1n1t n HIS 276 N 1.79 0.00 -0.06 3.44 8.25 0.01 -4.84 115.22 123.82 1n1t n HIS 276 Ca 0.04 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.39 1n1t n HIS 276 Cb 0.41 -0.88 -0.05 0.00 1.12 0.00 0.00 29.99 30.59 1n1t n HIS 276 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1n1t h VAL 277 N 0.00 1.23 -2.26 1.59 2.07 -1.69 -3.42 116.25 113.78 1n1t h VAL 277 Ca 0.00 -0.77 -0.49 0.00 0.82 0.00 0.00 66.70 66.26 1n1t h VAL 277 Cb 0.27 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 1n1t h VAL 277 CO 0.00 0.23 -0.48 0.26 0.02 0.00 0.00 177.57 177.61 1n1t s TRP 278 N -5.10 3.31 0.27 1.57 0.51 -1.26 -0.60 118.94 117.64 1n1t s TRP 278 Ca -0.14 -0.04 -0.06 0.00 -2.12 0.00 0.00 56.10 53.75 1n1t s TRP 278 Cb 0.06 -1.51 0.02 0.00 -0.81 0.00 0.00 33.47 31.23 1n1t s TRP 278 CO 0.72 0.48 0.45 -2.37 -0.51 0.00 0.00 176.95 175.72 1n1t n THR 279 N -1.19 0.00 0.87 2.01 5.66 -1.26 -0.86 114.28 119.51 1n1t n THR 279 Ca -0.08 -1.02 0.11 0.00 -3.05 0.00 0.00 64.05 60.01 1n1t n THR 279 Cb 0.57 0.75 0.06 0.00 -1.55 0.00 0.00 70.33 70.16 1n1t n THR 279 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1n1t n ASN 280 N -1.59 0.69 -3.61 1.09 6.94 -1.26 -4.93 115.26 112.59 1n1t n ASN 280 Ca -0.03 -0.48 0.04 0.00 -0.02 0.00 0.00 54.58 54.09 1n1t n ASN 280 Cb 0.42 0.66 0.00 0.00 -2.36 0.00 0.00 39.78 38.51 1n1t n ASN 280 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 1n1t s SER 281 N -3.28 -0.01 0.40 0.53 1.04 -1.26 -4.62 113.70 106.50 1n1t s SER 281 Ca 0.08 -0.03 0.11 0.00 0.48 0.00 0.00 55.95 56.58 1n1t s SER 281 Cb 0.16 0.03 0.91 0.00 0.10 0.00 0.00 66.02 67.23 1n1t s SER 281 CO 0.79 -0.06 1.96 -0.65 0.98 0.00 0.00 173.24 176.25 1n1t h PRO 282 N 2.00 0.54 -0.02 4.02 0.11 -1.81 -2.60 132.00 134.24 1n1t h PRO 282 Ca -0.32 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1n1t h PRO 282 Cb 1.19 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1n1t h PRO 282 CO 0.30 0.36 -0.21 0.25 -0.21 0.00 0.00 178.00 178.48 1n1t n THR 283 N -4.48 0.00 -0.89 -1.15 -2.24 -1.26 -4.67 114.28 99.59 1n1t n THR 283 Ca 0.11 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1n1t n THR 283 Cb 0.34 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.62 1n1t n THR 283 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1n1t n SER 284 N 0.33 -3.39 -1.24 3.42 7.64 -0.98 -4.86 113.62 114.53 1n1t n SER 284 Ca 0.13 0.00 0.04 0.00 1.01 0.00 0.00 58.87 60.05 1n1t n SER 284 Cb 0.47 -2.29 0.28 0.00 -1.01 0.00 0.00 64.21 61.66 1n1t n SER 284 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1n1t n ASN 285 N -0.46 4.08 -4.77 6.43 6.94 -1.26 -2.36 115.26 123.86 1n1t n ASN 285 Ca 0.00 -3.16 -0.23 0.00 -0.02 0.00 0.00 54.58 51.18 1n1t n ASN 285 Cb 0.23 -0.61 -0.06 0.00 -2.36 0.00 0.00 39.78 36.98 1n1t n ASN 285 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 1n1t s GLN 286 N -2.92 2.44 0.24 -3.83 -1.52 -1.26 -4.67 119.66 108.13 1n1t s GLN 286 Ca 0.46 -1.53 -0.31 0.00 -1.95 0.00 0.00 55.36 52.04 1n1t s GLN 286 Cb 0.38 -2.23 -0.14 0.00 -0.22 0.00 0.00 33.01 30.80 1n1t s GLN 286 CO 0.09 0.06 1.25 0.94 -0.25 0.00 0.00 175.29 177.38 1n1t n GLN 287 N -1.23 1.65 -0.99 2.91 7.27 -1.26 -1.12 117.38 124.60 1n1t n GLN 287 Ca -0.02 0.59 -0.06 0.00 0.07 0.00 0.00 57.00 57.58 1n1t n GLN 287 Cb 0.61 -2.13 0.03 0.00 2.41 0.00 0.00 30.24 31.16 1n1t n GLN 287 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1n1t n ASP 288 N 1.80 0.28 -3.88 1.69 2.03 -1.26 -4.79 116.55 112.42 1n1t n ASP 288 Ca 0.12 -1.25 -0.10 0.00 0.52 0.00 0.00 54.79 54.07 1n1t n ASP 288 Cb 0.30 -0.17 -0.09 0.00 -0.72 0.00 0.00 41.12 40.44 1n1t n ASP 288 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1n1t s GLN 290 N -2.29 2.70 0.03 0.00 -0.44 -1.26 -4.79 119.66 113.60 1n1t s GLN 290 Ca -0.07 1.98 0.03 0.00 -2.50 0.00 0.00 55.36 54.79 1n1t s GLN 290 Cb -0.03 -1.87 -0.02 0.00 -1.64 0.00 0.00 33.01 29.45 1n1t s GLN 290 CO -0.03 -1.46 -0.08 -1.12 0.50 0.00 0.00 175.29 173.10 1n1t s SER 291 N -1.47 0.95 0.21 6.67 0.01 -1.26 -4.59 113.70 114.23 1n1t s SER 291 Ca 0.81 -0.41 -0.16 0.00 1.31 0.00 0.00 55.95 57.50 1n1t s SER 291 Cb -0.35 -0.02 -0.08 0.00 0.21 0.00 0.00 66.02 65.78 1n1t s SER 291 CO 0.37 -0.09 0.64 -0.94 0.41 0.00 0.00 173.24 173.64 1n1t s SER 292 N -1.11 6.86 -0.27 2.44 1.04 -1.23 -4.81 113.70 116.62 1n1t s SER 292 Ca -0.04 1.20 -0.00 0.00 0.48 0.00 0.00 55.95 57.59 1n1t s SER 292 Cb -0.07 -2.34 0.15 0.00 0.10 0.00 0.00 66.02 63.86 1n1t s SER 292 CO 0.00 -0.00 0.39 0.12 0.98 0.00 0.00 173.24 174.73 1n1t s PHE 293 N -1.63 -0.89 -0.00 5.02 5.36 -1.25 -1.77 117.98 122.81 1n1t s PHE 293 Ca 0.44 0.49 0.01 0.00 -0.96 0.00 0.00 56.93 56.91 1n1t s PHE 293 Cb -0.14 -0.11 -0.00 0.00 -0.34 0.00 0.00 43.02 42.43 1n1t s PHE 293 CO 0.20 -0.87 -0.03 0.54 -1.46 0.00 0.00 175.22 173.59 1n1t s VAL 294 N 2.53 0.23 -0.06 3.12 0.11 -0.59 -4.59 120.40 121.15 1n1t s VAL 294 Ca 0.11 -0.14 -0.14 0.00 -2.93 0.00 0.00 61.98 58.88 1n1t s VAL 294 Cb -0.14 -0.20 -0.05 0.00 -1.53 0.00 0.00 36.38 34.46 1n1t s VAL 294 CO -0.25 0.06 0.37 0.00 -3.33 0.00 0.00 175.10 171.95 1n1t s ALA 295 N -0.09 3.66 0.17 1.54 0.00 -1.26 -0.29 121.76 125.49 1n1t s ALA 295 Ca 0.01 -0.30 -0.03 0.00 0.00 0.00 0.00 51.96 51.65 1n1t s ALA 295 Cb -0.01 -2.38 -0.03 0.00 0.00 0.00 0.00 23.12 20.69 1n1t s ALA 295 CO -0.00 0.36 0.14 0.14 0.00 0.00 0.00 175.76 176.40 1n1t s VAL 296 N -0.55 0.04 -0.19 0.00 -7.23 -0.53 -5.00 120.40 106.95 1n1t s VAL 296 Ca 0.22 -1.87 -0.00 0.00 -1.81 0.00 0.00 61.98 58.52 1n1t s VAL 296 Cb -0.15 -2.24 0.02 0.00 0.56 0.00 0.00 36.38 34.56 1n1t s VAL 296 CO 0.10 -0.20 -0.16 -0.89 -0.31 0.00 0.00 175.10 173.64 1n1t s THR 297 N -4.09 2.38 -0.11 5.32 2.01 -1.26 -0.91 115.64 118.99 1n1t s THR 297 Ca 0.30 -0.88 0.02 0.00 0.31 0.00 0.00 61.69 61.44 1n1t s THR 297 Cb 0.06 -2.05 0.01 0.00 0.01 0.00 0.00 72.50 70.54 1n1t s THR 297 CO 0.07 0.48 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.68 1n1t s ILE 298 N 1.32 1.55 -1.46 1.82 1.01 -0.16 -4.70 121.20 120.59 1n1t s ILE 298 Ca 0.04 -0.68 -0.10 0.00 0.00 0.00 0.00 60.65 59.92 1n1t s ILE 298 Cb -0.14 -1.41 0.05 0.00 0.01 0.00 0.00 42.46 40.98 1n1t s ILE 298 CO -0.10 0.45 0.77 1.21 0.00 0.00 0.00 174.94 177.27 1n1t n GLU 299 N 4.11 -5.09 -1.00 2.79 4.07 -1.26 -1.45 120.64 122.82 1n1t n GLU 299 Ca -0.19 0.68 0.00 0.00 -0.06 0.00 0.00 57.16 57.59 1n1t n GLU 299 Cb 0.51 -5.54 0.00 0.00 -0.06 0.00 0.00 31.44 26.36 1n1t n GLU 299 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1n1t n GLY 300 N -1.55 0.96 3.32 8.31 0.00 -1.26 -4.96 105.19 110.02 1n1t n GLY 300 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 1n1t n GLY 300 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1n1t s LYS 301 N -0.01 3.06 0.07 1.61 2.20 -0.53 -5.09 119.74 121.05 1n1t s LYS 301 Ca 0.00 -0.78 -0.31 0.00 -0.36 0.00 0.00 55.97 54.52 1n1t s LYS 301 Cb 0.00 -2.43 -0.06 0.00 -1.51 0.00 0.00 37.83 33.83 1n1t s LYS 301 CO 0.00 0.28 1.27 0.50 -0.36 0.00 0.00 175.35 177.03 1n1t s ARG 302 N 0.15 4.39 0.13 4.03 6.06 -1.26 -0.99 118.95 131.46 1n1t s ARG 302 Ca -0.10 1.87 -0.01 0.00 -2.50 0.00 0.00 55.73 54.99 1n1t s ARG 302 Cb -0.16 -3.34 -0.04 0.00 0.06 0.00 0.00 34.95 31.48 1n1t s ARG 302 CO 0.06 -0.34 0.07 0.14 -2.50 0.00 0.00 175.30 172.73 1n1t s VAL 303 N 1.18 0.10 -0.07 7.11 -7.23 -0.08 -4.78 120.40 116.63 1n1t s VAL 303 Ca 0.61 -1.90 0.01 0.00 -1.81 0.00 0.00 61.98 58.89 1n1t s VAL 303 Cb -0.32 -2.06 -0.03 0.00 0.56 0.00 0.00 36.38 34.54 1n1t s VAL 303 CO 0.29 -0.44 -0.06 -0.04 -0.31 0.00 0.00 175.10 174.54 1n1t s MET 304 N -4.05 2.75 -0.07 4.82 1.00 0.48 -1.45 119.30 122.78 1n1t s MET 304 Ca 0.24 -0.55 0.02 0.00 0.00 0.00 0.00 55.69 55.41 1n1t s MET 304 Cb 0.07 -2.60 -0.03 0.00 0.00 0.00 0.00 34.83 32.28 1n1t s MET 304 CO 0.02 0.66 -0.12 -0.51 0.00 0.00 0.00 175.02 175.08 1n1t s LEU 305 N -0.85 2.86 -0.03 -0.03 1.43 0.60 -1.09 118.68 121.57 1n1t s LEU 305 Ca 0.13 -0.17 0.01 0.00 -1.03 0.00 0.00 54.13 53.07 1n1t s LEU 305 Cb -0.11 -1.60 0.01 0.00 0.03 0.00 0.00 46.19 44.52 1n1t s LEU 305 CO 0.02 0.32 -0.04 0.12 0.23 0.00 0.00 176.35 176.99 1n1t s PHE 306 N -0.55 0.62 0.06 0.29 5.36 -0.38 -1.54 117.98 121.84 1n1t s PHE 306 Ca 0.08 -0.14 0.09 0.00 -0.96 0.00 0.00 56.93 56.00 1n1t s PHE 306 Cb -0.12 -0.53 -0.03 0.00 -0.34 0.00 0.00 43.02 42.00 1n1t s PHE 306 CO 0.02 -0.13 -0.26 0.95 -1.46 0.00 0.00 175.22 174.34 1n1t s THR 307 N 0.61 2.21 -0.24 0.12 -4.23 -0.73 -0.50 115.64 112.87 1n1t s THR 307 Ca -0.08 -1.43 -0.26 0.00 -1.18 0.00 0.00 61.69 58.75 1n1t s THR 307 Cb -0.11 -1.88 0.11 0.00 1.34 0.00 0.00 72.50 71.96 1n1t s THR 307 CO -0.00 0.33 0.97 -2.28 -0.54 0.00 0.00 174.62 173.09 1n1t s HIS 308 N -0.85 -0.50 0.58 3.99 5.04 -0.66 -3.58 115.29 119.31 1n1t s HIS 308 Ca 0.12 1.14 -0.18 0.00 -1.54 0.00 0.00 55.06 54.60 1n1t s HIS 308 Cb -0.10 0.37 -0.04 0.00 0.04 0.00 0.00 32.58 32.85 1n1t s HIS 308 CO 0.03 -0.29 1.13 -2.14 -2.34 0.00 0.00 174.74 171.13 1n1t s PRO 309 N -0.11 3.15 0.27 2.88 0.02 -1.26 -1.11 135.00 138.84 1n1t s PRO 309 Ca 0.01 1.57 0.13 0.00 0.02 0.00 0.00 61.00 62.73 1n1t s PRO 309 Cb -0.04 -1.98 0.28 0.00 0.02 0.00 0.00 34.50 32.78 1n1t s PRO 309 CO -0.03 -1.01 1.54 -0.07 -0.33 0.00 0.00 177.00 177.11 1n1t h LEU 310 N 0.82 0.00 -1.33 -5.54 3.38 -0.41 -3.46 115.31 108.77 1n1t h LEU 310 Ca -0.49 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.06 1n1t h LEU 310 Cb 1.26 0.00 0.06 0.00 0.09 0.00 0.00 40.66 42.07 1n1t h LEU 310 CO 0.56 0.60 -0.77 -3.20 0.09 0.00 0.00 178.44 175.72 1n1t n ASN 311 N -3.50 -3.44 0.27 -0.43 5.15 -0.42 -4.11 115.26 108.78 1n1t n ASN 311 Ca 0.00 -0.72 0.14 0.00 -0.60 0.00 0.00 54.58 53.40 1n1t n ASN 311 Cb 0.68 -4.37 0.78 0.00 -0.53 0.00 0.00 39.78 36.34 1n1t n ASN 311 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1n1t h LEU 312 N -2.11 0.00 0.00 1.20 3.38 -1.92 -1.77 115.31 114.09 1n1t h LEU 312 Ca -0.59 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.38 1n1t h LEU 312 Cb 1.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.11 1n1t h LEU 312 CO 0.59 0.09 -0.19 0.11 0.09 0.00 0.00 178.44 179.12 1n1t h LYS 313 N 0.00 0.00 0.00 1.13 1.57 -1.92 -3.48 116.57 113.87 1n1t h LYS 313 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1n1t h LYS 313 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1n1t h LYS 313 CO 0.01 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.30 1n1t n GLY 314 N 1.17 -1.07 7.00 3.86 0.00 -0.67 -4.92 105.19 110.57 1n1t n GLY 314 Ca 0.04 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.44 1n1t n GLY 314 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n1t n ARG 315 N -0.96 0.00 -0.29 1.61 1.74 -1.26 -1.91 116.66 115.59 1n1t n ARG 315 Ca 0.00 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.18 1n1t n ARG 315 Cb 0.00 0.00 0.26 0.00 -1.02 0.00 0.00 32.46 31.70 1n1t n ARG 315 CO 0.00 0.00 0.00 -2.67 -1.52 0.00 0.00 177.63 173.44 1n1t n TRP 316 N 14.00 0.76 -0.07 -1.55 2.14 -1.26 -4.44 117.44 127.02 1n1t n TRP 316 Ca 0.00 -0.38 -0.09 0.00 2.07 0.00 0.00 57.50 59.10 1n1t n TRP 316 Cb 0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 31.31 30.48 1n1t n TRP 316 CO 0.00 0.00 0.00 0.52 2.07 0.00 0.00 177.69 180.28 1n1t h MET 317 N 3.43 0.36 -5.98 -2.67 0.00 -1.74 -3.47 114.93 104.87 1n1t h MET 317 Ca 0.00 -0.02 -0.42 0.00 0.00 0.00 0.00 59.70 59.26 1n1t h MET 317 Cb 0.78 -0.08 0.08 0.00 0.00 0.00 0.00 31.60 32.39 1n1t h MET 317 CO 0.00 0.24 -0.73 0.54 0.00 0.00 0.00 176.91 176.96 1n1t n ARG 318 N -4.90 -6.84 -1.57 1.72 1.74 -1.26 -3.31 116.66 102.24 1n1t n ARG 318 Ca -0.02 0.75 -0.32 0.00 -0.77 0.00 0.00 57.85 57.48 1n1t n ARG 318 Cb 0.02 -5.71 0.07 0.00 -1.02 0.00 0.00 32.46 25.82 1n1t n ARG 318 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 1n1t s ASP 319 N -3.53 4.83 -0.47 0.55 1.47 -1.26 -1.00 116.67 117.26 1n1t s ASP 319 Ca 0.49 1.97 -0.01 0.00 1.18 0.00 0.00 52.55 56.18 1n1t s ASP 319 Cb -0.23 -2.54 -0.01 0.00 -0.34 0.00 0.00 42.92 39.79 1n1t s ASP 319 CO 0.77 -1.82 0.43 0.54 0.68 0.00 0.00 175.17 175.77 1n1t n ARG 320 N -2.80 -0.91 -2.19 2.11 1.74 -1.23 -1.30 116.66 112.06 1n1t n ARG 320 Ca 0.10 0.86 -0.42 0.00 -0.77 0.00 0.00 57.85 57.61 1n1t n ARG 320 Cb 0.52 -3.89 -0.03 0.00 -1.02 0.00 0.00 32.46 28.05 1n1t n ARG 320 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1n1t s LEU 321 N -3.53 4.29 0.25 0.55 2.96 -1.26 -0.58 118.68 121.36 1n1t s LEU 321 Ca 0.09 2.07 0.09 0.00 -0.22 0.00 0.00 54.13 56.16 1n1t s LEU 321 Cb -0.01 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.09 1n1t s LEU 321 CO 0.41 -0.79 0.06 -1.00 -1.32 0.00 0.00 176.35 173.71 1n1t s HIS 322 N 3.07 2.83 -0.10 5.38 3.76 -0.27 -0.25 115.29 129.71 1n1t s HIS 322 Ca 0.65 -0.18 0.02 0.00 -0.15 0.00 0.00 55.06 55.40 1n1t s HIS 322 Cb -0.30 -1.27 0.01 0.00 1.11 0.00 0.00 32.58 32.13 1n1t s HIS 322 CO 0.25 0.58 -0.17 -1.17 -0.85 0.00 0.00 174.74 173.39 1n1t s LEU 323 N -3.66 1.81 0.15 0.89 2.96 -0.69 -1.65 118.68 118.49 1n1t s LEU 323 Ca 0.32 -0.45 0.09 0.00 -0.22 0.00 0.00 54.13 53.87 1n1t s LEU 323 Cb -0.07 -1.14 -0.04 0.00 0.50 0.00 0.00 46.19 45.44 1n1t s LEU 323 CO 0.21 0.05 -0.13 0.26 -1.32 0.00 0.00 176.35 175.42 1n1t s TRP 324 N 0.81 2.60 -0.07 5.38 0.51 0.34 -0.68 118.94 127.83 1n1t s TRP 324 Ca -0.10 -0.23 0.02 0.00 -2.12 0.00 0.00 56.10 53.67 1n1t s TRP 324 Cb -0.16 -1.31 0.02 0.00 -0.81 0.00 0.00 33.47 31.21 1n1t s TRP 324 CO 0.01 0.47 -0.11 1.41 -0.51 0.00 0.00 176.95 178.21 1n1t s MET 325 N -2.55 1.67 0.03 4.98 -2.45 0.17 -1.25 119.30 119.89 1n1t s MET 325 Ca 0.22 -0.39 0.02 0.00 -1.25 0.00 0.00 55.69 54.30 1n1t s MET 325 Cb -0.10 -1.43 -0.02 0.00 1.25 0.00 0.00 34.83 34.54 1n1t s MET 325 CO 0.13 -0.02 -0.07 -0.08 1.05 0.00 0.00 175.02 176.03 1n1t s THR 326 N 0.83 0.50 -0.30 10.11 -1.32 -0.25 -0.40 115.64 124.81 1n1t s THR 326 Ca -0.11 -0.92 0.10 0.00 -1.21 0.00 0.00 61.69 59.55 1n1t s THR 326 Cb -0.15 -0.55 0.63 0.00 -1.51 0.00 0.00 72.50 70.92 1n1t s THR 326 CO 0.02 -0.30 1.66 -0.90 -2.21 0.00 0.00 174.62 172.89 1n1t n ASP 327 N 1.73 3.89 -0.01 8.08 3.85 -1.11 -0.39 116.55 132.60 1n1t n ASP 327 Ca -0.21 -3.38 -0.00 0.00 -0.71 0.00 0.00 54.79 50.49 1n1t n ASP 327 Cb 0.55 -0.69 -0.00 0.00 -1.35 0.00 0.00 41.12 39.63 1n1t n ASP 327 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 1n1t n ASN 328 N -0.62 -4.08 0.03 -1.12 4.05 -1.26 -4.74 115.26 107.52 1n1t n ASN 328 Ca 0.38 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.41 1n1t n ASN 328 Cb 1.24 -1.59 0.00 0.00 1.23 0.00 0.00 39.78 40.65 1n1t n ASN 328 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1n1t n GLN 329 N -1.57 0.00 -3.31 1.20 6.02 -1.26 -4.92 117.38 113.54 1n1t n GLN 329 Ca -0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.68 1n1t n GLN 329 Cb 0.18 -0.05 -0.05 0.00 1.02 0.00 0.00 30.24 31.34 1n1t n GLN 329 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1n1t s ARG 330 N -1.28 3.81 -0.17 -1.09 3.00 -1.26 -4.82 118.95 117.14 1n1t s ARG 330 Ca 0.00 0.32 -0.02 0.00 0.00 0.00 0.00 55.73 56.03 1n1t s ARG 330 Cb 0.00 -2.59 0.05 0.00 0.00 0.00 0.00 34.95 32.41 1n1t s ARG 330 CO 0.00 0.24 -0.00 0.42 0.00 0.00 0.00 175.30 175.96 1n1t s ILE 331 N -1.93 0.78 -0.15 1.52 1.01 -1.26 -2.75 121.20 118.42 1n1t s ILE 331 Ca 0.48 -0.55 -0.05 0.00 0.00 0.00 0.00 60.65 60.54 1n1t s ILE 331 Cb -0.11 -1.11 -0.04 0.00 0.01 0.00 0.00 42.46 41.21 1n1t s ILE 331 CO 0.23 -0.03 0.03 0.12 0.00 0.00 0.00 174.94 175.29 1n1t s PHE 332 N 1.76 3.20 -0.49 3.97 5.36 0.46 -4.81 117.98 127.43 1n1t s PHE 332 Ca -0.00 0.06 -0.22 0.00 -0.96 0.00 0.00 56.93 55.81 1n1t s PHE 332 Cb -0.16 -1.97 0.04 0.00 -0.34 0.00 0.00 43.02 40.59 1n1t s PHE 332 CO -0.07 0.24 0.77 0.34 -1.46 0.00 0.00 175.22 175.03 1n1t s ASP 333 N -0.07 6.32 0.37 6.13 2.15 -1.26 -0.66 116.67 129.66 1n1t s ASP 333 Ca 0.05 -0.44 0.15 0.00 0.43 0.00 0.00 52.55 52.74 1n1t s ASP 333 Cb -0.12 -2.36 0.73 0.00 -0.30 0.00 0.00 42.92 40.86 1n1t s ASP 333 CO 0.02 -0.98 1.80 0.58 -0.17 0.00 0.00 175.17 176.41 1n1t h VAL 334 N 5.94 1.14 0.00 1.11 2.07 -1.25 -3.46 116.25 121.80 1n1t h VAL 334 Ca -0.26 -1.39 0.00 0.00 0.82 0.00 0.00 66.70 65.87 1n1t h VAL 334 Cb 1.09 1.78 0.00 0.00 -1.52 0.00 0.00 31.29 32.63 1n1t h VAL 334 CO 0.99 0.38 0.00 0.61 0.02 0.00 0.00 177.57 179.57 1n1t n GLY 335 N -0.22 0.74 3.70 2.17 0.00 -1.18 -3.80 105.19 106.60 1n1t n GLY 335 Ca -0.01 -2.12 -0.40 0.00 0.00 0.00 0.00 46.02 43.48 1n1t n GLY 335 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1n1t s GLN 336 N -1.00 4.37 -0.02 1.61 0.74 -0.20 -1.70 119.66 123.47 1n1t s GLN 336 Ca 0.00 0.88 0.21 0.00 0.05 0.00 0.00 55.36 56.50 1n1t s GLN 336 Cb 0.00 -3.49 -0.31 0.00 1.10 0.00 0.00 33.01 30.30 1n1t s GLN 336 CO 0.00 -0.07 0.54 0.44 -0.55 0.00 0.00 175.29 175.66 1n1t n ILE 337 N 4.13 0.00 -1.74 -2.34 -5.35 0.65 -2.19 119.36 112.53 1n1t n ILE 337 Ca 0.00 -0.40 -0.29 0.00 -0.27 0.00 0.00 62.75 61.79 1n1t n ILE 337 Cb 0.51 0.20 0.16 0.00 -1.74 0.00 0.00 39.64 38.77 1n1t n ILE 337 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1n1t s SER 338 N -4.17 3.23 -0.21 7.28 1.04 -1.22 -4.24 113.70 115.42 1n1t s SER 338 Ca -0.05 0.57 -0.06 0.00 0.48 0.00 0.00 55.95 56.90 1n1t s SER 338 Cb 0.14 -0.85 -0.03 0.00 0.10 0.00 0.00 66.02 65.38 1n1t s SER 338 CO 0.88 -2.68 0.02 -0.63 0.98 0.00 0.00 173.24 171.81 1n1t s ILE 339 N -3.58 4.12 0.00 -1.02 1.01 -1.26 -2.10 121.20 118.37 1n1t s ILE 339 Ca 0.69 -0.25 0.00 0.00 0.00 0.00 0.00 60.65 61.08 1n1t s ILE 339 Cb -0.08 -2.88 0.00 0.00 0.01 0.00 0.00 42.46 39.51 1n1t s ILE 339 CO 0.52 0.41 0.00 0.61 0.00 0.00 0.00 174.94 176.48 1n1t n GLY 340 N 4.36 2.91 1.76 6.18 0.00 -1.26 -2.39 105.19 116.75 1n1t n GLY 340 Ca -0.17 -0.24 0.07 0.00 0.00 0.00 0.00 46.02 45.68 1n1t n GLY 340 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1n1t n ASP 341 N 1.79 5.29 -4.75 1.61 2.03 -1.26 -4.62 116.55 116.63 1n1t n ASP 341 Ca 0.00 -2.78 -0.35 0.00 0.52 0.00 0.00 54.79 52.17 1n1t n ASP 341 Cb 0.00 -0.65 0.04 0.00 -0.72 0.00 0.00 41.12 39.78 1n1t n ASP 341 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 1n1t s GLU 342 N -2.49 2.92 0.08 -0.67 -1.05 -1.01 -4.81 118.70 111.67 1n1t s GLU 342 Ca 0.51 1.77 -0.30 0.00 -0.15 0.00 0.00 54.97 56.80 1n1t s GLU 342 Cb 0.38 -1.93 -0.06 0.00 -0.44 0.00 0.00 34.13 32.08 1n1t s GLU 342 CO 0.17 -1.24 1.12 -0.80 0.95 0.00 0.00 175.26 175.47 1n1t s ASN 343 N -1.72 7.20 0.00 0.83 0.01 -1.26 -3.58 114.94 116.41 1n1t s ASN 343 Ca 0.76 1.95 0.00 0.00 -0.71 0.00 0.00 52.86 54.86 1n1t s ASN 343 Cb -0.29 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 38.79 1n1t s ASN 343 CO 0.34 -0.36 0.00 -1.54 -1.51 0.00 0.00 177.10 174.04 1n1t n SER 344 N 3.52 0.00 0.00 -1.22 3.41 -0.17 -1.74 113.62 117.43 1n1t n SER 344 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 1n1t n SER 344 Cb 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 1n1t n SER 344 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n1t n GLY 345 N 5.00 -0.21 3.74 5.00 0.00 -1.22 -4.36 105.19 113.14 1n1t n GLY 345 Ca 0.00 -0.59 -0.35 0.00 0.00 0.00 0.00 46.02 45.08 1n1t n GLY 345 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1n1t s TYR 346 N -2.85 2.28 0.18 1.61 1.51 -1.26 -4.71 117.35 114.12 1n1t s TYR 346 Ca 0.00 1.55 -0.14 0.00 -1.01 0.00 0.00 57.07 57.46 1n1t s TYR 346 Cb 0.00 -3.45 0.01 0.00 -0.11 0.00 0.00 41.96 38.41 1n1t s TYR 346 CO 0.00 -2.33 0.44 -1.54 -1.11 0.00 0.00 175.55 171.01 1n1t s SER 347 N -1.86 -0.15 -0.07 2.29 1.04 -1.26 -1.43 113.70 112.25 1n1t s SER 347 Ca 0.75 -0.62 -0.13 0.00 0.48 0.00 0.00 55.95 56.43 1n1t s SER 347 Cb -0.29 0.53 0.03 0.00 0.10 0.00 0.00 66.02 66.39 1n1t s SER 347 CO 0.39 -1.00 0.33 -0.55 0.98 0.00 0.00 173.24 173.39 1n1t s SER 348 N -2.91 -0.28 -0.00 7.02 0.15 -0.01 -4.05 113.70 113.63 1n1t s SER 348 Ca 0.12 0.40 0.04 0.00 0.70 0.00 0.00 55.95 57.21 1n1t s SER 348 Cb 0.01 0.52 -0.01 0.00 -1.71 0.00 0.00 66.02 64.82 1n1t s SER 348 CO -0.02 -0.28 -0.13 0.68 1.20 0.00 0.00 173.24 174.69 1n1t s VAL 349 N -0.55 1.05 -0.03 4.45 -7.23 -1.26 -1.51 120.40 115.31 1n1t s VAL 349 Ca -0.07 -0.64 0.01 0.00 -1.81 0.00 0.00 61.98 59.47 1n1t s VAL 349 Cb -0.04 -0.89 0.02 0.00 0.56 0.00 0.00 36.38 36.03 1n1t s VAL 349 CO 0.02 0.23 -0.02 -0.22 -0.31 0.00 0.00 175.10 174.81 1n1t s LEU 350 N -0.47 1.39 -0.26 1.32 2.96 -0.25 -4.90 118.68 118.47 1n1t s LEU 350 Ca 0.04 -0.07 -0.03 0.00 -0.22 0.00 0.00 54.13 53.85 1n1t s LEU 350 Cb -0.06 -0.29 0.02 0.00 0.50 0.00 0.00 46.19 46.36 1n1t s LEU 350 CO -0.00 -0.05 -0.02 -0.47 -1.32 0.00 0.00 176.35 174.49 1n1t s TYR 351 N 0.75 3.08 -0.03 5.38 5.04 -1.26 -0.56 117.35 129.75 1n1t s TYR 351 Ca -0.08 -1.30 -0.01 0.00 -2.44 0.00 0.00 57.07 53.24 1n1t s TYR 351 Cb -0.12 -2.12 0.03 0.00 0.35 0.00 0.00 41.96 40.10 1n1t s TYR 351 CO -0.01 -0.66 0.03 0.21 -1.34 0.00 0.00 175.55 173.78 1n1t s LYS 352 N 1.40 0.08 -1.53 4.97 2.20 -0.12 -4.87 119.74 121.87 1n1t s LYS 352 Ca 0.02 0.21 -0.05 0.00 -0.36 0.00 0.00 55.97 55.78 1n1t s LYS 352 Cb -0.17 -0.44 0.05 0.00 -1.51 0.00 0.00 37.83 35.76 1n1t s LYS 352 CO -0.02 -0.22 0.38 -0.25 -0.36 0.00 0.00 175.35 174.89 1n1t n ASP 353 N 4.56 -0.62 -1.73 1.43 8.00 -1.26 -1.41 116.55 125.52 1n1t n ASP 353 Ca -0.19 -1.10 -0.17 0.00 0.71 0.00 0.00 54.79 54.04 1n1t n ASP 353 Cb 0.50 -2.51 -0.03 0.00 -0.02 0.00 0.00 41.12 39.07 1n1t n ASP 353 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1n1t n ASP 354 N -2.87 -5.03 -4.16 -2.24 4.64 -1.26 -5.01 116.55 100.63 1n1t n ASP 354 Ca -0.22 0.13 -0.22 0.00 -1.38 0.00 0.00 54.79 53.10 1n1t n ASP 354 Cb 0.64 -4.09 -0.14 0.00 -1.04 0.00 0.00 41.12 36.49 1n1t n ASP 354 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 1n1t s LYS 355 N -4.39 1.10 -0.09 -0.67 1.02 -0.50 -5.15 119.74 111.06 1n1t s LYS 355 Ca 0.00 -0.74 -0.01 0.00 0.02 0.00 0.00 55.97 55.24 1n1t s LYS 355 Cb 0.00 -1.12 -0.03 0.00 -0.52 0.00 0.00 37.83 36.16 1n1t s LYS 355 CO 0.00 0.29 -0.03 -1.17 -0.92 0.00 0.00 175.35 173.51 1n1t s LEU 356 N -0.94 3.35 0.08 3.17 2.96 -1.26 -0.94 118.68 125.09 1n1t s LEU 356 Ca 0.04 0.02 0.02 0.00 -0.22 0.00 0.00 54.13 53.98 1n1t s LEU 356 Cb -0.07 -1.76 -0.04 0.00 0.50 0.00 0.00 46.19 44.82 1n1t s LEU 356 CO 0.01 0.32 -0.07 -0.31 -1.32 0.00 0.00 176.35 174.99 1n1t s TYR 357 N -0.57 0.80 0.04 5.38 1.51 0.28 -1.12 117.35 123.66 1n1t s TYR 357 Ca 0.09 -0.80 0.03 0.00 -1.01 0.00 0.00 57.07 55.38 1n1t s TYR 357 Cb -0.12 -0.47 -0.02 0.00 -0.11 0.00 0.00 41.96 41.24 1n1t s TYR 357 CO 0.02 -0.15 -0.10 0.45 -1.11 0.00 0.00 175.55 174.67 1n1t s SER 358 N -2.60 1.11 -0.17 2.29 0.15 -0.49 -1.09 113.70 112.91 1n1t s SER 358 Ca 0.05 -0.46 0.01 0.00 0.70 0.00 0.00 55.95 56.25 1n1t s SER 358 Cb 0.01 -0.03 0.02 0.00 -1.71 0.00 0.00 66.02 64.32 1n1t s SER 358 CO -0.04 -0.09 -0.17 -0.22 1.20 0.00 0.00 173.24 173.93 1n1t s LEU 359 N -1.25 1.97 0.12 3.45 2.96 -0.57 -0.02 118.68 125.34 1n1t s LEU 359 Ca -0.04 -0.60 -0.09 0.00 -0.22 0.00 0.00 54.13 53.18 1n1t s LEU 359 Cb -0.08 -1.35 -0.00 0.00 0.50 0.00 0.00 46.19 45.26 1n1t s LEU 359 CO 0.01 -0.03 0.24 -1.38 -1.32 0.00 0.00 176.35 173.87 1n1t s HIS 360 N 1.37 0.25 0.38 5.38 -3.43 -0.67 -0.83 115.29 117.74 1n1t s HIS 360 Ca 0.05 -0.64 -0.25 0.00 -0.80 0.00 0.00 55.06 53.41 1n1t s HIS 360 Cb -0.13 -0.05 -0.09 0.00 -1.43 0.00 0.00 32.58 30.88 1n1t s HIS 360 CO -0.12 -0.63 1.06 -1.21 -2.00 0.00 0.00 174.74 171.84 1n1t s GLU 361 N -3.91 4.23 0.02 -0.38 2.02 -0.51 -0.80 118.70 119.37 1n1t s GLU 361 Ca 0.10 1.57 0.05 0.00 0.02 0.00 0.00 54.97 56.71 1n1t s GLU 361 Cb 0.04 -2.64 -0.02 0.00 0.10 0.00 0.00 34.13 31.61 1n1t s GLU 361 CO -0.06 -0.10 -0.16 0.96 0.02 0.00 0.00 175.26 175.92 1n1t s ILE 362 N -1.57 1.27 -0.13 -1.63 -4.36 -0.37 -3.65 121.20 110.75 1n1t s ILE 362 Ca 0.56 -0.92 -0.02 0.00 -0.26 0.00 0.00 60.65 60.01 1n1t s ILE 362 Cb -0.24 -1.11 0.04 0.00 1.25 0.00 0.00 42.46 42.41 1n1t s ILE 362 CO 0.30 0.17 0.01 0.21 0.24 0.00 0.00 174.94 175.87 1n1t s ASN 363 N -0.86 2.19 -0.16 4.36 3.04 -0.71 -1.31 114.94 121.48 1n1t s ASN 363 Ca 0.04 -0.41 0.01 0.00 0.04 0.00 0.00 52.86 52.55 1n1t s ASN 363 Cb -0.07 -0.54 0.02 0.00 -1.54 0.00 0.00 41.25 39.12 1n1t s ASN 363 CO 0.01 -0.23 -0.18 -0.89 -3.04 0.00 0.00 177.10 172.76 1n1t s THR 364 N 1.90 1.88 -1.76 -5.21 2.01 -1.01 -4.19 115.64 109.27 1n1t s THR 364 Ca 0.03 -0.84 -0.01 0.00 0.31 0.00 0.00 61.69 61.18 1n1t s THR 364 Cb -0.14 -1.72 0.00 0.00 0.01 0.00 0.00 72.50 70.65 1n1t s THR 364 CO -0.07 0.51 0.09 0.59 -0.69 0.00 0.00 174.62 175.06 1n1t n ASN 365 N 4.59 -5.97 -3.21 3.53 3.02 -1.26 -1.89 115.26 114.07 1n1t n ASN 365 Ca -0.20 -0.06 -0.23 0.00 -0.03 0.00 0.00 54.58 54.06 1n1t n ASN 365 Cb 0.50 -4.95 0.05 0.00 -0.61 0.00 0.00 39.78 34.77 1n1t n ASN 365 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1n1t n ASP 366 N -2.08 -6.13 -4.16 6.41 8.00 -1.26 -5.00 116.55 112.33 1n1t n ASP 366 Ca -0.23 -0.37 -0.32 0.00 0.71 0.00 0.00 54.79 54.58 1n1t n ASP 366 Cb 0.68 -4.92 -0.17 0.00 -0.02 0.00 0.00 41.12 36.70 1n1t n ASP 366 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1n1t s VAL 367 N -3.22 1.97 -0.08 2.53 1.01 -0.79 -4.53 120.40 117.29 1n1t s VAL 367 Ca 0.39 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.46 1n1t s VAL 367 Cb -0.18 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.44 1n1t s VAL 367 CO 0.49 0.53 -0.15 -0.31 0.00 0.00 0.00 175.10 175.66 1n1t s TYR 368 N 0.77 2.73 0.39 5.22 1.51 -1.26 -2.42 117.35 124.29 1n1t s TYR 368 Ca -0.09 -0.38 0.08 0.00 -1.01 0.00 0.00 57.07 55.67 1n1t s TYR 368 Cb -0.16 -1.71 -0.06 0.00 -0.11 0.00 0.00 41.96 39.92 1n1t s TYR 368 CO -0.00 0.00 0.07 -1.12 -1.11 0.00 0.00 175.55 173.39 1n1t s SER 369 N -0.27 4.17 -0.14 2.29 0.01 -0.43 -1.04 113.70 118.28 1n1t s SER 369 Ca 0.02 -1.14 0.02 0.00 1.31 0.00 0.00 55.95 56.15 1n1t s SER 369 Cb -0.13 -0.47 0.00 0.00 0.21 0.00 0.00 66.02 65.64 1n1t s SER 369 CO 0.03 -0.41 -0.20 -0.76 0.41 0.00 0.00 173.24 172.31 1n1t s LEU 370 N -3.78 2.25 -0.06 2.44 1.43 -0.54 -1.24 118.68 119.19 1n1t s LEU 370 Ca 0.37 -0.55 -0.04 0.00 -1.03 0.00 0.00 54.13 52.88 1n1t s LEU 370 Cb 0.04 -1.49 -0.04 0.00 0.03 0.00 0.00 46.19 44.74 1n1t s LEU 370 CO 0.20 0.09 0.16 0.68 0.23 0.00 0.00 176.35 177.71 1n1t s VAL 371 N 0.78 5.46 -0.29 -1.59 -7.23 0.02 -1.35 120.40 116.20 1n1t s VAL 371 Ca -0.07 -0.01 -0.08 0.00 -1.81 0.00 0.00 61.98 60.01 1n1t s VAL 371 Cb -0.16 -3.48 -0.00 0.00 0.56 0.00 0.00 36.38 33.30 1n1t s VAL 371 CO -0.00 0.45 0.10 0.12 -0.31 0.00 0.00 175.10 175.45 1n1t s PHE 372 N -1.20 3.14 -0.10 2.82 5.36 -0.01 -1.67 117.98 126.31 1n1t s PHE 372 Ca 0.22 -0.75 0.01 0.00 -0.96 0.00 0.00 56.93 55.46 1n1t s PHE 372 Cb -0.12 -2.28 -0.02 0.00 -0.34 0.00 0.00 43.02 40.26 1n1t s PHE 372 CO 0.13 -0.50 -0.14 0.08 -1.46 0.00 0.00 175.22 173.32 1n1t s VAL 373 N 1.56 2.98 -0.48 3.12 1.01 0.97 -1.57 120.40 127.99 1n1t s VAL 373 Ca 0.04 -0.71 -0.18 0.00 0.00 0.00 0.00 61.98 61.13 1n1t s VAL 373 Cb -0.17 -2.22 0.05 0.00 0.00 0.00 0.00 36.38 34.05 1n1t s VAL 373 CO 0.04 0.55 0.54 -0.13 0.00 0.00 0.00 175.10 176.09 1n1t s ARG 374 N 0.02 3.09 -1.30 2.72 0.52 -0.05 -1.39 118.95 122.56 1n1t s ARG 374 Ca -0.05 -0.95 -0.08 0.00 -0.52 0.00 0.00 55.73 54.13 1n1t s ARG 374 Cb -0.14 -4.08 0.15 0.00 0.52 0.00 0.00 34.95 31.40 1n1t s ARG 374 CO 0.04 -1.11 2.02 1.28 0.02 0.00 0.00 175.30 177.55 1n1t n LEU 375 N 5.86 7.02 -0.05 2.53 4.77 -0.28 -2.86 117.00 134.00 1n1t n LEU 375 Ca -0.08 -4.69 -0.14 0.00 -0.03 0.00 0.00 56.01 51.07 1n1t n LEU 375 Cb 0.45 -1.45 -0.12 0.00 -2.33 0.00 0.00 43.42 39.97 1n1t n LEU 375 CO 0.51 1.55 0.46 0.40 -1.33 0.00 0.00 177.39 178.98 1n1t h ILE 376 N 3.47 1.64 -0.51 -0.08 2.04 -1.81 -2.25 117.51 120.01 1n1t h ILE 376 Ca 0.47 -1.94 -0.06 0.00 1.00 0.00 0.00 64.86 64.33 1n1t h ILE 376 Cb 0.55 2.95 -0.02 0.00 -0.74 0.00 0.00 36.82 39.55 1n1t h ILE 376 CO 1.60 0.51 0.09 1.23 0.00 0.00 0.00 178.15 181.58 1n1t h GLY 377 N -0.77 0.85 0.91 5.37 0.00 -1.79 -2.45 103.07 105.20 1n1t h GLY 377 Ca -0.01 -0.51 -0.08 0.00 0.00 0.00 0.00 47.33 46.74 1n1t h GLY 377 CO 0.01 0.47 -0.10 0.83 0.00 0.00 0.00 176.54 177.76 1n1t h GLU 378 N 0.76 0.63 -0.79 4.80 3.07 -1.88 -2.64 114.58 118.52 1n1t h GLU 378 Ca 0.16 -0.25 -0.02 0.00 -0.50 0.00 0.00 59.36 58.75 1n1t h GLU 378 Cb 0.33 -0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 28.18 1n1t h GLU 378 CO 0.00 0.82 0.42 1.25 -1.40 0.00 0.00 179.01 180.11 1n1t h LEU 379 N 0.40 1.00 -0.60 1.33 5.85 -1.27 -0.25 115.31 121.77 1n1t h LEU 379 Ca 0.08 -0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.74 1n1t h LEU 379 Cb 0.60 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 1n1t h LEU 379 CO 0.04 0.81 0.36 -0.61 -0.34 0.00 0.00 178.44 178.69 1n1t h GLN 380 N 1.12 0.67 -0.35 1.25 4.15 -1.27 -0.68 115.11 120.00 1n1t h GLN 380 Ca 0.28 -0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.59 1n1t h GLN 380 Cb 0.05 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.58 1n1t h GLN 380 CO -0.04 0.45 -0.06 1.25 -1.93 0.00 0.00 178.83 178.49 1n1t h LEU 381 N 0.69 0.66 -0.66 -2.39 5.85 -1.05 -2.25 115.31 116.17 1n1t h LEU 381 Ca 0.25 -0.35 0.07 0.00 0.84 0.00 0.00 57.88 58.68 1n1t h LEU 381 Cb 0.06 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 40.85 1n1t h LEU 381 CO -0.12 0.85 0.34 0.24 -0.34 0.00 0.00 178.44 179.42 1n1t h MET 382 N 0.45 0.61 -0.68 1.25 2.86 -0.68 -0.67 114.93 118.07 1n1t h MET 382 Ca 0.09 -0.04 -0.07 0.00 -2.06 0.00 0.00 59.70 57.62 1n1t h MET 382 Cb 0.55 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 1n1t h MET 382 CO 0.03 0.40 0.14 0.87 1.06 0.00 0.00 176.91 179.41 1n1t h LYS 383 N 0.63 1.09 -0.62 1.72 1.57 -0.94 -0.12 116.57 119.90 1n1t h LYS 383 Ca 0.30 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1n1t h LYS 383 Cb 0.24 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.38 1n1t h LYS 383 CO -0.21 0.98 0.39 1.03 -0.57 0.00 0.00 179.45 181.07 1n1t h SER 384 N 1.03 0.73 -0.38 0.86 0.87 -0.81 -0.90 113.55 114.96 1n1t h SER 384 Ca 0.21 -0.04 -0.10 0.00 -1.23 0.00 0.00 61.79 60.62 1n1t h SER 384 Cb 0.39 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 1n1t h SER 384 CO 0.01 0.56 -0.17 0.58 -0.53 0.00 0.00 176.83 177.28 1n1t h VAL 385 N 0.84 1.28 -0.68 2.23 2.07 -0.78 -1.17 116.25 120.04 1n1t h VAL 385 Ca 0.22 -1.29 -0.03 0.00 0.82 0.00 0.00 66.70 66.42 1n1t h VAL 385 Cb -0.05 1.31 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 1n1t h VAL 385 CO -0.04 0.43 0.31 0.58 0.02 0.00 0.00 177.57 178.86 1n1t h VAL 386 N 0.58 1.22 -0.86 2.57 2.07 -0.81 -0.43 116.25 120.58 1n1t h VAL 386 Ca 0.09 -0.65 -0.03 0.00 0.82 0.00 0.00 66.70 66.93 1n1t h VAL 386 Cb 0.71 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 1n1t h VAL 386 CO 0.05 0.27 0.43 0.03 0.02 0.00 0.00 177.57 178.37 1n1t h ARG 387 N 0.97 1.24 -0.47 1.57 3.08 -0.84 -0.34 114.38 119.58 1n1t h ARG 387 Ca 0.23 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 1n1t h ARG 387 Cb 0.12 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 1n1t h ARG 387 CO -0.03 0.94 0.24 1.15 -1.07 0.00 0.00 179.97 181.20 1n1t h THR 388 N 1.23 1.18 -0.39 2.04 2.02 -0.19 0.18 112.91 118.97 1n1t h THR 388 Ca 0.30 -0.48 -0.03 0.00 0.77 0.00 0.00 66.41 66.97 1n1t h THR 388 Cb 0.10 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 67.13 1n1t h THR 388 CO -0.04 0.19 0.13 -0.50 0.37 0.00 0.00 175.52 175.67 1n1t h TRP 389 N 0.62 0.62 -0.42 3.16 6.55 -0.64 -0.92 115.95 124.92 1n1t h TRP 389 Ca 0.16 -0.06 -0.07 0.00 0.95 0.00 0.00 58.89 59.87 1n1t h TRP 389 Cb 0.09 -0.18 -0.01 0.00 -0.86 0.00 0.00 29.16 28.19 1n1t h TRP 389 CO -0.01 0.58 -0.03 0.87 -1.05 0.00 0.00 178.44 178.80 1n1t h LYS 390 N 0.49 0.76 -0.52 0.49 1.57 -0.92 -1.30 116.57 117.14 1n1t h LYS 390 Ca 0.13 -0.26 -0.05 0.00 -1.87 0.00 0.00 60.65 58.61 1n1t h LYS 390 Cb 0.24 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 1n1t h LYS 390 CO -0.01 0.85 0.15 1.49 -0.57 0.00 0.00 179.45 181.36 1n1t h GLU 391 N 0.59 0.82 -0.14 3.15 4.81 -0.73 0.15 114.58 123.22 1n1t h GLU 391 Ca 0.12 -0.19 -0.17 0.00 -0.13 0.00 0.00 59.36 58.99 1n1t h GLU 391 Cb 0.52 -0.11 0.01 0.00 0.63 0.00 0.00 28.75 29.80 1n1t h GLU 391 CO 0.03 0.77 -0.56 1.49 -0.73 0.00 0.00 179.01 180.00 1n1t h GLU 392 N 0.71 0.63 -0.73 1.92 4.57 -1.15 -0.64 114.58 119.89 1n1t h GLU 392 Ca 0.16 -0.49 0.02 0.00 -1.18 0.00 0.00 59.36 57.88 1n1t h GLU 392 Cb 0.30 0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.94 1n1t h GLU 392 CO -0.00 1.11 0.46 -0.44 -1.18 0.00 0.00 179.01 178.96 1n1t h ASP 393 N 0.29 0.77 -0.23 1.04 3.32 -1.15 -0.41 116.42 120.05 1n1t h ASP 393 Ca -0.03 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 56.88 1n1t h ASP 393 Cb 1.19 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.56 1n1t h ASP 393 CO 0.12 0.54 -0.31 0.78 -1.72 0.00 0.00 179.24 178.65 1n1t h ASN 394 N 0.92 0.76 0.06 6.45 2.35 -0.89 -0.69 115.58 124.53 1n1t h ASN 394 Ca 0.28 -0.31 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1n1t h ASN 394 Cb -0.02 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.14 1n1t h ASN 394 CO -0.10 1.02 -0.03 -0.74 -1.65 0.00 0.00 177.43 175.93 1n1t h HIS 395 N 0.62 -0.07 -0.37 1.19 2.76 -0.80 -2.00 115.15 116.47 1n1t h HIS 395 Ca 0.07 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.22 1n1t h HIS 395 Cb 0.83 0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.80 1n1t h HIS 395 CO 0.04 0.11 0.18 -0.07 -1.30 0.00 0.00 177.93 176.89 1n1t h LEU 396 N -0.25 0.48 -1.54 0.26 3.38 -0.97 -2.52 115.31 114.16 1n1t h LEU 396 Ca -0.01 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1n1t h LEU 396 Cb 0.22 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1n1t h LEU 396 CO 0.01 0.48 0.00 0.00 0.09 0.00 0.00 178.44 179.02 1n1t h ALA 397 N 1.03 1.00 -0.01 1.53 0.00 -1.05 -2.46 119.26 119.29 1n1t h ALA 397 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1n1t h ALA 397 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1n1t h ALA 397 CO -0.02 0.00 -0.50 0.43 0.00 0.00 0.00 179.25 179.16 1n1t n SER 398 N -2.52 1.56 -4.73 0.00 7.64 -0.76 -4.75 113.62 110.06 1n1t n SER 398 Ca -0.01 -1.23 -0.42 0.00 1.01 0.00 0.00 58.87 58.23 1n1t n SER 398 Cb 0.13 0.46 -0.03 0.00 -1.01 0.00 0.00 64.21 63.77 1n1t n SER 398 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1n1t s ILE 399 N -2.59 2.60 -0.65 0.44 1.01 -0.93 -4.93 121.20 116.15 1n1t s ILE 399 Ca 0.18 0.46 -0.23 0.00 0.00 0.00 0.00 60.65 61.06 1n1t s ILE 399 Cb 0.18 -3.29 0.07 0.00 0.01 0.00 0.00 42.46 39.42 1n1t s ILE 399 CO 0.61 0.05 0.98 0.00 0.00 0.00 0.00 174.94 176.58 1n1t s THR 401 N 4.13 3.79 0.41 0.00 -4.23 -1.26 -4.87 115.64 113.61 1n1t s THR 401 Ca 0.23 0.35 -0.27 0.00 -1.18 0.00 0.00 61.69 60.82 1n1t s THR 401 Cb -0.16 -3.54 -0.10 0.00 1.34 0.00 0.00 72.50 70.04 1n1t s THR 401 CO 0.11 -0.65 1.44 -2.84 -0.54 0.00 0.00 174.62 172.14 1n1t s PRO 402 N -5.17 3.91 0.59 3.99 0.02 -1.26 -0.92 135.00 136.16 1n1t s PRO 402 Ca 0.56 2.46 -0.19 0.00 0.02 0.00 0.00 61.00 63.85 1n1t s PRO 402 Cb -0.11 -2.81 -0.04 0.00 0.02 0.00 0.00 34.50 31.57 1n1t s PRO 402 CO 0.49 -0.65 1.19 0.14 -0.33 0.00 0.00 177.00 177.84 1n1t s VAL 403 N -1.17 2.74 0.32 3.83 -7.23 -1.26 -3.48 120.40 114.15 1n1t s VAL 403 Ca 0.57 0.45 0.11 0.00 -1.81 0.00 0.00 61.98 61.29 1n1t s VAL 403 Cb -0.44 -3.16 -0.06 0.00 0.56 0.00 0.00 36.38 33.28 1n1t s VAL 403 CO 0.59 -0.11 -0.14 0.68 -0.31 0.00 0.00 175.10 175.81 1n1t s VAL 404 N -1.67 2.34 0.54 1.32 -7.23 -1.26 -4.93 120.40 109.52 1n1t s VAL 404 Ca 0.76 -2.30 0.31 0.00 -1.81 0.00 0.00 61.98 58.94 1n1t s VAL 404 Cb -0.29 -2.49 0.46 0.00 0.56 0.00 0.00 36.38 34.63 1n1t s VAL 404 CO 0.33 -0.29 1.90 -0.65 -0.31 0.00 0.00 175.10 176.07 1n1t h PRO 405 N 2.13 0.00 -1.66 4.82 0.11 -2.05 -3.51 132.00 131.84 1n1t h PRO 405 Ca -0.41 0.00 -0.68 0.00 0.11 0.00 0.00 66.00 65.01 1n1t h PRO 405 Cb 1.25 0.00 -0.33 0.00 0.11 0.00 0.00 31.00 32.03 1n1t h PRO 405 CO 0.66 0.00 0.30 0.00 -0.21 0.00 0.00 178.00 178.74 1n1t n ALA 406 N -2.67 5.90 -0.07 -0.75 0.00 -1.26 -5.30 120.51 116.37 1n1t n ALA 406 Ca 0.17 -4.12 -0.02 0.00 0.00 0.00 0.00 53.44 49.47 1n1t n ALA 406 Cb 0.90 -1.36 -0.02 0.00 0.00 0.00 0.00 19.45 18.98 1n1t n ALA 406 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n1t n GLY 413 N -0.56 -0.45 3.61 0.00 0.00 -1.26 -5.08 105.19 101.44 1n1t n GLY 413 Ca 0.49 0.20 -0.24 0.00 0.00 0.00 0.00 46.02 46.47 1n1t n GLY 413 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1t n GLY 415 N -0.68 -0.81 3.76 0.00 0.00 -0.10 -4.78 105.19 102.59 1n1t n GLY 415 Ca -0.07 -1.64 -0.35 0.00 0.00 0.00 0.00 46.02 43.96 1n1t n GLY 415 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1t s ALA 416 N -3.99 2.57 0.47 4.61 0.00 -1.26 -4.59 121.76 119.57 1n1t s ALA 416 Ca 0.00 0.90 -0.23 0.00 0.00 0.00 0.00 51.96 52.63 1n1t s ALA 416 Cb 0.00 -3.41 -0.07 0.00 0.00 0.00 0.00 23.12 19.64 1n1t s ALA 416 CO 0.00 -1.07 1.26 0.00 0.00 0.00 0.00 175.76 175.95 1n1t s ALA 417 N -1.73 3.01 0.12 0.00 0.00 -1.26 -4.59 121.76 117.31 1n1t s ALA 417 Ca 0.75 1.13 -0.33 0.00 0.00 0.00 0.00 51.96 53.52 1n1t s ALA 417 Cb -0.27 -3.46 -0.12 0.00 0.00 0.00 0.00 23.12 19.26 1n1t s ALA 417 CO 0.32 -0.91 1.75 0.28 0.00 0.00 0.00 175.76 177.20 1n1t n VAL 418 N -0.47 0.22 -1.88 0.00 0.31 -1.26 -4.87 118.33 110.37 1n1t n VAL 418 Ca 0.07 -0.04 -0.42 0.00 -0.01 0.00 0.00 64.34 63.94 1n1t n VAL 418 Cb 0.46 -1.90 -0.03 0.00 -0.91 0.00 0.00 33.84 31.46 1n1t n VAL 418 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1n1t s PRO 419 N 2.08 4.19 -0.00 5.55 0.04 -1.26 -4.47 135.00 141.12 1n1t s PRO 419 Ca 0.81 2.41 0.01 0.00 0.04 0.00 0.00 61.00 64.28 1n1t s PRO 419 Cb -0.57 -3.24 -0.02 0.00 0.04 0.00 0.00 34.50 30.72 1n1t s PRO 419 CO 0.38 -0.67 0.03 0.25 0.04 0.00 0.00 177.00 177.03 1n1t n THR 420 N 4.14 0.00 -2.17 1.26 -2.24 -1.26 -4.83 114.28 109.18 1n1t n THR 420 Ca 0.15 -0.04 -0.42 0.00 -2.27 0.00 0.00 64.05 61.46 1n1t n THR 420 Cb 0.38 0.50 -0.03 0.00 -2.10 0.00 0.00 70.33 69.08 1n1t n THR 420 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1n1t s ALA 421 N -2.04 3.60 0.00 6.98 0.00 -1.26 -1.99 121.76 127.05 1n1t s ALA 421 Ca -0.00 0.92 0.00 0.00 0.00 0.00 0.00 51.96 52.88 1n1t s ALA 421 Cb 0.01 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1n1t s ALA 421 CO 0.05 -0.98 0.00 0.41 0.00 0.00 0.00 175.76 175.24 1n1t n GLY 422 N 3.73 0.55 3.61 0.00 0.00 -1.26 -4.93 105.19 106.88 1n1t n GLY 422 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 1n1t n GLY 422 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1n1t s LEU 423 N 0.00 3.69 -0.20 0.99 0.20 -0.84 -1.28 118.68 121.24 1n1t s LEU 423 Ca 0.00 0.62 -0.09 0.00 0.69 0.00 0.00 54.13 55.35 1n1t s LEU 423 Cb 0.00 -3.55 -0.20 0.00 -0.43 0.00 0.00 46.19 42.01 1n1t s LEU 423 CO 0.00 -1.20 0.08 0.52 -0.29 0.00 0.00 176.35 175.46 1n1t n VAL 424 N 6.68 1.62 -3.85 1.68 0.31 0.45 -4.74 118.33 120.49 1n1t n VAL 424 Ca 0.12 -0.45 -0.10 0.00 -0.01 0.00 0.00 64.34 63.90 1n1t n VAL 424 Cb 0.48 -1.76 -0.08 0.00 -0.91 0.00 0.00 33.84 31.58 1n1t n VAL 424 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1n1t s GLY 425 N -5.62 0.05 -0.19 2.92 0.00 -1.08 -4.66 107.32 98.74 1n1t s GLY 425 Ca -0.29 -0.36 -0.08 0.00 0.00 0.00 0.00 44.72 43.99 1n1t s GLY 425 CO 0.65 -0.53 0.42 -0.12 0.00 0.00 0.00 173.10 173.51 1n1t s PHE 426 N -2.81 -0.75 -0.24 1.90 5.99 -1.26 -0.90 117.98 119.91 1n1t s PHE 426 Ca -0.03 1.47 -0.06 0.00 0.00 0.00 0.00 56.93 58.31 1n1t s PHE 426 Cb 0.00 0.30 -0.02 0.00 0.00 0.00 0.00 43.02 43.30 1n1t s PHE 426 CO -0.05 -0.45 0.02 -0.51 -0.00 0.00 0.00 175.22 174.23 1n1t s LEU 427 N 2.28 3.23 0.00 6.12 1.43 0.37 -0.25 118.68 131.86 1n1t s LEU 427 Ca -0.04 -0.32 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 1n1t s LEU 427 Cb -0.11 -1.84 0.00 0.00 0.03 0.00 0.00 46.19 44.27 1n1t s LEU 427 CO -0.13 -0.04 0.00 -0.24 0.23 0.00 0.00 176.35 176.17 1n1t n SER 428 N 4.87 0.00 -0.14 2.29 2.88 -1.26 -0.77 113.62 121.49 1n1t n SER 428 Ca -0.17 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.26 1n1t n SER 428 Cb 0.51 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.96 1n1t n SER 428 CO 0.00 0.00 0.00 -0.74 -1.23 0.00 0.00 175.04 173.07 1n1t h HIS 429 N 0.00 0.96 -2.81 0.66 2.76 -1.90 -3.21 115.15 111.61 1n1t h HIS 429 Ca 0.00 -0.22 -0.54 0.00 -2.20 0.00 0.00 60.37 57.41 1n1t h HIS 429 Cb 0.00 -0.23 -0.00 0.00 1.55 0.00 0.00 27.41 28.73 1n1t h HIS 429 CO 0.00 0.97 0.92 -1.12 -1.30 0.00 0.00 177.93 177.40 1n1t s SER 430 N -6.50 6.78 0.06 3.26 0.01 -1.26 -4.56 113.70 111.49 1n1t s SER 430 Ca -0.12 2.16 -0.28 0.00 1.31 0.00 0.00 55.95 59.02 1n1t s SER 430 Cb 0.11 -2.55 0.09 0.00 0.21 0.00 0.00 66.02 63.87 1n1t s SER 430 CO 0.83 -0.79 1.00 0.00 0.41 0.00 0.00 173.24 174.70 1n1t s ALA 431 N 2.86 -1.82 0.00 1.44 0.00 -1.26 -1.99 121.76 120.98 1n1t s ALA 431 Ca 0.66 0.59 0.00 0.00 0.00 0.00 0.00 51.96 53.21 1n1t s ALA 431 Cb -0.32 0.48 0.00 0.00 0.00 0.00 0.00 23.12 23.27 1n1t s ALA 431 CO 0.27 -0.90 0.00 0.27 0.00 0.00 0.00 175.76 175.40 1n1t n ASN 432 N -0.38 0.16 0.21 0.00 0.23 -0.06 -4.99 115.26 110.43 1n1t n ASN 432 Ca -0.07 0.00 0.07 0.00 -0.53 0.00 0.00 54.58 54.06 1n1t n ASN 432 Cb 0.61 0.00 0.46 0.00 -2.08 0.00 0.00 39.78 38.77 1n1t n ASN 432 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 1n1t h GLY 433 N 0.00 0.00 0.00 4.83 0.00 -1.96 -3.35 103.07 102.59 1n1t h GLY 433 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1n1t h GLY 433 CO 0.00 0.00 -0.40 -1.14 0.00 0.00 0.00 176.54 175.00 1n1t n SER 434 N -3.66 2.02 -4.04 0.19 3.41 -1.26 -4.43 113.62 105.85 1n1t n SER 434 Ca -0.01 -0.23 -0.23 0.00 -0.26 0.00 0.00 58.87 58.14 1n1t n SER 434 Cb 0.41 0.87 -0.16 0.00 -0.26 0.00 0.00 64.21 65.07 1n1t n SER 434 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1n1t s VAL 435 N -1.28 1.05 -0.28 -3.33 1.01 -1.26 -0.82 120.40 115.50 1n1t s VAL 435 Ca 0.00 -0.49 -0.07 0.00 0.00 0.00 0.00 61.98 61.42 1n1t s VAL 435 Cb 0.00 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.44 1n1t s VAL 435 CO 0.00 0.32 0.07 0.86 0.00 0.00 0.00 175.10 176.35 1n1t s TRP 436 N 0.29 3.11 0.09 5.22 -0.11 0.01 -0.88 118.94 126.67 1n1t s TRP 436 Ca -0.06 -0.76 -0.30 0.00 1.22 0.00 0.00 56.10 56.20 1n1t s TRP 436 Cb -0.11 -2.25 -0.05 0.00 -1.50 0.00 0.00 33.47 29.56 1n1t s TRP 436 CO 0.02 -0.49 1.01 -1.21 -4.62 0.00 0.00 176.95 171.65 1n1t s GLU 437 N 1.55 4.63 -0.04 5.86 2.02 -0.84 -1.44 118.70 130.43 1n1t s GLU 437 Ca 0.04 1.51 -0.30 0.00 0.02 0.00 0.00 54.97 56.25 1n1t s GLU 437 Cb -0.16 -3.38 -0.05 0.00 0.10 0.00 0.00 34.13 30.64 1n1t s GLU 437 CO 0.03 0.09 1.46 0.34 0.02 0.00 0.00 175.26 177.20 1n1t s ASP 438 N 0.30 6.80 0.48 -0.19 2.15 -1.26 -4.26 116.67 120.68 1n1t s ASP 438 Ca 0.49 2.10 0.16 0.00 0.43 0.00 0.00 52.55 55.73 1n1t s ASP 438 Cb -0.24 -2.55 1.16 0.00 -0.30 0.00 0.00 42.92 40.99 1n1t s ASP 438 CO 0.30 -0.79 2.04 0.58 -0.17 0.00 0.00 175.17 177.13 1n1t h VAL 439 N 5.19 0.91 -0.23 1.11 2.07 -1.00 -0.36 116.25 123.95 1n1t h VAL 439 Ca -0.37 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1n1t h VAL 439 Cb 1.17 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 1n1t h VAL 439 CO 0.93 0.04 0.00 -1.22 0.02 0.00 0.00 177.57 177.34 1n1t n TYR 440 N -4.47 0.31 -1.32 1.57 4.02 -1.26 -4.93 117.16 111.08 1n1t n TYR 440 Ca 0.05 -0.15 -0.11 0.00 -0.01 0.00 0.00 57.90 57.68 1n1t n TYR 440 Cb 0.31 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.58 1n1t n TYR 440 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1n1t n ARG 441 N 0.32 -0.81 -0.05 -0.72 1.74 -0.14 -4.89 116.66 112.10 1n1t n ARG 441 Ca 0.13 0.88 -0.11 0.00 -0.77 0.00 0.00 57.85 57.98 1n1t n ARG 441 Cb 0.29 -4.85 -0.04 0.00 -1.02 0.00 0.00 32.46 26.84 1n1t n ARG 441 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1n1t s VAL 443 N -2.40 1.00 0.70 0.00 1.01 -1.26 -4.91 120.40 114.55 1n1t s VAL 443 Ca -0.19 -1.23 -0.11 0.00 0.00 0.00 0.00 61.98 60.45 1n1t s VAL 443 Cb 0.05 -1.61 0.01 0.00 0.00 0.00 0.00 36.38 34.83 1n1t s VAL 443 CO 0.26 -0.46 1.07 -1.81 0.00 0.00 0.00 175.10 174.15 1n1t s ASP 444 N 1.59 5.40 0.05 3.32 1.01 -1.26 -4.31 116.67 122.46 1n1t s ASP 444 Ca 0.05 1.45 0.00 0.00 0.71 0.00 0.00 52.55 54.76 1n1t s ASP 444 Cb -0.18 -2.33 -0.04 0.00 1.01 0.00 0.00 42.92 41.38 1n1t s ASP 444 CO -0.17 -1.41 0.19 0.00 0.21 0.00 0.00 175.17 173.99 1n1t s ALA 445 N -3.13 3.95 -0.10 5.23 0.00 -0.52 -4.54 121.76 122.65 1n1t s ALA 445 Ca 0.58 -0.85 -0.12 0.00 0.00 0.00 0.00 51.96 51.57 1n1t s ALA 445 Cb -0.13 -1.79 -0.05 0.00 0.00 0.00 0.00 23.12 21.15 1n1t s ALA 445 CO 0.54 0.81 0.27 -0.80 0.00 0.00 0.00 175.76 176.59 1n1t s ASN 446 N -2.43 6.53 0.08 0.00 0.01 -0.03 -0.81 114.94 118.29 1n1t s ASN 446 Ca 0.33 0.62 0.10 0.00 -0.71 0.00 0.00 52.86 53.21 1n1t s ASN 446 Cb -0.13 -2.16 -0.03 0.00 0.41 0.00 0.00 41.25 39.33 1n1t s ASN 446 CO 0.26 0.27 -0.25 -0.69 -1.51 0.00 0.00 177.10 175.18 1n1t s VAL 447 N -0.50 2.29 0.02 1.60 1.01 -0.00 -0.46 120.40 124.35 1n1t s VAL 447 Ca 0.18 -1.53 0.00 0.00 0.00 0.00 0.00 61.98 60.63 1n1t s VAL 447 Cb -0.14 -1.96 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 1n1t s VAL 447 CO 0.07 0.24 -0.03 0.00 0.00 0.00 0.00 175.10 175.37 1n1t s ALA 448 N -0.94 0.14 -1.26 5.51 0.00 -0.60 -4.46 121.76 120.14 1n1t s ALA 448 Ca 0.13 -0.47 -0.20 0.00 0.00 0.00 0.00 51.96 51.43 1n1t s ALA 448 Cb -0.10 0.10 0.01 0.00 0.00 0.00 0.00 23.12 23.13 1n1t s ALA 448 CO 0.04 -0.11 0.59 0.09 0.00 0.00 0.00 175.76 176.38 1n1t n ASN 449 N 1.94 -3.25 -4.27 0.00 3.02 -1.26 -1.91 115.26 109.53 1n1t n ASN 449 Ca -0.21 -1.15 -0.16 0.00 -0.03 0.00 0.00 54.58 53.03 1n1t n ASN 449 Cb 0.56 -2.50 -0.10 0.00 -0.61 0.00 0.00 39.78 37.12 1n1t n ASN 449 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n1t s ALA 450 N -3.69 1.59 -0.01 5.41 0.00 -1.26 -1.19 121.76 122.62 1n1t s ALA 450 Ca 0.34 -1.48 0.04 0.00 0.00 0.00 0.00 51.96 50.86 1n1t s ALA 450 Cb -0.16 -0.02 -0.01 0.00 0.00 0.00 0.00 23.12 22.94 1n1t s ALA 450 CO 0.92 -0.01 -0.12 -2.00 0.00 0.00 0.00 175.76 174.56 1n1t s GLU 451 N -3.43 0.93 0.32 0.00 2.12 0.13 -4.94 118.70 113.83 1n1t s GLU 451 Ca 0.16 -0.42 -0.28 0.00 0.36 0.00 0.00 54.97 54.79 1n1t s GLU 451 Cb -0.00 -0.90 -0.09 0.00 0.26 0.00 0.00 34.13 33.39 1n1t s GLU 451 CO 0.03 0.25 1.14 1.03 -0.54 0.00 0.00 175.26 177.16 1n1t s ARG 452 N -0.28 4.45 0.20 4.30 0.52 -1.26 -0.68 118.95 126.20 1n1t s ARG 452 Ca 0.04 1.85 0.02 0.00 -0.52 0.00 0.00 55.73 57.12 1n1t s ARG 452 Cb -0.04 -3.02 -0.05 0.00 0.52 0.00 0.00 34.95 32.36 1n1t s ARG 452 CO -0.00 0.03 0.01 0.14 0.02 0.00 0.00 175.30 175.50 1n1t s VAL 453 N -1.25 0.74 0.05 3.52 -7.23 -0.69 -4.84 120.40 110.70 1n1t s VAL 453 Ca 0.49 -2.00 -0.35 0.00 -1.81 0.00 0.00 61.98 58.31 1n1t s VAL 453 Cb -0.32 -2.23 -0.14 0.00 0.56 0.00 0.00 36.38 34.25 1n1t s VAL 453 CO 0.41 -0.38 1.64 -2.65 -0.31 0.00 0.00 175.10 173.81 1n1t n PRO 454 N -0.31 1.96 -1.35 4.82 -0.02 -1.26 -1.98 135.00 136.86 1n1t n PRO 454 Ca -0.05 0.71 -0.12 0.00 -2.02 0.00 0.00 63.50 62.02 1n1t n PRO 454 Cb 0.64 -2.48 -0.05 0.00 -0.02 0.00 0.00 33.50 31.59 1n1t n PRO 454 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1n1t n ASN 455 N 4.30 -4.92 0.00 2.55 3.02 -1.26 -4.84 115.26 114.12 1n1t n ASN 455 Ca 0.19 0.30 0.00 0.00 -0.03 0.00 0.00 54.58 55.04 1n1t n ASN 455 Cb 0.27 -3.48 0.00 0.00 -0.61 0.00 0.00 39.78 35.96 1n1t n ASN 455 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1n1t n GLY 456 N -0.88 -0.75 3.00 7.41 0.00 -0.84 -1.75 105.19 111.38 1n1t n GLY 456 Ca -0.12 -0.32 -0.11 0.00 0.00 0.00 0.00 46.02 45.47 1n1t n GLY 456 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n1t s LEU 457 N 0.00 1.89 -0.15 0.99 1.43 -0.66 -1.71 118.68 120.48 1n1t s LEU 457 Ca 0.00 -0.20 -0.03 0.00 -1.03 0.00 0.00 54.13 52.87 1n1t s LEU 457 Cb 0.00 0.29 -0.03 0.00 0.03 0.00 0.00 46.19 46.49 1n1t s LEU 457 CO 0.00 -0.22 -0.06 -0.75 0.23 0.00 0.00 176.35 175.55 1n1t s LYS 458 N -0.91 3.57 -0.12 1.70 2.20 0.15 -0.75 119.74 125.58 1n1t s LYS 458 Ca -0.10 -0.55 -0.04 0.00 -0.36 0.00 0.00 55.97 54.92 1n1t s LYS 458 Cb -0.06 -2.84 -0.04 0.00 -1.51 0.00 0.00 37.83 33.38 1n1t s LYS 458 CO 0.00 0.26 0.05 -0.06 -0.36 0.00 0.00 175.35 175.24 1n1t s PHE 459 N 0.28 3.29 -0.29 4.03 0.40 -0.25 -0.70 117.98 124.75 1n1t s PHE 459 Ca -0.05 0.24 -0.02 0.00 -0.60 0.00 0.00 56.93 56.50 1n1t s PHE 459 Cb -0.14 -1.90 0.17 0.00 0.51 0.00 0.00 43.02 41.66 1n1t s PHE 459 CO 0.03 0.46 0.56 1.21 0.70 0.00 0.00 175.22 178.19 1n1t s ASN 460 N -0.62 -1.08 0.00 1.36 3.84 -0.34 -3.97 114.94 114.14 1n1t s ASN 460 Ca 0.11 0.84 0.00 0.00 0.21 0.00 0.00 52.86 54.02 1n1t s ASN 460 Cb -0.12 1.99 0.00 0.00 -0.55 0.00 0.00 41.25 42.58 1n1t s ASN 460 CO 0.02 -0.26 0.00 0.61 -2.79 0.00 0.00 177.10 174.68 1n1t n GLY 461 N 5.42 3.05 3.69 1.21 0.00 -1.26 -4.62 105.19 112.67 1n1t n GLY 461 Ca -0.03 -1.86 -0.42 0.00 0.00 0.00 0.00 46.02 43.72 1n1t n GLY 461 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n1t s VAL 462 N -2.01 2.73 -0.38 1.61 1.01 -1.26 -1.25 120.40 120.85 1n1t s VAL 462 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.12 1n1t s VAL 462 Cb 0.00 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.29 1n1t s VAL 462 CO 0.00 -0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.71 1n1t n GLY 463 N 4.24 0.65 3.67 4.51 0.00 0.44 -4.81 105.19 113.88 1n1t n GLY 463 Ca 0.18 -0.50 -0.45 0.00 0.00 0.00 0.00 46.02 45.25 1n1t n GLY 463 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n1t n GLY 464 N -2.14 1.66 0.00 -0.02 0.00 -0.38 -4.10 105.19 100.21 1n1t n GLY 464 Ca -0.04 0.83 0.00 0.00 0.00 0.00 0.00 46.02 46.81 1n1t n GLY 464 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n1t n GLY 465 N 4.45 -1.55 3.07 -0.02 0.00 -0.80 -1.73 105.19 108.60 1n1t n GLY 465 Ca 0.21 -1.36 -0.18 0.00 0.00 0.00 0.00 46.02 44.69 1n1t n GLY 465 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1t s ALA 466 N -1.33 0.84 -0.22 4.61 0.00 0.21 -1.56 121.76 124.32 1n1t s ALA 466 Ca 0.00 -0.62 -0.04 0.00 0.00 0.00 0.00 51.96 51.30 1n1t s ALA 466 Cb 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 1n1t s ALA 466 CO 0.00 0.15 -0.04 0.08 0.00 0.00 0.00 175.76 175.95 1n1t s VAL 467 N -0.69 3.45 -0.47 0.00 1.01 0.39 -1.16 120.40 122.93 1n1t s VAL 467 Ca -0.00 -0.47 -0.10 0.00 0.00 0.00 0.00 61.98 61.41 1n1t s VAL 467 Cb -0.06 -2.57 0.11 0.00 0.00 0.00 0.00 36.38 33.86 1n1t s VAL 467 CO 0.00 0.42 0.35 0.86 0.00 0.00 0.00 175.10 176.74 1n1t s TRP 468 N 1.40 3.39 0.36 5.22 -0.00 -0.02 -0.85 118.94 128.44 1n1t s TRP 468 Ca 0.05 -1.74 -0.27 0.00 -0.00 0.00 0.00 56.10 54.14 1n1t s TRP 468 Cb -0.14 -3.43 -0.09 0.00 -0.00 0.00 0.00 33.47 29.80 1n1t s TRP 468 CO -0.02 -0.97 1.28 -1.25 -0.00 0.00 0.00 176.95 175.99 1n1t s PRO 469 N 1.40 4.20 0.00 5.86 0.04 -1.26 -0.77 135.00 144.47 1n1t s PRO 469 Ca 0.05 2.13 0.00 0.00 0.04 0.00 0.00 61.00 63.22 1n1t s PRO 469 Cb -0.26 -2.92 0.00 0.00 0.04 0.00 0.00 34.50 31.36 1n1t s PRO 469 CO 0.00 -0.29 0.00 0.28 0.04 0.00 0.00 177.00 177.03 1n1t n VAL 470 N 0.50 0.00 0.25 -0.36 0.31 -0.47 -4.54 118.33 114.02 1n1t n VAL 470 Ca 0.02 0.00 0.08 0.00 -0.01 0.00 0.00 64.34 64.42 1n1t n VAL 470 Cb 0.43 -0.05 0.62 0.00 -0.91 0.00 0.00 33.84 33.93 1n1t n VAL 470 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1n1t h ALA 471 N 0.50 1.85 0.00 3.52 0.00 -0.77 -1.39 119.26 122.96 1n1t h ALA 471 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1n1t h ALA 471 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1n1t h ALA 471 CO 0.00 0.08 0.00 0.54 0.00 0.00 0.00 179.25 179.87 1n1t n ARG 472 N -4.39 0.06 0.30 0.00 1.74 -0.89 -1.45 116.66 112.04 1n1t n ARG 472 Ca -0.03 0.28 0.19 0.00 -0.77 0.00 0.00 57.85 57.53 1n1t n ARG 472 Cb 0.14 -1.50 0.95 0.00 -1.02 0.00 0.00 32.46 31.04 1n1t n ARG 472 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1n1t h GLN 473 N 0.00 0.00 0.00 5.56 4.20 -1.49 -3.48 115.11 119.90 1n1t h GLN 473 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1n1t h GLN 473 Cb 0.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.85 1n1t h GLN 473 CO 0.00 0.02 0.00 0.41 -0.67 0.00 0.00 178.83 178.59 1n1t n GLY 474 N -0.67 1.25 0.13 3.46 0.00 -0.53 -4.48 105.19 104.34 1n1t n GLY 474 Ca -0.02 -0.89 -0.12 0.00 0.00 0.00 0.00 46.02 44.99 1n1t n GLY 474 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1n1t h GLN 475 N 0.00 -0.19 -4.88 1.61 4.15 -1.88 -3.41 115.11 110.51 1n1t h GLN 475 Ca 0.00 0.01 -0.66 0.00 0.77 0.00 0.00 58.65 58.78 1n1t h GLN 475 Cb 0.00 0.04 -0.17 0.00 0.21 0.00 0.00 27.48 27.56 1n1t h GLN 475 CO 0.00 0.23 -0.41 0.99 -1.93 0.00 0.00 178.83 177.71 1n1t s THR 476 N -4.02 5.25 -0.91 2.39 2.01 -1.26 -4.56 115.64 114.54 1n1t s THR 476 Ca -0.14 0.04 -0.07 0.00 0.31 0.00 0.00 61.69 61.83 1n1t s THR 476 Cb 0.01 -3.69 0.23 0.00 0.01 0.00 0.00 72.50 69.06 1n1t s THR 476 CO 0.56 0.05 0.83 -0.13 -0.69 0.00 0.00 174.62 175.24 1n1t s ARG 477 N 1.85 3.54 0.24 4.92 0.52 0.23 -4.79 118.95 125.46 1n1t s ARG 477 Ca 0.09 -2.96 0.25 0.00 -0.52 0.00 0.00 55.73 52.58 1n1t s ARG 477 Cb -0.17 -4.22 0.92 0.00 0.52 0.00 0.00 34.95 32.01 1n1t s ARG 477 CO 0.11 -1.25 1.74 0.54 0.02 0.00 0.00 175.30 176.46 1n1t n ARG 478 N 3.00 0.22 -0.64 3.54 1.74 -1.26 -2.13 116.66 121.13 1n1t n ARG 478 Ca 0.18 0.35 0.04 0.00 -0.77 0.00 0.00 57.85 57.66 1n1t n ARG 478 Cb 0.40 -1.85 0.28 0.00 -1.02 0.00 0.00 32.46 30.27 1n1t n ARG 478 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1n1t n TYR 479 N -2.26 1.33 0.20 -1.55 0.53 -1.26 -4.63 117.16 109.53 1n1t n TYR 479 Ca 0.03 -1.01 0.16 0.00 -1.02 0.00 0.00 57.90 56.06 1n1t n TYR 479 Cb 0.30 -0.42 0.79 0.00 -1.03 0.00 0.00 39.34 38.98 1n1t n TYR 479 CO 0.00 0.00 0.00 0.37 -1.02 0.00 0.00 176.86 176.21 1n1t h GLN 480 N 2.07 0.00 -0.26 -0.72 5.75 -1.76 -1.31 115.11 118.87 1n1t h GLN 480 Ca 0.07 0.00 0.07 0.00 -0.15 0.00 0.00 58.65 58.65 1n1t h GLN 480 Cb 1.68 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 30.22 1n1t h GLN 480 CO 0.36 0.00 0.25 0.27 -2.65 0.00 0.00 178.83 177.06 1n1t h PHE 481 N 0.00 0.00 0.00 3.99 -0.00 -1.81 -2.51 116.94 116.62 1n1t h PHE 481 Ca 0.08 0.00 -0.02 0.00 -0.00 0.00 0.00 57.97 58.03 1n1t h PHE 481 Cb 0.41 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.36 1n1t h PHE 481 CO 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 178.31 178.22 1n1t h ALA 482 N 1.75 1.36 0.00 12.09 0.00 -1.35 0.20 119.26 133.31 1n1t h ALA 482 Ca 0.12 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1n1t h ALA 482 Cb 0.62 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1n1t h ALA 482 CO -0.00 0.12 0.00 -0.91 0.00 0.00 0.00 179.25 178.46 1n1t h ASN 483 N 0.00 0.00 0.01 0.00 2.35 -1.66 -3.19 115.58 113.09 1n1t h ASN 483 Ca -0.00 0.00 -0.40 0.00 -0.55 0.00 0.00 56.30 55.35 1n1t h ASN 483 Cb 0.26 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.56 1n1t h ASN 483 CO 0.01 0.00 -2.37 0.00 -1.65 0.00 0.00 177.43 173.42 1n1t n TYR 484 N -3.02 0.21 -3.55 1.19 9.36 -0.04 -4.42 117.16 116.88 1n1t n TYR 484 Ca -0.00 0.06 -0.12 0.00 3.32 0.00 0.00 57.90 61.16 1n1t n TYR 484 Cb 0.25 -1.03 -0.05 0.00 -0.63 0.00 0.00 39.34 37.89 1n1t n TYR 484 CO 0.00 0.00 0.00 -0.98 0.22 0.00 0.00 176.86 176.10 1n1t s ARG 485 N -2.51 0.75 0.13 2.98 1.70 -0.58 -4.22 118.95 117.20 1n1t s ARG 485 Ca -0.34 0.12 -0.25 0.00 -0.47 0.00 0.00 55.73 54.79 1n1t s ARG 485 Cb 0.10 0.35 0.07 0.00 -0.57 0.00 0.00 34.95 34.90 1n1t s ARG 485 CO 0.59 -0.25 0.78 -0.59 -1.08 0.00 0.00 175.30 174.75 1n1t s PHE 486 N -1.39 -0.34 -0.05 5.89 -0.12 -0.11 -3.89 117.98 117.97 1n1t s PHE 486 Ca -0.03 0.09 0.03 0.00 -0.05 0.00 0.00 56.93 56.96 1n1t s PHE 486 Cb -0.00 0.60 0.01 0.00 -0.63 0.00 0.00 43.02 42.99 1n1t s PHE 486 CO 0.02 -0.82 -0.13 0.99 -0.05 0.00 0.00 175.22 175.23 1n1t s THR 487 N -3.50 1.14 -0.11 -4.49 2.01 -0.67 -1.15 115.64 108.87 1n1t s THR 487 Ca 0.06 -0.52 0.03 0.00 0.31 0.00 0.00 61.69 61.57 1n1t s THR 487 Cb -0.02 -1.01 0.01 0.00 0.01 0.00 0.00 72.50 71.48 1n1t s THR 487 CO -0.05 0.35 -0.22 -0.22 -0.69 0.00 0.00 174.62 173.78 1n1t s LEU 488 N 0.36 2.05 0.03 4.42 2.96 -0.25 -0.93 118.68 127.33 1n1t s LEU 488 Ca -0.09 -0.55 0.07 0.00 -0.22 0.00 0.00 54.13 53.34 1n1t s LEU 488 Cb -0.13 -1.37 -0.02 0.00 0.50 0.00 0.00 46.19 45.17 1n1t s LEU 488 CO 0.02 0.12 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.28 1n1t s VAL 489 N 0.56 1.63 0.13 1.68 1.01 0.08 -0.43 120.40 125.05 1n1t s VAL 489 Ca -0.14 -1.11 -0.22 0.00 0.00 0.00 0.00 61.98 60.50 1n1t s VAL 489 Cb -0.17 -1.40 0.06 0.00 0.00 0.00 0.00 36.38 34.87 1n1t s VAL 489 CO 0.04 0.25 0.57 0.00 0.00 0.00 0.00 175.10 175.96 1n1t s ALA 490 N -0.72 -1.48 -0.16 5.51 0.00 0.27 -0.67 121.76 124.51 1n1t s ALA 490 Ca 0.07 0.48 -0.05 0.00 0.00 0.00 0.00 51.96 52.46 1n1t s ALA 490 Cb -0.08 0.74 -0.04 0.00 0.00 0.00 0.00 23.12 23.74 1n1t s ALA 490 CO 0.01 -0.69 0.03 0.99 0.00 0.00 0.00 175.76 176.09 1n1t s THR 491 N -3.43 4.48 0.07 0.00 2.01 -0.57 -0.39 115.64 117.81 1n1t s THR 491 Ca -0.00 -0.15 0.04 0.00 0.31 0.00 0.00 61.69 61.88 1n1t s THR 491 Cb -0.00 -2.98 -0.03 0.00 0.01 0.00 0.00 72.50 69.50 1n1t s THR 491 CO -0.10 0.50 -0.10 0.68 -0.69 0.00 0.00 174.62 174.91 1n1t s VAL 492 N 0.10 0.86 0.00 3.82 -7.23 0.09 -0.93 120.40 117.11 1n1t s VAL 492 Ca 0.03 -1.41 0.03 0.00 -1.81 0.00 0.00 61.98 58.82 1n1t s VAL 492 Cb -0.13 -1.09 -0.01 0.00 0.56 0.00 0.00 36.38 35.72 1n1t s VAL 492 CO 0.01 -0.44 -0.11 0.42 -0.31 0.00 0.00 175.10 174.68 1n1t s THR 493 N -1.90 0.83 -0.23 5.32 -4.23 0.05 -0.67 115.64 114.80 1n1t s THR 493 Ca -0.01 -0.53 -0.16 0.00 -1.18 0.00 0.00 61.69 59.82 1n1t s THR 493 Cb -0.06 -0.71 -0.04 0.00 1.34 0.00 0.00 72.50 73.03 1n1t s THR 493 CO 0.00 0.17 0.40 -0.63 -0.54 0.00 0.00 174.62 174.02 1n1t s ILE 494 N -0.37 5.18 -0.15 2.99 -1.09 -1.26 -1.15 121.20 125.35 1n1t s ILE 494 Ca 0.03 0.67 0.08 0.00 -2.23 0.00 0.00 60.65 59.20 1n1t s ILE 494 Cb -0.05 -3.73 -0.23 0.00 -1.58 0.00 0.00 42.46 36.88 1n1t s ILE 494 CO -0.00 0.20 0.24 0.47 -1.23 0.00 0.00 174.94 174.62 1n1t n ASP 495 N 4.90 1.12 -3.91 3.58 8.00 0.54 -1.31 116.55 129.46 1n1t n ASP 495 Ca -0.08 0.13 -0.11 0.00 0.71 0.00 0.00 54.79 55.45 1n1t n ASP 495 Cb 0.51 0.01 -0.12 0.00 -0.02 0.00 0.00 41.12 41.49 1n1t n ASP 495 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1n1t s GLU 496 N -2.54 0.19 0.41 -1.24 2.02 -1.09 -4.79 118.70 111.65 1n1t s GLU 496 Ca -0.16 -0.26 -0.26 0.00 0.02 0.00 0.00 54.97 54.31 1n1t s GLU 496 Cb 0.07 0.07 -0.09 0.00 0.10 0.00 0.00 34.13 34.29 1n1t s GLU 496 CO 0.77 -0.03 1.35 -0.51 0.02 0.00 0.00 175.26 176.86 1n1t s LEU 497 N -0.70 4.21 0.63 1.80 1.43 -1.26 -4.63 118.68 120.15 1n1t s LEU 497 Ca -0.08 2.77 -0.09 0.00 -1.03 0.00 0.00 54.13 55.69 1n1t s LEU 497 Cb -0.05 -3.88 -0.01 0.00 0.03 0.00 0.00 46.19 42.28 1n1t s LEU 497 CO -0.00 -0.93 1.00 -2.16 0.23 0.00 0.00 176.35 174.49 1n1t s PRO 498 N -2.26 3.20 0.11 1.29 0.04 -1.26 -4.99 135.00 131.13 1n1t s PRO 498 Ca 0.57 0.44 -0.14 0.00 0.04 0.00 0.00 61.00 61.91 1n1t s PRO 498 Cb -0.40 -2.13 -0.08 0.00 0.04 0.00 0.00 34.50 31.93 1n1t s PRO 498 CO 0.52 -0.71 1.43 -0.22 0.04 0.00 0.00 177.00 178.06 1n1t h LYS 499 N -0.34 0.75 0.00 4.56 3.64 -1.96 -3.38 116.57 119.85 1n1t h LYS 499 Ca -0.45 -0.40 0.00 0.00 -1.27 0.00 0.00 60.65 58.53 1n1t h LYS 499 Cb 1.23 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 1n1t h LYS 499 CO 0.62 1.02 0.00 0.41 -2.27 0.00 0.00 179.45 179.23 1n1t n GLY 500 N 0.15 1.53 3.38 5.01 0.00 -1.26 -4.73 105.19 109.28 1n1t n GLY 500 Ca -0.03 -0.19 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 1n1t n GLY 500 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n1t s THR 501 N 0.87 2.29 -0.00 2.61 2.01 -1.26 -0.80 115.64 121.35 1n1t s THR 501 Ca 0.00 -1.55 -0.05 0.00 0.31 0.00 0.00 61.69 60.40 1n1t s THR 501 Cb 0.00 -1.96 -0.00 0.00 0.01 0.00 0.00 72.50 70.55 1n1t s THR 501 CO 0.00 0.22 0.09 -0.55 -0.69 0.00 0.00 174.62 173.69 1n1t s SER 502 N -1.68 0.05 0.51 3.53 0.15 -0.37 -4.98 113.70 110.92 1n1t s SER 502 Ca 0.13 -0.20 -0.17 0.00 0.70 0.00 0.00 55.95 56.41 1n1t s SER 502 Cb -0.10 0.18 -0.08 0.00 -1.71 0.00 0.00 66.02 64.31 1n1t s SER 502 CO 0.05 -0.29 0.99 -2.16 1.20 0.00 0.00 173.24 173.03 1n1t s PRO 503 N -1.12 3.89 0.00 5.44 0.05 -1.26 -1.69 135.00 140.31 1n1t s PRO 503 Ca -0.12 1.05 0.00 0.00 0.05 0.00 0.00 61.00 61.98 1n1t s PRO 503 Cb -0.07 -2.12 0.00 0.00 0.05 0.00 0.00 34.50 32.36 1n1t s PRO 503 CO 0.01 -0.32 0.00 -0.11 0.05 0.00 0.00 177.00 176.62 1n1t n LEU 504 N -1.44 0.00 -3.64 -3.56 7.94 -0.49 -4.08 117.00 111.73 1n1t n LEU 504 Ca 0.07 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.86 1n1t n LEU 504 Cb 0.54 -0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.41 1n1t n LEU 504 CO 0.44 -0.20 0.37 -0.22 -1.11 0.00 0.00 177.39 176.67 1n1t s LEU 505 N -5.60 -0.73 0.00 -1.96 2.96 -1.00 -0.25 118.68 112.09 1n1t s LEU 505 Ca 0.00 1.42 0.00 0.00 -0.22 0.00 0.00 54.13 55.33 1n1t s LEU 505 Cb 0.00 2.36 0.00 0.00 0.50 0.00 0.00 46.19 49.05 1n1t s LEU 505 CO 0.00 -0.24 0.00 0.61 -1.32 0.00 0.00 176.35 175.40 1n1t n GLY 506 N 3.27 -1.41 3.22 7.98 0.00 -0.78 0.11 105.19 117.57 1n1t n GLY 506 Ca -0.16 -1.01 -0.34 0.00 0.00 0.00 0.00 46.02 44.50 1n1t n GLY 506 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1t s ALA 507 N -1.64 2.65 0.41 4.61 0.00 0.18 -1.01 121.76 126.96 1n1t s ALA 507 Ca 0.00 -1.31 -0.09 0.00 0.00 0.00 0.00 51.96 50.56 1n1t s ALA 507 Cb 0.00 -1.58 -0.06 0.00 0.00 0.00 0.00 23.12 21.48 1n1t s ALA 507 CO 0.00 -0.58 0.75 0.20 0.00 0.00 0.00 175.76 176.13 1n1t s GLY 508 N 1.37 1.85 0.03 0.00 0.00 -0.14 -0.68 107.32 109.75 1n1t s GLY 508 Ca 0.03 -0.30 0.04 0.00 0.00 0.00 0.00 44.72 44.50 1n1t s GLY 508 CO -0.06 -0.12 -0.08 1.08 0.00 0.00 0.00 173.10 173.92 1n1t s LEU 509 N -3.98 3.11 0.73 0.66 1.43 -0.68 -0.54 118.68 119.41 1n1t s LEU 509 Ca 0.50 -0.22 -0.13 0.00 -1.03 0.00 0.00 54.13 53.24 1n1t s LEU 509 Cb -0.10 -1.82 0.04 0.00 0.03 0.00 0.00 46.19 44.33 1n1t s LEU 509 CO 0.34 0.25 1.12 -1.61 0.23 0.00 0.00 176.35 176.68 1n1t s GLU 510 N -1.64 2.39 0.00 1.70 0.41 -0.38 -4.61 118.70 116.58 1n1t s GLU 510 Ca 0.18 1.39 0.00 0.00 -0.41 0.00 0.00 54.97 56.13 1n1t s GLU 510 Cb -0.11 -1.90 0.00 0.00 -1.78 0.00 0.00 34.13 30.34 1n1t s GLU 510 CO 0.09 -1.57 0.00 0.41 -0.49 0.00 0.00 175.26 173.70 1n1t n GLY 511 N -0.53 1.01 3.74 -1.39 0.00 -1.26 -4.93 105.19 101.83 1n1t n GLY 511 Ca 0.11 -2.29 -0.38 0.00 0.00 0.00 0.00 46.02 43.46 1n1t n GLY 511 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1n1t s PRO 512 N -1.07 2.88 5.06 1.61 0.02 -1.26 -4.74 135.00 137.50 1n1t s PRO 512 Ca 0.00 2.12 0.00 0.00 0.02 0.00 0.00 61.00 63.14 1n1t s PRO 512 Cb 0.00 -2.05 0.00 0.00 0.02 0.00 0.00 34.50 32.47 1n1t s PRO 512 CO 0.00 -1.36 0.00 0.41 -0.33 0.00 0.00 177.00 175.72 1n1t n GLY 513 N 0.78 1.36 2.34 0.52 0.00 -1.26 -4.27 105.19 104.65 1n1t n GLY 513 Ca 0.13 -0.69 -0.16 0.00 0.00 0.00 0.00 46.02 45.30 1n1t n GLY 513 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1n1t n ASP 514 N 3.41 -0.18 -4.79 1.61 3.85 -1.26 -5.12 116.55 114.09 1n1t n ASP 514 Ca 0.00 -3.13 -0.36 0.00 -0.71 0.00 0.00 54.79 50.59 1n1t n ASP 514 Cb 0.00 0.08 -0.04 0.00 -1.35 0.00 0.00 41.12 39.80 1n1t n ASP 514 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1n1t s ALA 515 N -1.48 3.07 0.10 2.12 0.00 -1.26 -4.97 121.76 119.35 1n1t s ALA 515 Ca 0.35 0.66 0.10 0.00 0.00 0.00 0.00 51.96 53.07 1n1t s ALA 515 Cb 0.30 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 20.13 1n1t s ALA 515 CO -0.09 -0.17 -0.26 0.15 0.00 0.00 0.00 175.76 175.39 1n1t s LYS 516 N -2.58 1.55 -0.10 0.00 1.02 -1.26 -1.68 119.74 116.69 1n1t s LYS 516 Ca 0.58 -1.26 -0.26 0.00 0.02 0.00 0.00 55.97 55.05 1n1t s LYS 516 Cb -0.20 -1.94 -0.28 0.00 -0.52 0.00 0.00 37.83 34.89 1n1t s LYS 516 CO 0.25 0.47 0.83 1.25 -0.92 0.00 0.00 175.35 177.24 1n1t h LEU 517 N 4.18 0.20 -7.00 3.17 5.85 -1.19 -3.36 115.31 117.16 1n1t h LEU 517 Ca -0.49 -0.98 -0.02 0.00 0.84 0.00 0.00 57.88 57.23 1n1t h LEU 517 Cb 1.16 -0.07 -0.21 0.00 0.37 0.00 0.00 40.66 41.91 1n1t h LEU 517 CO 0.41 1.17 0.10 -0.22 -0.34 0.00 0.00 178.44 179.55 1n1t s LEU 518 N -8.08 -0.82 0.00 2.25 2.96 -1.23 -0.85 118.68 112.91 1n1t s LEU 518 Ca -0.17 1.46 -0.21 0.00 -0.22 0.00 0.00 54.13 55.00 1n1t s LEU 518 Cb -0.01 2.43 0.07 0.00 0.50 0.00 0.00 46.19 49.17 1n1t s LEU 518 CO 0.75 -0.24 0.97 0.61 -1.32 0.00 0.00 176.35 177.12 1n1t n GLY 519 N 3.28 0.51 2.79 7.98 0.00 -0.57 -0.65 105.19 118.53 1n1t n GLY 519 Ca -0.16 -1.07 -0.15 0.00 0.00 0.00 0.00 46.02 44.64 1n1t n GLY 519 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1n1t s LEU 520 N 0.00 1.07 0.48 0.99 2.96 0.12 -0.47 118.68 123.83 1n1t s LEU 520 Ca 0.22 0.07 0.03 0.00 -0.22 0.00 0.00 54.13 54.23 1n1t s LEU 520 Cb -0.02 -0.02 -0.03 0.00 0.50 0.00 0.00 46.19 46.63 1n1t s LEU 520 CO 0.02 -0.13 0.01 -0.44 -1.32 0.00 0.00 176.35 174.50 1n1t s SER 521 N 1.04 3.97 0.05 3.68 0.01 -0.06 -1.40 113.70 120.99 1n1t s SER 521 Ca -0.09 -1.59 -0.05 0.00 1.31 0.00 0.00 55.95 55.54 1n1t s SER 521 Cb -0.12 0.30 -0.02 0.00 0.21 0.00 0.00 66.02 66.39 1n1t s SER 521 CO -0.03 -0.76 0.08 -0.72 0.41 0.00 0.00 173.24 172.22 1n1t s TYR 522 N -2.87 0.26 0.31 2.43 -0.85 -0.68 -0.62 117.35 115.33 1n1t s TYR 522 Ca 0.14 -0.63 0.03 0.00 -0.52 0.00 0.00 57.07 56.09 1n1t s TYR 522 Cb 0.04 -0.18 -0.05 0.00 0.38 0.00 0.00 41.96 42.15 1n1t s TYR 522 CO 0.07 -0.39 0.11 0.16 -1.52 0.00 0.00 175.55 173.98 1n1t s ASP 523 N -2.36 1.83 0.62 -0.18 1.47 -0.76 -1.23 116.67 116.07 1n1t s ASP 523 Ca -0.02 -1.48 0.41 0.00 1.18 0.00 0.00 52.55 52.64 1n1t s ASP 523 Cb 0.01 0.22 2.04 0.00 -0.34 0.00 0.00 42.92 44.85 1n1t s ASP 523 CO -0.06 -0.78 2.23 0.07 0.68 0.00 0.00 175.17 177.31 1n1t h LYS 524 N 2.17 0.00 -0.19 2.11 2.10 -1.14 -1.12 116.57 120.51 1n1t h LYS 524 Ca -0.37 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.28 1n1t h LYS 524 Cb 1.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 1n1t h LYS 524 CO 0.60 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 178.14 1n1t n ASN 525 N -3.08 1.21 -2.92 7.07 3.02 -1.26 -4.91 115.26 114.39 1n1t n ASN 525 Ca -0.02 -1.85 -0.21 0.00 -0.03 0.00 0.00 54.58 52.47 1n1t n ASN 525 Cb 0.16 -0.12 0.04 0.00 -0.61 0.00 0.00 39.78 39.24 1n1t n ASN 525 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1n1t n ARG 526 N 0.10 -5.19 -4.26 3.52 1.74 -0.42 -4.95 116.66 107.20 1n1t n ARG 526 Ca 0.11 0.83 -0.24 0.00 -0.77 0.00 0.00 57.85 57.78 1n1t n ARG 526 Cb 0.22 -5.58 -0.07 0.00 -1.02 0.00 0.00 32.46 26.01 1n1t n ARG 526 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1n1t s GLN 527 N -5.75 2.36 0.35 5.56 -0.21 -1.26 -1.66 119.66 119.06 1n1t s GLN 527 Ca 0.34 -1.31 -0.18 0.00 0.02 0.00 0.00 55.36 54.23 1n1t s GLN 527 Cb -0.15 -2.24 -0.10 0.00 1.00 0.00 0.00 33.01 31.52 1n1t s GLN 527 CO 0.42 0.39 0.81 -1.58 -2.12 0.00 0.00 175.29 173.22 1n1t s TRP 528 N -2.14 3.40 -0.51 0.91 0.52 -0.15 -1.82 118.94 119.15 1n1t s TRP 528 Ca 0.30 1.39 0.03 0.00 0.02 0.00 0.00 56.10 57.84 1n1t s TRP 528 Cb -0.07 -2.66 0.15 0.00 -1.15 0.00 0.00 33.47 29.73 1n1t s TRP 528 CO 0.20 0.06 0.32 1.03 0.02 0.00 0.00 176.95 178.57 1n1t s ARG 529 N -2.90 1.59 0.43 4.98 0.52 0.20 -0.61 118.95 123.17 1n1t s ARG 529 Ca 0.55 -2.41 -0.23 0.00 -0.52 0.00 0.00 55.73 53.12 1n1t s ARG 529 Cb -0.11 -2.56 -0.08 0.00 0.52 0.00 0.00 34.95 32.72 1n1t s ARG 529 CO 0.17 -1.22 1.10 -1.25 0.02 0.00 0.00 175.30 174.12 1n1t s PRO 530 N -0.20 3.96 -0.24 3.54 0.04 -1.26 -0.89 135.00 139.95 1n1t s PRO 530 Ca 0.22 1.62 -0.01 0.00 0.04 0.00 0.00 61.00 62.87 1n1t s PRO 530 Cb -0.15 -2.45 0.03 0.00 0.04 0.00 0.00 34.50 31.97 1n1t s PRO 530 CO -0.07 -0.34 -0.08 -0.51 0.04 0.00 0.00 177.00 176.04 1n1t s LEU 531 N -2.86 3.13 -0.80 -3.56 1.43 0.38 -4.51 118.68 111.88 1n1t s LEU 531 Ca 0.61 -0.94 -0.01 0.00 -1.03 0.00 0.00 54.13 52.76 1n1t s LEU 531 Cb -0.25 -1.62 0.20 0.00 0.03 0.00 0.00 46.19 44.55 1n1t s LEU 531 CO 0.30 -0.13 0.65 -0.31 0.23 0.00 0.00 176.35 177.10 1n1t s TYR 532 N 1.28 3.73 0.00 0.29 1.51 -1.26 -1.52 117.35 121.38 1n1t s TYR 532 Ca -0.01 -3.01 0.00 0.00 -1.01 0.00 0.00 57.07 53.04 1n1t s TYR 532 Cb -0.17 -3.15 0.00 0.00 -0.11 0.00 0.00 41.96 38.53 1n1t s TYR 532 CO -0.05 -0.73 0.00 0.41 -1.11 0.00 0.00 175.55 174.06 1n1t n GLY 533 N 2.54 2.50 0.59 0.71 0.00 -0.03 -2.58 105.19 108.93 1n1t n GLY 533 Ca 0.18 -0.31 0.13 0.00 0.00 0.00 0.00 46.02 46.02 1n1t n GLY 533 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1t n ALA 534 N 11.16 2.60 -1.77 4.61 0.00 -1.26 -4.62 120.51 131.22 1n1t n ALA 534 Ca 0.00 -0.51 -0.40 0.00 0.00 0.00 0.00 53.44 52.53 1n1t n ALA 534 Cb 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1n1t n ALA 534 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n1t s ALA 535 N -2.04 3.43 0.06 0.00 0.00 -1.06 -4.89 121.76 117.25 1n1t s ALA 535 Ca 0.34 1.49 -0.35 0.00 0.00 0.00 0.00 51.96 53.45 1n1t s ALA 535 Cb 0.21 -3.59 -0.14 0.00 0.00 0.00 0.00 23.12 19.60 1n1t s ALA 535 CO 0.34 -1.06 1.65 -2.30 0.00 0.00 0.00 175.76 174.39 1n1t n PRO 536 N 0.22 2.00 -2.89 0.00 -0.02 -1.26 -4.56 135.00 128.50 1n1t n PRO 536 Ca 0.03 0.73 -0.44 0.00 -2.02 0.00 0.00 63.50 61.80 1n1t n PRO 536 Cb 0.41 -2.50 -0.01 0.00 -0.02 0.00 0.00 33.50 31.38 1n1t n PRO 536 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n1t s ALA 537 N 1.93 3.69 0.36 3.55 0.00 -1.26 -4.95 121.76 125.09 1n1t s ALA 537 Ca 0.84 -3.10 -0.24 0.00 0.00 0.00 0.00 51.96 49.46 1n1t s ALA 537 Cb -0.73 -4.17 -0.10 0.00 0.00 0.00 0.00 23.12 18.11 1n1t s ALA 537 CO 0.44 -2.92 0.95 -1.54 0.00 0.00 0.00 175.76 172.69 1n1t s SER 538 N 3.30 7.18 0.59 0.00 1.04 -1.26 -4.85 113.70 119.70 1n1t s SER 538 Ca 0.41 1.79 -0.17 0.00 0.48 0.00 0.00 55.95 58.47 1n1t s SER 538 Cb -0.03 -2.57 -0.03 0.00 0.10 0.00 0.00 66.02 63.49 1n1t s SER 538 CO -0.02 -0.18 1.08 -2.84 0.98 0.00 0.00 173.24 172.26 1n1t s PRO 539 N -2.46 3.22 0.00 4.02 0.02 -1.26 -4.36 135.00 134.18 1n1t s PRO 539 Ca 0.55 1.35 -0.24 0.00 0.02 0.00 0.00 61.00 62.67 1n1t s PRO 539 Cb -0.15 -2.01 0.05 0.00 0.02 0.00 0.00 34.50 32.41 1n1t s PRO 539 CO 0.20 -0.91 0.55 -0.08 -0.33 0.00 0.00 177.00 176.43 1n1t s THR 540 N -2.25 0.02 0.00 0.99 -1.32 0.22 -4.97 115.64 108.33 1n1t s THR 540 Ca 0.67 -0.18 0.00 0.00 -1.21 0.00 0.00 61.69 60.96 1n1t s THR 540 Cb -0.19 -0.93 0.00 0.00 -1.51 0.00 0.00 72.50 69.87 1n1t s THR 540 CO 0.35 -0.10 0.00 0.61 -2.21 0.00 0.00 174.62 173.27 1n1t n GLY 541 N 0.70 -0.11 3.57 6.08 0.00 -1.26 -0.98 105.19 113.20 1n1t n GLY 541 Ca -0.19 -1.01 -0.14 0.00 0.00 0.00 0.00 46.02 44.68 1n1t n GLY 541 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1n1t s SER 542 N -4.00 -0.70 0.18 1.61 0.15 -1.26 -4.51 113.70 105.18 1n1t s SER 542 Ca 0.00 1.28 -0.02 0.00 0.70 0.00 0.00 55.95 57.92 1n1t s SER 542 Cb 0.00 1.29 -0.04 0.00 -1.71 0.00 0.00 66.02 65.56 1n1t s SER 542 CO 0.00 -0.28 0.13 -1.66 1.20 0.00 0.00 173.24 172.63 1n1t s TRP 543 N 0.18 1.02 0.06 3.44 1.48 -0.66 -4.93 118.94 119.54 1n1t s TRP 543 Ca -0.01 -1.30 0.09 0.00 -1.06 0.00 0.00 56.10 53.82 1n1t s TRP 543 Cb -0.04 -0.49 -0.03 0.00 -1.16 0.00 0.00 33.47 31.74 1n1t s TRP 543 CO 0.02 -0.62 -0.24 -1.21 -4.06 0.00 0.00 176.95 170.84 1n1t s GLU 544 N -4.12 1.55 0.57 3.25 2.02 -1.26 -4.84 118.70 115.87 1n1t s GLU 544 Ca 0.34 -1.09 -0.21 0.00 0.02 0.00 0.00 54.97 54.03 1n1t s GLU 544 Cb 0.07 -1.76 -0.04 0.00 0.10 0.00 0.00 34.13 32.50 1n1t s GLU 544 CO 0.09 0.44 1.34 -0.51 0.02 0.00 0.00 175.26 176.64 1n1t s LEU 545 N -1.39 3.78 -0.16 1.80 1.43 -1.26 -3.51 118.68 119.37 1n1t s LEU 545 Ca 0.10 2.72 0.00 0.00 -1.03 0.00 0.00 54.13 55.92 1n1t s LEU 545 Cb -0.10 -4.37 0.00 0.00 0.03 0.00 0.00 46.19 41.76 1n1t s LEU 545 CO 0.03 -1.68 0.00 1.41 0.23 0.00 0.00 176.35 176.34 1n1t n HIS 546 N -1.26 0.00 -4.37 0.29 8.25 -0.43 -4.99 115.22 112.71 1n1t n HIS 546 Ca 0.12 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.23 1n1t n HIS 546 Cb 0.46 -1.34 -0.09 0.00 1.12 0.00 0.00 29.99 30.14 1n1t n HIS 546 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1n1t s LYS 547 N -1.43 2.96 0.08 -0.41 2.20 -1.23 -4.99 119.74 116.92 1n1t s LYS 547 Ca 0.00 -0.43 -0.27 0.00 -0.36 0.00 0.00 55.97 54.91 1n1t s LYS 547 Cb 0.00 -2.78 -0.06 0.00 -1.51 0.00 0.00 37.83 33.49 1n1t s LYS 547 CO 0.00 0.70 0.84 0.15 -0.36 0.00 0.00 175.35 176.68 1n1t s LYS 548 N -0.94 4.59 0.09 4.03 1.02 -1.26 -4.34 119.74 122.93 1n1t s LYS 548 Ca 0.14 1.23 0.07 0.00 0.02 0.00 0.00 55.97 57.42 1n1t s LYS 548 Cb -0.11 -3.36 -0.03 0.00 -0.52 0.00 0.00 37.83 33.81 1n1t s LYS 548 CO 0.03 0.29 -0.17 0.71 -0.92 0.00 0.00 175.35 175.29 1n1t s TYR 549 N -0.16 1.48 -0.20 3.18 1.51 0.15 -4.96 117.35 118.35 1n1t s TYR 549 Ca 0.41 -0.46 -0.09 0.00 -1.01 0.00 0.00 57.07 55.92 1n1t s TYR 549 Cb -0.22 -0.81 -0.05 0.00 -0.11 0.00 0.00 41.96 40.77 1n1t s TYR 549 CO 0.26 0.14 0.12 -1.58 -1.11 0.00 0.00 175.55 173.38 1n1t s HIS 550 N -1.39 3.35 -0.09 2.71 2.46 -1.26 -0.73 115.29 120.34 1n1t s HIS 550 Ca 0.03 0.24 0.04 0.00 0.47 0.00 0.00 55.06 55.85 1n1t s HIS 550 Cb -0.09 -2.16 -0.01 0.00 -0.13 0.00 0.00 32.58 30.19 1n1t s HIS 550 CO 0.03 0.20 -0.23 0.08 -2.47 0.00 0.00 174.74 172.35 1n1t s VAL 551 N 0.52 2.15 -0.06 0.89 1.01 0.48 -0.59 120.40 124.80 1n1t s VAL 551 Ca 0.07 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 61.05 1n1t s VAL 551 Cb -0.12 -1.81 0.02 0.00 0.00 0.00 0.00 36.38 34.47 1n1t s VAL 551 CO -0.00 0.56 -0.07 -0.69 0.00 0.00 0.00 175.10 174.90 1n1t s VAL 552 N 0.13 0.78 -0.15 2.92 1.01 -0.58 -0.57 120.40 123.94 1n1t s VAL 552 Ca -0.12 -0.24 -0.02 0.00 0.00 0.00 0.00 61.98 61.61 1n1t s VAL 552 Cb -0.16 -0.77 -0.02 0.00 0.00 0.00 0.00 36.38 35.43 1n1t s VAL 552 CO 0.07 0.29 -0.10 -0.76 0.00 0.00 0.00 175.10 174.60 1n1t s LEU 553 N 1.01 2.87 0.01 3.92 1.43 0.43 -0.12 118.68 128.24 1n1t s LEU 553 Ca -0.09 -0.29 0.07 0.00 -1.03 0.00 0.00 54.13 52.80 1n1t s LEU 553 Cb -0.14 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.38 1n1t s LEU 553 CO -0.00 0.14 -0.23 0.42 0.23 0.00 0.00 176.35 176.91 1n1t s THR 554 N 0.52 1.82 -0.07 5.49 -4.23 -0.06 -1.09 115.64 118.02 1n1t s THR 554 Ca -0.07 -1.09 -0.03 0.00 -1.18 0.00 0.00 61.69 59.33 1n1t s THR 554 Cb -0.15 -1.53 0.04 0.00 1.34 0.00 0.00 72.50 72.20 1n1t s THR 554 CO 0.04 0.41 0.13 -0.32 -0.54 0.00 0.00 174.62 174.34 1n1t s MET 555 N -0.80 0.01 0.06 3.99 0.00 -0.30 -1.06 119.30 121.21 1n1t s MET 555 Ca 0.09 0.47 -0.27 0.00 0.00 0.00 0.00 55.69 55.99 1n1t s MET 555 Cb -0.09 -0.31 0.07 0.00 0.00 0.00 0.00 34.83 34.50 1n1t s MET 555 CO 0.00 -0.28 0.65 0.00 0.00 0.00 0.00 175.02 175.38 1n1t s ALA 556 N 2.03 -1.68 -1.39 4.11 0.00 -0.87 -0.93 121.76 123.03 1n1t s ALA 556 Ca 0.01 0.87 -0.11 0.00 0.00 0.00 0.00 51.96 52.73 1n1t s ALA 556 Cb -0.12 0.48 0.08 0.00 0.00 0.00 0.00 23.12 23.56 1n1t s ALA 556 CO -0.05 -0.59 0.61 -0.25 0.00 0.00 0.00 175.76 175.48 1n1t n ASP 557 N 0.19 -4.04 -0.12 0.00 8.00 -1.26 -0.71 116.55 118.62 1n1t n ASP 557 Ca -0.18 -0.51 -0.02 0.00 0.71 0.00 0.00 54.79 54.80 1n1t n ASP 557 Cb 0.61 -3.30 -0.01 0.00 -0.02 0.00 0.00 41.12 38.40 1n1t n ASP 557 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1n1t n ARG 558 N -3.97 -1.58 -4.16 -1.24 1.74 -1.26 -4.98 116.66 101.21 1n1t n ARG 558 Ca -0.00 0.47 -0.36 0.00 -0.77 0.00 0.00 57.85 57.19 1n1t n ARG 558 Cb 0.54 -4.68 -0.08 0.00 -1.02 0.00 0.00 32.46 27.22 1n1t n ARG 558 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1n1t s GLN 559 N -1.78 3.21 -0.01 5.56 -0.21 0.11 -0.29 119.66 126.25 1n1t s GLN 559 Ca 0.00 -0.29 0.06 0.00 0.02 0.00 0.00 55.36 55.15 1n1t s GLN 559 Cb 0.00 -2.97 -0.02 0.00 1.00 0.00 0.00 33.01 31.02 1n1t s GLN 559 CO 0.00 0.72 -0.19 0.20 -2.12 0.00 0.00 175.29 173.90 1n1t s GLY 560 N -0.89 0.94 0.05 3.09 0.00 -0.36 -2.04 107.32 108.11 1n1t s GLY 560 Ca 0.13 -0.83 0.03 0.00 0.00 0.00 0.00 44.72 44.05 1n1t s GLY 560 CO 0.03 -0.70 -0.10 -0.56 0.00 0.00 0.00 173.10 171.77 1n1t s SER 561 N -0.50 1.11 -0.13 1.64 0.01 -0.22 -1.78 113.70 113.83 1n1t s SER 561 Ca 0.07 -0.55 0.01 0.00 1.31 0.00 0.00 55.95 56.79 1n1t s SER 561 Cb -0.07 0.00 0.02 0.00 0.21 0.00 0.00 66.02 66.18 1n1t s SER 561 CO -0.01 -0.15 -0.17 -0.69 0.41 0.00 0.00 173.24 172.63 1n1t s VAL 562 N -1.29 1.69 -0.08 3.43 1.01 -1.26 -0.88 120.40 123.01 1n1t s VAL 562 Ca -0.07 -0.74 0.02 0.00 0.00 0.00 0.00 61.98 61.19 1n1t s VAL 562 Cb -0.10 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 34.72 1n1t s VAL 562 CO 0.01 0.48 -0.12 -0.31 0.00 0.00 0.00 175.10 175.16 1n1t s TYR 563 N 1.09 2.80 -0.12 5.22 1.51 0.83 -0.26 117.35 128.43 1n1t s TYR 563 Ca -0.03 -0.28 0.03 0.00 -1.01 0.00 0.00 57.07 55.79 1n1t s TYR 563 Cb -0.14 -1.73 0.00 0.00 -0.11 0.00 0.00 41.96 39.98 1n1t s TYR 563 CO -0.05 0.08 -0.23 0.08 -1.11 0.00 0.00 175.55 174.32 1n1t s VAL 564 N -0.35 2.07 -1.57 0.71 1.01 -0.36 -1.53 120.40 120.38 1n1t s VAL 564 Ca 0.04 -1.00 -0.14 0.00 0.00 0.00 0.00 61.98 60.89 1n1t s VAL 564 Cb -0.12 -1.80 0.10 0.00 0.00 0.00 0.00 36.38 34.55 1n1t s VAL 564 CO 0.02 0.56 0.85 0.47 0.00 0.00 0.00 175.10 177.00 1n1t n ASP 565 N 3.76 -3.68 0.00 3.32 8.00 0.24 -2.01 116.55 126.18 1n1t n ASP 565 Ca -0.19 -0.88 0.00 0.00 0.71 0.00 0.00 54.79 54.42 1n1t n ASP 565 Cb 0.52 -3.43 0.00 0.00 -0.02 0.00 0.00 41.12 38.20 1n1t n ASP 565 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1n1t n GLY 566 N -1.61 0.82 3.26 0.44 0.00 -1.26 -5.02 105.19 101.82 1n1t n GLY 566 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1n1t n GLY 566 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n1t s GLN 567 N -0.02 2.07 0.36 1.61 -1.52 -0.85 -4.91 119.66 116.41 1n1t s GLN 567 Ca 0.00 -0.84 -0.27 0.00 -1.95 0.00 0.00 55.36 52.30 1n1t s GLN 567 Cb 0.00 -1.91 -0.09 0.00 -0.22 0.00 0.00 33.01 30.79 1n1t s GLN 567 CO 0.00 0.45 1.21 -1.25 -0.25 0.00 0.00 175.29 175.45 1n1t s PRO 568 N -0.39 4.22 0.46 2.91 0.04 -1.26 -1.22 135.00 139.76 1n1t s PRO 568 Ca 0.04 1.98 -0.20 0.00 0.04 0.00 0.00 61.00 62.87 1n1t s PRO 568 Cb -0.11 -2.88 -0.10 0.00 0.04 0.00 0.00 34.50 31.45 1n1t s PRO 568 CO 0.01 -0.22 0.97 -0.51 0.04 0.00 0.00 177.00 177.28 1n1t s LEU 569 N -2.12 3.85 0.22 -3.56 1.43 0.65 -4.89 118.68 114.25 1n1t s LEU 569 Ca 0.53 1.68 -0.31 0.00 -1.03 0.00 0.00 54.13 55.00 1n1t s LEU 569 Cb -0.34 -4.53 -0.15 0.00 0.03 0.00 0.00 46.19 41.19 1n1t s LEU 569 CO 0.44 -0.46 1.07 0.00 0.23 0.00 0.00 176.35 177.64 1n1t n ALA 570 N -0.92 -0.64 -0.00 4.21 0.00 -1.26 -1.88 120.51 120.01 1n1t n ALA 570 Ca 0.07 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1n1t n ALA 570 Cb 0.54 -2.01 0.00 0.00 0.00 0.00 0.00 19.45 17.98 1n1t n ALA 570 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n1t n GLY 571 N 1.70 0.14 3.79 0.00 0.00 -1.26 -4.95 105.19 104.61 1n1t n GLY 571 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 1n1t n GLY 571 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1n1t s SER 572 N -2.12 5.33 0.00 1.61 0.01 -0.79 -4.26 113.70 113.48 1n1t s SER 572 Ca 0.00 1.87 0.00 0.00 1.31 0.00 0.00 55.95 59.13 1n1t s SER 572 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 1n1t s SER 572 CO 0.00 -1.48 0.00 0.61 0.41 0.00 0.00 173.24 172.78 1n1t n GLY 573 N -0.94 0.85 3.89 3.44 0.00 -0.73 -5.00 105.19 106.70 1n1t n GLY 573 Ca 0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 1n1t n GLY 573 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1n1t s ASN 574 N -2.00 4.99 0.09 1.61 0.01 -1.25 -4.83 114.94 113.56 1n1t s ASN 574 Ca 0.00 -0.83 -0.31 0.00 -0.71 0.00 0.00 52.86 51.01 1n1t s ASN 574 Cb 0.00 -0.35 -0.07 0.00 0.41 0.00 0.00 41.25 41.24 1n1t s ASN 574 CO 0.00 -0.77 1.32 -0.89 -1.51 0.00 0.00 177.10 175.25 1n1t s THR 575 N -2.53 3.58 -0.22 1.60 2.01 -1.26 -1.22 115.64 117.59 1n1t s THR 575 Ca 0.47 1.13 0.07 0.00 0.31 0.00 0.00 61.69 63.67 1n1t s THR 575 Cb -0.03 -3.72 -0.09 0.00 0.01 0.00 0.00 72.50 68.66 1n1t s THR 575 CO 0.28 0.08 0.26 1.33 -0.69 0.00 0.00 174.62 175.87 1n1t n VAL 576 N 3.98 0.00 -4.46 3.82 0.24 0.60 -4.88 118.33 117.63 1n1t n VAL 576 Ca 0.11 -0.27 -0.28 0.00 -2.04 0.00 0.00 64.34 61.85 1n1t n VAL 576 Cb 0.44 0.76 -0.17 0.00 -1.47 0.00 0.00 33.84 33.40 1n1t n VAL 576 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1n1t s VAL 577 N -1.98 1.43 0.27 3.34 0.11 -1.20 -4.39 120.40 117.98 1n1t s VAL 577 Ca 0.01 -0.61 0.07 0.00 -2.93 0.00 0.00 61.98 58.52 1n1t s VAL 577 Cb 0.05 -1.31 -0.03 0.00 -1.53 0.00 0.00 36.38 33.56 1n1t s VAL 577 CO 0.30 0.43 0.21 -0.13 -3.33 0.00 0.00 175.10 172.58 1n1t s ARG 578 N 0.97 2.87 0.42 1.54 3.00 -1.26 -4.94 118.95 121.55 1n1t s ARG 578 Ca -0.07 -1.11 0.00 0.00 0.00 0.00 0.00 55.73 54.54 1n1t s ARG 578 Cb -0.15 -2.54 0.00 0.00 0.00 0.00 0.00 34.95 32.27 1n1t s ARG 578 CO -0.01 0.34 0.00 0.41 0.00 0.00 0.00 175.30 176.04 1n1t n GLY 579 N -1.21 -1.83 0.00 -3.53 0.00 -1.26 -4.66 105.19 92.70 1n1t n GLY 579 Ca -0.07 -1.81 0.04 0.00 0.00 0.00 0.00 46.02 44.18 1n1t n GLY 579 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1t n ALA 580 N 0.09 2.63 -2.21 4.61 0.00 -1.26 -5.02 120.51 119.36 1n1t n ALA 580 Ca 0.00 -0.19 -0.42 0.00 0.00 0.00 0.00 53.44 52.83 1n1t n ALA 580 Cb 0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 19.45 19.16 1n1t n ALA 580 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1n1t s THR 581 N -2.06 3.46 0.36 0.00 2.01 -1.26 -4.97 115.64 113.18 1n1t s THR 581 Ca 0.00 1.07 -0.28 0.00 0.31 0.00 0.00 61.69 62.79 1n1t s THR 581 Cb 0.05 -3.68 -0.11 0.00 0.01 0.00 0.00 72.50 68.76 1n1t s THR 581 CO 0.30 0.09 1.48 0.18 -0.69 0.00 0.00 174.62 175.98 1n1t n LEU 582 N 3.77 4.52 -4.53 4.42 4.77 -1.26 -4.97 117.00 123.72 1n1t n LEU 582 Ca 0.10 1.21 -0.29 0.00 -0.03 0.00 0.00 56.01 57.00 1n1t n LEU 582 Cb 0.43 -1.60 0.23 0.00 -2.33 0.00 0.00 43.42 40.16 1n1t n LEU 582 CO 0.58 0.06 0.56 -2.84 -1.33 0.00 0.00 177.39 174.42 1n1t s PRO 583 N -1.81 -0.44 -0.46 3.23 0.02 -1.26 -5.01 135.00 129.26 1n1t s PRO 583 Ca 0.55 1.07 0.03 0.00 0.02 0.00 0.00 61.00 62.67 1n1t s PRO 583 Cb -0.49 -1.59 0.15 0.00 0.02 0.00 0.00 34.50 32.58 1n1t s PRO 583 CO 0.61 -3.47 0.29 0.34 -0.33 0.00 0.00 177.00 174.44 1n1t s ASP 584 N -2.51 3.33 0.11 2.53 2.15 -1.26 -4.82 116.67 116.20 1n1t s ASP 584 Ca 0.68 -2.84 -0.31 0.00 0.43 0.00 0.00 52.55 50.52 1n1t s ASP 584 Cb -0.25 -0.94 -0.07 0.00 -0.30 0.00 0.00 42.92 41.36 1n1t s ASP 584 CO 0.63 -0.23 1.30 -0.63 -0.17 0.00 0.00 175.17 176.07 1n1t s ILE 585 N 0.11 3.56 -0.01 4.11 1.01 -1.26 -1.24 121.20 127.48 1n1t s ILE 585 Ca 0.22 1.15 -0.19 0.00 0.00 0.00 0.00 60.65 61.83 1n1t s ILE 585 Cb -0.16 -3.74 -0.33 0.00 0.01 0.00 0.00 42.46 38.24 1n1t s ILE 585 CO -0.06 0.11 0.95 0.77 0.00 0.00 0.00 174.94 176.71 1n1t h SER 586 N 6.49 0.66 -4.55 3.58 4.64 -1.09 -1.08 113.55 122.21 1n1t h SER 586 Ca -0.42 -0.93 0.23 0.00 -0.47 0.00 0.00 61.79 60.19 1n1t h SER 586 Cb 1.21 -0.22 -0.17 0.00 -0.31 0.00 0.00 62.40 62.92 1n1t h SER 586 CO 0.83 1.55 0.73 -1.38 -0.87 0.00 0.00 176.83 177.68 1n1t s HIS 587 N -2.53 -0.17 -0.02 4.77 -3.43 -1.25 -1.36 115.29 111.31 1n1t s HIS 587 Ca -0.11 0.08 -0.17 0.00 -0.80 0.00 0.00 55.06 54.06 1n1t s HIS 587 Cb 0.02 0.53 -0.05 0.00 -1.43 0.00 0.00 32.58 31.65 1n1t s HIS 587 CO 0.89 -0.31 0.48 -0.06 -2.00 0.00 0.00 174.74 173.73 1n1t s PHE 588 N -2.61 3.68 -0.01 0.38 0.40 0.05 -0.97 117.98 118.90 1n1t s PHE 588 Ca 0.09 1.04 0.00 0.00 -0.60 0.00 0.00 56.93 57.46 1n1t s PHE 588 Cb -0.00 -2.44 -0.04 0.00 0.51 0.00 0.00 43.02 41.05 1n1t s PHE 588 CO -0.05 0.47 0.04 1.52 0.70 0.00 0.00 175.22 177.89 1n1t s TYR 589 N -0.50 3.18 -0.10 0.36 -0.85 -0.18 -0.84 117.35 118.42 1n1t s TYR 589 Ca 0.26 0.15 -0.01 0.00 -0.52 0.00 0.00 57.07 56.95 1n1t s TYR 589 Cb -0.17 -1.71 0.03 0.00 0.38 0.00 0.00 41.96 40.49 1n1t s TYR 589 CO 0.14 0.51 -0.06 0.42 -1.52 0.00 0.00 175.55 175.04 1n1t s ILE 590 N -1.13 0.89 0.00 -3.49 1.01 -0.31 -1.87 121.20 116.30 1n1t s ILE 590 Ca 0.21 -0.20 0.00 0.00 0.00 0.00 0.00 60.65 60.66 1n1t s ILE 590 Cb -0.12 -0.94 0.00 0.00 0.01 0.00 0.00 42.46 41.42 1n1t s ILE 590 CO 0.11 0.35 0.00 0.61 0.00 0.00 0.00 174.94 176.01 1n1t n GLY 591 N 4.99 0.53 2.76 6.18 0.00 0.65 -0.62 105.19 119.68 1n1t n GLY 591 Ca -0.11 -0.89 -0.25 0.00 0.00 0.00 0.00 46.02 44.76 1n1t n GLY 591 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n1t n GLY 592 N 0.00 5.29 3.77 -0.02 0.00 -0.70 -3.73 105.19 109.79 1n1t n GLY 592 Ca 0.00 -2.59 -0.35 0.00 0.00 0.00 0.00 46.02 43.07 1n1t n GLY 592 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1n1t s PRO 593 N -3.34 3.29 -0.19 1.61 0.04 -1.23 -3.97 135.00 131.21 1n1t s PRO 593 Ca 0.47 1.65 -0.30 0.00 0.04 0.00 0.00 61.00 62.85 1n1t s PRO 593 Cb 0.31 -1.99 0.15 0.00 0.04 0.00 0.00 34.50 33.01 1n1t s PRO 593 CO -0.13 -0.90 1.13 -0.98 0.04 0.00 0.00 177.00 176.15 1n1t s ARG 594 N -3.29 0.40 0.00 4.56 1.04 -1.26 -4.96 118.95 115.44 1n1t s ARG 594 Ca 0.73 0.04 0.00 0.00 -1.04 0.00 0.00 55.73 55.46 1n1t s ARG 594 Cb -0.25 0.19 0.00 0.00 -2.04 0.00 0.00 34.95 32.85 1n1t s ARG 594 CO 0.28 -0.14 0.45 -1.13 -0.04 0.00 0.00 175.30 174.72 1n1t n SER 595 N 0.49 0.90 -3.19 -2.89 3.41 -1.26 -4.62 113.62 106.46 1n1t n SER 595 Ca -0.05 -0.95 -0.06 0.00 -0.26 0.00 0.00 58.87 57.54 1n1t n SER 595 Cb 0.58 0.10 0.02 0.00 -0.26 0.00 0.00 64.21 64.65 1n1t n SER 595 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1n1t s LYS 596 N -0.10 1.80 2.42 4.33 -2.85 -1.26 -5.15 119.74 118.93 1n1t s LYS 596 Ca 0.00 -1.14 0.00 0.00 -1.00 0.00 0.00 55.97 53.83 1n1t s LYS 596 Cb 0.00 0.51 0.00 0.00 -2.06 0.00 0.00 37.83 36.28 1n1t s LYS 596 CO 0.00 -0.84 0.00 0.41 0.10 0.00 0.00 175.35 175.02 1n1t n GLY 597 N -0.59 -0.98 3.73 0.59 0.00 -1.26 -4.82 105.19 101.87 1n1t n GLY 597 Ca -0.06 -1.21 -0.40 0.00 0.00 0.00 0.00 46.02 44.35 1n1t n GLY 597 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1t n ALA 598 N 3.05 1.68 -1.61 4.61 0.00 -1.26 -4.84 120.51 122.15 1n1t n ALA 598 Ca 0.00 0.24 -0.40 0.00 0.00 0.00 0.00 53.44 53.28 1n1t n ALA 598 Cb 0.00 -2.34 -0.02 0.00 0.00 0.00 0.00 19.45 17.10 1n1t n ALA 598 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1n1t n PRO 599 N -0.18 3.71 -1.67 0.00 -0.04 -1.26 -4.97 135.00 130.59 1n1t n PRO 599 Ca 0.06 -2.63 -0.43 0.00 -0.04 0.00 0.00 63.50 60.47 1n1t n PRO 599 Cb 0.41 -2.87 -0.00 0.00 -0.04 0.00 0.00 33.50 30.99 1n1t n PRO 599 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1n1t n THR 600 N 3.50 2.09 -3.34 0.52 -1.04 -1.26 -4.73 114.28 110.02 1n1t n THR 600 Ca 0.67 -0.50 -0.22 0.00 -2.04 0.00 0.00 64.05 61.97 1n1t n THR 600 Cb 0.28 -1.42 -0.09 0.00 -1.82 0.00 0.00 70.33 67.28 1n1t n THR 600 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1n1t s ASP 601 N -0.42 1.43 -0.33 8.00 -1.08 -1.26 -0.42 116.67 122.60 1n1t s ASP 601 Ca 0.57 -2.18 -0.25 0.00 -0.52 0.00 0.00 52.55 50.17 1n1t s ASP 601 Cb -0.59 0.16 0.01 0.00 -1.46 0.00 0.00 42.92 41.04 1n1t s ASP 601 CO 0.61 -0.23 0.88 -0.44 0.52 0.00 0.00 175.17 176.51 1n1t s SER 602 N 0.89 6.72 -1.15 -0.34 0.01 -1.26 -4.92 113.70 113.64 1n1t s SER 602 Ca 0.23 0.70 -0.15 0.00 1.31 0.00 0.00 55.95 58.05 1n1t s SER 602 Cb -0.10 -2.45 0.17 0.00 0.21 0.00 0.00 66.02 63.84 1n1t s SER 602 CO -0.07 -0.73 1.37 -0.13 0.41 0.00 0.00 173.24 174.09 1n1t s ARG 603 N 3.23 4.00 0.18 12.44 1.81 -1.26 -4.59 118.95 134.75 1n1t s ARG 603 Ca 0.36 -2.44 0.02 0.00 -1.72 0.00 0.00 55.73 51.95 1n1t s ARG 603 Cb -0.13 -5.02 -0.05 0.00 -0.45 0.00 0.00 34.95 29.30 1n1t s ARG 603 CO 0.15 -1.76 0.00 0.14 -0.68 0.00 0.00 175.30 173.16 1n1t s VAL 604 N 1.72 0.71 -0.08 3.52 -7.23 -1.25 -0.34 120.40 117.44 1n1t s VAL 604 Ca 0.40 -1.99 0.02 0.00 -1.81 0.00 0.00 61.98 58.61 1n1t s VAL 604 Cb -0.03 -2.16 0.01 0.00 0.56 0.00 0.00 36.38 34.76 1n1t s VAL 604 CO -0.02 -0.44 -0.13 -0.89 -0.31 0.00 0.00 175.10 173.30 1n1t s THR 605 N -3.63 1.29 -0.04 5.32 2.01 -0.30 -1.09 115.64 119.19 1n1t s THR 605 Ca 0.25 -0.54 0.04 0.00 0.31 0.00 0.00 61.69 61.75 1n1t s THR 605 Cb 0.06 -1.18 -0.00 0.00 0.01 0.00 0.00 72.50 71.39 1n1t s THR 605 CO 0.05 0.39 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.51 1n1t s VAL 606 N 0.83 1.39 0.11 3.82 1.01 0.07 -0.77 120.40 126.85 1n1t s VAL 606 Ca -0.11 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.21 1n1t s VAL 606 Cb -0.15 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 1n1t s VAL 606 CO 0.02 0.40 -0.10 0.42 0.00 0.00 0.00 175.10 175.83 1n1t s THR 607 N -0.01 1.01 -0.92 3.92 -4.23 -0.10 -1.66 115.64 113.65 1n1t s THR 607 Ca -0.02 -1.74 -0.08 0.00 -1.18 0.00 0.00 61.69 58.67 1n1t s THR 607 Cb -0.11 -1.48 -0.00 0.00 1.34 0.00 0.00 72.50 72.25 1n1t s THR 607 CO 0.02 -0.59 0.70 0.59 -0.54 0.00 0.00 174.62 174.79 1n1t n ASN 608 N 0.39 -5.91 -4.63 3.99 5.03 -0.72 -1.52 115.26 111.90 1n1t n ASN 608 Ca -0.15 -0.72 -0.41 0.00 0.87 0.00 0.00 54.58 54.18 1n1t n ASN 608 Cb 0.58 -3.37 -0.06 0.00 -1.02 0.00 0.00 39.78 35.91 1n1t n ASN 608 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1n1t s VAL 609 N -3.17 4.98 -0.05 2.41 1.01 0.05 -4.14 120.40 121.50 1n1t s VAL 609 Ca 0.18 1.16 0.06 0.00 0.00 0.00 0.00 61.98 63.38 1n1t s VAL 609 Cb -0.06 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.35 1n1t s VAL 609 CO 0.84 0.03 -0.23 -0.69 0.00 0.00 0.00 175.10 175.05 1n1t s VAL 610 N 2.45 2.26 -0.09 2.92 1.01 0.16 -0.48 120.40 128.62 1n1t s VAL 610 Ca 0.27 -1.01 0.03 0.00 0.00 0.00 0.00 61.98 61.27 1n1t s VAL 610 Cb -0.16 -1.82 0.01 0.00 0.00 0.00 0.00 36.38 34.41 1n1t s VAL 610 CO 0.09 0.57 -0.20 -0.22 0.00 0.00 0.00 175.10 175.34 1n1t s LEU 611 N -0.39 1.94 0.13 3.92 2.96 -0.08 -0.74 118.68 126.41 1n1t s LEU 611 Ca 0.03 -0.48 0.10 0.00 -0.22 0.00 0.00 54.13 53.57 1n1t s LEU 611 Cb -0.12 -1.22 -0.04 0.00 0.50 0.00 0.00 46.19 45.31 1n1t s LEU 611 CO 0.02 0.11 -0.25 -0.31 -1.32 0.00 0.00 176.35 174.60 1n1t s TYR 612 N 0.51 2.37 -0.36 5.38 1.51 -0.10 -0.41 117.35 126.25 1n1t s TYR 612 Ca -0.16 -0.35 0.02 0.00 -1.01 0.00 0.00 57.07 55.57 1n1t s TYR 612 Cb -0.17 -1.27 0.43 0.00 -0.11 0.00 0.00 41.96 40.84 1n1t s TYR 612 CO 0.06 0.36 1.74 0.27 -1.11 0.00 0.00 175.55 176.87 1n1t n ASN 613 N 0.85 4.39 -3.83 2.29 0.23 -0.41 -1.67 115.26 117.12 1n1t n ASN 613 Ca -0.17 -3.20 -0.06 0.00 -0.53 0.00 0.00 54.58 50.62 1n1t n ASN 613 Cb 0.53 -0.81 -0.02 0.00 -2.08 0.00 0.00 39.78 37.40 1n1t n ASN 613 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1n1t s ARG 614 N -2.42 1.65 -0.30 -3.83 1.70 -1.26 -4.73 118.95 109.76 1n1t s ARG 614 Ca 0.42 -0.91 -0.21 0.00 -0.47 0.00 0.00 55.73 54.55 1n1t s ARG 614 Cb 0.34 0.57 -0.01 0.00 -0.57 0.00 0.00 34.95 35.28 1n1t s ARG 614 CO 0.06 -0.76 0.68 0.50 -1.08 0.00 0.00 175.30 174.70 1n1t s ARG 615 N -3.78 3.92 0.55 3.89 3.52 -1.26 -2.50 118.95 123.29 1n1t s ARG 615 Ca 0.11 0.39 -0.20 0.00 -0.13 0.00 0.00 55.73 55.91 1n1t s ARG 615 Cb -0.05 -3.73 -0.05 0.00 -1.56 0.00 0.00 34.95 29.56 1n1t s ARG 615 CO 0.06 -0.60 1.16 -0.51 -0.81 0.00 0.00 175.30 174.60 1n1t s LEU 616 N 2.71 3.75 0.77 -0.88 1.43 -1.26 -5.02 118.68 120.19 1n1t s LEU 616 Ca 0.27 2.26 -0.06 0.00 -1.03 0.00 0.00 54.13 55.57 1n1t s LEU 616 Cb -0.15 -4.55 0.12 0.00 0.03 0.00 0.00 46.19 41.64 1n1t s LEU 616 CO 0.12 -1.31 1.07 0.54 0.23 0.00 0.00 176.35 177.00 1n1t s ASN 617 N -1.66 4.24 0.29 2.29 2.20 -1.26 -4.83 114.94 116.20 1n1t s ASN 617 Ca 0.73 0.09 -0.02 0.00 -0.94 0.00 0.00 52.86 52.72 1n1t s ASN 617 Cb -0.27 -0.50 0.41 0.00 -2.00 0.00 0.00 41.25 38.90 1n1t s ASN 617 CO 0.30 -1.96 1.91 0.77 -2.94 0.00 0.00 177.10 175.18 1n1t h SER 618 N -0.80 0.90 -0.67 3.54 4.64 -2.00 -1.32 113.55 117.83 1n1t h SER 618 Ca -0.41 -0.08 -0.06 0.00 -0.47 0.00 0.00 61.79 60.77 1n1t h SER 618 Cb 1.28 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 63.11 1n1t h SER 618 CO 0.47 0.73 0.19 -1.28 -0.87 0.00 0.00 176.83 176.08 1n1t h SER 619 N 1.01 1.01 -0.19 4.97 0.87 -2.00 -1.74 113.55 117.49 1n1t h SER 619 Ca 0.25 -0.19 -0.15 0.00 -1.23 0.00 0.00 61.79 60.47 1n1t h SER 619 Cb 0.04 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.73 1n1t h SER 619 CO -0.04 0.95 -0.43 -0.33 -0.53 0.00 0.00 176.83 176.45 1n1t h GLU 620 N 1.03 0.74 -0.44 2.24 5.08 -1.69 -1.22 114.58 120.32 1n1t h GLU 620 Ca 0.22 -0.40 -0.05 0.00 -1.00 0.00 0.00 59.36 58.13 1n1t h GLU 620 Cb 0.32 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1n1t h GLU 620 CO -0.00 1.02 0.06 0.82 -1.00 0.00 0.00 179.01 179.91 1n1t h ILE 621 N 0.60 1.25 -0.53 3.13 2.04 -1.09 -1.52 117.51 121.38 1n1t h ILE 621 Ca 0.04 -0.91 -0.02 0.00 1.00 0.00 0.00 64.86 64.97 1n1t h ILE 621 Cb 0.99 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 1n1t h ILE 621 CO 0.09 0.31 0.24 -0.09 0.00 0.00 0.00 178.15 178.71 1n1t h ARG 622 N 0.59 0.78 -0.47 2.37 2.43 -1.17 -1.12 114.38 117.78 1n1t h ARG 622 Ca 0.13 -0.13 0.03 0.00 -0.81 0.00 0.00 59.98 59.21 1n1t h ARG 622 Cb 0.39 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.77 1n1t h ARG 622 CO 0.01 0.66 0.25 1.15 -1.51 0.00 0.00 179.97 180.53 1n1t h THR 623 N 0.72 0.99 -0.67 0.20 2.02 -0.93 -0.13 112.91 115.10 1n1t h THR 623 Ca 0.18 -0.17 -0.03 0.00 0.77 0.00 0.00 66.41 67.16 1n1t h THR 623 Cb 0.15 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 1n1t h THR 623 CO -0.02 0.09 0.29 -0.07 0.37 0.00 0.00 175.52 176.18 1n1t h LEU 624 N 0.49 0.91 -1.17 2.58 3.38 -1.03 -1.37 115.31 119.10 1n1t h LEU 624 Ca 0.20 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 58.04 1n1t h LEU 624 Cb 0.08 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.55 1n1t h LEU 624 CO -0.13 0.82 0.57 0.15 0.09 0.00 0.00 178.44 179.94 1n1t h PHE 625 N 0.95 1.04 0.00 1.13 3.57 -0.57 -2.39 116.94 120.67 1n1t h PHE 625 Ca 0.23 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.75 1n1t h PHE 625 Cb 0.18 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.57 1n1t h PHE 625 CO 0.01 0.61 -0.24 1.28 -2.23 0.00 0.00 178.31 177.74 1n1t n LEU 626 N -4.44 0.77 -0.83 0.59 4.77 -0.12 -3.95 117.00 113.78 1n1t n LEU 626 Ca 0.11 0.44 0.07 0.00 -0.03 0.00 0.00 56.01 56.60 1n1t n LEU 626 Cb 0.10 -0.27 0.23 0.00 -2.33 0.00 0.00 43.42 41.16 1n1t n LEU 626 CO 0.35 -0.13 0.69 -1.54 -1.33 0.00 0.00 177.39 175.43 1n1t n SER 627 N -2.20 3.44 0.26 -1.43 3.41 -0.55 -4.65 113.62 111.90 1n1t n SER 627 Ca 0.05 -3.16 0.08 0.00 -0.26 0.00 0.00 58.87 55.58 1n1t n SER 627 Cb 0.43 -0.55 0.65 0.00 -0.26 0.00 0.00 64.21 64.49 1n1t n SER 627 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1n1t h GLN 628 N 1.42 0.00 -0.11 4.33 4.20 -1.64 0.41 115.11 123.71 1n1t h GLN 628 Ca 0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1n1t h GLN 628 Cb 1.43 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.21 1n1t h GLN 628 CO 0.22 0.02 0.00 -0.25 -0.67 0.00 0.00 178.83 178.16 1n1t n ASP 629 N -4.45 1.36 -0.08 1.46 8.00 -1.26 -4.13 116.55 117.46 1n1t n ASP 629 Ca -0.03 -1.61 0.04 0.00 0.71 0.00 0.00 54.79 53.90 1n1t n ASP 629 Cb 0.11 -0.07 -0.03 0.00 -0.02 0.00 0.00 41.12 41.11 1n1t n ASP 629 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1n1t n MET 630 N 0.11 3.50 0.00 -1.24 2.81 0.13 -4.71 117.12 117.72 1n1t n MET 630 Ca 0.17 -0.22 0.08 0.00 -1.81 0.00 0.00 57.70 55.91 1n1t n MET 630 Cb 0.29 -0.94 -0.09 0.00 -0.71 0.00 0.00 33.22 31.78 1n1t n MET 630 CO 0.00 0.00 0.00 0.44 1.51 0.00 0.00 175.97 177.92 1n1t n ILE 631 N -0.83 0.00 -1.62 2.02 -5.35 -1.20 -5.02 119.36 107.36 1n1t n ILE 631 Ca 0.02 -0.12 -0.34 0.00 -0.27 0.00 0.00 62.75 62.04 1n1t n ILE 631 Cb 0.14 1.02 0.07 0.00 -1.74 0.00 0.00 39.64 39.13 1n1t n ILE 631 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1n1t s GLY 632 N -2.54 2.32 0.00 3.28 0.00 -1.26 -4.94 107.32 104.17 1n1t s GLY 632 Ca 0.07 0.77 0.27 0.00 0.00 0.00 0.00 44.72 45.82 1n1t s GLY 632 CO 0.67 1.15 1.63 -1.30 0.00 0.00 0.00 173.10 175.25 1n1t n THR 633 N -2.48 0.00 0.00 0.90 -2.24 -1.26 -5.03 114.28 104.17 1n1t n THR 633 Ca 0.12 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1n1t n THR 633 Cb 0.51 0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.82 1n1t n THR 633 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60