# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 A C C 60.16 9.46 16.38 26.24 113.09 -153.00 -91.18 128.92 99.90 0.08 0.01 99.86 0.05 0.03 0.00 0.00 0.00 0.04 0.01 1 A C C 43.29 12.91 14.42 27.58 118.41 -155.34 -96.83 135.71 95.59 3.18 1.23 91.22 1.01 3.93 0.35 0.54 0.00 2.26 0.69 2 K C C 111.91 7.21 21.31 28.90 113.47 -140.42 -91.92 125.98 89.59 8.98 1.43 62.52 19.79 6.99 0.38 1.18 0.00 6.43 2.71 3 I C C 8.75 25.12 11.75 36.77 120.32 -155.13 -103.62 134.50 88.12 11.52 0.36 82.04 5.30 0.27 0.18 0.16 0.00 5.10 6.95 4 R C C 104.10 5.74 24.06 29.96 130.53 -168.69 -120.07 157.10 96.53 3.32 0.15 96.17 0.83 0.11 0.05 0.05 0.00 1.38 1.41 5 R C T 117.59 11.34 15.73 27.21 109.74 -89.41 -61.69 138.99 99.02 0.71 0.27 0.32 1.66 97.37 0.01 0.16 0.00 0.40 0.08 6 D C T 101.12 3.79 20.79 25.24 93.46 16.64 73.68 5.51 99.65 0.24 0.11 0.32 1.83 97.57 0.00 0.09 0.00 0.17 0.01 7 D C C 27.67 15.70 14.76 31.33 118.53 137.33 -73.56 146.77 96.72 3.25 0.02 93.55 3.06 0.11 0.00 0.02 0.00 3.13 0.12 8 E E E 81.02 8.46 24.70 33.62 114.98 -120.36 -85.03 132.99 4.15 95.84 0.02 4.27 0.14 0.01 0.01 0.01 0.00 94.39 1.17 9 V E E 3.21 25.78 17.03 43.50 131.00 -173.69 -128.14 149.45 1.82 98.16 0.02 1.69 0.09 0.02 0.00 0.01 0.00 98.09 0.10 10 I E E 32.76 11.87 26.11 39.13 118.87 -142.75 -110.22 130.10 2.97 96.73 0.30 2.68 0.25 0.13 0.10 0.16 0.00 96.52 0.15 11 V E E 9.65 21.64 17.73 40.13 109.56 -126.14 -79.39 122.88 16.27 83.60 0.14 15.71 0.66 0.13 0.03 0.09 0.00 82.46 0.92 12 L C C 47.76 11.90 21.47 34.16 99.71 176.34 -98.72 -23.70 90.83 8.89 0.27 62.21 26.00 2.24 0.04 0.28 0.00 8.60 0.63 13 T C S 59.14 5.18 22.18 28.09 139.72 15.08 -149.54 158.24 95.66 3.75 0.59 11.87 79.16 4.97 0.08 0.43 0.00 2.13 1.36 14 G C S 36.36 4.82 18.83 24.79 126.16 32.49 88.99 -162.78 91.13 1.46 7.41 6.66 74.80 10.20 0.61 6.12 0.00 0.56 1.05 15 K C T 155.54 2.37 18.44 21.30 93.28 -42.01 -69.85 -21.68 86.39 0.78 12.83 1.64 21.38 63.17 0.45 12.48 0.00 0.38 0.49 16 D C T 37.67 15.35 12.75 28.53 96.24 50.96 -98.87 8.00 88.30 0.88 10.82 4.62 11.57 70.83 0.50 11.53 0.00 0.53 0.41 17 K C T 101.18 10.98 13.79 25.90 110.92 132.13 -61.33 132.51 96.92 0.88 2.20 1.64 2.58 92.99 0.26 1.64 0.00 0.43 0.45 18 G C T 48.81 4.10 19.64 24.42 94.08 21.33 86.06 -2.78 98.36 0.63 1.01 1.55 3.17 93.68 0.08 0.91 0.00 0.50 0.10 19 K C C 83.14 9.94 18.09 29.03 119.85 125.37 -77.24 146.00 96.37 3.40 0.23 91.08 4.48 0.72 0.04 0.21 0.00 3.21 0.26 20 R E E 119.17 10.33 19.98 31.23 127.16 -150.07 -116.94 144.66 9.22 90.70 0.07 8.83 0.61 0.07 0.06 0.03 0.00 85.24 5.16 21 G E E 9.42 15.25 20.45 36.07 143.45 148.53 -159.58 176.19 4.36 95.62 0.02 3.63 0.47 0.04 0.00 0.01 0.00 95.79 0.06 22 K E E 94.02 6.83 25.76 33.43 120.04 -84.88 -99.38 139.08 1.54 98.45 0.01 1.34 0.10 0.01 0.00 0.00 0.00 98.51 0.04 23 V E E 6.50 24.88 13.13 38.88 110.01 -116.00 -75.37 125.60 2.23 97.74 0.04 2.17 0.07 0.01 0.01 0.02 0.00 97.67 0.06 24 K E E 98.59 6.04 22.80 29.51 100.36 176.03 -97.00 -29.37 3.55 96.35 0.11 2.53 0.74 0.07 0.01 0.08 0.00 96.52 0.04 25 N E E 74.46 5.16 24.83 30.72 138.77 -0.18 -154.11 151.06 1.07 98.89 0.04 0.78 0.14 0.02 0.00 0.02 0.00 99.03 0.01 26 V E E 39.40 20.09 14.02 33.13 121.32 -149.61 -117.53 128.25 1.62 98.35 0.03 1.44 0.10 0.02 0.01 0.01 0.00 98.20 0.21 27 L E E 46.35 10.59 14.66 26.87 118.58 -136.45 -80.91 153.90 49.64 50.18 0.18 46.72 1.27 0.28 0.03 0.11 0.00 50.95 0.63 28 S C T 88.54 2.86 15.36 19.45 93.10 -109.97 -63.83 -21.68 82.42 14.31 3.28 11.62 9.08 61.87 0.26 3.20 0.00 13.35 0.62 29 S C T 76.85 2.91 17.40 20.57 94.23 54.87 -83.48 1.50 97.62 0.52 1.87 19.37 7.58 70.41 0.17 1.98 0.00 0.38 0.11 30 G C C 19.40 13.75 15.06 29.20 97.85 -101.15 86.11 7.11 96.79 1.18 2.04 37.95 28.76 29.40 0.10 2.69 0.00 0.92 0.18 31 K E E 61.66 10.46 21.19 32.44 121.46 132.77 -89.08 148.11 46.79 53.17 0.03 43.95 1.42 0.11 0.00 0.02 0.00 53.92 0.58 32 V E E 5.06 24.18 17.33 42.32 119.91 -146.06 -109.99 131.36 0.67 99.33 0.00 0.62 0.01 0.00 0.00 0.00 0.00 99.35 0.02 33 I E E 36.58 10.95 26.46 38.53 117.35 -157.04 -108.59 126.88 0.07 99.93 0.00 0.06 0.00 0.00 0.00 0.00 0.00 99.94 0.00 34 V E E 5.33 24.59 16.52 41.73 117.47 -166.23 -110.73 124.10 0.23 99.77 0.00 0.22 0.00 0.00 0.00 0.00 0.00 99.77 0.01 35 E E E 92.01 7.11 23.75 31.07 120.70 -158.17 -97.43 144.03 9.51 90.45 0.04 5.20 2.57 1.09 0.00 0.05 0.00 90.98 0.10 36 G E E 32.73 6.63 23.02 30.37 97.87 17.91 79.41 23.14 35.76 64.17 0.07 9.94 20.55 3.72 0.00 0.08 0.00 65.58 0.13 37 I E E 24.90 22.76 12.96 34.67 115.23 143.78 -93.75 129.84 36.13 63.70 0.17 31.95 3.01 0.44 0.03 0.13 0.00 63.99 0.46 38 N E E 76.09 7.39 22.94 30.47 112.64 -158.73 -109.39 105.49 30.94 68.89 0.17 23.89 5.81 0.97 0.02 0.15 0.00 68.65 0.51 39 L E E 58.33 15.61 15.08 30.40 117.48 -162.69 -97.33 131.90 13.95 85.97 0.07 11.76 1.82 0.19 0.01 0.05 0.00 85.61 0.55 40 V E E 53.23 10.42 16.21 27.94 123.59 -169.31 -118.72 137.80 5.52 94.45 0.03 4.88 0.48 0.05 0.01 0.01 0.00 94.36 0.22 41 K E E 117.35 7.58 15.07 24.01 116.53 -137.88 -96.59 130.08 5.00 94.97 0.03 4.35 0.43 0.05 0.01 0.01 0.00 95.04 0.12 42 K E E 102.75 7.38 13.81 22.66 123.19 -167.07 -115.63 140.07 8.14 91.80 0.06 6.69 1.07 0.15 0.01 0.04 0.00 91.89 0.16 43 H E E 111.87 6.53 12.51 20.61 117.50 -127.29 -99.32 134.36 12.74 87.15 0.11 11.08 1.34 0.21 0.03 0.07 0.00 86.64 0.63 44 Q E E 88.48 8.02 11.21 20.81 120.69 -160.85 -106.56 137.74 29.71 70.12 0.17 25.48 3.87 0.41 0.05 0.12 0.00 68.19 1.88 45 K C C 134.82 3.05 13.63 18.04 115.85 -118.42 -86.16 137.95 71.60 28.26 0.14 63.00 6.57 0.38 0.04 0.10 0.00 29.15 0.77 46 P C C 73.80 7.46 9.71 18.79 113.15 -105.53 -67.72 147.20 79.37 19.55 1.08 67.41 9.46 1.72 0.40 0.69 0.00 17.93 2.38 47 V C C 74.91 4.98 9.33 16.46 115.01 -133.60 -99.38 128.87 83.95 13.00 3.05 70.14 10.27 2.21 1.78 1.47 0.00 6.92 7.22 48 P C G 107.55 1.96 9.75 12.98 97.28 -125.06 -65.14 -30.47 52.31 1.65 46.04 16.81 9.83 25.54 5.59 40.68 0.01 0.97 0.56 49 A C G 91.57 1.11 9.69 11.31 96.15 55.58 -74.46 -18.36 52.46 1.27 46.27 13.54 9.63 29.09 5.29 41.20 0.01 0.73 0.53 50 L C G 98.80 3.97 8.23 13.87 101.40 48.12 -92.69 9.40 55.10 1.44 43.46 13.05 13.12 29.18 4.04 39.14 0.01 0.73 0.73 51 N C T 134.73 1.24 11.81 13.69 96.76 -123.23 55.93 34.05 94.36 1.60 4.04 29.89 17.96 46.47 0.61 3.59 0.00 0.96 0.52 52 Q C C 95.16 4.58 10.08 16.78 123.15 121.23 -110.70 144.45 86.44 13.03 0.52 46.15 39.86 1.74 0.15 0.41 0.00 7.40 4.29 53 P C C 105.20 2.28 13.69 16.97 112.03 -101.18 -67.47 143.86 83.80 15.32 0.89 63.15 13.21 7.37 0.17 0.91 0.00 12.46 2.74 54 G C C 35.27 9.81 10.89 21.31 122.92 -142.36 -116.24 173.45 78.75 20.74 0.51 49.57 19.64 9.18 0.06 0.57 0.00 19.82 1.17 55 G E E 33.13 6.02 15.40 22.63 126.80 -157.66 149.24 -175.66 39.79 60.03 0.18 28.80 9.40 1.47 0.02 0.18 0.00 59.41 0.71 56 I E E 89.26 9.82 13.27 24.08 121.57 -77.63 -107.60 134.87 6.19 93.80 0.01 5.53 0.46 0.03 0.00 0.01 0.00 93.67 0.30 57 V E E 59.33 8.88 14.36 24.93 122.94 -167.12 -118.00 137.57 1.54 98.45 0.00 1.44 0.05 0.00 0.00 0.00 0.00 98.45 0.05 58 E E E 113.66 8.16 14.37 24.11 120.59 -151.84 -109.67 133.40 2.57 97.43 0.00 2.11 0.22 0.01 0.00 0.00 0.00 97.62 0.04 59 K E E 94.24 6.70 17.01 25.21 131.08 166.20 -135.56 149.17 4.60 95.36 0.03 3.99 0.39 0.04 0.00 0.02 0.00 95.47 0.09 60 E E E 98.52 11.12 15.96 27.56 117.48 -119.61 -86.24 136.30 10.78 89.17 0.05 9.91 0.71 0.07 0.01 0.03 0.00 88.96 0.31 61 A E E 23.64 13.74 18.17 32.79 135.69 169.09 -139.24 155.87 26.06 73.90 0.03 24.27 0.99 0.06 0.01 0.02 0.00 74.40 0.25 62 A E E 48.64 11.00 21.97 32.89 115.46 -105.33 -74.68 141.91 20.79 79.20 0.01 18.89 1.19 0.05 0.00 0.01 0.00 79.51 0.35 63 I E E 10.48 23.65 15.83 39.63 125.88 -163.99 -120.26 139.75 8.15 91.85 0.01 7.84 0.35 0.01 0.00 0.00 0.00 89.69 2.10 64 Q E E 68.96 8.08 25.19 33.86 109.62 -118.18 -76.75 127.14 18.44 81.54 0.02 19.39 0.23 0.01 0.00 0.01 0.00 78.54 1.82 65 V H G 21.97 22.63 15.68 38.03 91.87 -135.76 -62.51 -29.78 7.56 0.54 91.90 1.61 0.98 3.78 0.77 92.27 0.00 0.59 0.01 66 S H G 60.11 8.57 22.54 31.94 90.63 67.37 -71.23 -15.23 6.79 0.41 92.80 0.52 0.70 4.59 0.52 93.26 0.00 0.40 0.01 67 N H G 54.90 12.44 21.85 34.91 96.94 55.08 -99.19 4.14 7.78 0.47 91.76 1.03 1.03 4.49 0.46 92.54 0.00 0.44 0.01 68 V E E 5.84 25.31 17.28 43.09 121.60 94.77 -103.13 136.53 34.34 64.35 1.32 29.16 4.60 0.57 0.61 0.81 0.01 59.46 4.77 69 A E E 22.16 14.67 25.83 40.45 125.52 -164.16 -115.40 141.64 25.70 74.21 0.09 25.00 0.78 0.08 0.03 0.04 0.00 72.56 1.50 70 I E E 18.05 20.93 21.47 42.00 117.75 -144.33 -104.97 129.07 15.18 84.76 0.07 13.52 1.62 0.13 0.02 0.04 0.00 84.13 0.53 71 F E E 52.76 12.92 19.88 33.67 118.73 -156.75 -106.90 129.65 3.78 96.17 0.04 3.60 0.19 0.01 0.09 0.01 0.00 77.66 18.44 72 N C C 32.70 11.82 14.68 28.59 108.43 -134.57 -87.00 115.74 66.23 33.74 0.03 66.15 0.62 0.06 0.01 0.02 0.00 31.68 1.46 73 A C T 66.50 6.91 14.23 22.92 92.99 -156.83 -65.95 -26.38 99.68 0.07 0.25 0.28 2.97 96.50 0.01 0.18 0.00 0.04 0.02 74 A C T 87.82 1.43 14.79 16.01 96.69 48.14 -75.29 -39.59 99.68 0.05 0.27 0.09 1.96 97.72 0.00 0.18 0.00 0.02 0.01 75 T C T 79.39 3.17 13.56 17.59 100.96 21.14 -104.12 -17.27 99.75 0.04 0.21 0.24 2.31 97.26 0.00 0.16 0.00 0.02 0.01 76 G C C 41.11 7.17 12.19 21.11 96.07 -125.67 77.09 7.60 99.36 0.44 0.20 69.96 8.26 21.14 0.04 0.16 0.00 0.32 0.13 77 K C C 112.98 3.41 18.83 23.13 119.91 134.50 -83.80 146.54 85.08 14.85 0.07 74.10 10.49 0.46 0.01 0.06 0.00 13.66 1.21 78 A E E 43.37 14.51 14.92 29.31 116.28 -108.46 -74.20 142.66 4.20 95.77 0.03 4.02 0.24 0.02 0.04 0.01 0.00 72.72 22.96 79 D E E 36.39 14.21 18.00 32.53 129.77 -171.46 -126.59 156.84 33.13 66.85 0.03 29.02 2.67 0.13 0.00 0.02 0.00 67.93 0.23 80 R E E 98.20 10.78 22.17 32.99 117.44 -110.91 -94.27 134.63 16.58 83.40 0.02 14.40 1.71 0.07 0.00 0.01 0.00 83.31 0.48 81 V E E 20.78 20.28 16.84 36.85 120.43 -155.00 -106.56 134.14 8.69 91.30 0.01 8.35 0.20 0.01 0.00 0.00 0.00 91.31 0.13 82 G E E 11.72 12.16 22.08 35.08 136.76 164.45 -135.28 167.12 1.42 98.57 0.00 1.25 0.05 0.00 0.00 0.00 0.00 98.66 0.03 83 F E E 68.57 15.75 16.52 32.02 128.64 -136.05 -127.75 144.48 0.76 99.24 0.00 0.68 0.02 0.00 0.00 0.00 0.00 99.27 0.02 84 R E E 92.19 8.04 17.53 26.78 132.06 -176.89 -134.33 152.10 0.95 99.04 0.00 0.80 0.06 0.00 0.00 0.00 0.00 99.12 0.02 85 F E E 105.89 8.33 12.30 22.17 115.96 -131.03 -100.11 127.02 5.37 94.62 0.01 4.48 0.48 0.04 0.00 0.01 0.00 94.89 0.09 86 E E E 91.40 6.29 9.64 17.96 121.88 173.06 -133.90 126.13 11.10 88.73 0.17 5.92 3.10 1.63 0.02 0.18 0.00 88.70 0.45 87 D C T 137.85 0.39 11.61 10.54 92.90 -13.94 52.18 40.25 99.56 0.24 0.21 0.58 5.62 93.34 0.00 0.27 0.00 0.16 0.03 88 G C T 64.39 0.90 10.72 11.80 94.52 -50.45 79.28 2.59 99.73 0.10 0.17 0.59 6.55 92.56 0.00 0.22 0.00 0.07 0.01 89 K E E 120.70 2.74 12.37 16.90 125.45 103.63 -114.70 145.19 7.58 92.41 0.01 5.13 2.06 0.13 0.00 0.01 0.00 92.41 0.27 90 K E E 106.60 7.96 12.87 22.41 114.56 -118.78 -83.64 130.41 2.15 97.85 0.00 1.88 0.07 0.00 0.00 0.00 0.00 98.03 0.03 91 V E E 28.80 12.49 15.24 29.59 127.47 -173.45 -125.26 145.92 1.20 98.80 0.00 1.11 0.02 0.00 0.00 0.00 0.00 98.86 0.01 92 R E E 71.60 12.06 19.07 31.98 116.65 -132.41 -97.81 131.14 0.75 99.25 0.00 0.65 0.01 0.00 0.00 0.00 0.00 99.33 0.01 93 F E E 32.19 13.36 18.41 33.28 128.98 -174.06 -126.37 147.30 0.37 99.63 0.00 0.32 0.01 0.00 0.00 0.00 0.00 99.58 0.08 94 F E E 23.66 15.16 14.23 31.15 110.34 -115.23 -77.54 125.76 4.49 95.50 0.01 4.19 0.17 0.01 0.00 0.00 0.00 94.97 0.66 95 K C T 106.08 8.17 16.21 25.58 94.07 -148.29 -66.66 -32.27 98.59 0.96 0.46 0.98 3.57 94.23 0.01 0.41 0.00 0.71 0.09 96 S C T 76.71 3.31 15.93 19.88 97.42 47.82 -76.42 -36.78 99.14 0.32 0.53 0.25 2.11 96.95 0.01 0.44 0.00 0.16 0.08 97 N C T 83.51 4.52 13.63 19.38 102.82 21.19 -108.50 -8.86 99.38 0.18 0.44 0.79 3.27 95.34 0.01 0.43 0.00 0.11 0.03 98 S C C 74.85 5.73 13.06 20.54 94.57 -127.65 68.67 14.70 99.07 0.65 0.28 66.40 7.92 24.77 0.06 0.22 0.00 0.49 0.15 99 E C C 95.91 4.51 14.65 20.98 118.78 141.78 -79.00 145.34 81.14 18.77 0.08 73.18 7.13 0.54 0.02 0.07 0.00 17.76 1.31 100 T E E 79.44 7.00 15.71 24.07 113.94 -115.38 -80.40 134.44 4.39 95.57 0.04 4.06 0.23 0.01 0.07 0.01 0.00 56.37 39.25 101 I C C 33.84 18.88 13.69 31.79 108.75 -160.60 -96.29 108.10 93.07 6.93 0.00 93.10 0.08 0.01 0.00 0.00 0.00 6.77 0.04