# 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 Q C C 99.95 7.21 16.00 24.40 117.36 -163.77 -104.36 133.30 99.83 0.16 0.01 99.83 0.06 0.01 0.00 0.00 0.00 0.09 0.01 1 P C C 82.97 6.73 14.96 23.10 116.63 -121.64 -78.48 144.98 82.49 14.71 2.80 80.66 0.98 1.39 1.38 0.86 0.00 12.76 1.97 2 V C C 51.38 15.10 11.37 26.33 120.34 -153.90 -107.32 134.61 58.55 36.84 4.61 48.72 6.61 2.50 2.43 2.12 0.01 34.58 3.03 3 K E E 124.80 4.84 17.84 24.21 119.86 -153.59 -109.49 133.50 38.68 56.58 4.73 32.49 4.17 1.82 2.79 2.13 0.01 51.36 5.23 4 E C E 84.22 13.24 12.30 25.47 119.48 -154.83 -104.04 137.42 48.50 46.09 5.41 40.15 5.30 2.92 2.21 2.95 0.01 43.47 2.99 5 S C E 59.90 8.48 14.81 24.20 109.94 -161.06 -98.84 99.46 59.07 31.92 9.02 22.46 12.95 26.66 1.61 6.95 0.06 26.71 2.59 6 G C T 52.23 4.10 16.23 21.38 102.15 -27.98 77.74 3.72 85.33 7.18 7.50 10.58 18.53 55.89 0.64 7.31 0.00 5.98 1.07 7 G C T 39.01 9.36 14.92 24.66 111.40 -39.47 91.78 7.79 85.33 10.11 4.56 19.81 30.12 35.62 0.33 4.53 0.00 8.55 1.03 8 R C E 108.76 9.19 17.82 27.61 124.91 150.77 -111.29 143.98 53.12 46.44 0.43 41.37 9.86 1.78 0.09 0.42 0.00 44.87 1.63 9 L E E 79.10 11.26 19.44 30.78 116.76 -125.25 -90.47 131.71 19.90 79.98 0.12 17.35 2.36 0.24 0.05 0.08 0.00 77.27 2.65 10 V E E 13.95 20.49 14.60 35.18 125.20 -169.03 -119.18 140.80 14.80 85.14 0.05 13.67 0.84 0.04 0.04 0.02 0.00 73.99 11.40 11 T C C 66.66 5.44 23.95 29.41 122.11 -144.99 -101.48 146.62 92.24 7.74 0.01 91.89 1.00 0.04 0.00 0.01 0.00 6.38 0.68 12 P C T 56.05 14.84 13.59 28.31 110.15 -90.92 -60.08 137.73 99.44 0.43 0.13 0.49 3.11 95.97 0.01 0.09 0.00 0.28 0.05 13 G C T 50.38 3.40 19.32 23.30 96.07 22.60 87.84 -5.49 99.82 0.12 0.06 0.64 3.28 95.92 0.00 0.05 0.00 0.08 0.01 14 T C C 61.25 7.37 17.42 26.08 120.62 118.37 -86.13 146.74 97.57 2.42 0.02 56.29 41.73 0.12 0.00 0.01 0.00 1.49 0.35 15 P C C 78.22 7.36 19.67 27.77 116.04 -106.91 -70.65 145.47 87.81 12.19 0.00 88.66 0.53 0.02 0.00 0.00 0.00 10.19 0.61 16 L E E 12.06 23.42 13.71 37.15 123.38 -156.65 -115.93 137.42 2.86 97.14 0.00 2.88 0.05 0.00 0.00 0.00 0.00 96.78 0.29 17 T E E 61.37 8.04 25.40 34.07 119.29 -154.94 -112.39 128.07 0.63 99.37 0.00 0.61 0.02 0.00 0.00 0.00 0.00 99.34 0.02 18 L E E 6.18 25.22 16.53 42.29 120.40 -167.43 -113.34 128.70 2.47 97.52 0.00 2.28 0.11 0.00 0.00 0.00 0.00 97.54 0.06 19 T E E 51.57 8.82 26.51 35.89 122.36 -164.81 -115.04 135.37 13.30 86.69 0.01 12.48 0.39 0.02 0.00 0.01 0.00 86.96 0.14 20 C E E 6.10 24.95 16.05 41.14 131.25 -171.60 -132.80 146.71 19.43 80.55 0.03 18.76 0.50 0.04 0.01 0.01 0.00 80.36 0.32 21 T E E 56.91 8.02 26.89 35.61 123.68 -159.87 -119.92 135.28 12.78 87.14 0.08 12.02 0.79 0.08 0.05 0.04 0.00 83.02 4.01 22 A E E 9.30 24.02 14.45 38.26 122.38 -169.75 -118.52 133.02 35.77 63.86 0.37 33.37 1.92 0.37 0.12 0.27 0.00 60.85 3.09 23 S C C 61.16 5.98 21.06 27.94 127.39 -167.76 -118.69 147.67 66.79 32.49 0.72 32.30 23.30 12.47 0.07 0.82 0.00 29.86 1.18 24 G C S 53.12 2.82 20.50 23.50 98.53 18.46 83.19 2.44 82.73 16.60 0.67 26.05 41.10 16.06 0.05 0.78 0.00 14.80 1.15 25 F C C 49.52 19.31 10.82 29.02 121.06 124.02 -94.17 144.79 81.52 17.56 0.91 68.17 10.67 2.13 0.20 0.90 0.00 13.76 4.17 26 S C C 56.69 5.25 21.56 27.09 121.15 -147.42 -111.25 144.03 85.80 13.06 1.14 74.63 8.10 2.49 0.30 0.97 0.00 8.91 4.60 27 L C T 66.38 16.74 13.22 29.05 95.45 -135.26 -69.96 -19.60 73.41 5.40 21.19 16.91 19.12 37.85 1.32 20.02 0.01 3.36 1.40 28 S C T 75.88 3.80 19.42 23.72 93.85 69.58 -75.01 -17.31 77.40 4.49 18.12 6.68 18.09 52.40 0.85 17.88 0.01 3.26 0.84 29 S C T 48.95 8.70 18.51 27.92 103.12 41.89 -104.21 1.75 72.39 11.29 16.31 21.06 15.89 36.08 0.76 15.86 0.00 9.45 0.90 30 Y C C 26.28 21.48 15.01 35.98 130.72 73.96 -123.97 149.27 57.26 42.47 0.27 46.94 9.20 0.63 0.05 0.23 0.00 42.06 0.89 31 W E E 76.92 11.87 26.73 38.88 126.53 -155.59 -119.86 141.36 9.39 90.59 0.02 8.77 0.41 0.03 0.00 0.01 0.00 90.55 0.22 32 M E E 3.97 26.29 20.44 47.15 123.11 -158.16 -116.72 134.67 1.11 98.89 0.00 1.01 0.03 0.00 0.00 0.00 0.00 98.93 0.02 33 S E E 11.48 17.04 27.74 44.77 135.04 -177.45 -134.47 154.33 0.45 99.55 0.00 0.40 0.02 0.00 0.00 0.00 0.00 99.58 0.00 34 W E E 6.69 24.87 23.04 47.87 125.62 -148.24 -118.22 139.03 0.49 99.51 0.00 0.43 0.02 0.00 0.00 0.00 0.00 99.55 0.00 35 V E E 12.69 18.51 24.98 43.24 128.36 -168.73 -125.57 142.00 0.35 99.65 0.00 0.31 0.01 0.00 0.00 0.00 0.00 99.67 0.01 36 R E E 44.01 17.32 21.79 38.52 124.96 -161.20 -116.34 139.34 0.55 99.45 0.00 0.49 0.02 0.00 0.00 0.00 0.00 99.48 0.02 37 Q E E 56.97 12.48 18.48 31.63 115.93 -140.65 -100.88 130.20 5.11 94.87 0.02 4.59 0.25 0.03 0.00 0.01 0.00 94.91 0.21 38 A C C 29.06 10.97 13.19 25.81 117.42 -134.24 -79.63 151.43 61.76 37.64 0.61 56.37 3.29 1.38 0.10 0.52 0.00 37.19 1.15 39 R C T 165.89 3.41 12.50 17.77 108.61 -83.35 -59.74 133.80 90.87 0.74 8.39 0.84 5.30 84.16 0.15 8.91 0.00 0.46 0.18 40 G C T 70.09 0.24 12.63 10.04 96.45 14.42 81.43 -3.67 91.37 0.11 8.51 0.65 4.01 85.73 0.14 9.36 0.00 0.06 0.04 41 K C T 135.09 2.94 11.08 15.51 107.07 68.70 -105.95 -1.92 87.63 2.17 10.20 8.64 28.35 49.04 0.35 11.65 0.00 1.40 0.58 42 G C C 35.10 3.55 15.99 20.65 126.32 -120.65 89.21 -169.18 61.57 38.25 0.18 45.57 13.20 2.61 0.03 0.20 0.00 37.26 1.13 43 L E E 64.79 14.60 12.98 27.57 116.15 -25.76 -76.51 137.61 23.96 76.02 0.02 21.97 0.93 0.06 0.00 0.02 0.00 76.84 0.18 44 E E E 72.66 10.21 20.69 31.54 127.06 -170.31 -125.19 139.52 1.90 98.10 0.00 1.65 0.10 0.00 0.00 0.00 0.00 98.20 0.03 45 W E E 93.32 15.43 20.14 35.07 110.69 -115.22 -73.72 127.70 0.55 99.45 0.00 0.53 0.01 0.00 0.00 0.00 0.00 99.45 0.01 46 I E E 10.34 21.52 21.43 43.25 100.80 176.42 -101.54 -25.76 4.88 95.12 0.00 3.15 1.16 0.03 0.00 0.00 0.00 95.65 0.01 47 G E E 2.12 19.95 23.98 44.21 146.13 -35.15 163.03 169.65 0.83 99.17 0.00 0.56 0.11 0.01 0.00 0.00 0.00 99.32 0.00 48 T E E 20.28 17.68 25.75 43.07 133.40 -126.20 -139.44 149.64 0.40 99.60 0.00 0.35 0.01 0.00 0.00 0.00 0.00 99.62 0.01 49 A E E 6.45 22.10 19.76 42.05 120.15 -151.25 -111.76 129.36 1.33 98.67 0.00 1.11 0.10 0.01 0.00 0.00 0.00 98.67 0.11 50 T E E 38.21 10.50 21.70 32.80 126.63 -162.07 -105.89 156.65 26.76 73.12 0.12 23.00 2.38 0.35 0.02 0.10 0.00 73.67 0.48 51 A C T 51.49 14.28 14.80 28.44 101.96 -102.39 -68.69 44.53 79.23 17.57 3.20 5.11 11.58 63.58 0.15 3.31 0.00 15.26 1.00 52 G C T 59.19 1.75 17.37 18.79 95.82 38.66 43.15 1.64 95.47 1.07 3.46 2.15 11.19 81.51 0.12 4.03 0.00 0.76 0.24 53 G C S 45.68 6.18 14.75 22.04 99.41 -88.42 88.95 2.57 94.81 1.15 4.04 8.90 48.01 37.39 0.16 4.48 0.00 0.74 0.31 54 S C C 56.98 4.85 17.95 23.84 120.00 130.90 -85.23 147.74 64.99 34.71 0.30 54.24 6.97 1.86 0.04 0.29 0.00 35.94 0.65 55 A E E 40.65 18.02 13.24 30.37 126.63 -150.78 -120.93 142.43 12.68 87.29 0.04 11.44 0.89 0.07 0.01 0.03 0.00 87.01 0.55 56 W E E 94.22 10.51 21.81 32.84 130.46 -173.45 -133.13 144.95 3.04 96.94 0.02 2.67 0.25 0.02 0.01 0.01 0.00 96.64 0.41 57 Y E E 97.67 14.07 19.28 32.91 122.02 -137.12 -101.69 137.00 12.05 87.81 0.14 10.22 1.72 0.24 0.04 0.11 0.00 86.82 0.85 58 A C C 9.42 21.24 12.84 34.19 109.16 -124.59 -80.79 117.02 84.90 13.94 1.16 78.98 4.38 1.03 0.23 0.86 0.00 13.76 0.77 59 S C G 80.12 2.80 20.28 23.61 93.81 -159.13 -67.47 -29.92 53.58 1.87 44.55 7.93 14.40 32.10 2.80 40.98 0.01 1.12 0.66 60 W C T 121.49 8.93 18.11 27.77 91.77 60.31 -69.99 -22.66 56.22 1.05 42.73 2.53 9.82 43.56 2.63 40.32 0.02 0.60 0.51 61 A C G 5.46 23.01 10.72 33.83 97.40 45.87 -99.14 0.03 51.62 4.06 44.32 8.84 9.06 34.18 3.31 40.54 0.05 2.55 1.49 62 K C T 131.60 6.10 15.56 24.20 109.52 128.75 -60.13 127.97 89.23 4.37 6.40 3.57 5.19 81.01 1.61 3.99 0.02 2.42 2.18 63 G C T 63.75 1.10 18.26 17.93 94.23 10.69 80.66 -1.45 93.06 0.63 6.32 1.21 4.90 87.69 0.75 4.82 0.00 0.38 0.25 64 R C T 87.67 12.44 16.47 29.08 101.68 68.52 -100.21 -22.09 93.40 1.96 4.64 6.29 18.67 68.37 0.45 4.23 0.00 1.63 0.36 65 F E E 9.94 23.74 12.57 36.60 135.24 32.30 -138.18 150.48 19.57 80.17 0.26 14.38 4.89 0.76 0.10 0.19 0.00 74.90 4.77 66 T E E 65.89 5.90 26.41 32.94 125.20 -160.66 -124.56 139.69 5.98 93.99 0.03 5.75 0.23 0.03 0.01 0.01 0.00 93.05 0.91 67 I E E 22.16 23.78 14.31 37.92 120.80 -157.21 -114.76 127.83 12.07 87.89 0.04 11.62 0.43 0.06 0.01 0.02 0.00 87.25 0.60 68 S E E 47.43 6.95 23.22 30.51 127.94 -176.05 -124.46 147.03 31.55 68.38 0.08 29.27 1.48 0.20 0.02 0.05 0.00 68.02 0.95 69 R C C 111.98 14.40 15.03 28.85 106.49 -149.83 -103.53 14.97 60.12 39.68 0.20 43.11 14.95 2.12 0.03 0.22 0.00 38.21 1.36 70 T C C 92.90 3.28 20.39 23.87 102.82 86.35 -101.03 6.97 86.71 12.99 0.31 54.59 27.42 4.53 0.05 0.34 0.00 11.75 1.33 71 S C S 36.38 10.44 17.52 28.67 135.56 65.98 -128.89 170.31 97.20 2.44 0.36 34.66 54.68 8.02 0.05 0.37 0.00 1.71 0.52 72 T C S 55.03 13.77 17.58 31.52 98.36 -106.96 -91.52 -7.38 97.02 2.70 0.27 13.67 75.26 8.16 0.03 0.24 0.00 2.29 0.35 73 T C E 48.83 9.36 22.39 32.87 125.59 60.29 -122.50 136.34 50.30 49.48 0.22 34.48 15.12 1.37 0.05 0.21 0.00 45.81 2.96 74 V E E 5.44 24.58 16.05 41.28 123.73 -166.61 -123.20 132.66 25.47 74.49 0.04 23.97 0.97 0.09 0.01 0.02 0.00 73.71 1.22 75 E E E 60.21 9.36 27.32 37.58 118.03 -158.40 -111.00 127.21 13.97 86.02 0.01 13.07 0.51 0.03 0.00 0.01 0.00 86.03 0.36 76 L E E 3.13 26.40 17.61 45.06 119.12 -164.49 -111.12 128.17 4.17 95.83 0.00 4.34 0.08 0.00 0.00 0.00 0.00 95.51 0.07 77 R E E 93.13 8.82 27.21 36.53 120.26 -165.10 -116.36 130.31 0.83 99.17 0.00 0.91 0.01 0.00 0.00 0.00 0.00 99.00 0.08 78 M E E 11.53 23.93 15.53 39.63 117.31 -165.26 -106.54 123.97 7.64 92.36 0.00 7.95 0.08 0.00 0.00 0.00 0.00 90.70 1.28 79 T C S 63.22 7.02 22.66 29.91 103.99 -172.35 -92.74 -25.89 93.74 6.23 0.04 42.98 48.07 1.94 0.00 0.06 0.00 6.75 0.21 80 S C S 64.01 4.18 23.91 28.04 111.90 9.85 -131.02 86.07 99.12 0.86 0.02 8.00 89.58 1.67 0.00 0.02 0.00 0.65 0.09 81 L C C 29.07 22.83 11.36 33.42 112.36 -137.11 -70.77 131.21 99.44 0.55 0.01 98.38 1.16 0.02 0.00 0.00 0.00 0.26 0.18 82 T C C 53.21 5.11 23.58 28.72 134.86 170.75 -131.99 167.59 93.81 6.15 0.04 91.44 0.92 0.01 0.02 0.01 0.00 0.53 7.06 83 T H G 76.18 11.02 16.09 27.62 90.84 -96.91 -60.70 -31.37 8.07 0.08 91.85 0.43 0.70 6.05 0.71 92.03 0.00 0.05 0.01 84 E H G 123.58 3.97 21.38 26.22 89.92 63.38 -70.13 -18.57 7.33 0.12 92.55 0.33 0.62 5.56 0.51 92.88 0.00 0.09 0.01 85 D H G 9.80 22.31 15.45 38.14 93.63 60.29 -86.96 -0.93 7.63 0.20 92.17 1.76 1.23 3.36 0.67 92.81 0.00 0.15 0.02 86 T C C 40.24 16.08 21.26 37.07 112.91 106.57 -78.57 129.91 97.00 2.60 0.39 93.45 3.55 0.29 0.08 0.26 0.00 2.08 0.30 87 A E E 16.14 15.96 23.37 39.15 145.12 116.14 -167.55 172.51 11.36 88.62 0.02 10.95 0.62 0.04 0.01 0.01 0.00 87.59 0.77 88 T E E 33.37 14.77 25.28 40.01 118.80 -86.51 -99.88 135.26 0.78 99.22 0.00 0.79 0.02 0.00 0.00 0.00 0.00 99.14 0.04 89 Y E E 7.58 25.10 20.85 45.95 124.39 -166.29 -118.32 138.17 0.41 99.59 0.00 0.39 0.01 0.00 0.00 0.00 0.00 99.59 0.01 90 F E E 24.49 18.43 27.76 45.52 126.69 -165.93 -119.65 141.81 0.86 99.14 0.00 0.73 0.05 0.00 0.00 0.00 0.00 99.20 0.02 91 C E E 3.28 25.08 23.75 48.52 126.38 -165.79 -121.14 141.34 5.50 94.47 0.03 4.64 0.47 0.03 0.01 0.01 0.00 94.70 0.13 92 A E E 9.67 19.01 25.16 43.74 127.00 -163.83 -120.37 143.00 8.61 91.33 0.06 7.67 0.63 0.07 0.02 0.03 0.00 91.12 0.46 93 R E E 53.05 17.55 21.65 38.34 121.33 -152.64 -109.36 137.47 26.77 73.12 0.11 22.39 4.00 0.35 0.04 0.09 0.00 70.62 2.52 94 D C C 50.01 12.65 18.21 31.23 116.71 -139.79 -105.87 126.66 75.64 24.23 0.13 63.64 10.43 0.71 0.03 0.13 0.00 23.67 1.40 95 P C C 61.73 9.61 15.02 25.56 113.00 -125.03 -73.26 150.86 90.28 5.71 4.02 37.28 26.17 26.84 0.41 4.09 0.00 4.04 1.16 96 P C T 103.13 3.39 14.27 18.96 106.29 -72.91 -70.33 126.45 93.60 1.19 5.21 12.27 23.24 57.36 0.45 5.44 0.00 0.70 0.53 97 G C T 56.10 2.64 14.36 17.63 104.69 21.59 84.84 -2.94 91.31 2.64 6.05 21.64 27.42 41.91 0.61 5.97 0.00 1.43 1.03 98 H C C 98.80 9.68 10.85 21.21 112.65 108.73 -92.19 121.07 87.72 6.51 5.78 48.53 23.80 15.15 1.03 5.13 0.00 3.44 2.92 99 S C C 76.28 4.60 15.25 21.26 110.18 -159.69 -92.11 107.01 87.17 7.20 5.63 38.66 25.28 23.85 0.89 4.84 0.00 4.33 2.14 100 G C C 37.34 9.06 16.87 26.40 111.56 7.57 93.20 70.82 84.84 9.74 5.43 43.03 23.36 19.07 0.82 4.91 0.01 6.39 2.41 101 L C C 63.02 15.25 16.89 31.35 106.96 116.66 -84.84 103.55 73.64 21.28 5.08 46.56 16.33 10.64 1.23 4.28 0.01 14.67 6.27 102 W C C 81.08 16.28 18.40 33.68 110.84 51.06 -99.06 91.10 60.72 35.18 4.11 33.02 17.30 11.24 1.34 3.09 0.12 20.49 13.41 103 G C C 21.29 13.99 19.61 33.04 125.24 -123.57 81.61 -171.67 79.74 17.29 2.97 41.77 25.16 13.72 0.50 2.71 0.01 12.60 3.52 104 R C C 130.99 7.98 22.59 30.62 102.02 -44.35 -75.34 26.56 83.72 13.60 2.68 30.09 28.51 26.02 0.34 2.53 0.00 10.67 1.84 105 G C C 15.64 18.10 19.07 35.73 124.51 -115.86 87.77 173.15 76.88 21.71 1.41 38.93 18.59 19.40 0.13 1.56 0.00 20.34 1.04 106 T E E 18.66 20.17 20.71 40.33 121.07 -100.21 -105.34 138.03 36.36 63.53 0.11 32.35 2.81 0.27 0.02 0.10 0.00 63.64 0.81 107 L E E 67.07 11.84 25.40 37.14 116.64 -136.18 -92.59 129.91 3.64 96.35 0.01 3.37 0.19 0.01 0.00 0.00 0.00 96.21 0.21 108 V E E 8.33 24.61 17.09 41.94 122.14 -167.95 -116.04 132.02 0.95 99.05 0.00 0.93 0.03 0.00 0.00 0.00 0.00 99.01 0.03 109 T E E 54.80 8.32 25.73 34.57 119.54 -153.74 -106.89 132.70 1.44 98.56 0.00 1.36 0.07 0.01 0.00 0.00 0.00 98.47 0.09 110 V E E 19.70 22.17 13.81 35.49 119.24 -156.38 -106.06 131.26 9.64 90.32 0.04 8.89 0.54 0.06 0.01 0.02 0.00 89.85 0.62 111 S C C 50.50 7.11 18.46 26.31 127.95 -168.88 -116.30 160.14 51.56 48.36 0.08 49.62 1.09 0.20 0.02 0.05 0.00 47.77 1.25 112 S C C 73.70 6.64 16.05 23.74 107.09 -101.48 -79.20 120.49 99.72 0.28 0.01 99.58 0.17 0.04 0.00 0.00 0.00 0.20 0.01