# 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 I C C 33.19 19.12 17.73 36.45 118.79 -158.99 -107.59 129.32 96.84 3.15 0.00 96.94 0.07 0.01 0.00 0.00 0.00 2.95 0.03 1 V E E 60.24 9.94 21.12 31.71 119.14 -160.30 -111.14 128.82 20.91 79.04 0.05 21.16 0.29 0.05 0.02 0.02 0.00 77.63 0.83 2 L E E 35.70 18.19 14.40 32.50 117.11 -160.15 -100.74 128.36 11.38 88.55 0.08 10.32 0.77 0.11 0.03 0.04 0.00 88.04 0.70 3 T E E 69.81 7.91 19.57 28.13 115.56 -170.05 -111.63 125.19 17.80 82.07 0.13 15.62 1.66 0.27 0.04 0.08 0.00 81.36 0.97 4 Q E E 72.48 12.95 15.27 28.40 126.04 -163.21 -120.41 141.58 44.69 55.11 0.20 35.21 8.65 0.85 0.04 0.18 0.00 53.95 1.12 5 S C C 60.85 7.42 17.82 26.15 120.56 -130.83 -96.88 145.19 81.44 18.43 0.13 57.61 21.67 1.20 0.02 0.13 0.00 18.63 0.73 6 P C S 71.97 9.05 16.46 26.10 111.71 -56.34 -69.54 147.53 87.93 11.75 0.31 29.17 46.89 10.67 0.02 0.40 0.00 12.40 0.46 7 G E E 33.20 9.42 17.76 27.51 115.25 71.69 82.16 -143.76 47.13 52.55 0.32 22.23 19.66 5.70 0.02 0.38 0.00 51.41 0.60 8 T E E 74.60 8.12 19.25 28.23 127.60 -21.14 -126.28 140.48 18.44 81.48 0.08 16.17 1.72 0.19 0.01 0.07 0.00 81.44 0.40 9 L E E 25.81 20.02 14.83 34.47 125.86 -170.17 -124.99 137.85 3.25 96.75 0.01 2.96 0.18 0.01 0.00 0.00 0.00 96.71 0.14 10 S E E 64.25 6.80 23.44 31.24 121.92 -157.26 -114.71 133.63 2.17 97.83 0.00 1.94 0.12 0.01 0.00 0.00 0.00 97.84 0.09 11 L E E 17.37 20.99 13.84 34.56 132.86 173.83 -135.62 151.20 12.97 87.02 0.01 12.32 0.53 0.02 0.00 0.01 0.00 86.07 1.06 12 S C C 52.69 4.79 23.46 27.97 121.83 -123.85 -85.14 158.10 94.18 5.79 0.03 93.14 1.18 0.12 0.01 0.02 0.00 5.10 0.44 13 P C T 60.58 13.72 14.48 28.36 109.42 -80.40 -59.47 135.49 99.19 0.35 0.46 0.26 2.54 96.61 0.03 0.30 0.00 0.19 0.07 14 G C T 45.99 4.46 19.40 24.70 95.83 23.30 88.53 -6.41 99.31 0.25 0.44 0.46 2.90 96.11 0.03 0.32 0.00 0.16 0.02 15 E C C 82.59 8.30 17.85 27.28 122.32 119.12 -83.97 150.82 91.63 8.07 0.30 72.54 18.55 0.58 0.05 0.26 0.00 7.19 0.82 16 R E E 124.39 9.51 18.76 29.38 124.11 -135.15 -109.49 141.72 45.04 54.89 0.06 43.96 0.85 0.09 0.01 0.04 0.00 53.92 1.13 17 A E E 9.94 21.17 15.66 36.78 131.13 -170.35 -131.61 148.21 2.46 97.53 0.02 2.26 0.11 0.01 0.00 0.01 0.00 97.50 0.11 18 T E E 65.13 8.75 24.58 33.91 121.58 -147.02 -114.82 132.88 1.18 98.81 0.00 1.04 0.06 0.00 0.00 0.00 0.00 98.86 0.03 19 L E E 6.21 25.12 17.06 42.61 122.42 -168.23 -116.91 133.16 4.21 95.78 0.01 3.78 0.25 0.01 0.00 0.00 0.00 95.89 0.06 20 S E E 35.83 10.25 26.49 37.20 126.39 -166.41 -118.35 143.01 10.28 89.71 0.01 9.14 0.57 0.03 0.00 0.01 0.00 90.14 0.11 21 C E E 4.84 25.03 16.88 42.23 133.65 -174.69 -137.58 149.87 9.24 90.74 0.02 8.51 0.45 0.04 0.00 0.01 0.00 90.62 0.36 22 R E E 110.58 6.72 26.54 34.04 121.36 -154.63 -115.95 133.20 5.50 94.47 0.03 5.08 0.28 0.03 0.01 0.02 0.00 92.33 2.25 23 A E E 8.39 24.03 11.71 35.45 119.07 -145.04 -88.73 141.40 44.60 55.01 0.39 42.31 1.75 0.33 0.09 0.29 0.00 53.42 1.80 24 S C S 74.85 3.46 21.49 25.13 97.98 -155.22 -85.65 -17.85 89.95 9.53 0.52 24.53 60.25 4.54 0.04 0.52 0.00 9.66 0.47 25 Q C S 93.14 4.02 20.77 25.14 134.89 22.45 -138.01 160.70 90.72 8.60 0.68 10.23 73.84 6.62 0.05 0.60 0.00 8.04 0.61 26 S C C 71.52 6.31 19.39 26.80 114.86 -92.67 -72.43 140.80 89.69 9.38 0.92 78.37 7.74 3.05 0.10 1.11 0.00 8.64 0.98 27 V C C 16.48 22.32 11.61 33.47 124.06 -161.87 -118.27 134.68 65.73 33.57 0.70 59.02 4.48 1.21 0.27 0.50 0.00 19.86 14.65 28 S C C 78.75 3.34 23.20 26.75 103.85 -156.92 -96.53 36.10 83.36 16.00 0.64 61.44 18.11 3.63 0.13 0.66 0.00 13.41 2.62 29 S C S 29.72 14.57 16.44 31.17 132.60 91.59 -123.32 160.68 82.03 14.65 3.31 32.56 38.85 11.12 0.32 3.25 0.00 12.24 1.66 30 S C S 56.62 10.18 21.42 31.74 96.79 -133.16 -85.19 -13.40 85.38 12.90 1.72 12.11 61.14 11.05 0.09 1.59 0.00 13.44 0.59 31 Y E E 57.66 13.92 23.33 37.38 126.83 46.11 -127.60 140.39 26.11 72.21 1.68 16.39 6.72 4.00 0.14 1.62 0.00 70.65 0.47 32 L E E 4.02 25.68 20.08 45.97 129.57 -174.49 -130.01 143.55 4.80 95.18 0.01 4.30 0.33 0.03 0.00 0.01 0.00 95.19 0.14 33 A E E 10.67 17.97 27.67 45.44 128.78 -164.13 -124.56 145.13 0.70 99.30 0.00 0.65 0.02 0.00 0.00 0.00 0.00 99.32 0.01 34 W E E 8.50 24.42 22.93 47.09 125.58 -156.94 -114.97 140.10 0.60 99.40 0.00 0.53 0.03 0.00 0.00 0.00 0.00 99.44 0.01 35 Y E E 23.03 17.57 23.64 41.17 133.59 -175.25 -132.85 150.21 0.70 99.30 0.00 0.61 0.03 0.00 0.00 0.00 0.00 99.34 0.02 36 Q E E 44.22 14.38 21.60 36.16 122.66 -142.50 -111.65 135.82 2.42 97.58 0.00 2.00 0.20 0.01 0.00 0.00 0.00 97.71 0.07 37 Q E E 52.67 14.07 15.63 30.20 121.43 -158.62 -110.08 137.82 24.72 75.26 0.02 22.40 1.60 0.07 0.00 0.01 0.00 74.83 1.07 38 K C C 100.14 6.11 15.74 23.13 118.72 -136.85 -92.19 146.04 97.91 2.07 0.03 96.18 1.80 0.18 0.01 0.02 0.00 1.52 0.30 39 P C T 102.15 4.26 11.44 17.72 109.43 -86.23 -58.44 133.95 99.62 0.10 0.28 0.39 3.45 95.80 0.01 0.27 0.00 0.06 0.02 40 G C T 69.00 0.30 13.14 10.80 95.26 18.27 83.60 -2.94 99.63 0.07 0.30 0.50 3.46 95.65 0.01 0.32 0.00 0.04 0.01 41 Q C S 90.15 5.36 10.28 17.79 129.36 97.00 -113.44 159.59 94.69 4.90 0.41 35.73 57.81 1.32 0.08 0.34 0.00 1.73 2.99 42 A C C 75.76 2.33 17.70 20.00 116.74 -97.83 -70.23 150.04 97.78 2.19 0.03 87.34 10.45 0.19 0.01 0.03 0.00 1.68 0.31 43 P C C 44.21 18.04 11.69 29.04 114.79 -99.91 -66.04 144.00 90.37 9.60 0.04 88.30 2.03 0.15 0.00 0.03 0.00 9.19 0.29 44 R E E 99.72 8.97 21.56 31.11 124.56 -160.04 -121.35 138.38 8.06 91.87 0.07 7.11 0.83 0.09 0.03 0.04 0.00 91.20 0.72 45 L E E 56.02 16.58 18.89 34.92 110.87 -116.10 -75.79 126.62 1.33 98.66 0.01 1.19 0.06 0.01 0.00 0.00 0.00 98.68 0.05 46 L E E 19.63 19.08 21.84 40.67 101.52 176.03 -96.55 -33.44 2.45 97.53 0.02 1.73 0.55 0.03 0.01 0.01 0.00 97.65 0.02 47 I E E 10.17 21.89 22.28 43.88 135.41 5.66 -146.30 142.08 0.78 99.21 0.01 0.63 0.06 0.01 0.00 0.00 0.00 99.27 0.02 48 Y E E 56.45 17.43 23.85 40.10 128.50 -172.71 -131.72 137.81 5.95 93.94 0.10 4.87 0.66 0.13 0.03 0.04 0.00 94.08 0.19 49 G E E 10.04 18.47 21.14 38.73 129.26 160.58 -135.01 167.19 43.78 54.93 1.29 26.38 13.87 4.78 0.32 0.90 0.00 52.98 0.78 50 A C C 37.42 13.78 20.16 33.62 108.51 -111.52 -89.20 100.94 69.54 23.34 7.12 31.09 23.77 16.68 1.78 4.75 0.05 19.86 2.04 51 S C C 48.42 10.85 18.39 29.27 111.95 43.56 -97.30 128.96 76.08 9.48 14.44 26.51 26.25 25.38 3.81 9.24 0.08 6.54 2.19 52 R C C 139.42 7.73 17.88 26.19 102.19 -91.44 -81.76 14.96 67.41 13.56 19.03 25.11 22.71 22.29 5.91 11.25 0.20 9.52 3.02 53 R C C 124.41 8.05 17.42 26.15 109.16 88.34 -93.97 92.74 57.67 25.65 16.68 32.46 13.74 13.47 6.49 9.69 0.19 19.44 4.52 54 A C C 41.46 16.01 12.66 27.87 111.96 152.42 -89.44 116.31 62.22 24.63 13.15 41.43 11.27 10.34 5.17 7.84 0.05 19.76 4.13 55 T C C 87.98 5.12 18.04 24.26 115.80 -174.12 -104.29 129.61 68.68 22.87 8.45 28.91 16.97 24.92 2.95 4.97 0.13 17.60 3.54 56 G C C 44.87 5.59 18.90 25.31 106.53 10.65 89.95 3.15 83.41 13.54 3.06 32.43 27.82 24.35 0.54 2.52 0.00 10.35 1.99 57 I C C 36.59 20.55 11.41 30.75 116.34 121.27 -94.37 129.98 90.14 9.49 0.37 69.25 20.26 1.04 0.13 0.27 0.00 6.12 2.94 58 P C C 50.57 9.49 16.25 27.01 114.15 -111.10 -66.65 151.97 90.96 4.65 4.39 74.87 7.00 8.49 0.71 4.21 0.00 3.49 1.22 59 D C T 118.67 2.70 17.69 21.34 93.58 -106.77 -64.32 -19.94 84.27 2.47 13.26 10.20 22.87 51.00 1.10 12.45 0.01 1.66 0.72 60 R C T 106.48 10.12 17.80 28.19 95.30 62.40 -84.42 -7.81 77.27 8.83 13.90 10.93 20.78 46.07 1.08 12.62 0.02 7.50 1.00 61 F E E 21.13 23.13 13.10 35.42 117.91 73.66 -106.58 126.74 24.22 69.92 5.86 17.26 6.15 3.52 1.42 3.83 0.02 65.71 2.09 62 S E E 51.59 7.72 23.24 31.86 132.88 157.60 -132.86 153.96 12.54 87.14 0.31 10.46 1.84 0.43 0.14 0.17 0.00 85.92 1.05 63 G E E 21.81 17.16 16.63 32.95 142.92 166.33 -160.23 168.25 12.62 87.20 0.18 10.47 1.69 0.35 0.05 0.10 0.00 86.97 0.36 64 S E E 62.23 4.93 23.48 29.77 134.87 -152.35 -144.02 152.49 13.59 86.21 0.20 11.31 1.77 0.37 0.04 0.13 0.00 85.88 0.49 65 A E E 33.41 20.19 11.94 30.80 130.35 -161.18 -132.45 147.21 22.62 77.04 0.34 17.60 4.64 1.07 0.06 0.29 0.00 74.94 1.40 66 S E E 73.52 3.08 21.28 24.64 117.70 -168.31 -128.01 117.09 48.92 50.51 0.56 35.58 10.26 3.77 0.10 0.55 0.00 47.85 1.88 67 G C T 39.98 6.63 19.00 26.35 111.21 -44.57 63.01 -131.46 98.51 1.02 0.47 2.38 46.25 50.02 0.02 0.46 0.00 0.75 0.11 68 T C T 56.84 13.82 16.05 30.05 97.56 -13.44 -98.35 -0.53 98.53 1.08 0.39 2.14 47.26 49.28 0.01 0.38 0.00 0.84 0.10 69 D E E 56.04 9.57 22.04 32.75 120.88 85.25 -107.07 134.38 32.04 67.85 0.11 21.46 10.40 1.14 0.02 0.13 0.00 65.67 1.18 70 F E E 6.82 24.83 16.49 41.98 124.58 -168.65 -121.90 137.39 7.98 92.01 0.00 7.62 0.19 0.01 0.00 0.00 0.00 91.98 0.19 71 I E E 38.54 10.62 27.19 39.03 120.17 -162.21 -116.39 129.75 1.26 98.74 0.00 1.10 0.03 0.00 0.00 0.00 0.00 98.85 0.01 72 L E E 2.60 26.28 19.39 46.64 118.81 -163.20 -110.77 127.55 0.18 99.82 0.00 0.19 0.00 0.00 0.00 0.00 0.00 99.81 0.00 73 T E E 36.43 10.39 27.23 38.56 119.65 -163.97 -114.30 128.34 0.16 99.84 0.00 0.17 0.00 0.00 0.00 0.00 0.00 99.82 0.01 74 I E E 6.62 24.35 16.61 41.60 117.73 -166.11 -112.73 124.58 3.33 96.67 0.00 3.52 0.03 0.00 0.00 0.00 0.00 95.93 0.51 75 S C S 46.35 7.47 23.08 30.76 121.16 -166.50 -100.15 154.39 92.35 7.62 0.03 42.65 46.53 1.93 0.00 0.06 0.00 8.65 0.17 76 R C S 141.45 4.25 23.82 28.24 96.91 9.43 55.92 58.92 98.77 1.22 0.01 9.58 87.32 1.89 0.00 0.01 0.00 1.11 0.09 77 L C C 16.21 24.08 10.59 34.25 114.57 -150.28 -77.49 134.13 99.16 0.83 0.01 98.00 1.34 0.02 0.00 0.00 0.00 0.30 0.34 78 E C C 85.86 4.61 24.45 28.77 130.02 -171.65 -123.42 155.23 99.88 0.11 0.01 99.61 0.30 0.00 0.00 0.00 0.00 0.02 0.06 79 P H G 64.84 14.12 14.88 28.97 91.14 -105.67 -58.67 -31.78 3.27 0.02 96.71 0.16 0.19 2.04 0.22 97.38 0.00 0.01 0.00 80 E H G 123.83 4.01 21.61 26.45 90.26 63.13 -71.05 -15.46 2.80 0.03 97.18 0.09 0.15 1.87 0.13 97.74 0.00 0.02 0.00 81 D H G 16.48 19.87 17.05 37.26 94.45 61.17 -88.07 -1.82 3.80 0.05 96.15 0.45 0.37 1.72 0.19 97.22 0.00 0.04 0.00 82 F C C 38.45 18.75 20.34 38.94 116.97 103.51 -82.38 135.99 88.03 11.73 0.24 85.05 2.86 0.10 0.02 0.21 0.00 11.49 0.27 83 A E E 11.15 18.60 23.61 41.52 141.44 158.46 -149.76 171.32 4.07 95.93 0.00 3.74 0.23 0.01 0.00 0.00 0.00 95.74 0.28 84 V E E 27.86 16.38 25.56 41.71 119.53 -111.19 -107.80 131.71 0.45 99.55 0.00 0.41 0.01 0.00 0.00 0.00 0.00 99.57 0.01 85 Y E E 7.61 24.78 21.26 45.94 123.55 -166.16 -115.65 136.63 0.24 99.76 0.00 0.21 0.01 0.00 0.00 0.00 0.00 99.78 0.00 86 Y E E 29.78 16.77 26.96 43.46 129.38 -169.58 -124.09 145.43 0.68 99.32 0.00 0.58 0.03 0.00 0.00 0.00 0.00 99.37 0.01 87 C E E 3.44 24.93 21.00 46.12 125.51 -159.63 -117.69 140.20 2.88 97.09 0.03 2.39 0.25 0.03 0.01 0.01 0.00 97.25 0.06 88 Q E E 34.67 14.17 25.49 39.79 127.32 -170.98 -123.46 142.75 3.23 96.72 0.06 2.78 0.25 0.05 0.01 0.02 0.00 96.75 0.13 89 Q E E 37.66 16.91 18.65 35.50 120.53 -150.57 -108.18 134.14 12.68 87.17 0.15 10.70 1.51 0.26 0.04 0.09 0.00 86.93 0.46 90 Y E E 68.89 11.45 15.79 28.50 118.20 -157.86 -108.94 132.98 42.65 57.00 0.35 35.94 5.07 1.16 0.08 0.31 0.00 55.70 1.74 91 R C T 137.65 5.84 14.05 21.07 104.72 -134.60 -79.50 -20.46 88.57 10.36 1.07 13.70 31.34 43.46 0.08 1.13 0.00 9.52 0.77 92 N C T 133.75 1.18 14.71 15.46 102.18 -3.33 -90.05 9.05 96.72 2.38 0.90 10.61 41.39 44.73 0.05 1.02 0.00 1.84 0.36 93 S C S 50.59 7.01 11.39 20.24 125.38 60.67 -120.98 147.19 91.03 8.34 0.64 27.51 58.11 5.67 0.07 0.65 0.00 6.71 1.27 94 P C C 83.78 5.37 16.12 22.41 109.18 -100.24 -69.77 145.29 86.74 12.66 0.60 37.91 36.30 11.99 0.05 0.70 0.00 12.49 0.56 95 W C C 83.10 16.06 13.52 29.07 118.24 -118.78 -96.18 134.28 57.63 41.89 0.48 43.77 9.23 2.97 0.06 0.50 0.00 42.79 0.69 96 T E E 55.16 10.24 21.04 31.74 126.45 -169.04 -123.65 139.66 18.01 81.83 0.16 16.01 1.54 0.31 0.05 0.12 0.00 79.61 2.36 97 F E E 56.39 18.80 16.89 34.71 118.62 -137.74 -98.99 136.07 14.05 85.81 0.13 11.90 1.56 0.32 0.05 0.09 0.00 81.78 4.30 98 G C C 17.85 14.61 17.98 32.46 121.81 -138.81 -81.74 173.72 56.63 43.22 0.15 44.17 10.14 1.32 0.02 0.14 0.00 43.47 0.73 99 Q C C 116.60 5.04 22.96 28.48 110.32 -79.65 -79.73 130.80 68.20 31.65 0.16 57.12 8.22 0.89 0.02 0.15 0.00 33.09 0.52 100 G C C 17.16 19.45 15.28 33.31 127.71 -127.36 -84.22 171.19 55.41 44.50 0.09 49.00 3.95 0.34 0.01 0.07 0.00 46.20 0.43 101 T E E 36.87 13.71 20.46 34.61 128.02 -118.10 -123.77 143.60 6.60 93.39 0.01 6.14 0.27 0.02 0.00 0.00 0.00 93.35 0.22 102 K E E 103.78 9.92 22.09 32.33 118.05 -133.41 -95.87 133.01 1.03 98.97 0.00 0.89 0.06 0.00 0.00 0.00 0.00 99.01 0.03 103 V E E 12.15 22.29 14.54 36.87 121.59 -165.37 -116.26 132.18 1.41 98.59 0.00 1.31 0.03 0.00 0.00 0.00 0.00 98.62 0.03 104 E E E 99.65 5.34 23.51 29.30 116.79 -151.74 -102.67 128.72 3.38 96.61 0.01 3.26 0.10 0.01 0.00 0.00 0.00 96.50 0.13 105 I E E 25.20 21.19 10.79 31.21 115.16 -153.84 -96.97 127.18 24.64 75.29 0.07 24.76 0.29 0.06 0.02 0.02 0.00 73.85 0.99 106 K C C 130.80 3.77 19.86 24.35 113.70 -152.74 -95.52 127.53 99.41 0.59 0.00 99.45 0.05 0.01 0.00 0.00 0.00 0.46 0.01