# 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 E C C 121.75 4.66 19.16 24.79 117.61 -141.77 -93.80 135.25 99.81 0.19 0.00 99.78 0.07 0.01 0.00 0.00 0.00 0.13 0.01 1 T C C 44.62 17.22 11.65 28.13 118.25 -144.17 -98.64 132.11 72.36 27.52 0.12 71.63 0.47 0.22 0.02 0.06 0.00 26.85 0.75 2 T E E 66.63 6.65 19.56 27.16 123.45 -168.34 -119.33 135.14 25.26 74.60 0.15 22.19 2.48 0.33 0.05 0.10 0.00 73.84 1.01 3 L E E 43.80 18.91 13.08 31.41 120.29 -155.81 -109.11 131.27 11.25 88.67 0.08 10.37 0.80 0.12 0.03 0.04 0.00 87.73 0.92 4 T E E 70.37 6.92 20.54 28.29 125.20 -171.79 -121.57 139.05 14.68 85.20 0.11 13.20 1.20 0.19 0.04 0.06 0.00 83.74 1.56 5 Q E E 71.18 14.20 14.70 28.87 127.63 -160.47 -123.56 141.47 43.50 56.31 0.18 33.94 9.10 0.79 0.04 0.17 0.00 54.72 1.25 6 S C C 60.01 7.63 17.59 26.22 121.60 -138.44 -100.39 147.37 80.06 19.76 0.18 51.57 26.58 1.45 0.02 0.19 0.00 19.40 0.80 7 P C C 67.81 7.49 17.23 25.66 113.59 -2.75 -69.36 150.09 88.56 10.77 0.67 48.31 33.78 5.80 0.06 0.72 0.00 10.80 0.52 8 A C C 50.14 13.04 15.11 28.24 98.84 -145.77 -81.79 -20.97 63.35 35.76 0.90 36.30 22.89 4.22 0.08 0.92 0.00 34.82 0.77 9 T E E 73.70 6.98 19.96 28.08 129.57 29.61 -132.41 141.05 20.01 79.72 0.27 17.13 2.50 0.41 0.05 0.22 0.00 79.14 0.55 10 L E E 30.83 19.33 14.38 33.37 127.12 -173.07 -130.80 139.66 3.74 96.25 0.01 3.42 0.24 0.02 0.00 0.01 0.00 96.16 0.16 11 S E E 67.76 5.63 23.18 29.93 121.30 -156.05 -114.37 133.45 2.53 97.46 0.00 2.33 0.14 0.01 0.00 0.00 0.00 97.43 0.08 12 V E E 17.13 20.47 13.20 33.50 133.19 173.28 -137.74 151.71 11.78 88.21 0.01 11.26 0.52 0.02 0.00 0.01 0.00 87.08 1.12 13 S C C 54.12 4.46 23.11 27.20 121.53 -120.71 -84.47 155.85 91.90 8.08 0.03 90.96 1.19 0.09 0.01 0.02 0.00 7.17 0.56 14 P C T 61.95 13.59 13.95 27.66 109.72 -82.76 -59.96 135.68 99.39 0.32 0.29 0.25 2.79 96.54 0.01 0.19 0.00 0.18 0.04 15 G C T 49.83 3.39 19.08 23.12 95.90 21.93 87.95 -6.16 99.49 0.27 0.24 0.40 3.20 96.00 0.01 0.18 0.00 0.18 0.02 16 E C C 84.94 7.51 17.24 26.07 123.93 115.61 -87.17 152.13 90.40 9.45 0.15 66.37 23.88 0.41 0.03 0.14 0.00 8.33 0.85 17 T C C 76.09 9.11 18.30 28.49 123.09 -130.91 -107.03 142.80 58.47 41.50 0.02 58.21 0.70 0.04 0.00 0.01 0.00 40.31 0.72 18 A E E 11.44 20.67 15.29 35.87 131.93 -171.83 -134.17 149.17 1.64 98.36 0.00 1.57 0.04 0.00 0.00 0.00 0.00 98.24 0.14 19 T E E 66.12 8.36 24.48 33.42 121.19 -147.39 -114.35 131.87 0.83 99.17 0.00 0.80 0.03 0.00 0.00 0.00 0.00 99.14 0.03 20 L E E 6.53 25.23 16.75 42.37 121.95 -167.63 -114.36 133.76 5.38 94.62 0.01 4.80 0.34 0.02 0.00 0.00 0.00 94.76 0.08 21 S E E 36.58 10.06 26.70 37.30 125.95 -166.98 -119.28 143.56 14.90 85.09 0.01 13.48 0.70 0.03 0.00 0.01 0.00 85.65 0.13 22 C E E 5.40 25.22 17.14 42.59 130.89 -174.87 -134.79 146.72 12.03 87.95 0.02 10.97 0.58 0.04 0.00 0.01 0.00 88.13 0.27 23 R E E 106.56 7.35 26.98 35.14 121.29 -157.23 -116.23 131.68 5.11 94.85 0.04 4.64 0.35 0.04 0.02 0.02 0.00 93.51 1.42 24 A E E 10.00 23.63 13.78 36.96 123.33 -165.74 -108.89 143.23 31.99 67.75 0.25 29.88 1.68 0.28 0.09 0.16 0.00 65.64 2.27 25 S C C 50.34 7.09 20.24 27.83 116.28 -139.57 -95.42 161.68 76.90 22.14 0.95 52.98 20.27 3.35 0.18 0.85 0.00 20.97 1.39 26 Q C S 115.94 5.54 17.58 23.73 101.99 -66.12 -73.80 -5.24 87.47 5.53 7.00 17.15 47.94 23.52 1.66 4.47 0.01 4.12 1.13 27 N C C 95.01 5.74 18.48 24.92 108.72 49.45 -92.15 92.28 87.16 5.04 7.80 32.95 31.27 23.63 1.72 5.82 0.01 3.37 1.23 28 V C C 47.96 15.96 15.83 31.18 108.94 -128.94 -89.24 119.11 79.04 11.22 9.74 44.66 22.07 12.79 2.70 7.04 0.02 7.45 3.26 29 I C C 47.96 15.43 17.37 32.58 122.10 -165.86 -112.51 138.93 77.94 14.30 7.76 57.47 11.60 8.54 1.94 6.18 0.00 11.54 2.72 30 N C S 82.49 9.05 22.43 31.39 104.16 -159.13 -98.65 -14.14 79.06 17.01 3.93 24.38 35.30 20.74 0.55 3.19 0.01 14.56 1.27 31 N C E 58.94 11.36 23.57 34.89 113.83 38.12 -115.73 107.65 58.00 39.53 2.48 27.16 14.97 16.77 0.27 2.24 0.00 37.82 0.77 32 L E E 5.86 25.26 18.13 43.53 125.51 130.51 -114.49 140.65 16.83 83.12 0.05 14.95 1.37 0.11 0.01 0.04 0.00 83.19 0.33 33 A E E 11.68 16.72 27.67 44.48 132.03 -173.25 -131.06 149.49 1.22 98.77 0.00 1.14 0.05 0.00 0.00 0.00 0.00 98.78 0.03 34 W E E 9.10 24.52 22.79 47.20 124.43 -149.42 -114.42 138.08 0.44 99.56 0.00 0.40 0.02 0.00 0.00 0.00 0.00 99.57 0.01 35 Y E E 23.68 17.29 23.67 40.92 132.20 -174.32 -131.05 150.11 0.64 99.36 0.00 0.56 0.02 0.00 0.00 0.00 0.00 99.40 0.02 36 Q E E 43.76 14.29 21.46 36.03 120.91 -145.26 -107.43 134.28 3.01 96.98 0.00 2.56 0.22 0.01 0.00 0.00 0.00 97.13 0.08 37 Q E E 53.79 14.07 15.24 29.80 118.85 -146.94 -102.23 135.47 32.22 67.76 0.02 29.70 1.62 0.07 0.00 0.02 0.00 67.24 1.35 38 K C C 101.81 5.89 15.35 22.58 119.57 -138.45 -91.75 147.49 98.49 1.48 0.03 96.74 1.85 0.15 0.01 0.01 0.00 0.97 0.26 39 P C T 107.14 3.33 11.27 16.61 109.51 -83.85 -58.52 134.13 99.67 0.09 0.24 0.30 3.14 96.26 0.01 0.22 0.00 0.06 0.02 40 G C T 69.48 0.25 12.84 10.24 95.21 17.70 83.23 -3.14 99.69 0.06 0.25 0.39 3.08 96.22 0.00 0.24 0.00 0.04 0.01 41 Q C S 88.81 5.55 9.77 17.44 128.81 95.98 -113.46 158.85 94.15 5.52 0.32 39.30 53.92 0.99 0.07 0.25 0.00 1.86 3.60 42 A C C 76.75 2.14 17.43 19.44 116.72 -98.66 -69.51 150.76 97.56 2.41 0.03 87.92 9.69 0.16 0.00 0.02 0.00 1.86 0.34 43 P C C 46.82 17.59 11.35 28.25 115.15 -100.14 -65.60 144.09 91.83 8.15 0.02 89.80 1.99 0.12 0.00 0.02 0.00 7.81 0.25 44 R E E 102.28 8.34 21.15 30.26 124.82 -160.76 -122.96 139.32 7.10 92.87 0.04 6.28 0.65 0.05 0.01 0.02 0.00 92.42 0.57 45 L E E 62.22 15.78 18.36 33.68 110.63 -114.89 -74.41 126.79 0.91 99.09 0.01 0.80 0.04 0.00 0.00 0.00 0.00 99.13 0.03 46 L E E 22.08 18.50 20.99 39.43 101.44 175.31 -97.08 -33.65 1.86 98.13 0.01 1.30 0.42 0.02 0.00 0.00 0.00 98.25 0.01 47 I E E 13.78 20.91 21.55 42.27 136.59 4.45 -147.77 142.63 0.55 99.44 0.01 0.45 0.04 0.00 0.00 0.00 0.00 99.48 0.02 48 Y E E 71.38 16.66 22.84 38.25 127.98 -172.15 -131.17 137.66 5.24 94.69 0.08 4.28 0.56 0.10 0.02 0.03 0.00 94.84 0.17 49 G E E 14.36 17.26 21.12 37.47 129.98 137.40 -134.21 163.90 46.66 52.49 0.86 28.37 15.66 3.62 0.19 0.61 0.00 50.84 0.71 50 A C C 40.42 13.47 20.09 33.29 115.79 -120.12 -104.75 136.88 66.63 28.58 4.79 38.70 21.32 8.30 1.46 3.09 0.03 24.73 2.36 51 S C C 40.80 12.89 17.73 30.69 119.75 -159.04 -109.14 148.68 74.47 16.73 8.80 40.21 22.69 12.89 2.82 5.66 0.04 12.52 3.17 52 T C C 79.22 8.76 17.22 26.51 105.31 -147.15 -94.30 18.67 70.89 16.05 13.06 36.50 21.47 14.78 4.66 7.66 0.11 10.80 4.02 53 R C C 132.03 6.65 16.31 24.02 113.39 88.40 -96.75 120.15 70.41 17.71 11.88 42.94 15.92 12.44 4.42 7.10 0.06 12.45 4.67 54 A C C 49.44 12.70 12.17 24.90 110.86 -147.31 -90.50 121.15 75.76 14.93 9.31 49.42 13.89 12.33 3.43 5.81 0.02 10.26 4.84 55 T C T 89.80 5.32 15.48 22.02 107.98 -140.61 -93.68 76.17 86.59 7.59 5.82 24.94 19.99 42.55 1.72 3.62 0.01 4.96 2.19 56 G C T 54.22 3.31 17.06 21.26 101.12 -3.73 83.40 0.54 93.40 4.41 2.20 20.63 31.18 41.96 0.32 1.89 0.00 3.11 0.91 57 I C C 48.71 15.63 11.81 27.51 118.41 106.23 -101.92 129.24 81.94 17.36 0.70 48.39 32.84 1.96 0.26 0.49 0.00 8.63 7.43 58 P C C 66.39 7.15 19.07 27.00 111.17 -112.52 -67.38 144.98 84.30 12.93 2.76 62.85 13.14 7.78 0.66 2.41 0.00 10.13 3.04 59 A C C 46.11 15.12 15.26 29.73 104.64 -123.52 -73.54 75.85 82.56 12.81 4.63 49.80 20.44 12.71 0.63 4.33 0.00 10.68 1.41 60 R C C 112.57 8.52 21.77 30.52 114.14 70.32 -107.86 117.28 62.73 33.01 4.26 39.66 17.15 6.81 0.71 3.23 0.00 31.01 1.42 61 F E E 27.55 22.90 13.92 36.11 124.06 127.21 -114.52 139.17 20.53 78.86 0.61 17.66 2.74 0.65 0.23 0.35 0.00 77.00 1.37 62 S E E 53.40 6.78 24.31 32.18 134.75 -178.39 -137.06 156.15 8.04 91.80 0.16 6.97 0.83 0.17 0.06 0.07 0.00 91.42 0.48 63 G E E 22.21 18.56 15.30 32.71 141.01 167.13 -157.80 166.49 8.60 91.30 0.10 7.18 1.08 0.20 0.02 0.05 0.00 91.13 0.33 64 S E E 65.06 4.73 22.11 28.41 135.01 -161.52 -144.79 155.43 12.99 86.91 0.10 11.32 1.33 0.24 0.02 0.06 0.00 86.51 0.53 65 G E E 29.61 11.88 15.06 27.51 139.86 140.27 -153.34 160.51 30.39 69.45 0.16 22.17 7.98 1.16 0.02 0.15 0.00 67.54 0.98 66 S C C 78.32 2.85 20.88 24.00 115.76 -118.08 -120.04 117.92 62.03 37.66 0.31 45.64 14.34 2.74 0.06 0.34 0.00 34.08 2.80 67 G C S 35.21 9.29 18.87 28.35 108.41 -53.99 65.78 -121.65 98.45 1.16 0.39 2.02 62.11 34.52 0.01 0.36 0.00 0.86 0.12 68 T C S 55.25 14.34 16.44 30.71 97.94 -8.96 -100.31 -1.63 98.33 1.37 0.29 1.96 63.13 33.38 0.01 0.27 0.00 1.14 0.10 69 E E E 78.28 8.62 22.38 32.19 122.47 82.91 -111.51 134.42 29.00 70.93 0.07 21.98 6.79 0.53 0.01 0.08 0.00 68.87 1.73 70 F E E 7.64 24.60 15.85 40.92 128.97 -174.12 -129.05 142.73 8.30 91.69 0.00 8.03 0.19 0.01 0.00 0.00 0.00 91.53 0.25 71 T E E 36.57 9.90 27.12 38.16 121.77 -158.07 -117.61 132.72 2.90 97.10 0.00 2.49 0.11 0.00 0.00 0.00 0.00 97.37 0.03 72 L E E 2.86 26.34 18.69 46.01 120.17 -165.10 -113.41 128.91 0.46 99.54 0.00 0.48 0.01 0.00 0.00 0.00 0.00 99.51 0.00 73 T E E 41.18 9.94 27.35 38.14 120.59 -165.19 -115.37 130.14 0.15 99.85 0.00 0.18 0.00 0.00 0.00 0.00 0.00 99.81 0.01 74 I E E 7.69 24.18 16.36 41.08 116.86 -164.21 -111.20 125.24 2.01 97.99 0.00 2.09 0.03 0.00 0.00 0.00 0.00 97.48 0.40 75 S C C 48.50 7.15 22.92 30.28 117.65 -165.88 -101.95 158.99 89.23 10.69 0.08 42.82 39.24 5.00 0.00 0.13 0.00 12.56 0.25 76 S C S 63.61 4.81 23.89 28.66 104.86 10.02 58.83 89.26 98.51 1.45 0.04 13.35 79.54 5.59 0.00 0.06 0.00 1.34 0.13 77 M C C 29.83 22.81 11.03 32.97 112.34 -140.89 -75.94 127.84 98.60 1.38 0.02 97.24 1.52 0.04 0.01 0.01 0.00 0.61 0.58 78 Q C C 81.14 4.18 23.13 27.20 131.84 161.86 -125.59 162.54 98.01 1.94 0.05 96.52 1.31 0.02 0.02 0.01 0.00 0.28 1.85 79 S H G 64.53 10.62 15.43 26.64 90.92 -99.41 -60.03 -31.08 4.40 0.03 95.57 0.28 0.33 2.90 0.61 95.87 0.00 0.02 0.00 80 E H G 119.30 4.73 20.97 26.55 90.57 63.10 -72.31 -16.16 3.48 0.03 96.49 0.16 0.22 2.41 0.52 96.66 0.00 0.02 0.00 81 D H G 13.62 20.97 16.15 37.34 94.33 60.77 -87.49 -3.19 4.17 0.05 95.78 0.59 0.45 1.99 0.65 96.27 0.00 0.04 0.00 82 F C C 49.78 17.06 20.99 37.84 117.09 103.77 -81.76 136.30 80.77 15.88 3.35 74.60 5.66 1.00 0.50 2.81 0.00 14.65 0.79 83 A E E 13.06 18.44 22.91 40.53 139.55 157.27 -144.91 171.24 20.93 78.94 0.14 18.08 2.56 0.37 0.03 0.11 0.00 77.98 0.88 84 V E E 34.75 15.02 25.65 40.63 118.22 -104.55 -103.44 131.53 2.17 97.81 0.02 2.01 0.14 0.01 0.00 0.01 0.00 97.74 0.08 85 Y E E 8.09 24.79 20.78 45.45 124.29 -167.00 -116.29 138.40 0.87 99.12 0.01 0.77 0.06 0.01 0.00 0.00 0.00 99.13 0.03 86 Y E E 31.81 16.63 27.18 43.57 129.59 -169.98 -126.46 145.58 2.10 97.87 0.03 1.82 0.12 0.02 0.01 0.01 0.00 97.95 0.06 87 C E E 4.16 24.62 21.40 46.07 123.66 -156.98 -116.40 135.80 11.23 88.54 0.23 9.29 1.59 0.23 0.07 0.10 0.00 88.38 0.34 88 Q E E 35.26 14.62 24.71 39.30 127.68 -171.74 -122.17 141.57 18.31 81.15 0.54 16.14 1.79 0.42 0.21 0.28 0.00 80.09 1.07 89 Q E E 44.96 16.03 19.20 34.96 115.87 -138.07 -94.49 135.27 39.48 59.37 1.16 31.55 6.86 1.83 0.30 0.86 0.00 57.15 1.46 90 Y C C 80.57 11.96 16.59 29.18 115.04 -153.42 -102.50 124.96 62.04 33.06 4.90 38.82 15.25 9.88 0.82 4.12 0.02 27.85 3.22 91 N C T 88.55 7.03 14.85 22.84 111.03 154.24 -104.80 72.20 87.08 9.21 3.71 21.95 30.16 35.31 0.29 3.75 0.00 7.34 1.20 92 D C S 108.96 3.16 15.04 19.08 102.23 -8.38 -95.09 29.54 92.55 4.51 2.94 25.68 33.74 33.26 0.23 3.05 0.00 3.15 0.88 93 W C S 104.65 10.50 10.34 21.78 121.52 110.01 -103.44 139.36 88.06 10.46 1.48 41.49 41.66 5.67 0.35 1.20 0.00 6.44 3.19 94 P C C 82.62 4.87 15.93 21.72 112.36 -93.72 -70.00 148.02 90.32 6.75 2.93 51.00 23.91 15.44 0.42 2.74 0.00 5.56 0.93 95 R C C 121.18 9.77 14.76 25.17 114.54 -104.68 -80.31 135.33 74.57 21.50 3.93 49.42 14.55 10.69 0.70 3.33 0.00 19.44 1.86 96 S E E 43.51 12.35 16.26 29.05 122.61 -166.61 -114.30 141.93 47.47 49.43 3.10 37.15 6.28 3.75 1.05 2.29 0.01 43.67 5.80 97 F E E 77.66 14.45 15.83 30.13 118.37 -147.76 -108.19 134.67 41.02 56.85 2.13 27.79 9.25 5.20 0.86 1.60 0.05 46.48 8.79 98 G C C 29.32 11.00 16.86 28.13 122.08 -139.76 0.59 -159.45 71.32 27.67 1.01 40.40 21.81 9.70 0.15 0.95 0.00 25.38 1.60 99 Q C C 120.88 5.11 20.15 25.71 104.43 -64.59 -87.71 19.55 76.32 22.78 0.90 46.69 22.72 6.76 0.13 0.91 0.00 21.55 1.25 100 G C C 22.22 15.22 14.44 29.10 126.84 -127.78 95.24 174.05 67.39 32.24 0.37 49.67 13.65 2.69 0.05 0.38 0.00 32.61 0.94 101 T E E 54.59 11.65 17.48 29.70 125.06 -97.80 -117.24 144.87 19.71 80.10 0.19 17.14 2.23 0.38 0.05 0.13 0.00 78.52 1.55 102 R E E 135.39 6.90 17.84 26.14 119.07 -133.37 -98.82 135.19 9.74 90.09 0.18 8.90 0.76 0.16 0.11 0.09 0.00 87.21 2.79 103 L E E 56.06 15.70 10.17 25.41 114.57 -146.82 -94.63 131.72 48.62 51.13 0.25 48.49 0.46 0.17 0.12 0.09 0.00 49.39 1.28 104 D C C 103.52 3.31 17.51 21.79 114.48 -153.09 -99.79 130.25 98.74 1.24 0.01 98.77 0.07 0.02 0.00 0.00 0.00 1.12 0.02