A0A3Q0KKI6_SCHMA Loading...

Putative RNA-binding protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KKI6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 793 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	37.7	Very low	233 Å²	233	146.4 Å²	146.4	100%	1.148	82%	0.824	S	S	*	*				0	138.4	0	-69.5	-59.7	-167.4	0	0	108.2
2	P	43.3	Very low	37.5	Very low	107 Å²	107	144.8 Å²	144.8	70%	0.695	82%	0.82	S	S	*	*			cis	-131.3	-159.9	-45.2	30.3	-10.1	0	0	0	111.1
3	L	36.9	Very low	37.3	Very low	158 Å²	158	142.5 Å²	142.5	83%	0.827	82%	0.816	S	S	*	*			trans	95.8	158.9	161.6	-54.9	177	0	0	0	120
4	C	37.7	Very low	37	Very low	135 Å²	135	139.9 Å²	139.9	91%	0.912	81%	0.812	S	S	*	*			trans	75.2	101.9	173.2	-62.8	0	0	0	0	118.3
5	S	36.5	Very low	37	Very low	105 Å²	105	141 Å²	141	73%	0.734	81%	0.813	S	S	*	*			trans	-144.5	165.6	160	59.5	0	0	0	0	110.6
6	N	39.1	Very low	37	Very low	146 Å²	146	142.4 Å²	142.4	78%	0.781	82%	0.816	S	S	*	*			trans	75	91.8	170.9	-55	-24.7	0	0	0	119.1
7	L	38.3	Very low	36.9	Very low	176 Å²	176	138.5 Å²	138.5	92%	0.921	81%	0.814	S	S	*	*				-167.9	127.9	119.4	-102.4	159.8	0	0	0	109.7
8	P	41.5	Very low	36.8	Very low	109 Å²	109	140.1 Å²	140.1	71%	0.708	82%	0.817	S	S	*	*			trans	-105.6	147.1	-163.9	38.1	-34.4	0	0	0	116.9
9	H	38.3	Very low	36.9	Very low	178 Å²	178	139.7 Å²	139.7	82%	0.824	82%	0.823	S	S	*	*			trans	27.3	116.4	146.3	-67.9	-84.9	0	0	0	121.3
10	I	37.4	Very low	36.8	Very low	160 Å²	160	137.4 Å²	137.4	82%	0.821	82%	0.821	S	S	*	*			trans	-85.5	133.9	135.8	-67.6	172.3	0	0	0	107.5	V12	I10-V12 HydrophobicContact CG2-CG2 4.32Å
11	C	33.1	Very low	36.7	Very low	103 Å²	103	138.6 Å²	138.6	70%	0.696	82%	0.82	S	S	*	*			trans	-110.2	137.3	175.8	-169.1	0	0	0	0	110.2
12	V	34.5	Very low	36.9	Very low	128 Å²	128	136.7 Å²	136.7	78%	0.776	80%	0.8	S	S	*	*			trans	-132.4	113.2	174.6	-173.6	0	0	0	0	107.6	I10	I10-V12 HydrophobicContact CG2-CG2 4.32Å
13	C	35.3	Very low	36.7	Very low	114 Å²	114	140 Å²	140	77%	0.77	80%	0.799	S	S	*	*			trans	-115.3	120	175	-68.2	0	0	0	0	109.7
14	S	33.1	Very low	36.9	Very low	107 Å²	107	140.5 Å²	140.5	75%	0.748	80%	0.796	S	S	*	*			trans	-85.3	146.2	159.2	-51	0	0	0	0	108.4
15	D	37	Very low	37	Very low	156 Å²	156	136.8 Å²	136.8	83%	0.834	78%	0.781	S	S	*	*			trans	-162.1	167.5	133.1	-119.3	-35	0	0	0	116.2
16	L	36.6	Very low	37.3	Very low	163 Å²	163	138.6 Å²	138.6	85%	0.853	78%	0.782	S	S	*	*			trans	-79.5	162.2	-164.4	-62.7	149.4	0	0	0	115.8
17	G	36.7	Very low	37.2	Very low	77 Å²	77	139.3 Å²	139.3	79%	0.794	78%	0.781	S	S	*	*			trans	170.9	121.8	160.7	0	0	0	0	0	115.8
18	L	34.7	Very low	37.1	Very low	166 Å²	166	137 Å²	137	87%	0.869	77%	0.77	S	S	*	*			trans	-107.7	147.1	175	-73.1	79.9	0	0	0	111.9
19	S	37.4	Very low	36.9	Very low	133 Å²	133	141.4 Å²	141.4	93%	0.93	78%	0.778	S	S	*	*				-179.7	169.9	128.8	-82.6	0	0	0	0	111.9
20	A	34.8	Very low	37	Very low	93 Å²	93	138.4 Å²	138.4	77%	0.769	78%	0.777	S	S	*	*			trans	-149.2	154.5	-169.3	0	0	0	0	0	113.7
21	M	35.5	Very low	37.5	Very low	164 Å²	164	137 Å²	137	81%	0.808	78%	0.779	S	S	*	*			trans	-177.4	135.5	142.5	-105.6	166	54.7	0	0	114.7
22	R	37.1	Very low	37.7	Very low	193 Å²	193	137.9 Å²	137.9	73%	0.728	78%	0.783	S	S	*	*				37.3	146	126	-61.8	-178.6	178.7	-175.3	0.3	120
23	R	39.6	Very low	37.7	Very low	177 Å²	177	137 Å²	137	67%	0.668	78%	0.782	S	S	*	*			cis	-175.2	156.6	5.9	-119.4	174.8	-173.9	-159.9	1.8	111.9
24	H	39.8	Very low	37.8	Very low	167 Å²	167	141.4 Å²	141.4	77%	0.773	79%	0.789	S	S	*	*			trans	55.7	155.4	161	-62.9	-73.8	0	0	0	119.4
25	G	40.5	Very low	38	Very low	58 Å²	58	147.6 Å²	147.6	60%	0.598	80%	0.795	S	S	*	*			cis	171	158.4	-9.2	0	0	0	0	0	112.9
26	D	42	Very low	38.1	Very low	142 Å²	142	148.5 Å²	148.5	76%	0.759	79%	0.794	S	S	*	*			trans	61.1	157.2	159.1	-55.9	-49.9	0	0	0	118.8
27	Q	37.8	Very low	38.2	Very low	161 Å²	161	151.7 Å²	151.7	75%	0.752	80%	0.795	S	S	*	*			cis	-150.6	-178.1	-5.6	-131.7	162	46.6	0	0	112.2
28	D	36.9	Very low	38.3	Very low	129 Å²	129	154.4 Å²	154.4	69%	0.69	79%	0.791	S	S	*	*			trans	-64.5	163.7	-168.5	-56.2	-87	0	0	0	118.5
29	F	37.9	Very low	38.5	Very low	200 Å²	200	157.9 Å²	157.9	88%	0.877	79%	0.793	S	S	*	*				171	156.5	110.6	-92.9	-67.7	0	0	0	113
30	S	38.9	Very low	38.6	Very low	116 Å²	116	157.3 Å²	157.3	81%	0.811	79%	0.789	S	S	*	*			trans	-153.4	139.3	177.2	-69.8	0	0	0	0	112.7
31	P	48.1	Very low	38.8	Very low	130 Å²	130	156.2 Å²	156.2	84%	0.844	79%	0.787	S	S	*	*			trans	-128	163.4	158.8	25.6	-6.2	0	0	0	114.2
32	P	38.4	Very low	38.8	Very low	121 Å²	121	159.3 Å²	159.3	79%	0.786	79%	0.791	S	S	*	*			trans	-120.8	175.5	-162.2	42.8	-32.1	0	0	0	116.5
33	S	33.5	Very low	38.9	Very low	109 Å²	109	154.3 Å²	154.3	76%	0.762	79%	0.786	S	S	*	*			trans	72.1	118	148.7	-168.4	0	0	0	0	120.4
34	K	38.3	Very low	38.9	Very low	208 Å²	208	152.4 Å²	152.4	90%	0.904	78%	0.784	S	S	*	*				-159.9	155	130	-109.3	160.5	-174	175.4	0	111.4
35	R	35.9	Very low	38.8	Very low	237 Å²	237	152.5 Å²	152.5	89%	0.894	78%	0.778	S	S	*	*			trans	-115.1	150.1	173.6	-67.9	175.6	174.4	164.8	-2.5	109.2
36	H	40.6	Very low	38.6	Very low	175 Å²	175	156.7 Å²	156.7	81%	0.81	78%	0.781	S	S	*	*			trans	-143.9	159.1	148.3	-117.9	-87.3	0	0	0	110.1	D38	H36-D38 IonicContact CE1-OD2 3.84Å; H36-D38 IonicContact CG-OD2 2.63Å; H36-D38 IonicContact ND1-OD1 3.45Å; H36-D38 IonicContact ND1-OD2 2.64Å; H36-D38 PolarHBondContact ND1-OD2 2.76Å
37	R	38.6	Very low	38.4	Very low	230 Å²	230	161.9 Å²	161.9	87%	0.868	79%	0.791	S	S	*	*			trans	-169.9	101.7	-165.2	-176	-160.6	-161.8	-171.6	8.2	110.3
38	D	37.7	Very low	38.4	Very low	134 Å²	134	159.3 Å²	159.3	72%	0.717	79%	0.79	S	S	*	*			trans	-131.3	141.8	-166.9	-63.4	-88.4	0	0	0	110.4	H36	H36-D38 IonicContact CE1-OD2 3.84Å; H36-D38 IonicContact CG-OD2 2.63Å; H36-D38 IonicContact ND1-OD1 3.45Å; H36-D38 IonicContact ND1-OD2 2.64Å; H36-D38 PolarHBondContact ND1-OD2 2.76Å
39	R	39.8	Very low	38.8	Very low	238 Å²	238	159.9 Å²	159.9	90%	0.898	80%	0.798	S	S	*	*			trans	-155.4	105	-143.4	161.8	-111	179.5	-174.7	0.7	116
40	S	39.1	Very low	39.1	Very low	122 Å²	122	154.2 Å²	154.2	85%	0.853	78%	0.783	S	S	*	*			trans	-169.7	157.7	157.8	57.7	0	0	0	0	110.3
41	G	38	Very low	39.2	Very low	70 Å²	70	159.1 Å²	159.1	72%	0.722	78%	0.784	S	S	*	*			cis	110.2	107.2	-19.9	0	0	0	0	0	116.7
42	Y	36.1	Very low	38.8	Very low	229 Å²	229	159.9 Å²	159.9	90%	0.898	78%	0.781	S	S	*	*			trans	-153.5	157.2	166	-141	-92.7	0	0	0	113.2
43	S	40.5	Very low	39	Very low	88 Å²	88	159 Å²	159	62%	0.615	78%	0.778	S	S	*	*			trans	-160.7	-170.7	179.9	55.7	0	0	0	0	110.8
44	E	39.1	Very low	39.4	Very low	136 Å²	136	159.9 Å²	159.9	64%	0.636	78%	0.781	S	S	*	*			trans	80.1	151.7	170.6	-50.8	-149.9	127.1	0	0	116.3
45	R	37	Very low	39.5	Very low	170 Å²	170	155.3 Å²	155.3	64%	0.642	78%	0.775	S	S	*	*			cis	-161.8	165.5	-2.2	-125.3	164.6	-164	-170	36.6	113.7
46	H	37.5	Very low	39.7	Very low	145 Å²	145	149 Å²	149	67%	0.671	77%	0.767	S	S	*	*			trans	53.8	131.2	149.7	-62	-45	0	0	0	123.1
47	R	36.8	Very low	39.6	Very low	252 Å²	252	152 Å²	152	95%	0.951	77%	0.771	S	S	*	*				-157.4	156	111.8	-106.2	169.8	-172.1	-179.7	3	110.8
48	S	38.2	Very low	39.6	Very low	106 Å²	106	146.4 Å²	146.4	74%	0.741	77%	0.768	S	S	*	*			trans	-154.2	121	-170.2	54.1	0	0	0	0	113.3
49	V	43.9	Very low	39.5	Very low	142 Å²	142	148 Å²	148	86%	0.861	77%	0.768	S	S	*	*			trans	-154.8	152.5	170.6	-174.8	0	0	0	0	106.8
50	S	44.2	Very low	39.5	Very low	81 Å²	81	146.5 Å²	146.5	57%	0.566	76%	0.764	S	S	*	*			cis	179.1	146.9	-47.8	79.3	0	0	0	0	106.1
51	R	41.2	Very low	39.2	Very low	218 Å²	218	144.7 Å²	144.7	82%	0.823	75%	0.751	S	S	*	*			trans	77.8	132	154.8	-63.9	174.7	-178.7	-163.7	-1.1	121.2
52	N	40.4	Very low	39.1	Very low	146 Å²	146	149.5 Å²	149.5	78%	0.781	76%	0.759	S	S	*	*			trans	68.6	146.2	143.9	-58.3	8.6	0	0	0	119.2
53	S	43.5	Very low	39.2	Very low	104 Å²	104	143.4 Å²	143.4	73%	0.727	75%	0.75	S	S	*	*			cis	-163	158.3	-17.8	-83.9	0	0	0	0	109.3
54	P	40.3	Very low	38.8	Very low	127 Å²	127	146 Å²	146	83%	0.825	76%	0.757	S	S	*	*			trans	-107.3	145.6	-175.5	37.8	-32	0	0	0	115.9
55	S	41.4	Very low	38.8	Very low	111 Å²	111	149.7 Å²	149.7	78%	0.776	77%	0.765	S	S	*	*			trans	-163.8	164.4	162	63.6	0	0	0	0	113.9
56	S	40	Very low	38.7	Very low	104 Å²	104	149.2 Å²	149.2	73%	0.727	77%	0.77	S	S	*	*			trans	28.5	126.3	162.3	46.9	0	0	0	0	121.2
57	R	38.3	Very low	38.6	Very low	239 Å²	239	147.9 Å²	147.9	90%	0.902	78%	0.777	S	S	*	*			cis	89.6	137	38.2	-166.5	-179.5	-170	-169.7	4.2	114.1
58	S	38.6	Very low	38.6	Very low	113 Å²	113	141.2 Å²	141.2	79%	0.79	77%	0.77	S	S	*	*			trans	72.5	133.4	-170.5	71.4	0	0	0	0	113.6
59	K	35.4	Very low	38.6	Very low	168 Å²	168	147.6 Å²	147.6	73%	0.73	78%	0.777	S	S	*	*			cis	95.2	132.7	33.5	-88.5	-161.4	172.6	-170.8	0	112.8
60	Y	39.1	Very low	38.1	Very low	205 Å²	205	145.7 Å²	145.7	80%	0.804	77%	0.768	S	S	*	*			trans	67.5	151.4	-179.4	-53.5	-73.6	0	0	0	114.3
61	S	33.6	Very low	37.5	Very low	84 Å²	84	151.6 Å²	151.6	59%	0.587	78%	0.783	S	S	*	*			cis	176	154.1	-33	51.4	0	0	0	0	107
62	L	36.8	Very low	37.2	Very low	171 Å²	171	148 Å²	148	90%	0.895	78%	0.78	S	S	*	*			trans	68.9	150.5	176.1	-48.5	150.1	0	0	0	112.1
63	S	37.4	Very low	36.9	Very low	101 Å²	101	145.8 Å²	145.8	71%	0.706	78%	0.776	S	S	*	*			cis	-151.7	169.8	17.3	57.9	0	0	0	0	112.1
64	N	33.1	Very low	36.3	Very low	143 Å²	143	149.9 Å²	149.9	77%	0.765	78%	0.784	S	S	*	*			trans	16.8	136.7	149.3	-60.6	-11.8	0	0	0	119.9
65	R	37.3	Very low	35.6	Very low	213 Å²	213	147 Å²	147	80%	0.804	78%	0.778	S	S	*	*				-170.1	144.3	95.8	-96.4	171.9	-159.3	-104.5	8.4	114.1
66	H	36.3	Very low	35	Very low	160 Å²	160	151.7 Å²	151.7	74%	0.741	78%	0.778	S	S	*	*			trans	29.6	115.7	154.7	-42.3	-58.2	0	0	0	120.5
67	S	35.6	Very low	34.6	Very low	117 Å²	117	153.8 Å²	153.8	82%	0.818	79%	0.787	S	S	*	*				-169.3	135.3	107.7	-169.3	0	0	0	0	111.6
68	S	35.6	Very low	34.4	Very low	113 Å²	113	149.2 Å²	149.2	79%	0.79	78%	0.776	S	S	*	*			trans	-100.1	125.5	170.3	42.1	0	0	0	0	110.2
69	R	38.9	Very low	33.9	Very low	239 Å²	239	146.3 Å²	146.3	90%	0.902	76%	0.763	S	S	*	*			trans	-146	160.3	167.7	-97.6	-159.1	160.6	174	-5.8	111.1
70	P	33.1	Very low	34.3	Very low	102 Å²	102	144.7 Å²	144.7	66%	0.662	76%	0.762	S	S	*	*			trans	-110.7	174.7	-132.7	40.8	-37.4	0	0	0	114.8	N72	P70-N72 PolarHBondContact O-N 3.26Å
71	K	31.3	Very low	34.7	Very low	205 Å²	205	139.7 Å²	139.7	89%	0.891	75%	0.749	S	S	*	*			trans	-55.8	130.3	153.7	-64.5	-179.5	178.1	-178.4	0	108.7
72	N	35.9	Very low	36	Very low	142 Å²	142	142.4 Å²	142.4	76%	0.759	75%	0.752	S	S	*	*			trans	-160.1	148.4	163.4	-124.4	6.3	0	0	0	111.6	P70	P70-N72 PolarHBondContact O-N 3.26Å
73	S	34.5	Very low	37.6	Very low	100 Å²	100	135.7 Å²	135.7	70%	0.699	72%	0.719	S	S	*	*			trans	40.9	121.6	153.4	62.7	0	0	0	0	120.3
74	E	29.6	Very low	40	Very low	191 Å²	191	137 Å²	137	89%	0.893	71%	0.709	S	S	*	*	S	Bend	trans	-32.7	158.5	140.4	-56	157.9	131.6	0	0	114.5
75	G	26.2	Very low	42.6	Very low	67 Å²	67	131.6 Å²	131.6	69%	0.691	68%	0.681	S	S	*	*			trans	78.7	101.4	159.8	0	0	0	0	0	115.8
76	R	29.6	Very low	45.1	Very low	208 Å²	208	121.4 Å²	121.4	79%	0.785	64%	0.643	S	S	*	*			trans	-166.2	85.1	139.1	-104.6	159.8	-168.5	-127.4	6.4	111.7	H78	R76-H78 WeakPolarHBondContact CD-NE2 3.34Å; R76-H78 WeakPolarHBondContact CG-NE2 3.39Å; R76-H78 PolarHBondContact NH1-NE2 3.42Å; R76-H78 VanDerWaalsContact NH1-NE2 3.11Å; R76-H78 PolarHBondContact O-N 2.88Å
77	T	30.7	Very low	47.7	Very low	148 Å²	148	113.8 Å²	113.8	91%	0.908	61%	0.607	S	S	*	*			trans	-68.5	68	159.6	39	0	0	0	0	110.3
78	H	33	Very low	50.3	Low	144 Å²	144	108.2 Å²	108.2	67%	0.667	57%	0.569	S	S	*	*			trans	-95.8	132.3	166.8	-68.5	-38.5	0	0	0	109	R76	R76-H78 WeakPolarHBondContact CD-NE2 3.34Å; R76-H78 WeakPolarHBondContact CG-NE2 3.39Å; R76-H78 PolarHBondContact NH1-NE2 3.42Å; R76-H78 VanDerWaalsContact NH1-NE2 3.11Å; R76-H78 PolarHBondContact O-N 2.88Å
79	G	30	Very low	52.9	Low	51 Å²	51	106.2 Å²	106.2	53%	0.526	54%	0.543	S	S	.	.			cis	-178.6	119.5	-9.5	0	0	0	0	0	107.3
80	L	43	Very low	55.2	Low	134 Å²	134	97.8 Å²	97.8	70%	0.702	52%	0.516	S	S	*	.	S	Bend	trans	-126.8	110.3	173.7	-75.3	173.9	0	0	0	106.1
81	D	47.3	Very low	57.8	Low	100 Å²	100	93.5 Å²	93.5	54%	0.535	49%	0.488	S	S	.	.			trans	-70.9	144.9	-136.9	-61.5	-68.3	0	0	0	116.3	S83	D81-S83 PolarHBondContact O-N 3.48Å
82	H	61	Low	60.2	Low	141 Å²	141	85 Å²	85	65%	0.653	45%	0.454	S	S	*	.			trans	-69	57.5	178.6	-63.7	88.3	0	0	0	112.2	R84	H82-R84 PolarHBondContact O-N 3.33Å; H82-R84 VanDerWaalsContact O-N 3.16Å
83	S	71.3	Confident	62.4	Low	30 Å²	30	83.2 Å²	83.2	21%	0.21	45%	0.453	C	S	.	.			trans	-71.8	108.5	-179	-73.7	0	0	0	0	111	D81 T85 A137 I160	D81-S83 PolarHBondContact O-N 3.48Å; S83-T85 PolarHBondContact O-N 2.84Å; S83-A137 WeakPolarHBondContact O-CB 3.47Å; S83-I160 WeakPolarHBondContact OG-CG1 3.24Å
84	R	86.7	Confident	64.7	Low	128 Å²	128	87.6 Å²	87.6	48%	0.483	46%	0.459	S	S	.	.			trans	-64.9	-12.6	172.8	-59.6	-171.7	-179	-175.2	2.5	113.8	H82 T130 Y131 Q132	H82-R84 PolarHBondContact O-N 3.33Å; H82-R84 VanDerWaalsContact O-N 3.16Å; R84-T130 HydrophobicContact CB-CG2 4.32Å; R84-T130 WeakPolarHBondContact O-CA 3.31Å; R84-Y131 PolarHBondContact O-N 3.12Å; R84-Q132 WeakPolarHBondContact CD-O 3.4Å; R84-Q132 PolarHBondContact NE-O 2.9Å; R84-Q132 PolarHBondContact NH1-O 3.45Å
85	T	87.9	Confident	67.3	Low	30 Å²	30	80.3 Å²	80.3	18%	0.184	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	128.3	-177.1	-46.3	0	0	0	0	112.1	S83 L128 V129 T130 L159	S83-T85 PolarHBondContact O-N 2.84Å; T85-L128 HydrophobicContact CG2-CB 4.41Å; T85-V129 WeakPolarHBondContact CA-O 3.2Å; T85-T130 VanDerWaalsContact CG2-OG1 3.27Å; T85-T130 WeakPolarHBondContact CG2-OG1 3.32Å; T85-T130 WeakPolarHBondContact OG1-CG2 3.49Å; T85-T130 PolarHBondContact OG1-OG1 2.83Å; T85-L159 HydrophobicContact CG2-CB 4.36Å; T85-L159 HydrophobicContact CG2-CD2 3.81Å; T85-L159 HydrophobicContact CG2-CG 4.48Å; T85-L159 WeakPolarHBondContact O-CB 3.45Å; T85-L159 PolarHBondContact O-N 3.36Å
86	I	90.4	Very high	70.3	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	161.3	169.4	63.9	-178.5	0	0	0	110	L108 V129 Y131 A137 A140 L141 V156 T157	I86-L108 HydrophobicContact CD1-CD1 4.07Å; I86-V129 HydrophobicContact CD1-CB 4.43Å; I86-V129 HydrophobicContact CG1-CB 3.81Å; I86-V129 HydrophobicContact CG1-CG1 4.37Å; I86-V129 PolarHBondContact N-O 2.73Å; I86-V129 PolarHBondContact O-N 2.69Å; I86-Y131 HydrophobicContact CD1-CE2 3.71Å; I86-Y131 HydrophobicContact CG1-CE2 4.27Å; I86-A137 HydrophobicContact CG2-CB 4.46Å; I86-A140 HydrophobicContact CD1-CB 4.11Å; I86-L141 HydrophobicContact CG2-CB 4.36Å; I86-V156 HydrophobicContact CB-CG1 4.26Å; I86-V156 HydrophobicContact CD1-CG1 3.69Å; I86-V156 HydrophobicContact CG1-CG1 4.26Å; I86-T157 CarbonylContact C-O 3.5Å; I86-T157 WeakPolarHBondContact CA-O 3.21Å
87	C	90.6	Very high	73.1	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	119.1	-173	-176.4	0	0	0	0	109.6	L128 T157 L159	C87-L128 HydrophobicContact CB-CD2 4.24Å; C87-T157 PolarHBondContact N-O 2.83Å; C87-T157 PolarHBondContact O-N 3.08Å; C87-T157 PolarHBondContact O-OG1 2.89Å; C87-L159 HydrophobicContact CB-CD1 3.71Å
88	V	90.6	Very high	75.9	Confident	0 Å²	0	69 Å²	69	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	120.4	174	-175.5	0	0	0	0	108.7	I91 V104 L108 V126 A127 V129 I147 I149 A154 N155 V156	V88-I91 HydrophobicContact CB-CD1 4.2Å; V88-I91 HydrophobicContact CG1-CD1 3.97Å; V88-I91 HydrophobicContact CG1-CG1 4.18Å; V88-V104 HydrophobicContact CG2-CG1 4.33Å; V88-V104 HydrophobicContact CG2-CG2 4.49Å; V88-L108 HydrophobicContact CG2-CD1 4.15Å; V88-V126 CarbonylContact O-C 3.45Å; V88-V126 WeakPolarHBondContact O-CA 3.27Å; V88-V126 WeakPolarHBondContact O-CB 3.33Å; V88-A127 HydrophobicContact CB-CB 4.12Å; V88-A127 HydrophobicContact CG2-CB 4.48Å; V88-A127 PolarHBondContact N-O 3.16Å; V88-A127 PolarHBondContact O-N 2.98Å; V88-V129 HydrophobicContact CG2-CG2 4.11Å; V88-I147 HydrophobicContact CG1-CD1 3.93Å; V88-I147 HydrophobicContact CG1-CG1 4.27Å; V88-I147 HydrophobicContact CG2-CD1 4.15Å; V88-I149 HydrophobicContact CG1-CD1 4.22Å; V88-A154 HydrophobicContact CG1-CB 3.69Å; V88-N155 CarbonylContact C-O 3.53Å; V88-N155 WeakPolarHBondContact CA-O 3.49Å; V88-V156 HydrophobicContact CG2-CG2 4.36Å
89	R	90.1	Very high	78.6	Confident	70 Å²	70	64.4 Å²	64.4	26%	0.264	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	171.8	-176.6	-70.3	175.1	157.3	119.4	-12.2	112	I91 V126 A154 N155 T157	R89-I91 VanDerWaalsContact C-N 3.33Å; R89-V126 HydrophobicContact CG-CG1 3.89Å; R89-A154 CarbonylContact O-C 3.59Å; R89-A154 VanDerWaalsContact O-CA 3.28Å; R89-A154 WeakPolarHBondContact O-CA 3.27Å; R89-A154 WeakPolarHBondContact O-CB 3.36Å; R89-N155 PolarHBondContact N-O 2.81Å; R89-N155 PolarHBondContact O-N 3.41Å; R89-N155 VanDerWaalsContact O-N 3.08Å; R89-T157 PolarHBondContact NH1-OG1 3.04Å
90	N	86.9	Confident	81.5	Confident	62 Å²	62	62 Å²	62	33%	0.332	33%	0.327	S	S	.	.	S	Bend	trans	65.7	25.4	-174.5	-169.5	36.6	0	0	0	115.1	R152 P153	N90-R152 PolarHBondContact O-NE 3.48Å; N90-R152 VanDerWaalsContact O-NE 3.12Å; N90-R152 PolarHBondContact OD1-NE 2.92Å; N90-R152 PolarHBondContact OD1-NH2 2.9Å; N90-P153 PolarHBondContact ND2-O 2.79Å
91	I	86.7	Confident	83.8	Confident	13 Å²	13	57.9 Å²	57.9	7%	0.067	30%	0.304	C	S	.	.			trans	-75.4	131.6	179.8	-50.5	-171.6	0	0	0	110.2	V88 R89 V100 A127 I149	V88-I91 HydrophobicContact CB-CD1 4.2Å; V88-I91 HydrophobicContact CG1-CD1 3.97Å; V88-I91 HydrophobicContact CG1-CG1 4.18Å; R89-I91 VanDerWaalsContact C-N 3.33Å; I91-V100 HydrophobicContact CD1-CG1 3.79Å; I91-V100 HydrophobicContact CG2-CB 4.43Å; I91-V100 HydrophobicContact CG2-CG1 3.92Å; I91-V100 HydrophobicContact CG2-CG2 3.58Å; I91-A127 HydrophobicContact CD1-CB 3.63Å; I91-A127 VanDerWaalsContact CD1-N 3.31Å; I91-I149 HydrophobicContact CD1-CD1 4.23Å; I91-I149 HydrophobicContact CG1-CD1 4.13Å; I91-I149 HydrophobicContact CG2-CD1 4.46Å
92	S	83.3	Confident	85.9	Confident	27 Å²	27	59.6 Å²	59.6	19%	0.189	31%	0.309	C	S	.	.			trans	-66.3	134.4	178.7	-178.7	0	0	0	0	111.9	K94 R125	S92-K94 PolarHBondContact O-N 2.82Å; S92-K94 PolarHBondContact OG-N 2.8Å; S92-R125 PolarHBondContact O-NH1 3.31Å
93	S	82	Confident	87.3	Confident	103 Å²	103	53.2 Å²	53.2	72%	0.72	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-10.2	171.9	53.4	0	0	0	0	113.7
94	K	81.9	Confident	88.2	Confident	192 Å²	192	51.8 Å²	51.8	84%	0.835	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-9.1	177.8	-63.6	-170.5	175.8	-172.6	0	114.8	S92	S92-K94 PolarHBondContact O-N 2.82Å; S92-K94 PolarHBondContact OG-N 2.8Å
95	L	85.1	Confident	88.5	Confident	39 Å²	39	52.1 Å²	52.1	20%	0.204	27%	0.272	C	S	.	.	S	Bend	trans	-96.2	149.2	-178.5	-55.8	-178.9	0	0	0	110.3	V100 R125 I149 L150	L95-V100 HydrophobicContact CB-CG2 3.88Å; L95-V100 HydrophobicContact CD1-CG2 4.2Å; L95-R125 PolarHBondContact O-NH1 2.94Å; L95-R125 PolarHBondContact O-NH2 3.48Å; L95-I149 HydrophobicContact CD1-CG2 3.57Å; L95-L150 HydrophobicContact CD1-CD1 4.22Å; L95-L150 HydrophobicContact CD2-CD1 3.69Å
96	S	87.7	Confident	88.7	Confident	52 Å²	52	57.4 Å²	57.4	36%	0.364	29%	0.288	S	S	.	.			trans	-65.9	174.7	172.4	83.7	0	0	0	0	111.6	D98 V99 V100 R125	S96-D98 VanDerWaalsContact CB-OD2 3.25Å; S96-D98 WeakPolarHBondContact CB-OD2 3.19Å; S96-D98 PolarHBondContact OG-N 3.14Å; S96-D98 PolarHBondContact OG-OD2 2.92Å; S96-V99 WeakPolarHBondContact OG-CG2 3.36Å; S96-V99 PolarHBondContact OG-N 3.32Å; S96-V99 VanDerWaalsContact OG-N 3.09Å; S96-V100 WeakPolarHBondContact O-CG2 3.47Å; S96-R125 PolarHBondContact O-NH2 3.42Å
97	A	89	Confident	88.6	Confident	39 Å²	39	60.1 Å²	60.1	32%	0.322	30%	0.301	S	S	.	.	H	α-helix	trans	-66.4	-47.9	170.4	0	0	0	0	0	110.2	V99 V100 E101	A97-V99 PolarHBondContact O-N 3.22Å; A97-V100 CarbonylContact O-C 3.57Å; A97-V100 WeakPolarHBondContact O-CA 3.42Å; A97-V100 WeakPolarHBondContact O-CB 3.2Å; A97-V100 PolarHBondContact O-N 3.15Å; A97-E101 WeakPolarHBondContact O-CG 3.42Å; A97-E101 PolarHBondContact O-N 3.37Å
98	D	89.6	Confident	88.6	Confident	93 Å²	93	60.1 Å²	60.1	50%	0.497	30%	0.301	S	S	.	.	H	α-helix	trans	-62.2	-41.2	-173.7	-17.4	-86.9	0	0	0	112	S96 V100 E101 Q102	S96-D98 VanDerWaalsContact CB-OD2 3.25Å; S96-D98 WeakPolarHBondContact CB-OD2 3.19Å; S96-D98 PolarHBondContact OG-N 3.14Å; S96-D98 PolarHBondContact OG-OD2 2.92Å; D98-V100 VanDerWaalsContact C-N 3.31Å; D98-V100 PolarHBondContact O-N 2.88Å; D98-E101 PolarHBondContact O-N 3.5Å; D98-Q102 WeakPolarHBondContact O-CB 3.49Å; D98-Q102 VanDerWaalsContact O-CG 3.27Å; D98-Q102 WeakPolarHBondContact O-CG 3.36Å; D98-Q102 PolarHBondContact O-N 3.39Å
99	V	90.1	Very high	88.6	Confident	49 Å²	49	61.4 Å²	61.4	30%	0.297	31%	0.314	S	S	.	.	H	α-helix	trans	-65.4	-34.9	175.2	170	0	0	0	0	111.8	S96 A97 C103 L150	S96-V99 WeakPolarHBondContact OG-CG2 3.36Å; S96-V99 PolarHBondContact OG-N 3.32Å; S96-V99 VanDerWaalsContact OG-N 3.09Å; A97-V99 PolarHBondContact O-N 3.22Å; V99-C103 WeakPolarHBondContact O-CB 3.45Å; V99-C103 PolarHBondContact O-N 2.68Å; V99-C103 VanDerWaalsContact O-N 3.1Å; V99-C103 PolarHBondContact O-SG 3.09Å; V99-L150 HydrophobicContact CG1-CD1 3.66Å
100	V	91	Very high	88.6	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-72.4	-45.3	175.1	171.2	0	0	0	0	110.1	I91 L95 S96 A97 D98 Q102 C103 V104 V118 A127 I149	I91-V100 HydrophobicContact CD1-CG1 3.79Å; I91-V100 HydrophobicContact CG2-CB 4.43Å; I91-V100 HydrophobicContact CG2-CG1 3.92Å; I91-V100 HydrophobicContact CG2-CG2 3.58Å; L95-V100 HydrophobicContact CB-CG2 3.88Å; L95-V100 HydrophobicContact CD1-CG2 4.2Å; S96-V100 WeakPolarHBondContact O-CG2 3.47Å; A97-V100 CarbonylContact O-C 3.57Å; A97-V100 WeakPolarHBondContact O-CA 3.42Å; A97-V100 WeakPolarHBondContact O-CB 3.2Å; A97-V100 PolarHBondContact O-N 3.15Å; D98-V100 VanDerWaalsContact C-N 3.31Å; D98-V100 PolarHBondContact O-N 2.88Å; V100-Q102 PolarHBondContact O-N 3.34Å; V100-C103 PolarHBondContact O-N 2.87Å; V100-V104 HydrophobicContact CG1-CG2 4.15Å; V100-V104 VanDerWaalsContact O-CB 3.31Å; V100-V104 WeakPolarHBondContact O-CB 3.22Å; V100-V104 WeakPolarHBondContact O-CG2 3.35Å; V100-V104 PolarHBondContact O-N 3.29Å; V100-V118 HydrophobicContact CB-CG2 4.16Å; V100-V118 HydrophobicContact CG1-CG1 4.2Å; V100-V118 HydrophobicContact CG1-CG2 3.68Å; V100-A127 HydrophobicContact CG1-CB 4.24Å; V100-I149 HydrophobicContact CG1-CD1 4.49Å
101	E	91.7	Very high	88.7	Confident	48 Å²	48	62.3 Å²	62.3	22%	0.224	32%	0.316	C	S	.	.	H	α-helix	trans	-58.9	-46.4	176.5	-69.9	174.3	-168.8	0	0	110.8	A97 D98 V104 Y105 I116 V118	A97-E101 WeakPolarHBondContact O-CG 3.42Å; A97-E101 PolarHBondContact O-N 3.37Å; D98-E101 PolarHBondContact O-N 3.5Å; E101-V104 PolarHBondContact O-N 3.11Å; E101-Y105 WeakPolarHBondContact O-CB 3.24Å; E101-Y105 PolarHBondContact O-N 2.9Å; E101-I116 HydrophobicContact CB-CD1 4.46Å; E101-I116 HydrophobicContact CG-CB 4.23Å; E101-I116 HydrophobicContact CG-CG2 3.9Å; E101-I116 WeakPolarHBondContact O-CD1 3.38Å; E101-V118 HydrophobicContact CG-CG2 3.56Å
102	Q	90.7	Very high	88.7	Confident	136 Å²	136	62.9 Å²	62.9	64%	0.636	33%	0.326	S	S	*	.	H	α-helix	trans	-64.1	-41.6	176.5	-73.4	174.5	-2.7	0	0	113.5	D98 V100 R106	D98-Q102 WeakPolarHBondContact O-CB 3.49Å; D98-Q102 VanDerWaalsContact O-CG 3.27Å; D98-Q102 WeakPolarHBondContact O-CG 3.36Å; D98-Q102 PolarHBondContact O-N 3.39Å; V100-Q102 PolarHBondContact O-N 3.34Å; Q102-R106 WeakPolarHBondContact O-CB 3.3Å; Q102-R106 PolarHBondContact O-N 3.36Å
103	C	90.2	Very high	88.9	Confident	6 Å²	6	67 Å²	67	4%	0.041	35%	0.345	C	S	.	.	H	α-helix	trans	-66.8	-45	175.8	-72.3	0	0	0	0	111.7	V99 V100 R106 E107 I149	V99-C103 WeakPolarHBondContact O-CB 3.45Å; V99-C103 PolarHBondContact O-N 2.68Å; V99-C103 VanDerWaalsContact O-N 3.1Å; V99-C103 PolarHBondContact O-SG 3.09Å; V100-C103 PolarHBondContact O-N 2.87Å; C103-R106 PolarHBondContact O-N 2.85Å; C103-E107 WeakPolarHBondContact O-CG 3.45Å; C103-E107 PolarHBondContact O-N 2.83Å; C103-E107 VanDerWaalsContact O-N 3.14Å; C103-I149 HydrophobicContact CB-CB 4.45Å; C103-I149 HydrophobicContact CB-CG1 4.31Å; C103-I149 HydrophobicContact CB-CG2 3.98Å
104	V	90.9	Very high	89.4	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-65	-40.7	179.2	171.8	0	0	0	0	110.7	V88 V100 E101 E107 L108 I116 A127 V129 I147 I149	V88-V104 HydrophobicContact CG2-CG1 4.33Å; V88-V104 HydrophobicContact CG2-CG2 4.49Å; V100-V104 HydrophobicContact CG1-CG2 4.15Å; V100-V104 VanDerWaalsContact O-CB 3.31Å; V100-V104 WeakPolarHBondContact O-CB 3.22Å; V100-V104 WeakPolarHBondContact O-CG2 3.35Å; V100-V104 PolarHBondContact O-N 3.29Å; E101-V104 PolarHBondContact O-N 3.11Å; V104-E107 PolarHBondContact O-N 3.02Å; V104-L108 HydrophobicContact CG1-CD1 4.11Å; V104-L108 WeakPolarHBondContact O-CB 3.18Å; V104-L108 PolarHBondContact O-N 2.83Å; V104-I116 HydrophobicContact CB-CD1 4Å; V104-I116 HydrophobicContact CG1-CD1 3.81Å; V104-I116 HydrophobicContact CG1-CG1 4.26Å; V104-I116 HydrophobicContact CG1-CG2 4.27Å; V104-A127 HydrophobicContact CG2-CB 4.26Å; V104-V129 HydrophobicContact CG1-CG2 3.44Å; V104-V129 VanDerWaalsContact CG1-CG2 3.44Å; V104-I147 HydrophobicContact CG2-CD1 4.08Å; V104-I149 HydrophobicContact CG2-CD1 3.96Å
105	Y	92.7	Very high	89.7	Confident	136 Å²	136	58 Å²	58	53%	0.533	31%	0.305	S	S	.	.	H	α-helix	trans	-61.6	-43.2	174.7	-170.3	-87	0	0	0	112.1	E101 E107 G109 L114 I116	E101-Y105 WeakPolarHBondContact O-CB 3.24Å; E101-Y105 PolarHBondContact O-N 2.9Å; Y105-E107 PolarHBondContact O-N 3.39Å; Y105-G109 VanDerWaalsContact O-CA 3.24Å; Y105-G109 WeakPolarHBondContact O-CA 3.48Å; Y105-G109 PolarHBondContact O-N 2.88Å; Y105-L114 HydrophobicContact CD2-CD1 3.77Å; Y105-L114 HydrophobicContact CE2-CD1 4.29Å; Y105-I116 HydrophobicContact CD2-CD1 4.4Å
106	R	90.5	Very high	90.1	Very high	141 Å²	141	57.6 Å²	57.6	53%	0.532	30%	0.302	S	S	.	.	H	α-helix	trans	-62.9	-41.9	178.2	-173.9	-171.8	65	-115.8	-8.4	112.7	Q102 C103	Q102-R106 WeakPolarHBondContact O-CB 3.3Å; Q102-R106 PolarHBondContact O-N 3.36Å; C103-R106 PolarHBondContact O-N 2.85Å
107	E	89.4	Confident	90.2	Very high	56 Å²	56	58.4 Å²	58.4	26%	0.262	30%	0.303	S	S	.	.	H	α-helix	trans	-81.3	-32.5	-177.2	-57.9	-52.3	139.1	0	0	113.3	C103 V104 Y105 K110 I147	C103-E107 WeakPolarHBondContact O-CG 3.45Å; C103-E107 PolarHBondContact O-N 2.83Å; C103-E107 VanDerWaalsContact O-N 3.14Å; V104-E107 PolarHBondContact O-N 3.02Å; Y105-E107 PolarHBondContact O-N 3.39Å; E107-K110 PolarHBondContact O-NZ 2.87Å; E107-I147 HydrophobicContact CB-CB 4Å; E107-I147 HydrophobicContact CB-CD1 4.43Å; E107-I147 HydrophobicContact CB-CG2 3.86Å; E107-I147 HydrophobicContact CG-CB 4.15Å
108	L	90.6	Very high	90.2	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-112.6	-16.3	-171.1	-63.5	-174.7	0	0	0	114.7	I86 V88 V104 K110 Y111 L114 V129 Y131 I147	I86-L108 HydrophobicContact CD1-CD1 4.07Å; V88-L108 HydrophobicContact CG2-CD1 4.15Å; V104-L108 HydrophobicContact CG1-CD1 4.11Å; V104-L108 WeakPolarHBondContact O-CB 3.18Å; V104-L108 PolarHBondContact O-N 2.83Å; L108-K110 PolarHBondContact O-N 3.02Å; L108-K110 VanDerWaalsContact O-N 3.11Å; L108-Y111 HydrophobicContact CD2-CD2 4.46Å; L108-Y111 HydrophobicContact CD2-CE2 4.03Å; L108-Y111 WeakPolarHBondContact O-CD2 3.33Å; L108-Y111 PolarHBondContact O-N 3.33Å; L108-L114 VanDerWaalsContact C-CD2 3.45Å; L108-L114 HydrophobicContact CB-CD2 4.04Å; L108-L114 WeakPolarHBondContact O-CD2 3.48Å; L108-V129 HydrophobicContact CD1-CG2 4.33Å; L108-Y131 WeakPolarHBondContact CB-OH 3.42Å; L108-Y131 PolarHBondContact O-OH 2.94Å; L108-I147 HydrophobicContact CD1-CD1 4.12Å; L108-I147 HydrophobicContact CD2-CG2 3.79Å; L108-I147 HydrophobicContact CG-CD1 4.25Å; L108-I147 HydrophobicContact CG-CG2 4.22Å
109	G	89.6	Confident	90.1	Very high	27 Å²	27	53.8 Å²	53.8	28%	0.278	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-7	177.3	0	0	0	0	0	114.3	Y105 Y111	Y105-G109 VanDerWaalsContact O-CA 3.24Å; Y105-G109 WeakPolarHBondContact O-CA 3.48Å; Y105-G109 PolarHBondContact O-N 2.88Å; G109-Y111 VanDerWaalsContact C-N 3.3Å; G109-Y111 PolarHBondContact O-N 2.88Å
110	K	90.7	Very high	89.9	Confident	122 Å²	122	57.1 Å²	57.1	53%	0.53	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-12.3	175.8	68.1	178.6	-169.3	-79.8	0	114.8	E107 L108 S144	E107-K110 PolarHBondContact O-NZ 2.87Å; L108-K110 PolarHBondContact O-N 3.02Å; L108-K110 VanDerWaalsContact O-N 3.11Å; K110-S144 PolarHBondContact NZ-OG 2.92Å; K110-S144 VanDerWaalsContact NZ-OG 3.16Å
111	Y	89.6	Confident	89.2	Confident	29 Å²	29	58.7 Å²	58.7	11%	0.114	30%	0.296	C	S	.	.	S	Bend	trans	-98.2	-20.1	-178.1	-56.2	-74.8	0	0	0	114	L108 G109 E139 A140 D143 S144	L108-Y111 HydrophobicContact CD2-CD2 4.46Å; L108-Y111 HydrophobicContact CD2-CE2 4.03Å; L108-Y111 WeakPolarHBondContact O-CD2 3.33Å; L108-Y111 PolarHBondContact O-N 3.33Å; G109-Y111 VanDerWaalsContact C-N 3.3Å; G109-Y111 PolarHBondContact O-N 2.88Å; Y111-E139 HydrophobicContact CD1-CB 4.38Å; Y111-E139 HydrophobicContact CD1-CG 3.92Å; Y111-E139 HydrophobicContact CE1-CG 4.2Å; Y111-A140 HydrophobicContact CD1-CB 4.49Å; Y111-A140 HydrophobicContact CD2-CB 3.35Å; Y111-A140 HydrophobicContact CE2-CB 3.8Å; Y111-A140 HydrophobicContact CG-CB 3.76Å; Y111-D143 HydrophobicContact CE1-CB 4.02Å; Y111-D143 WeakPolarHBondContact OH-CB 3.13Å; Y111-D143 PolarHBondContact OH-OD2 3.01Å; Y111-S144 PolarHBondContact OH-OG 3.4Å
112	G	87.4	Confident	88.5	Confident	25 Å²	25	60.4 Å²	60.4	26%	0.258	33%	0.327	S	S	.	.	S	Bend	trans	159.4	171.9	-177.3	0	0	0	0	0	113.2	L114	G112-L114 PolarHBondContact O-N 3.25Å
113	D	87.5	Confident	87.9	Confident	113 Å²	113	57.3 Å²	57.3	60%	0.604	33%	0.331	S	S	*	.			trans	-61.8	123.9	177.9	-88.1	-25.3	0	0	0	110.8	Y131 Q132	D113-Y131 CarbonylContact O-C 3.53Å; D113-Y131 WeakPolarHBondContact O-CA 3.25Å; D113-Q132 HydrophobicContact CB-CB 4.26Å; D113-Q132 PolarHBondContact O-N 2.53Å
114	L	91.7	Very high	87.6	Confident	28 Å²	28	62.4 Å²	62.4	15%	0.147	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	148.4	-173.1	61.5	78.6	0	0	0	113.8	Y105 L108 G112 I116 V129 T130 Y131	Y105-L114 HydrophobicContact CD2-CD1 3.77Å; Y105-L114 HydrophobicContact CE2-CD1 4.29Å; L108-L114 VanDerWaalsContact C-CD2 3.45Å; L108-L114 HydrophobicContact CB-CD2 4.04Å; L108-L114 WeakPolarHBondContact O-CD2 3.48Å; G112-L114 PolarHBondContact O-N 3.25Å; L114-I116 HydrophobicContact CD1-CD1 3.77Å; L114-I116 HydrophobicContact CD1-CG1 3.46Å; L114-I116 VanDerWaalsContact CD1-CG1 3.46Å; L114-V129 HydrophobicContact CB-CG1 3.97Å; L114-V129 HydrophobicContact CD1-CG1 4.2Å; L114-V129 HydrophobicContact CD2-CG1 3.83Å; L114-V129 HydrophobicContact CG-CG1 4.25Å; L114-T130 CarbonylContact C-O 3.53Å; L114-T130 WeakPolarHBondContact CA-O 3.44Å; L114-Y131 HydrophobicContact CB-CD1 3.88Å; L114-Y131 HydrophobicContact CB-CE1 3.93Å; L114-Y131 HydrophobicContact CB-CG 4.31Å; L114-Y131 HydrophobicContact CD2-CD1 4.41Å; L114-Y131 HydrophobicContact CD2-CE1 3.61Å; L114-Y131 HydrophobicContact CG-CE1 4.34Å
115	S	89	Confident	87.4	Confident	80 Å²	80	63.8 Å²	63.8	56%	0.559	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	122.2	172.1	-180	0	0	0	0	109.3	V129 T130	S115-V129 WeakPolarHBondContact O-CA 3.48Å; S115-T130 PolarHBondContact N-O 2.89Å; S115-T130 PolarHBondContact O-N 3.1Å
116	I	92.6	Very high	87.4	Confident	29 Å²	29	57.5 Å²	57.5	15%	0.149	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	137.3	178.1	-47.7	171.8	0	0	0	109.2	E101 V104 Y105 L114 V118 A127 L128 V129	E101-I116 HydrophobicContact CB-CD1 4.46Å; E101-I116 HydrophobicContact CG-CB 4.23Å; E101-I116 HydrophobicContact CG-CG2 3.9Å; E101-I116 WeakPolarHBondContact O-CD1 3.38Å; V104-I116 HydrophobicContact CB-CD1 4Å; V104-I116 HydrophobicContact CG1-CD1 3.81Å; V104-I116 HydrophobicContact CG1-CG1 4.26Å; V104-I116 HydrophobicContact CG1-CG2 4.27Å; Y105-I116 HydrophobicContact CD2-CD1 4.4Å; L114-I116 HydrophobicContact CD1-CD1 3.77Å; L114-I116 HydrophobicContact CD1-CG1 3.46Å; L114-I116 VanDerWaalsContact CD1-CG1 3.46Å; I116-V118 HydrophobicContact CG2-CG2 4.22Å; I116-A127 HydrophobicContact CG2-CB 4.11Å; I116-L128 CarbonylContact C-O 3.59Å; I116-L128 WeakPolarHBondContact CA-O 3.44Å; I116-V129 HydrophobicContact CG1-CG2 4.42Å; I116-V129 HydrophobicContact CG2-CG2 4.38Å
117	N	89.3	Confident	87.4	Confident	70 Å²	70	50.8 Å²	50.8	37%	0.374	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	112.5	169.7	-175	5.1	0	0	0	109.5	L128 V171	N117-L128 PolarHBondContact N-O 2.75Å; N117-L128 PolarHBondContact O-N 3.16Å; N117-V171 PolarHBondContact ND2-O 3.11Å
118	V	90.3	Very high	87.6	Confident	23 Å²	23	49.4 Å²	49.4	14%	0.139	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	108.8	-178.5	-175.8	0	0	0	0	110.5	V100 E101 I116 R125 V126 A127	V100-V118 HydrophobicContact CB-CG2 4.16Å; V100-V118 HydrophobicContact CG1-CG1 4.2Å; V100-V118 HydrophobicContact CG1-CG2 3.68Å; E101-V118 HydrophobicContact CG-CG2 3.56Å; I116-V118 HydrophobicContact CG2-CG2 4.22Å; V118-R125 HydrophobicContact CG1-CG 4.37Å; V118-V126 WeakPolarHBondContact CA-O 3.45Å; V118-A127 HydrophobicContact CG2-CB 3.97Å
119	G	87.2	Confident	87.7	Confident	11 Å²	11	49.4 Å²	49.4	11%	0.113	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	-165.4	-177.2	0	0	0	0	0	113.5	V126	G119-V126 PolarHBondContact N-O 3.28Å; G119-V126 PolarHBondContact O-N 3.21Å; G119-V126 VanDerWaalsContact O-O 3.13Å
120	H	85.7	Confident	87.8	Confident	119 Å²	119	50.7 Å²	50.7	55%	0.551	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.4	168	-65.9	84.2	0	0	0	109.3	E124	H120-E124 CarbonylContact C-O 3.45Å; H120-E124 WeakPolarHBondContact CA-O 3.39Å
121	L	77	Confident	87.9	Confident	33 Å²	33	45.1 Å²	45.1	17%	0.173	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	123.2	-177	-166.8	79.1	0	0	0	108.6	G123 E124 V126 I162	L121-G123 PolarHBondContact O-N 3.11Å; L121-G123 VanDerWaalsContact O-N 3.14Å; L121-E124 PolarHBondContact N-O 3.43Å; L121-E124 PolarHBondContact O-N 3.22Å; L121-E124 VanDerWaalsContact O-N 3.13Å; L121-V126 HydrophobicContact CB-CG1 4.33Å; L121-V126 HydrophobicContact CB-CG2 3.65Å; L121-I162 HydrophobicContact CD1-CG2 4.37Å; L121-I162 HydrophobicContact CD2-CD1 3.48Å; L121-I162 VanDerWaalsContact CD2-CD1 3.48Å; L121-I162 HydrophobicContact CD2-CG1 3.95Å; L121-I162 HydrophobicContact CD2-CG2 4.32Å
122	G	75.2	Confident	87.8	Confident	85 Å²	85	48.2 Å²	48.2	88%	0.876	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	13.9	-171.2	0	0	0	0	0	114.6	E124	G122-E124 VanDerWaalsContact C-N 3.33Å
123	G	78.4	Confident	87.8	Confident	70 Å²	70	52.8 Å²	52.8	72%	0.722	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.6	-15.5	-172.8	0	0	0	0	0	114.7	L121	L121-G123 PolarHBondContact O-N 3.11Å; L121-G123 VanDerWaalsContact O-N 3.14Å
124	E	84	Confident	87.9	Confident	113 Å²	113	48.1 Å²	48.1	53%	0.528	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	149.8	169.2	-65.7	-157.3	143.2	0	0	111.1	H120 L121 G122	H120-E124 CarbonylContact C-O 3.45Å; H120-E124 WeakPolarHBondContact CA-O 3.39Å; L121-E124 PolarHBondContact N-O 3.43Å; L121-E124 PolarHBondContact O-N 3.22Å; L121-E124 VanDerWaalsContact O-N 3.13Å; G122-E124 VanDerWaalsContact C-N 3.33Å
125	R	88	Confident	87.6	Confident	30 Å²	30	53.1 Å²	53.1	11%	0.113	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	127.5	172.7	-168.2	178	179.2	-146.8	2.6	110.1	S92 L95 S96 V118	S92-R125 PolarHBondContact O-NH1 3.31Å; L95-R125 PolarHBondContact O-NH1 2.94Å; L95-R125 PolarHBondContact O-NH2 3.48Å; S96-R125 PolarHBondContact O-NH2 3.42Å; V118-R125 HydrophobicContact CG1-CG 4.37Å
126	V	91.6	Very high	87.7	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.018	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	151.7	-175.1	-57.5	0	0	0	0	111.6	V88 R89 V118 G119 L121 L128	V88-V126 CarbonylContact O-C 3.45Å; V88-V126 WeakPolarHBondContact O-CA 3.27Å; V88-V126 WeakPolarHBondContact O-CB 3.33Å; R89-V126 HydrophobicContact CG-CG1 3.89Å; V118-V126 WeakPolarHBondContact CA-O 3.45Å; G119-V126 PolarHBondContact N-O 3.28Å; G119-V126 PolarHBondContact O-N 3.21Å; G119-V126 VanDerWaalsContact O-O 3.13Å; L121-V126 HydrophobicContact CB-CG1 4.33Å; L121-V126 HydrophobicContact CB-CG2 3.65Å; V126-L128 HydrophobicContact CG2-CD2 4.24Å
127	A	91.8	Very high	87.6	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	118.9	167.2	0	0	0	0	0	108.8	V88 I91 V100 V104 I116 V118	V88-A127 HydrophobicContact CB-CB 4.12Å; V88-A127 HydrophobicContact CG2-CB 4.48Å; V88-A127 PolarHBondContact N-O 3.16Å; V88-A127 PolarHBondContact O-N 2.98Å; I91-A127 HydrophobicContact CD1-CB 3.63Å; I91-A127 VanDerWaalsContact CD1-N 3.31Å; V100-A127 HydrophobicContact CG1-CB 4.24Å; V104-A127 HydrophobicContact CG2-CB 4.26Å; I116-A127 HydrophobicContact CG2-CB 4.11Å; V118-A127 HydrophobicContact CG2-CB 3.97Å
128	L	91.8	Very high	87.5	Confident	27 Å²	27	49 Å²	49	14%	0.141	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	123.1	171.5	-56.3	-175.8	0	0	0	107.7	T85 C87 I116 N117 V126 L159 V171	T85-L128 HydrophobicContact CG2-CB 4.41Å; C87-L128 HydrophobicContact CB-CD2 4.24Å; I116-L128 CarbonylContact C-O 3.59Å; I116-L128 WeakPolarHBondContact CA-O 3.44Å; N117-L128 PolarHBondContact N-O 2.75Å; N117-L128 PolarHBondContact O-N 3.16Å; V126-L128 HydrophobicContact CG2-CD2 4.24Å; L128-L159 HydrophobicContact CD2-CD1 3.55Å; L128-V171 HydrophobicContact CD1-CG1 3.94Å
129	V	92.7	Very high	87.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	114.1	-179.1	-177.9	0	0	0	0	107.3	T85 I86 V88 V104 L108 L114 S115 I116 Y131	T85-V129 WeakPolarHBondContact CA-O 3.2Å; I86-V129 HydrophobicContact CD1-CB 4.43Å; I86-V129 HydrophobicContact CG1-CB 3.81Å; I86-V129 HydrophobicContact CG1-CG1 4.37Å; I86-V129 PolarHBondContact N-O 2.73Å; I86-V129 PolarHBondContact O-N 2.69Å; V88-V129 HydrophobicContact CG2-CG2 4.11Å; V104-V129 HydrophobicContact CG1-CG2 3.44Å; V104-V129 VanDerWaalsContact CG1-CG2 3.44Å; L108-V129 HydrophobicContact CD1-CG2 4.33Å; L114-V129 HydrophobicContact CB-CG1 3.97Å; L114-V129 HydrophobicContact CD1-CG1 4.2Å; L114-V129 HydrophobicContact CD2-CG1 3.83Å; L114-V129 HydrophobicContact CG-CG1 4.25Å; S115-V129 WeakPolarHBondContact O-CA 3.48Å; I116-V129 HydrophobicContact CG1-CG2 4.42Å; I116-V129 HydrophobicContact CG2-CG2 4.38Å; V129-Y131 HydrophobicContact CG1-CD2 4.46Å; V129-Y131 HydrophobicContact CG1-CE2 3.96Å
130	T	91.7	Very high	87.5	Confident	55 Å²	55	53.1 Å²	53.1	34%	0.337	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	117	-179.2	-55	0	0	0	0	109.6	R84 T85 L114 S115	R84-T130 HydrophobicContact CB-CG2 4.32Å; R84-T130 WeakPolarHBondContact O-CA 3.31Å; T85-T130 VanDerWaalsContact CG2-OG1 3.27Å; T85-T130 WeakPolarHBondContact CG2-OG1 3.32Å; T85-T130 WeakPolarHBondContact OG1-CG2 3.49Å; T85-T130 PolarHBondContact OG1-OG1 2.83Å; L114-T130 CarbonylContact C-O 3.53Å; L114-T130 WeakPolarHBondContact CA-O 3.44Å; S115-T130 PolarHBondContact N-O 2.89Å; S115-T130 PolarHBondContact O-N 3.1Å
131	Y	93	Very high	87.6	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.016	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	159.5	175.9	-72.4	-89.5	0	0	0	112.3	R84 I86 L108 D113 L114 V129 Y133 D136 A137 A140	R84-Y131 PolarHBondContact O-N 3.12Å; I86-Y131 HydrophobicContact CD1-CE2 3.71Å; I86-Y131 HydrophobicContact CG1-CE2 4.27Å; L108-Y131 WeakPolarHBondContact CB-OH 3.42Å; L108-Y131 PolarHBondContact O-OH 2.94Å; D113-Y131 CarbonylContact O-C 3.53Å; D113-Y131 WeakPolarHBondContact O-CA 3.25Å; L114-Y131 HydrophobicContact CB-CD1 3.88Å; L114-Y131 HydrophobicContact CB-CE1 3.93Å; L114-Y131 HydrophobicContact CB-CG 4.31Å; L114-Y131 HydrophobicContact CD2-CD1 4.41Å; L114-Y131 HydrophobicContact CD2-CE1 3.61Å; L114-Y131 HydrophobicContact CG-CE1 4.34Å; V129-Y131 HydrophobicContact CG1-CD2 4.46Å; V129-Y131 HydrophobicContact CG1-CE2 3.96Å; Y131-Y133 VanDerWaalsContact CB-O 3.3Å; Y131-Y133 WeakPolarHBondContact CB-O 3.41Å; Y131-D136 HydrophobicContact CD1-CB 3.45Å; Y131-D136 VanDerWaalsContact CD1-CB 3.45Å; Y131-D136 HydrophobicContact CE1-CB 4.04Å; Y131-D136 HydrophobicContact CG-CB 3.77Å; Y131-A137 HydrophobicContact CD2-CB 3.66Å; Y131-A137 HydrophobicContact CE2-CB 4.42Å; Y131-A137 HydrophobicContact CG-CB 4.25Å; Y131-A140 HydrophobicContact CE2-CB 3.89Å; Y131-A140 VanDerWaalsContact OH-CB 3.22Å; Y131-A140 WeakPolarHBondContact OH-CB 3.41Å
132	Q	88	Confident	88	Confident	94 Å²	94	52.4 Å²	52.4	44%	0.439	30%	0.299	S	S	.	.	S	Bend	trans	-63.3	-44.7	170.6	-171	174.1	59.5	0	0	111.1	R84 D113	R84-Q132 WeakPolarHBondContact CD-O 3.4Å; R84-Q132 PolarHBondContact NE-O 2.9Å; R84-Q132 PolarHBondContact NH1-O 3.45Å; D113-Q132 HydrophobicContact CB-CB 4.26Å; D113-Q132 PolarHBondContact O-N 2.53Å
133	Y	87.5	Confident	88.6	Confident	121 Å²	121	53 Å²	53	48%	0.475	28%	0.282	S	S	.	.	S	Bend	trans	-109.6	163.4	177.7	-50.6	-83.8	0	0	0	112.5	Y131 D136	Y131-Y133 VanDerWaalsContact CB-O 3.3Å; Y131-Y133 WeakPolarHBondContact CB-O 3.41Å; Y133-D136 WeakPolarHBondContact CB-OD1 3.34Å; Y133-D136 WeakPolarHBondContact CD2-OD2 3.47Å; Y133-D136 PolarHBondContact N-OD2 3.1Å
134	S	88.8	Confident	88.9	Confident	16 Å²	16	50.2 Å²	50.2	11%	0.112	25%	0.252	C	S	.	.	H	α-helix	trans	-82.1	-25.3	177.4	35.9	0	0	0	0	113.1	Q138	S134-Q138 WeakPolarHBondContact O-CG 3.43Å; S134-Q138 PolarHBondContact O-N 3.45Å
135	E	86.9	Confident	89	Confident	132 Å²	132	47.3 Å²	47.3	62%	0.617	24%	0.243	S	C	*	.	H	α-helix	trans	-66.3	-51.6	176.3	-75.2	105.2	-107.2	0	0	110.9	A137 Q138 E139	E135-A137 PolarHBondContact O-N 3.46Å; E135-A137 VanDerWaalsContact O-N 3.15Å; E135-Q138 WeakPolarHBondContact O-CA 3.44Å; E135-Q138 PolarHBondContact O-N 3.5Å; E135-E139 PolarHBondContact O-N 3.41Å
136	D	90.9	Very high	89	Confident	23 Å²	23	47.9 Å²	47.9	12%	0.123	25%	0.247	C	C	.	.	H	α-helix	trans	-49.1	-43.9	175.1	-30.8	-17.6	0	0	0	111.7	Y131 Y133 Q138 E139 A140	Y131-D136 HydrophobicContact CD1-CB 3.45Å; Y131-D136 VanDerWaalsContact CD1-CB 3.45Å; Y131-D136 HydrophobicContact CE1-CB 4.04Å; Y131-D136 HydrophobicContact CG-CB 3.77Å; Y133-D136 WeakPolarHBondContact CB-OD1 3.34Å; Y133-D136 WeakPolarHBondContact CD2-OD2 3.47Å; Y133-D136 PolarHBondContact N-OD2 3.1Å; D136-Q138 PolarHBondContact O-N 3.35Å; D136-E139 PolarHBondContact O-N 3.04Å; D136-A140 WeakPolarHBondContact O-CB 3.44Å; D136-A140 PolarHBondContact O-N 3.02Å
137	A	89.8	Confident	88.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-68.8	-31.3	-179.6	0	0	0	0	0	113.4	S83 I86 Y131 E135 L141	S83-A137 WeakPolarHBondContact O-CB 3.47Å; I86-A137 HydrophobicContact CG2-CB 4.46Å; Y131-A137 HydrophobicContact CD2-CB 3.66Å; Y131-A137 HydrophobicContact CE2-CB 4.42Å; Y131-A137 HydrophobicContact CG-CB 4.25Å; E135-A137 PolarHBondContact O-N 3.46Å; E135-A137 VanDerWaalsContact O-N 3.15Å; A137-L141 WeakPolarHBondContact O-CB 3.21Å; A137-L141 PolarHBondContact O-N 2.88Å
138	Q	87.9	Confident	88.6	Confident	70 Å²	70	54 Å²	54	33%	0.327	27%	0.271	S	S	.	.	H	α-helix	trans	-77.8	-40.9	172.7	-67.5	-56.5	-75.2	0	0	111.2	S134 E135 D136 L141 C142	S134-Q138 WeakPolarHBondContact O-CG 3.43Å; S134-Q138 PolarHBondContact O-N 3.45Å; E135-Q138 WeakPolarHBondContact O-CA 3.44Å; E135-Q138 PolarHBondContact O-N 3.5Å; D136-Q138 PolarHBondContact O-N 3.35Å; Q138-L141 PolarHBondContact O-N 3.11Å; Q138-C142 WeakPolarHBondContact O-CB 3.47Å; Q138-C142 PolarHBondContact O-N 2.73Å; Q138-C142 PolarHBondContact O-SG 3.36Å
139	E	87.6	Confident	88.2	Confident	120 Å²	120	53 Å²	53	56%	0.561	27%	0.266	S	S	*	.	H	α-helix	trans	-64	-47.6	178.9	-170.9	167.1	-161.3	0	0	111.1	Y111 E135 D136 L141 C142 D143	Y111-E139 HydrophobicContact CD1-CB 4.38Å; Y111-E139 HydrophobicContact CD1-CG 3.92Å; Y111-E139 HydrophobicContact CE1-CG 4.2Å; E135-E139 PolarHBondContact O-N 3.41Å; D136-E139 PolarHBondContact O-N 3.04Å; E139-L141 VanDerWaalsContact C-N 3.28Å; E139-L141 PolarHBondContact O-N 3.12Å; E139-C142 PolarHBondContact O-N 2.88Å; E139-C142 VanDerWaalsContact O-N 3.1Å; E139-D143 WeakPolarHBondContact O-CB 3.47Å; E139-D143 PolarHBondContact O-N 2.86Å
140	A	89.6	Confident	87.7	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-55.7	-40.4	174.2	0	0	0	0	0	113.3	I86 Y111 Y131 D136 S144	I86-A140 HydrophobicContact CD1-CB 4.11Å; Y111-A140 HydrophobicContact CD1-CB 4.49Å; Y111-A140 HydrophobicContact CD2-CB 3.35Å; Y111-A140 HydrophobicContact CE2-CB 3.8Å; Y111-A140 HydrophobicContact CG-CB 3.76Å; Y131-A140 HydrophobicContact CE2-CB 3.89Å; Y131-A140 VanDerWaalsContact OH-CB 3.22Å; Y131-A140 WeakPolarHBondContact OH-CB 3.41Å; D136-A140 WeakPolarHBondContact O-CB 3.44Å; D136-A140 PolarHBondContact O-N 3.02Å; A140-S144 CarbonylContact O-C 3.57Å; A140-S144 WeakPolarHBondContact O-CA 3.35Å; A140-S144 WeakPolarHBondContact O-CB 3.4Å; A140-S144 PolarHBondContact O-N 2.98Å
141	L	87.7	Confident	87	Confident	37 Å²	37	63 Å²	63	19%	0.194	32%	0.317	C	S	.	.	H	α-helix	trans	-72.2	-34.5	178	-177.3	64.8	0	0	0	112.7	I86 A137 Q138 E139 V156	I86-L141 HydrophobicContact CG2-CB 4.36Å; A137-L141 WeakPolarHBondContact O-CB 3.21Å; A137-L141 PolarHBondContact O-N 2.88Å; Q138-L141 PolarHBondContact O-N 3.11Å; E139-L141 VanDerWaalsContact C-N 3.28Å; E139-L141 PolarHBondContact O-N 3.12Å; L141-V156 HydrophobicContact CD1-CB 4.5Å; L141-V156 HydrophobicContact CD1-CG1 3.98Å
142	C	85.9	Confident	86.5	Confident	101 Å²	101	68.1 Å²	68.1	68%	0.682	34%	0.336	S	S	*	.	H	α-helix	trans	-77	-40.1	-179.9	-68.2	0	0	0	0	112.6	Q138 E139	Q138-C142 WeakPolarHBondContact O-CB 3.47Å; Q138-C142 PolarHBondContact O-N 2.73Å; Q138-C142 PolarHBondContact O-SG 3.36Å; E139-C142 PolarHBondContact O-N 2.88Å; E139-C142 VanDerWaalsContact O-N 3.1Å
143	D	86.8	Confident	86.5	Confident	96 Å²	96	66.1 Å²	66.1	51%	0.513	33%	0.331	S	S	.	.	H	α-helix	trans	-91.2	-37.5	-174.4	-174.2	59.5	0	0	0	112.7	Y111 E139 P145	Y111-D143 HydrophobicContact CE1-CB 4.02Å; Y111-D143 WeakPolarHBondContact OH-CB 3.13Å; Y111-D143 PolarHBondContact OH-OD2 3.01Å; E139-D143 WeakPolarHBondContact O-CB 3.47Å; E139-D143 PolarHBondContact O-N 2.86Å; D143-P145 WeakPolarHBondContact O-CD 3.35Å
144	S	84.8	Confident	86.4	Confident	13 Å²	13	60.4 Å²	60.4	9%	0.091	31%	0.309	C	S	.	.			trans	-115.6	59.1	177.8	-68.5	0	0	0	0	114.2	K110 Y111 A140 I146 V156	K110-S144 PolarHBondContact NZ-OG 2.92Å; K110-S144 VanDerWaalsContact NZ-OG 3.16Å; Y111-S144 PolarHBondContact OH-OG 3.4Å; A140-S144 CarbonylContact O-C 3.57Å; A140-S144 WeakPolarHBondContact O-CA 3.35Å; A140-S144 WeakPolarHBondContact O-CB 3.4Å; A140-S144 PolarHBondContact O-N 2.98Å; S144-I146 PolarHBondContact O-N 3.32Å; S144-V156 WeakPolarHBondContact O-CB 3.45Å; S144-V156 WeakPolarHBondContact O-CG2 3.47Å
145	P	86	Confident	86.3	Confident	52 Å²	52	63.2 Å²	63.2	34%	0.338	32%	0.323	S	S	.	.	S	Bend	trans	-67	-15.6	177.4	29.1	-36.3	0	0	0	114	D143 V156	D143-P145 WeakPolarHBondContact O-CD 3.35Å; P145-V156 PolarHBondContact O-N 2.8Å
146	I	87.4	Confident	86.5	Confident	41 Å²	41	57.3 Å²	57.3	21%	0.21	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	124.7	171.4	-54.5	176.2	0	0	0	107.8	S144 P153 A154 R397	S144-I146 PolarHBondContact O-N 3.32Å; I146-P153 HydrophobicContact CG2-CB 3.64Å; I146-A154 WeakPolarHBondContact CA-O 3.42Å; I146-R397 PolarHBondContact O-NH2 2.73Å
147	I	88.1	Confident	86.2	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.021	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	161.2	174.5	63	171.6	0	0	0	110.6	V88 V104 E107 L108 P153 A154 V156	V88-I147 HydrophobicContact CG1-CD1 3.93Å; V88-I147 HydrophobicContact CG1-CG1 4.27Å; V88-I147 HydrophobicContact CG2-CD1 4.15Å; V104-I147 HydrophobicContact CG2-CD1 4.08Å; E107-I147 HydrophobicContact CB-CB 4Å; E107-I147 HydrophobicContact CB-CD1 4.43Å; E107-I147 HydrophobicContact CB-CG2 3.86Å; E107-I147 HydrophobicContact CG-CB 4.15Å; L108-I147 HydrophobicContact CD1-CD1 4.12Å; L108-I147 HydrophobicContact CD2-CG2 3.79Å; L108-I147 HydrophobicContact CG-CD1 4.25Å; L108-I147 HydrophobicContact CG-CG2 4.22Å; I147-P153 WeakPolarHBondContact O-CA 3.17Å; I147-A154 HydrophobicContact CG1-CB 4.24Å; I147-A154 PolarHBondContact N-O 3.32Å; I147-A154 PolarHBondContact O-N 2.9Å; I147-V156 HydrophobicContact CD1-CG2 4.42Å; I147-V156 HydrophobicContact CG1-CG2 4.11Å; I147-V156 HydrophobicContact CG2-CG2 4.05Å
148	Y	86.9	Confident	85.7	Confident	128 Å²	128	58.5 Å²	58.5	50%	0.502	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	122.3	-178.8	-72.8	-98	0	0	0	111.9	P153	Y148-P153 HydrophobicContact CD1-CB 4.36Å; Y148-P153 HydrophobicContact CE1-CB 4Å; Y148-P153 HydrophobicContact CE1-CG 4.5Å
149	I	85.2	Confident	84.8	Confident	6 Å²	6	57.1 Å²	57.1	3%	0.031	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	96.2	176.9	-54.4	177.9	0	0	0	107.4	V88 I91 L95 V100 C103 V104 R152 A154	V88-I149 HydrophobicContact CG1-CD1 4.22Å; I91-I149 HydrophobicContact CD1-CD1 4.23Å; I91-I149 HydrophobicContact CG1-CD1 4.13Å; I91-I149 HydrophobicContact CG2-CD1 4.46Å; L95-I149 HydrophobicContact CD1-CG2 3.57Å; V100-I149 HydrophobicContact CG1-CD1 4.49Å; C103-I149 HydrophobicContact CB-CB 4.45Å; C103-I149 HydrophobicContact CB-CG1 4.31Å; C103-I149 HydrophobicContact CB-CG2 3.98Å; V104-I149 HydrophobicContact CG2-CD1 3.96Å; I149-R152 PolarHBondContact N-O 2.87Å; I149-R152 PolarHBondContact O-N 2.85Å; I149-A154 HydrophobicContact CD1-CB 3.74Å; I149-A154 HydrophobicContact CG1-CB 4.09Å
150	L	80.7	Confident	83.4	Confident	106 Å²	106	54.8 Å²	54.8	56%	0.555	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	68.8	-176.5	-62.2	171.7	0	0	0	111.6	L95 V99 R152	L95-L150 HydrophobicContact CD1-CD1 4.22Å; L95-L150 HydrophobicContact CD2-CD1 3.69Å; V99-L150 HydrophobicContact CG1-CD1 3.66Å; L150-R152 PolarHBondContact O-N 3Å
151	D	76.8	Confident	81.4	Confident	158 Å²	158	61 Å²	61	85%	0.845	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	0.3	-179.4	-51.4	-34.7	0	0	0	116.6
152	R	83.9	Confident	79.6	Confident	113 Å²	113	60.4 Å²	60.4	43%	0.426	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	124	173.5	-172.2	175	176.6	131.2	-1.7	111.2	N90 I149 L150 A154	N90-R152 PolarHBondContact O-NE 3.48Å; N90-R152 VanDerWaalsContact O-NE 3.12Å; N90-R152 PolarHBondContact OD1-NE 2.92Å; N90-R152 PolarHBondContact OD1-NH2 2.9Å; I149-R152 PolarHBondContact N-O 2.87Å; I149-R152 PolarHBondContact O-N 2.85Å; L150-R152 PolarHBondContact O-N 3Å; R152-A154 PolarHBondContact O-N 3.18Å
153	P	87	Confident	77.7	Confident	51 Å²	51	59.9 Å²	59.9	33%	0.331	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	129.5	174.4	27.8	-33.3	0	0	0	111.1	N90 I146 I147 Y148	N90-P153 PolarHBondContact ND2-O 2.79Å; I146-P153 HydrophobicContact CG2-CB 3.64Å; I147-P153 WeakPolarHBondContact O-CA 3.17Å; Y148-P153 HydrophobicContact CD1-CB 4.36Å; Y148-P153 HydrophobicContact CE1-CB 4Å; Y148-P153 HydrophobicContact CE1-CG 4.5Å
154	A	86.2	Confident	75.5	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.008	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131.1	177.5	0	0	0	0	0	109.5	V88 R89 I146 I147 I149 R152	V88-A154 HydrophobicContact CG1-CB 3.69Å; R89-A154 CarbonylContact O-C 3.59Å; R89-A154 VanDerWaalsContact O-CA 3.28Å; R89-A154 WeakPolarHBondContact O-CA 3.27Å; R89-A154 WeakPolarHBondContact O-CB 3.36Å; I146-A154 WeakPolarHBondContact CA-O 3.42Å; I147-A154 HydrophobicContact CG1-CB 4.24Å; I147-A154 PolarHBondContact N-O 3.32Å; I147-A154 PolarHBondContact O-N 2.9Å; I149-A154 HydrophobicContact CD1-CB 3.74Å; I149-A154 HydrophobicContact CG1-CB 4.09Å; R152-A154 PolarHBondContact O-N 3.18Å
155	N	87	Confident	73.3	Confident	76 Å²	76	69.6 Å²	69.6	41%	0.406	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	130.9	-170.3	-67.2	2.1	0	0	0	110.5	V88 R89	V88-N155 CarbonylContact C-O 3.53Å; V88-N155 WeakPolarHBondContact CA-O 3.49Å; R89-N155 PolarHBondContact N-O 2.81Å; R89-N155 PolarHBondContact O-N 3.41Å; R89-N155 VanDerWaalsContact O-N 3.08Å
156	V	89.4	Confident	70.9	Confident	8 Å²	8	70.9 Å²	70.9	5%	0.048	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	132.1	178.4	-172.8	0	0	0	0	109.3	I86 V88 L141 S144 P145 I147	I86-V156 HydrophobicContact CB-CG1 4.26Å; I86-V156 HydrophobicContact CD1-CG1 3.69Å; I86-V156 HydrophobicContact CG1-CG1 4.26Å; V88-V156 HydrophobicContact CG2-CG2 4.36Å; L141-V156 HydrophobicContact CD1-CB 4.5Å; L141-V156 HydrophobicContact CD1-CG1 3.98Å; S144-V156 WeakPolarHBondContact O-CB 3.45Å; S144-V156 WeakPolarHBondContact O-CG2 3.47Å; P145-V156 PolarHBondContact O-N 2.8Å; I147-V156 HydrophobicContact CD1-CG2 4.42Å; I147-V156 HydrophobicContact CG1-CG2 4.11Å; I147-V156 HydrophobicContact CG2-CG2 4.05Å
157	T	84.6	Confident	69.1	Low	27 Å²	27	72.6 Å²	72.6	17%	0.166	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	148.9	-173	47.2	0	0	0	0	110.6	I86 C87 R89	I86-T157 CarbonylContact C-O 3.5Å; I86-T157 WeakPolarHBondContact CA-O 3.21Å; C87-T157 PolarHBondContact N-O 2.83Å; C87-T157 PolarHBondContact O-N 3.08Å; C87-T157 PolarHBondContact O-OG1 2.89Å; R89-T157 PolarHBondContact NH1-OG1 3.04Å
158	S	80.7	Confident	67.1	Low	21 Å²	21	76.1 Å²	76.1	15%	0.147	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	150.2	173.4	-169.9	0	0	0	0	111.3	I160	S158-I160 VanDerWaalsContact C-N 3.27Å; S158-I160 PolarHBondContact O-N 2.86Å; S158-I160 WeakPolarHBondContact OG-CD1 2.96Å; S158-I160 WeakPolarHBondContact OG-CG1 3.27Å
159	L	68.3	Low	64.9	Low	41 Å²	41	80.6 Å²	80.6	22%	0.215	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-79.6	-2.3	179.8	-152	77.4	0	0	0	114.5	T85 C87 L128 D161 I162	T85-L159 HydrophobicContact CG2-CB 4.36Å; T85-L159 HydrophobicContact CG2-CD2 3.81Å; T85-L159 HydrophobicContact CG2-CG 4.48Å; T85-L159 WeakPolarHBondContact O-CB 3.45Å; T85-L159 PolarHBondContact O-N 3.36Å; C87-L159 HydrophobicContact CB-CD1 3.71Å; L128-L159 HydrophobicContact CD2-CD1 3.55Å; L159-D161 PolarHBondContact O-N 3.45Å; L159-D161 VanDerWaalsContact O-N 3.12Å; L159-I162 HydrophobicContact CD1-CD1 3.43Å; L159-I162 VanDerWaalsContact CD1-CD1 3.43Å; L159-I162 HydrophobicContact CG-CB 4.48Å; L159-I162 HydrophobicContact CG-CD1 3.84Å; L159-I162 PolarHBondContact O-N 3.08Å; L159-I162 VanDerWaalsContact O-N 3.11Å
160	I	59.5	Low	63.1	Low	70 Å²	70	87 Å²	87	36%	0.359	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-55.3	-35	-171.8	-66	166.7	0	0	0	112.9	S83 S158 I162	S83-I160 WeakPolarHBondContact OG-CG1 3.24Å; S158-I160 VanDerWaalsContact C-N 3.27Å; S158-I160 PolarHBondContact O-N 2.86Å; S158-I160 WeakPolarHBondContact OG-CD1 2.96Å; S158-I160 WeakPolarHBondContact OG-CG1 3.27Å; I160-I162 PolarHBondContact O-N 2.95Å; I160-I162 VanDerWaalsContact O-N 3.11Å
161	D	47.6	Very low	61.6	Low	132 Å²	132	83.1 Å²	83.1	71%	0.706	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-68.6	-8.1	-177.6	-64	-49.2	0	0	0	114.8	L159	L159-D161 PolarHBondContact O-N 3.45Å; L159-D161 VanDerWaalsContact O-N 3.12Å
162	I	49.9	Very low	60	Low	23 Å²	23	82.1 Å²	82.1	12%	0.118	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-101.7	-9.1	-171.4	-65.3	144.2	0	0	0	112.9	L121 L159 I160 N164 E165 T168	L121-I162 HydrophobicContact CD1-CG2 4.37Å; L121-I162 HydrophobicContact CD2-CD1 3.48Å; L121-I162 VanDerWaalsContact CD2-CD1 3.48Å; L121-I162 HydrophobicContact CD2-CG1 3.95Å; L121-I162 HydrophobicContact CD2-CG2 4.32Å; L159-I162 HydrophobicContact CD1-CD1 3.43Å; L159-I162 VanDerWaalsContact CD1-CD1 3.43Å; L159-I162 HydrophobicContact CG-CB 4.48Å; L159-I162 HydrophobicContact CG-CD1 3.84Å; L159-I162 PolarHBondContact O-N 3.08Å; L159-I162 VanDerWaalsContact O-N 3.11Å; I160-I162 PolarHBondContact O-N 2.95Å; I160-I162 VanDerWaalsContact O-N 3.11Å; I162-N164 PolarHBondContact O-N 3.45Å; I162-E165 PolarHBondContact O-N 3.28Å; I162-T168 HydrophobicContact CG2-CG2 4.46Å
163	A	43.9	Very low	57.6	Low	90 Å²	90	80.7 Å²	80.7	74%	0.744	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-15	178.2	0	0	0	0	0	114.4
164	N	42.2	Very low	55	Low	157 Å²	157	83.8 Å²	83.8	84%	0.84	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-3.6	-178.9	-70.8	-36.4	0	0	0	114.8	I162	I162-N164 PolarHBondContact O-N 3.45Å
165	E	37.8	Very low	52.8	Low	156 Å²	156	92.6 Å²	92.6	73%	0.729	51%	0.514	S	S	*	.	S	Bend	trans	-117.5	123.6	169.8	-77.3	-162.9	123.3	0	0	111.1	I162 D167	I162-E165 PolarHBondContact O-N 3.28Å; E165-D167 PolarHBondContact O-N 2.81Å
166	G	35.4	Very low	50.2	Low	79 Å²	79	98.6 Å²	98.6	81%	0.814	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	22.7	-167	0	0	0	0	0	117.3
167	D	49.6	Very low	47.4	Very low	78 Å²	78	110 Å²	110	42%	0.417	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.1	0.6	-168.7	-133.6	25	0	0	0	115.2	E165 R169 K170	E165-D167 PolarHBondContact O-N 2.81Å; D167-R169 PolarHBondContact O-N 2.86Å; D167-K170 PolarHBondContact O-N 3.06Å; D167-K170 WeakPolarHBondContact OD1-CD 3.35Å; D167-K170 WeakPolarHBondContact OD1-CE 3.2Å; D167-K170 IonicContact OD1-NZ 2.66Å; D167-K170 PolarHBondContact OD1-NZ 3.27Å; D167-K170 IonicContact OD2-NZ 2.81Å; D167-K170 PolarHBondContact OD2-NZ 3.31Å
168	T	45.7	Very low	44.8	Very low	78 Å²	78	117.7 Å²	117.7	48%	0.479	61%	0.613	S	S	.	*	G	3₁₀ helix	trans	-53.8	-26.9	-179.8	54.6	0	0	0	0	114.1	I162 K170 V171	I162-T168 HydrophobicContact CG2-CG2 4.46Å; T168-K170 VanDerWaalsContact C-N 3.3Å; T168-K170 PolarHBondContact O-N 2.86Å; T168-V171 PolarHBondContact O-N 2.66Å
169	R	42	Very low	42.5	Very low	221 Å²	221	126.5 Å²	126.5	83%	0.834	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-66.6	-23.2	178	-70.5	-175.4	176.8	176.4	-0.3	114.2	D167 V171	D167-R169 PolarHBondContact O-N 2.86Å; R169-V171 VanDerWaalsContact C-N 3.34Å; R169-V171 PolarHBondContact O-N 3.25Å
170	K	47.5	Very low	40.7	Very low	140 Å²	140	128.2 Å²	128.2	61%	0.609	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-74.8	-21.2	-179.4	-68.4	-177.3	-170.8	146.5	0	113.7	D167 T168 I172	D167-K170 PolarHBondContact O-N 3.06Å; D167-K170 WeakPolarHBondContact OD1-CD 3.35Å; D167-K170 WeakPolarHBondContact OD1-CE 3.2Å; D167-K170 IonicContact OD1-NZ 2.66Å; D167-K170 PolarHBondContact OD1-NZ 3.27Å; D167-K170 IonicContact OD2-NZ 2.81Å; D167-K170 PolarHBondContact OD2-NZ 3.31Å; T168-K170 VanDerWaalsContact C-N 3.3Å; T168-K170 PolarHBondContact O-N 2.86Å; K170-I172 VanDerWaalsContact C-N 3.28Å; K170-I172 PolarHBondContact O-N 3.13Å
171	V	48.3	Very low	39.4	Very low	25 Å²	25	132.2 Å²	132.2	15%	0.152	70%	0.698	C	S	.	*	G	3₁₀ helix	trans	-80.9	-7.7	-175.6	-168	0	0	0	0	112.8	N117 L128 T168 R169	N117-V171 PolarHBondContact ND2-O 3.11Å; L128-V171 HydrophobicContact CD1-CG1 3.94Å; T168-V171 PolarHBondContact O-N 2.66Å; R169-V171 VanDerWaalsContact C-N 3.34Å; R169-V171 PolarHBondContact O-N 3.25Å
172	I	42.7	Very low	38.6	Very low	137 Å²	137	133.8 Å²	133.8	70%	0.703	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-102.3	-13.2	-173	-59	175	0	0	0	112.3	K170 S174	K170-I172 VanDerWaalsContact C-N 3.28Å; K170-I172 PolarHBondContact O-N 3.13Å; I172-S174 PolarHBondContact O-N 2.82Å
173	A	33.5	Very low	37.9	Very low	84 Å²	84	137.2 Å²	137.2	69%	0.694	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-7.7	-162.2	0	0	0	0	0	116.9
174	S	33.7	Very low	37.3	Very low	116 Å²	116	141.3 Å²	141.3	81%	0.811	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	-2.9	-156.4	-50.5	0	0	0	0	117.6	I172	I172-S174 PolarHBondContact O-N 2.82Å
175	K	39.4	Very low	37.1	Very low	186 Å²	186	140.5 Å²	140.5	81%	0.809	73%	0.733	S	S	*	*	S	Bend	trans	-130.9	19.7	-170.8	-148.8	173	-175.1	174.3	0	115.3
176	K	33.3	Very low	37.3	Very low	201 Å²	201	139.2 Å²	139.2	87%	0.874	73%	0.73	S	S	*	*			trans	-143.5	75.5	179.6	-167.7	174.6	-177.6	173.9	0	113.5
177	R	30.4	Very low	37.3	Very low	247 Å²	247	142.1 Å²	142.1	93%	0.932	73%	0.726	S	S	*	*			trans	-167.3	65.4	163.5	-119.2	173.9	-174	-170.6	0.3	114.8
178	Q	30.2	Very low	36.7	Very low	189 Å²	189	143 Å²	143	88%	0.883	73%	0.731	S	S	*	*	S	Bend	trans	-160.8	152.6	155.2	-109.9	160.6	-4.3	0	0	107.8
179	E	30.9	Very low	36.4	Very low	206 Å²	206	147.2 Å²	147.2	96%	0.963	74%	0.738	S	S	*	*			trans	77.6	137.3	-169.2	-54.7	171.9	-173.1	0	0	115.8
180	G	31.9	Very low	36.3	Very low	77 Å²	77	145.2 Å²	145.2	79%	0.794	73%	0.731	S	S	*	*			trans	107.6	60.4	163.3	0	0	0	0	0	120.7
181	M	32	Very low	35.9	Very low	155 Å²	155	145.5 Å²	145.5	76%	0.764	73%	0.734	S	S	*	*				47.3	115.2	124.8	-150.6	161.1	174.1	0	0	122.8
182	E	30	Very low	35.5	Very low	164 Å²	164	150.6 Å²	150.6	77%	0.766	76%	0.76	S	S	*	*			trans	74.8	148.8	139.2	-69.3	168.7	-163.5	0	0	124.8
183	A	35.1	Very low	35.2	Very low	96 Å²	96	150.9 Å²	150.9	79%	0.793	76%	0.76	S	S	*	*			trans	58	127.2	176.6	0	0	0	0	0	118.4
184	E	32	Very low	35.4	Very low	176 Å²	176	153.8 Å²	153.8	82%	0.822	76%	0.759	S	S	*	*			cis	99.3	148.3	33.3	-74.6	-64.4	171.3	0	0	115.5
185	D	37.9	Very low	35.5	Very low	139 Å²	139	154 Å²	154	74%	0.743	75%	0.75	S	S	*	*			trans	65.1	154.7	179	-72.4	-23.4	0	0	0	119.9
186	I	41	Very low	35.7	Very low	130 Å²	130	152.2 Å²	152.2	67%	0.667	75%	0.749	S	S	*	*			cis	-161.7	134.7	-47.7	-124.9	176.5	0	0	0	110.7
187	N	35.8	Very low	36	Very low	140 Å²	140	148.3 Å²	148.3	75%	0.749	74%	0.743	S	S	*	*			trans	56.8	173.4	164.3	-61.6	-35.5	0	0	0	118.5
188	D	37.7	Very low	36.3	Very low	96 Å²	96	140.1 Å²	140.1	51%	0.513	74%	0.736	S	S	.	*			cis	-152	159.5	3.6	-148.7	-14.1	0	0	0	114.2
189	R	38.9	Very low	36.6	Very low	167 Å²	167	138.9 Å²	138.9	63%	0.63	73%	0.728	S	S	*	*			trans	50.1	117.6	158.2	-77.8	140.6	-144.7	-177.6	6.4	122.7
190	R	40	Very low	36.9	Very low	178 Å²	178	134.9 Å²	134.9	67%	0.672	72%	0.717	S	S	*	*				73.3	143.3	82	-65.1	177.1	-148.4	153.8	0.8	114
191	H	39.2	Very low	36.9	Very low	146 Å²	146	137.7 Å²	137.7	68%	0.676	71%	0.71	S	S	*	*			cis	-143.8	141.7	31.4	-85.7	-93.4	0	0	0	112.5
192	L	39.3	Very low	37.2	Very low	133 Å²	133	134.9 Å²	134.9	70%	0.696	71%	0.706	S	S	*	*				60.1	142.4	89	-74.6	74.6	0	0	0	116.1
193	M	37.6	Very low	37.3	Very low	142 Å²	142	132.4 Å²	132.4	70%	0.7	70%	0.701	S	S	*	*			cis	-164.6	-173.7	-9.1	-101	-56.8	177.6	0	0	108.2
194	H	38	Very low	37.2	Very low	146 Å²	146	137.1 Å²	137.1	68%	0.676	71%	0.705	S	S	*	*			cis	-155.5	175.1	5.6	-114.3	-3.3	0	0	0	107.7
195	N	34.4	Very low	37.6	Very low	119 Å²	119	133.2 Å²	133.2	64%	0.636	69%	0.694	S	S	*	*			cis	78.5	138.5	38.4	-59.6	-8.8	0	0	0	116
196	I	43.5	Very low	37.4	Very low	150 Å²	150	133 Å²	133	77%	0.769	69%	0.693	S	S	*	*			cis	-161.6	163.5	-7.5	-118.9	167.5	0	0	0	112.1
197	P	41.3	Very low	37.2	Very low	118 Å²	118	135.9 Å²	135.9	77%	0.766	70%	0.701	S	S	*	*			trans	-123.1	-178.8	-174.6	43.6	-32.1	0	0	0	118
198	G	35.7	Very low	37.3	Very low	76 Å²	76	136.4 Å²	136.4	78%	0.784	70%	0.703	S	S	*	*			trans	164.6	173	167.6	0	0	0	0	0	114.1
199	K	36.3	Very low	37.2	Very low	163 Å²	163	137.8 Å²	137.8	71%	0.709	72%	0.717	S	S	*	*			cis	-168.7	-169	-20.6	-147.1	-150.2	176.9	-140.3	0	110.7	E201	K199-E201 WeakPolarHBondContact CD-OE1 3.28Å; K199-E201 WeakPolarHBondContact CE-OE1 3.33Å; K199-E201 WeakPolarHBondContact CG-OE1 3.4Å; K199-E201 IonicContact NZ-OE1 3.94Å; K199-E201 PolarHBondContact NZ-OE1 2.84Å; K199-E201 IonicContact NZ-OE2 2.79Å; K199-E201 PolarHBondContact NZ-OE2 3.12Å
200	V	37.1	Very low	36.8	Very low	122 Å²	122	139.4 Å²	139.4	74%	0.739	73%	0.729	S	S	*	*			trans	74.3	129.8	176.9	-52	0	0	0	0	118.8
201	E	33.1	Very low	37	Very low	135 Å²	135	136.3 Å²	136.3	63%	0.631	73%	0.732	S	S	*	*			cis	87.9	140.3	25.1	-58.7	143.3	-99.7	0	0	113.4	K199	K199-E201 WeakPolarHBondContact CD-OE1 3.28Å; K199-E201 WeakPolarHBondContact CE-OE1 3.33Å; K199-E201 WeakPolarHBondContact CG-OE1 3.4Å; K199-E201 IonicContact NZ-OE1 3.94Å; K199-E201 PolarHBondContact NZ-OE1 2.84Å; K199-E201 IonicContact NZ-OE2 2.79Å; K199-E201 PolarHBondContact NZ-OE2 3.12Å
202	S	37.6	Very low	37.1	Very low	97 Å²	97	133.8 Å²	133.8	68%	0.678	74%	0.737	S	S	*	*			cis	-161.1	139.4	15.7	63.5	0	0	0	0	114
203	T	32.9	Very low	37.2	Very low	111 Å²	111	133.2 Å²	133.2	68%	0.681	74%	0.741	S	S	*	*				87.8	140.6	109.2	-64.9	0	0	0	0	120
204	F	31.5	Very low	37.3	Very low	196 Å²	196	135.2 Å²	135.2	86%	0.86	75%	0.754	S	S	*	*				171.7	145.3	125.5	-94.5	-66.2	0	0	0	116.2
205	P	42	Very low	37.3	Very low	93 Å²	93	131.6 Å²	131.6	60%	0.604	76%	0.755	S	S	*	*			trans	-141.3	-157.1	-174.1	36.9	-11.7	0	0	0	117.1
206	D	32.9	Very low	37.7	Very low	136 Å²	136	131.8 Å²	131.8	73%	0.727	76%	0.763	S	S	*	*			trans	101.4	169.8	150.5	-63.9	-29.9	0	0	0	123.7
207	F	36.4	Very low	37.3	Very low	189 Å²	189	131 Å²	131	83%	0.829	77%	0.771	S	S	*	*			trans	79.7	109.5	-174.7	-54.4	-79.7	0	0	0	116.7
208	L	37.3	Very low	37.1	Very low	152 Å²	152	128.3 Å²	128.3	80%	0.796	76%	0.764	S	S	*	*			cis	100.9	162.8	38.7	-69.2	172.3	0	0	0	113.1
209	P	36.7	Very low	37.3	Very low	124 Å²	124	131.6 Å²	131.6	81%	0.805	77%	0.769	S	S	*	*				-132.5	-162.9	-62.3	41.4	-24.4	0	0	0	115.7
210	K	31	Very low	37.5	Very low	201 Å²	201	129.6 Å²	129.6	87%	0.874	77%	0.771	S	S	*	*			trans	-94.1	-171.9	-179.9	-132.1	-175.3	174.8	-178	0	111.2
211	P	44.2	Very low	37.6	Very low	113 Å²	113	128.8 Å²	128.8	73%	0.734	77%	0.771	S	S	*	*			cis	-143.5	-163.2	-8.8	43.2	-21.8	0	0	0	117.2
212	A	40.1	Very low	38	Very low	94 Å²	94	129.2 Å²	129.2	78%	0.777	78%	0.777	S	S	*	*			trans	116.3	153.1	145.4	0	0	0	0	0	119.9
213	P	42.3	Very low	38	Very low	121 Å²	121	132.6 Å²	132.6	79%	0.786	79%	0.786	S	S	*	*			trans	-131.5	173.5	-161	43.8	-28.1	0	0	0	117.6
214	L	39.7	Very low	37.9	Very low	184 Å²	184	130.6 Å²	130.6	96%	0.963	79%	0.788	S	S	*	*			trans	-175.6	156.8	155.8	-105.6	165.6	0	0	0	113.3
215	G	38.2	Very low	38.5	Very low	69 Å²	69	129.6 Å²	129.6	71%	0.711	79%	0.788	S	S	*	*			trans	105.2	118.9	158.3	0	0	0	0	0	120.4
216	P	41.3	Very low	38	Very low	123 Å²	123	131.2 Å²	131.2	80%	0.799	80%	0.798	S	S	*	*			trans	-134.4	151.9	-179	41.2	-26.7	0	0	0	118.7
217	S	37	Very low	38	Very low	135 Å²	135	128.4 Å²	128.4	94%	0.944	80%	0.802	S	S	*	*			trans	175.2	150.9	149.9	-82.6	0	0	0	0	111
218	G	35.9	Very low	38	Very low	60 Å²	60	127.8 Å²	127.8	62%	0.619	80%	0.803	S	S	*	*			cis	175	149.8	-10.1	0	0	0	0	0	113.4
219	T	39.3	Very low	38.2	Very low	145 Å²	145	124.2 Å²	124.2	89%	0.89	80%	0.796	S	S	*	*			trans	67.8	153.6	173	78.4	0	0	0	0	117.1
220	T	41.9	Very low	38.3	Very low	121 Å²	121	122.3 Å²	122.3	74%	0.742	79%	0.785	S	S	*	*			cis	-133.6	157.3	7.4	48.8	0	0	0	0	113.6
221	S	38.9	Very low	39.2	Very low	105 Å²	105	117.8 Å²	117.8	73%	0.734	78%	0.779	S	S	*	*			trans	29.7	142.7	138	-60.2	0	0	0	0	122.8
222	L	40.8	Very low	39.6	Very low	145 Å²	145	115.9 Å²	115.9	76%	0.759	77%	0.773	S	S	*	*			cis	-163.3	140.8	6.9	-109	158.6	0	0	0	109.9
223	L	38.2	Very low	39.9	Very low	167 Å²	167	117.5 Å²	117.5	87%	0.874	77%	0.766	S	S	*	*			trans	48.3	135.4	158.8	-61.3	164.3	0	0	0	119.6
224	G	31.1	Very low	40.4	Very low	69 Å²	69	119.1 Å²	119.1	71%	0.711	77%	0.765	S	S	*	*			cis	133.5	134.2	8.8	0	0	0	0	0	109.5
225	M	42.9	Very low	40.9	Very low	176 Å²	176	112.9 Å²	112.9	87%	0.867	74%	0.74	S	S	*	*			cis	-146.2	159	1.4	-65.2	179.9	68.2	0	0	110.7
226	P	33.1	Very low	41.6	Very low	127 Å²	127	112.2 Å²	112.2	83%	0.825	73%	0.728	S	S	*	*			trans	-81.1	113.9	171.3	31.5	-32.1	0	0	0	112.2
227	G	32.2	Very low	41.9	Very low	77 Å²	77	108.9 Å²	108.9	79%	0.794	71%	0.711	S	S	*	*			trans	-98	93	-173.6	0	0	0	0	0	114.9
228	M	37.1	Very low	42.7	Very low	175 Å²	175	105 Å²	105	86%	0.862	69%	0.686	S	S	*	*			trans	-49.3	128.6	169.5	44.5	170.1	64.4	0	0	114.8
229	A	40.2	Very low	43.5	Very low	78 Å²	78	111 Å²	111	65%	0.645	70%	0.695	S	S	*	*			trans	-133.6	84.6	165.1	0	0	0	0	0	109.5
230	S	38.8	Very low	44.1	Very low	83 Å²	83	108.1 Å²	108.1	58%	0.58	69%	0.687	S	S	*	*			trans	-59.3	155	-175.6	-57.7	0	0	0	0	113	A232 M233	S230-A232 PolarHBondContact O-N 3.49Å; S230-M233 PolarHBondContact O-N 2.8Å
231	S	49.3	Very low	44.4	Very low	106 Å²	106	108.6 Å²	108.6	74%	0.741	68%	0.684	S	S	*	*	H	α-helix	trans	-49.5	-28.8	176.9	-171.7	0	0	0	0	113.9	M233 M234 A235	S231-M233 VanDerWaalsContact C-N 3.27Å; S231-M233 PolarHBondContact O-N 3.08Å; S231-M234 PolarHBondContact O-N 3.43Å; S231-A235 WeakPolarHBondContact O-CB 3.37Å; S231-A235 PolarHBondContact O-N 3.31Å
232	A	52.5	Low	44.5	Very low	74 Å²	74	106.3 Å²	106.3	61%	0.612	68%	0.677	S	S	*	*	H	α-helix	trans	-56.9	-34.2	173.8	0	0	0	0	0	113.8	S230 A235 A236	S230-A232 PolarHBondContact O-N 3.49Å; A232-A235 PolarHBondContact O-N 3.12Å; A232-A236 WeakPolarHBondContact O-CB 3.47Å; A232-A236 PolarHBondContact O-N 3.29Å
233	M	47.2	Very low	44.7	Very low	127 Å²	127	106.2 Å²	106.2	63%	0.626	68%	0.676	S	S	*	*	H	α-helix	trans	-76.3	-34.4	179.9	-158.4	-177.4	-65.8	0	0	111.7	S230 S231 A236 A237	S230-M233 PolarHBondContact O-N 2.8Å; S231-M233 VanDerWaalsContact C-N 3.27Å; S231-M233 PolarHBondContact O-N 3.08Å; M233-A236 PolarHBondContact O-N 3.39Å; M233-A237 PolarHBondContact O-N 3.29Å
234	M	53.2	Low	44.7	Very low	156 Å²	156	106.4 Å²	106.4	77%	0.768	68%	0.678	S	S	*	*	H	α-helix	trans	-71.4	-33.3	172	-163.3	168.7	-74.8	0	0	111.6	S231 A237 A238	S231-M234 PolarHBondContact O-N 3.43Å; M234-A237 PolarHBondContact O-N 3.07Å; M234-A238 PolarHBondContact O-N 3.43Å
235	A	50.4	Low	45.1	Very low	52 Å²	52	107.3 Å²	107.3	43%	0.43	68%	0.679	S	S	.	*	H	α-helix	trans	-69.9	-32.8	169.8	0	0	0	0	0	112.9	S231 A232 A238 K239	S231-A235 WeakPolarHBondContact O-CB 3.37Å; S231-A235 PolarHBondContact O-N 3.31Å; A232-A235 PolarHBondContact O-N 3.12Å; A235-A238 PolarHBondContact O-N 3.37Å; A235-K239 PolarHBondContact O-N 3.38Å
236	A	51.5	Low	45.4	Very low	56 Å²	56	105.7 Å²	105.7	46%	0.463	68%	0.679	S	S	.	*	H	α-helix	trans	-66.7	-41.6	171.5	0	0	0	0	0	111.5	A232 M233 A238 K239 A240	A232-A236 WeakPolarHBondContact O-CB 3.47Å; A232-A236 PolarHBondContact O-N 3.29Å; M233-A236 PolarHBondContact O-N 3.39Å; A236-A238 VanDerWaalsContact C-N 3.35Å; A236-A238 PolarHBondContact O-N 2.82Å; A236-K239 PolarHBondContact O-N 2.97Å; A236-A240 PolarHBondContact O-N 2.88Å
237	A	47.8	Very low	45.5	Very low	53 Å²	53	105.8 Å²	105.8	44%	0.438	68%	0.679	S	S	.	*	H	α-helix	trans	-61.5	-40.4	171.9	0	0	0	0	0	112.2	M233 M234 K239 A240 L241	M233-A237 PolarHBondContact O-N 3.29Å; M234-A237 PolarHBondContact O-N 3.07Å; A237-K239 PolarHBondContact O-N 2.77Å; A237-A240 PolarHBondContact O-N 3.36Å; A237-L241 WeakPolarHBondContact O-CG 3.19Å; A237-L241 PolarHBondContact O-N 3.14Å
238	A	54.7	Low	45.8	Very low	52 Å²	52	105.3 Å²	105.3	43%	0.43	67%	0.674	S	S	.	*	H	α-helix	trans	-62.5	-39.5	173.4	0	0	0	0	0	112.7	M234 A235 A236 L241	M234-A238 PolarHBondContact O-N 3.43Å; A235-A238 PolarHBondContact O-N 3.37Å; A236-A238 VanDerWaalsContact C-N 3.35Å; A236-A238 PolarHBondContact O-N 2.82Å; A238-L241 PolarHBondContact O-N 3.35Å
239	K	52.3	Low	45.9	Very low	187 Å²	187	103.7 Å²	103.7	81%	0.813	67%	0.674	S	S	*	*	H	α-helix	trans	-67.5	-31	172.9	-81.8	-171.4	171.8	-175.9	0	113.5	A235 A236 A237 L241	A235-K239 PolarHBondContact O-N 3.38Å; A236-K239 PolarHBondContact O-N 2.97Å; A237-K239 PolarHBondContact O-N 2.77Å; K239-L241 PolarHBondContact O-N 2.84Å
240	A	51.1	Low	45.7	Very low	85 Å²	85	108 Å²	108	70%	0.702	69%	0.685	S	S	*	*	H	α-helix	trans	-71.3	-13.7	175.2	0	0	0	0	0	113.6	A236 A237	A236-A240 PolarHBondContact O-N 2.88Å; A237-A240 PolarHBondContact O-N 3.36Å
241	L	50.1	Low	46	Very low	131 Å²	131	109 Å²	109	69%	0.686	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	14.1	-177.3	-69.5	171.6	0	0	0	114.2	A237 A238 K239 L243	A237-L241 WeakPolarHBondContact O-CG 3.19Å; A237-L241 PolarHBondContact O-N 3.14Å; A238-L241 PolarHBondContact O-N 3.35Å; K239-L241 PolarHBondContact O-N 2.84Å; L241-L243 PolarHBondContact O-N 2.85Å
242	G	39.5	Very low	45.5	Very low	57 Å²	57	110 Å²	110	59%	0.588	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.9	7.2	169.8	0	0	0	0	0	116.4	N244	G242-N244 PolarHBondContact O-N 3.18Å
243	L	46.2	Very low	44.5	Very low	142 Å²	142	110.9 Å²	110.9	74%	0.743	70%	0.701	S	S	*	*			trans	-76	83.5	-179.2	-67.4	178	0	0	0	111.3	L241 A245	L241-L243 PolarHBondContact O-N 2.85Å; L243-A245 PolarHBondContact O-N 3.26Å
244	N	36.5	Very low	43.9	Very low	171 Å²	171	114 Å²	114	91%	0.914	71%	0.714	S	S	*	*			trans	-64.4	100.7	172.9	-74.8	-25	0	0	0	111.2	G242	G242-N244 PolarHBondContact O-N 3.18Å
245	A	41	Very low	42.8	Very low	89 Å²	89	113.6 Å²	113.6	74%	0.736	71%	0.714	S	S	*	*			trans	-130.1	133.8	168.5	0	0	0	0	0	110	L243	L243-A245 PolarHBondContact O-N 3.26Å
246	V	48.2	Very low	41.7	Very low	141 Å²	141	118.3 Å²	118.3	86%	0.855	73%	0.732	S	S	*	*			trans	-73.2	135	-168.2	-178.2	0	0	0	0	111.6	G248	V246-G248 PolarHBondContact O-N 3.46Å
247	P	36.4	Very low	40.7	Very low	130 Å²	130	120.7 Å²	120.7	84%	0.844	74%	0.741	S	S	*	*			trans	-81.2	114.3	173.9	-3.3	21.2	0	0	0	111.2
248	G	37.3	Very low	40	Very low	66 Å²	66	124.7 Å²	124.7	68%	0.68	75%	0.754	S	S	*	*			trans	170.7	143	171.3	0	0	0	0	0	113.3	V246	V246-G248 PolarHBondContact O-N 3.46Å
249	V	40.4	Very low	38.7	Very low	141 Å²	141	128.6 Å²	128.6	86%	0.855	77%	0.772	S	S	*	*			trans	60.8	93.1	173.7	-167.5	0	0	0	0	115.9
250	L	36.3	Very low	37.7	Very low	170 Å²	170	123.9 Å²	123.9	89%	0.89	76%	0.763	S	S	*	*			trans	-121	126.3	158	-90	173.7	0	0	0	110.1
251	P	43.2	Very low	36.8	Very low	104 Å²	104	127.4 Å²	127.4	68%	0.675	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-81	156.8	151.4	-12.5	30.5	0	0	0	110.8
252	P	39.7	Very low	36	Very low	126 Å²	126	126.9 Å²	126.9	82%	0.818	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-86.6	161.8	-159.9	33.7	-37.5	0	0	0	115.5
253	A	32.5	Very low	35.7	Very low	92 Å²	92	135 Å²	135	76%	0.76	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-70.3	148.5	175.5	0	0	0	0	0	113.6
254	Q	34	Very low	35.1	Very low	192 Å²	192	137.9 Å²	137.9	90%	0.897	78%	0.778	S	S	*	*			trans	-110.1	138.1	158	-71.9	-105.4	-76.4	0	0	108.6
255	L	28.7	Very low	34.9	Very low	149 Å²	149	132.9 Å²	132.9	78%	0.78	77%	0.766	S	S	*	*			trans	-71.1	137.6	175.5	-86.7	65.6	0	0	0	110.6
256	N	29	Very low	34.7	Very low	150 Å²	150	132.7 Å²	132.7	80%	0.802	76%	0.759	S	S	*	*				-166.3	116.8	127.5	-91	-29.1	0	0	0	106.2
257	T	28.9	Very low	34.2	Very low	106 Å²	106	130.1 Å²	130.1	65%	0.65	75%	0.753	S	S	*	*				51.4	103	64.7	-36.9	0	0	0	0	108.1
258	I	33.3	Very low	34.2	Very low	138 Å²	138	131.2 Å²	131.2	71%	0.708	75%	0.752	S	S	*	*				-144.8	126.7	56.8	-68.6	159.3	0	0	0	111.8	S260	I258-S260 WeakPolarHBondContact CG2-OG 3.49Å
259	T	28.9	Very low	34.2	Very low	133 Å²	133	135.2 Å²	135.2	82%	0.816	76%	0.757	S	S	*	*			trans	-96.5	79.9	163.3	37.8	0	0	0	0	111	H261	T259-H261 VanDerWaalsContact C-N 3.29Å; T259-H261 PolarHBondContact O-N 3.05Å
260	S	31	Very low	34	Very low	89 Å²	89	138.5 Å²	138.5	62%	0.622	75%	0.754	S	S	*	*			trans	-76.4	71	-179.4	-82.6	0	0	0	0	113.7	I258 N262	I258-S260 WeakPolarHBondContact CG2-OG 3.49Å; S260-N262 VanDerWaalsContact C-N 3.26Å; S260-N262 PolarHBondContact O-N 3.14Å
261	H	32	Very low	33.8	Very low	159 Å²	159	137.9 Å²	137.9	74%	0.736	75%	0.746	S	S	*	*			trans	-70.3	80.7	158.4	-79	-63.2	0	0	0	110.5	T259 R263	T259-H261 VanDerWaalsContact C-N 3.29Å; T259-H261 PolarHBondContact O-N 3.05Å; H261-R263 PolarHBondContact O-N 2.92Å
262	N	32.1	Very low	33.2	Very low	120 Å²	120	142.7 Å²	142.7	64%	0.642	75%	0.752	S	S	*	*			trans	-72.4	69.1	174.1	-89.8	11.3	0	0	0	112.6	S260 Y264	S260-N262 VanDerWaalsContact C-N 3.26Å; S260-N262 PolarHBondContact O-N 3.14Å; N262-Y264 VanDerWaalsContact C-N 3.3Å; N262-Y264 HydrophobicContact CB-CD2 4.12Å; N262-Y264 PolarHBondContact O-N 3.05Å
263	R	34.5	Very low	32.8	Very low	227 Å²	227	145.8 Å²	145.8	86%	0.857	76%	0.756	S	S	*	*			trans	-74.7	83.2	152.4	-84.9	-172.4	-90.4	-167.6	-9.1	108.4	H261 G265	H261-R263 PolarHBondContact O-N 2.92Å; R263-G265 PolarHBondContact O-N 2.75Å
264	Y	32.9	Very low	32.9	Very low	203 Å²	203	148.2 Å²	148.2	80%	0.796	75%	0.751	S	S	*	*			trans	-92.3	98.8	170.2	-91.9	-68.1	0	0	0	111.7	N262	N262-Y264 VanDerWaalsContact C-N 3.3Å; N262-Y264 HydrophobicContact CB-CD2 4.12Å; N262-Y264 PolarHBondContact O-N 3.05Å
265	G	33.2	Very low	33	Very low	65 Å²	65	146.6 Å²	146.6	67%	0.67	75%	0.749	S	S	*	*			trans	-123.8	89.3	171.5	0	0	0	0	0	111.8	R263	R263-G265 PolarHBondContact O-N 2.75Å
266	S	36.7	Very low	33.2	Very low	85 Å²	85	150 Å²	150	59%	0.594	75%	0.751	S	S	*	*	S	Bend	trans	69.3	143.5	168.4	-57.8	0	0	0	0	118.8	K330	S266-K330 PolarHBondContact OG-NZ 2.82Å
267	A	38.1	Very low	33.4	Very low	88 Å²	88	148.5 Å²	148.5	73%	0.727	75%	0.753	S	S	*	*			trans	62.7	125.1	161.4	0	0	0	0	0	117.3
268	N	35.8	Very low	33.5	Very low	153 Å²	153	146.3 Å²	146.3	82%	0.818	75%	0.751	S	S	*	*			cis	-147.7	156.9	27.2	-88.1	-50	0	0	0	114.8
269	L	37.4	Very low	33.4	Very low	149 Å²	149	149.7 Å²	149.7	78%	0.78	76%	0.761	S	S	*	*			trans	-1.7	121.4	145.5	-112.8	68.2	0	0	0	118.2
270	R	35.8	Very low	33.5	Very low	211 Å²	211	148.7 Å²	148.7	80%	0.796	76%	0.759	S	S	*	*				174.3	156.8	105	-97.2	169.5	-170.6	-179.6	2.4	114.2
271	H	32.3	Very low	33.5	Very low	156 Å²	156	151 Å²	151	72%	0.722	77%	0.773	S	S	*	*			trans	28.6	117.2	170.7	-50.5	-64.4	0	0	0	120.1
272	Y	30.4	Very low	33.4	Very low	205 Å²	205	146 Å²	146	80%	0.804	76%	0.763	S	S	*	*				60	97.3	73.2	-110.7	-82.7	0	0	0	114.1
273	E	31.7	Very low	33.6	Very low	191 Å²	191	144.7 Å²	144.7	89%	0.893	77%	0.77	S	S	*	*				-145.7	140.3	129.9	-148.4	168.2	-140.9	0	0	109.8
274	H	35.3	Very low	33.9	Very low	143 Å²	143	137.5 Å²	137.5	66%	0.662	75%	0.754	S	S	*	*			trans	-89.6	134.6	173.2	-106.8	2.5	0	0	0	108.3
275	N	35	Very low	34.7	Very low	159 Å²	159	131.8 Å²	131.8	85%	0.85	74%	0.737	S	S	*	*			trans	-138.5	132.9	148.1	-149.8	-21.5	0	0	0	111.4
276	R	32.2	Very low	35.4	Very low	219 Å²	219	132.1 Å²	132.1	83%	0.826	73%	0.729	S	S	*	*			trans	-105.2	97.4	-174.6	-70.7	-179.4	177.6	-178	-0.5	109.7
277	S	34	Very low	36	Very low	119 Å²	119	135.7 Å²	135.7	83%	0.832	74%	0.737	S	S	*	*			trans	-158.3	144.5	159.2	-152.8	0	0	0	0	107.8
278	G	31.4	Very low	36.9	Very low	60 Å²	60	136.1 Å²	136.1	62%	0.619	72%	0.722	S	S	*	*			cis	130.6	93.5	11.9	0	0	0	0	0	108.3
279	F	31.8	Very low	38.3	Very low	209 Å²	209	130.2 Å²	130.2	92%	0.917	69%	0.69	S	S	*	*			trans	14.5	100.1	175.5	-87	-97.1	0	0	0	118.3
280	S	30.2	Very low	39.7	Very low	112 Å²	112	125.4 Å²	125.4	78%	0.783	67%	0.668	S	S	*	*			trans	-158.6	107.1	151.7	-82.3	0	0	0	0	110.7	G282	S280-G282 VanDerWaalsContact C-N 3.28Å; S280-G282 PolarHBondContact O-N 3.15Å
281	P	31.8	Very low	41.8	Very low	139 Å²	139	123 Å²	123	90%	0.903	66%	0.664	S	S	*	*			trans	-79	75.8	174.7	32.7	-33.3	0	0	0	110.3
282	G	28.7	Very low	44.4	Very low	52 Å²	52	115.7 Å²	115.7	54%	0.536	63%	0.63	S	S	.	*			trans	-115.5	129.7	-175.7	0	0	0	0	0	113.8	S280 S284	S280-G282 VanDerWaalsContact C-N 3.28Å; S280-G282 PolarHBondContact O-N 3.15Å; G282-S284 VanDerWaalsContact C-N 3.29Å; G282-S284 PolarHBondContact O-N 3.18Å
283	A	35.5	Very low	47.4	Very low	94 Å²	94	106.3 Å²	106.3	78%	0.777	59%	0.594	S	S	*	*	S	Bend	trans	57	-56.3	168.9	0	0	0	0	0	118.8	D285 S286	A283-D285 VanDerWaalsContact C-N 3.29Å; A283-D285 PolarHBondContact O-N 2.76Å; A283-S286 PolarHBondContact O-N 2.88Å
284	S	42.6	Very low	50.4	Low	75 Å²	75	97.5 Å²	97.5	52%	0.524	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.9	-12.5	-157.6	82.7	0	0	0	0	116.5	G282 K288	G282-S284 VanDerWaalsContact C-N 3.29Å; G282-S284 PolarHBondContact O-N 3.18Å; S284-K288 PolarHBondContact O-NZ 3.27Å
285	D	48.8	Very low	53.2	Low	83 Å²	83	91.2 Å²	91.2	44%	0.444	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-18.7	-179.9	-77.9	-44.5	0	0	0	114.5	A283 E287 K288 E289	A283-D285 VanDerWaalsContact C-N 3.29Å; A283-D285 PolarHBondContact O-N 2.76Å; D285-E287 PolarHBondContact O-N 2.88Å; D285-K288 WeakPolarHBondContact O-CB 3.08Å; D285-K288 PolarHBondContact O-N 3.04Å; D285-K288 WeakPolarHBondContact OD1-CD 2.9Å; D285-K288 IonicContact OD1-NZ 3.79Å; D285-K288 PolarHBondContact OD1-NZ 2.73Å; D285-E289 PolarHBondContact O-N 2.67Å; D285-E289 VanDerWaalsContact O-N 3.15Å
286	S	47.5	Very low	56.1	Low	72 Å²	72	83.7 Å²	83.7	50%	0.503	48%	0.484	S	S	.	.	H	α-helix	trans	-61.9	-41.8	178.7	-71.7	0	0	0	0	112.4	A283 K288 E289 S290 R442	A283-S286 PolarHBondContact O-N 2.88Å; S286-K288 VanDerWaalsContact C-N 3.26Å; S286-K288 PolarHBondContact O-N 2.9Å; S286-E289 PolarHBondContact O-N 2.81Å; S286-S290 PolarHBondContact O-N 2.93Å; S286-R442 PolarHBondContact OG-NH2 3.28Å
287	E	48.7	Very low	59.1	Low	161 Å²	161	76.6 Å²	76.6	75%	0.752	46%	0.46	S	S	*	.	H	α-helix	trans	-59.9	-37	173.6	-65.4	-168.7	159.1	0	0	112.3	D285 E289 S290	D285-E287 PolarHBondContact O-N 2.88Å; E287-E289 VanDerWaalsContact C-N 3.31Å; E287-E289 PolarHBondContact O-N 2.91Å; E287-S290 WeakPolarHBondContact O-CB 3.22Å; E287-S290 PolarHBondContact O-N 3.08Å; E287-S290 PolarHBondContact O-OG 3.1Å
288	K	58.6	Low	62	Low	97 Å²	97	71 Å²	71	42%	0.422	42%	0.42	S	S	.	.	H	α-helix	trans	-70.4	-29.1	-178.6	-51.9	-168.2	-165.2	79.1	0	111.7	S284 D285 S286 K291 Y368	S284-K288 PolarHBondContact O-NZ 3.27Å; D285-K288 WeakPolarHBondContact O-CB 3.08Å; D285-K288 PolarHBondContact O-N 3.04Å; D285-K288 WeakPolarHBondContact OD1-CD 2.9Å; D285-K288 IonicContact OD1-NZ 3.79Å; D285-K288 PolarHBondContact OD1-NZ 2.73Å; S286-K288 VanDerWaalsContact C-N 3.26Å; S286-K288 PolarHBondContact O-N 2.9Å; K288-K291 PolarHBondContact O-N 3.29Å; K288-Y368 WeakPolarHBondContact O-CD2 3.46Å; K288-Y368 VanDerWaalsContact O-CE2 3.31Å; K288-Y368 WeakPolarHBondContact O-CE2 3.49Å
289	E	65	Low	64.9	Low	29 Å²	29	68.3 Å²	68.3	14%	0.136	39%	0.393	C	S	.	.	H	α-helix	trans	-75.7	-21	176.4	-73.2	-173.3	-110.8	0	0	114	D285 S286 E287 K291 A292 M352 R442	D285-E289 PolarHBondContact O-N 2.67Å; D285-E289 VanDerWaalsContact O-N 3.15Å; S286-E289 PolarHBondContact O-N 2.81Å; E287-E289 VanDerWaalsContact C-N 3.31Å; E287-E289 PolarHBondContact O-N 2.91Å; E289-K291 PolarHBondContact O-N 3.42Å; E289-K291 VanDerWaalsContact O-N 3.13Å; E289-A292 WeakPolarHBondContact O-CB 3.5Å; E289-A292 PolarHBondContact O-N 2.63Å; E289-M352 HydrophobicContact CG-CE 3.93Å; E289-M352 WeakPolarHBondContact OE1-CE 3.26Å; E289-M352 WeakPolarHBondContact OE2-CE 3.27Å; E289-R442 VanDerWaalsContact CD-NH2 3.31Å; E289-R442 IonicContact OE1-CZ 3.66Å; E289-R442 IonicContact OE1-NH1 3.78Å; E289-R442 PolarHBondContact OE1-NH1 2.91Å; E289-R442 IonicContact OE1-NH2 3.92Å; E289-R442 PolarHBondContact OE1-NH2 3.2Å; E289-R442 IonicContact OE2-CZ 2.73Å; E289-R442 IonicContact OE2-NH1 2.89Å; E289-R442 PolarHBondContact OE2-NH1 3.21Å; E289-R442 IonicContact OE2-NH2 2.77Å
290	S	67.2	Low	67.8	Low	48 Å²	48	59.8 Å²	59.8	34%	0.336	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-26.6	168	73.9	0	0	0	0	112.8	S286 E287	S286-S290 PolarHBondContact O-N 2.93Å; E287-S290 WeakPolarHBondContact O-CB 3.22Å; E287-S290 PolarHBondContact O-N 3.08Å; E287-S290 PolarHBondContact O-OG 3.1Å
291	K	78.4	Confident	70.8	Confident	160 Å²	160	54.5 Å²	54.5	70%	0.696	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	19.7	176.2	-83	165.9	178.5	150.5	0	113.5	K288 E289 T293 Y368	K288-K291 PolarHBondContact O-N 3.29Å; E289-K291 PolarHBondContact O-N 3.42Å; E289-K291 VanDerWaalsContact O-N 3.13Å; K291-T293 PolarHBondContact O-N 3.4Å; K291-Y368 WeakPolarHBondContact O-CB 3.4Å
292	A	88.1	Confident	73.6	Confident	2 Å²	2	49.2 Å²	49.2	2%	0.017	29%	0.285	C	S	.	.			trans	-57.6	134.7	174.4	0	0	0	0	0	112.2	E289 V344 Y368 K431	E289-A292 WeakPolarHBondContact O-CB 3.5Å; E289-A292 PolarHBondContact O-N 2.63Å; A292-V344 HydrophobicContact CB-CG2 3.89Å; A292-Y368 HydrophobicContact CB-CD1 4.41Å; A292-Y368 HydrophobicContact CB-CE1 3.96Å; A292-Y368 HydrophobicContact CB-CE2 4.2Å; A292-K431 WeakPolarHBondContact O-CE 3.29Å; A292-K431 PolarHBondContact O-NZ 3.36Å
293	T	93.2	Very high	76.5	Confident	8 Å²	8	50.6 Å²	50.6	5%	0.049	29%	0.285	C	S	.	.			trans	-145.6	160.1	177.5	57.5	0	0	0	0	110.1	K291 T295 A347 G369 A371 D446	K291-T293 PolarHBondContact O-N 3.4Å; T293-T295 PolarHBondContact O-N 3.4Å; T293-T295 PolarHBondContact OG1-O 3.44Å; T293-A347 WeakPolarHBondContact O-CB 3.45Å; T293-G369 WeakPolarHBondContact CG2-O 3.19Å; T293-G369 PolarHBondContact OG1-O 3.39Å; T293-A371 HydrophobicContact CG2-CB 3.8Å; T293-D446 WeakPolarHBondContact CA-OD2 3.39Å; T293-D446 WeakPolarHBondContact CB-OD2 3.44Å
294	R	93.4	Very high	79.1	Confident	6 Å²	6	50.3 Å²	50.3	2%	0.023	27%	0.271	C	S	.	.	S	Bend	trans	-71	-16.2	176.2	66	164.2	158	161.5	-4.8	113.7	E321 R340 F341 D446 F447 N449	R294-E321 IonicContact CZ-OE2 3.24Å; R294-E321 VanDerWaalsContact NH1-CD 3.28Å; R294-E321 IonicContact NH1-OE1 2.91Å; R294-E321 PolarHBondContact NH1-OE1 3.06Å; R294-E321 VanDerWaalsContact NH1-OE1 3.12Å; R294-E321 IonicContact NH1-OE2 2.91Å; R294-E321 PolarHBondContact NH1-OE2 3.5Å; R294-R340 HydrophobicContact CG-CG 4.44Å; R294-F341 WeakPolarHBondContact CB-O 3.15Å; R294-F341 VanDerWaalsContact CD-O 3.24Å; R294-F341 WeakPolarHBondContact CD-O 3.47Å; R294-F341 PolarHBondContact O-N 3.06Å; R294-D446 PolarHBondContact N-OD2 2.78Å; R294-F447 VanDerWaalsContact CZ-O 3.24Å; R294-F447 PolarHBondContact NE-O 3.43Å; R294-F447 PolarHBondContact NH2-O 3.47Å; R294-N449 PolarHBondContact NH1-OD1 3.4Å; R294-N449 PolarHBondContact NH2-OD1 2.8Å
295	T	95.2	Very high	81.5	Confident	12 Å²	12	46.8 Å²	46.8	7%	0.074	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.8	175.8	-53.7	0	0	0	0	110.2	T293 F338 G369	T293-T295 PolarHBondContact O-N 3.4Å; T293-T295 PolarHBondContact OG1-O 3.44Å; T295-F338 HydrophobicContact CG2-CB 4.05Å; T295-F338 HydrophobicContact CG2-CD1 4.24Å; T295-G369 WeakPolarHBondContact O-CA 3.39Å; T295-G369 PolarHBondContact O-N 3.31Å
296	L	95.7	Very high	83.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	140.1	168.2	-61.1	-175.1	0	0	0	110.6	V298 F314 F338 V339 F341 A347 A350 K351 I366 G367 Y368	L296-V298 HydrophobicContact CB-CG2 4.37Å; L296-F314 HydrophobicContact CD1-CE1 4.26Å; L296-F338 CarbonylContact O-C 3.12Å; L296-F338 VanDerWaalsContact O-CA 3.27Å; L296-F338 WeakPolarHBondContact O-CA 3.26Å; L296-V339 PolarHBondContact N-O 2.94Å; L296-V339 PolarHBondContact O-N 2.92Å; L296-F341 HydrophobicContact CD1-CD2 4.49Å; L296-F341 HydrophobicContact CD1-CE2 3.85Å; L296-F341 HydrophobicContact CG-CE2 4.31Å; L296-A347 HydrophobicContact CD2-CB 4.01Å; L296-A347 HydrophobicContact CG-CB 4.09Å; L296-A350 HydrophobicContact CD1-CB 3.8Å; L296-K351 HydrophobicContact CD1-CB 4.3Å; L296-K351 HydrophobicContact CD2-CB 4.08Å; L296-I366 HydrophobicContact CB-CG2 4.23Å; L296-I366 HydrophobicContact CD1-CG2 3.93Å; L296-I366 HydrophobicContact CD2-CG2 4.23Å; L296-I366 HydrophobicContact CG-CG2 4.37Å; L296-G367 CarbonylContact C-O 3.52Å; L296-G367 WeakPolarHBondContact CA-O 3.36Å; L296-Y368 HydrophobicContact CD2-CD1 3.86Å; L296-Y368 HydrophobicContact CD2-CE1 4.17Å
297	F	95.4	Very high	85.9	Confident	71 Å²	71	47.6 Å²	47.6	31%	0.311	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	129.2	158.3	167.3	-92.9	0	0	0	108.4	Y336 F338 I366 G367	F297-Y336 HydrophobicContact CD2-CD2 4.07Å; F297-Y336 AromaticContact CE2-CD2 3.55Å; F297-Y336 HydrophobicContact CE2-CD2 3.55Å; F297-Y336 HydrophobicContact CE2-CE2 4.39Å; F297-Y336 AromaticContact CE2-CG 3.78Å; F297-Y336 HydrophobicContact CE2-CG 3.78Å; F297-Y336 HydrophobicContact CZ-CG 4.44Å; F297-F338 HydrophobicContact CB-CD1 4.23Å; F297-F338 HydrophobicContact CB-CE1 4.02Å; F297-F338 HydrophobicContact CD2-CD1 4.43Å; F297-F338 AromaticContact CD2-CE1 3.78Å; F297-F338 HydrophobicContact CD2-CE1 3.78Å; F297-F338 HydrophobicContact CD2-CZ 4.12Å; F297-F338 HydrophobicContact CG-CE1 4.4Å; F297-I366 VanDerWaalsContact O-CA 3.3Å; F297-I366 WeakPolarHBondContact O-CA 3.48Å; F297-G367 PolarHBondContact N-O 3.32Å; F297-G367 PolarHBondContact O-N 3.45Å
298	V	94.9	Very high	88.1	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	95.6	178.5	-172.3	0	0	0	0	108.1	L296 L301 F314 Y336 A337 V339 I359 C364 I366	L296-V298 HydrophobicContact CB-CG2 4.37Å; V298-L301 HydrophobicContact CB-CD1 4.45Å; V298-L301 HydrophobicContact CG1-CD1 4.12Å; V298-L301 HydrophobicContact CG1-CD2 3.92Å; V298-L301 HydrophobicContact CG1-CG 4.18Å; V298-F314 HydrophobicContact CB-CE2 4.46Å; V298-F314 HydrophobicContact CB-CZ 4.4Å; V298-F314 HydrophobicContact CG1-CE2 3.97Å; V298-F314 HydrophobicContact CG1-CZ 3.92Å; V298-F314 HydrophobicContact CG2-CE1 4.33Å; V298-F314 HydrophobicContact CG2-CE2 3.78Å; V298-F314 HydrophobicContact CG2-CZ 3.54Å; V298-Y336 CarbonylContact O-C 3.52Å; V298-Y336 VanDerWaalsContact O-CA 3.23Å; V298-Y336 WeakPolarHBondContact O-CA 3.28Å; V298-A337 HydrophobicContact CB-CB 4.44Å; V298-A337 PolarHBondContact N-O 2.84Å; V298-A337 PolarHBondContact O-N 2.9Å; V298-V339 HydrophobicContact CG2-CB 4.47Å; V298-V339 HydrophobicContact CG2-CG2 3.95Å; V298-I359 HydrophobicContact CG1-CD1 4.37Å; V298-C364 HydrophobicContact CG1-CB 3.99Å; V298-I366 HydrophobicContact CG1-CG1 4.39Å; V298-I366 HydrophobicContact CG2-CG1 4.49Å
299	G	93.1	Very high	89.7	Confident	5 Å²	5	46.3 Å²	46.3	5%	0.052	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	170.8	178.5	0	0	0	0	0	113.4	K365	G299-K365 PolarHBondContact N-O 3.01Å; G299-K365 PolarHBondContact O-N 2.66Å
300	S	92.2	Very high	91.2	Very high	30 Å²	30	45 Å²	45	21%	0.21	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	65	41	-178.6	-164.6	0	0	0	0	113.4	L362 H363	S300-L362 VanDerWaalsContact O-CB 3.24Å; S300-L362 WeakPolarHBondContact O-CB 3.1Å; S300-H363 WeakPolarHBondContact CB-O 3.44Å; S300-H363 PolarHBondContact OG-O 2.64Å
301	L	92.8	Very high	92.5	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	158.1	172.3	-59.2	176.5	0	0	0	111.1	V298 I305 V310 H334 S335 A337 I359 C364	V298-L301 HydrophobicContact CB-CD1 4.45Å; V298-L301 HydrophobicContact CG1-CD1 4.12Å; V298-L301 HydrophobicContact CG1-CD2 3.92Å; V298-L301 HydrophobicContact CG1-CG 4.18Å; L301-I305 HydrophobicContact CB-CG2 4.05Å; L301-I305 HydrophobicContact CD1-CG2 4.45Å; L301-V310 HydrophobicContact CD1-CG2 4.35Å; L301-H334 WeakPolarHBondContact O-CB 3.45Å; L301-S335 PolarHBondContact N-O 2.83Å; L301-S335 PolarHBondContact O-N 3.08Å; L301-A337 HydrophobicContact CD1-CB 3.74Å; L301-I359 HydrophobicContact CD2-CB 4.17Å; L301-I359 HydrophobicContact CD2-CD1 3.94Å; L301-I359 HydrophobicContact CD2-CG2 4.2Å; L301-C364 HydrophobicContact CD2-CB 4.23Å
302	E	90.8	Very high	93.3	Very high	27 Å²	27	41.1 Å²	41.1	13%	0.126	22%	0.218	C	C	.	.			trans	-66.5	151.1	178.7	-70	178	-166.1	0	0	111.8	D304 I305 S335 R360 S361 L362	E302-D304 PolarHBondContact O-N 3.04Å; E302-I305 VanDerWaalsContact O-CG2 3.22Å; E302-I305 WeakPolarHBondContact O-CG2 3.45Å; E302-I305 PolarHBondContact O-N 2.77Å; E302-S335 VanDerWaalsContact O-CB 3.27Å; E302-S335 WeakPolarHBondContact O-CB 3.49Å; E302-S335 PolarHBondContact O-OG 3.35Å; E302-R360 WeakPolarHBondContact OE1-CB 3.39Å; E302-R360 WeakPolarHBondContact OE2-CD 3.42Å; E302-R360 IonicContact OE2-CZ 3.08Å; E302-R360 IonicContact OE2-NE 3.73Å; E302-R360 IonicContact OE2-NH1 2.69Å; E302-R360 PolarHBondContact OE2-NH1 3.17Å; E302-S361 VanDerWaalsContact OE1-CB 3.29Å; E302-S361 WeakPolarHBondContact OE1-CB 3.46Å; E302-S361 PolarHBondContact OE1-N 3.42Å; E302-S361 PolarHBondContact OE1-OG 3.22Å; E302-L362 HydrophobicContact CG-CD1 3.65Å; E302-L362 HydrophobicContact CG-CG 3.83Å
303	P	89.4	Confident	93.5	Very high	82 Å²	82	41.6 Å²	41.6	53%	0.532	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-28.4	-174.3	25.6	-34.6	0	0	0	113.2	R327 S335	P303-R327 WeakPolarHBondContact O-CD 3.46Å; P303-R327 PolarHBondContact O-NH1 3.26Å; P303-S335 WeakPolarHBondContact CA-OG 3.36Å; P303-S335 PolarHBondContact O-OG 2.88Å
304	D	90.4	Very high	93.6	Very high	88 Å²	88	41.2 Å²	41.2	47%	0.471	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-6	-175.7	69.8	-59.9	0	0	0	114.3	E302 T306 R327 R360	E302-D304 PolarHBondContact O-N 3.04Å; D304-T306 PolarHBondContact O-N 3.46Å; D304-R327 PolarHBondContact O-NH1 3.44Å; D304-R360 IonicContact OD1-NH1 2.71Å; D304-R360 PolarHBondContact OD1-NH1 2.58Å; D304-R360 IonicContact OD2-CZ 3.21Å; D304-R360 IonicContact OD2-NH1 3.16Å; D304-R360 PolarHBondContact OD2-NH1 3.26Å; D304-R360 IonicContact OD2-NH2 2.83Å; D304-R360 PolarHBondContact OD2-NH2 3.3Å; D304-R360 VanDerWaalsContact OD2-NH2 3.08Å
305	I	91.7	Very high	93.7	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.242	C	C	.	.			trans	-42.4	133.1	-177.3	-167.4	65.3	0	0	0	113.2	L301 E302 E309 V310 I325 R327 I359 R360	L301-I305 HydrophobicContact CB-CG2 4.05Å; L301-I305 HydrophobicContact CD1-CG2 4.45Å; E302-I305 VanDerWaalsContact O-CG2 3.22Å; E302-I305 WeakPolarHBondContact O-CG2 3.45Å; E302-I305 PolarHBondContact O-N 2.77Å; I305-E309 HydrophobicContact CD1-CB 3.9Å; I305-V310 HydrophobicContact CG1-CG2 3.98Å; I305-I325 HydrophobicContact CG2-CD1 4.47Å; I305-I325 HydrophobicContact CG2-CG2 4.24Å; I305-R327 VanDerWaalsContact O-CZ 3.28Å; I305-R327 PolarHBondContact O-NH1 2.99Å; I305-R327 PolarHBondContact O-NH2 3.06Å; I305-I359 HydrophobicContact CD1-CG2 4.01Å; I305-R360 HydrophobicContact CD1-CG 4.34Å
306	T	93.9	Very high	93.6	Very high	60 Å²	60	53.8 Å²	53.8	37%	0.368	27%	0.27	S	S	.	.			trans	-94.1	157.4	-179.5	71.2	0	0	0	0	112.5	D304 K308 E309 V310	D304-T306 PolarHBondContact O-N 3.46Å; T306-K308 VanDerWaalsContact C-N 3.3Å; T306-K308 PolarHBondContact O-N 2.81Å; T306-E309 VanDerWaalsContact CB-OE2 3.3Å; T306-E309 WeakPolarHBondContact CB-OE2 3.42Å; T306-E309 WeakPolarHBondContact CG2-OE2 3.17Å; T306-E309 PolarHBondContact N-OE2 3.33Å; T306-E309 PolarHBondContact O-N 3.39Å; T306-E309 VanDerWaalsContact OG1-CD 3.32Å; T306-E309 VanDerWaalsContact OG1-CG 3.31Å; T306-E309 WeakPolarHBondContact OG1-CG 3.44Å; T306-E309 PolarHBondContact OG1-N 3.22Å; T306-E309 PolarHBondContact OG1-OE2 2.93Å; T306-V310 PolarHBondContact O-N 3.21Å
307	E	94.9	Very high	93.6	Very high	111 Å²	111	55.8 Å²	55.8	52%	0.519	28%	0.278	S	S	.	.	H	α-helix	trans	-61.3	-37.8	175.5	-174.3	171.8	-173.5	0	0	112.5	E309 V310 L311 I323 I325	E307-E309 VanDerWaalsContact C-N 3.29Å; E307-E309 PolarHBondContact O-N 3.48Å; E307-V310 PolarHBondContact O-N 3.17Å; E307-L311 WeakPolarHBondContact O-CB 3.37Å; E307-L311 PolarHBondContact O-N 3.42Å; E307-I323 HydrophobicContact CG-CB 3.98Å; E307-I323 HydrophobicContact CG-CD1 4.01Å; E307-I323 HydrophobicContact CG-CG2 4.09Å; E307-I325 HydrophobicContact CB-CD1 4.18Å
308	K	94.9	Very high	93.4	Very high	169 Å²	169	53.1 Å²	53.1	74%	0.735	27%	0.27	S	S	*	.	H	α-helix	trans	-60.9	-35.8	177.2	-64.5	-173.9	177.8	-175.8	0	112.6	T306 S312	T306-K308 VanDerWaalsContact C-N 3.3Å; T306-K308 PolarHBondContact O-N 2.81Å; K308-S312 VanDerWaalsContact O-CB 3.3Å; K308-S312 WeakPolarHBondContact O-CB 3.3Å; K308-S312 PolarHBondContact O-N 2.97Å; K308-S312 PolarHBondContact O-OG 2.7Å
309	E	94.1	Very high	93.3	Very high	63 Å²	63	60.2 Å²	60.2	29%	0.294	30%	0.298	S	S	.	.	H	α-helix	trans	-73.9	-39.2	177.4	-68.2	164.5	109.7	0	0	112	I305 T306 E307 S312 A313 R360	I305-E309 HydrophobicContact CD1-CB 3.9Å; T306-E309 VanDerWaalsContact CB-OE2 3.3Å; T306-E309 WeakPolarHBondContact CB-OE2 3.42Å; T306-E309 WeakPolarHBondContact CG2-OE2 3.17Å; T306-E309 PolarHBondContact N-OE2 3.33Å; T306-E309 PolarHBondContact O-N 3.39Å; T306-E309 VanDerWaalsContact OG1-CD 3.32Å; T306-E309 VanDerWaalsContact OG1-CG 3.31Å; T306-E309 WeakPolarHBondContact OG1-CG 3.44Å; T306-E309 PolarHBondContact OG1-N 3.22Å; T306-E309 PolarHBondContact OG1-OE2 2.93Å; E307-E309 VanDerWaalsContact C-N 3.29Å; E307-E309 PolarHBondContact O-N 3.48Å; E309-S312 PolarHBondContact O-N 3.29Å; E309-A313 WeakPolarHBondContact O-CB 3.45Å; E309-A313 PolarHBondContact O-N 3.37Å; E309-R360 IonicContact OE1-CZ 3.68Å; E309-R360 VanDerWaalsContact OE1-CZ 3.28Å; E309-R360 IonicContact OE1-NE 3.7Å; E309-R360 PolarHBondContact OE1-NE 3.03Å; E309-R360 IonicContact OE1-NH2 2.68Å; E309-R360 PolarHBondContact OE1-NH2 3.49Å; E309-R360 IonicContact OE2-CZ 2.69Å; E309-R360 IonicContact OE2-NE 3.04Å; E309-R360 IonicContact OE2-NH2 3.71Å; E309-R360 PolarHBondContact OE2-NH2 3.43Å
310	V	94.8	Very high	93.4	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64	-45.2	172.8	179.5	0	0	0	0	110.1	L301 I305 T306 E307 A313 F314 I323 I325 A337 V339	L301-V310 HydrophobicContact CD1-CG2 4.35Å; I305-V310 HydrophobicContact CG1-CG2 3.98Å; T306-V310 PolarHBondContact O-N 3.21Å; E307-V310 PolarHBondContact O-N 3.17Å; V310-A313 PolarHBondContact O-N 3.38Å; V310-F314 HydrophobicContact CG1-CD2 3.84Å; V310-F314 HydrophobicContact CG1-CE2 4.24Å; V310-F314 VanDerWaalsContact O-CD2 3.3Å; V310-F314 WeakPolarHBondContact O-CD2 3.34Å; V310-F314 PolarHBondContact O-N 2.95Å; V310-F314 VanDerWaalsContact O-N 3.09Å; V310-I323 HydrophobicContact CB-CD1 4.33Å; V310-I323 HydrophobicContact CB-CG2 4.4Å; V310-I323 HydrophobicContact CG1-CD1 4.13Å; V310-I323 HydrophobicContact CG1-CG2 3.99Å; V310-I325 HydrophobicContact CG2-CD1 3.92Å; V310-A337 HydrophobicContact CG1-CB 4.44Å; V310-V339 HydrophobicContact CG1-CG2 3.5Å; V310-V339 VanDerWaalsContact CG1-CG2 3.5Å
311	L	95.9	Very high	93.4	Very high	58 Å²	58	62 Å²	62	30%	0.304	30%	0.303	S	S	.	.	H	α-helix	trans	-56.9	-53.5	174.3	-174.9	64.6	0	0	0	110.9	E307 A313 F314 E315 V320 I323	E307-L311 WeakPolarHBondContact O-CB 3.37Å; E307-L311 PolarHBondContact O-N 3.42Å; L311-A313 PolarHBondContact O-N 3.04Å; L311-A313 VanDerWaalsContact O-N 3.12Å; L311-F314 PolarHBondContact O-N 3.23Å; L311-E315 HydrophobicContact CD1-CB 4.17Å; L311-E315 HydrophobicContact CG-CB 4.42Å; L311-E315 VanDerWaalsContact O-CB 3.22Å; L311-E315 WeakPolarHBondContact O-CB 3.41Å; L311-E315 PolarHBondContact O-N 3.27Å; L311-V320 HydrophobicContact CD1-CB 3.87Å; L311-V320 HydrophobicContact CD1-CG1 4.26Å; L311-V320 HydrophobicContact CD1-CG2 4.19Å; L311-I323 HydrophobicContact CB-CD1 3.76Å; L311-I323 HydrophobicContact CD1-CD1 4.12Å
312	S	94.5	Very high	93.4	Very high	70 Å²	70	66.9 Å²	66.9	49%	0.49	33%	0.326	S	S	.	.	H	α-helix	trans	-57.6	-29.6	178.8	-59.1	0	0	0	0	113.5	K308 E309 R316	K308-S312 VanDerWaalsContact O-CB 3.3Å; K308-S312 WeakPolarHBondContact O-CB 3.3Å; K308-S312 PolarHBondContact O-N 2.97Å; K308-S312 PolarHBondContact O-OG 2.7Å; E309-S312 PolarHBondContact O-N 3.29Å; S312-R316 PolarHBondContact O-NE 3.42Å; S312-R316 PolarHBondContact O-NH2 3.17Å
313	A	93.3	Very high	93.6	Very high	11 Å²	11	66.5 Å²	66.5	9%	0.091	32%	0.324	C	S	.	.	H	α-helix	trans	-75.6	-36.2	174.7	0	0	0	0	0	112.8	E309 V310 L311 R316 Y317 M354 I359	E309-A313 WeakPolarHBondContact O-CB 3.45Å; E309-A313 PolarHBondContact O-N 3.37Å; V310-A313 PolarHBondContact O-N 3.38Å; L311-A313 PolarHBondContact O-N 3.04Å; L311-A313 VanDerWaalsContact O-N 3.12Å; A313-R316 PolarHBondContact O-NE 3.49Å; A313-Y317 WeakPolarHBondContact O-CE2 3.33Å; A313-M354 HydrophobicContact CB-CE 4.23Å; A313-I359 HydrophobicContact CB-CD1 4.16Å; A313-I359 HydrophobicContact CB-CG1 4.4Å
314	F	95.4	Very high	93.9	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-104.9	-30.8	-167.8	-79.7	-71.2	0	0	0	116	L296 V298 V310 L311 R316 Y317 V320 V339 F341 A350 M354 I359 I366	L296-F314 HydrophobicContact CD1-CE1 4.26Å; V298-F314 HydrophobicContact CB-CE2 4.46Å; V298-F314 HydrophobicContact CB-CZ 4.4Å; V298-F314 HydrophobicContact CG1-CE2 3.97Å; V298-F314 HydrophobicContact CG1-CZ 3.92Å; V298-F314 HydrophobicContact CG2-CE1 4.33Å; V298-F314 HydrophobicContact CG2-CE2 3.78Å; V298-F314 HydrophobicContact CG2-CZ 3.54Å; V310-F314 HydrophobicContact CG1-CD2 3.84Å; V310-F314 HydrophobicContact CG1-CE2 4.24Å; V310-F314 VanDerWaalsContact O-CD2 3.3Å; V310-F314 WeakPolarHBondContact O-CD2 3.34Å; V310-F314 PolarHBondContact O-N 2.95Å; V310-F314 VanDerWaalsContact O-N 3.09Å; L311-F314 PolarHBondContact O-N 3.23Å; F314-R316 PolarHBondContact O-N 2.87Å; F314-Y317 HydrophobicContact CD1-CD2 4.48Å; F314-Y317 WeakPolarHBondContact O-CD2 3.3Å; F314-Y317 PolarHBondContact O-N 3.39Å; F314-V320 HydrophobicContact CB-CG2 4.33Å; F314-V339 HydrophobicContact CB-CG1 3.99Å; F314-V339 HydrophobicContact CD2-CG1 4.39Å; F314-V339 HydrophobicContact CD2-CG2 4.02Å; F314-V339 HydrophobicContact CE2-CG2 4.3Å; F314-V339 HydrophobicContact CG-CG1 4.06Å; F314-V339 HydrophobicContact CG-CG2 4.49Å; F314-F341 HydrophobicContact CB-CZ 3.92Å; F314-F341 HydrophobicContact CD1-CE2 4.32Å; F314-F341 HydrophobicContact CD1-CZ 4.02Å; F314-F341 HydrophobicContact CG-CZ 4.39Å; F314-F341 WeakPolarHBondContact O-CE1 3.43Å; F314-A350 HydrophobicContact CD1-CB 4.07Å; F314-A350 HydrophobicContact CE1-CB 4.43Å; F314-M354 HydrophobicContact CE1-CB 4.07Å; F314-M354 HydrophobicContact CE1-CG 4.09Å; F314-M354 HydrophobicContact CZ-CB 4.39Å; F314-I359 HydrophobicContact CE2-CD1 3.84Å; F314-I359 HydrophobicContact CZ-CD1 4.3Å; F314-I366 HydrophobicContact CE1-CD1 3.74Å; F314-I366 HydrophobicContact CZ-CD1 3.68Å
315	E	94.7	Very high	94.1	Very high	105 Å²	105	62.9 Å²	62.9	49%	0.491	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-56.3	-33.8	-177.6	-178.1	174.7	-151.6	0	0	113.2	L311 Y317 G318	L311-E315 HydrophobicContact CD1-CB 4.17Å; L311-E315 HydrophobicContact CG-CB 4.42Å; L311-E315 VanDerWaalsContact O-CB 3.22Å; L311-E315 WeakPolarHBondContact O-CB 3.41Å; L311-E315 PolarHBondContact O-N 3.27Å; E315-Y317 PolarHBondContact O-N 2.99Å; E315-G318 CarbonylContact O-C 3.51Å; E315-G318 PolarHBondContact O-N 3.46Å; E315-G318 VanDerWaalsContact O-O 3.06Å
316	R	93.4	Very high	94.2	Very high	178 Å²	178	66.5 Å²	66.5	67%	0.672	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-56.8	-13.9	175.3	70.9	-174.3	69.2	-152.3	-2.4	115.1	S312 A313 F314	S312-R316 PolarHBondContact O-NE 3.42Å; S312-R316 PolarHBondContact O-NH2 3.17Å; A313-R316 PolarHBondContact O-NE 3.49Å; F314-R316 PolarHBondContact O-N 2.87Å
317	Y	94.4	Very high	94.1	Very high	41 Å²	41	69.2 Å²	69.2	16%	0.161	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-103.5	-6.5	178.6	-54.3	-66.4	0	0	0	113.6	A313 F314 E315 R349 A350 S353 M354	A313-Y317 WeakPolarHBondContact O-CE2 3.33Å; F314-Y317 HydrophobicContact CD1-CD2 4.48Å; F314-Y317 WeakPolarHBondContact O-CD2 3.3Å; F314-Y317 PolarHBondContact O-N 3.39Å; E315-Y317 PolarHBondContact O-N 2.99Å; Y317-R349 PolarHBondContact O-NE 2.95Å; Y317-R349 PolarHBondContact O-NH2 3.2Å; Y317-A350 HydrophobicContact CD2-CB 3.8Å; Y317-A350 HydrophobicContact CG-CB 3.9Å; Y317-S353 WeakPolarHBondContact CE1-OG 3.33Å; Y317-S353 VanDerWaalsContact CZ-CB 3.5Å; Y317-M354 HydrophobicContact CD2-CG 4.27Å; Y317-M354 HydrophobicContact CE2-CG 3.29Å; Y317-M354 HydrophobicContact CE2-SD 3.92Å; Y317-M354 WeakPolarHBondContact OH-CG 3.42Å; Y317-M354 PolarHBondContact OH-SD 3Å
318	G	92.3	Very high	93.4	Very high	15 Å²	15	66.3 Å²	66.3	16%	0.155	31%	0.312	C	S	.	.	S	Bend	trans	146.3	168.8	-179.5	0	0	0	0	0	112.4	E315 V320 F341	E315-G318 CarbonylContact O-C 3.51Å; E315-G318 PolarHBondContact O-N 3.46Å; E315-G318 VanDerWaalsContact O-O 3.06Å; G318-V320 PolarHBondContact O-N 3.34Å; G318-F341 WeakPolarHBondContact O-CD1 3.45Å; G318-F341 WeakPolarHBondContact O-CE1 3.34Å
319	Y	93.1	Very high	92.8	Very high	149 Å²	149	66.8 Å²	66.8	58%	0.584	32%	0.321	S	S	*	.			trans	-62.1	125.9	-177	-171.4	-98.3	0	0	0	111.9	F341 Q342 M346	Y319-F341 WeakPolarHBondContact O-CA 3.4Å; Y319-Q342 HydrophobicContact CD1-CB 4.31Å; Y319-Q342 PolarHBondContact O-N 2.73Å; Y319-M346 PolarHBondContact N-SD 3.24Å; Y319-M346 VanDerWaalsContact N-SD 3.43Å
320	V	94.4	Very high	92.2	Very high	16 Å²	16	70 Å²	70	10%	0.097	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	119.7	176.4	179.5	0	0	0	0	108.4	L311 F314 G318 I323 V339 R340 F341	L311-V320 HydrophobicContact CD1-CB 3.87Å; L311-V320 HydrophobicContact CD1-CG1 4.26Å; L311-V320 HydrophobicContact CD1-CG2 4.19Å; F314-V320 HydrophobicContact CB-CG2 4.33Å; G318-V320 PolarHBondContact O-N 3.34Å; V320-I323 HydrophobicContact CG1-CD1 4.12Å; V320-I323 HydrophobicContact CG1-CG1 3.66Å; V320-V339 HydrophobicContact CG1-CG1 3.9Å; V320-V339 HydrophobicContact CG2-CG1 4.17Å; V320-R340 CarbonylContact C-O 3.33Å; V320-F341 HydrophobicContact CG2-CD1 4.1Å; V320-F341 HydrophobicContact CG2-CE1 3.77Å; V320-F341 HydrophobicContact CG2-CZ 4.17Å
321	E	92	Very high	91.4	Very high	56 Å²	56	76.4 Å²	76.4	26%	0.262	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-34.4	-178.3	-174.9	-165.7	168.6	0	0	112	R294 R340 N449	R294-E321 IonicContact CZ-OE2 3.24Å; R294-E321 VanDerWaalsContact NH1-CD 3.28Å; R294-E321 IonicContact NH1-OE1 2.91Å; R294-E321 PolarHBondContact NH1-OE1 3.06Å; R294-E321 VanDerWaalsContact NH1-OE1 3.12Å; R294-E321 IonicContact NH1-OE2 2.91Å; R294-E321 PolarHBondContact NH1-OE2 3.5Å; E321-R340 HydrophobicContact CB-CG 4.35Å; E321-R340 PolarHBondContact N-O 2.73Å; E321-R340 IonicContact OE1-CZ 3.5Å; E321-R340 IonicContact OE1-NE 2.65Å; E321-R340 PolarHBondContact OE1-NE 3.13Å; E321-R340 VanDerWaalsContact OE1-NE 3.16Å; E321-R340 IonicContact OE1-NH2 2.83Å; E321-R340 PolarHBondContact OE1-NH2 3.17Å; E321-R340 WeakPolarHBondContact OE2-CG 3.42Å; E321-R340 IonicContact OE2-CZ 3.29Å; E321-R340 IonicContact OE2-NE 3.67Å; E321-R340 PolarHBondContact OE2-NE 3.26Å; E321-R340 IonicContact OE2-NH2 2.71Å; E321-N449 VanDerWaalsContact OE1-CG 3.26Å; E321-N449 PolarHBondContact OE1-ND2 3.28Å; E321-N449 PolarHBondContact OE1-OD1 2.87Å
322	Q	93.2	Very high	90.5	Very high	104 Å²	104	77.5 Å²	77.5	49%	0.486	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	142.2	-177.6	-170.1	177.3	28.9	0	0	111.5	R340	Q322-R340 HydrophobicContact CB-CB 4.13Å; Q322-R340 PolarHBondContact N-O 2.83Å; Q322-R340 PolarHBondContact O-N 3.18Å
323	I	95.6	Very high	90.1	Very high	19 Å²	19	75.8 Å²	75.8	10%	0.097	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	139.1	167.2	-56	176.1	0	0	0	108.8	E307 V310 L311 V320 I325 F338 V339	E307-I323 HydrophobicContact CG-CB 3.98Å; E307-I323 HydrophobicContact CG-CD1 4.01Å; E307-I323 HydrophobicContact CG-CG2 4.09Å; V310-I323 HydrophobicContact CB-CD1 4.33Å; V310-I323 HydrophobicContact CB-CG2 4.4Å; V310-I323 HydrophobicContact CG1-CD1 4.13Å; V310-I323 HydrophobicContact CG1-CG2 3.99Å; L311-I323 HydrophobicContact CB-CD1 3.76Å; L311-I323 HydrophobicContact CD1-CD1 4.12Å; V320-I323 HydrophobicContact CG1-CD1 4.12Å; V320-I323 HydrophobicContact CG1-CG1 3.66Å; I323-I325 HydrophobicContact CG2-CD1 4.49Å; I323-I325 HydrophobicContact CG2-CG1 3.94Å; I323-F338 CarbonylContact C-O 3.5Å; I323-F338 WeakPolarHBondContact CA-O 3.47Å; I323-V339 HydrophobicContact CG2-CG2 4.48Å
324	D	95.1	Very high	89.8	Confident	58 Å²	58	79.9 Å²	79.9	31%	0.31	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	96.9	177.6	172.6	7.3	0	0	0	109.2	K326 A337 F338	D324-K326 IonicContact OD1-NZ 3.64Å; D324-K326 PolarHBondContact OD1-NZ 3.46Å; D324-K326 WeakPolarHBondContact OD2-CE 3.46Å; D324-K326 IonicContact OD2-NZ 2.69Å; D324-K326 PolarHBondContact OD2-NZ 2.83Å; D324-A337 CarbonylContact O-C 3.53Å; D324-A337 VanDerWaalsContact O-CA 3.3Å; D324-A337 WeakPolarHBondContact O-CA 3.45Å; D324-F338 HydrophobicContact CB-CB 4.33Å; D324-F338 PolarHBondContact N-O 2.78Å; D324-F338 PolarHBondContact O-N 2.88Å
325	I	95.1	Very high	89.7	Confident	37 Å²	37	80 Å²	80	19%	0.19	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	117	-179.8	-58	-178.4	0	0	0	110.2	I305 E307 V310 I323 R327 A337	I305-I325 HydrophobicContact CG2-CD1 4.47Å; I305-I325 HydrophobicContact CG2-CG2 4.24Å; E307-I325 HydrophobicContact CB-CD1 4.18Å; V310-I325 HydrophobicContact CG2-CD1 3.92Å; I323-I325 HydrophobicContact CG2-CD1 4.49Å; I323-I325 HydrophobicContact CG2-CG1 3.94Å; I325-R327 HydrophobicContact CG2-CG 4.3Å; I325-A337 HydrophobicContact CG1-CB 4.05Å
326	K	93.6	Very high	89.6	Confident	76 Å²	76	78.8 Å²	78.8	33%	0.33	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	105.8	175.9	-57.5	-156.6	-173.3	-55.1	0	110.2	D324 Y336 F338	D324-K326 IonicContact OD1-NZ 3.64Å; D324-K326 PolarHBondContact OD1-NZ 3.46Å; D324-K326 WeakPolarHBondContact OD2-CE 3.46Å; D324-K326 IonicContact OD2-NZ 2.69Å; D324-K326 PolarHBondContact OD2-NZ 2.83Å; K326-Y336 HydrophobicContact CB-CD1 4.31Å; K326-Y336 HydrophobicContact CB-CD2 4.1Å; K326-Y336 HydrophobicContact CB-CE1 3.83Å; K326-Y336 HydrophobicContact CB-CE2 3.63Å; K326-Y336 HydrophobicContact CB-CG 4.43Å; K326-Y336 VanDerWaalsContact CB-CZ 3.47Å; K326-Y336 HydrophobicContact CD-CE2 3.89Å; K326-Y336 HydrophobicContact CG-CE2 4.03Å; K326-Y336 PolarHBondContact N-O 2.96Å; K326-Y336 WeakPolarHBondContact O-CD1 3.36Å; K326-Y336 PolarHBondContact O-N 3.16Å; K326-Y336 VanDerWaalsContact O-N 3.1Å; K326-F338 HydrophobicContact CD-CE2 4.32Å
327	R	91	Very high	89.8	Confident	117 Å²	117	70.3 Å²	70.3	44%	0.442	37%	0.368	S	S	.	.			trans	-81.6	139.6	173.1	-54.3	-176.8	-163.6	-74.4	-6.6	109.5	P303 D304 I305 I325	P303-R327 WeakPolarHBondContact O-CD 3.46Å; P303-R327 PolarHBondContact O-NH1 3.26Å; D304-R327 PolarHBondContact O-NH1 3.44Å; I305-R327 VanDerWaalsContact O-CZ 3.28Å; I305-R327 PolarHBondContact O-NH1 2.99Å; I305-R327 PolarHBondContact O-NH2 3.06Å; I325-R327 HydrophobicContact CG2-CG 4.3Å
328	S	81.6	Confident	89.9	Confident	51 Å²	51	71.1 Å²	71.1	36%	0.357	37%	0.373	S	S	.	.			trans	-82	132.1	178.7	-66.2	0	0	0	0	110.6	K330 H334	S328-K330 PolarHBondContact O-N 2.92Å; S328-H334 PolarHBondContact OG-O 3.43Å
329	L	80.5	Confident	90.1	Very high	178 Å²	178	70.4 Å²	70.4	93%	0.932	37%	0.366	S	S	*	.	S	Bend	trans	-70.4	-11.2	177.1	-80.8	74.8	0	0	0	113.7
330	K	81.7	Confident	90.1	Very high	132 Å²	132	64.8 Å²	64.8	57%	0.574	34%	0.343	S	S	*	.	S	Bend	trans	-80.9	126.5	174.6	-65.6	-170.2	178.9	-167.3	0	109.3	S266 S328 G332 A333	S266-K330 PolarHBondContact OG-NZ 2.82Å; S328-K330 PolarHBondContact O-N 2.92Å; K330-G332 PolarHBondContact O-N 3.1Å; K330-A333 HydrophobicContact CB-CB 3.96Å; K330-A333 WeakPolarHBondContact O-CB 2.94Å; K330-A333 PolarHBondContact O-N 2.91Å; K330-A333 VanDerWaalsContact O-N 3.16Å
331	P	77.8	Confident	90.2	Very high	133 Å²	133	64 Å²	64	86%	0.864	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	140.5	175	25.3	-33.8	0	0	0	110.6	A333	P331-A333 PolarHBondContact O-N 3.36Å
332	G	78.5	Confident	90.1	Very high	81 Å²	81	64 Å²	64	84%	0.835	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	-4.7	-177	0	0	0	0	0	116	K330	K330-G332 PolarHBondContact O-N 3.1Å
333	A	84.8	Confident	90.1	Very high	34 Å²	34	60.1 Å²	60.1	28%	0.281	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-82	131.1	175.4	0	0	0	0	0	111.5	K330 P331	K330-A333 HydrophobicContact CB-CB 3.96Å; K330-A333 WeakPolarHBondContact O-CB 2.94Å; K330-A333 PolarHBondContact O-N 2.91Å; K330-A333 VanDerWaalsContact O-N 3.16Å; P331-A333 PolarHBondContact O-N 3.36Å
334	H	88.4	Confident	89.9	Confident	98 Å²	98	59.2 Å²	59.2	45%	0.454	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-56.4	151	179.3	-59.2	-63.6	0	0	0	113.3	L301 S328 L362	L301-H334 WeakPolarHBondContact O-CB 3.45Å; S328-H334 PolarHBondContact OG-O 3.43Å; H334-L362 WeakPolarHBondContact ND1-CD1 3.46Å
335	S	92	Very high	89.7	Confident	2 Å²	2	58 Å²	58	1%	0.014	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	161.3	165.3	-62.4	0	0	0	0	110.8	L301 E302 P303	L301-S335 PolarHBondContact N-O 2.83Å; L301-S335 PolarHBondContact O-N 3.08Å; E302-S335 VanDerWaalsContact O-CB 3.27Å; E302-S335 WeakPolarHBondContact O-CB 3.49Å; E302-S335 PolarHBondContact O-OG 3.35Å; P303-S335 WeakPolarHBondContact CA-OG 3.36Å; P303-S335 PolarHBondContact O-OG 2.88Å
336	Y	94.2	Very high	89.7	Confident	80 Å²	80	57.7 Å²	57.7	31%	0.314	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	153.4	164	59.7	-80.5	0	0	0	109.9	F297 V298 K326 F338	F297-Y336 HydrophobicContact CD2-CD2 4.07Å; F297-Y336 AromaticContact CE2-CD2 3.55Å; F297-Y336 HydrophobicContact CE2-CD2 3.55Å; F297-Y336 HydrophobicContact CE2-CE2 4.39Å; F297-Y336 AromaticContact CE2-CG 3.78Å; F297-Y336 HydrophobicContact CE2-CG 3.78Å; F297-Y336 HydrophobicContact CZ-CG 4.44Å; V298-Y336 CarbonylContact O-C 3.52Å; V298-Y336 VanDerWaalsContact O-CA 3.23Å; V298-Y336 WeakPolarHBondContact O-CA 3.28Å; K326-Y336 HydrophobicContact CB-CD1 4.31Å; K326-Y336 HydrophobicContact CB-CD2 4.1Å; K326-Y336 HydrophobicContact CB-CE1 3.83Å; K326-Y336 HydrophobicContact CB-CE2 3.63Å; K326-Y336 HydrophobicContact CB-CG 4.43Å; K326-Y336 VanDerWaalsContact CB-CZ 3.47Å; K326-Y336 HydrophobicContact CD-CE2 3.89Å; K326-Y336 HydrophobicContact CG-CE2 4.03Å; K326-Y336 PolarHBondContact N-O 2.96Å; K326-Y336 WeakPolarHBondContact O-CD1 3.36Å; K326-Y336 PolarHBondContact O-N 3.16Å; K326-Y336 VanDerWaalsContact O-N 3.1Å; Y336-F338 HydrophobicContact CD2-CE2 4.15Å; Y336-F338 HydrophobicContact CD2-CZ 4.35Å; Y336-F338 AromaticContact CE2-CE2 3.8Å; Y336-F338 HydrophobicContact CE2-CE2 3.8Å; Y336-F338 HydrophobicContact CE2-CZ 4.12Å
337	A	95.7	Very high	89.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	151	175.6	0	0	0	0	0	110.8	V298 L301 V310 D324 I325 V339	V298-A337 HydrophobicContact CB-CB 4.44Å; V298-A337 PolarHBondContact N-O 2.84Å; V298-A337 PolarHBondContact O-N 2.9Å; L301-A337 HydrophobicContact CD1-CB 3.74Å; V310-A337 HydrophobicContact CG1-CB 4.44Å; D324-A337 CarbonylContact O-C 3.53Å; D324-A337 VanDerWaalsContact O-CA 3.3Å; D324-A337 WeakPolarHBondContact O-CA 3.45Å; I325-A337 HydrophobicContact CG1-CB 4.05Å; A337-V339 HydrophobicContact CB-CG2 4.39Å
338	F	96.5	Very high	89.8	Confident	58 Å²	58	49 Å²	49	25%	0.254	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	126	156.3	-62.2	-75.5	0	0	0	108.7	T295 L296 F297 I323 D324 K326 Y336	T295-F338 HydrophobicContact CG2-CB 4.05Å; T295-F338 HydrophobicContact CG2-CD1 4.24Å; L296-F338 CarbonylContact O-C 3.12Å; L296-F338 VanDerWaalsContact O-CA 3.27Å; L296-F338 WeakPolarHBondContact O-CA 3.26Å; F297-F338 HydrophobicContact CB-CD1 4.23Å; F297-F338 HydrophobicContact CB-CE1 4.02Å; F297-F338 HydrophobicContact CD2-CD1 4.43Å; F297-F338 AromaticContact CD2-CE1 3.78Å; F297-F338 HydrophobicContact CD2-CE1 3.78Å; F297-F338 HydrophobicContact CD2-CZ 4.12Å; F297-F338 HydrophobicContact CG-CE1 4.4Å; I323-F338 CarbonylContact C-O 3.5Å; I323-F338 WeakPolarHBondContact CA-O 3.47Å; D324-F338 HydrophobicContact CB-CB 4.33Å; D324-F338 PolarHBondContact N-O 2.78Å; D324-F338 PolarHBondContact O-N 2.88Å; K326-F338 HydrophobicContact CD-CE2 4.32Å; Y336-F338 HydrophobicContact CD2-CE2 4.15Å; Y336-F338 HydrophobicContact CD2-CZ 4.35Å; Y336-F338 AromaticContact CE2-CE2 3.8Å; Y336-F338 HydrophobicContact CE2-CE2 3.8Å; Y336-F338 HydrophobicContact CE2-CZ 4.12Å
339	V	96.4	Very high	90.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	112.1	178.6	-179.7	0	0	0	0	107.6	L296 V298 V310 F314 V320 I323 A337 F341	L296-V339 PolarHBondContact N-O 2.94Å; L296-V339 PolarHBondContact O-N 2.92Å; V298-V339 HydrophobicContact CG2-CB 4.47Å; V298-V339 HydrophobicContact CG2-CG2 3.95Å; V310-V339 HydrophobicContact CG1-CG2 3.5Å; V310-V339 VanDerWaalsContact CG1-CG2 3.5Å; F314-V339 HydrophobicContact CB-CG1 3.99Å; F314-V339 HydrophobicContact CD2-CG1 4.39Å; F314-V339 HydrophobicContact CD2-CG2 4.02Å; F314-V339 HydrophobicContact CE2-CG2 4.3Å; F314-V339 HydrophobicContact CG-CG1 4.06Å; F314-V339 HydrophobicContact CG-CG2 4.49Å; V320-V339 HydrophobicContact CG1-CG1 3.9Å; V320-V339 HydrophobicContact CG2-CG1 4.17Å; I323-V339 HydrophobicContact CG2-CG2 4.48Å; A337-V339 HydrophobicContact CB-CG2 4.39Å; V339-F341 HydrophobicContact CG1-CD2 4.41Å; V339-F341 HydrophobicContact CG1-CE2 3.87Å; V339-F341 HydrophobicContact CG1-CZ 4.29Å
340	R	94.9	Very high	91	Very high	31 Å²	31	44.9 Å²	44.9	12%	0.117	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	117.9	-175.8	178.1	174.2	159.5	177.4	-4.6	109.2	R294 V320 E321 Q322 N449	R294-R340 HydrophobicContact CG-CG 4.44Å; V320-R340 CarbonylContact C-O 3.33Å; E321-R340 HydrophobicContact CB-CG 4.35Å; E321-R340 PolarHBondContact N-O 2.73Å; E321-R340 IonicContact OE1-CZ 3.5Å; E321-R340 IonicContact OE1-NE 2.65Å; E321-R340 PolarHBondContact OE1-NE 3.13Å; E321-R340 VanDerWaalsContact OE1-NE 3.16Å; E321-R340 IonicContact OE1-NH2 2.83Å; E321-R340 PolarHBondContact OE1-NH2 3.17Å; E321-R340 WeakPolarHBondContact OE2-CG 3.42Å; E321-R340 IonicContact OE2-CZ 3.29Å; E321-R340 IonicContact OE2-NE 3.67Å; E321-R340 PolarHBondContact OE2-NE 3.26Å; E321-R340 IonicContact OE2-NH2 2.71Å; Q322-R340 HydrophobicContact CB-CB 4.13Å; Q322-R340 PolarHBondContact N-O 2.83Å; Q322-R340 PolarHBondContact O-N 3.18Å; R340-N449 PolarHBondContact NH2-OD1 3.41Å
341	F	95.1	Very high	91.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	161.6	173.4	-71.5	-91.9	0	0	0	110.9	R294 L296 F314 G318 Y319 V320 V339 N343 M346 A347 A350	R294-F341 WeakPolarHBondContact CB-O 3.15Å; R294-F341 VanDerWaalsContact CD-O 3.24Å; R294-F341 WeakPolarHBondContact CD-O 3.47Å; R294-F341 PolarHBondContact O-N 3.06Å; L296-F341 HydrophobicContact CD1-CD2 4.49Å; L296-F341 HydrophobicContact CD1-CE2 3.85Å; L296-F341 HydrophobicContact CG-CE2 4.31Å; F314-F341 HydrophobicContact CB-CZ 3.92Å; F314-F341 HydrophobicContact CD1-CE2 4.32Å; F314-F341 HydrophobicContact CD1-CZ 4.02Å; F314-F341 HydrophobicContact CG-CZ 4.39Å; F314-F341 WeakPolarHBondContact O-CE1 3.43Å; G318-F341 WeakPolarHBondContact O-CD1 3.45Å; G318-F341 WeakPolarHBondContact O-CE1 3.34Å; Y319-F341 WeakPolarHBondContact O-CA 3.4Å; V320-F341 HydrophobicContact CG2-CD1 4.1Å; V320-F341 HydrophobicContact CG2-CE1 3.77Å; V320-F341 HydrophobicContact CG2-CZ 4.17Å; V339-F341 HydrophobicContact CG1-CD2 4.41Å; V339-F341 HydrophobicContact CG1-CE2 3.87Å; V339-F341 HydrophobicContact CG1-CZ 4.29Å; F341-N343 VanDerWaalsContact C-N 3.35Å; F341-N343 PolarHBondContact O-N 3.2Å; F341-M346 HydrophobicContact CB-CB 3.91Å; F341-M346 HydrophobicContact CD1-CB 3.67Å; F341-M346 HydrophobicContact CE1-CB 4.46Å; F341-M346 HydrophobicContact CG-CB 3.96Å; F341-A347 HydrophobicContact CB-CB 4.26Å; F341-A347 HydrophobicContact CD2-CB 3.76Å; F341-A347 HydrophobicContact CG-CB 4.27Å; F341-A350 HydrophobicContact CE1-CB 4.3Å; F341-A350 HydrophobicContact CE2-CB 3.67Å; F341-A350 HydrophobicContact CZ-CB 3.44Å; F341-A350 VanDerWaalsContact CZ-CB 3.44Å
342	Q	91.6	Very high	92.3	Very high	56 Å²	56	37.5 Å²	37.5	26%	0.262	20%	0.196	S	C	.	.	S	Bend	trans	-54.4	-49.2	171.9	-163.4	-178.5	30.2	0	0	112.1	Y319 M346 L452	Y319-Q342 HydrophobicContact CD1-CB 4.31Å; Y319-Q342 PolarHBondContact O-N 2.73Å; Q342-M346 HydrophobicContact CB-CE 4.36Å; Q342-M346 HydrophobicContact CB-SD 3.99Å; Q342-L452 HydrophobicContact CG-CD1 3.78Å; Q342-L452 HydrophobicContact CG-CD2 4.36Å
343	N	91.2	Very high	93	Very high	21 Å²	21	35.9 Å²	35.9	11%	0.112	17%	0.172	C	C	.	.	S	Bend	trans	-128.2	149.7	-174.7	-60.2	-13.3	0	0	0	111.8	F341 D345 M346 A347 Y378	F341-N343 VanDerWaalsContact C-N 3.35Å; F341-N343 PolarHBondContact O-N 3.2Å; N343-D345 PolarHBondContact O-N 2.86Å; N343-M346 HydrophobicContact CB-CG 4.42Å; N343-M346 WeakPolarHBondContact O-CB 3.36Å; N343-M346 PolarHBondContact O-N 2.93Å; N343-M346 VanDerWaalsContact O-N 3.1Å; N343-A347 PolarHBondContact O-N 3.25Å; N343-Y378 HydrophobicContact CB-CD1 4.39Å; N343-Y378 HydrophobicContact CB-CD2 4.36Å; N343-Y378 HydrophobicContact CB-CE1 4.04Å; N343-Y378 HydrophobicContact CB-CE2 4.03Å; N343-Y378 VanDerWaalsContact CG-CE2 3.5Å; N343-Y378 VanDerWaalsContact ND2-CE2 3.27Å; N343-Y378 WeakPolarHBondContact ND2-CE2 3.09Å
344	V	92.5	Very high	93.3	Very high	1 Å²	1	35 Å²	35	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-58.9	-29.8	177.1	63.3	0	0	0	0	113.6	A292 M346 A347 S348 Y378 R444 D446	A292-V344 HydrophobicContact CB-CG2 3.89Å; V344-M346 PolarHBondContact O-N 2.92Å; V344-A347 PolarHBondContact O-N 3.5Å; V344-S348 PolarHBondContact O-N 3.37Å; V344-Y378 HydrophobicContact CG1-CD1 3.78Å; V344-Y378 HydrophobicContact CG1-CE1 4.05Å; V344-R444 HydrophobicContact CG1-CB 3.87Å; V344-R444 WeakPolarHBondContact CG1-O 3.48Å; V344-R444 HydrophobicContact CG2-CB 4.26Å; V344-D446 HydrophobicContact CB-CB 4.09Å; V344-D446 HydrophobicContact CG2-CB 4.46Å
345	D	91.4	Very high	93.4	Very high	33 Å²	33	33 Å²	33	18%	0.176	16%	0.159	C	C	.	.	H	α-helix	trans	-64.2	-39	176.2	-83.5	18.4	0	0	0	112.5	N343 S348 R349 R444	N343-D345 PolarHBondContact O-N 2.86Å; D345-S348 PolarHBondContact O-N 2.75Å; D345-R349 WeakPolarHBondContact O-CG 3.45Å; D345-R349 PolarHBondContact O-N 3.48Å; D345-R444 IonicContact OD1-CZ 3.59Å; D345-R444 VanDerWaalsContact OD1-CZ 3.24Å; D345-R444 IonicContact OD1-NE 2.75Å; D345-R444 PolarHBondContact OD1-NE 3.46Å; D345-R444 IonicContact OD1-NH2 3.75Å; D345-R444 PolarHBondContact OD1-NH2 3.2Å; D345-R444 IonicContact OD2-CZ 3.94Å; D345-R444 IonicContact OD2-NH2 3.21Å; D345-R444 PolarHBondContact OD2-NH2 3.34Å
346	M	93.7	Very high	93.2	Very high	30 Å²	30	35 Å²	35	15%	0.148	18%	0.181	C	C	.	.	H	α-helix	trans	-66.9	-45.6	176	-59.3	177.3	-176.6	0	0	110.6	Y319 F341 Q342 N343 V344 S348 R349 A350	Y319-M346 PolarHBondContact N-SD 3.24Å; Y319-M346 VanDerWaalsContact N-SD 3.43Å; F341-M346 HydrophobicContact CB-CB 3.91Å; F341-M346 HydrophobicContact CD1-CB 3.67Å; F341-M346 HydrophobicContact CE1-CB 4.46Å; F341-M346 HydrophobicContact CG-CB 3.96Å; Q342-M346 HydrophobicContact CB-CE 4.36Å; Q342-M346 HydrophobicContact CB-SD 3.99Å; N343-M346 HydrophobicContact CB-CG 4.42Å; N343-M346 WeakPolarHBondContact O-CB 3.36Å; N343-M346 PolarHBondContact O-N 2.93Å; N343-M346 VanDerWaalsContact O-N 3.1Å; V344-M346 PolarHBondContact O-N 2.92Å; M346-S348 VanDerWaalsContact C-N 3.31Å; M346-S348 PolarHBondContact O-N 3.32Å; M346-R349 PolarHBondContact O-N 3.3Å; M346-A350 WeakPolarHBondContact O-CB 3.32Å; M346-A350 PolarHBondContact O-N 2.94Å
347	A	94.6	Very high	93	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-59.9	-39.1	175.1	0	0	0	0	0	112.4	T293 L296 F341 N343 V344 A350 K351	T293-A347 WeakPolarHBondContact O-CB 3.45Å; L296-A347 HydrophobicContact CD2-CB 4.01Å; L296-A347 HydrophobicContact CG-CB 4.09Å; F341-A347 HydrophobicContact CB-CB 4.26Å; F341-A347 HydrophobicContact CD2-CB 3.76Å; F341-A347 HydrophobicContact CG-CB 4.27Å; N343-A347 PolarHBondContact O-N 3.25Å; V344-A347 PolarHBondContact O-N 3.5Å; A347-A350 PolarHBondContact O-N 3.19Å; A347-K351 WeakPolarHBondContact O-CB 3.45Å; A347-K351 PolarHBondContact O-N 2.77Å
348	S	92.6	Very high	92.7	Very high	9 Å²	9	44.6 Å²	44.6	6%	0.063	22%	0.22	C	C	.	.	H	α-helix	trans	-67.4	-44.7	176.5	-145.2	0	0	0	0	111.9	V344 D345 M346 A350 K351 M352 Y368	V344-S348 PolarHBondContact O-N 3.37Å; D345-S348 PolarHBondContact O-N 2.75Å; M346-S348 VanDerWaalsContact C-N 3.31Å; M346-S348 PolarHBondContact O-N 3.32Å; S348-A350 VanDerWaalsContact C-N 3.33Å; S348-A350 PolarHBondContact O-N 2.78Å; S348-K351 PolarHBondContact O-N 3.22Å; S348-M352 PolarHBondContact O-N 2.62Å; S348-Y368 PolarHBondContact OG-OH 2.91Å
349	R	93.2	Very high	92.3	Very high	143 Å²	143	42.4 Å²	42.4	54%	0.54	21%	0.21	S	C	.	.	H	α-helix	trans	-58.8	-43.5	173.7	-68.4	-171.8	-51.3	-165.3	6	112.1	Y317 D345 M346 M352 S353	Y317-R349 PolarHBondContact O-NE 2.95Å; Y317-R349 PolarHBondContact O-NH2 3.2Å; D345-R349 WeakPolarHBondContact O-CG 3.45Å; D345-R349 PolarHBondContact O-N 3.48Å; M346-R349 PolarHBondContact O-N 3.3Å; R349-M352 PolarHBondContact O-N 3.39Å; R349-S353 WeakPolarHBondContact O-CB 3.43Å; R349-S353 PolarHBondContact O-N 3.14Å; R349-S353 PolarHBondContact O-OG 2.87Å
350	A	95	Very high	91.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-49.2	176.2	0	0	0	0	0	112	L296 F314 Y317 F341 M346 A347 S348 M352 S353 M354	L296-A350 HydrophobicContact CD1-CB 3.8Å; F314-A350 HydrophobicContact CD1-CB 4.07Å; F314-A350 HydrophobicContact CE1-CB 4.43Å; Y317-A350 HydrophobicContact CD2-CB 3.8Å; Y317-A350 HydrophobicContact CG-CB 3.9Å; F341-A350 HydrophobicContact CE1-CB 4.3Å; F341-A350 HydrophobicContact CE2-CB 3.67Å; F341-A350 HydrophobicContact CZ-CB 3.44Å; F341-A350 VanDerWaalsContact CZ-CB 3.44Å; M346-A350 WeakPolarHBondContact O-CB 3.32Å; M346-A350 PolarHBondContact O-N 2.94Å; A347-A350 PolarHBondContact O-N 3.19Å; S348-A350 VanDerWaalsContact C-N 3.33Å; S348-A350 PolarHBondContact O-N 2.78Å; A350-M352 PolarHBondContact O-N 3.24Å; A350-S353 PolarHBondContact O-N 3.46Å; A350-M354 WeakPolarHBondContact O-CB 3.46Å; A350-M354 PolarHBondContact O-N 3.33Å
351	K	93.8	Very high	91.5	Very high	16 Å²	16	49.1 Å²	49.1	7%	0.07	25%	0.248	C	C	.	.	H	α-helix	trans	-58.2	-49.5	176.3	171.4	173.4	153	-75.4	0	111.9	L296 A347 S348 S353 S355 I366 Y368	L296-K351 HydrophobicContact CD1-CB 4.3Å; L296-K351 HydrophobicContact CD2-CB 4.08Å; A347-K351 WeakPolarHBondContact O-CB 3.45Å; A347-K351 PolarHBondContact O-N 2.77Å; S348-K351 PolarHBondContact O-N 3.22Å; K351-S353 PolarHBondContact O-N 2.89Å; K351-S355 VanDerWaalsContact O-CB 3.26Å; K351-S355 WeakPolarHBondContact O-CB 3.48Å; K351-S355 PolarHBondContact O-N 3.47Å; K351-S355 PolarHBondContact O-OG 3Å; K351-I366 HydrophobicContact CB-CG2 3.94Å; K351-I366 HydrophobicContact CD-CG2 4.49Å; K351-I366 HydrophobicContact CG-CG2 3.96Å; K351-Y368 HydrophobicContact CD-CD1 4.29Å; K351-Y368 HydrophobicContact CD-CD2 4.2Å; K351-Y368 HydrophobicContact CD-CE1 3.81Å; K351-Y368 HydrophobicContact CD-CE2 3.7Å; K351-Y368 HydrophobicContact CD-CG 4.47Å; K351-Y368 VanDerWaalsContact CD-CZ 3.48Å; K351-Y368 PolarHBondContact NZ-OH 3.42Å
352	M	91.5	Very high	91.2	Very high	95 Å²	95	51.1 Å²	51.1	47%	0.468	26%	0.258	S	S	.	.	H	α-helix	trans	-63.5	-30.7	-179	-86.2	53.5	166.5	0	0	112.6	E289 S348 R349 A350	E289-M352 HydrophobicContact CG-CE 3.93Å; E289-M352 WeakPolarHBondContact OE1-CE 3.26Å; E289-M352 WeakPolarHBondContact OE2-CE 3.27Å; S348-M352 PolarHBondContact O-N 2.62Å; R349-M352 PolarHBondContact O-N 3.39Å; A350-M352 PolarHBondContact O-N 3.24Å
353	S	93.2	Very high	91.2	Very high	47 Å²	47	53.4 Å²	53.4	33%	0.329	27%	0.269	S	S	.	.	H	α-helix	trans	-87.1	-35.5	-177.7	-53.3	0	0	0	0	113.9	Y317 R349 A350 K351 R357	Y317-S353 WeakPolarHBondContact CE1-OG 3.33Å; Y317-S353 VanDerWaalsContact CZ-CB 3.5Å; R349-S353 WeakPolarHBondContact O-CB 3.43Å; R349-S353 PolarHBondContact O-N 3.14Å; R349-S353 PolarHBondContact O-OG 2.87Å; A350-S353 PolarHBondContact O-N 3.46Å; K351-S353 PolarHBondContact O-N 2.89Å; S353-R357 WeakPolarHBondContact O-CG 3.39Å; S353-R357 PolarHBondContact O-NE 3.33Å
354	M	92.5	Very high	91.2	Very high	14 Å²	14	52.4 Å²	52.4	7%	0.069	26%	0.263	C	S	.	.	H	α-helix	trans	-102	-12.6	-173.1	-69.5	-64.8	-66.2	0	0	115.1	A313 F314 Y317 A350 G356 R357 I359 C364 I366	A313-M354 HydrophobicContact CB-CE 4.23Å; F314-M354 HydrophobicContact CE1-CB 4.07Å; F314-M354 HydrophobicContact CE1-CG 4.09Å; F314-M354 HydrophobicContact CZ-CB 4.39Å; Y317-M354 HydrophobicContact CD2-CG 4.27Å; Y317-M354 HydrophobicContact CE2-CG 3.29Å; Y317-M354 HydrophobicContact CE2-SD 3.92Å; Y317-M354 WeakPolarHBondContact OH-CG 3.42Å; Y317-M354 PolarHBondContact OH-SD 3Å; A350-M354 WeakPolarHBondContact O-CB 3.46Å; A350-M354 PolarHBondContact O-N 3.33Å; M354-G356 PolarHBondContact O-N 3.49Å; M354-G356 VanDerWaalsContact O-N 3.08Å; M354-R357 HydrophobicContact CE-CB 4.01Å; M354-R357 WeakPolarHBondContact O-CB 3.37Å; M354-R357 PolarHBondContact O-N 3.45Å; M354-R357 HydrophobicContact SD-CB 4.05Å; M354-R357 HydrophobicContact SD-CG 4.11Å; M354-I359 HydrophobicContact CE-CD1 3.96Å; M354-I359 HydrophobicContact CE-CG1 3.76Å; M354-C364 PolarHBondContact O-SG 3.4Å; M354-I366 HydrophobicContact CB-CD1 3.35Å
355	S	90.5	Very high	91.2	Very high	56 Å²	56	59.5 Å²	59.5	39%	0.392	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	117.6	178.3	-67.7	0	0	0	0	111	K351 R357	K351-S355 VanDerWaalsContact O-CB 3.26Å; K351-S355 WeakPolarHBondContact O-CB 3.48Å; K351-S355 PolarHBondContact O-N 3.47Å; K351-S355 PolarHBondContact O-OG 3Å; S355-R357 VanDerWaalsContact C-N 3.26Å; S355-R357 PolarHBondContact O-N 2.94Å
356	G	87.6	Confident	91.3	Very high	46 Å²	46	59.1 Å²	59.1	47%	0.474	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	4.6	-176.5	0	0	0	0	0	114.9	M354 C364	M354-G356 PolarHBondContact O-N 3.49Å; M354-G356 VanDerWaalsContact O-N 3.08Å; G356-C364 PolarHBondContact N-O 2.9Å; G356-C364 VanDerWaalsContact N-O 3.08Å
357	R	90.5	Very high	91.3	Very high	159 Å²	159	58.9 Å²	58.9	60%	0.6	30%	0.297	S	S	*	.			trans	-75.1	153.5	167.3	-65.5	-63.6	-171	161	0	110.6	S353 M354 S355 C364	S353-R357 WeakPolarHBondContact O-CG 3.39Å; S353-R357 PolarHBondContact O-NE 3.33Å; M354-R357 HydrophobicContact CE-CB 4.01Å; M354-R357 WeakPolarHBondContact O-CB 3.37Å; M354-R357 PolarHBondContact O-N 3.45Å; M354-R357 HydrophobicContact SD-CB 4.05Å; M354-R357 HydrophobicContact SD-CG 4.11Å; S355-R357 VanDerWaalsContact C-N 3.26Å; S355-R357 PolarHBondContact O-N 2.94Å; R357-C364 PolarHBondContact O-N 2.95Å; R357-C364 PolarHBondContact O-SG 2.99Å
358	F	87.6	Confident	91.3	Very high	122 Å²	122	60.7 Å²	60.7	54%	0.535	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	136.3	170.9	-65.4	-89.6	0	0	0	111	S361 L362 H363	F358-S361 WeakPolarHBondContact CD1-O 3.38Å; F358-L362 WeakPolarHBondContact CA-O 3.19Å; F358-H363 AromaticContact CE1-CE1 3.37Å; F358-H363 WeakPolarHBondContact CE1-CE1 3.43Å; F358-H363 AromaticContact CE1-CG 3.96Å; F358-H363 AromaticContact CE1-ND1 3.55Å; F358-H363 AromaticContact CE1-NE2 3.68Å; F358-H363 AromaticContact CE2-NE2 3.8Å; F358-H363 AromaticContact CZ-CD2 3.77Å; F358-H363 AromaticContact CZ-CE1 3.31Å; F358-H363 WeakPolarHBondContact CZ-CE1 3.36Å; F358-H363 AromaticContact CZ-ND1 3.92Å; F358-H363 AromaticContact CZ-NE2 3.2Å; F358-H363 WeakPolarHBondContact CZ-NE2 3.38Å
359	I	88.3	Confident	91.3	Very high	11 Å²	11	60.8 Å²	60.8	6%	0.056	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	111.1	158.2	-64.5	177.7	0	0	0	104.6	V298 L301 I305 A313 F314 M354 S361 L362 C364	V298-I359 HydrophobicContact CG1-CD1 4.37Å; L301-I359 HydrophobicContact CD2-CB 4.17Å; L301-I359 HydrophobicContact CD2-CD1 3.94Å; L301-I359 HydrophobicContact CD2-CG2 4.2Å; I305-I359 HydrophobicContact CD1-CG2 4.01Å; A313-I359 HydrophobicContact CB-CD1 4.16Å; A313-I359 HydrophobicContact CB-CG1 4.4Å; F314-I359 HydrophobicContact CE2-CD1 3.84Å; F314-I359 HydrophobicContact CZ-CD1 4.3Å; M354-I359 HydrophobicContact CE-CD1 3.96Å; M354-I359 HydrophobicContact CE-CG1 3.76Å; I359-S361 PolarHBondContact O-N 3.31Å; I359-L362 PolarHBondContact N-O 3.45Å; I359-L362 PolarHBondContact O-N 3.33Å; I359-C364 HydrophobicContact CD1-CB 3.85Å; I359-C364 HydrophobicContact CG1-CB 4.13Å
360	R	88.2	Confident	91.2	Very high	93 Å²	93	62.9 Å²	62.9	35%	0.351	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	-122.1	-160.6	-58.1	176.1	178.4	-176.8	-1	111.4	E302 D304 I305 E309	E302-R360 WeakPolarHBondContact OE1-CB 3.39Å; E302-R360 WeakPolarHBondContact OE2-CD 3.42Å; E302-R360 IonicContact OE2-CZ 3.08Å; E302-R360 IonicContact OE2-NE 3.73Å; E302-R360 IonicContact OE2-NH1 2.69Å; E302-R360 PolarHBondContact OE2-NH1 3.17Å; D304-R360 IonicContact OD1-NH1 2.71Å; D304-R360 PolarHBondContact OD1-NH1 2.58Å; D304-R360 IonicContact OD2-CZ 3.21Å; D304-R360 IonicContact OD2-NH1 3.16Å; D304-R360 PolarHBondContact OD2-NH1 3.26Å; D304-R360 IonicContact OD2-NH2 2.83Å; D304-R360 PolarHBondContact OD2-NH2 3.3Å; D304-R360 VanDerWaalsContact OD2-NH2 3.08Å; I305-R360 HydrophobicContact CD1-CG 4.34Å; E309-R360 IonicContact OE1-CZ 3.68Å; E309-R360 VanDerWaalsContact OE1-CZ 3.28Å; E309-R360 IonicContact OE1-NE 3.7Å; E309-R360 PolarHBondContact OE1-NE 3.03Å; E309-R360 IonicContact OE1-NH2 2.68Å; E309-R360 PolarHBondContact OE1-NH2 3.49Å; E309-R360 IonicContact OE2-CZ 2.69Å; E309-R360 IonicContact OE2-NE 3.04Å; E309-R360 IonicContact OE2-NH2 3.71Å; E309-R360 PolarHBondContact OE2-NH2 3.43Å
361	S	87.2	Confident	90.9	Very high	79 Å²	79	64.7 Å²	64.7	55%	0.552	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-17.2	-176.3	72.9	0	0	0	0	114.5	E302 F358 I359	E302-S361 VanDerWaalsContact OE1-CB 3.29Å; E302-S361 WeakPolarHBondContact OE1-CB 3.46Å; E302-S361 PolarHBondContact OE1-N 3.42Å; E302-S361 PolarHBondContact OE1-OG 3.22Å; F358-S361 WeakPolarHBondContact CD1-O 3.38Å; I359-S361 PolarHBondContact O-N 3.31Å
362	L	89.3	Confident	90.7	Very high	42 Å²	42	67.9 Å²	67.9	22%	0.22	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	138.4	-171	-60.4	-176.4	0	0	0	113.2	S300 E302 H334 F358 I359 C364	S300-L362 VanDerWaalsContact O-CB 3.24Å; S300-L362 WeakPolarHBondContact O-CB 3.1Å; E302-L362 HydrophobicContact CG-CD1 3.65Å; E302-L362 HydrophobicContact CG-CG 3.83Å; H334-L362 WeakPolarHBondContact ND1-CD1 3.46Å; F358-L362 WeakPolarHBondContact CA-O 3.19Å; I359-L362 PolarHBondContact N-O 3.45Å; I359-L362 PolarHBondContact O-N 3.33Å; L362-C364 PolarHBondContact O-N 2.88Å
363	H	91.1	Very high	90.7	Very high	104 Å²	104	66.7 Å²	66.7	48%	0.481	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	111.6	171	-61.3	84.4	0	0	0	109.9	S300 F358	S300-H363 WeakPolarHBondContact CB-O 3.44Å; S300-H363 PolarHBondContact OG-O 2.64Å; F358-H363 AromaticContact CE1-CE1 3.37Å; F358-H363 WeakPolarHBondContact CE1-CE1 3.43Å; F358-H363 AromaticContact CE1-CG 3.96Å; F358-H363 AromaticContact CE1-ND1 3.55Å; F358-H363 AromaticContact CE1-NE2 3.68Å; F358-H363 AromaticContact CE2-NE2 3.8Å; F358-H363 AromaticContact CZ-CD2 3.77Å; F358-H363 AromaticContact CZ-CE1 3.31Å; F358-H363 WeakPolarHBondContact CZ-CE1 3.36Å; F358-H363 AromaticContact CZ-ND1 3.92Å; F358-H363 AromaticContact CZ-NE2 3.2Å; F358-H363 WeakPolarHBondContact CZ-NE2 3.38Å
364	C	91.1	Very high	90.7	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.34	C	S	.	.			trans	-74.3	135.7	179.5	72.3	0	0	0	0	111.7	V298 L301 M354 G356 R357 I359 L362	V298-C364 HydrophobicContact CG1-CB 3.99Å; L301-C364 HydrophobicContact CD2-CB 4.23Å; M354-C364 PolarHBondContact O-SG 3.4Å; G356-C364 PolarHBondContact N-O 2.9Å; G356-C364 VanDerWaalsContact N-O 3.08Å; R357-C364 PolarHBondContact O-N 2.95Å; R357-C364 PolarHBondContact O-SG 2.99Å; I359-C364 HydrophobicContact CD1-CB 3.85Å; I359-C364 HydrophobicContact CG1-CB 4.13Å; L362-C364 PolarHBondContact O-N 2.88Å
365	K	92.2	Very high	90.7	Very high	151 Å²	151	67.8 Å²	67.8	66%	0.657	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	108.9	179.8	-69.5	-175.7	179.1	178.9	0	109.3	G299	G299-K365 PolarHBondContact N-O 3.01Å; G299-K365 PolarHBondContact O-N 2.66Å
366	I	94.2	Very high	90.8	Very high	24 Å²	24	65.2 Å²	65.2	12%	0.123	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	131.7	-173.1	-56.1	-177.6	0	0	0	111.1	L296 F297 V298 F314 K351 M354	L296-I366 HydrophobicContact CB-CG2 4.23Å; L296-I366 HydrophobicContact CD1-CG2 3.93Å; L296-I366 HydrophobicContact CD2-CG2 4.23Å; L296-I366 HydrophobicContact CG-CG2 4.37Å; F297-I366 VanDerWaalsContact O-CA 3.3Å; F297-I366 WeakPolarHBondContact O-CA 3.48Å; V298-I366 HydrophobicContact CG1-CG1 4.39Å; V298-I366 HydrophobicContact CG2-CG1 4.49Å; F314-I366 HydrophobicContact CE1-CD1 3.74Å; F314-I366 HydrophobicContact CZ-CD1 3.68Å; K351-I366 HydrophobicContact CB-CG2 3.94Å; K351-I366 HydrophobicContact CD-CG2 4.49Å; K351-I366 HydrophobicContact CG-CG2 3.96Å; M354-I366 HydrophobicContact CB-CD1 3.35Å
367	G	93.7	Very high	91	Very high	25 Å²	25	63 Å²	63	26%	0.258	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	169.7	168.9	0	0	0	0	0	110.8	L296 F297	L296-G367 CarbonylContact C-O 3.52Å; L296-G367 WeakPolarHBondContact CA-O 3.36Å; F297-G367 PolarHBondContact N-O 3.32Å; F297-G367 PolarHBondContact O-N 3.45Å
368	Y	94.3	Very high	91.1	Very high	38 Å²	38	55.9 Å²	55.9	15%	0.149	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	133.1	168.6	-61.6	-68.9	0	0	0	109.9	K288 K291 A292 L296 S348 K351	K288-Y368 WeakPolarHBondContact O-CD2 3.46Å; K288-Y368 VanDerWaalsContact O-CE2 3.31Å; K288-Y368 WeakPolarHBondContact O-CE2 3.49Å; K291-Y368 WeakPolarHBondContact O-CB 3.4Å; A292-Y368 HydrophobicContact CB-CD1 4.41Å; A292-Y368 HydrophobicContact CB-CE1 3.96Å; A292-Y368 HydrophobicContact CB-CE2 4.2Å; L296-Y368 HydrophobicContact CD2-CD1 3.86Å; L296-Y368 HydrophobicContact CD2-CE1 4.17Å; S348-Y368 PolarHBondContact OG-OH 2.91Å; K351-Y368 HydrophobicContact CD-CD1 4.29Å; K351-Y368 HydrophobicContact CD-CD2 4.2Å; K351-Y368 HydrophobicContact CD-CE1 3.81Å; K351-Y368 HydrophobicContact CD-CE2 3.7Å; K351-Y368 HydrophobicContact CD-CG 4.47Å; K351-Y368 VanDerWaalsContact CD-CZ 3.48Å; K351-Y368 PolarHBondContact NZ-OH 3.42Å
369	G	91.8	Very high	91.3	Very high	12 Å²	12	50.1 Å²	50.1	12%	0.124	26%	0.259	C	S	.	.			trans	-79.8	177.4	173.2	0	0	0	0	0	111.6	T293 T295	T293-G369 WeakPolarHBondContact CG2-O 3.19Å; T293-G369 PolarHBondContact OG1-O 3.39Å; T295-G369 WeakPolarHBondContact O-CA 3.39Å; T295-G369 PolarHBondContact O-N 3.31Å
370	K	90.8	Very high	91.3	Very high	187 Å²	187	49.6 Å²	49.6	81%	0.813	26%	0.257	S	S	*	.			trans	-70.7	133	176.5	-64.3	-173.1	179.8	-174.3	0	110.1
371	A	89.5	Confident	91	Very high	37 Å²	37	46 Å²	46	31%	0.306	25%	0.249	S	C	.	.			trans	-60.3	146.2	167.6	0	0	0	0	0	110.3	T293 D446 F447	T293-A371 HydrophobicContact CG2-CB 3.8Å; A371-D446 WeakPolarHBondContact CB-OD1 3.31Å; A371-F447 HydrophobicContact CB-CD2 4.01Å; A371-F447 HydrophobicContact CB-CE2 4.2Å
372	I	90.5	Very high	90.7	Very high	84 Å²	84	42.6 Å²	42.6	43%	0.431	22%	0.224	S	C	.	.			trans	-109.1	111.3	173.7	-65.8	169.8	0	0	0	106.8	F447	I372-F447 WeakPolarHBondContact O-CB 3.1Å; I372-F447 WeakPolarHBondContact O-CD2 3.5Å; I372-F447 WeakPolarHBondContact O-CG 3.08Å
373	P	91.6	Very high	89.6	Confident	69 Å²	69	44.8 Å²	44.8	45%	0.448	23%	0.233	S	C	.	.			trans	-57.8	144.3	-176.7	-27.1	36.3	0	0	0	113.8	L424 F447	P373-L424 HydrophobicContact CB-CD1 4.16Å; P373-L424 HydrophobicContact CB-CD2 4.3Å; P373-L424 HydrophobicContact CB-CG 4.23Å; P373-L424 HydrophobicContact CG-CD1 4.47Å; P373-L424 HydrophobicContact CG-CD2 4.12Å; P373-F447 HydrophobicContact CB-CE1 4.49Å; P373-F447 HydrophobicContact CB-CE2 4.25Å; P373-F447 HydrophobicContact CB-CZ 4.17Å; P373-F447 HydrophobicContact CG-CE2 4.34Å
374	S	92.1	Very high	88.4	Confident	15 Å²	15	44.7 Å²	44.7	11%	0.105	24%	0.244	C	C	.	.			trans	-151.2	161.9	179.8	-175.3	0	0	0	0	108.3	C376 A423 F447 I448	S374-C376 VanDerWaalsContact C-N 3.25Å; S374-C376 PolarHBondContact OG-N 3.31Å; S374-A423 WeakPolarHBondContact O-CB 3.35Å; S374-F447 WeakPolarHBondContact O-CD1 3.43Å; S374-F447 VanDerWaalsContact O-CE1 3.25Å; S374-F447 WeakPolarHBondContact O-CE1 3.44Å; S374-I448 VanDerWaalsContact CB-O 3.26Å; S374-I448 WeakPolarHBondContact CB-O 3.34Å; S374-I448 PolarHBondContact OG-O 3.21Å
375	H	91.8	Very high	87.2	Confident	70 Å²	70	52.1 Å²	52.1	32%	0.324	27%	0.272	S	S	.	.	S	Bend	trans	-78.8	-10.9	168.5	57.1	-82.1	0	0	0	112.3	Y417	H375-Y417 PolarHBondContact O-N 3.49Å
376	C	92.7	Very high	86.2	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.007	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.4	176.3	-58.5	0	0	0	0	112.1	S374 A415 V416 F447 I448 V453	S374-C376 VanDerWaalsContact C-N 3.25Å; S374-C376 PolarHBondContact OG-N 3.31Å; C376-A415 CarbonylContact C-O 3.6Å; C376-A415 WeakPolarHBondContact CA-O 3.43Å; C376-V416 HydrophobicContact CB-CG2 4.47Å; C376-F447 VanDerWaalsContact O-CA 3.32Å; C376-F447 WeakPolarHBondContact O-CA 3.33Å; C376-I448 HydrophobicContact CB-CG1 3.82Å; C376-I448 PolarHBondContact O-N 2.81Å; C376-V453 HydrophobicContact CB-CG2 4.47Å
377	L	93	Very high	85.4	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	142.4	172.4	-62.5	-175.8	0	0	0	111.9	I414 A415 Y417 A423 A426 N427 V445 F447	L377-I414 WeakPolarHBondContact O-CA 3.5Å; L377-A415 PolarHBondContact N-O 2.75Å; L377-A415 PolarHBondContact O-N 2.89Å; L377-Y417 HydrophobicContact CD1-CE2 4.09Å; L377-A423 HydrophobicContact CD2-CB 4.43Å; L377-A423 HydrophobicContact CG-CB 4.29Å; L377-A426 HydrophobicContact CD1-CB 3.74Å; L377-N427 HydrophobicContact CD1-CB 4.26Å; L377-N427 HydrophobicContact CD2-CB 3.9Å; L377-V445 HydrophobicContact CB-CG1 4.43Å; L377-V445 HydrophobicContact CD1-CG1 4.19Å; L377-V445 HydrophobicContact CD2-CG1 4.4Å; L377-F447 HydrophobicContact CD2-CD1 3.36Å; L377-F447 HydrophobicContact CD2-CE1 3.59Å; L377-F447 HydrophobicContact CD2-CG 4.09Å; L377-F447 HydrophobicContact CD2-CZ 4.46Å
378	Y	92.8	Very high	84.9	Confident	9 Å²	9	47.7 Å²	47.7	4%	0.035	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	129.7	161.9	178.6	-85.3	0	0	0	109.1	N343 V344 Y412 I414 V445 D446 I448	N343-Y378 HydrophobicContact CB-CD1 4.39Å; N343-Y378 HydrophobicContact CB-CD2 4.36Å; N343-Y378 HydrophobicContact CB-CE1 4.04Å; N343-Y378 HydrophobicContact CB-CE2 4.03Å; N343-Y378 VanDerWaalsContact CG-CE2 3.5Å; N343-Y378 VanDerWaalsContact ND2-CE2 3.27Å; N343-Y378 WeakPolarHBondContact ND2-CE2 3.09Å; V344-Y378 HydrophobicContact CG1-CD1 3.78Å; V344-Y378 HydrophobicContact CG1-CE1 4.05Å; Y378-Y412 AromaticContact CD2-CD2 3.99Å; Y378-Y412 HydrophobicContact CD2-CD2 3.99Å; Y378-Y412 HydrophobicContact CD2-CG 4.45Å; Y378-Y412 HydrophobicContact CE2-CD1 4.14Å; Y378-Y412 AromaticContact CE2-CD2 3.32Å; Y378-Y412 HydrophobicContact CE2-CD2 3.32Å; Y378-Y412 AromaticContact CE2-CE2 3.89Å; Y378-Y412 HydrophobicContact CE2-CE2 3.89Å; Y378-Y412 AromaticContact CE2-CG 3.47Å; Y378-Y412 HydrophobicContact CE2-CG 3.47Å; Y378-Y412 VanDerWaalsContact CE2-CG 3.47Å; Y378-Y412 VanDerWaalsContact CZ-CB 3.47Å; Y378-Y412 AromaticContact CZ-CD2 3.98Å; Y378-Y412 AromaticContact CZ-CG 3.61Å; Y378-Y412 WeakPolarHBondContact OH-CB 3.47Å; Y378-Y412 WeakPolarHBondContact OH-CD1 3.46Å; Y378-I414 HydrophobicContact CD2-CG1 4.29Å; Y378-V445 VanDerWaalsContact O-CA 3.28Å; Y378-V445 WeakPolarHBondContact O-CA 3.47Å; Y378-D446 PolarHBondContact N-O 2.79Å; Y378-D446 PolarHBondContact O-N 2.88Å; Y378-I448 HydrophobicContact CG-CG2 4.47Å
379	I	90.6	Very high	84.4	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	91.8	-178.2	-56.1	169.2	0	0	0	107.3	L382 L395 Y412 A413 A415 L430 V445	I379-L382 HydrophobicContact CB-CD1 4.4Å; I379-L382 HydrophobicContact CG2-CD1 3.98Å; I379-L382 HydrophobicContact CG2-CD2 4.16Å; I379-L382 HydrophobicContact CG2-CG 4Å; I379-L395 HydrophobicContact CD1-CD1 4.09Å; I379-L395 HydrophobicContact CD1-CD2 3.7Å; I379-L395 HydrophobicContact CD1-CG 4.48Å; I379-Y412 CarbonylContact O-C 3.5Å; I379-Y412 WeakPolarHBondContact O-CA 3.49Å; I379-Y412 WeakPolarHBondContact O-CB 3.42Å; I379-A413 HydrophobicContact CB-CB 4.3Å; I379-A413 PolarHBondContact N-O 2.95Å; I379-A413 PolarHBondContact O-N 3.13Å; I379-A415 HydrophobicContact CD1-CB 4.21Å; I379-L430 HydrophobicContact CD1-CD1 3.87Å; I379-L430 HydrophobicContact CG1-CD1 4.22Å; I379-V445 HydrophobicContact CB-CG2 4.4Å; I379-V445 HydrophobicContact CG1-CG1 4.21Å; I379-V445 HydrophobicContact CG1-CG2 4.19Å; I379-V445 HydrophobicContact CG2-CG2 4.09Å
380	G	88.3	Confident	83.9	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	159.6	177.8	0	0	0	0	0	113.1	L443 R444	G380-L443 CarbonylContact O-C 3.58Å; G380-L443 WeakPolarHBondContact O-CA 3.35Å; G380-R444 PolarHBondContact N-O 3.35Å; G380-R444 PolarHBondContact O-N 3.01Å
381	G	82.5	Confident	83.7	Confident	18 Å²	18	43.3 Å²	43.3	19%	0.186	24%	0.244	C	C	.	.			trans	81.7	17.2	-178.9	0	0	0	0	0	114.3	K411 L443	G381-K411 PolarHBondContact N-O 3.16Å; G381-L443 WeakPolarHBondContact O-CD2 3.32Å
382	L	80.6	Confident	83.6	Confident	7 Å²	7	45.9 Å²	45.9	4%	0.037	25%	0.25	C	S	.	.			trans	-70.9	127.1	169.4	-69.2	170.4	0	0	0	109.4	I379 L391 K411 A413 L443	I379-L382 HydrophobicContact CB-CD1 4.4Å; I379-L382 HydrophobicContact CG2-CD1 3.98Å; I379-L382 HydrophobicContact CG2-CD2 4.16Å; I379-L382 HydrophobicContact CG2-CG 4Å; L382-L391 HydrophobicContact CD1-CD2 3.76Å; L382-L391 HydrophobicContact CD2-CD1 4.46Å; L382-K411 PolarHBondContact N-O 3.28Å; L382-K411 VanDerWaalsContact N-O 3.16Å; L382-K411 VanDerWaalsContact O-CA 3.3Å; L382-K411 WeakPolarHBondContact O-CA 3.41Å; L382-K411 WeakPolarHBondContact O-CB 3.43Å; L382-A413 HydrophobicContact CD1-CB 3.54Å; L382-L443 HydrophobicContact CD2-CD2 3.84Å; L382-L443 HydrophobicContact CG-CD2 4.43Å
383	E	67.2	Low	83.4	Confident	89 Å²	89	49.9 Å²	49.9	42%	0.416	26%	0.26	S	S	.	.			trans	-104.6	161.4	177.6	-154.6	71.5	-101.2	0	0	108.7	W385 T386 K411	E383-W385 PolarHBondContact O-N 3.41Å; E383-T386 PolarHBondContact O-N 3.4Å; E383-K411 WeakPolarHBondContact OE1-CE 3.38Å; E383-K411 IonicContact OE1-NZ 3.79Å; E383-K411 PolarHBondContact OE1-NZ 2.96Å; E383-K411 IonicContact OE2-NZ 2.63Å
384	S	64.6	Low	83.1	Confident	101 Å²	101	49.9 Å²	49.9	71%	0.706	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	12.8	-165.8	63.6	0	0	0	0	117.1
385	W	65.4	Low	82.9	Confident	156 Å²	156	49.1 Å²	49.1	59%	0.591	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-22.4	177.5	65.2	-95.1	0	0	0	113	E383 L441	E383-W385 PolarHBondContact O-N 3.41Å; W385-L441 HydrophobicContact CH2-CD2 4.34Å; W385-L441 HydrophobicContact CZ2-CD1 3.59Å; W385-L441 HydrophobicContact CZ2-CD2 3.64Å; W385-L441 HydrophobicContact CZ2-CG 4.27Å
386	T	72.4	Confident	82.8	Confident	7 Å²	7	48.5 Å²	48.5	4%	0.043	25%	0.253	C	S	.	.			trans	-76.3	132	176.4	-38.1	0	0	0	0	108.6	E383 L391 W406	E383-T386 PolarHBondContact O-N 3.4Å; T386-L391 HydrophobicContact CG2-CB 3.88Å; T386-W406 WeakPolarHBondContact O-CH2 3.46Å; T386-W406 WeakPolarHBondContact O-CZ2 3.14Å
387	S	77.3	Confident	82.6	Confident	39 Å²	39	54.8 Å²	54.8	27%	0.273	28%	0.277	S	S	.	.			trans	-91.3	165.2	171.2	87.4	0	0	0	0	111.6	D389 S390 L391	S387-D389 VanDerWaalsContact C-N 3.25Å; S387-D389 PolarHBondContact O-N 2.91Å; S387-D389 PolarHBondContact OG-N 2.73Å; S387-D389 PolarHBondContact OG-OD2 2.82Å; S387-S390 PolarHBondContact O-N 2.76Å; S387-S390 WeakPolarHBondContact OG-CB 3.33Å; S387-S390 PolarHBondContact OG-N 3.02Å; S387-S390 VanDerWaalsContact OG-N 3.08Å; S387-S390 PolarHBondContact OG-OG 2.92Å; S387-L391 WeakPolarHBondContact O-CB 3.42Å; S387-L391 PolarHBondContact O-N 2.91Å
388	V	82.7	Confident	82.4	Confident	61 Å²	61	55.7 Å²	55.7	37%	0.37	28%	0.281	S	S	.	.	H	α-helix	trans	-54.9	-49.9	177.1	-161.1	0	0	0	0	109.1	S390 L391 Q392 W406	V388-S390 VanDerWaalsContact C-N 3.34Å; V388-S390 PolarHBondContact O-N 3.05Å; V388-L391 PolarHBondContact O-N 3.26Å; V388-Q392 WeakPolarHBondContact O-CB 3.39Å; V388-Q392 PolarHBondContact O-N 2.89Å; V388-W406 HydrophobicContact CB-CE3 3.95Å; V388-W406 HydrophobicContact CB-CZ3 4.11Å; V388-W406 HydrophobicContact CG1-CE3 4.26Å; V388-W406 HydrophobicContact CG2-CE3 3.65Å; V388-W406 HydrophobicContact CG2-CZ3 3.53Å
389	D	83.2	Confident	82.2	Confident	95 Å²	95	56.4 Å²	56.4	51%	0.508	29%	0.291	S	S	.	.	H	α-helix	trans	-70.2	-32.5	-173.3	-19.7	-93.4	0	0	0	111.2	S387 R393	S387-D389 VanDerWaalsContact C-N 3.25Å; S387-D389 PolarHBondContact O-N 2.91Å; S387-D389 PolarHBondContact OG-N 2.73Å; S387-D389 PolarHBondContact OG-OD2 2.82Å; D389-R393 VanDerWaalsContact O-CB 3.27Å; D389-R393 WeakPolarHBondContact O-CB 3.19Å; D389-R393 VanDerWaalsContact O-CG 3.24Å; D389-R393 WeakPolarHBondContact O-CG 3.4Å; D389-R393 PolarHBondContact O-N 3.23Å; D389-R393 PolarHBondContact O-NE 3.05Å
390	S	82.7	Confident	82.1	Confident	47 Å²	47	62.4 Å²	62.4	33%	0.329	32%	0.319	S	S	.	.	H	α-helix	trans	-73.8	-43.3	176.6	-54.7	0	0	0	0	111.2	S387 V388 R393 M394	S387-S390 PolarHBondContact O-N 2.76Å; S387-S390 WeakPolarHBondContact OG-CB 3.33Å; S387-S390 PolarHBondContact OG-N 3.02Å; S387-S390 VanDerWaalsContact OG-N 3.08Å; S387-S390 PolarHBondContact OG-OG 2.92Å; V388-S390 VanDerWaalsContact C-N 3.34Å; V388-S390 PolarHBondContact O-N 3.05Å; S390-R393 PolarHBondContact OG-NH2 3.02Å; S390-R393 VanDerWaalsContact OG-NH2 3.08Å; S390-M394 WeakPolarHBondContact O-CB 3.38Å; S390-M394 PolarHBondContact O-N 3.1Å; S390-M394 VanDerWaalsContact O-N 3.12Å
391	L	85.5	Confident	82.2	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.016	32%	0.324	C	S	.	.	H	α-helix	trans	-66.5	-43.1	173.2	-176.1	60.3	0	0	0	111	L382 T386 S387 V388 M394 L395 L404 W406 A413	L382-L391 HydrophobicContact CD1-CD2 3.76Å; L382-L391 HydrophobicContact CD2-CD1 4.46Å; T386-L391 HydrophobicContact CG2-CB 3.88Å; S387-L391 WeakPolarHBondContact O-CB 3.42Å; S387-L391 PolarHBondContact O-N 2.91Å; V388-L391 PolarHBondContact O-N 3.26Å; L391-M394 PolarHBondContact O-N 3.35Å; L391-L395 HydrophobicContact CD1-CD1 4.04Å; L391-L395 HydrophobicContact CD1-CG 4.18Å; L391-L395 HydrophobicContact CD2-CD1 4.49Å; L391-L395 HydrophobicContact CG-CD1 3.8Å; L391-L395 HydrophobicContact CG-CG 4.35Å; L391-L395 WeakPolarHBondContact O-CB 3.38Å; L391-L395 WeakPolarHBondContact O-CG 3.44Å; L391-L395 PolarHBondContact O-N 3.44Å; L391-L404 HydrophobicContact CD2-CD1 4.48Å; L391-W406 HydrophobicContact CD2-CB 3.93Å; L391-W406 HydrophobicContact CD2-CD2 4.49Å; L391-W406 HydrophobicContact CD2-CG 3.83Å; L391-A413 HydrophobicContact CD2-CB 3.68Å
392	Q	87.6	Confident	82.5	Confident	92 Å²	92	67.1 Å²	67.1	43%	0.43	34%	0.343	S	S	.	.	H	α-helix	trans	-62.8	-49.3	178.8	-176.5	168.9	-19.3	0	0	111.6	V388 M394 L395 S396 L401 L404	V388-Q392 WeakPolarHBondContact O-CB 3.39Å; V388-Q392 PolarHBondContact O-N 2.89Å; Q392-M394 VanDerWaalsContact C-N 3.31Å; Q392-M394 PolarHBondContact O-N 3.15Å; Q392-L395 PolarHBondContact O-N 3.01Å; Q392-S396 WeakPolarHBondContact O-CB 3.37Å; Q392-S396 PolarHBondContact O-N 3.25Å; Q392-S396 PolarHBondContact O-OG 3.42Å; Q392-L401 HydrophobicContact CG-CD2 4.15Å; Q392-L404 HydrophobicContact CB-CD2 3.83Å; Q392-L404 HydrophobicContact CG-CD2 4.32Å
393	R	86.3	Confident	82.8	Confident	167 Å²	167	70.3 Å²	70.3	63%	0.63	36%	0.355	S	S	*	.	H	α-helix	trans	-58.2	-41.4	174.3	-78.3	174.5	-69.8	146.4	-2.3	112.4	D389 S390 R397	D389-R393 VanDerWaalsContact O-CB 3.27Å; D389-R393 WeakPolarHBondContact O-CB 3.19Å; D389-R393 VanDerWaalsContact O-CG 3.24Å; D389-R393 WeakPolarHBondContact O-CG 3.4Å; D389-R393 PolarHBondContact O-N 3.23Å; D389-R393 PolarHBondContact O-NE 3.05Å; S390-R393 PolarHBondContact OG-NH2 3.02Å; S390-R393 VanDerWaalsContact OG-NH2 3.08Å; R393-R397 PolarHBondContact O-N 2.84Å
394	M	85.4	Confident	83.8	Confident	69 Å²	69	67.6 Å²	67.6	34%	0.34	34%	0.343	S	S	.	.	H	α-helix	trans	-62.7	-44.4	175.8	-172.9	-175.5	-62.2	0	0	111.8	S390 L391 Q392 F398 L430 L433	S390-M394 WeakPolarHBondContact O-CB 3.38Å; S390-M394 PolarHBondContact O-N 3.1Å; S390-M394 VanDerWaalsContact O-N 3.12Å; L391-M394 PolarHBondContact O-N 3.35Å; Q392-M394 VanDerWaalsContact C-N 3.31Å; Q392-M394 PolarHBondContact O-N 3.15Å; M394-F398 HydrophobicContact CG-CE2 4.33Å; M394-F398 HydrophobicContact CG-CZ 4.28Å; M394-F398 WeakPolarHBondContact O-CD2 2.84Å; M394-F398 WeakPolarHBondContact O-CE2 3.28Å; M394-F398 WeakPolarHBondContact O-CZ 3.49Å; M394-L430 HydrophobicContact SD-CD2 3.99Å; M394-L433 HydrophobicContact SD-CD1 4.07Å
395	L	88.4	Confident	84.8	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-71.4	-40.1	-178.8	-71	172.1	0	0	0	113.1	I379 L391 Q392 R397 F398 L401 L404 A415 Y417 L430	I379-L395 HydrophobicContact CD1-CD1 4.09Å; I379-L395 HydrophobicContact CD1-CD2 3.7Å; I379-L395 HydrophobicContact CD1-CG 4.48Å; L391-L395 HydrophobicContact CD1-CD1 4.04Å; L391-L395 HydrophobicContact CD1-CG 4.18Å; L391-L395 HydrophobicContact CD2-CD1 4.49Å; L391-L395 HydrophobicContact CG-CD1 3.8Å; L391-L395 HydrophobicContact CG-CG 4.35Å; L391-L395 WeakPolarHBondContact O-CB 3.38Å; L391-L395 WeakPolarHBondContact O-CG 3.44Å; L391-L395 PolarHBondContact O-N 3.44Å; Q392-L395 PolarHBondContact O-N 3.01Å; L395-R397 PolarHBondContact O-N 3.32Å; L395-F398 HydrophobicContact CD2-CD2 4.48Å; L395-F398 PolarHBondContact O-N 3.19Å; L395-F398 VanDerWaalsContact O-N 3.07Å; L395-L401 HydrophobicContact CB-CD1 4.46Å; L395-L401 HydrophobicContact CB-CD2 4.08Å; L395-L401 HydrophobicContact CD1-CD2 4.38Å; L395-L404 HydrophobicContact CD1-CD1 3.65Å; L395-L404 HydrophobicContact CD1-CD2 4.42Å; L395-A415 HydrophobicContact CD1-CB 3.81Å; L395-A415 HydrophobicContact CD2-CB 4.47Å; L395-Y417 WeakPolarHBondContact CA-OH 3.19Å; L395-Y417 WeakPolarHBondContact CB-OH 3.32Å; L395-Y417 WeakPolarHBondContact CD2-OH 3.13Å; L395-Y417 WeakPolarHBondContact O-CE1 3.37Å; L395-Y417 PolarHBondContact O-OH 3.45Å; L395-L430 HydrophobicContact CD2-CD1 3.85Å
396	S	90.7	Very high	85.7	Confident	56 Å²	56	58 Å²	58	39%	0.392	29%	0.294	S	S	.	.	H	α-helix	trans	-64.8	-21.1	177.6	-67.3	0	0	0	0	113.3	Q392 F398 G399	Q392-S396 WeakPolarHBondContact O-CB 3.37Å; Q392-S396 PolarHBondContact O-N 3.25Å; Q392-S396 PolarHBondContact O-OG 3.42Å; S396-F398 PolarHBondContact O-N 3.32Å; S396-G399 PolarHBondContact O-N 3.42Å
397	R	87.6	Confident	85.7	Confident	133 Å²	133	59.4 Å²	59.4	50%	0.502	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-16.8	171.8	-173.4	169.3	175.5	157.4	-0.5	113.1	I146 R393 L395	I146-R397 PolarHBondContact O-NH2 2.73Å; R393-R397 PolarHBondContact O-N 2.84Å; L395-R397 PolarHBondContact O-N 3.32Å
398	F	88.8	Confident	85.4	Confident	20 Å²	20	61.5 Å²	61.5	9%	0.088	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-6.1	-180	-47	-46.7	0	0	0	114	M394 L395 S396 Y417 S422 A426 Q429 L430	M394-F398 HydrophobicContact CG-CE2 4.33Å; M394-F398 HydrophobicContact CG-CZ 4.28Å; M394-F398 WeakPolarHBondContact O-CD2 2.84Å; M394-F398 WeakPolarHBondContact O-CE2 3.28Å; M394-F398 WeakPolarHBondContact O-CZ 3.49Å; L395-F398 HydrophobicContact CD2-CD2 4.48Å; L395-F398 PolarHBondContact O-N 3.19Å; L395-F398 VanDerWaalsContact O-N 3.07Å; S396-F398 PolarHBondContact O-N 3.32Å; F398-Y417 HydrophobicContact CB-CE1 4.46Å; F398-S422 WeakPolarHBondContact O-CA 3.09Å; F398-A426 HydrophobicContact CB-CB 3.75Å; F398-A426 HydrophobicContact CD2-CB 3.48Å; F398-A426 VanDerWaalsContact CD2-CB 3.48Å; F398-A426 HydrophobicContact CE2-CB 4.38Å; F398-A426 HydrophobicContact CG-CB 3.89Å; F398-Q429 HydrophobicContact CD1-CB 4.37Å; F398-Q429 HydrophobicContact CD1-CG 4.42Å; F398-Q429 HydrophobicContact CE1-CB 3.77Å; F398-Q429 VanDerWaalsContact CE1-CD 3.46Å; F398-Q429 HydrophobicContact CE1-CG 4.1Å; F398-Q429 VanDerWaalsContact CE1-OE1 3.3Å; F398-Q429 HydrophobicContact CZ-CB 3.94Å; F398-L430 HydrophobicContact CE2-CD2 4.21Å; F398-L430 HydrophobicContact CE2-CG 4.12Å
399	G	88.1	Confident	84.8	Confident	24 Å²	24	70.4 Å²	70.4	25%	0.247	34%	0.343	C	S	.	.	S	Bend	trans	144.8	179.2	-180	0	0	0	0	0	112.6	S396 L401	S396-G399 PolarHBondContact O-N 3.42Å; G399-L401 PolarHBondContact O-N 2.83Å
400	Q	89.8	Confident	84.3	Confident	127 Å²	127	70.5 Å²	70.5	59%	0.593	34%	0.337	S	S	*	.			trans	-71.1	119.4	-174	-177.2	58.5	37	0	0	111.2	Y417 D418	Q400-Y417 WeakPolarHBondContact O-CA 3.39Å; Q400-Y417 WeakPolarHBondContact O-CD1 3.15Å; Q400-D418 HydrophobicContact CB-CB 4.17Å; Q400-D418 PolarHBondContact O-N 2.95Å
401	L	89.5	Confident	84.2	Confident	20 Å²	20	74.2 Å²	74.2	11%	0.105	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	111.6	-179.1	-169.1	68	0	0	0	109.6	Q392 L395 G399 L404 A415 Y417	Q392-L401 HydrophobicContact CG-CD2 4.15Å; L395-L401 HydrophobicContact CB-CD1 4.46Å; L395-L401 HydrophobicContact CB-CD2 4.08Å; L395-L401 HydrophobicContact CD1-CD2 4.38Å; G399-L401 PolarHBondContact O-N 2.83Å; L401-L404 HydrophobicContact CD2-CB 4.03Å; L401-L404 HydrophobicContact CD2-CD2 4.14Å; L401-L404 HydrophobicContact CD2-CG 4.49Å; L401-A415 HydrophobicContact CD1-CB 3.97Å; L401-Y417 HydrophobicContact CD1-CD1 4.45Å; L401-Y417 HydrophobicContact CD1-CD2 4.49Å; L401-Y417 HydrophobicContact CD1-CE1 4.21Å; L401-Y417 HydrophobicContact CD1-CE2 4.24Å
402	T	88.8	Confident	84.3	Confident	96 Å²	96	76.9 Å²	76.9	59%	0.589	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	-36.6	-178.4	-53.3	0	0	0	0	112.1	V416 D418	T402-V416 WeakPolarHBondContact CA-O 3.05Å; T402-V416 WeakPolarHBondContact CB-O 3.34Å; T402-V416 PolarHBondContact N-O 3.29Å; T402-D418 PolarHBondContact OG1-N 3.31Å
403	Y	87.3	Confident	84.4	Confident	75 Å²	75	72.5 Å²	72.5	29%	0.294	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	146.1	179.1	179	-102	0	0	0	111.8	D405 V416 V453	Y403-D405 HydrophobicContact CE1-CB 3.86Å; Y403-V416 HydrophobicContact CD1-CG2 4.07Å; Y403-V416 PolarHBondContact N-O 2.93Å; Y403-V416 VanDerWaalsContact N-O 3.17Å; Y403-V416 PolarHBondContact O-N 2.77Å; Y403-V453 HydrophobicContact CD1-CG1 3.86Å; Y403-V453 HydrophobicContact CE1-CG1 3.77Å
404	L	88.5	Confident	84.6	Confident	32 Å²	32	65.5 Å²	65.5	17%	0.168	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	107.9	176	-176.6	62.9	0	0	0	110	L391 Q392 L395 L401 W406 A413 I414 A415	L391-L404 HydrophobicContact CD2-CD1 4.48Å; Q392-L404 HydrophobicContact CB-CD2 3.83Å; Q392-L404 HydrophobicContact CG-CD2 4.32Å; L395-L404 HydrophobicContact CD1-CD1 3.65Å; L395-L404 HydrophobicContact CD1-CD2 4.42Å; L401-L404 HydrophobicContact CD2-CB 4.03Å; L401-L404 HydrophobicContact CD2-CD2 4.14Å; L401-L404 HydrophobicContact CD2-CG 4.49Å; L404-W406 HydrophobicContact CG-CB 4.42Å; L404-A413 HydrophobicContact CD1-CB 4.36Å; L404-I414 CarbonylContact C-O 3.58Å; L404-I414 WeakPolarHBondContact CA-O 3.49Å; L404-A415 HydrophobicContact CD1-CB 4.05Å
405	D	85.5	Confident	84.9	Confident	28 Å²	28	62.2 Å²	62.2	15%	0.15	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	94.6	159.6	177.2	19.7	0	0	0	107.9	Y403 S407 R410 A413 I414	Y403-D405 HydrophobicContact CE1-CB 3.86Å; D405-S407 PolarHBondContact OD1-OG 3.06Å; D405-R410 IonicContact OD2-NH1 3.55Å; D405-R410 PolarHBondContact OD2-NH1 2.87Å; D405-A413 CarbonylContact O-C 3.51Å; D405-A413 VanDerWaalsContact O-CA 3.28Å; D405-A413 WeakPolarHBondContact O-CA 3.31Å; D405-I414 HydrophobicContact CB-CB 4.45Å; D405-I414 PolarHBondContact N-O 3.34Å; D405-I414 PolarHBondContact O-N 3.29Å
406	W	83	Confident	85.1	Confident	27 Å²	27	63 Å²	63	10%	0.102	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	127.3	156.9	179.2	71.3	0	0	0	109.3	T386 V388 L391 L404 P408 A413	T386-W406 WeakPolarHBondContact O-CH2 3.46Å; T386-W406 WeakPolarHBondContact O-CZ2 3.14Å; V388-W406 HydrophobicContact CB-CE3 3.95Å; V388-W406 HydrophobicContact CB-CZ3 4.11Å; V388-W406 HydrophobicContact CG1-CE3 4.26Å; V388-W406 HydrophobicContact CG2-CE3 3.65Å; V388-W406 HydrophobicContact CG2-CZ3 3.53Å; L391-W406 HydrophobicContact CD2-CB 3.93Å; L391-W406 HydrophobicContact CD2-CD2 4.49Å; L391-W406 HydrophobicContact CD2-CG 3.83Å; L404-W406 HydrophobicContact CG-CB 4.42Å; W406-P408 HydrophobicContact CH2-CB 3.6Å; W406-P408 HydrophobicContact CH2-CG 3.91Å; W406-P408 HydrophobicContact CZ2-CB 3.65Å; W406-P408 HydrophobicContact CZ2-CG 4.37Å; W406-P408 HydrophobicContact CZ3-CB 4.38Å; W406-P408 HydrophobicContact CZ3-CG 4.25Å; W406-A413 HydrophobicContact CB-CB 3.79Å; W406-A413 HydrophobicContact CG-CB 4.14Å
407	S	73.5	Confident	85.3	Confident	37 Å²	37	60.4 Å²	60.4	26%	0.259	28%	0.282	S	S	.	.			trans	-133.8	124.2	173.5	36.8	0	0	0	0	108.1	D405 R409 R410	D405-S407 PolarHBondContact OD1-OG 3.06Å; S407-R409 PolarHBondContact O-N 3.3Å; S407-R410 WeakPolarHBondContact O-CA 3.01Å; S407-R410 WeakPolarHBondContact O-CB 3.25Å; S407-R410 PolarHBondContact O-N 3.01Å; S407-R410 WeakPolarHBondContact OG-CD 3.31Å
408	P	69.9	Low	85.5	Confident	82 Å²	82	58.8 Å²	58.8	53%	0.532	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-15.4	-168.1	17.9	-29.9	0	0	0	115.2	W406 R410	W406-P408 HydrophobicContact CH2-CB 3.6Å; W406-P408 HydrophobicContact CH2-CG 3.91Å; W406-P408 HydrophobicContact CZ2-CB 3.65Å; W406-P408 HydrophobicContact CZ2-CG 4.37Å; W406-P408 HydrophobicContact CZ3-CB 4.38Å; W406-P408 HydrophobicContact CZ3-CG 4.25Å; P408-R410 VanDerWaalsContact C-N 3.25Å; P408-R410 PolarHBondContact O-N 3.36Å
409	R	71.6	Confident	85.6	Confident	249 Å²	249	59.9 Å²	59.9	94%	0.94	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-21.1	170.8	-62.8	-172.5	-179.8	-160.5	1.4	112.9	S407	S407-R409 PolarHBondContact O-N 3.3Å
410	R	71.3	Confident	85.9	Confident	97 Å²	97	61 Å²	61	37%	0.366	30%	0.297	S	S	.	.	S	Bend	trans	-100.8	125.3	174.9	-64.2	177.5	171.4	-179.2	-8.3	108	D405 S407 P408 Y412	D405-R410 IonicContact OD2-NH1 3.55Å; D405-R410 PolarHBondContact OD2-NH1 2.87Å; S407-R410 WeakPolarHBondContact O-CA 3.01Å; S407-R410 WeakPolarHBondContact O-CB 3.25Å; S407-R410 PolarHBondContact O-N 3.01Å; S407-R410 WeakPolarHBondContact OG-CD 3.31Å; P408-R410 VanDerWaalsContact C-N 3.25Å; P408-R410 PolarHBondContact O-N 3.36Å; R410-Y412 HydrophobicContact CB-CD1 4.02Å; R410-Y412 HydrophobicContact CB-CE1 3.89Å; R410-Y412 HydrophobicContact CB-CG 4.46Å; R410-Y412 HydrophobicContact CG-CE1 4.16Å; R410-Y412 PolarHBondContact O-N 2.78Å
411	K	81.6	Confident	86.1	Confident	124 Å²	124	62 Å²	62	54%	0.539	30%	0.301	S	S	.	.	S	Bend	trans	-73.9	29.1	174.8	-61.1	-156.7	178.6	-158.6	0	113.6	G381 L382 E383	G381-K411 PolarHBondContact N-O 3.16Å; L382-K411 PolarHBondContact N-O 3.28Å; L382-K411 VanDerWaalsContact N-O 3.16Å; L382-K411 VanDerWaalsContact O-CA 3.3Å; L382-K411 WeakPolarHBondContact O-CA 3.41Å; L382-K411 WeakPolarHBondContact O-CB 3.43Å; E383-K411 WeakPolarHBondContact OE1-CE 3.38Å; E383-K411 IonicContact OE1-NZ 3.79Å; E383-K411 PolarHBondContact OE1-NZ 2.96Å; E383-K411 IonicContact OE2-NZ 2.63Å
412	Y	87.3	Confident	86.3	Confident	60 Å²	60	62 Å²	62	24%	0.235	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	156.2	-179.7	69.2	-95.8	0	0	0	111.8	Y378 I379 R410 I414	Y378-Y412 AromaticContact CD2-CD2 3.99Å; Y378-Y412 HydrophobicContact CD2-CD2 3.99Å; Y378-Y412 HydrophobicContact CD2-CG 4.45Å; Y378-Y412 HydrophobicContact CE2-CD1 4.14Å; Y378-Y412 AromaticContact CE2-CD2 3.32Å; Y378-Y412 HydrophobicContact CE2-CD2 3.32Å; Y378-Y412 AromaticContact CE2-CE2 3.89Å; Y378-Y412 HydrophobicContact CE2-CE2 3.89Å; Y378-Y412 AromaticContact CE2-CG 3.47Å; Y378-Y412 HydrophobicContact CE2-CG 3.47Å; Y378-Y412 VanDerWaalsContact CE2-CG 3.47Å; Y378-Y412 VanDerWaalsContact CZ-CB 3.47Å; Y378-Y412 AromaticContact CZ-CD2 3.98Å; Y378-Y412 AromaticContact CZ-CG 3.61Å; Y378-Y412 WeakPolarHBondContact OH-CB 3.47Å; Y378-Y412 WeakPolarHBondContact OH-CD1 3.46Å; I379-Y412 CarbonylContact O-C 3.5Å; I379-Y412 WeakPolarHBondContact O-CA 3.49Å; I379-Y412 WeakPolarHBondContact O-CB 3.42Å; R410-Y412 HydrophobicContact CB-CD1 4.02Å; R410-Y412 HydrophobicContact CB-CE1 3.89Å; R410-Y412 HydrophobicContact CB-CG 4.46Å; R410-Y412 HydrophobicContact CG-CE1 4.16Å; R410-Y412 PolarHBondContact O-N 2.78Å; Y412-I414 HydrophobicContact CD2-CG1 4.44Å; Y412-I414 HydrophobicContact CE2-CD1 4.31Å; Y412-I414 HydrophobicContact CE2-CG1 4.38Å
413	A	89.5	Confident	86.5	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	157.1	167.6	0	0	0	0	0	110.7	I379 L382 L391 L404 D405 W406	I379-A413 HydrophobicContact CB-CB 4.3Å; I379-A413 PolarHBondContact N-O 2.95Å; I379-A413 PolarHBondContact O-N 3.13Å; L382-A413 HydrophobicContact CD1-CB 3.54Å; L391-A413 HydrophobicContact CD2-CB 3.68Å; L404-A413 HydrophobicContact CD1-CB 4.36Å; D405-A413 CarbonylContact O-C 3.51Å; D405-A413 VanDerWaalsContact O-CA 3.28Å; D405-A413 WeakPolarHBondContact O-CA 3.31Å; W406-A413 HydrophobicContact CB-CB 3.79Å; W406-A413 HydrophobicContact CG-CB 4.14Å
414	I	90.7	Very high	86.9	Confident	20 Å²	20	57.6 Å²	57.6	10%	0.103	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	120.6	165.1	-67.8	171.8	0	0	0	107.8	L377 Y378 L404 D405 Y412 V416 I448 V453	L377-I414 WeakPolarHBondContact O-CA 3.5Å; Y378-I414 HydrophobicContact CD2-CG1 4.29Å; L404-I414 CarbonylContact C-O 3.58Å; L404-I414 WeakPolarHBondContact CA-O 3.49Å; D405-I414 HydrophobicContact CB-CB 4.45Å; D405-I414 PolarHBondContact N-O 3.34Å; D405-I414 PolarHBondContact O-N 3.29Å; Y412-I414 HydrophobicContact CD2-CG1 4.44Å; Y412-I414 HydrophobicContact CE2-CD1 4.31Å; Y412-I414 HydrophobicContact CE2-CG1 4.38Å; I414-V416 HydrophobicContact CG2-CG2 4.34Å; I414-I448 HydrophobicContact CD1-CD1 4.16Å; I414-I448 HydrophobicContact CG1-CD1 4.03Å; I414-I448 HydrophobicContact CG2-CD1 3.98Å; I414-V453 HydrophobicContact CG2-CB 4.36Å; I414-V453 HydrophobicContact CG2-CG1 3.76Å; I414-V453 HydrophobicContact CG2-CG2 3.64Å
415	A	91.6	Very high	87.1	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.9	179.7	0	0	0	0	0	109.7	C376 L377 I379 L395 L401 L404 Y417	C376-A415 CarbonylContact C-O 3.6Å; C376-A415 WeakPolarHBondContact CA-O 3.43Å; L377-A415 PolarHBondContact N-O 2.75Å; L377-A415 PolarHBondContact O-N 2.89Å; I379-A415 HydrophobicContact CD1-CB 4.21Å; L395-A415 HydrophobicContact CD1-CB 3.81Å; L395-A415 HydrophobicContact CD2-CB 4.47Å; L401-A415 HydrophobicContact CD1-CB 3.97Å; L404-A415 HydrophobicContact CD1-CB 4.05Å; A415-Y417 HydrophobicContact CB-CE2 4.4Å
416	V	92.8	Very high	87.4	Confident	15 Å²	15	57.5 Å²	57.5	9%	0.091	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	120.7	-178.7	-173.9	0	0	0	0	108.6	C376 T402 Y403 I414 V453	C376-V416 HydrophobicContact CB-CG2 4.47Å; T402-V416 WeakPolarHBondContact CA-O 3.05Å; T402-V416 WeakPolarHBondContact CB-O 3.34Å; T402-V416 PolarHBondContact N-O 3.29Å; Y403-V416 HydrophobicContact CD1-CG2 4.07Å; Y403-V416 PolarHBondContact N-O 2.93Å; Y403-V416 VanDerWaalsContact N-O 3.17Å; Y403-V416 PolarHBondContact O-N 2.77Å; I414-V416 HydrophobicContact CG2-CG2 4.34Å; V416-V453 HydrophobicContact CG2-CG1 4.03Å
417	Y	94.2	Very high	87.9	Confident	3 Å²	3	56.6 Å²	56.6	1%	0.012	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	165.7	177.5	-70.8	-89.6	0	0	0	111.9	H375 L377 L395 F398 Q400 L401 A415 A423 A426	H375-Y417 PolarHBondContact O-N 3.49Å; L377-Y417 HydrophobicContact CD1-CE2 4.09Å; L395-Y417 WeakPolarHBondContact CA-OH 3.19Å; L395-Y417 WeakPolarHBondContact CB-OH 3.32Å; L395-Y417 WeakPolarHBondContact CD2-OH 3.13Å; L395-Y417 WeakPolarHBondContact O-CE1 3.37Å; L395-Y417 PolarHBondContact O-OH 3.45Å; F398-Y417 HydrophobicContact CB-CE1 4.46Å; Q400-Y417 WeakPolarHBondContact O-CA 3.39Å; Q400-Y417 WeakPolarHBondContact O-CD1 3.15Å; L401-Y417 HydrophobicContact CD1-CD1 4.45Å; L401-Y417 HydrophobicContact CD1-CD2 4.49Å; L401-Y417 HydrophobicContact CD1-CE1 4.21Å; L401-Y417 HydrophobicContact CD1-CE2 4.24Å; A415-Y417 HydrophobicContact CB-CE2 4.4Å; Y417-A423 HydrophobicContact CD2-CB 3.79Å; Y417-A423 HydrophobicContact CG-CB 4.3Å; Y417-A426 HydrophobicContact CE2-CB 3.82Å; Y417-A426 WeakPolarHBondContact OH-CB 3.33Å
418	D	91.9	Very high	88.6	Confident	99 Å²	99	62.4 Å²	62.4	53%	0.529	29%	0.291	S	S	.	.	S	Bend	trans	-63.4	-42.2	165.5	67	-31.8	0	0	0	112.4	Q400 T402 S422	Q400-D418 HydrophobicContact CB-CB 4.17Å; Q400-D418 PolarHBondContact O-N 2.95Å; T402-D418 PolarHBondContact OG1-N 3.31Å; D418-S422 PolarHBondContact OD1-OG 2.95Å; D418-S422 VanDerWaalsContact OD1-OG 3.1Å
419	S	92	Very high	89.5	Confident	42 Å²	42	60.5 Å²	60.5	29%	0.294	28%	0.275	S	S	.	.			trans	-121.3	143.9	-172.2	178.2	0	0	0	0	112.3	E421 S422 A423	S419-E421 PolarHBondContact O-N 3.42Å; S419-E421 PolarHBondContact OG-N 3.29Å; S419-E421 VanDerWaalsContact OG-N 3.08Å; S419-S422 PolarHBondContact O-N 3.25Å; S419-A423 PolarHBondContact O-N 2.94Å
420	C	92.7	Very high	90.2	Very high	49 Å²	49	48.7 Å²	48.7	33%	0.331	23%	0.231	S	C	.	.	H	α-helix	trans	-63.7	-25.5	170.1	-167.4	0	0	0	0	111.8	L424	C420-L424 WeakPolarHBondContact O-CB 3.2Å; C420-L424 WeakPolarHBondContact O-CD1 3.41Å; C420-L424 WeakPolarHBondContact O-CG 3.26Å; C420-L424 PolarHBondContact O-N 3.47Å
421	E	94	Very high	90.9	Very high	148 Å²	148	45.8 Å²	45.8	69%	0.692	22%	0.221	S	C	*	.	H	α-helix	trans	-73.3	-45.7	176.8	-170.6	161.5	-157.6	0	0	111.7	S419 A423 L424 E425	S419-E421 PolarHBondContact O-N 3.42Å; S419-E421 PolarHBondContact OG-N 3.29Å; S419-E421 VanDerWaalsContact OG-N 3.08Å; E421-A423 VanDerWaalsContact C-N 3.29Å; E421-A423 PolarHBondContact O-N 2.96Å; E421-L424 WeakPolarHBondContact O-CB 3.31Å; E421-L424 PolarHBondContact O-N 2.87Å; E421-L424 VanDerWaalsContact O-N 3.1Å; E421-E425 PolarHBondContact O-N 2.71Å
422	S	94.4	Very high	90.8	Very high	19 Å²	19	42.8 Å²	42.8	13%	0.133	22%	0.216	C	C	.	.	H	α-helix	trans	-53.5	-46.5	170.2	-50.1	0	0	0	0	111.4	F398 D418 S419 E425 A426	F398-S422 WeakPolarHBondContact O-CA 3.09Å; D418-S422 PolarHBondContact OD1-OG 2.95Å; D418-S422 VanDerWaalsContact OD1-OG 3.1Å; S419-S422 PolarHBondContact O-N 3.25Å; S422-E425 PolarHBondContact O-N 3.48Å; S422-A426 VanDerWaalsContact O-CB 3.3Å; S422-A426 WeakPolarHBondContact O-CB 3.27Å; S422-A426 PolarHBondContact O-N 3.41Å
423	A	94	Very high	90.2	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-68.7	-33.1	177.3	0	0	0	0	0	113.4	S374 L377 Y417 S419 E421 N427 F447	S374-A423 WeakPolarHBondContact O-CB 3.35Å; L377-A423 HydrophobicContact CD2-CB 4.43Å; L377-A423 HydrophobicContact CG-CB 4.29Å; Y417-A423 HydrophobicContact CD2-CB 3.79Å; Y417-A423 HydrophobicContact CG-CB 4.3Å; S419-A423 PolarHBondContact O-N 2.94Å; E421-A423 VanDerWaalsContact C-N 3.29Å; E421-A423 PolarHBondContact O-N 2.96Å; A423-N427 VanDerWaalsContact O-CB 3.27Å; A423-N427 WeakPolarHBondContact O-CB 3.01Å; A423-N427 PolarHBondContact O-N 3.28Å; A423-F447 HydrophobicContact CB-CE1 4.16Å
424	L	93.8	Very high	89.2	Confident	79 Å²	79	44.4 Å²	44.4	41%	0.414	23%	0.23	S	C	.	.	H	α-helix	trans	-64.6	-45.9	172.9	-92.1	159	0	0	0	111.6	P373 C420 E421 N427 R428 F447	P373-L424 HydrophobicContact CB-CD1 4.16Å; P373-L424 HydrophobicContact CB-CD2 4.3Å; P373-L424 HydrophobicContact CB-CG 4.23Å; P373-L424 HydrophobicContact CG-CD1 4.47Å; P373-L424 HydrophobicContact CG-CD2 4.12Å; C420-L424 WeakPolarHBondContact O-CB 3.2Å; C420-L424 WeakPolarHBondContact O-CD1 3.41Å; C420-L424 WeakPolarHBondContact O-CG 3.26Å; C420-L424 PolarHBondContact O-N 3.47Å; E421-L424 WeakPolarHBondContact O-CB 3.31Å; E421-L424 PolarHBondContact O-N 2.87Å; E421-L424 VanDerWaalsContact O-N 3.1Å; L424-N427 PolarHBondContact O-N 3.34Å; L424-R428 WeakPolarHBondContact O-CB 3.41Å; L424-R428 PolarHBondContact O-N 2.85Å; L424-F447 HydrophobicContact CB-CZ 4.47Å; L424-F447 HydrophobicContact CD2-CE2 4.22Å; L424-F447 HydrophobicContact CD2-CZ 3.66Å; L424-F447 HydrophobicContact CG-CE1 4.38Å; L424-F447 HydrophobicContact CG-CZ 3.79Å
425	E	92.8	Very high	87.7	Confident	57 Å²	57	47 Å²	47	27%	0.266	26%	0.255	S	S	.	.	H	α-helix	trans	-68.6	-42.8	179.4	-177.9	57.2	-167.9	0	0	111.6	E421 S422 N427 R428 Q429	E421-E425 PolarHBondContact O-N 2.71Å; S422-E425 PolarHBondContact O-N 3.48Å; E425-N427 PolarHBondContact O-N 2.83Å; E425-R428 VanDerWaalsContact CD-NH2 3.27Å; E425-R428 WeakPolarHBondContact O-CB 3.3Å; E425-R428 PolarHBondContact O-N 2.93Å; E425-R428 VanDerWaalsContact O-N 3.17Å; E425-R428 IonicContact OE1-CZ 2.63Å; E425-R428 IonicContact OE1-NE 4Å; E425-R428 IonicContact OE1-NH2 2.67Å; E425-R428 PolarHBondContact OE1-NH2 2.75Å; E425-R428 IonicContact OE2-CZ 3.71Å; E425-R428 VanDerWaalsContact OE2-CZ 3.3Å; E425-R428 IonicContact OE2-NE 3.3Å; E425-R428 PolarHBondContact OE2-NE 2.98Å; E425-R428 IonicContact OE2-NH2 3.04Å; E425-R428 PolarHBondContact OE2-NH2 3.32Å; E425-Q429 PolarHBondContact O-N 3.06Å; E425-Q429 WeakPolarHBondContact OE1-CG 3.33Å; E425-Q429 PolarHBondContact OE1-NE2 2.97Å
426	A	92.9	Very high	86	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-57.5	-46.8	171.8	0	0	0	0	0	112.5	L377 F398 Y417 S422 R428 Q429 L430	L377-A426 HydrophobicContact CD1-CB 3.74Å; F398-A426 HydrophobicContact CB-CB 3.75Å; F398-A426 HydrophobicContact CD2-CB 3.48Å; F398-A426 VanDerWaalsContact CD2-CB 3.48Å; F398-A426 HydrophobicContact CE2-CB 4.38Å; F398-A426 HydrophobicContact CG-CB 3.89Å; Y417-A426 HydrophobicContact CE2-CB 3.82Å; Y417-A426 WeakPolarHBondContact OH-CB 3.33Å; S422-A426 VanDerWaalsContact O-CB 3.3Å; S422-A426 WeakPolarHBondContact O-CB 3.27Å; S422-A426 PolarHBondContact O-N 3.41Å; A426-R428 VanDerWaalsContact C-N 3.29Å; A426-R428 PolarHBondContact O-N 2.75Å; A426-Q429 PolarHBondContact O-N 2.84Å; A426-L430 VanDerWaalsContact O-CB 3.26Å; A426-L430 WeakPolarHBondContact O-CB 2.98Å; A426-L430 WeakPolarHBondContact O-CD1 3.42Å; A426-L430 WeakPolarHBondContact O-CG 3.19Å; A426-L430 PolarHBondContact O-N 3.45Å
427	N	92.4	Very high	84	Confident	8 Å²	8	53.6 Å²	53.6	4%	0.043	30%	0.297	C	S	.	.	H	α-helix	trans	-62.3	-37	176.6	-168.5	-0.8	0	0	0	111.6	L377 A423 L424 E425 K431 V445 F447	L377-N427 HydrophobicContact CD1-CB 4.26Å; L377-N427 HydrophobicContact CD2-CB 3.9Å; A423-N427 VanDerWaalsContact O-CB 3.27Å; A423-N427 WeakPolarHBondContact O-CB 3.01Å; A423-N427 PolarHBondContact O-N 3.28Å; L424-N427 PolarHBondContact O-N 3.34Å; E425-N427 PolarHBondContact O-N 2.83Å; N427-K431 WeakPolarHBondContact O-CB 3.44Å; N427-K431 VanDerWaalsContact O-CG 3.32Å; N427-K431 WeakPolarHBondContact O-CG 3.39Å; N427-K431 PolarHBondContact O-N 3.46Å; N427-K431 WeakPolarHBondContact OD1-CD 3.44Å; N427-K431 WeakPolarHBondContact OD1-CE 3.46Å; N427-K431 PolarHBondContact OD1-NZ 3.48Å; N427-V445 HydrophobicContact CB-CG1 4.38Å; N427-F447 HydrophobicContact CB-CE1 4.44Å; N427-F447 HydrophobicContact CB-CZ 4.11Å; N427-F447 WeakPolarHBondContact ND2-CD2 3.26Å; N427-F447 WeakPolarHBondContact ND2-CE2 3.44Å; N427-F447 VanDerWaalsContact ND2-CZ 3.31Å; N427-F447 WeakPolarHBondContact ND2-CZ 3.48Å
428	R	89.6	Confident	82	Confident	159 Å²	159	61.5 Å²	61.5	60%	0.6	33%	0.327	S	S	*	.	H	α-helix	trans	-66.3	-50.6	176.2	-170.2	-179.5	73.8	91.3	-2.5	111.9	L424 E425 A426 S432	L424-R428 WeakPolarHBondContact O-CB 3.41Å; L424-R428 PolarHBondContact O-N 2.85Å; E425-R428 VanDerWaalsContact CD-NH2 3.27Å; E425-R428 WeakPolarHBondContact O-CB 3.3Å; E425-R428 PolarHBondContact O-N 2.93Å; E425-R428 VanDerWaalsContact O-N 3.17Å; E425-R428 IonicContact OE1-CZ 2.63Å; E425-R428 IonicContact OE1-NE 4Å; E425-R428 IonicContact OE1-NH2 2.67Å; E425-R428 PolarHBondContact OE1-NH2 2.75Å; E425-R428 IonicContact OE2-CZ 3.71Å; E425-R428 VanDerWaalsContact OE2-CZ 3.3Å; E425-R428 IonicContact OE2-NE 3.3Å; E425-R428 PolarHBondContact OE2-NE 2.98Å; E425-R428 IonicContact OE2-NH2 3.04Å; E425-R428 PolarHBondContact OE2-NH2 3.32Å; A426-R428 VanDerWaalsContact C-N 3.29Å; A426-R428 PolarHBondContact O-N 2.75Å; R428-S432 PolarHBondContact O-N 3.45Å
429	Q	88.1	Confident	80	Confident	42 Å²	42	62.6 Å²	62.6	20%	0.196	34%	0.34	C	S	.	.	H	α-helix	trans	-70.8	-43.5	-177.7	-67.1	-156.9	42.4	0	0	112.3	F398 E425 A426 K431 S432 L433	F398-Q429 HydrophobicContact CD1-CB 4.37Å; F398-Q429 HydrophobicContact CD1-CG 4.42Å; F398-Q429 HydrophobicContact CE1-CB 3.77Å; F398-Q429 VanDerWaalsContact CE1-CD 3.46Å; F398-Q429 HydrophobicContact CE1-CG 4.1Å; F398-Q429 VanDerWaalsContact CE1-OE1 3.3Å; F398-Q429 HydrophobicContact CZ-CB 3.94Å; E425-Q429 PolarHBondContact O-N 3.06Å; E425-Q429 WeakPolarHBondContact OE1-CG 3.33Å; E425-Q429 PolarHBondContact OE1-NE2 2.97Å; A426-Q429 PolarHBondContact O-N 2.84Å; Q429-K431 VanDerWaalsContact C-N 3.26Å; Q429-K431 PolarHBondContact O-N 3.24Å; Q429-S432 PolarHBondContact O-N 2.59Å; Q429-S432 VanDerWaalsContact O-N 3.08Å; Q429-S432 PolarHBondContact O-OG 3.06Å; Q429-L433 WeakPolarHBondContact O-CG 3.41Å; Q429-L433 PolarHBondContact O-N 3.46Å
430	L	87	Confident	78.1	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-60.4	-36.8	177	-67.7	166.2	0	0	0	111.8	I379 M394 L395 F398 A426 L433 S434 V445	I379-L430 HydrophobicContact CD1-CD1 3.87Å; I379-L430 HydrophobicContact CG1-CD1 4.22Å; M394-L430 HydrophobicContact SD-CD2 3.99Å; L395-L430 HydrophobicContact CD2-CD1 3.85Å; F398-L430 HydrophobicContact CE2-CD2 4.21Å; F398-L430 HydrophobicContact CE2-CG 4.12Å; A426-L430 VanDerWaalsContact O-CB 3.26Å; A426-L430 WeakPolarHBondContact O-CB 2.98Å; A426-L430 WeakPolarHBondContact O-CD1 3.42Å; A426-L430 WeakPolarHBondContact O-CG 3.19Å; A426-L430 PolarHBondContact O-N 3.45Å; L430-L433 HydrophobicContact CD2-CD1 4.44Å; L430-L433 WeakPolarHBondContact O-CB 3.13Å; L430-L433 PolarHBondContact O-N 3.35Å; L430-S434 PolarHBondContact O-N 3.25Å; L430-S434 PolarHBondContact O-OG 3.37Å; L430-V445 HydrophobicContact CB-CG2 3.74Å; L430-V445 HydrophobicContact CD1-CG1 4.31Å; L430-V445 HydrophobicContact CD1-CG2 4.09Å
431	K	86.3	Confident	76.4	Confident	37 Å²	37	66.6 Å²	66.6	16%	0.161	35%	0.354	C	S	.	.	H	α-helix	trans	-68.6	-32.5	174.3	-79.1	175.4	172	158.9	0	113.9	A292 N427 Q429 S434 A435 V445 D446	A292-K431 WeakPolarHBondContact O-CE 3.29Å; A292-K431 PolarHBondContact O-NZ 3.36Å; N427-K431 WeakPolarHBondContact O-CB 3.44Å; N427-K431 VanDerWaalsContact O-CG 3.32Å; N427-K431 WeakPolarHBondContact O-CG 3.39Å; N427-K431 PolarHBondContact O-N 3.46Å; N427-K431 WeakPolarHBondContact OD1-CD 3.44Å; N427-K431 WeakPolarHBondContact OD1-CE 3.46Å; N427-K431 PolarHBondContact OD1-NZ 3.48Å; Q429-K431 VanDerWaalsContact C-N 3.26Å; Q429-K431 PolarHBondContact O-N 3.24Å; K431-S434 PolarHBondContact O-N 2.79Å; K431-A435 PolarHBondContact O-N 2.85Å; K431-V445 WeakPolarHBondContact CE-O 3.33Å; K431-V445 PolarHBondContact NZ-O 2.9Å; K431-D446 IonicContact NZ-OD1 2.89Å
432	S	79.4	Confident	75.2	Confident	61 Å²	61	64.1 Å²	64.1	43%	0.427	34%	0.339	S	S	.	.	H	α-helix	trans	-72.9	-31.8	171.6	62.7	0	0	0	0	111.9	R428 Q429 A435 T436	R428-S432 PolarHBondContact O-N 3.45Å; Q429-S432 PolarHBondContact O-N 2.59Å; Q429-S432 VanDerWaalsContact O-N 3.08Å; Q429-S432 PolarHBondContact O-OG 3.06Å; S432-A435 PolarHBondContact O-N 3.15Å; S432-T436 WeakPolarHBondContact O-CB 3.28Å; S432-T436 PolarHBondContact O-N 3.23Å; S432-T436 PolarHBondContact O-OG1 3.23Å
433	L	74.2	Confident	74.7	Confident	64 Å²	64	64.1 Å²	64.1	34%	0.335	34%	0.337	S	S	.	.	H	α-helix	trans	-64	-42.5	170	-65.9	173.2	0	0	0	111.5	M394 Q429 L430 A435 T436 S437	M394-L433 HydrophobicContact SD-CD1 4.07Å; Q429-L433 WeakPolarHBondContact O-CG 3.41Å; Q429-L433 PolarHBondContact O-N 3.46Å; L430-L433 HydrophobicContact CD2-CD1 4.44Å; L430-L433 WeakPolarHBondContact O-CB 3.13Å; L430-L433 PolarHBondContact O-N 3.35Å; L433-A435 PolarHBondContact O-N 3.06Å; L433-A435 VanDerWaalsContact O-N 3.17Å; L433-T436 PolarHBondContact O-N 3.43Å; L433-T436 VanDerWaalsContact O-N 3.15Å; L433-S437 VanDerWaalsContact O-CB 3.26Å; L433-S437 WeakPolarHBondContact O-CB 3.4Å; L433-S437 PolarHBondContact O-N 2.93Å
434	S	68	Low	74.4	Confident	29 Å²	29	66.6 Å²	66.6	20%	0.203	35%	0.346	C	S	.	.	H	α-helix	trans	-57.8	-27.2	173	-48	0	0	0	0	114.6	L430 K431 L443	L430-S434 PolarHBondContact O-N 3.25Å; L430-S434 PolarHBondContact O-OG 3.37Å; K431-S434 PolarHBondContact O-N 2.79Å; S434-L443 WeakPolarHBondContact CB-O 3.32Å; S434-L443 WeakPolarHBondContact OG-CB 3.17Å; S434-L443 PolarHBondContact OG-O 2.88Å
435	A	59.2	Low	74.2	Confident	76 Å²	76	62.9 Å²	62.9	63%	0.628	33%	0.327	S	S	*	.	H	α-helix	trans	-89.8	-18.8	-178.6	0	0	0	0	0	113.1	K431 S432 L433	K431-A435 PolarHBondContact O-N 2.85Å; S432-A435 PolarHBondContact O-N 3.15Å; L433-A435 PolarHBondContact O-N 3.06Å; L433-A435 VanDerWaalsContact O-N 3.17Å
436	T	56.6	Low	74.3	Confident	102 Å²	102	60.2 Å²	60.2	63%	0.626	32%	0.315	S	S	*	.	H	α-helix	trans	-114.8	-30.9	-171.6	-42.8	0	0	0	0	112.6	S432 L433	S432-T436 WeakPolarHBondContact O-CB 3.28Å; S432-T436 PolarHBondContact O-N 3.23Å; S432-T436 PolarHBondContact O-OG1 3.23Å; L433-T436 PolarHBondContact O-N 3.43Å; L433-T436 VanDerWaalsContact O-N 3.15Å
437	S	50.1	Low	74.3	Confident	50 Å²	50	60.4 Å²	60.4	35%	0.35	32%	0.315	S	S	.	.	S	Bend	trans	-93.4	106.1	-174.7	-172.1	0	0	0	0	111.7	L433	L433-S437 VanDerWaalsContact O-CB 3.26Å; L433-S437 WeakPolarHBondContact O-CB 3.4Å; L433-S437 PolarHBondContact O-N 2.93Å
438	R	52.7	Low	74.2	Confident	170 Å²	170	60.2 Å²	60.2	64%	0.642	31%	0.314	S	S	*	.			trans	48.2	129.8	168.1	-62.1	-175	176.8	-173.8	-0.4	116.4	N440 L441	R438-N440 PolarHBondContact O-N 3.43Å; R438-L441 PolarHBondContact O-N 3.44Å
439	P	50.4	Low	74	Confident	121 Å²	121	54 Å²	54	79%	0.786	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-17	-174.9	23.7	-35	0	0	0	115.7
440	N	51.4	Low	73.5	Confident	153 Å²	153	54.8 Å²	54.8	82%	0.818	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-16	178.2	-59.5	-18	0	0	0	114	R438 R442	R438-N440 PolarHBondContact O-N 3.43Å; N440-R442 PolarHBondContact O-N 3.39Å
441	L	57.8	Low	72.9	Confident	22 Å²	22	62.3 Å²	62.3	12%	0.115	34%	0.337	C	S	.	.			trans	-102.4	68.5	-170.5	-167.4	77.6	0	0	0	113.2	W385 R438 L443	W385-L441 HydrophobicContact CH2-CD2 4.34Å; W385-L441 HydrophobicContact CZ2-CD1 3.59Å; W385-L441 HydrophobicContact CZ2-CD2 3.64Å; W385-L441 HydrophobicContact CZ2-CG 4.27Å; R438-L441 PolarHBondContact O-N 3.44Å; L441-L443 VanDerWaalsContact C-N 3.29Å; L441-L443 HydrophobicContact CD1-CD2 4.08Å; L441-L443 HydrophobicContact CD2-CD1 4.32Å; L441-L443 HydrophobicContact CD2-CD2 4.47Å; L441-L443 HydrophobicContact CD2-CG 4.22Å; L441-L443 HydrophobicContact CG-CD2 4.06Å; L441-L443 HydrophobicContact CG-CG 4.03Å; L441-L443 PolarHBondContact O-N 3.22Å
442	R	68.8	Low	71.9	Confident	97 Å²	97	63.8 Å²	63.8	37%	0.366	35%	0.346	S	S	.	.			trans	-84.4	66.3	-177.2	-52.2	-178.6	93.3	-134.3	8	111.6	S286 E289 N440 R444	S286-R442 PolarHBondContact OG-NH2 3.28Å; E289-R442 VanDerWaalsContact CD-NH2 3.31Å; E289-R442 IonicContact OE1-CZ 3.66Å; E289-R442 IonicContact OE1-NH1 3.78Å; E289-R442 PolarHBondContact OE1-NH1 2.91Å; E289-R442 IonicContact OE1-NH2 3.92Å; E289-R442 PolarHBondContact OE1-NH2 3.2Å; E289-R442 IonicContact OE2-CZ 2.73Å; E289-R442 IonicContact OE2-NH1 2.89Å; E289-R442 PolarHBondContact OE2-NH1 3.21Å; E289-R442 IonicContact OE2-NH2 2.77Å; N440-R442 PolarHBondContact O-N 3.39Å; R442-R444 PolarHBondContact O-N 2.86Å; R442-R444 PolarHBondContact O-NH1 3.26Å
443	L	82.8	Confident	71.4	Confident	18 Å²	18	61.9 Å²	61.9	9%	0.094	33%	0.332	C	S	.	.			trans	-59.2	131.9	175.1	-54.2	178.2	0	0	0	110.1	G380 G381 L382 S434 L441	G380-L443 CarbonylContact O-C 3.58Å; G380-L443 WeakPolarHBondContact O-CA 3.35Å; G381-L443 WeakPolarHBondContact O-CD2 3.32Å; L382-L443 HydrophobicContact CD2-CD2 3.84Å; L382-L443 HydrophobicContact CG-CD2 4.43Å; S434-L443 WeakPolarHBondContact CB-O 3.32Å; S434-L443 WeakPolarHBondContact OG-CB 3.17Å; S434-L443 PolarHBondContact OG-O 2.88Å; L441-L443 VanDerWaalsContact C-N 3.29Å; L441-L443 HydrophobicContact CD1-CD2 4.08Å; L441-L443 HydrophobicContact CD2-CD1 4.32Å; L441-L443 HydrophobicContact CD2-CD2 4.47Å; L441-L443 HydrophobicContact CD2-CG 4.22Å; L441-L443 HydrophobicContact CG-CD2 4.06Å; L441-L443 HydrophobicContact CG-CG 4.03Å; L441-L443 PolarHBondContact O-N 3.22Å
444	R	87.3	Confident	70.4	Confident	53 Å²	53	66.6 Å²	66.6	20%	0.2	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	108.4	177.5	-68.8	177.6	-60.5	-77.6	-7.4	109.2	V344 D345 G380 R442	V344-R444 HydrophobicContact CG1-CB 3.87Å; V344-R444 WeakPolarHBondContact CG1-O 3.48Å; V344-R444 HydrophobicContact CG2-CB 4.26Å; D345-R444 IonicContact OD1-CZ 3.59Å; D345-R444 VanDerWaalsContact OD1-CZ 3.24Å; D345-R444 IonicContact OD1-NE 2.75Å; D345-R444 PolarHBondContact OD1-NE 3.46Å; D345-R444 IonicContact OD1-NH2 3.75Å; D345-R444 PolarHBondContact OD1-NH2 3.2Å; D345-R444 IonicContact OD2-CZ 3.94Å; D345-R444 IonicContact OD2-NH2 3.21Å; D345-R444 PolarHBondContact OD2-NH2 3.34Å; G380-R444 PolarHBondContact N-O 3.35Å; G380-R444 PolarHBondContact O-N 3.01Å; R442-R444 PolarHBondContact O-N 2.86Å; R442-R444 PolarHBondContact O-NH1 3.26Å
445	V	91.3	Very high	69.5	Low	0 Å²	0	68.9 Å²	68.9	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	140.7	179.9	-173.4	0	0	0	0	110.1	L377 Y378 I379 N427 L430 K431	L377-V445 HydrophobicContact CB-CG1 4.43Å; L377-V445 HydrophobicContact CD1-CG1 4.19Å; L377-V445 HydrophobicContact CD2-CG1 4.4Å; Y378-V445 VanDerWaalsContact O-CA 3.28Å; Y378-V445 WeakPolarHBondContact O-CA 3.47Å; I379-V445 HydrophobicContact CB-CG2 4.4Å; I379-V445 HydrophobicContact CG1-CG1 4.21Å; I379-V445 HydrophobicContact CG1-CG2 4.19Å; I379-V445 HydrophobicContact CG2-CG2 4.09Å; N427-V445 HydrophobicContact CB-CG1 4.38Å; L430-V445 HydrophobicContact CB-CG2 3.74Å; L430-V445 HydrophobicContact CD1-CG1 4.31Å; L430-V445 HydrophobicContact CD1-CG2 4.09Å; K431-V445 WeakPolarHBondContact CE-O 3.33Å; K431-V445 PolarHBondContact NZ-O 2.9Å
446	D	93.1	Very high	68.6	Low	2 Å²	2	74 Å²	74	1%	0.011	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	167	158.5	-155.5	21	0	0	0	111.9	T293 R294 V344 A371 Y378 K431	T293-D446 WeakPolarHBondContact CA-OD2 3.39Å; T293-D446 WeakPolarHBondContact CB-OD2 3.44Å; R294-D446 PolarHBondContact N-OD2 2.78Å; V344-D446 HydrophobicContact CB-CB 4.09Å; V344-D446 HydrophobicContact CG2-CB 4.46Å; A371-D446 WeakPolarHBondContact CB-OD1 3.31Å; Y378-D446 PolarHBondContact N-O 2.79Å; Y378-D446 PolarHBondContact O-N 2.88Å; K431-D446 IonicContact NZ-OD1 2.89Å
447	F	93.6	Very high	67.7	Low	4 Å²	4	73.6 Å²	73.6	2%	0.018	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	142	174.8	-59.5	-74.1	0	0	0	112.4	R294 A371 I372 P373 S374 C376 L377 A423 L424 N427	R294-F447 VanDerWaalsContact CZ-O 3.24Å; R294-F447 PolarHBondContact NE-O 3.43Å; R294-F447 PolarHBondContact NH2-O 3.47Å; A371-F447 HydrophobicContact CB-CD2 4.01Å; A371-F447 HydrophobicContact CB-CE2 4.2Å; I372-F447 WeakPolarHBondContact O-CB 3.1Å; I372-F447 WeakPolarHBondContact O-CD2 3.5Å; I372-F447 WeakPolarHBondContact O-CG 3.08Å; P373-F447 HydrophobicContact CB-CE1 4.49Å; P373-F447 HydrophobicContact CB-CE2 4.25Å; P373-F447 HydrophobicContact CB-CZ 4.17Å; P373-F447 HydrophobicContact CG-CE2 4.34Å; S374-F447 WeakPolarHBondContact O-CD1 3.43Å; S374-F447 VanDerWaalsContact O-CE1 3.25Å; S374-F447 WeakPolarHBondContact O-CE1 3.44Å; C376-F447 VanDerWaalsContact O-CA 3.32Å; C376-F447 WeakPolarHBondContact O-CA 3.33Å; L377-F447 HydrophobicContact CD2-CD1 3.36Å; L377-F447 HydrophobicContact CD2-CE1 3.59Å; L377-F447 HydrophobicContact CD2-CG 4.09Å; L377-F447 HydrophobicContact CD2-CZ 4.46Å; A423-F447 HydrophobicContact CB-CE1 4.16Å; L424-F447 HydrophobicContact CB-CZ 4.47Å; L424-F447 HydrophobicContact CD2-CE2 4.22Å; L424-F447 HydrophobicContact CD2-CZ 3.66Å; L424-F447 HydrophobicContact CG-CE1 4.38Å; L424-F447 HydrophobicContact CG-CZ 3.79Å; N427-F447 HydrophobicContact CB-CE1 4.44Å; N427-F447 HydrophobicContact CB-CZ 4.11Å; N427-F447 WeakPolarHBondContact ND2-CD2 3.26Å; N427-F447 WeakPolarHBondContact ND2-CE2 3.44Å; N427-F447 VanDerWaalsContact ND2-CZ 3.31Å; N427-F447 WeakPolarHBondContact ND2-CZ 3.48Å
448	I	91.5	Very high	67	Low	3 Å²	3	79.9 Å²	79.9	2%	0.015	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	171.2	170.1	57.8	167.4	0	0	0	111.7	S374 C376 Y378 I414 V453	S374-I448 VanDerWaalsContact CB-O 3.26Å; S374-I448 WeakPolarHBondContact CB-O 3.34Å; S374-I448 PolarHBondContact OG-O 3.21Å; C376-I448 HydrophobicContact CB-CG1 3.82Å; C376-I448 PolarHBondContact O-N 2.81Å; Y378-I448 HydrophobicContact CG-CG2 4.47Å; I414-I448 HydrophobicContact CD1-CD1 4.16Å; I414-I448 HydrophobicContact CG1-CD1 4.03Å; I414-I448 HydrophobicContact CG2-CD1 3.98Å; I448-V453 HydrophobicContact CD1-CG2 3.78Å
449	N	84.7	Confident	66.1	Low	29 Å²	29	79.4 Å²	79.4	16%	0.155	41%	0.408	C	S	.	.			trans	-79.1	144.5	174.4	-59	9.2	0	0	0	109.9	R294 E321 R340 E451 L452	R294-N449 PolarHBondContact NH1-OD1 3.4Å; R294-N449 PolarHBondContact NH2-OD1 2.8Å; E321-N449 VanDerWaalsContact OE1-CG 3.26Å; E321-N449 PolarHBondContact OE1-ND2 3.28Å; E321-N449 PolarHBondContact OE1-OD1 2.87Å; R340-N449 PolarHBondContact NH2-OD1 3.41Å; N449-E451 PolarHBondContact O-N 3.04Å; N449-L452 HydrophobicContact CB-CD1 4.44Å; N449-L452 HydrophobicContact CB-CG 4.36Å; N449-L452 PolarHBondContact O-N 2.8Å
450	P	77.4	Confident	65.1	Low	59 Å²	59	80.8 Å²	80.8	38%	0.383	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-61.6	-31.8	173.5	25.7	-34.3	0	0	0	112.8	L452 V453	P450-L452 PolarHBondContact O-N 3.03Å; P450-L452 VanDerWaalsContact O-N 3.16Å; P450-V453 WeakPolarHBondContact O-CA 3.33Å; P450-V453 WeakPolarHBondContact O-CB 3.41Å; P450-V453 PolarHBondContact O-N 3.39Å
451	E	74.2	Confident	64	Low	159 Å²	159	80.5 Å²	80.5	74%	0.743	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-60.1	-25.1	178.8	-61.8	165.2	161.8	0	0	113.8	N449 V453	N449-E451 PolarHBondContact O-N 3.04Å; E451-V453 VanDerWaalsContact C-N 3.26Å
452	L	66.5	Low	62.8	Low	68 Å²	68	89.6 Å²	89.6	36%	0.356	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-79.7	-11	175.3	-63.1	175.7	0	0	0	112.5	Q342 N449 P450	Q342-L452 HydrophobicContact CG-CD1 3.78Å; Q342-L452 HydrophobicContact CG-CD2 4.36Å; N449-L452 HydrophobicContact CB-CD1 4.44Å; N449-L452 HydrophobicContact CB-CG 4.36Å; N449-L452 PolarHBondContact O-N 2.8Å; P450-L452 PolarHBondContact O-N 3.03Å; P450-L452 VanDerWaalsContact O-N 3.16Å
453	V	67.3	Low	61	Low	20 Å²	20	90.6 Å²	90.6	12%	0.121	46%	0.462	C	S	.	.			trans	-103.5	85.3	-177.9	-167.3	0	0	0	0	108.8	C376 Y403 I414 V416 I448 P450 E451 P455	C376-V453 HydrophobicContact CB-CG2 4.47Å; Y403-V453 HydrophobicContact CD1-CG1 3.86Å; Y403-V453 HydrophobicContact CE1-CG1 3.77Å; I414-V453 HydrophobicContact CG2-CB 4.36Å; I414-V453 HydrophobicContact CG2-CG1 3.76Å; I414-V453 HydrophobicContact CG2-CG2 3.64Å; V416-V453 HydrophobicContact CG2-CG1 4.03Å; I448-V453 HydrophobicContact CD1-CG2 3.78Å; P450-V453 WeakPolarHBondContact O-CA 3.33Å; P450-V453 WeakPolarHBondContact O-CB 3.41Å; P450-V453 PolarHBondContact O-N 3.39Å; E451-V453 VanDerWaalsContact C-N 3.26Å; V453-P455 WeakPolarHBondContact O-CD 3.4Å
454	Q	53.2	Low	58.6	Low	164 Å²	164	96.7 Å²	96.7	77%	0.766	50%	0.495	S	S	*	.			trans	-77.1	110.3	171.3	-67.3	-175.4	6.1	0	0	110.1	K456	Q454-K456 PolarHBondContact O-N 3.2Å
455	P	50.3	Low	56.4	Low	77 Å²	77	99.8 Å²	99.8	50%	0.5	53%	0.525	S	S	.	.			trans	-65.7	132.3	166.5	29.6	-34.5	0	0	0	108.8	V453 S457	V453-P455 WeakPolarHBondContact O-CD 3.4Å; P455-S457 PolarHBondContact O-N 3.06Å
456	K	40.7	Very low	53.7	Low	184 Å²	184	107.1 Å²	107.1	80%	0.8	56%	0.564	S	S	*	*	S	Bend	trans	-73.9	38.2	-174	-71.4	-177.1	171.1	178.3	0	114.4	Q454	Q454-K456 PolarHBondContact O-N 3.2Å
457	S	36	Very low	51.1	Low	93 Å²	93	113.7 Å²	113.7	65%	0.65	60%	0.604	S	S	*	*			trans	-133.4	36.8	-163.7	62.7	0	0	0	0	115.2	P455	P455-S457 PolarHBondContact O-N 3.06Å
458	Q	35.3	Very low	48.3	Very low	182 Å²	182	122.8 Å²	122.8	85%	0.85	65%	0.647	S	S	*	*			trans	-137.3	10.1	168.1	-71.5	-164.2	-5.5	0	0	115.3	L460	Q458-L460 PolarHBondContact O-N 3.16Å
459	I	33.8	Very low	45.7	Very low	159 Å²	159	126.5 Å²	126.5	82%	0.815	69%	0.686	S	S	*	*	S	Bend	trans	-99.2	63	173.7	-47.4	-177.8	0	0	0	110.4
460	L	30	Very low	43.4	Very low	150 Å²	150	133.3 Å²	133.3	79%	0.785	72%	0.722	S	S	*	*	S	Bend	trans	-161.7	162.3	157.2	-146.7	65.1	0	0	0	107.9	Q458	Q458-L460 PolarHBondContact O-N 3.16Å
461	N	28.1	Very low	41.4	Very low	148 Å²	148	133.7 Å²	133.7	79%	0.791	74%	0.736	S	S	*	*			trans	75.9	56.6	-178.2	-49.6	6.2	0	0	0	115.7
462	K	32.6	Very low	39.7	Very low	213 Å²	213	134.2 Å²	134.2	93%	0.926	74%	0.739	S	S	*	*			trans	-153.2	72.7	145	-126.1	-179.5	-176.3	-173.1	0	112
463	T	32	Very low	38.2	Very low	118 Å²	118	137 Å²	137	72%	0.724	75%	0.754	S	S	*	*			trans	-115.5	171.6	162.5	-22	0	0	0	0	107.7
464	D	32.7	Very low	36.7	Very low	145 Å²	145	142 Å²	142	78%	0.775	78%	0.78	S	S	*	*			trans	70.8	66.9	162.9	-44.5	-25.5	0	0	0	116.8
465	S	40.7	Very low	35.9	Very low	119 Å²	119	141.5 Å²	141.5	83%	0.832	78%	0.778	S	S	*	*			trans	-143.2	105.1	148	65.4	0	0	0	0	109.8
466	N	33.9	Very low	34.9	Very low	153 Å²	153	145.8 Å²	145.8	82%	0.818	79%	0.793	S	S	*	*			trans	-70.9	143.7	-172.5	-52.2	-30.8	0	0	0	112.5
467	T	37.8	Very low	34.6	Very low	140 Å²	140	143 Å²	143	86%	0.859	80%	0.797	S	S	*	*			trans	-159.3	132.1	144.4	-67.4	0	0	0	0	107.4
468	E	35.8	Very low	34.3	Very low	196 Å²	196	145.6 Å²	145.6	92%	0.916	80%	0.799	S	S	*	*			trans	-84.2	146.4	179.3	-60.6	177.2	142	0	0	110.6
469	G	37.3	Very low	34.4	Very low	81 Å²	81	142.3 Å²	142.3	84%	0.835	80%	0.796	S	S	*	*			trans	-173.4	105	-178.6	0	0	0	0	0	111.5
470	D	35.1	Very low	34.2	Very low	172 Å²	172	144.7 Å²	144.7	92%	0.92	80%	0.795	S	S	*	*			trans	-81.6	165.2	-179.2	-169.4	14.8	0	0	0	111.9
471	G	36.2	Very low	34.3	Very low	66 Å²	66	144.7 Å²	144.7	68%	0.68	80%	0.796	S	S	*	*			trans	130.5	75	169.1	0	0	0	0	0	117.5
472	Q	39.5	Very low	34.5	Very low	171 Å²	171	142.6 Å²	142.6	80%	0.799	80%	0.799	S	S	*	*			trans	8.4	142.3	148.9	-71.3	-178.8	-56.9	0	0	123.2
473	D	34.5	Very low	34.6	Very low	125 Å²	125	137.9 Å²	137.9	67%	0.668	78%	0.783	S	S	*	*			trans	85.7	111.4	131.8	-77	26	0	0	0	124.3
474	N	35.3	Very low	34.7	Very low	125 Å²	125	140.8 Å²	140.8	67%	0.668	79%	0.792	S	S	*	*				108.2	128.8	119.3	-92.2	-53.1	0	0	0	123.2
475	Q	36.7	Very low	34.8	Very low	155 Å²	155	142.9 Å²	142.9	72%	0.724	79%	0.789	S	S	*	*			trans	75.7	110	148.7	-67.5	177.3	47.8	0	0	123
476	M	29.5	Very low	34.5	Very low	167 Å²	167	141.5 Å²	141.5	82%	0.823	78%	0.78	S	S	*	*				51.5	115.7	129.4	-69.9	170.1	52	0	0	121.3
477	S	33.9	Very low	34.4	Very low	126 Å²	126	142.2 Å²	142.2	88%	0.881	78%	0.783	S	S	*	*				-163.3	154.8	110.7	-84	0	0	0	0	112.5
478	E	30.4	Very low	34.2	Very low	146 Å²	146	142.6 Å²	142.6	68%	0.682	78%	0.78	S	S	*	*			trans	-77.6	144.4	-176.7	-67.3	-176.7	89.7	0	0	113.8	R480	E478-R480 IonicContact OE1-CZ 3.2Å; E478-R480 IonicContact OE1-NE 3.26Å; E478-R480 IonicContact OE1-NH2 2.66Å; E478-R480 PolarHBondContact OE1-NH2 2.9Å
479	S	36.3	Very low	34	Very low	114 Å²	114	136.5 Å²	136.5	80%	0.797	77%	0.77	S	S	*	*			trans	-155.3	120.2	152.6	-84.3	0	0	0	0	111.1	N481	S479-N481 PolarHBondContact O-N 3.1Å
480	R	30.9	Very low	33.9	Very low	209 Å²	209	139.9 Å²	139.9	79%	0.789	77%	0.767	S	S	*	*			trans	-83.6	76.5	-165.3	-68	-174.2	175.7	112.8	12.4	113.9	E478 A482	E478-R480 IonicContact OE1-CZ 3.2Å; E478-R480 IonicContact OE1-NE 3.26Å; E478-R480 IonicContact OE1-NH2 2.66Å; E478-R480 PolarHBondContact OE1-NH2 2.9Å; R480-A482 PolarHBondContact O-N 3.05Å
481	N	31.9	Very low	33.6	Very low	149 Å²	149	137.7 Å²	137.7	80%	0.797	76%	0.762	S	S	*	*			trans	-87.1	88.1	167.6	-77.2	-28.4	0	0	0	111.3	S479 I483	S479-N481 PolarHBondContact O-N 3.1Å; N481-I483 PolarHBondContact O-N 2.96Å
482	A	31.8	Very low	33.6	Very low	105 Å²	105	141 Å²	141	87%	0.868	77%	0.769	S	S	*	*			trans	-75.2	84	178.4	0	0	0	0	0	112.2	R480	R480-A482 PolarHBondContact O-N 3.05Å
483	I	34.7	Very low	33.2	Very low	114 Å²	114	139.2 Å²	139.2	59%	0.585	77%	0.77	S	S	*	*			trans	-63.7	141.4	174.7	-58	169.1	0	0	0	110.2	N481 R485	N481-I483 PolarHBondContact O-N 2.96Å; I483-R485 VanDerWaalsContact C-N 3.26Å; I483-R485 HydrophobicContact CG2-CB 4.28Å; I483-R485 HydrophobicContact CG2-CG 3.79Å; I483-R485 PolarHBondContact O-N 3.29Å
484	I	34.2	Very low	33.2	Very low	178 Å²	178	138 Å²	138	91%	0.913	78%	0.777	S	S	*	*			trans	-72.6	84.2	167.6	-56.2	179.6	0	0	0	109.5
485	R	35	Very low	33.2	Very low	189 Å²	189	138.6 Å²	138.6	71%	0.713	78%	0.78	S	S	*	*			trans	-145.6	147.1	172.6	-82.6	-179.8	-175.2	-166.4	3.7	106.9	I483	I483-R485 VanDerWaalsContact C-N 3.26Å; I483-R485 HydrophobicContact CG2-CB 4.28Å; I483-R485 HydrophobicContact CG2-CG 3.79Å; I483-R485 PolarHBondContact O-N 3.29Å
486	S	33.1	Very low	33	Very low	91 Å²	91	138.4 Å²	138.4	64%	0.636	78%	0.784	S	S	*	*			cis	-151	149.1	-16.8	-78.5	0	0	0	0	106
487	D	33.7	Very low	33.2	Very low	168 Å²	168	136.7 Å²	136.7	90%	0.898	79%	0.787	S	S	*	*			trans	-104.1	115.3	169	-160.9	8	0	0	0	108.3
488	N	32.2	Very low	32.9	Very low	148 Å²	148	142 Å²	142	79%	0.791	79%	0.788	S	S	*	*			trans	-95.7	116.8	-167.7	-77.3	-13	0	0	0	110.6
489	G	32.9	Very low	33.1	Very low	67 Å²	67	142.1 Å²	142.1	69%	0.691	79%	0.792	S	S	*	*			trans	-162.1	87.9	-179.2	0	0	0	0	0	115.2
490	I	35.2	Very low	32.8	Very low	153 Å²	153	147.9 Å²	147.9	79%	0.785	80%	0.796	S	S	*	*			trans	56	114.6	153.3	-48.6	173.8	0	0	0	117.3	V492	I490-V492 HydrophobicContact CG2-CG2 4.44Å
491	P	29	Very low	32.9	Very low	125 Å²	125	143.9 Å²	143.9	81%	0.812	80%	0.795	S	S	*	*			trans	-82	140.9	167.2	34	-32.1	0	0	0	111.9
492	V	34.7	Very low	32.8	Very low	137 Å²	137	143.6 Å²	143.6	83%	0.83	79%	0.793	S	S	*	*			trans	-132.1	133.3	163.9	-179.7	0	0	0	0	108.4	I490	I490-V492 HydrophobicContact CG2-CG2 4.44Å
493	T	30.6	Very low	33.1	Very low	132 Å²	132	145.1 Å²	145.1	81%	0.81	79%	0.787	S	S	*	*			trans	-80.7	128.4	-166.1	-47.4	0	0	0	0	113.3
494	A	35.7	Very low	33.1	Very low	99 Å²	99	148.1 Å²	148.1	82%	0.818	80%	0.798	S	S	*	*			trans	-151.3	141.7	161.1	0	0	0	0	0	110.6
495	N	35.4	Very low	33.1	Very low	139 Å²	139	149.7 Å²	149.7	74%	0.743	80%	0.799	S	S	*	*			trans	-85.4	152.5	-163.6	-67.9	-31.4	0	0	0	115.1
496	N	33.1	Very low	33.2	Very low	151 Å²	151	148 Å²	148	81%	0.807	80%	0.804	S	S	*	*			trans	37.3	122.6	142.1	-62.9	-17.5	0	0	0	120.5
497	C	31.8	Very low	33.2	Very low	131 Å²	131	147 Å²	147	89%	0.885	81%	0.808	S	S	*	*				-149.1	124.2	114.2	-133.1	0	0	0	0	110.8
498	R	29.2	Very low	33.3	Very low	236 Å²	236	141.8 Å²	141.8	89%	0.891	79%	0.794	S	S	*	*			trans	-126	121.5	176.7	-121.4	-176.3	-174.3	162	1.8	107.1
499	I	34.6	Very low	33.8	Very low	149 Å²	149	141.2 Å²	141.2	76%	0.764	80%	0.798	S	S	*	*			trans	-108.7	109.3	168.2	-59.1	-179.8	0	0	0	107.8	T501	I499-T501 HydrophobicContact CG2-CG2 4.36Å
500	R	29	Very low	33.9	Very low	235 Å²	235	148.1 Å²	148.1	89%	0.887	81%	0.805	S	S	*	*			trans	-119.3	131	153.3	-82.9	-174.3	171.2	-168.5	-3.1	105.3
501	T	33.5	Very low	34.1	Very low	126 Å²	126	147.1 Å²	147.1	77%	0.773	81%	0.806	S	S	*	*			trans	-136.6	107.4	169.4	48.9	0	0	0	0	108.3	I499	I499-T501 HydrophobicContact CG2-CG2 4.36Å
502	N	30.5	Very low	34.3	Very low	142 Å²	142	146.5 Å²	146.5	76%	0.759	80%	0.8	S	S	*	*			trans	-137.4	168.2	151.8	-149	74.3	0	0	0	106.3
503	D	36.3	Very low	34.3	Very low	137 Å²	137	146 Å²	146	73%	0.733	79%	0.793	S	S	*	*			trans	78.7	121.6	173.2	-47.7	-28.5	0	0	0	116.1
504	H	35.4	Very low	34.5	Very low	178 Å²	178	146.2 Å²	146.2	82%	0.824	79%	0.785	S	S	*	*			trans	-65.8	151.6	177.5	-50.9	70.5	0	0	0	111.2
505	F	34.6	Very low	34.6	Very low	210 Å²	210	149.4 Å²	149.4	92%	0.921	78%	0.777	S	S	*	*				-162.5	168.2	112.6	-121.9	-90	0	0	0	112.3
506	D	35.8	Very low	34.6	Very low	154 Å²	154	151.9 Å²	151.9	82%	0.824	78%	0.777	S	S	*	*			trans	-75.1	167.5	-170.9	-165.1	5.8	0	0	0	114.8
507	G	34.4	Very low	34.8	Very low	70 Å²	70	150.8 Å²	150.8	72%	0.722	77%	0.77	S	S	*	*			trans	146.5	89	167.6	0	0	0	0	0	116.8
508	G	35.3	Very low	34.9	Very low	59 Å²	59	151.9 Å²	151.9	61%	0.608	76%	0.762	S	S	*	*			trans	-63.5	177.2	-171.8	0	0	0	0	0	120.7
509	P	42.4	Very low	35.5	Very low	135 Å²	135	148 Å²	148	88%	0.877	76%	0.759	S	S	*	*			trans	-86.2	159.5	-177.1	36	-35.8	0	0	0	113.7
510	Y	36	Very low	35.7	Very low	213 Å²	213	146.1 Å²	146.1	84%	0.835	76%	0.756	S	S	*	*			trans	-117.5	162.3	-178.3	-84.5	-85.8	0	0	0	114
511	T	38.7	Very low	36.1	Very low	131 Å²	131	140.2 Å²	140.2	80%	0.804	76%	0.758	S	S	*	*			trans	79.1	141.8	164.4	74.5	0	0	0	0	117.7
512	T	33.8	Very low	36.2	Very low	112 Å²	112	138 Å²	138	69%	0.687	76%	0.76	S	S	*	*			cis	-166.6	162.5	-15.1	-99.3	0	0	0	0	109.4
513	N	33.8	Very low	36.4	Very low	128 Å²	128	138.4 Å²	138.4	68%	0.684	76%	0.762	S	S	*	*			trans	88.6	136.5	174.2	-63.5	-27.1	0	0	0	117.2
514	Q	35.6	Very low	36.6	Very low	136 Å²	136	141.6 Å²	141.6	64%	0.636	77%	0.769	S	S	*	*			cis	-163.2	146.3	-16.5	-124.5	169.4	-6.9	0	0	111.8
515	Y	37.1	Very low	36.4	Very low	165 Å²	165	140.4 Å²	140.4	65%	0.647	77%	0.769	S	S	*	*			trans	62.2	127	154.7	-69.2	-57.7	0	0	0	123.8
516	Y	36.1	Very low	36.5	Very low	191 Å²	191	137.8 Å²	137.8	75%	0.749	76%	0.764	S	S	*	*			trans	55.5	141.5	139.2	-61.2	-46.7	0	0	0	121.7
517	I	36.8	Very low	36.6	Very low	128 Å²	128	135.8 Å²	135.8	66%	0.656	76%	0.758	S	S	*	*			cis	-157.3	175.1	-23.1	-142.9	173.4	0	0	0	108.9
518	E	34.8	Very low	36.6	Very low	155 Å²	155	138.1 Å²	138.1	72%	0.724	76%	0.758	S	S	*	*			trans	-29.7	145	171.5	-61.3	142.4	158.2	0	0	115.4
519	D	41	Very low	36.7	Very low	154 Å²	154	140.9 Å²	140.9	82%	0.824	76%	0.763	S	S	*	*			cis	-175.6	176.7	46.3	-125.6	-9.8	0	0	0	111.2
520	P	39.4	Very low	36.4	Very low	109 Å²	109	143.9 Å²	143.9	71%	0.708	76%	0.756	S	S	*	*			trans	-109.4	173.3	-171.8	41.2	-36	0	0	0	117.6
521	A	35.6	Very low	36.5	Very low	111 Å²	111	141 Å²	141	92%	0.917	75%	0.751	S	S	*	*			trans	79.4	133.6	165	0	0	0	0	0	119.3
522	G	36.8	Very low	36.4	Very low	79 Å²	79	142 Å²	142	81%	0.814	75%	0.75	S	S	*	*			trans	158	112	170.5	0	0	0	0	0	114.6
523	D	33.7	Very low	36.5	Very low	152 Å²	152	142.2 Å²	142.2	81%	0.813	75%	0.753	S	S	*	*			trans	-66.9	145.5	169.5	-67.5	-66.6	0	0	0	112.4
524	K	41.9	Very low	36.7	Very low	203 Å²	203	147 Å²	147	88%	0.883	76%	0.763	S	S	*	*				179.1	151	110.7	-91.7	142.9	-158.4	158.3	0	114.2
525	N	31.1	Very low	36.9	Very low	153 Å²	153	146.2 Å²	146.2	82%	0.818	77%	0.768	S	S	*	*			trans	-73.4	154.8	174.3	-51.9	-76.3	0	0	0	112.4
526	L	37.2	Very low	37.1	Very low	155 Å²	155	147.5 Å²	147.5	81%	0.812	78%	0.776	S	S	*	*			trans	-162.8	124.2	134.5	-130.8	68.8	0	0	0	113.1
527	T	36.8	Very low	37.3	Very low	113 Å²	113	142.2 Å²	142.2	69%	0.693	77%	0.766	S	S	*	*			trans	41.5	149.2	137.1	58.9	0	0	0	0	122.9
528	T	35.4	Very low	37.2	Very low	119 Å²	119	142 Å²	142	73%	0.73	77%	0.773	S	S	*	*			cis	-175.6	-176.3	-9.2	-82	0	0	0	0	106.5
529	V	37.4	Very low	37.4	Very low	116 Å²	116	143.4 Å²	143.4	70%	0.703	78%	0.777	S	S	*	*			trans	87.4	125.4	165.3	-177.2	0	0	0	0	114.5
530	R	36	Very low	37	Very low	198 Å²	198	144.4 Å²	144.4	75%	0.747	78%	0.776	S	S	*	*			cis	-164.2	146.8	-7.3	-115.9	177.1	-165.5	158.1	0.8	110.5
531	H	38	Very low	36.9	Very low	154 Å²	154	147.3 Å²	147.3	71%	0.713	78%	0.784	S	S	*	*			trans	58.7	153.5	156.2	-56.1	-55	0	0	0	118.7
532	L	36.3	Very low	36.7	Very low	151 Å²	151	146.2 Å²	146.2	79%	0.791	77%	0.769	S	S	*	*			cis	-149.7	138.1	-4.2	-156	75.1	0	0	0	109.6
533	P	36.1	Very low	36.7	Very low	116 Å²	116	148.5 Å²	148.5	75%	0.753	76%	0.763	S	S	*	*			trans	-104.7	152.3	174.4	37	-31.3	0	0	0	113.5
534	Y	37.7	Very low	36.6	Very low	228 Å²	228	151 Å²	151	89%	0.894	76%	0.761	S	S	*	*			trans	-129.2	126.7	168.7	-164.3	-95.6	0	0	0	110.7
535	V	39.5	Very low	36.3	Very low	121 Å²	121	150 Å²	150	73%	0.733	75%	0.753	S	S	*	*			trans	-147.1	132.3	-173.5	175.6	0	0	0	0	109.7
536	K	42.3	Very low	36.6	Very low	191 Å²	191	150.4 Å²	150.4	83%	0.83	75%	0.75	S	S	*	*			trans	160.3	165.1	153.6	-95.6	164.7	-177.1	179.3	0	110.4
537	P	39.1	Very low	36.3	Very low	80 Å²	80	148.7 Å²	148.7	52%	0.519	75%	0.746	S	S	.	*			cis	-135.2	163.9	-27.8	36.1	-20.9	0	0	0	113.7	F539	P537-F539 HydrophobicContact CB-CD2 3.98Å; P537-F539 HydrophobicContact CB-CE2 3.7Å; P537-F539 HydrophobicContact CB-CZ 4.34Å; P537-F539 HydrophobicContact CG-CD2 3.62Å; P537-F539 HydrophobicContact CG-CE2 3.44Å; P537-F539 VanDerWaalsContact CG-CE2 3.44Å; P537-F539 HydrophobicContact CG-CZ 4.48Å
538	P	35.4	Very low	36.3	Very low	125 Å²	125	154.5 Å²	154.5	81%	0.812	76%	0.757	S	S	*	*			trans	-87	140.8	154.7	34.6	-29.9	0	0	0	110.8
539	F	39.5	Very low	36	Very low	183 Å²	183	154.5 Å²	154.5	80%	0.803	75%	0.752	S	S	*	*			trans	-141.1	132.7	170.9	-81.1	-60.6	0	0	0	113	P537	P537-F539 HydrophobicContact CB-CD2 3.98Å; P537-F539 HydrophobicContact CB-CE2 3.7Å; P537-F539 HydrophobicContact CB-CZ 4.34Å; P537-F539 HydrophobicContact CG-CD2 3.62Å; P537-F539 HydrophobicContact CG-CE2 3.44Å; P537-F539 VanDerWaalsContact CG-CE2 3.44Å; P537-F539 HydrophobicContact CG-CZ 4.48Å
540	H	31.8	Very low	35.9	Very low	176 Å²	176	160.6 Å²	160.6	82%	0.815	76%	0.763	S	S	*	*			trans	-75.4	145.5	161.9	-85.8	-110.1	0	0	0	110.4
541	I	37	Very low	35.6	Very low	170 Å²	170	157.5 Å²	157.5	87%	0.872	76%	0.761	S	S	*	*			trans	-128.1	143	151.6	-66.1	-176.4	0	0	0	107.6
542	S	31.8	Very low	35.4	Very low	87 Å²	87	157 Å²	157	61%	0.608	77%	0.769	S	S	*	*			trans	-127	129.1	-171.9	-55.1	0	0	0	0	112
543	N	36.4	Very low	35.2	Very low	128 Å²	128	155.3 Å²	155.3	68%	0.684	77%	0.77	S	S	*	*			trans	-170.6	123.2	139.6	-90.1	-33.3	0	0	0	107
544	R	31.2	Very low	35	Very low	204 Å²	204	160.8 Å²	160.8	77%	0.77	78%	0.775	S	S	*	*				78.4	150.5	56.8	-152	-164.1	-54.2	-144.9	4.4	111
545	Y	36.1	Very low	34.8	Very low	183 Å²	183	160.7 Å²	160.7	72%	0.718	78%	0.775	S	S	*	*			trans	74.7	128.1	-166.9	-47.1	-70.6	0	0	0	113.2
546	H	38	Very low	34.5	Very low	161 Å²	161	159.2 Å²	159.2	75%	0.745	77%	0.77	S	S	*	*			cis	-137.1	146.5	-6.1	-109.5	-71.5	0	0	0	111.5
547	T	31.4	Very low	34	Very low	118 Å²	118	156.3 Å²	156.3	72%	0.724	76%	0.763	S	S	*	*			trans	-85.3	136.5	170	49.8	0	0	0	0	111.4
548	Y	36.4	Very low	33.8	Very low	236 Å²	236	158.8 Å²	158.8	93%	0.925	77%	0.772	S	S	*	*			trans	-140.5	135.7	138.9	-90.9	-68.9	0	0	0	110.5
549	N	28.9	Very low	33.9	Very low	118 Å²	118	161.6 Å²	161.6	63%	0.631	77%	0.774	S	S	*	*			trans	-131.2	136.8	-174.3	172.8	0.9	0	0	0	107.7
550	R	34.9	Very low	33.4	Very low	245 Å²	245	156.2 Å²	156.2	93%	0.925	77%	0.771	S	S	*	*			trans	-148.5	108.8	157.1	-124.5	175.5	-173	-170.7	0.3	113.3
551	N	29.3	Very low	33.6	Very low	133 Å²	133	155.4 Å²	155.4	71%	0.711	77%	0.771	S	S	*	*			trans	-69.9	140.8	169.5	-37.9	-71.5	0	0	0	111.7
552	T	34.7	Very low	33.6	Very low	143 Å²	143	155.2 Å²	155.2	88%	0.877	77%	0.771	S	S	*	*			trans	-176.9	147	145.8	35.2	0	0	0	0	108.1
553	S	32.5	Very low	33.6	Very low	116 Å²	116	155.8 Å²	155.8	81%	0.811	77%	0.774	S	S	*	*			cis	-153.9	174.3	-19.6	-166.9	0	0	0	0	108.7
554	R	30.5	Very low	33.5	Very low	230 Å²	230	155.8 Å²	155.8	87%	0.868	78%	0.782	S	S	*	*			trans	-87.2	135	176.4	-55.1	170.3	-178.1	160.1	-2.2	111.3
555	Y	34.4	Very low	33.5	Very low	227 Å²	227	150.7 Å²	150.7	89%	0.89	77%	0.773	S	S	*	*			trans	-169.2	113.8	145.2	-100.2	-79.7	0	0	0	105.5
556	S	32.2	Very low	33.4	Very low	90 Å²	90	150 Å²	150	63%	0.629	78%	0.776	S	S	*	*				75.3	110.3	86.5	-124.9	0	0	0	0	114.6
557	D	31.7	Very low	33.2	Very low	130 Å²	130	149.7 Å²	149.7	70%	0.695	78%	0.78	S	S	*	*			trans	68.6	132.4	146.6	-48.8	-54	0	0	0	123.2
558	N	35	Very low	33.7	Very low	131 Å²	131	149.6 Å²	149.6	70%	0.701	77%	0.774	S	S	*	*			trans	73.5	106	141.1	-68	-13.2	0	0	0	123.1
559	H	37.9	Very low	34.2	Very low	184 Å²	184	142.3 Å²	142.3	85%	0.852	76%	0.755	S	S	*	*			trans	76.2	139.1	137.9	-65.6	-62.9	0	0	0	122.1
560	G	30.4	Very low	34.8	Very low	71 Å²	71	141.9 Å²	141.9	73%	0.732	76%	0.761	S	S	*	*			trans	91.1	149.8	169.8	0	0	0	0	0	114.3
561	I	35.1	Very low	35.8	Very low	159 Å²	159	135.1 Å²	135.1	82%	0.815	74%	0.743	S	S	*	*	S	Bend	cis	-146.1	120.8	-7.4	-56.2	177.7	0	0	0	104.3
562	L	36.6	Very low	37.4	Very low	166 Å²	166	129.7 Å²	129.7	87%	0.869	71%	0.713	S	S	*	*	S	Bend		-143.8	158.2	75.3	-76	158.8	0	0	0	111.1
563	S	32	Very low	38.7	Very low	98 Å²	98	130.5 Å²	130.5	69%	0.685	71%	0.705	S	S	*	*			trans	-89.5	129.5	-149.3	58.5	0	0	0	0	116.8
564	P	34.2	Very low	40.4	Very low	129 Å²	129	129.4 Å²	129.4	84%	0.838	70%	0.697	S	S	*	*			trans	-89.3	113.2	162.3	33.3	-27.5	0	0	0	110.3
565	V	32.5	Very low	42.5	Very low	97 Å²	97	118.9 Å²	118.9	59%	0.588	66%	0.658	S	S	*	*			trans	-137.2	114.6	-174.2	-174.9	0	0	0	0	111.8
566	E	32.4	Very low	44.6	Very low	168 Å²	168	111.4 Å²	111.4	79%	0.785	64%	0.636	S	S	*	*			trans	64.5	116.1	151.9	-67.7	150.2	-154.1	0	0	121.2
567	D	34.1	Very low	47	Very low	155 Å²	155	109.9 Å²	109.9	83%	0.829	62%	0.623	S	S	*	*			trans	61	77.4	141.3	-61.4	0.1	0	0	0	120.7
568	I	42.8	Very low	49.4	Very low	115 Å²	115	105.2 Å²	105.2	59%	0.59	60%	0.598	S	S	*	*			trans	-118.2	121.2	139.2	-58.5	174.7	0	0	0	107	C570	I568-C570 PolarHBondContact O-N 3.43Å
569	P	46.6	Very low	51.7	Low	83 Å²	83	106.5 Å²	106.5	54%	0.539	60%	0.6	S	S	.	*			trans	-66.6	128.9	-175.4	28.1	-35.5	0	0	0	111.2	N571	P569-N571 VanDerWaalsContact C-N 3.26Å; P569-N571 PolarHBondContact O-N 3.48Å
570	C	41.5	Very low	53.8	Low	110 Å²	110	101.5 Å²	101.5	74%	0.743	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	0.3	-152.4	-65.3	0	0	0	0	117.9	I568	I568-C570 PolarHBondContact O-N 3.43Å
571	N	55.9	Low	56.3	Low	102 Å²	102	98.1 Å²	98.1	55%	0.545	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-7.6	-165.6	-74.2	3.6	0	0	0	116.4	P569 K573 S574 Y584	P569-N571 VanDerWaalsContact C-N 3.26Å; P569-N571 PolarHBondContact O-N 3.48Å; N571-K573 PolarHBondContact O-N 3.21Å; N571-S574 PolarHBondContact O-N 3.36Å; N571-S574 PolarHBondContact O-OG 3.1Å; N571-Y584 HydrophobicContact CB-CE2 3.98Å
572	L	61.7	Low	58.7	Low	19 Å²	19	91.9 Å²	91.9	10%	0.099	51%	0.51	C	S	.	.	G	3₁₀ helix	trans	-59.9	-14	178.3	-70.3	174.4	0	0	0	114.5	S574 I575 L581 Y584 A771	L572-S574 VanDerWaalsContact C-N 3.35Å; L572-S574 PolarHBondContact O-N 3.34Å; L572-I575 HydrophobicContact CD2-CD1 3.83Å; L572-L581 HydrophobicContact CD2-CD1 4.13Å; L572-Y584 HydrophobicContact CD2-CD1 3.39Å; L572-Y584 HydrophobicContact CD2-CE1 3.44Å; L572-Y584 VanDerWaalsContact CD2-CE1 3.44Å; L572-Y584 HydrophobicContact CD2-CG 4.41Å; L572-Y584 HydrophobicContact CG-CD1 4.25Å; L572-Y584 HydrophobicContact CG-CE1 3.77Å; L572-A771 WeakPolarHBondContact CB-O 3.24Å; L572-A771 HydrophobicContact CD1-CB 4.43Å
573	K	63.1	Low	60.9	Low	161 Å²	161	90.1 Å²	90.1	70%	0.7	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-73.7	-18	-179	-65.1	179.3	-177.1	173.8	0	114.6	N571 C774	N571-K573 PolarHBondContact O-N 3.21Å; K573-C774 PolarHBondContact O-SG 3Å
574	S	67.6	Low	63.2	Low	92 Å²	92	89.5 Å²	89.5	64%	0.643	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-99.1	-3.1	179.8	59.7	0	0	0	0	114	N571 L572	N571-S574 PolarHBondContact O-N 3.36Å; N571-S574 PolarHBondContact O-OG 3.1Å; L572-S574 VanDerWaalsContact C-N 3.35Å; L572-S574 PolarHBondContact O-N 3.34Å
575	I	74.1	Confident	65.4	Low	9 Å²	9	84.6 Å²	84.6	5%	0.046	45%	0.447	C	S	.	.			trans	-80	125.6	-175	-65.4	-177.2	0	0	0	110.3	L572 E580 L581 Y584 C774 L775	L572-I575 HydrophobicContact CD2-CD1 3.83Å; I575-E580 WeakPolarHBondContact CA-OE2 3.2Å; I575-E580 HydrophobicContact CG1-CB 4.4Å; I575-E580 HydrophobicContact CG2-CB 3.83Å; I575-L581 HydrophobicContact CD1-CD1 4.25Å; I575-L581 HydrophobicContact CG2-CB 3.96Å; I575-L581 HydrophobicContact CG2-CD1 4.33Å; I575-Y584 HydrophobicContact CD1-CD1 4.19Å; I575-Y584 HydrophobicContact CD1-CG 3.93Å; I575-C774 CarbonylContact O-C 3.54Å; I575-C774 VanDerWaalsContact O-C 3.27Å; I575-C774 WeakPolarHBondContact O-CB 3.39Å; I575-L775 HydrophobicContact CG2-CD2 3.89Å; I575-L775 PolarHBondContact O-N 3.06Å
576	V	79.1	Confident	67.5	Low	71 Å²	71	83.9 Å²	83.9	43%	0.43	44%	0.437	S	S	.	.			trans	-114.2	-35.5	-178.2	-176.7	0	0	0	0	111.5	E580 L775 S776	V576-E580 PolarHBondContact N-OE2 3.25Å; V576-L775 WeakPolarHBondContact O-CA 3.27Å; V576-S776 PolarHBondContact O-N 2.76Å
577	T	82.3	Confident	69.7	Low	57 Å²	57	81.4 Å²	81.4	35%	0.35	44%	0.436	S	S	.	.	S	Bend	trans	-104.3	157.3	-177.5	73	0	0	0	0	113.9	Q579 E580 L581	T577-Q579 PolarHBondContact O-N 2.9Å; T577-E580 WeakPolarHBondContact CB-OE1 3.12Å; T577-E580 WeakPolarHBondContact CG2-OE1 3.41Å; T577-E580 PolarHBondContact N-OE2 2.73Å; T577-E580 VanDerWaalsContact N-OE2 3.14Å; T577-E580 WeakPolarHBondContact OG1-CG 3.2Å; T577-E580 PolarHBondContact OG1-N 3.25Å; T577-E580 PolarHBondContact OG1-OE1 3.01Å; T577-L581 PolarHBondContact O-N 3.49Å
578	L	83	Confident	72	Confident	32 Å²	32	76.2 Å²	76.2	17%	0.168	41%	0.408	C	S	.	.	H	α-helix	trans	-64.8	-28.3	173.4	-175.5	62.3	0	0	0	112.3	L581 D582 L671 L673 L779 D784 Y785	L578-L581 HydrophobicContact CD1-CD2 4.43Å; L578-L581 PolarHBondContact O-N 3.41Å; L578-D582 WeakPolarHBondContact O-CB 3.39Å; L578-D582 PolarHBondContact O-N 2.86Å; L578-L671 HydrophobicContact CD1-CD1 4.44Å; L578-L671 HydrophobicContact CD1-CD2 4.26Å; L578-L673 HydrophobicContact CD1-CD2 4.46Å; L578-L673 HydrophobicContact CD2-CD2 4.4Å; L578-L779 HydrophobicContact CB-CD2 4.26Å; L578-L779 HydrophobicContact CD1-CD2 4.37Å; L578-D784 HydrophobicContact CD2-CB 4.47Å; L578-Y785 HydrophobicContact CD2-CD1 4.05Å; L578-Y785 HydrophobicContact CD2-CG 4.47Å
579	Q	83.2	Confident	73.7	Confident	159 Å²	159	72.8 Å²	72.8	74%	0.743	39%	0.391	S	S	*	.	H	α-helix	trans	-74.2	-41.3	-179.5	-175.3	176.5	-6.9	0	0	111.9	T577 L581 D582 Q583	T577-Q579 PolarHBondContact O-N 2.9Å; Q579-L581 VanDerWaalsContact C-N 3.28Å; Q579-L581 PolarHBondContact O-N 3.36Å; Q579-D582 PolarHBondContact O-N 3Å; Q579-Q583 WeakPolarHBondContact O-CB 3.4Å; Q579-Q583 PolarHBondContact O-N 2.77Å
580	E	81.7	Confident	75.5	Confident	79 Å²	79	70 Å²	70	37%	0.369	37%	0.37	S	S	.	.	H	α-helix	trans	-58.7	-41.5	168.5	-74.3	145.3	-129.3	0	0	111.5	I575 V576 T577 Q583 Y584	I575-E580 WeakPolarHBondContact CA-OE2 3.2Å; I575-E580 HydrophobicContact CG1-CB 4.4Å; I575-E580 HydrophobicContact CG2-CB 3.83Å; V576-E580 PolarHBondContact N-OE2 3.25Å; T577-E580 WeakPolarHBondContact CB-OE1 3.12Å; T577-E580 WeakPolarHBondContact CG2-OE1 3.41Å; T577-E580 PolarHBondContact N-OE2 2.73Å; T577-E580 VanDerWaalsContact N-OE2 3.14Å; T577-E580 WeakPolarHBondContact OG1-CG 3.2Å; T577-E580 PolarHBondContact OG1-N 3.25Å; T577-E580 PolarHBondContact OG1-OE1 3.01Å; E580-Q583 PolarHBondContact O-N 3.43Å; E580-Y584 VanDerWaalsContact O-CB 3.3Å; E580-Y584 WeakPolarHBondContact O-CB 3.47Å; E580-Y584 PolarHBondContact O-N 2.81Å
581	L	83	Confident	77.7	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-65.5	-47.6	179.2	-170.7	67	0	0	0	112	L572 I575 T577 L578 Q579 Q583 Y584 L585 L608 L671 L768 A772 L775	L572-L581 HydrophobicContact CD2-CD1 4.13Å; I575-L581 HydrophobicContact CD1-CD1 4.25Å; I575-L581 HydrophobicContact CG2-CB 3.96Å; I575-L581 HydrophobicContact CG2-CD1 4.33Å; T577-L581 PolarHBondContact O-N 3.49Å; L578-L581 HydrophobicContact CD1-CD2 4.43Å; L578-L581 PolarHBondContact O-N 3.41Å; Q579-L581 VanDerWaalsContact C-N 3.28Å; Q579-L581 PolarHBondContact O-N 3.36Å; L581-Q583 VanDerWaalsContact C-N 3.35Å; L581-Q583 PolarHBondContact O-N 3.45Å; L581-Y584 PolarHBondContact O-N 2.85Å; L581-L585 HydrophobicContact CD1-CD1 3.89Å; L581-L585 HydrophobicContact CD1-CG 4.11Å; L581-L585 HydrophobicContact CD2-CD1 4.39Å; L581-L585 HydrophobicContact CG-CD1 3.75Å; L581-L585 HydrophobicContact CG-CG 4.27Å; L581-L585 WeakPolarHBondContact O-CB 3.24Å; L581-L585 VanDerWaalsContact O-CG 3.23Å; L581-L585 WeakPolarHBondContact O-CG 3.11Å; L581-L585 PolarHBondContact O-N 3.02Å; L581-L608 HydrophobicContact CD2-CD2 4.45Å; L581-L671 HydrophobicContact CD2-CD2 4.01Å; L581-L671 HydrophobicContact CG-CD2 4.35Å; L581-L768 HydrophobicContact CD2-CD1 3.98Å; L581-L768 HydrophobicContact CD2-CD2 4.3Å; L581-L768 HydrophobicContact CD2-CG 4.26Å; L581-A772 HydrophobicContact CD1-CB 4.05Å; L581-L775 HydrophobicContact CD2-CD1 4.12Å
582	D	84.6	Confident	79.1	Confident	27 Å²	27	63.3 Å²	63.3	14%	0.144	32%	0.323	C	S	.	.	H	α-helix	trans	-55.3	-50	172.5	176.7	19	0	0	0	111	L578 Q579 Y584 L585 Q586 R604 L673	L578-D582 WeakPolarHBondContact O-CB 3.39Å; L578-D582 PolarHBondContact O-N 2.86Å; Q579-D582 PolarHBondContact O-N 3Å; D582-Y584 VanDerWaalsContact C-N 3.25Å; D582-Y584 PolarHBondContact O-N 3.15Å; D582-L585 PolarHBondContact O-N 2.76Å; D582-Q586 WeakPolarHBondContact O-CG 3.44Å; D582-Q586 PolarHBondContact O-N 2.65Å; D582-Q586 PolarHBondContact OD1-NE2 2.91Å; D582-R604 VanDerWaalsContact CG-NH2 3.29Å; D582-R604 IonicContact OD1-CZ 2.76Å; D582-R604 IonicContact OD1-NH1 3.67Å; D582-R604 PolarHBondContact OD1-NH1 3.31Å; D582-R604 IonicContact OD1-NH2 3.75Å; D582-R604 PolarHBondContact OD1-NH2 2.88Å; D582-R604 IonicContact OD2-CZ 3.05Å; D582-R604 IonicContact OD2-NH1 2.75Å; D582-R604 IonicContact OD2-NH2 2.73Å; D582-R604 PolarHBondContact OD2-NH2 2.87Å; D582-L673 HydrophobicContact CB-CD1 3.82Å
583	Q	82.8	Confident	80.4	Confident	129 Å²	129	64.4 Å²	64.4	60%	0.603	33%	0.327	S	S	*	.	H	α-helix	trans	-64.1	-29.1	-178.3	-169.8	57	87.1	0	0	113.5	Q579 E580 L581 Q586	Q579-Q583 WeakPolarHBondContact O-CB 3.4Å; Q579-Q583 PolarHBondContact O-N 2.77Å; E580-Q583 PolarHBondContact O-N 3.43Å; L581-Q583 VanDerWaalsContact C-N 3.35Å; L581-Q583 PolarHBondContact O-N 3.45Å; Q583-Q586 VanDerWaalsContact NE2-OE1 3.09Å
584	Y	80.5	Confident	81.7	Confident	85 Å²	85	56.7 Å²	56.7	33%	0.333	29%	0.293	S	S	.	.	H	α-helix	trans	-84.6	-31.5	177.9	-173.2	-94.4	0	0	0	113.8	N571 L572 I575 E580 L581 D582	N571-Y584 HydrophobicContact CB-CE2 3.98Å; L572-Y584 HydrophobicContact CD2-CD1 3.39Å; L572-Y584 HydrophobicContact CD2-CE1 3.44Å; L572-Y584 VanDerWaalsContact CD2-CE1 3.44Å; L572-Y584 HydrophobicContact CD2-CG 4.41Å; L572-Y584 HydrophobicContact CG-CD1 4.25Å; L572-Y584 HydrophobicContact CG-CE1 3.77Å; I575-Y584 HydrophobicContact CD1-CD1 4.19Å; I575-Y584 HydrophobicContact CD1-CG 3.93Å; E580-Y584 VanDerWaalsContact O-CB 3.3Å; E580-Y584 WeakPolarHBondContact O-CB 3.47Å; E580-Y584 PolarHBondContact O-N 2.81Å; L581-Y584 PolarHBondContact O-N 2.85Å; D582-Y584 VanDerWaalsContact C-N 3.25Å; D582-Y584 PolarHBondContact O-N 3.15Å
585	L	80.3	Confident	82.7	Confident	27 Å²	27	53.4 Å²	53.4	14%	0.141	27%	0.268	C	S	.	.	H	α-helix	trans	-86.2	-4.5	-179.3	-63.5	178.7	0	0	0	113.8	L581 D582 L606 L608 L671	L581-L585 HydrophobicContact CD1-CD1 3.89Å; L581-L585 HydrophobicContact CD1-CG 4.11Å; L581-L585 HydrophobicContact CD2-CD1 4.39Å; L581-L585 HydrophobicContact CG-CD1 3.75Å; L581-L585 HydrophobicContact CG-CG 4.27Å; L581-L585 WeakPolarHBondContact O-CB 3.24Å; L581-L585 VanDerWaalsContact O-CG 3.23Å; L581-L585 WeakPolarHBondContact O-CG 3.11Å; L581-L585 PolarHBondContact O-N 3.02Å; D582-L585 PolarHBondContact O-N 2.76Å; L585-L606 HydrophobicContact CB-CB 4.04Å; L585-L606 HydrophobicContact CB-CD2 3.92Å; L585-L608 HydrophobicContact CD1-CD2 3.53Å; L585-L608 HydrophobicContact CD1-CG 4.2Å; L585-L671 HydrophobicContact CD1-CB 4.47Å; L585-L671 HydrophobicContact CD1-CD2 4.09Å
586	Q	77.7	Confident	83.4	Confident	81 Å²	81	54 Å²	54	38%	0.379	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-65.7	147.3	173	-80.7	167	29.5	0	0	111.6	D582 Q583 L606	D582-Q586 WeakPolarHBondContact O-CG 3.44Å; D582-Q586 PolarHBondContact O-N 2.65Å; D582-Q586 PolarHBondContact OD1-NE2 2.91Å; Q583-Q586 VanDerWaalsContact NE2-OE1 3.09Å; Q586-L606 HydrophobicContact CG-CD2 4.11Å
587	P	78.5	Confident	83.7	Confident	117 Å²	117	57.9 Å²	57.9	76%	0.76	28%	0.283	S	S	*	.	S	Bend	cis	-76.3	154.9	9.7	31.3	-36.9	0	0	0	114.8	L589	P587-L589 PolarHBondContact O-N 3.12Å
588	D	81.1	Confident	83.6	Confident	46 Å²	46	59.2 Å²	59.2	25%	0.246	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-51	128.7	169.8	-71.9	-21.4	0	0	0	110.2	K591 R604 C605	D588-K591 WeakPolarHBondContact OD2-CE 3.2Å; D588-K591 IonicContact OD2-NZ 2.94Å; D588-R604 WeakPolarHBondContact OD1-CD 3.04Å; D588-R604 IonicContact OD1-CZ 3.34Å; D588-R604 IonicContact OD1-NH1 3.12Å; D588-R604 PolarHBondContact OD1-NH1 2.98Å; D588-R604 WeakPolarHBondContact OD2-CD 3.48Å; D588-C605 CarbonylContact C-O 3.59Å
589	L	80.1	Confident	83.8	Confident	43 Å²	43	60 Å²	60	23%	0.225	29%	0.292	C	S	.	.	S	Bend	trans	-66.3	-41.5	-180	-172.6	66.7	0	0	0	111.6	P587 C605 M607 K612 M670	P587-L589 PolarHBondContact O-N 3.12Å; L589-C605 VanDerWaalsContact CB-O 3.27Å; L589-C605 WeakPolarHBondContact CB-O 3.49Å; L589-C605 PolarHBondContact N-O 2.66Å; L589-M607 HydrophobicContact CD1-CB 4.46Å; L589-M607 HydrophobicContact CD2-CB 4.06Å; L589-K612 HydrophobicContact CD1-CG 4.35Å; L589-M670 HydrophobicContact CD2-SD 4.13Å
590	W	84.1	Confident	83.9	Confident	24 Å²	24	54 Å²	54	9%	0.091	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.4	163.6	165.7	46.5	-98.3	0	0	0	110.6	F603 C605 S615 L619 P634 L636	W590-F603 HydrophobicContact CE3-CE2 4.23Å; W590-F603 AromaticContact CH2-CE2 3.62Å; W590-F603 HydrophobicContact CH2-CE2 3.62Å; W590-F603 AromaticContact CH2-CZ 3.65Å; W590-F603 HydrophobicContact CH2-CZ 3.65Å; W590-F603 HydrophobicContact CZ3-CD2 4.45Å; W590-F603 AromaticContact CZ3-CE2 3.31Å; W590-F603 HydrophobicContact CZ3-CE2 3.31Å; W590-F603 AromaticContact CZ3-CZ 3.38Å; W590-F603 HydrophobicContact CZ3-CZ 3.38Å; W590-C605 HydrophobicContact CD2-CB 4.02Å; W590-C605 HydrophobicContact CE3-CB 4.14Å; W590-C605 HydrophobicContact CH2-CB 4.43Å; W590-C605 HydrophobicContact CZ2-CB 4.33Å; W590-C605 HydrophobicContact CZ3-CB 4.37Å; W590-C605 VanDerWaalsContact O-CB 3.3Å; W590-C605 WeakPolarHBondContact O-CB 3.44Å; W590-C605 PolarHBondContact O-N 2.97Å; W590-S615 PolarHBondContact NE1-O 2.96Å; W590-L619 HydrophobicContact CB-CD1 3.99Å; W590-L619 HydrophobicContact CD2-CD1 4.24Å; W590-L619 HydrophobicContact CG-CD1 3.89Å; W590-P634 HydrophobicContact CD2-CG 4.17Å; W590-P634 HydrophobicContact CE3-CG 3.44Å; W590-P634 VanDerWaalsContact CE3-CG 3.44Å; W590-P634 HydrophobicContact CH2-CG 4.49Å; W590-P634 HydrophobicContact CZ3-CB 4.47Å; W590-P634 HydrophobicContact CZ3-CG 3.62Å; W590-L636 HydrophobicContact CH2-CD1 3.79Å; W590-L636 HydrophobicContact CH2-CG 4.34Å
591	K	86.7	Confident	84.3	Confident	71 Å²	71	50.5 Å²	50.5	31%	0.309	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	138	174.1	-61.7	-171	170.5	-170.2	0	110.3	D588 F603 R604 P634	D588-K591 WeakPolarHBondContact OD2-CE 3.2Å; D588-K591 IonicContact OD2-NZ 2.94Å; K591-F603 WeakPolarHBondContact CA-O 3.2Å; K591-R604 HydrophobicContact CD-CB 4.44Å; K591-R604 HydrophobicContact CG-CB 3.89Å; K591-P634 WeakPolarHBondContact O-CD 3.48Å
592	G	86.5	Confident	84.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	-176.6	-170.8	0	0	0	0	0	114.1	F603 P634	G592-F603 PolarHBondContact N-O 2.69Å; G592-F603 WeakPolarHBondContact O-CD1 3.34Å; G592-F603 PolarHBondContact O-N 3.3Å; G592-P634 WeakPolarHBondContact CA-O 3.38Å
593	K	89	Confident	84.9	Confident	42 Å²	42	49.4 Å²	49.4	18%	0.183	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	135.9	173.1	61.8	179.7	-179	173.2	0	112.3	F601 Y602 P634 T635 L636	K593-F601 CarbonylContact C-O 3.6Å; K593-F601 VanDerWaalsContact CA-O 3.24Å; K593-F601 WeakPolarHBondContact CA-O 3.4Å; K593-Y602 HydrophobicContact CB-CD1 4.17Å; K593-Y602 HydrophobicContact CB-CE1 4.15Å; K593-Y602 HydrophobicContact CD-CE1 4.3Å; K593-P634 PolarHBondContact N-O 2.86Å; K593-T635 WeakPolarHBondContact CE-OG1 3.22Å; K593-T635 HydrophobicContact CG-CG2 4.27Å; K593-T635 CarbonylContact O-C 3.56Å; K593-T635 WeakPolarHBondContact O-CA 3.49Å; K593-L636 PolarHBondContact O-N 2.79Å
594	F	90.6	Very high	85.3	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	140.2	167.4	-66.1	-65.5	0	0	0	109.6	F601 F603 L636 I638 I672 L710 L713 I726 L757 L788	F594-F601 HydrophobicContact CB-CB 4.37Å; F594-F601 HydrophobicContact CB-CD2 4.39Å; F594-F601 PolarHBondContact N-O 3.25Å; F594-F601 PolarHBondContact O-N 2.93Å; F594-F601 VanDerWaalsContact O-N 3.08Å; F594-F603 HydrophobicContact CB-CE1 4.49Å; F594-F603 HydrophobicContact CD1-CD1 4.5Å; F594-F603 AromaticContact CD1-CE1 3.78Å; F594-F603 HydrophobicContact CD1-CE1 3.78Å; F594-F603 HydrophobicContact CD1-CZ 4.28Å; F594-F603 AromaticContact CD2-CD1 3.33Å; F594-F603 HydrophobicContact CD2-CD1 3.33Å; F594-F603 AromaticContact CD2-CE1 3.46Å; F594-F603 HydrophobicContact CD2-CE1 3.46Å; F594-F603 VanDerWaalsContact CD2-CE1 3.46Å; F594-F603 HydrophobicContact CD2-CG 4.15Å; F594-F603 HydrophobicContact CD2-CZ 4.36Å; F594-F603 HydrophobicContact CE1-CD1 4.45Å; F594-F603 AromaticContact CE1-CE1 3.7Å; F594-F603 HydrophobicContact CE1-CE1 3.7Å; F594-F603 AromaticContact CE1-CZ 3.78Å; F594-F603 HydrophobicContact CE1-CZ 3.78Å; F594-F603 HydrophobicContact CE2-CB 4.35Å; F594-F603 AromaticContact CE2-CD1 3.28Å; F594-F603 HydrophobicContact CE2-CD1 3.28Å; F594-F603 HydrophobicContact CE2-CD2 4.2Å; F594-F603 AromaticContact CE2-CE1 3.38Å; F594-F603 HydrophobicContact CE2-CE1 3.38Å; F594-F603 HydrophobicContact CE2-CE2 4.28Å; F594-F603 AromaticContact CE2-CG 3.71Å; F594-F603 HydrophobicContact CE2-CG 3.71Å; F594-F603 AromaticContact CE2-CZ 3.89Å; F594-F603 HydrophobicContact CE2-CZ 3.89Å; F594-F603 AromaticContact CG-CD1 3.96Å; F594-F603 HydrophobicContact CG-CD1 3.96Å; F594-F603 AromaticContact CG-CE1 3.64Å; F594-F603 HydrophobicContact CG-CE1 3.64Å; F594-F603 AromaticContact CZ-CD1 3.88Å; F594-F603 HydrophobicContact CZ-CD1 3.88Å; F594-F603 HydrophobicContact CZ-CD2 4.35Å; F594-F603 AromaticContact CZ-CE1 3.49Å; F594-F603 HydrophobicContact CZ-CE1 3.49Å; F594-F603 VanDerWaalsContact CZ-CE1 3.49Å; F594-F603 HydrophobicContact CZ-CE2 4.02Å; F594-F603 HydrophobicContact CZ-CG 4.28Å; F594-F603 AromaticContact CZ-CZ 3.56Å; F594-F603 HydrophobicContact CZ-CZ 3.56Å; F594-L636 WeakPolarHBondContact CA-O 3.4Å; F594-L636 HydrophobicContact CD1-CB 3.77Å; F594-L636 HydrophobicContact CE1-CB 4Å; F594-L636 HydrophobicContact CE1-CD1 4.06Å; F594-I638 HydrophobicContact CB-CD1 4.17Å; F594-I638 HydrophobicContact CD1-CD1 4.34Å; F594-I638 HydrophobicContact CD1-CG1 4.33Å; F594-I638 HydrophobicContact CG-CD1 4.34Å; F594-I672 HydrophobicContact CE2-CG2 3.92Å; F594-I672 HydrophobicContact CZ-CG2 4.28Å; F594-L710 HydrophobicContact CD2-CD1 4.07Å; F594-L710 HydrophobicContact CE2-CD1 4.17Å; F594-L713 HydrophobicContact CB-CD2 4.11Å; F594-L713 HydrophobicContact CD2-CD2 3.75Å; F594-L713 HydrophobicContact CE2-CD2 4.49Å; F594-L713 HydrophobicContact CG-CD2 4.09Å; F594-I726 HydrophobicContact CD1-CD1 4.04Å; F594-I726 HydrophobicContact CE1-CD1 3.74Å; F594-L757 HydrophobicContact CD1-CD2 4.07Å; F594-L757 HydrophobicContact CD2-CD2 4.35Å; F594-L757 HydrophobicContact CE1-CD1 4.33Å; F594-L757 HydrophobicContact CE1-CD2 3.78Å; F594-L757 HydrophobicContact CE2-CD1 4.27Å; F594-L757 HydrophobicContact CE2-CD2 4.07Å; F594-L757 HydrophobicContact CG-CD2 4.36Å; F594-L757 HydrophobicContact CZ-CD1 3.75Å; F594-L757 HydrophobicContact CZ-CD2 3.79Å; F594-L757 HydrophobicContact CZ-CG 4.41Å; F594-L788 HydrophobicContact CE1-CD1 4.26Å; F594-L788 HydrophobicContact CZ-CD1 4.34Å
595	L	87.9	Confident	85.7	Confident	22 Å²	22	41.1 Å²	41.1	12%	0.115	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	112.3	170.9	178.8	66.6	0	0	0	109.4	K597 T635 L636 R637 I638	L595-K597 WeakPolarHBondContact CD1-O 3.46Å; L595-T635 HydrophobicContact CB-CG2 4.08Å; L595-L636 PolarHBondContact N-O 2.86Å; L595-R637 HydrophobicContact CB-CB 4.46Å; L595-R637 HydrophobicContact CD2-CG 4.15Å; L595-R637 HydrophobicContact CG-CG 4.46Å; L595-I638 PolarHBondContact O-N 3.4Å
596	L	88	Confident	86.1	Confident	22 Å²	22	39.8 Å²	39.8	12%	0.115	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	101.7	171.1	-176.3	69.6	0	0	0	108.9	N598 N599 F601 I638 L713 Y716	L596-N598 PolarHBondContact O-N 2.75Å; L596-N599 PolarHBondContact N-O 3.12Å; L596-N599 VanDerWaalsContact N-O 3.09Å; L596-N599 WeakPolarHBondContact O-CB 3.4Å; L596-N599 PolarHBondContact O-N 2.81Å; L596-N599 VanDerWaalsContact O-N 3.09Å; L596-N599 PolarHBondContact O-OD1 2.85Å; L596-F601 HydrophobicContact CB-CE2 3.89Å; L596-I638 HydrophobicContact CD1-CB 3.95Å; L596-I638 HydrophobicContact CD1-CG2 3.92Å; L596-L713 HydrophobicContact CD2-CD1 3.94Å; L596-Y716 HydrophobicContact CD1-CE1 4.46Å; L596-Y716 HydrophobicContact CD2-CD1 3.75Å; L596-Y716 HydrophobicContact CD2-CE1 3.53Å; L596-Y716 HydrophobicContact CD2-CG 4.48Å
597	K	85.3	Confident	86.6	Confident	153 Å²	153	39.2 Å²	39.2	67%	0.665	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	-95	-167.5	-51.2	172.3	-175.1	170.5	0	111.8	L595	L595-K597 WeakPolarHBondContact CD1-O 3.46Å
598	N	81.9	Confident	86.8	Confident	84 Å²	84	34.5 Å²	34.5	45%	0.449	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-9.8	-178.3	-60.3	31.8	0	0	0	111.2	L596 N705	L596-N598 PolarHBondContact O-N 2.75Å; N598-N705 WeakPolarHBondContact O-CA 3.41Å; N598-N705 WeakPolarHBondContact O-CB 3.33Å
599	N	85.7	Confident	86.9	Confident	49 Å²	49	34.1 Å²	34.1	26%	0.262	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	130.7	-171.7	-55.8	54.3	0	0	0	109.3	L596 F601 F708	L596-N599 PolarHBondContact N-O 3.12Å; L596-N599 VanDerWaalsContact N-O 3.09Å; L596-N599 WeakPolarHBondContact O-CB 3.4Å; L596-N599 PolarHBondContact O-N 2.81Å; L596-N599 VanDerWaalsContact O-N 3.09Å; L596-N599 PolarHBondContact O-OD1 2.85Å; N599-F601 HydrophobicContact CB-CE2 3.65Å; N599-F601 HydrophobicContact CB-CZ 3.8Å; N599-F601 WeakPolarHBondContact O-CE2 3.44Å; N599-F708 HydrophobicContact CB-CD2 3.9Å; N599-F708 HydrophobicContact CB-CE2 3.97Å; N599-F708 WeakPolarHBondContact ND2-CE2 3.47Å
600	H	86.4	Confident	87	Confident	32 Å²	32	33.4 Å²	33.4	15%	0.148	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	139	178.2	-63.9	135.1	0	0	0	111.8	Y602 N705 D706 F708	H600-Y602 HydrophobicContact CB-CE2 4.4Å; H600-N705 VanDerWaalsContact CE1-CB 3.49Å; H600-N705 WeakPolarHBondContact CE1-CB 3.18Å; H600-N705 PolarHBondContact ND1-O 3.31Å; H600-D706 PolarHBondContact N-O 3.26Å; H600-D706 VanDerWaalsContact N-O 3.09Å; H600-F708 PolarHBondContact O-N 3.35Å
601	F	89.7	Confident	86.9	Confident	6 Å²	6	34.2 Å²	34.2	3%	0.026	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	116.5	175.7	-49.7	-96.9	0	0	0	109.9	K593 F594 L596 N599 F708 S709 L710 A712 L713	K593-F601 CarbonylContact C-O 3.6Å; K593-F601 VanDerWaalsContact CA-O 3.24Å; K593-F601 WeakPolarHBondContact CA-O 3.4Å; F594-F601 HydrophobicContact CB-CB 4.37Å; F594-F601 HydrophobicContact CB-CD2 4.39Å; F594-F601 PolarHBondContact N-O 3.25Å; F594-F601 PolarHBondContact O-N 2.93Å; F594-F601 VanDerWaalsContact O-N 3.08Å; L596-F601 HydrophobicContact CB-CE2 3.89Å; N599-F601 HydrophobicContact CB-CE2 3.65Å; N599-F601 HydrophobicContact CB-CZ 3.8Å; N599-F601 WeakPolarHBondContact O-CE2 3.44Å; F601-F708 HydrophobicContact CD1-CB 3.74Å; F601-F708 HydrophobicContact CE1-CB 3.48Å; F601-F708 VanDerWaalsContact CE1-CB 3.48Å; F601-F708 HydrophobicContact CE1-CD2 4.41Å; F601-F708 HydrophobicContact CE1-CG 4.22Å; F601-F708 HydrophobicContact CZ-CB 4.27Å; F601-F708 HydrophobicContact CZ-CD2 4.41Å; F601-S709 WeakPolarHBondContact CD1-O 3.12Å; F601-L710 HydrophobicContact CB-CD1 4.41Å; F601-A712 HydrophobicContact CE1-CB 4.19Å; F601-L713 HydrophobicContact CB-CD2 4.45Å; F601-L713 HydrophobicContact CD1-CB 3.68Å; F601-L713 HydrophobicContact CD2-CB 4.43Å; F601-L713 HydrophobicContact CD2-CD2 4.3Å; F601-L713 HydrophobicContact CE1-CB 3.76Å; F601-L713 HydrophobicContact CE2-CD1 4.48Å; F601-L713 HydrophobicContact CG-CB 4.03Å; F601-L713 HydrophobicContact CG-CD2 4.24Å; F601-L713 HydrophobicContact CZ-CB 4.21Å
602	Y	90.1	Very high	86.6	Confident	4 Å²	4	36 Å²	36	2%	0.016	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	138.3	-177.9	-71.6	-92.4	0	0	0	112	K593 H600 D675 Q678 Y682	K593-Y602 HydrophobicContact CB-CD1 4.17Å; K593-Y602 HydrophobicContact CB-CE1 4.15Å; K593-Y602 HydrophobicContact CD-CE1 4.3Å; H600-Y602 HydrophobicContact CB-CE2 4.4Å; Y602-D675 PolarHBondContact O-N 2.87Å; Y602-Q678 HydrophobicContact CD1-CB 3.71Å; Y602-Q678 HydrophobicContact CD1-CG 4.47Å; Y602-Q678 HydrophobicContact CE1-CB 4.29Å; Y602-Q678 HydrophobicContact CG-CB 4.03Å; Y602-Y682 HydrophobicContact CE1-CD2 4.42Å; Y602-Y682 HydrophobicContact CE1-CE2 4.1Å; Y602-Y682 HydrophobicContact CE2-CD2 4.14Å; Y602-Y682 HydrophobicContact CE2-CE2 4.44Å; Y602-Y682 HydrophobicContact CE2-CG 4.4Å; Y602-Y682 AromaticContact CZ-CD2 3.84Å; Y602-Y682 AromaticContact CZ-CE2 3.69Å; Y602-Y682 VanDerWaalsContact OH-CE2 3.24Å; Y602-Y682 WeakPolarHBondContact OH-CE2 3.28Å
603	F	91	Very high	86.4	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	158	-177.9	70.4	-90	0	0	0	112.6	W590 K591 G592 F594 C605 L636 I672 L673 L710	W590-F603 HydrophobicContact CE3-CE2 4.23Å; W590-F603 AromaticContact CH2-CE2 3.62Å; W590-F603 HydrophobicContact CH2-CE2 3.62Å; W590-F603 AromaticContact CH2-CZ 3.65Å; W590-F603 HydrophobicContact CH2-CZ 3.65Å; W590-F603 HydrophobicContact CZ3-CD2 4.45Å; W590-F603 AromaticContact CZ3-CE2 3.31Å; W590-F603 HydrophobicContact CZ3-CE2 3.31Å; W590-F603 AromaticContact CZ3-CZ 3.38Å; W590-F603 HydrophobicContact CZ3-CZ 3.38Å; K591-F603 WeakPolarHBondContact CA-O 3.2Å; G592-F603 PolarHBondContact N-O 2.69Å; G592-F603 WeakPolarHBondContact O-CD1 3.34Å; G592-F603 PolarHBondContact O-N 3.3Å; F594-F603 HydrophobicContact CB-CE1 4.49Å; F594-F603 HydrophobicContact CD1-CD1 4.5Å; F594-F603 AromaticContact CD1-CE1 3.78Å; F594-F603 HydrophobicContact CD1-CE1 3.78Å; F594-F603 HydrophobicContact CD1-CZ 4.28Å; F594-F603 AromaticContact CD2-CD1 3.33Å; F594-F603 HydrophobicContact CD2-CD1 3.33Å; F594-F603 AromaticContact CD2-CE1 3.46Å; F594-F603 HydrophobicContact CD2-CE1 3.46Å; F594-F603 VanDerWaalsContact CD2-CE1 3.46Å; F594-F603 HydrophobicContact CD2-CG 4.15Å; F594-F603 HydrophobicContact CD2-CZ 4.36Å; F594-F603 HydrophobicContact CE1-CD1 4.45Å; F594-F603 AromaticContact CE1-CE1 3.7Å; F594-F603 HydrophobicContact CE1-CE1 3.7Å; F594-F603 AromaticContact CE1-CZ 3.78Å; F594-F603 HydrophobicContact CE1-CZ 3.78Å; F594-F603 HydrophobicContact CE2-CB 4.35Å; F594-F603 AromaticContact CE2-CD1 3.28Å; F594-F603 HydrophobicContact CE2-CD1 3.28Å; F594-F603 HydrophobicContact CE2-CD2 4.2Å; F594-F603 AromaticContact CE2-CE1 3.38Å; F594-F603 HydrophobicContact CE2-CE1 3.38Å; F594-F603 HydrophobicContact CE2-CE2 4.28Å; F594-F603 AromaticContact CE2-CG 3.71Å; F594-F603 HydrophobicContact CE2-CG 3.71Å; F594-F603 AromaticContact CE2-CZ 3.89Å; F594-F603 HydrophobicContact CE2-CZ 3.89Å; F594-F603 AromaticContact CG-CD1 3.96Å; F594-F603 HydrophobicContact CG-CD1 3.96Å; F594-F603 AromaticContact CG-CE1 3.64Å; F594-F603 HydrophobicContact CG-CE1 3.64Å; F594-F603 AromaticContact CZ-CD1 3.88Å; F594-F603 HydrophobicContact CZ-CD1 3.88Å; F594-F603 HydrophobicContact CZ-CD2 4.35Å; F594-F603 AromaticContact CZ-CE1 3.49Å; F594-F603 HydrophobicContact CZ-CE1 3.49Å; F594-F603 VanDerWaalsContact CZ-CE1 3.49Å; F594-F603 HydrophobicContact CZ-CE2 4.02Å; F594-F603 HydrophobicContact CZ-CG 4.28Å; F594-F603 AromaticContact CZ-CZ 3.56Å; F594-F603 HydrophobicContact CZ-CZ 3.56Å; F603-C605 HydrophobicContact CD2-CB 4.46Å; F603-C605 HydrophobicContact CE2-CB 4.23Å; F603-L636 HydrophobicContact CZ-CD1 4.27Å; F603-I672 HydrophobicContact CB-CG2 3.83Å; F603-I672 HydrophobicContact CD2-CD1 3.87Å; F603-I672 HydrophobicContact CD2-CG2 3.81Å; F603-I672 HydrophobicContact CE2-CD1 3.8Å; F603-I672 HydrophobicContact CG-CG2 3.97Å; F603-L673 CarbonylContact C-O 3.55Å; F603-L673 VanDerWaalsContact CA-O 3.31Å; F603-L673 WeakPolarHBondContact CA-O 3.37Å; F603-L673 WeakPolarHBondContact CB-O 3.23Å; F603-L710 HydrophobicContact CB-CD1 4.41Å; F603-L710 HydrophobicContact CB-CD2 4.45Å
604	R	90.1	Very high	86	Confident	40 Å²	40	38.1 Å²	38.1	15%	0.151	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	145.6	165.5	63.7	-167.3	178.4	94.8	-1.7	110.2	D582 D588 K591 L606 L673	D582-R604 VanDerWaalsContact CG-NH2 3.29Å; D582-R604 IonicContact OD1-CZ 2.76Å; D582-R604 IonicContact OD1-NH1 3.67Å; D582-R604 PolarHBondContact OD1-NH1 3.31Å; D582-R604 IonicContact OD1-NH2 3.75Å; D582-R604 PolarHBondContact OD1-NH2 2.88Å; D582-R604 IonicContact OD2-CZ 3.05Å; D582-R604 IonicContact OD2-NH1 2.75Å; D582-R604 IonicContact OD2-NH2 2.73Å; D582-R604 PolarHBondContact OD2-NH2 2.87Å; D588-R604 WeakPolarHBondContact OD1-CD 3.04Å; D588-R604 IonicContact OD1-CZ 3.34Å; D588-R604 IonicContact OD1-NH1 3.12Å; D588-R604 PolarHBondContact OD1-NH1 2.98Å; D588-R604 WeakPolarHBondContact OD2-CD 3.48Å; K591-R604 HydrophobicContact CD-CB 4.44Å; K591-R604 HydrophobicContact CG-CB 3.89Å; R604-L606 HydrophobicContact CG-CD1 4.49Å; R604-L673 HydrophobicContact CG-CB 3.99Å; R604-L673 PolarHBondContact N-O 2.88Å; R604-L673 PolarHBondContact O-N 2.85Å
605	C	89.5	Confident	85.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	133.2	-171.7	-167	0	0	0	0	109.2	D588 L589 W590 F603 M670 L671 I672	D588-C605 CarbonylContact C-O 3.59Å; L589-C605 VanDerWaalsContact CB-O 3.27Å; L589-C605 WeakPolarHBondContact CB-O 3.49Å; L589-C605 PolarHBondContact N-O 2.66Å; W590-C605 HydrophobicContact CD2-CB 4.02Å; W590-C605 HydrophobicContact CE3-CB 4.14Å; W590-C605 HydrophobicContact CH2-CB 4.43Å; W590-C605 HydrophobicContact CZ2-CB 4.33Å; W590-C605 HydrophobicContact CZ3-CB 4.37Å; W590-C605 VanDerWaalsContact O-CB 3.3Å; W590-C605 WeakPolarHBondContact O-CB 3.44Å; W590-C605 PolarHBondContact O-N 2.97Å; F603-C605 HydrophobicContact CD2-CB 4.46Å; F603-C605 HydrophobicContact CE2-CB 4.23Å; C605-M670 PolarHBondContact SG-SD 3.18Å; C605-L671 WeakPolarHBondContact CA-O 3.34Å; C605-I672 HydrophobicContact CB-CD1 4.06Å; C605-I672 VanDerWaalsContact SG-CD1 3.57Å
606	L	88.9	Confident	85	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	140	176.9	-52.3	93.4	0	0	0	109.2	L585 Q586 R604 M670 L671 L673	L585-L606 HydrophobicContact CB-CB 4.04Å; L585-L606 HydrophobicContact CB-CD2 3.92Å; Q586-L606 HydrophobicContact CG-CD2 4.11Å; R604-L606 HydrophobicContact CG-CD1 4.49Å; L606-M670 CarbonylContact O-C 3.57Å; L606-M670 VanDerWaalsContact O-CA 3.23Å; L606-M670 WeakPolarHBondContact O-CA 3.42Å; L606-M670 WeakPolarHBondContact O-CB 3.34Å; L606-L671 HydrophobicContact CB-CB 4.45Å; L606-L671 PolarHBondContact N-O 3.08Å; L606-L671 PolarHBondContact O-N 2.83Å; L606-L673 HydrophobicContact CD1-CB 4.5Å; L606-L673 HydrophobicContact CD1-CD1 3.79Å; L606-L673 HydrophobicContact CD1-CG 4.06Å
607	M	86.6	Confident	84.4	Confident	69 Å²	69	43.5 Å²	43.5	34%	0.34	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	133	-176.8	-164.8	173.6	71.5	0	0	110.8	L589 K612	L589-M607 HydrophobicContact CD1-CB 4.46Å; L589-M607 HydrophobicContact CD2-CB 4.06Å; M607-K612 HydrophobicContact SD-CB 3.99Å; M607-K612 HydrophobicContact SD-CG 4.35Å
608	L	83.9	Confident	83.9	Confident	18 Å²	18	36.2 Å²	36.2	9%	0.094	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-60	175	-77.3	162.4	0	0	0	111.9	L581 L585 L669 L671 L768 A771	L581-L608 HydrophobicContact CD2-CD2 4.45Å; L585-L608 HydrophobicContact CD1-CD2 3.53Å; L585-L608 HydrophobicContact CD1-CG 4.2Å; L608-L669 HydrophobicContact CB-CB 4.31Å; L608-L669 HydrophobicContact CB-CD2 4.06Å; L608-L669 HydrophobicContact CB-CG 4.15Å; L608-L669 WeakPolarHBondContact CB-O 3.38Å; L608-L669 HydrophobicContact CD1-CD2 4.05Å; L608-L669 HydrophobicContact CD1-CG 4Å; L608-L669 PolarHBondContact N-O 2.93Å; L608-L671 HydrophobicContact CD1-CB 3.91Å; L608-L671 HydrophobicContact CG-CB 4.04Å; L608-L768 HydrophobicContact CD1-CD1 3.5Å; L608-L768 VanDerWaalsContact CD1-CD1 3.5Å; L608-L768 HydrophobicContact CD2-CD1 3.75Å; L608-L768 HydrophobicContact CG-CD1 4.3Å; L608-A771 HydrophobicContact CD2-CB 4.12Å
609	I	83	Confident	83.3	Confident	37 Å²	37	36 Å²	36	19%	0.19	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	139.2	-174.7	-59.3	179.1	0	0	0	109	L660 L669 Q770 A771	I609-L660 HydrophobicContact CG2-CD2 3.81Å; I609-L669 HydrophobicContact CB-CB 4.32Å; I609-L669 HydrophobicContact CD1-CD2 4.49Å; I609-L669 PolarHBondContact N-O 2.69Å; I609-L669 PolarHBondContact O-N 3.05Å; I609-Q770 HydrophobicContact CD1-CB 4.08Å; I609-A771 HydrophobicContact CD1-CB 3.93Å; I609-A771 HydrophobicContact CG1-CB 4.05Å
610	G	81.4	Confident	82.1	Confident	29 Å²	29	38.2 Å²	38.2	30%	0.299	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	116.8	-164.2	167.4	0	0	0	0	0	113.4	L667	G610-L667 CarbonylContact C-O 3.47Å; G610-L667 VanDerWaalsContact CA-O 3.22Å; G610-L667 WeakPolarHBondContact CA-O 3.36Å
611	N	82	Confident	80.8	Confident	40 Å²	40	39.6 Å²	39.6	21%	0.214	20%	0.2	C	C	.	.			trans	-80.6	131.8	-176.2	-168.5	-0.7	0	0	0	112.1	D613 I614 L667 C668	N611-D613 VanDerWaalsContact C-N 3.34Å; N611-D613 PolarHBondContact ND2-OD2 2.83Å; N611-D613 PolarHBondContact OD1-N 2.73Å; N611-D613 PolarHBondContact OD1-OD2 2.82Å; N611-I614 HydrophobicContact CB-CD1 4.25Å; N611-I614 HydrophobicContact CB-CG1 4.45Å; N611-L667 PolarHBondContact N-O 3.16Å; N611-C668 WeakPolarHBondContact O-CB 3.27Å; N611-C668 PolarHBondContact O-SG 2.94Å
612	K	81.8	Confident	78.9	Confident	110 Å²	110	45.4 Å²	45.4	48%	0.478	23%	0.225	S	C	.	.	S	Bend	trans	-65.9	-32.8	173.3	-171	174.5	-179.6	177.6	0	112.3	L589 M607 I614 S615 Q616	L589-K612 HydrophobicContact CD1-CG 4.35Å; M607-K612 HydrophobicContact SD-CB 3.99Å; M607-K612 HydrophobicContact SD-CG 4.35Å; K612-I614 VanDerWaalsContact C-N 3.27Å; K612-I614 PolarHBondContact O-N 2.98Å; K612-S615 WeakPolarHBondContact O-CA 3.2Å; K612-S615 WeakPolarHBondContact O-CB 3.25Å; K612-S615 PolarHBondContact O-N 2.95Å; K612-S615 PolarHBondContact O-OG 2.74Å; K612-Q616 PolarHBondContact O-N 2.82Å
613	D	81.5	Confident	77	Confident	85 Å²	85	49.7 Å²	49.7	46%	0.455	25%	0.249	S	C	.	.	H	α-helix	trans	-57.6	-41.1	-178.3	-49.8	-25	0	0	0	111.6	N611 S615 Q616 D617	N611-D613 VanDerWaalsContact C-N 3.34Å; N611-D613 PolarHBondContact ND2-OD2 2.83Å; N611-D613 PolarHBondContact OD1-N 2.73Å; N611-D613 PolarHBondContact OD1-OD2 2.82Å; D613-S615 PolarHBondContact O-N 3Å; D613-S615 VanDerWaalsContact O-N 3.16Å; D613-Q616 CarbonylContact O-C 3.59Å; D613-Q616 WeakPolarHBondContact O-CA 3.4Å; D613-Q616 WeakPolarHBondContact O-CB 3.34Å; D613-Q616 PolarHBondContact O-N 3.32Å; D613-D617 PolarHBondContact O-N 3.28Å
614	I	82	Confident	74.6	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.3	-27.5	177	-68.7	173.1	0	0	0	112	N611 K612 L618 H665 N666 C668 L753 A790 R792	N611-I614 HydrophobicContact CB-CD1 4.25Å; N611-I614 HydrophobicContact CB-CG1 4.45Å; K612-I614 VanDerWaalsContact C-N 3.27Å; K612-I614 PolarHBondContact O-N 2.98Å; I614-L618 PolarHBondContact O-N 3.49Å; I614-H665 WeakPolarHBondContact CD1-O 3.44Å; I614-N666 VanDerWaalsContact CD1-C 3.48Å; I614-C668 HydrophobicContact CB-CB 3.89Å; I614-C668 HydrophobicContact CG2-CB 3.67Å; I614-L753 HydrophobicContact CG2-CD1 3.76Å; I614-L753 HydrophobicContact CG2-CD2 4.4Å; I614-A790 HydrophobicContact CG2-CB 3.5Å; I614-A790 VanDerWaalsContact CG2-CB 3.5Å; I614-R792 HydrophobicContact CD1-CB 4.23Å
615	S	78.3	Confident	72.5	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.014	31%	0.308	C	S	.	.	H	α-helix	trans	-79.9	-23.1	174.8	79.8	0	0	0	0	113.4	W590 K612 D613	W590-S615 PolarHBondContact NE1-O 2.96Å; K612-S615 WeakPolarHBondContact O-CA 3.2Å; K612-S615 WeakPolarHBondContact O-CB 3.25Å; K612-S615 PolarHBondContact O-N 2.95Å; K612-S615 PolarHBondContact O-OG 2.74Å; D613-S615 PolarHBondContact O-N 3Å; D613-S615 VanDerWaalsContact O-N 3.16Å
616	Q	77.5	Confident	70.1	Confident	107 Å²	107	63.3 Å²	63.3	50%	0.5	33%	0.33	S	S	.	.	H	α-helix	trans	-83.5	-39.9	173.9	-63.8	-177.9	-23.8	0	0	110.9	K612 D613 L618 L619 D620	K612-Q616 PolarHBondContact O-N 2.82Å; D613-Q616 CarbonylContact O-C 3.59Å; D613-Q616 WeakPolarHBondContact O-CA 3.4Å; D613-Q616 WeakPolarHBondContact O-CB 3.34Å; D613-Q616 PolarHBondContact O-N 3.32Å; Q616-L618 PolarHBondContact O-N 2.95Å; Q616-L618 VanDerWaalsContact O-N 3.08Å; Q616-L619 WeakPolarHBondContact O-CA 3.42Å; Q616-L619 WeakPolarHBondContact O-CB 3.44Å; Q616-L619 PolarHBondContact O-N 3.49Å; Q616-D620 PolarHBondContact O-N 3.06Å; Q616-D620 VanDerWaalsContact O-N 3.16Å
617	D	76	Confident	67.4	Low	48 Å²	48	71.7 Å²	71.7	26%	0.257	37%	0.374	S	S	.	.	H	α-helix	trans	-51.2	-30.5	166.7	-83.5	-26.8	0	0	0	111.9	D613 Y621	D613-D617 PolarHBondContact O-N 3.28Å; D617-Y621 WeakPolarHBondContact O-CD2 3.44Å; D617-Y621 VanDerWaalsContact O-CE2 3.31Å; D617-Y621 WeakPolarHBondContact O-CE2 3.48Å
618	L	74.1	Confident	65	Low	1 Å²	1	71.9 Å²	71.9	1%	0.005	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-23.3	175.2	-89.6	162.6	0	0	0	115.1	I614 Q616 L636 M670 L753 V755 A790	I614-L618 PolarHBondContact O-N 3.49Å; Q616-L618 PolarHBondContact O-N 2.95Å; Q616-L618 VanDerWaalsContact O-N 3.08Å; L618-L636 HydrophobicContact CD2-CD2 3.97Å; L618-M670 HydrophobicContact CD1-CE 3.84Å; L618-L753 HydrophobicContact CD1-CD2 3.82Å; L618-L753 HydrophobicContact CD2-CD2 3.97Å; L618-L753 HydrophobicContact CG-CD2 3.55Å; L618-V755 HydrophobicContact CD1-CG2 3.92Å; L618-V755 HydrophobicContact CD2-CG2 3.87Å; L618-V755 HydrophobicContact CG-CG2 4.37Å; L618-A790 HydrophobicContact CD1-CB 3.87Å
619	L	69.6	Low	62.5	Low	79 Å²	79	80.7 Å²	80.7	41%	0.414	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-35.5	177.8	-162	72.3	0	0	0	111.1	W590 Q616 Y621 P634	W590-L619 HydrophobicContact CB-CD1 3.99Å; W590-L619 HydrophobicContact CD2-CD1 4.24Å; W590-L619 HydrophobicContact CG-CD1 3.89Å; Q616-L619 WeakPolarHBondContact O-CA 3.42Å; Q616-L619 WeakPolarHBondContact O-CB 3.44Å; Q616-L619 PolarHBondContact O-N 3.49Å; L619-Y621 PolarHBondContact O-N 2.91Å; L619-P634 HydrophobicContact CD1-CB 4.2Å; L619-P634 HydrophobicContact CD1-CG 3.72Å
620	D	60.8	Low	60.2	Low	96 Å²	96	86.9 Å²	86.9	51%	0.513	45%	0.451	S	S	.	.	S	Bend	trans	-67.8	-11.3	179.4	-95.6	27.6	0	0	0	114.7	Q616 K622 R750	Q616-D620 PolarHBondContact O-N 3.06Å; Q616-D620 VanDerWaalsContact O-N 3.16Å; D620-K622 PolarHBondContact O-N 3.41Å; D620-R750 IonicContact OD2-CZ 2.93Å; D620-R750 IonicContact OD2-NH2 3.05Å; D620-R750 PolarHBondContact OD2-NH2 3.3Å
621	Y	59.1	Low	58.1	Low	60 Å²	60	94.1 Å²	94.1	24%	0.235	48%	0.482	C	S	.	.			trans	-78	69.7	171.8	-78.4	-77.9	0	0	0	111.7	D617 L619 P728 K729	D617-Y621 WeakPolarHBondContact O-CD2 3.44Å; D617-Y621 VanDerWaalsContact O-CE2 3.31Å; D617-Y621 WeakPolarHBondContact O-CE2 3.48Å; L619-Y621 PolarHBondContact O-N 2.91Å; Y621-P728 HydrophobicContact CD1-CB 3.72Å; Y621-P728 HydrophobicContact CD2-CB 3.82Å; Y621-P728 HydrophobicContact CD2-CG 4.31Å; Y621-P728 HydrophobicContact CE1-CB 3.42Å; Y621-P728 VanDerWaalsContact CE1-CB 3.42Å; Y621-P728 HydrophobicContact CE2-CB 3.54Å; Y621-P728 HydrophobicContact CE2-CG 4.04Å; Y621-P728 HydrophobicContact CG-CB 3.92Å; Y621-K729 WeakPolarHBondContact CE1-O 3.43Å
622	K	49.6	Very low	56.7	Low	129 Å²	129	95.4 Å²	95.4	56%	0.561	49%	0.491	S	S	*	.			trans	-84.6	127.7	173.7	-158.3	170.5	-170.6	171.7	0	110	D620 N624 T632	D620-K622 PolarHBondContact O-N 3.41Å; K622-N624 PolarHBondContact O-N 2.78Å; K622-T632 VanDerWaalsContact CE-OG1 3.22Å; K622-T632 WeakPolarHBondContact CE-OG1 3.44Å; K622-T632 PolarHBondContact NZ-OG1 2.84Å
623	D	49.9	Very low	55.8	Low	94 Å²	94	91.7 Å²	91.7	50%	0.503	48%	0.479	S	S	.	.			trans	-68.1	112.2	168.8	-97.2	-46.3	0	0	0	108.4	N625	D623-N625 PolarHBondContact O-N 3.46Å
624	N	42.3	Very low	55.4	Low	105 Å²	105	88.2 Å²	88.2	56%	0.561	46%	0.462	S	S	*	.	S	Bend	trans	-66.5	14.8	-177.7	-70.9	-39.6	0	0	0	115.1	K622 E731	K622-N624 PolarHBondContact O-N 2.78Å; N624-E731 PolarHBondContact ND2-OE1 3.42Å; N624-E731 PolarHBondContact ND2-OE2 2.7Å
625	N	44.4	Very low	55.4	Low	155 Å²	155	90 Å²	90	83%	0.829	47%	0.472	S	S	*	.			trans	-107.6	18.3	-166.6	-90	-41.9	0	0	0	115	D623	D623-N625 PolarHBondContact O-N 3.46Å
626	S	40.4	Very low	55.7	Low	66 Å²	66	90.2 Å²	90.2	46%	0.462	47%	0.473	S	S	.	.			trans	-142.1	98.6	176.6	62.5	0	0	0	0	113.1	S628	S626-S628 VanDerWaalsContact C-N 3.25Å; S626-S628 PolarHBondContact O-N 3.08Å
627	N	31.8	Very low	56.1	Low	176 Å²	176	91 Å²	91	94%	0.941	47%	0.472	S	S	*	.			trans	-75.2	73.4	172.4	-66.9	-8.8	0	0	0	110.5
628	S	35.1	Very low	56.7	Low	72 Å²	72	89.4 Å²	89.4	50%	0.503	46%	0.463	S	S	.	.			trans	-144.8	116.1	179.4	58.5	0	0	0	0	111.2	S626 Q630	S626-S628 VanDerWaalsContact C-N 3.25Å; S626-S628 PolarHBondContact O-N 3.08Å; S628-Q630 PolarHBondContact O-N 2.86Å
629	E	31.6	Very low	57	Low	204 Å²	204	92.2 Å²	92.2	95%	0.953	48%	0.483	S	S	*	.			trans	-80.3	35.3	-163	-57.2	174.4	117	0	0	115
630	Q	34.8	Very low	57.7	Low	167 Å²	167	96.9 Å²	96.9	78%	0.78	50%	0.495	S	S	*	.	S	Bend	trans	-117.3	129.1	-178.9	-66.7	-175	-8.1	0	0	111.2	S628 T632	S628-Q630 PolarHBondContact O-N 2.86Å; Q630-T632 PolarHBondContact O-N 2.83Å
631	L	37.7	Very low	58.9	Low	180 Å²	180	98.7 Å²	98.7	94%	0.942	50%	0.495	S	S	*	.			trans	-21.8	96	-174.8	-93.1	59.5	0	0	0	114	S633	L631-S633 PolarHBondContact O-N 2.86Å
632	T	51.7	Low	59.9	Low	67 Å²	67	96.6 Å²	96.6	41%	0.411	49%	0.491	S	S	.	.			trans	-88.8	92.9	-166.1	6.8	0	0	0	0	111.2	K622 Q630	K622-T632 VanDerWaalsContact CE-OG1 3.22Å; K622-T632 WeakPolarHBondContact CE-OG1 3.44Å; K622-T632 PolarHBondContact NZ-OG1 2.84Å; Q630-T632 PolarHBondContact O-N 2.83Å
633	S	63.5	Low	61.3	Low	32 Å²	32	95 Å²	95	22%	0.224	49%	0.492	C	S	.	.			trans	-57.5	135.2	174.8	64.7	0	0	0	0	112.1	L631	L631-S633 PolarHBondContact O-N 2.86Å
634	P	74.2	Confident	62.7	Low	13 Å²	13	92.6 Å²	92.6	8%	0.084	48%	0.479	C	S	.	.			trans	-55.3	143.9	178.6	25.7	-39.6	0	0	0	112.9	W590 K591 G592 K593 L619	W590-P634 HydrophobicContact CD2-CG 4.17Å; W590-P634 HydrophobicContact CE3-CG 3.44Å; W590-P634 VanDerWaalsContact CE3-CG 3.44Å; W590-P634 HydrophobicContact CH2-CG 4.49Å; W590-P634 HydrophobicContact CZ3-CB 4.47Å; W590-P634 HydrophobicContact CZ3-CG 3.62Å; K591-P634 WeakPolarHBondContact O-CD 3.48Å; G592-P634 WeakPolarHBondContact CA-O 3.38Å; K593-P634 PolarHBondContact N-O 2.86Å; L619-P634 HydrophobicContact CD1-CB 4.2Å; L619-P634 HydrophobicContact CD1-CG 3.72Å
635	T	80.5	Confident	64.4	Low	36 Å²	36	90.8 Å²	90.8	22%	0.221	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	94.8	-176	-58.9	0	0	0	0	110.6	K593 L595 R637	K593-T635 WeakPolarHBondContact CE-OG1 3.22Å; K593-T635 HydrophobicContact CG-CG2 4.27Å; K593-T635 CarbonylContact O-C 3.56Å; K593-T635 WeakPolarHBondContact O-CA 3.49Å; L595-T635 HydrophobicContact CB-CG2 4.08Å; T635-R637 PolarHBondContact O-N 2.91Å
636	L	85	Confident	66	Low	8 Å²	8	87.5 Å²	87.5	4%	0.042	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	104.9	-177.7	-67	-165.7	0	0	0	111.6	W590 K593 F594 L595 F603 L618 I638 I726 L788	W590-L636 HydrophobicContact CH2-CD1 3.79Å; W590-L636 HydrophobicContact CH2-CG 4.34Å; K593-L636 PolarHBondContact O-N 2.79Å; F594-L636 WeakPolarHBondContact CA-O 3.4Å; F594-L636 HydrophobicContact CD1-CB 3.77Å; F594-L636 HydrophobicContact CE1-CB 4Å; F594-L636 HydrophobicContact CE1-CD1 4.06Å; L595-L636 PolarHBondContact N-O 2.86Å; F603-L636 HydrophobicContact CZ-CD1 4.27Å; L618-L636 HydrophobicContact CD2-CD2 3.97Å; L636-I638 PolarHBondContact O-N 2.93Å; L636-I726 HydrophobicContact CB-CD1 4.09Å; L636-I726 HydrophobicContact CB-CG2 4.34Å; L636-I726 HydrophobicContact CD1-CD1 4.26Å; L636-I726 HydrophobicContact CD2-CG2 4.44Å; L636-L788 HydrophobicContact CD1-CD2 4.28Å
637	R	85.8	Confident	67.9	Low	124 Å²	124	88.6 Å²	88.6	47%	0.468	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	109.1	-178.2	-172.7	177.2	179.8	146.6	2.3	112.7	L595 T635 S639	L595-R637 HydrophobicContact CB-CB 4.46Å; L595-R637 HydrophobicContact CD2-CG 4.15Å; L595-R637 HydrophobicContact CG-CG 4.46Å; T635-R637 PolarHBondContact O-N 2.91Å; R637-S639 PolarHBondContact O-N 2.92Å; R637-S639 PolarHBondContact O-OG 2.88Å
638	I	88	Confident	70.3	Confident	13 Å²	13	83.1 Å²	83.1	7%	0.067	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	100.1	174.3	-56	173.6	0	0	0	108.2	F594 L595 L596 L636 L713 I726 L757	F594-I638 HydrophobicContact CB-CD1 4.17Å; F594-I638 HydrophobicContact CD1-CD1 4.34Å; F594-I638 HydrophobicContact CD1-CG1 4.33Å; F594-I638 HydrophobicContact CG-CD1 4.34Å; L595-I638 PolarHBondContact O-N 3.4Å; L596-I638 HydrophobicContact CD1-CB 3.95Å; L596-I638 HydrophobicContact CD1-CG2 3.92Å; L636-I638 PolarHBondContact O-N 2.93Å; I638-L713 HydrophobicContact CD1-CD1 3.86Å; I638-L713 HydrophobicContact CD1-CD2 3.93Å; I638-I726 HydrophobicContact CB-CG1 4.49Å; I638-I726 HydrophobicContact CG1-CD1 4.27Å; I638-I726 HydrophobicContact CG1-CG1 3.96Å; I638-L757 HydrophobicContact CD1-CD2 3.72Å; I638-L757 HydrophobicContact CG1-CD2 4.37Å
639	S	81.8	Confident	72.2	Confident	60 Å²	60	81.6 Å²	81.6	42%	0.42	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-26.1	-166	-65.9	0	0	0	0	113	R637 I725	R637-S639 PolarHBondContact O-N 2.92Å; R637-S639 PolarHBondContact O-OG 2.88Å; S639-I725 PolarHBondContact N-O 3.21Å
640	R	84.6	Confident	74.4	Confident	178 Å²	178	74.9 Å²	74.9	67%	0.672	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.1	173.2	175	-64.8	178.5	-176.2	168.1	2.3	110.1	I725	R640-I725 HydrophobicContact CB-CB 3.99Å; R640-I725 HydrophobicContact CB-CD1 4.47Å; R640-I725 HydrophobicContact CB-CG2 4.4Å; R640-I725 PolarHBondContact N-O 2.86Å; R640-I725 PolarHBondContact O-N 3.38Å
641	R	85.2	Confident	76.5	Confident	134 Å²	134	71.5 Å²	71.5	51%	0.506	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135.3	169.3	-71.9	173.5	-65.7	166.2	8.5	108.5	Y716 A723	R641-Y716 PolarHBondContact NH1-OH 2.93Å; R641-Y716 VanDerWaalsContact NH1-OH 3.08Å; R641-A723 CarbonylContact C-O 3.27Å; R641-A723 VanDerWaalsContact CA-O 3.25Å; R641-A723 WeakPolarHBondContact CA-O 3.34Å
642	G	80.4	Confident	78.4	Confident	15 Å²	15	63.4 Å²	63.4	16%	0.155	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	137.2	169	0	0	0	0	0	109.8	S722 A723	G642-S722 CarbonylContact O-C 3.6Å; G642-S722 WeakPolarHBondContact O-CA 3.4Å; G642-S722 WeakPolarHBondContact O-CB 3.47Å; G642-A723 PolarHBondContact N-O 3.12Å; G642-A723 PolarHBondContact O-N 3.16Å
643	T	78.8	Confident	79.6	Confident	96 Å²	96	62.3 Å²	62.3	59%	0.589	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	133.4	173.1	40.5	0	0	0	0	110.3	D645	T643-D645 VanDerWaalsContact C-N 3.31Å; T643-D645 PolarHBondContact O-N 3.19Å
644	L	78.6	Confident	80.2	Confident	43 Å²	43	66.4 Å²	66.4	23%	0.225	36%	0.355	C	S	.	.			trans	-92	62.8	176.7	-63	173.4	0	0	0	110.1	W648 M649 Q721 A723 F758	L644-W648 HydrophobicContact CD2-CE3 3.75Å; L644-W648 HydrophobicContact CD2-CH2 4.32Å; L644-W648 HydrophobicContact CD2-CZ3 3.44Å; L644-W648 VanDerWaalsContact CD2-CZ3 3.44Å; L644-M649 HydrophobicContact CB-CG 4.36Å; L644-M649 HydrophobicContact CB-SD 4.14Å; L644-M649 HydrophobicContact CD2-SD 3.95Å; L644-Q721 WeakPolarHBondContact CB-O 3.3Å; L644-Q721 PolarHBondContact N-O 3.39Å; L644-A723 HydrophobicContact CD2-CB 4.1Å; L644-F758 HydrophobicContact CD2-CD1 4.31Å; L644-F758 HydrophobicContact CD2-CE1 4.12Å
645	D	79.3	Confident	80.3	Confident	68 Å²	68	73 Å²	73	36%	0.364	38%	0.378	S	S	.	.			trans	-77.7	158.4	169.5	63.2	71.1	0	0	0	111.6	T643 S647 W648 M649	T643-D645 VanDerWaalsContact C-N 3.31Å; T643-D645 PolarHBondContact O-N 3.19Å; D645-S647 VanDerWaalsContact C-N 3.28Å; D645-S647 PolarHBondContact O-N 2.99Å; D645-S647 WeakPolarHBondContact OD1-CB 3.5Å; D645-S647 PolarHBondContact OD1-N 2.76Å; D645-S647 PolarHBondContact OD1-OG 2.83Å; D645-W648 PolarHBondContact O-N 3.16Å; D645-W648 WeakPolarHBondContact OD1-CB 3.47Å; D645-W648 PolarHBondContact OD1-N 2.99Å; D645-M649 WeakPolarHBondContact O-CB 3.35Å; D645-M649 WeakPolarHBondContact O-CG 3.31Å; D645-M649 PolarHBondContact O-N 2.97Å
646	A	77.1	Confident	80.2	Confident	86 Å²	86	71.8 Å²	71.8	71%	0.711	37%	0.37	S	S	*	.	H	α-helix	trans	-62.1	-34.6	-173.4	0	0	0	0	0	113.1	A650	A646-A650 WeakPolarHBondContact O-CB 3.44Å; A646-A650 PolarHBondContact O-N 3.33Å
647	S	80	Confident	79.8	Confident	89 Å²	89	75 Å²	75	62%	0.622	38%	0.384	S	S	*	.	H	α-helix	trans	-63.1	-51.1	174.2	20.9	0	0	0	0	111.8	D645 M649 A650 E651	D645-S647 VanDerWaalsContact C-N 3.28Å; D645-S647 PolarHBondContact O-N 2.99Å; D645-S647 WeakPolarHBondContact OD1-CB 3.5Å; D645-S647 PolarHBondContact OD1-N 2.76Å; D645-S647 PolarHBondContact OD1-OG 2.83Å; S647-M649 VanDerWaalsContact C-N 3.33Å; S647-M649 PolarHBondContact O-N 3.31Å; S647-A650 PolarHBondContact O-N 2.68Å; S647-E651 WeakPolarHBondContact O-CB 3.44Å; S647-E651 PolarHBondContact O-N 2.97Å
648	W	81.9	Confident	79.3	Confident	60 Å²	60	72.5 Å²	72.5	23%	0.227	38%	0.38	C	S	.	.	H	α-helix	trans	-63	-39.9	176.8	-172.9	90.2	0	0	0	111.7	L644 D645 E651 A652 Y756 F758	L644-W648 HydrophobicContact CD2-CE3 3.75Å; L644-W648 HydrophobicContact CD2-CH2 4.32Å; L644-W648 HydrophobicContact CD2-CZ3 3.44Å; L644-W648 VanDerWaalsContact CD2-CZ3 3.44Å; D645-W648 PolarHBondContact O-N 3.16Å; D645-W648 WeakPolarHBondContact OD1-CB 3.47Å; D645-W648 PolarHBondContact OD1-N 2.99Å; W648-E651 PolarHBondContact O-N 2.86Å; W648-A652 HydrophobicContact CD2-CB 4.34Å; W648-A652 HydrophobicContact CE3-CB 4.02Å; W648-A652 HydrophobicContact CH2-CB 3.9Å; W648-A652 HydrophobicContact CZ2-CB 4.23Å; W648-A652 HydrophobicContact CZ3-CB 3.78Å; W648-A652 WeakPolarHBondContact O-CB 3.23Å; W648-A652 PolarHBondContact O-N 3.39Å; W648-Y756 HydrophobicContact CH2-CD1 4.45Å; W648-Y756 HydrophobicContact CZ2-CD1 4.29Å; W648-Y756 AromaticContact CZ2-CE1 3.94Å; W648-Y756 HydrophobicContact CZ2-CE1 3.94Å; W648-F758 AromaticContact CH2-CE1 3.76Å; W648-F758 HydrophobicContact CH2-CE1 3.76Å; W648-F758 AromaticContact CH2-CZ 3.91Å; W648-F758 HydrophobicContact CH2-CZ 3.91Å; W648-F758 AromaticContact CZ3-CE1 3.91Å; W648-F758 HydrophobicContact CZ3-CE1 3.91Å; W648-F758 HydrophobicContact CZ3-CZ 4.41Å
649	M	76.2	Confident	78.6	Confident	40 Å²	40	73.9 Å²	73.9	20%	0.197	39%	0.389	C	S	.	.	H	α-helix	trans	-63.3	-43.6	177.1	-69	-96.7	-79.4	0	0	111.9	L644 D645 S647 T653 F763	L644-M649 HydrophobicContact CB-CG 4.36Å; L644-M649 HydrophobicContact CB-SD 4.14Å; L644-M649 HydrophobicContact CD2-SD 3.95Å; D645-M649 WeakPolarHBondContact O-CB 3.35Å; D645-M649 WeakPolarHBondContact O-CG 3.31Å; D645-M649 PolarHBondContact O-N 2.97Å; S647-M649 VanDerWaalsContact C-N 3.33Å; S647-M649 PolarHBondContact O-N 3.31Å; M649-T653 WeakPolarHBondContact O-CB 3.39Å; M649-T653 PolarHBondContact O-N 3.02Å; M649-T653 PolarHBondContact O-OG1 3.19Å; M649-F763 HydrophobicContact CE-CB 3.51Å; M649-F763 HydrophobicContact CE-CG 4.25Å; M649-F763 HydrophobicContact SD-CB 3.8Å; M649-F763 HydrophobicContact SD-CD1 4.28Å; M649-F763 HydrophobicContact SD-CD2 4.35Å; M649-F763 HydrophobicContact SD-CG 3.89Å
650	A	76.7	Confident	78.2	Confident	64 Å²	64	71.8 Å²	71.8	53%	0.529	37%	0.373	S	S	.	.	H	α-helix	trans	-65.9	-44.8	176.5	0	0	0	0	0	111.7	A646 S647 T653 H654	A646-A650 WeakPolarHBondContact O-CB 3.44Å; A646-A650 PolarHBondContact O-N 3.33Å; S647-A650 PolarHBondContact O-N 2.68Å; A650-T653 PolarHBondContact O-N 2.97Å; A650-H654 PolarHBondContact O-N 3.5Å
651	E	79.4	Confident	77.7	Confident	95 Å²	95	68 Å²	68	44%	0.444	37%	0.374	S	S	.	.	H	α-helix	trans	-63.2	-46.3	176.7	-177.9	179.1	-159.6	0	0	111.9	S647 W648 H654 R655	S647-E651 WeakPolarHBondContact O-CB 3.44Å; S647-E651 PolarHBondContact O-N 2.97Å; W648-E651 PolarHBondContact O-N 2.86Å; E651-H654 PolarHBondContact O-N 3.2Å; E651-R655 HydrophobicContact CG-CG 4.32Å; E651-R655 WeakPolarHBondContact O-CB 3.47Å; E651-R655 VanDerWaalsContact O-CG 3.29Å; E651-R655 WeakPolarHBondContact O-CG 3.34Å; E651-R655 PolarHBondContact O-N 3.03Å; E651-R655 IonicContact OE1-CZ 3.88Å; E651-R655 IonicContact OE1-NE 3.28Å; E651-R655 PolarHBondContact OE1-NE 2.78Å; E651-R655 IonicContact OE1-NH2 3.71Å; E651-R655 PolarHBondContact OE1-NH2 2.75Å
652	A	77.2	Confident	77.1	Confident	10 Å²	10	67.2 Å²	67.2	8%	0.083	38%	0.384	C	S	.	.	H	α-helix	trans	-61.5	-43.8	176.3	0	0	0	0	0	111.2	W648 H654 R655 I656 F763	W648-A652 HydrophobicContact CD2-CB 4.34Å; W648-A652 HydrophobicContact CE3-CB 4.02Å; W648-A652 HydrophobicContact CH2-CB 3.9Å; W648-A652 HydrophobicContact CZ2-CB 4.23Å; W648-A652 HydrophobicContact CZ3-CB 3.78Å; W648-A652 WeakPolarHBondContact O-CB 3.23Å; W648-A652 PolarHBondContact O-N 3.39Å; A652-H654 PolarHBondContact O-N 3.05Å; A652-R655 PolarHBondContact O-N 2.76Å; A652-I656 HydrophobicContact CB-CD1 4.33Å; A652-I656 VanDerWaalsContact O-CB 3.28Å; A652-I656 WeakPolarHBondContact O-CB 3.36Å; A652-I656 VanDerWaalsContact O-CD1 3.32Å; A652-I656 WeakPolarHBondContact O-CD1 3.43Å; A652-I656 WeakPolarHBondContact O-CG1 3.42Å; A652-I656 PolarHBondContact O-N 2.87Å; A652-F763 HydrophobicContact CB-CE2 4.42Å; A652-F763 HydrophobicContact CB-CZ 4.31Å
653	T	77.1	Confident	76.4	Confident	45 Å²	45	67.4 Å²	67.4	28%	0.276	38%	0.384	S	S	.	.	H	α-helix	trans	-55.8	-50.7	174.5	-56.5	0	0	0	0	110.7	M649 A650 I656 H657 F763	M649-T653 WeakPolarHBondContact O-CB 3.39Å; M649-T653 PolarHBondContact O-N 3.02Å; M649-T653 PolarHBondContact O-OG1 3.19Å; A650-T653 PolarHBondContact O-N 2.97Å; T653-I656 PolarHBondContact O-N 2.91Å; T653-H657 WeakPolarHBondContact O-CB 3.49Å; T653-H657 PolarHBondContact O-CD2 3.3Å; T653-H657 VanDerWaalsContact O-CD2 3.31Å; T653-H657 PolarHBondContact O-N 3.04Å; T653-F763 WeakPolarHBondContact OG1-CD2 3.27Å; T653-F763 WeakPolarHBondContact OG1-CE2 3.31Å
654	H	76.6	Confident	76	Confident	118 Å²	118	69.5 Å²	69.5	55%	0.546	38%	0.381	S	S	.	.	H	α-helix	trans	-63.6	-47.5	179.4	-174.1	56.8	0	0	0	112.2	A650 E651 A652 I656 H657 N658	A650-H654 PolarHBondContact O-N 3.5Å; E651-H654 PolarHBondContact O-N 3.2Å; A652-H654 PolarHBondContact O-N 3.05Å; H654-I656 VanDerWaalsContact C-N 3.34Å; H654-I656 PolarHBondContact O-N 3.2Å; H654-H657 PolarHBondContact O-N 3.42Å; H654-N658 PolarHBondContact CD2-ND2 3.35Å; H654-N658 PolarHBondContact CE1-ND2 2.7Å; H654-N658 VanDerWaalsContact CE1-ND2 3.26Å; H654-N658 PolarHBondContact CE1-OD1 3.15Å; H654-N658 VanDerWaalsContact CE1-OD1 3.3Å; H654-N658 PolarHBondContact ND1-OD1 3.4Å; H654-N658 PolarHBondContact NE2-ND2 3.34Å; H654-N658 WeakPolarHBondContact O-CB 2.87Å; H654-N658 PolarHBondContact O-N 3.26Å; H654-N658 PolarHBondContact O-ND2 2.88Å; H654-N658 PolarHBondContact O-OD1 3.34Å
655	R	75.5	Confident	75.8	Confident	152 Å²	152	72.6 Å²	72.6	57%	0.574	40%	0.395	S	S	*	.	H	α-helix	trans	-57.4	-44.9	177	-73.2	171.4	176.9	-115.9	8.8	112.1	E651 A652 V659	E651-R655 HydrophobicContact CG-CG 4.32Å; E651-R655 WeakPolarHBondContact O-CB 3.47Å; E651-R655 VanDerWaalsContact O-CG 3.29Å; E651-R655 WeakPolarHBondContact O-CG 3.34Å; E651-R655 PolarHBondContact O-N 3.03Å; E651-R655 IonicContact OE1-CZ 3.88Å; E651-R655 IonicContact OE1-NE 3.28Å; E651-R655 PolarHBondContact OE1-NE 2.78Å; E651-R655 IonicContact OE1-NH2 3.71Å; E651-R655 PolarHBondContact OE1-NH2 2.75Å; A652-R655 PolarHBondContact O-N 2.76Å; R655-V659 WeakPolarHBondContact O-CG2 3.38Å; R655-V659 PolarHBondContact O-N 3.36Å
656	I	78.3	Confident	75.8	Confident	9 Å²	9	72 Å²	72	5%	0.046	39%	0.391	C	S	.	.	H	α-helix	trans	-72	-44.2	-177.6	-66.8	161	0	0	0	110.9	A652 T653 H654 N658 V659 L660 L667 F763 L767 L789	A652-I656 HydrophobicContact CB-CD1 4.33Å; A652-I656 VanDerWaalsContact O-CB 3.28Å; A652-I656 WeakPolarHBondContact O-CB 3.36Å; A652-I656 VanDerWaalsContact O-CD1 3.32Å; A652-I656 WeakPolarHBondContact O-CD1 3.43Å; A652-I656 WeakPolarHBondContact O-CG1 3.42Å; A652-I656 PolarHBondContact O-N 2.87Å; T653-I656 PolarHBondContact O-N 2.91Å; H654-I656 VanDerWaalsContact C-N 3.34Å; H654-I656 PolarHBondContact O-N 3.2Å; I656-N658 VanDerWaalsContact C-N 3.33Å; I656-N658 PolarHBondContact O-N 2.95Å; I656-V659 PolarHBondContact O-N 3.26Å; I656-L660 HydrophobicContact CG2-CD1 3.7Å; I656-L660 HydrophobicContact CG2-CG 4.29Å; I656-L660 WeakPolarHBondContact O-CB 3.38Å; I656-L660 VanDerWaalsContact O-CG 3.26Å; I656-L660 WeakPolarHBondContact O-CG 3.3Å; I656-L660 PolarHBondContact O-N 2.62Å; I656-L667 HydrophobicContact CG2-CD1 4.23Å; I656-F763 HydrophobicContact CD1-CE2 4.45Å; I656-F763 HydrophobicContact CD1-CZ 3.77Å; I656-L767 HydrophobicContact CG2-CD2 3.72Å; I656-L789 HydrophobicContact CD1-CD2 3.4Å; I656-L789 HydrophobicContact CG1-CD2 3.83Å
657	H	77.1	Confident	76.2	Confident	76 Å²	76	68 Å²	68	35%	0.352	36%	0.358	S	S	.	.	H	α-helix	trans	-58.5	-44	173.2	-89.1	-100.7	0	0	0	111.7	T653 H654 V659 L660 S661 Q770	T653-H657 WeakPolarHBondContact O-CB 3.49Å; T653-H657 PolarHBondContact O-CD2 3.3Å; T653-H657 VanDerWaalsContact O-CD2 3.31Å; T653-H657 PolarHBondContact O-N 3.04Å; H654-H657 PolarHBondContact O-N 3.42Å; H657-V659 PolarHBondContact O-N 2.9Å; H657-L660 PolarHBondContact O-N 3.01Å; H657-S661 WeakPolarHBondContact O-CB 3.4Å; H657-S661 PolarHBondContact O-N 2.95Å; H657-S661 PolarHBondContact O-OG 2.89Å; H657-Q770 PolarHBondContact CD2-NE2 3.25Å; H657-Q770 PolarHBondContact CE1-NE2 3.16Å; H657-Q770 PolarHBondContact NE2-NE2 3.39Å
658	N	75.5	Confident	76.6	Confident	72 Å²	72	63.7 Å²	63.7	39%	0.385	33%	0.328	S	S	.	.	H	α-helix	trans	-60.6	-43.5	176.5	-65.6	-5.9	0	0	0	111.7	H654 I656 S661 T662	H654-N658 PolarHBondContact CD2-ND2 3.35Å; H654-N658 PolarHBondContact CE1-ND2 2.7Å; H654-N658 VanDerWaalsContact CE1-ND2 3.26Å; H654-N658 PolarHBondContact CE1-OD1 3.15Å; H654-N658 VanDerWaalsContact CE1-OD1 3.3Å; H654-N658 PolarHBondContact ND1-OD1 3.4Å; H654-N658 PolarHBondContact NE2-ND2 3.34Å; H654-N658 WeakPolarHBondContact O-CB 2.87Å; H654-N658 PolarHBondContact O-N 3.26Å; H654-N658 PolarHBondContact O-ND2 2.88Å; H654-N658 PolarHBondContact O-OD1 3.34Å; I656-N658 VanDerWaalsContact C-N 3.33Å; I656-N658 PolarHBondContact O-N 2.95Å; N658-S661 PolarHBondContact O-N 2.86Å; N658-T662 WeakPolarHBondContact O-CB 3.43Å; N658-T662 PolarHBondContact O-N 3.02Å; N658-T662 PolarHBondContact O-OG1 3.21Å
659	V	74.1	Confident	76.9	Confident	41 Å²	41	61 Å²	61	25%	0.248	32%	0.318	C	S	.	.	H	α-helix	trans	-66	-37.7	176	174.4	0	0	0	0	111.9	R655 I656 H657 S661 A663 R664 L667	R655-V659 WeakPolarHBondContact O-CG2 3.38Å; R655-V659 PolarHBondContact O-N 3.36Å; I656-V659 PolarHBondContact O-N 3.26Å; H657-V659 PolarHBondContact O-N 2.9Å; V659-S661 VanDerWaalsContact C-N 3.29Å; V659-S661 PolarHBondContact O-N 2.9Å; V659-A663 HydrophobicContact CG1-CB 4.46Å; V659-A663 CarbonylContact O-C 3.59Å; V659-A663 WeakPolarHBondContact O-CA 3.26Å; V659-A663 PolarHBondContact O-N 2.78Å; V659-R664 PolarHBondContact O-N 2.81Å; V659-L667 HydrophobicContact CB-CD1 4.35Å; V659-L667 HydrophobicContact CG1-CB 3.7Å; V659-L667 HydrophobicContact CG1-CD1 3.86Å; V659-L667 HydrophobicContact CG1-CG 4.45Å
660	L	72.9	Confident	77.5	Confident	17 Å²	17	59.1 Å²	59.1	9%	0.089	31%	0.309	C	S	.	.	H	α-helix	trans	-68.6	-25.1	174.9	-70.9	165.1	0	0	0	113.7	I609 I656 H657 R664 L667 Q770	I609-L660 HydrophobicContact CG2-CD2 3.81Å; I656-L660 HydrophobicContact CG2-CD1 3.7Å; I656-L660 HydrophobicContact CG2-CG 4.29Å; I656-L660 WeakPolarHBondContact O-CB 3.38Å; I656-L660 VanDerWaalsContact O-CG 3.26Å; I656-L660 WeakPolarHBondContact O-CG 3.3Å; I656-L660 PolarHBondContact O-N 2.62Å; H657-L660 PolarHBondContact O-N 3.01Å; L660-R664 WeakPolarHBondContact O-CG 3.21Å; L660-R664 PolarHBondContact O-NE 2.9Å; L660-R664 PolarHBondContact O-NH2 2.94Å; L660-L667 HydrophobicContact CD2-CD1 3.92Å; L660-L667 HydrophobicContact CD2-CD2 3.75Å; L660-L667 HydrophobicContact CG-CD1 3.95Å; L660-Q770 VanDerWaalsContact CD1-CD 3.46Å
661	S	73.8	Confident	78.3	Confident	97 Å²	97	56 Å²	56	68%	0.678	28%	0.283	S	S	*	.	H	α-helix	trans	-87.2	-34.8	174.5	-71.4	0	0	0	0	113.4	H657 N658 V659	H657-S661 WeakPolarHBondContact O-CB 3.4Å; H657-S661 PolarHBondContact O-N 2.95Å; H657-S661 PolarHBondContact O-OG 2.89Å; N658-S661 PolarHBondContact O-N 2.86Å; V659-S661 VanDerWaalsContact C-N 3.29Å; V659-S661 PolarHBondContact O-N 2.9Å
662	T	72.9	Confident	78.9	Confident	119 Å²	119	51.5 Å²	51.5	73%	0.73	26%	0.262	S	S	*	.	H	α-helix	trans	-113.9	-30.5	-167.9	-51.9	0	0	0	0	114.3	N658	N658-T662 WeakPolarHBondContact O-CB 3.43Å; N658-T662 PolarHBondContact O-N 3.02Å; N658-T662 PolarHBondContact O-OG1 3.21Å
663	A	66.3	Low	79.6	Confident	19 Å²	19	51.5 Å²	51.5	16%	0.157	26%	0.261	C	S	.	.			trans	-147.3	50.3	-165.2	0	0	0	0	0	113.7	V659 H665 N666	V659-A663 HydrophobicContact CG1-CB 4.46Å; V659-A663 CarbonylContact O-C 3.59Å; V659-A663 WeakPolarHBondContact O-CA 3.26Å; V659-A663 PolarHBondContact O-N 2.78Å; A663-H665 PolarHBondContact O-N 2.89Å; A663-N666 PolarHBondContact O-N 2.86Å
664	R	69.8	Low	80.2	Confident	139 Å²	139	50.7 Å²	50.7	53%	0.525	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-53.6	-25.4	-179.3	-65.9	-179.4	-175.4	161.9	3.8	114.3	V659 L660 N666 L667	V659-R664 PolarHBondContact O-N 2.81Å; L660-R664 WeakPolarHBondContact O-CG 3.21Å; L660-R664 PolarHBondContact O-NE 2.9Å; L660-R664 PolarHBondContact O-NH2 2.94Å; R664-N666 PolarHBondContact O-N 3.44Å; R664-L667 PolarHBondContact O-N 2.61Å
665	H	74.2	Confident	80.6	Confident	109 Å²	109	45.2 Å²	45.2	51%	0.505	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-66.3	-19.3	176.8	50.6	-101.8	0	0	0	114.3	I614 A663	I614-H665 WeakPolarHBondContact CD1-O 3.44Å; A663-H665 PolarHBondContact O-N 2.89Å
666	N	79.5	Confident	80.6	Confident	55 Å²	55	42.4 Å²	42.4	29%	0.294	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-99.3	7.4	178.6	-74	-26.4	0	0	0	113.8	I614 A663 R664 R792	I614-N666 VanDerWaalsContact CD1-C 3.48Å; A663-N666 PolarHBondContact O-N 2.86Å; R664-N666 PolarHBondContact O-N 3.44Å; N666-R792 HydrophobicContact CB-CB 4.13Å; N666-R792 PolarHBondContact O-N 2.94Å
667	L	85.8	Confident	80.4	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	144.2	-176.8	176.1	153	0	0	0	110.2	G610 N611 I656 V659 L660 R664 L669 L789 A790 L791	G610-L667 CarbonylContact C-O 3.47Å; G610-L667 VanDerWaalsContact CA-O 3.22Å; G610-L667 WeakPolarHBondContact CA-O 3.36Å; N611-L667 PolarHBondContact N-O 3.16Å; I656-L667 HydrophobicContact CG2-CD1 4.23Å; V659-L667 HydrophobicContact CB-CD1 4.35Å; V659-L667 HydrophobicContact CG1-CB 3.7Å; V659-L667 HydrophobicContact CG1-CD1 3.86Å; V659-L667 HydrophobicContact CG1-CG 4.45Å; L660-L667 HydrophobicContact CD2-CD1 3.92Å; L660-L667 HydrophobicContact CD2-CD2 3.75Å; L660-L667 HydrophobicContact CG-CD1 3.95Å; R664-L667 PolarHBondContact O-N 2.61Å; L667-L669 HydrophobicContact CD2-CB 4.21Å; L667-L789 HydrophobicContact CD1-CD1 3.88Å; L667-L789 HydrophobicContact CD2-CD1 4.38Å; L667-L789 HydrophobicContact CG-CD1 3.83Å; L667-A790 WeakPolarHBondContact CA-O 3.35Å; L667-L791 HydrophobicContact CB-CD2 4.05Å; L667-L791 HydrophobicContact CD1-CD2 3.86Å; L667-L791 HydrophobicContact CG-CD2 3.95Å
668	C	87	Confident	80.1	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	119.1	162.5	-165.2	0	0	0	0	109.8	N611 I614 M670 A790	N611-C668 WeakPolarHBondContact O-CB 3.27Å; N611-C668 PolarHBondContact O-SG 2.94Å; I614-C668 HydrophobicContact CB-CB 3.89Å; I614-C668 HydrophobicContact CG2-CB 3.67Å; C668-M670 HydrophobicContact CB-CE 3.95Å; C668-A790 HydrophobicContact CB-CB 4.36Å; C668-A790 PolarHBondContact N-O 2.91Å; C668-A790 PolarHBondContact O-N 3.33Å
669	L	88.7	Confident	79.8	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.016	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	128.4	174.9	-171.7	74.4	0	0	0	108	L608 I609 L667 L767 I787 L789	L608-L669 HydrophobicContact CB-CB 4.31Å; L608-L669 HydrophobicContact CB-CD2 4.06Å; L608-L669 HydrophobicContact CB-CG 4.15Å; L608-L669 WeakPolarHBondContact CB-O 3.38Å; L608-L669 HydrophobicContact CD1-CD2 4.05Å; L608-L669 HydrophobicContact CD1-CG 4Å; L608-L669 PolarHBondContact N-O 2.93Å; I609-L669 HydrophobicContact CB-CB 4.32Å; I609-L669 HydrophobicContact CD1-CD2 4.49Å; I609-L669 PolarHBondContact N-O 2.69Å; I609-L669 PolarHBondContact O-N 3.05Å; L667-L669 HydrophobicContact CD2-CB 4.21Å; L669-L767 HydrophobicContact CD1-CB 4.35Å; L669-L767 HydrophobicContact CD1-CD1 4.17Å; L669-L767 HydrophobicContact CD2-CB 4.36Å; L669-I787 HydrophobicContact CD1-CG2 3.47Å; L669-I787 VanDerWaalsContact CD1-CG2 3.47Å; L669-I787 HydrophobicContact CG-CG2 4.34Å; L669-L789 HydrophobicContact CD1-CB 4.38Å; L669-L789 HydrophobicContact CD1-CD1 4.05Å
670	M	90.3	Very high	79.5	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	137.6	-176.4	-40.1	176.6	-155.9	0	0	110.7	L589 C605 L606 L618 C668 L788 A790	L589-M670 HydrophobicContact CD2-SD 4.13Å; C605-M670 PolarHBondContact SG-SD 3.18Å; L606-M670 CarbonylContact O-C 3.57Å; L606-M670 VanDerWaalsContact O-CA 3.23Å; L606-M670 WeakPolarHBondContact O-CA 3.42Å; L606-M670 WeakPolarHBondContact O-CB 3.34Å; L618-M670 HydrophobicContact CD1-CE 3.84Å; C668-M670 HydrophobicContact CB-CE 3.95Å; M670-L788 HydrophobicContact CB-CB 4.23Å; M670-L788 HydrophobicContact CE-CD2 4.3Å; M670-L788 PolarHBondContact N-O 3Å; M670-L788 PolarHBondContact O-N 3.22Å; M670-L788 HydrophobicContact SD-CD2 3.91Å; M670-A790 HydrophobicContact CE-CB 4.18Å
671	L	91.9	Very high	79.4	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	135.4	169.6	-174.3	64.4	0	0	0	109	L578 L581 L585 C605 L606 L608 L673 L768 Y785	L578-L671 HydrophobicContact CD1-CD1 4.44Å; L578-L671 HydrophobicContact CD1-CD2 4.26Å; L581-L671 HydrophobicContact CD2-CD2 4.01Å; L581-L671 HydrophobicContact CG-CD2 4.35Å; L585-L671 HydrophobicContact CD1-CB 4.47Å; L585-L671 HydrophobicContact CD1-CD2 4.09Å; C605-L671 WeakPolarHBondContact CA-O 3.34Å; L606-L671 HydrophobicContact CB-CB 4.45Å; L606-L671 PolarHBondContact N-O 3.08Å; L606-L671 PolarHBondContact O-N 2.83Å; L608-L671 HydrophobicContact CD1-CB 3.91Å; L608-L671 HydrophobicContact CG-CB 4.04Å; L671-L673 HydrophobicContact CD2-CD1 4.28Å; L671-L673 HydrophobicContact CD2-CD2 4.35Å; L671-L673 HydrophobicContact CD2-CG 4.31Å; L671-L673 HydrophobicContact CG-CD2 4.28Å; L671-L673 HydrophobicContact CG-CG 4.24Å; L671-L768 HydrophobicContact CD1-CD1 4.25Å; L671-Y785 HydrophobicContact CD1-CD2 3.87Å; L671-Y785 HydrophobicContact CD1-CG 4.24Å
672	I	92.8	Very high	78.9	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	122.5	-179.9	-58.3	-62.7	0	0	0	108.1	F594 F603 C605 L710 Y785 M786 L788	F594-I672 HydrophobicContact CE2-CG2 3.92Å; F594-I672 HydrophobicContact CZ-CG2 4.28Å; F603-I672 HydrophobicContact CB-CG2 3.83Å; F603-I672 HydrophobicContact CD2-CD1 3.87Å; F603-I672 HydrophobicContact CD2-CG2 3.81Å; F603-I672 HydrophobicContact CE2-CD1 3.8Å; F603-I672 HydrophobicContact CG-CG2 3.97Å; C605-I672 HydrophobicContact CB-CD1 4.06Å; C605-I672 VanDerWaalsContact SG-CD1 3.57Å; I672-L710 HydrophobicContact CG2-CD2 4.06Å; I672-Y785 CarbonylContact O-C 3.56Å; I672-Y785 VanDerWaalsContact O-CA 3.28Å; I672-Y785 WeakPolarHBondContact O-CA 3.37Å; I672-M786 HydrophobicContact CB-CB 3.91Å; I672-M786 WeakPolarHBondContact CB-O 2.91Å; I672-M786 HydrophobicContact CG2-CB 4.15Å; I672-M786 PolarHBondContact N-O 2.94Å; I672-M786 PolarHBondContact O-N 3.02Å; I672-L788 HydrophobicContact CD1-CB 3.91Å; I672-L788 HydrophobicContact CD1-CD2 4.44Å; I672-L788 HydrophobicContact CG1-CB 3.82Å
673	L	91.6	Very high	78.3	Confident	9 Å²	9	49 Å²	49	5%	0.047	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	153.7	179.2	-62.6	178.7	0	0	0	110.3	L578 D582 F603 R604 L606 L671	L578-L673 HydrophobicContact CD1-CD2 4.46Å; L578-L673 HydrophobicContact CD2-CD2 4.4Å; D582-L673 HydrophobicContact CB-CD1 3.82Å; F603-L673 CarbonylContact C-O 3.55Å; F603-L673 VanDerWaalsContact CA-O 3.31Å; F603-L673 WeakPolarHBondContact CA-O 3.37Å; F603-L673 WeakPolarHBondContact CB-O 3.23Å; R604-L673 HydrophobicContact CG-CB 3.99Å; R604-L673 PolarHBondContact N-O 2.88Å; R604-L673 PolarHBondContact O-N 2.85Å; L606-L673 HydrophobicContact CD1-CB 4.5Å; L606-L673 HydrophobicContact CD1-CD1 3.79Å; L606-L673 HydrophobicContact CD1-CG 4.06Å; L671-L673 HydrophobicContact CD2-CD1 4.28Å; L671-L673 HydrophobicContact CD2-CD2 4.35Å; L671-L673 HydrophobicContact CD2-CG 4.31Å; L671-L673 HydrophobicContact CG-CD2 4.28Å; L671-L673 HydrophobicContact CG-CG 4.24Å
674	P	89.2	Confident	77.8	Confident	29 Å²	29	54 Å²	54	19%	0.188	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	140.1	177.1	25.3	-33.9	0	0	0	112	L710 D784	P674-L710 HydrophobicContact CB-CB 4.11Å; P674-L710 HydrophobicContact CB-CD2 4.37Å; P674-D784 WeakPolarHBondContact CD-O 3.49Å
675	D	84.8	Confident	77.2	Confident	3 Å²	3	54.2 Å²	54.2	2%	0.016	26%	0.263	C	S	.	.			trans	-96	90.9	167.9	-176.9	-7.9	0	0	0	109.2	Y602 E677 Q678 T679	Y602-D675 PolarHBondContact O-N 2.87Å; D675-E677 VanDerWaalsContact C-N 3.31Å; D675-E677 PolarHBondContact O-N 3.3Å; D675-E677 WeakPolarHBondContact OD1-CB 3.45Å; D675-E677 PolarHBondContact OD1-N 3.05Å; D675-Q678 PolarHBondContact OD1-N 3.04Å; D675-Q678 VanDerWaalsContact OD2-CG 3.3Å; D675-Q678 WeakPolarHBondContact OD2-CG 3.48Å; D675-Q678 PolarHBondContact OD2-NE2 3.16Å; D675-T679 WeakPolarHBondContact O-CB 3.34Å; D675-T679 PolarHBondContact O-N 2.96Å; D675-T679 VanDerWaalsContact O-N 3.15Å; D675-T679 PolarHBondContact O-OG1 3.33Å
676	T	77	Confident	76.1	Confident	92 Å²	92	53.6 Å²	53.6	56%	0.564	26%	0.26	S	S	*	.	H	α-helix	trans	-65.1	-32.9	179.1	43.8	0	0	0	0	112.4	N680	T676-N680 WeakPolarHBondContact O-CB 3.22Å; T676-N680 PolarHBondContact O-N 3.44Å; T676-N680 PolarHBondContact O-ND2 3.39Å
677	E	73.2	Confident	74.4	Confident	102 Å²	102	53.7 Å²	53.7	48%	0.477	27%	0.265	S	S	.	.	H	α-helix	trans	-63.5	-55	177.8	-74.5	-173.2	-129.9	0	0	111.6	D675 N680 K681	D675-E677 VanDerWaalsContact C-N 3.31Å; D675-E677 PolarHBondContact O-N 3.3Å; D675-E677 WeakPolarHBondContact OD1-CB 3.45Å; D675-E677 PolarHBondContact OD1-N 3.05Å; E677-N680 PolarHBondContact O-N 3.36Å; E677-K681 HydrophobicContact CB-CD 4.48Å; E677-K681 WeakPolarHBondContact O-CB 3.01Å; E677-K681 WeakPolarHBondContact O-CD 3.39Å; E677-K681 WeakPolarHBondContact O-CG 3.46Å; E677-K681 PolarHBondContact O-N 3.49Å; E677-K681 IonicContact OE2-NZ 3.45Å; E677-K681 PolarHBondContact OE2-NZ 3.36Å
678	Q	70.4	Confident	72.7	Confident	46 Å²	46	61 Å²	61	22%	0.215	30%	0.296	C	S	.	.	H	α-helix	trans	-68.2	-37.4	-177.5	-75.6	-166.7	87.1	0	0	111.9	Y602 D675 N680 K681 Y682	Y602-Q678 HydrophobicContact CD1-CB 3.71Å; Y602-Q678 HydrophobicContact CD1-CG 4.47Å; Y602-Q678 HydrophobicContact CE1-CB 4.29Å; Y602-Q678 HydrophobicContact CG-CB 4.03Å; D675-Q678 PolarHBondContact OD1-N 3.04Å; D675-Q678 VanDerWaalsContact OD2-CG 3.3Å; D675-Q678 WeakPolarHBondContact OD2-CG 3.48Å; D675-Q678 PolarHBondContact OD2-NE2 3.16Å; Q678-N680 PolarHBondContact O-N 3.27Å; Q678-K681 PolarHBondContact O-N 2.77Å; Q678-Y682 WeakPolarHBondContact O-CD2 3.48Å; Q678-Y682 PolarHBondContact O-N 3Å
679	T	69.3	Low	70.8	Confident	16 Å²	16	66.6 Å²	66.6	10%	0.098	33%	0.326	C	S	.	.	H	α-helix	trans	-55.8	-50.9	174.2	-54.6	0	0	0	0	110.5	D675 Y682 L683	D675-T679 WeakPolarHBondContact O-CB 3.34Å; D675-T679 PolarHBondContact O-N 2.96Å; D675-T679 VanDerWaalsContact O-N 3.15Å; D675-T679 PolarHBondContact O-OG1 3.33Å; T679-Y682 PolarHBondContact O-N 3.31Å; T679-L683 HydrophobicContact CG2-CD1 4.03Å; T679-L683 WeakPolarHBondContact O-CD1 3.45Å; T679-L683 PolarHBondContact O-N 3.42Å; T679-L683 VanDerWaalsContact O-N 3.16Å
680	N	68.7	Low	68.4	Low	88 Å²	88	72.5 Å²	72.5	47%	0.471	36%	0.358	S	S	.	.	H	α-helix	trans	-68.2	-37.3	179.7	-67.7	-9.4	0	0	0	112.8	T676 E677 Q678 Y682 L683 H684	T676-N680 WeakPolarHBondContact O-CB 3.22Å; T676-N680 PolarHBondContact O-N 3.44Å; T676-N680 PolarHBondContact O-ND2 3.39Å; E677-N680 PolarHBondContact O-N 3.36Å; Q678-N680 PolarHBondContact O-N 3.27Å; N680-Y682 VanDerWaalsContact C-N 3.27Å; N680-Y682 PolarHBondContact O-N 2.9Å; N680-L683 PolarHBondContact O-N 3.08Å; N680-H684 WeakPolarHBondContact O-CB 3.24Å; N680-H684 PolarHBondContact O-CD2 2.63Å; N680-H684 VanDerWaalsContact O-CD2 3.27Å; N680-H684 PolarHBondContact O-N 3.27Å
681	K	70.6	Confident	66.1	Low	124 Å²	124	79.2 Å²	79.2	54%	0.539	39%	0.393	S	S	.	.	H	α-helix	trans	-60.4	-34.8	175.9	-74.9	161.8	-177.6	171	0	112.2	E677 Q678 K685	E677-K681 HydrophobicContact CB-CD 4.48Å; E677-K681 WeakPolarHBondContact O-CB 3.01Å; E677-K681 WeakPolarHBondContact O-CD 3.39Å; E677-K681 WeakPolarHBondContact O-CG 3.46Å; E677-K681 PolarHBondContact O-N 3.49Å; E677-K681 IonicContact OE2-NZ 3.45Å; E677-K681 PolarHBondContact OE2-NZ 3.36Å; Q678-K681 PolarHBondContact O-N 2.77Å; K681-K685 PolarHBondContact O-N 2.9Å
682	Y	64	Low	63.9	Low	105 Å²	105	87.6 Å²	87.6	41%	0.412	43%	0.433	S	S	.	.	H	α-helix	trans	-76.1	-47.4	175	-88.5	-95.3	0	0	0	112.9	Y602 Q678 T679 N680 H684 K685 E686	Y602-Y682 HydrophobicContact CE1-CD2 4.42Å; Y602-Y682 HydrophobicContact CE1-CE2 4.1Å; Y602-Y682 HydrophobicContact CE2-CD2 4.14Å; Y602-Y682 HydrophobicContact CE2-CE2 4.44Å; Y602-Y682 HydrophobicContact CE2-CG 4.4Å; Y602-Y682 AromaticContact CZ-CD2 3.84Å; Y602-Y682 AromaticContact CZ-CE2 3.69Å; Y602-Y682 VanDerWaalsContact OH-CE2 3.24Å; Y602-Y682 WeakPolarHBondContact OH-CE2 3.28Å; Q678-Y682 WeakPolarHBondContact O-CD2 3.48Å; Q678-Y682 PolarHBondContact O-N 3Å; T679-Y682 PolarHBondContact O-N 3.31Å; N680-Y682 VanDerWaalsContact C-N 3.27Å; N680-Y682 PolarHBondContact O-N 2.9Å; Y682-H684 VanDerWaalsContact C-N 3.29Å; Y682-H684 PolarHBondContact O-N 3.26Å; Y682-K685 WeakPolarHBondContact O-CB 3.48Å; Y682-K685 PolarHBondContact O-N 3.08Å; Y682-E686 PolarHBondContact O-N 3.06Å
683	L	59.3	Low	61.2	Low	89 Å²	89	92 Å²	92	47%	0.466	46%	0.463	S	S	.	.	H	α-helix	trans	-57.4	-41.7	176.8	-88.2	87.1	0	0	0	112.2	T679 N680 K685 E686 S687	T679-L683 HydrophobicContact CG2-CD1 4.03Å; T679-L683 WeakPolarHBondContact O-CD1 3.45Å; T679-L683 PolarHBondContact O-N 3.42Å; T679-L683 VanDerWaalsContact O-N 3.16Å; N680-L683 PolarHBondContact O-N 3.08Å; L683-K685 VanDerWaalsContact C-N 3.26Å; L683-K685 PolarHBondContact O-N 2.86Å; L683-E686 PolarHBondContact O-N 3.16Å; L683-S687 PolarHBondContact O-N 2.86Å
684	H	56.8	Low	58.4	Low	125 Å²	125	98.9 Å²	98.9	58%	0.579	50%	0.5	S	S	*	.	H	α-helix	trans	-68.7	-21.4	176.6	-78	-54.2	0	0	0	114.3	N680 Y682 S687 K688	N680-H684 WeakPolarHBondContact O-CB 3.24Å; N680-H684 PolarHBondContact O-CD2 2.63Å; N680-H684 VanDerWaalsContact O-CD2 3.27Å; N680-H684 PolarHBondContact O-N 3.27Å; Y682-H684 VanDerWaalsContact C-N 3.29Å; Y682-H684 PolarHBondContact O-N 3.26Å; H684-S687 WeakPolarHBondContact CA-OG 3.3Å; H684-S687 PolarHBondContact O-OG 2.86Å; H684-S687 VanDerWaalsContact O-OG 3.06Å; H684-K688 PolarHBondContact O-N 2.78Å
685	K	56.5	Low	55.8	Low	143 Å²	143	103.7 Å²	103.7	62%	0.622	53%	0.529	S	S	*	.	H	α-helix	trans	-76	-40.2	175.6	-165.8	172.5	-177.6	177.9	0	110.9	K681 Y682 L683 K688 L689	K681-K685 PolarHBondContact O-N 2.9Å; Y682-K685 WeakPolarHBondContact O-CB 3.48Å; Y682-K685 PolarHBondContact O-N 3.08Å; L683-K685 VanDerWaalsContact C-N 3.26Å; L683-K685 PolarHBondContact O-N 2.86Å; K685-K688 PolarHBondContact O-N 2.88Å; K685-L689 PolarHBondContact O-N 2.89Å
686	E	50.2	Low	53.6	Low	95 Å²	95	112.4 Å²	112.4	44%	0.444	57%	0.57	S	S	.	*	H	α-helix	trans	-66.6	-41.9	173.5	-65.6	-178.1	156.1	0	0	111.6	Y682 L683 K688 L689 N690	Y682-E686 PolarHBondContact O-N 3.06Å; L683-E686 PolarHBondContact O-N 3.16Å; E686-K688 PolarHBondContact O-N 2.99Å; E686-K688 VanDerWaalsContact O-N 3.12Å; E686-L689 PolarHBondContact O-N 2.87Å; E686-L689 VanDerWaalsContact O-N 3.16Å; E686-N690 PolarHBondContact O-N 3.24Å
687	S	45.1	Very low	51.6	Low	58 Å²	58	116 Å²	116	41%	0.406	58%	0.584	S	S	.	*	H	α-helix	trans	-62.9	-20.2	177.4	75.4	0	0	0	0	114.1	L683 H684	L683-S687 PolarHBondContact O-N 2.86Å; H684-S687 WeakPolarHBondContact CA-OG 3.3Å; H684-S687 PolarHBondContact O-OG 2.86Å; H684-S687 VanDerWaalsContact O-OG 3.06Å
688	K	49.1	Very low	49.7	Very low	153 Å²	153	117.7 Å²	117.7	67%	0.665	60%	0.601	S	S	*	*	H	α-helix	trans	-87.1	-35.2	174.4	-76	-173.3	175.3	-172.8	0	113.2	H684 K685 E686	H684-K688 PolarHBondContact O-N 2.78Å; K685-K688 PolarHBondContact O-N 2.88Å; E686-K688 PolarHBondContact O-N 2.99Å; E686-K688 VanDerWaalsContact O-N 3.12Å
689	L	47.8	Very low	47.7	Very low	119 Å²	119	123.6 Å²	123.6	62%	0.623	63%	0.634	S	S	*	*	H	α-helix	trans	-64.6	-42	176.2	-104.6	72.8	0	0	0	112.1	K685 E686 N691 Q692 S693	K685-L689 PolarHBondContact O-N 2.89Å; E686-L689 PolarHBondContact O-N 2.87Å; E686-L689 VanDerWaalsContact O-N 3.16Å; L689-N691 PolarHBondContact O-N 2.64Å; L689-N691 VanDerWaalsContact O-N 3.13Å; L689-Q692 PolarHBondContact O-N 2.63Å; L689-S693 PolarHBondContact O-OG 2.94Å
690	N	38.9	Very low	45.9	Very low	127 Å²	127	128.3 Å²	128.3	68%	0.679	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-10.6	-175.5	-70.4	-7.6	0	0	0	114.6	E686	E686-N690 PolarHBondContact O-N 3.24Å
691	N	41.6	Very low	44.1	Very low	140 Å²	140	134.4 Å²	134.4	75%	0.749	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	6.4	-177.8	-74.3	-6.2	0	0	0	113.9	L689	L689-N691 PolarHBondContact O-N 2.64Å; L689-N691 VanDerWaalsContact O-N 3.13Å
692	Q	45.8	Very low	42.2	Very low	177 Å²	177	132.8 Å²	132.8	83%	0.827	69%	0.69	S	S	*	*	S	Bend	trans	-132.7	6.3	-175.5	-69.2	-168.5	-39.7	0	0	115.3	L689	L689-Q692 PolarHBondContact O-N 2.63Å
693	S	36.3	Very low	40.8	Very low	92 Å²	92	132.7 Å²	132.7	64%	0.643	70%	0.7	S	S	*	*			trans	-113.5	56.7	-173.2	47.2	0	0	0	0	114.1	L689	L689-S693 PolarHBondContact O-OG 2.94Å
694	N	32.3	Very low	40	Very low	153 Å²	153	134.6 Å²	134.6	82%	0.818	71%	0.709	S	S	*	*			trans	-81.9	151.5	152.4	-90.1	-24.8	0	0	0	109.5
695	T	34.6	Very low	39.8	Very low	130 Å²	130	131.6 Å²	131.6	80%	0.798	70%	0.697	S	S	*	*	S	Bend	trans	81	134.9	177	-10.5	0	0	0	0	117.2
696	E	37.6	Very low	40.4	Very low	187 Å²	187	128.5 Å²	128.5	87%	0.874	69%	0.688	S	S	*	*			trans	76.1	149.4	164.7	-50	-150.4	152.8	0	0	120.6
697	I	34.8	Very low	41.7	Very low	166 Å²	166	125.1 Å²	125.1	85%	0.851	67%	0.674	S	S	*	*			trans	-125.2	116.4	-161.2	-59.8	165.3	0	0	0	109.7
698	T	33.2	Very low	43.5	Very low	138 Å²	138	125.8 Å²	125.8	85%	0.847	67%	0.67	S	S	*	*			trans	-147.2	157.5	159.3	40.9	0	0	0	0	112.5	V700	T698-V700 PolarHBondContact O-N 2.97Å
699	N	29.3	Very low	45.3	Very low	170 Å²	170	121 Å²	121	91%	0.909	66%	0.656	S	S	*	*			trans	-78.1	111.3	-176.2	-74.8	-74.2	0	0	0	112.5
700	V	32.5	Very low	47.3	Very low	115 Å²	115	115.4 Å²	115.4	70%	0.697	63%	0.626	S	S	*	*			trans	-132.8	115.5	159	-174.3	0	0	0	0	110.2	T698 S702	T698-V700 PolarHBondContact O-N 2.97Å; V700-S702 VanDerWaalsContact C-N 3.26Å; V700-S702 PolarHBondContact O-N 3.27Å; V700-S702 VanDerWaalsContact O-N 3.13Å
701	K	28.9	Very low	49.8	Very low	217 Å²	217	113 Å²	113	94%	0.943	61%	0.611	S	S	*	*			trans	-83.3	67.9	168.9	-71.4	178.4	179.8	170	0	110
702	S	30.9	Very low	52.1	Low	90 Å²	90	108.3 Å²	108.3	63%	0.629	59%	0.591	S	S	*	*			trans	-71.7	128.8	171.8	38.2	0	0	0	0	109.9	V700 I704	V700-S702 VanDerWaalsContact C-N 3.26Å; V700-S702 PolarHBondContact O-N 3.27Å; V700-S702 VanDerWaalsContact O-N 3.13Å; S702-I704 PolarHBondContact O-N 2.95Å
703	T	36.3	Very low	54.2	Low	103 Å²	103	99.9 Å²	99.9	63%	0.632	55%	0.552	S	S	*	*			trans	-72.6	109.4	171.4	32	0	0	0	0	108.7	N705	T703-N705 PolarHBondContact O-N 3.09Å; T703-N705 VanDerWaalsContact O-N 3.15Å; T703-N705 PolarHBondContact O-ND2 3.22Å
704	I	40.9	Very low	56.9	Low	129 Å²	129	95.5 Å²	95.5	66%	0.662	52%	0.522	S	S	*	.			trans	-64.5	115	170.1	-49.1	178.3	0	0	0	106.9	S702 D706	S702-I704 PolarHBondContact O-N 2.95Å; I704-D706 VanDerWaalsContact CG2-OD1 3.32Å; I704-D706 WeakPolarHBondContact CG2-OD1 3.43Å
705	N	54.3	Low	59.6	Low	61 Å²	61	90.8 Å²	90.8	33%	0.326	50%	0.504	S	S	.	.			trans	-110	73.4	-178.1	-70.4	-44.7	0	0	0	108.9	N598 H600 T703 C707	N598-N705 WeakPolarHBondContact O-CA 3.41Å; N598-N705 WeakPolarHBondContact O-CB 3.33Å; H600-N705 VanDerWaalsContact CE1-CB 3.49Å; H600-N705 WeakPolarHBondContact CE1-CB 3.18Å; H600-N705 PolarHBondContact ND1-O 3.31Å; T703-N705 PolarHBondContact O-N 3.09Å; T703-N705 VanDerWaalsContact O-N 3.15Å; T703-N705 PolarHBondContact O-ND2 3.22Å; N705-C707 PolarHBondContact O-N 3.04Å
706	D	68.6	Low	62.3	Low	79 Å²	79	87.6 Å²	87.6	42%	0.422	48%	0.478	S	S	.	.			trans	-41.6	126.7	-177	-59.8	-19.5	0	0	0	113	H600 I704 F708	H600-D706 PolarHBondContact N-O 3.26Å; H600-D706 VanDerWaalsContact N-O 3.09Å; I704-D706 VanDerWaalsContact CG2-OD1 3.32Å; I704-D706 WeakPolarHBondContact CG2-OD1 3.43Å; D706-F708 HydrophobicContact CB-CD2 4.15Å; D706-F708 HydrophobicContact CB-CE2 3.27Å; D706-F708 HydrophobicContact CB-CZ 3.64Å; D706-F708 WeakPolarHBondContact O-CD2 3.3Å
707	C	77.6	Confident	64.8	Low	23 Å²	23	78.8 Å²	78.8	16%	0.155	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	133.4	174.5	-172.7	0	0	0	0	110.7	N705	N705-C707 PolarHBondContact O-N 3.04Å
708	F	83.4	Confident	67.5	Low	72 Å²	72	74.1 Å²	74.1	32%	0.316	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	153	-179.9	-64.5	-85.5	0	0	0	112.3	N599 H600 F601 D706 A712	N599-F708 HydrophobicContact CB-CD2 3.9Å; N599-F708 HydrophobicContact CB-CE2 3.97Å; N599-F708 WeakPolarHBondContact ND2-CE2 3.47Å; H600-F708 PolarHBondContact O-N 3.35Å; F601-F708 HydrophobicContact CD1-CB 3.74Å; F601-F708 HydrophobicContact CE1-CB 3.48Å; F601-F708 VanDerWaalsContact CE1-CB 3.48Å; F601-F708 HydrophobicContact CE1-CD2 4.41Å; F601-F708 HydrophobicContact CE1-CG 4.22Å; F601-F708 HydrophobicContact CZ-CB 4.27Å; F601-F708 HydrophobicContact CZ-CD2 4.41Å; D706-F708 HydrophobicContact CB-CD2 4.15Å; D706-F708 HydrophobicContact CB-CE2 3.27Å; D706-F708 HydrophobicContact CB-CZ 3.64Å; D706-F708 WeakPolarHBondContact O-CD2 3.3Å; F708-A712 HydrophobicContact CB-CB 4.34Å
709	S	86.8	Confident	70.1	Confident	53 Å²	53	73.5 Å²	73.5	37%	0.371	40%	0.401	S	S	.	.			trans	-67.6	148.7	171.4	65	0	0	0	0	111.8	F601 H711 A712	F601-S709 WeakPolarHBondContact CD1-O 3.12Å; S709-H711 PolarHBondContact O-N 3.09Å; S709-H711 VanDerWaalsContact O-N 3.12Å; S709-A712 WeakPolarHBondContact O-CB 3.46Å; S709-A712 PolarHBondContact O-N 2.95Å
710	L	89.1	Confident	72.9	Confident	1 Å²	1	70 Å²	70	1%	0.005	38%	0.377	C	S	.	.	H	α-helix	trans	-56.1	-32.1	-179.6	-168.9	68	0	0	0	112.7	F594 F601 F603 I672 P674 A712 L713 I714 M786	F594-L710 HydrophobicContact CD2-CD1 4.07Å; F594-L710 HydrophobicContact CE2-CD1 4.17Å; F601-L710 HydrophobicContact CB-CD1 4.41Å; F603-L710 HydrophobicContact CB-CD1 4.41Å; F603-L710 HydrophobicContact CB-CD2 4.45Å; I672-L710 HydrophobicContact CG2-CD2 4.06Å; P674-L710 HydrophobicContact CB-CB 4.11Å; P674-L710 HydrophobicContact CB-CD2 4.37Å; L710-A712 PolarHBondContact O-N 3.39Å; L710-L713 HydrophobicContact CD1-CD2 4.16Å; L710-L713 WeakPolarHBondContact O-CB 3.16Å; L710-L713 PolarHBondContact O-N 3.33Å; L710-I714 HydrophobicContact CD2-CD1 4.32Å; L710-I714 HydrophobicContact CG-CD1 4.05Å; L710-I714 HydrophobicContact CG-CG1 4.48Å; L710-I714 WeakPolarHBondContact O-CG1 3.35Å; L710-I714 PolarHBondContact O-N 2.97Å; L710-M786 HydrophobicContact CD1-SD 3.83Å; L710-M786 HydrophobicContact CD2-CG 4.4Å; L710-M786 HydrophobicContact CG-SD 4.15Å
711	H	90.3	Very high	75.6	Confident	77 Å²	77	71.9 Å²	71.9	36%	0.356	38%	0.379	S	S	.	.	H	α-helix	trans	-54	-34.2	174.8	-51.7	-72.1	0	0	0	113.1	S709 I714 A715 S783 D784	S709-H711 PolarHBondContact O-N 3.09Å; S709-H711 VanDerWaalsContact O-N 3.12Å; H711-I714 PolarHBondContact O-N 3.09Å; H711-A715 WeakPolarHBondContact O-CB 3.35Å; H711-A715 PolarHBondContact O-N 2.91Å; H711-S783 PolarHBondContact ND1-O 3.19Å; H711-D784 IonicContact CE1-OD1 2.7Å; H711-D784 PolarHBondContact CE1-OD1 2.85Å; H711-D784 VanDerWaalsContact CE1-OD1 3.29Å; H711-D784 IonicContact ND1-OD1 2.66Å
712	A	90	Very high	78.4	Confident	41 Å²	41	61.8 Å²	61.8	34%	0.339	34%	0.336	S	S	.	.	H	α-helix	trans	-70.2	-36	177.3	0	0	0	0	0	112.5	F601 F708 S709 L710 Y716	F601-A712 HydrophobicContact CE1-CB 4.19Å; F708-A712 HydrophobicContact CB-CB 4.34Å; S709-A712 WeakPolarHBondContact O-CB 3.46Å; S709-A712 PolarHBondContact O-N 2.95Å; L710-A712 PolarHBondContact O-N 3.39Å; A712-Y716 VanDerWaalsContact O-CB 3.31Å; A712-Y716 WeakPolarHBondContact O-CB 3.33Å; A712-Y716 PolarHBondContact O-N 3.08Å
713	L	90.9	Very high	81.2	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-67.7	-41.6	172.1	179	60.9	0	0	0	111.2	F594 L596 F601 I638 L710 Y716 L717 L757 M786	F594-L713 HydrophobicContact CB-CD2 4.11Å; F594-L713 HydrophobicContact CD2-CD2 3.75Å; F594-L713 HydrophobicContact CE2-CD2 4.49Å; F594-L713 HydrophobicContact CG-CD2 4.09Å; L596-L713 HydrophobicContact CD2-CD1 3.94Å; F601-L713 HydrophobicContact CB-CD2 4.45Å; F601-L713 HydrophobicContact CD1-CB 3.68Å; F601-L713 HydrophobicContact CD2-CB 4.43Å; F601-L713 HydrophobicContact CD2-CD2 4.3Å; F601-L713 HydrophobicContact CE1-CB 3.76Å; F601-L713 HydrophobicContact CE2-CD1 4.48Å; F601-L713 HydrophobicContact CG-CB 4.03Å; F601-L713 HydrophobicContact CG-CD2 4.24Å; F601-L713 HydrophobicContact CZ-CB 4.21Å; I638-L713 HydrophobicContact CD1-CD1 3.86Å; I638-L713 HydrophobicContact CD1-CD2 3.93Å; L710-L713 HydrophobicContact CD1-CD2 4.16Å; L710-L713 WeakPolarHBondContact O-CB 3.16Å; L710-L713 PolarHBondContact O-N 3.33Å; L713-Y716 HydrophobicContact CD1-CD1 4.45Å; L713-Y716 PolarHBondContact O-N 3.45Å; L713-L717 HydrophobicContact CD1-CD1 4.19Å; L713-L717 HydrophobicContact CD1-CG 4.35Å; L713-L717 HydrophobicContact CG-CD1 4.26Å; L713-L717 WeakPolarHBondContact O-CG 3.39Å; L713-L717 PolarHBondContact O-N 3.16Å; L713-L757 HydrophobicContact CD2-CD2 4.16Å; L713-M786 HydrophobicContact CD2-CE 4.49Å; L713-M786 HydrophobicContact CD2-SD 4.11Å; L713-M786 HydrophobicContact CG-CE 4.38Å; L713-M786 HydrophobicContact CG-SD 4.34Å
714	I	92.2	Very high	83.8	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.7	-51.5	176.3	-70.1	167.1	0	0	0	110.8	L710 H711 Y716 L717 K718 A759 P760 S783 Y785 M786	L710-I714 HydrophobicContact CD2-CD1 4.32Å; L710-I714 HydrophobicContact CG-CD1 4.05Å; L710-I714 HydrophobicContact CG-CG1 4.48Å; L710-I714 WeakPolarHBondContact O-CG1 3.35Å; L710-I714 PolarHBondContact O-N 2.97Å; H711-I714 PolarHBondContact O-N 3.09Å; I714-Y716 VanDerWaalsContact C-N 3.32Å; I714-Y716 PolarHBondContact O-N 2.86Å; I714-L717 PolarHBondContact O-N 2.91Å; I714-K718 HydrophobicContact CG2-CD 3.69Å; I714-K718 WeakPolarHBondContact O-CG 3.3Å; I714-K718 PolarHBondContact O-N 3.38Å; I714-A759 HydrophobicContact CG2-CB 4.39Å; I714-P760 HydrophobicContact CG2-CG 4.48Å; I714-S783 WeakPolarHBondContact CD1-O 2.97Å; I714-Y785 WeakPolarHBondContact CD1-O 3.29Å; I714-M786 HydrophobicContact CD1-CG 3.66Å; I714-M786 HydrophobicContact CD1-SD 4.27Å; I714-M786 HydrophobicContact CG1-CE 4.19Å; I714-M786 HydrophobicContact CG1-CG 3.43Å; I714-M786 VanDerWaalsContact CG1-CG 3.43Å; I714-M786 HydrophobicContact CG1-SD 3.6Å; I714-M786 VanDerWaalsContact CG1-SD 3.6Å
715	A	90.3	Very high	86.1	Confident	53 Å²	53	47.7 Å²	47.7	44%	0.438	25%	0.25	S	S	.	.	H	α-helix	trans	-58.9	-42.7	176.7	0	0	0	0	0	111.8	H711 L717 L719	H711-A715 WeakPolarHBondContact O-CB 3.35Å; H711-A715 PolarHBondContact O-N 2.91Å; A715-L717 PolarHBondContact O-N 2.86Å; A715-L719 WeakPolarHBondContact O-CB 3.23Å; A715-L719 PolarHBondContact O-N 3.12Å
716	Y	91.4	Very high	87.6	Confident	64 Å²	64	45 Å²	45	25%	0.251	24%	0.236	S	C	.	.	H	α-helix	trans	-61.1	-42.6	176.5	168.6	-99.5	0	0	0	113.1	L596 R641 A712 L713 I714 K720	L596-Y716 HydrophobicContact CD1-CE1 4.46Å; L596-Y716 HydrophobicContact CD2-CD1 3.75Å; L596-Y716 HydrophobicContact CD2-CE1 3.53Å; L596-Y716 HydrophobicContact CD2-CG 4.48Å; R641-Y716 PolarHBondContact NH1-OH 2.93Å; R641-Y716 VanDerWaalsContact NH1-OH 3.08Å; A712-Y716 VanDerWaalsContact O-CB 3.31Å; A712-Y716 WeakPolarHBondContact O-CB 3.33Å; A712-Y716 PolarHBondContact O-N 3.08Å; L713-Y716 HydrophobicContact CD1-CD1 4.45Å; L713-Y716 PolarHBondContact O-N 3.45Å; I714-Y716 VanDerWaalsContact C-N 3.32Å; I714-Y716 PolarHBondContact O-N 2.86Å; Y716-K720 HydrophobicContact CD2-CG 4.37Å; Y716-K720 HydrophobicContact CE2-CG 4.13Å; Y716-K720 WeakPolarHBondContact O-CB 3.46Å; Y716-K720 WeakPolarHBondContact O-CG 3.49Å; Y716-K720 PolarHBondContact O-N 2.93Å
717	L	90.3	Very high	87.8	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-74.1	-39	-179.9	-68.6	173.2	0	0	0	112.3	L713 I714 A715 K720 Q721 S722 A759 M786	L713-L717 HydrophobicContact CD1-CD1 4.19Å; L713-L717 HydrophobicContact CD1-CG 4.35Å; L713-L717 HydrophobicContact CG-CD1 4.26Å; L713-L717 WeakPolarHBondContact O-CG 3.39Å; L713-L717 PolarHBondContact O-N 3.16Å; I714-L717 PolarHBondContact O-N 2.91Å; A715-L717 PolarHBondContact O-N 2.86Å; L717-K720 CarbonylContact O-C 3.58Å; L717-K720 PolarHBondContact O-N 2.83Å; L717-K720 VanDerWaalsContact O-N 3.16Å; L717-Q721 PolarHBondContact O-N 3.09Å; L717-S722 WeakPolarHBondContact CD2-O 3.37Å; L717-S722 PolarHBondContact O-N 3.32Å; L717-A759 HydrophobicContact CB-CB 4.08Å; L717-M786 HydrophobicContact CD1-CE 3.48Å; L717-M786 VanDerWaalsContact CD1-CE 3.48Å
718	K	90.2	Very high	87.3	Confident	67 Å²	67	43.7 Å²	43.7	29%	0.291	23%	0.232	S	C	.	.	H	α-helix	trans	-59.7	-49.4	171.4	-69.3	168.2	86	174.6	0	110.6	I714 K720 Q721 A759 T781 T782 S783	I714-K718 HydrophobicContact CG2-CD 3.69Å; I714-K718 WeakPolarHBondContact O-CG 3.3Å; I714-K718 PolarHBondContact O-N 3.38Å; K718-K720 PolarHBondContact O-N 3.34Å; K718-Q721 PolarHBondContact O-N 2.97Å; K718-Q721 VanDerWaalsContact O-N 3.1Å; K718-A759 HydrophobicContact CD-CB 4.33Å; K718-A759 HydrophobicContact CG-CB 3.76Å; K718-T781 PolarHBondContact NZ-O 2.88Å; K718-T782 PolarHBondContact NZ-O 2.78Å; K718-S783 PolarHBondContact NZ-OG 3.32Å
719	L	89.1	Confident	86	Confident	126 Å²	126	47.7 Å²	47.7	66%	0.66	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-9.4	175.8	-177.8	59.3	0	0	0	114.5	A715	A715-L719 WeakPolarHBondContact O-CB 3.23Å; A715-L719 PolarHBondContact O-N 3.12Å
720	K	87.8	Confident	84.3	Confident	96 Å²	96	51.7 Å²	51.7	42%	0.417	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115	0.4	177.2	-67.4	-72.9	150.6	-89.6	0	113.2	Y716 L717 K718 S722	Y716-K720 HydrophobicContact CD2-CG 4.37Å; Y716-K720 HydrophobicContact CE2-CG 4.13Å; Y716-K720 WeakPolarHBondContact O-CB 3.46Å; Y716-K720 WeakPolarHBondContact O-CG 3.49Å; Y716-K720 PolarHBondContact O-N 2.93Å; L717-K720 CarbonylContact O-C 3.58Å; L717-K720 PolarHBondContact O-N 2.83Å; L717-K720 VanDerWaalsContact O-N 3.16Å; K718-K720 PolarHBondContact O-N 3.34Å; K720-S722 WeakPolarHBondContact CB-OG 3.17Å; K720-S722 WeakPolarHBondContact O-CB 3.41Å; K720-S722 PolarHBondContact O-N 3.04Å
721	Q	87.6	Confident	81.9	Confident	154 Å²	154	58.4 Å²	58.4	72%	0.72	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.4	49.2	-176.5	-67.5	177.9	-37.8	0	0	111	L644 L717 K718	L644-Q721 WeakPolarHBondContact CB-O 3.3Å; L644-Q721 PolarHBondContact N-O 3.39Å; L717-Q721 PolarHBondContact O-N 3.09Å; K718-Q721 PolarHBondContact O-N 2.97Å; K718-Q721 VanDerWaalsContact O-N 3.1Å
722	S	88.9	Confident	79.3	Confident	6 Å²	6	64.1 Å²	64.1	4%	0.042	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	136.4	-169.5	68.5	0	0	0	0	112.7	G642 L717 K720	G642-S722 CarbonylContact O-C 3.6Å; G642-S722 WeakPolarHBondContact O-CA 3.4Å; G642-S722 WeakPolarHBondContact O-CB 3.47Å; L717-S722 WeakPolarHBondContact CD2-O 3.37Å; L717-S722 PolarHBondContact O-N 3.32Å; K720-S722 WeakPolarHBondContact CB-OG 3.17Å; K720-S722 WeakPolarHBondContact O-CB 3.41Å; K720-S722 PolarHBondContact O-N 3.04Å
723	A	90.3	Very high	76.7	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	142.7	164.6	0	0	0	0	0	110.4	R641 G642 L644 L757 F758	R641-A723 CarbonylContact C-O 3.27Å; R641-A723 VanDerWaalsContact CA-O 3.25Å; R641-A723 WeakPolarHBondContact CA-O 3.34Å; G642-A723 PolarHBondContact N-O 3.12Å; G642-A723 PolarHBondContact O-N 3.16Å; L644-A723 HydrophobicContact CD2-CB 4.1Å; A723-L757 WeakPolarHBondContact CA-O 3.3Å; A723-F758 HydrophobicContact CB-CD1 3.81Å; A723-F758 HydrophobicContact CB-CE1 3.74Å
724	G	90.5	Very high	73.8	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	139.7	161.8	0	0	0	0	0	109.6	Y756 L757	G724-Y756 WeakPolarHBondContact O-CA 3.48Å; G724-L757 PolarHBondContact N-O 3.23Å; G724-L757 PolarHBondContact O-N 3.22Å
725	I	88.5	Confident	71.1	Confident	26 Å²	26	85.5 Å²	85.5	13%	0.133	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	118	172.4	-59.4	174.6	0	0	0	107.9	S639 R640 Y756	S639-I725 PolarHBondContact N-O 3.21Å; R640-I725 HydrophobicContact CB-CB 3.99Å; R640-I725 HydrophobicContact CB-CD1 4.47Å; R640-I725 HydrophobicContact CB-CG2 4.4Å; R640-I725 PolarHBondContact N-O 2.86Å; R640-I725 PolarHBondContact O-N 3.38Å; I725-Y756 HydrophobicContact CD1-CD1 4.5Å; I725-Y756 HydrophobicContact CD1-CE1 4.13Å; I725-Y756 HydrophobicContact CG1-CD1 3.96Å; I725-Y756 HydrophobicContact CG1-CE1 4.05Å
726	I	87.1	Confident	68.3	Low	4 Å²	4	92.3 Å²	92.3	2%	0.021	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	112.8	174.3	-65.5	148.5	0	0	0	105.9	F594 L636 I638 V755 L757 L788	F594-I726 HydrophobicContact CD1-CD1 4.04Å; F594-I726 HydrophobicContact CE1-CD1 3.74Å; L636-I726 HydrophobicContact CB-CD1 4.09Å; L636-I726 HydrophobicContact CB-CG2 4.34Å; L636-I726 HydrophobicContact CD1-CD1 4.26Å; L636-I726 HydrophobicContact CD2-CG2 4.44Å; I638-I726 HydrophobicContact CB-CG1 4.49Å; I638-I726 HydrophobicContact CG1-CD1 4.27Å; I638-I726 HydrophobicContact CG1-CG1 3.96Å; I726-V755 HydrophobicContact CB-CB 4.07Å; I726-V755 HydrophobicContact CB-CG1 4.36Å; I726-V755 HydrophobicContact CD1-CG1 4.31Å; I726-V755 HydrophobicContact CG2-CB 4.46Å; I726-V755 PolarHBondContact N-O 3.43Å; I726-V755 PolarHBondContact O-N 3.1Å; I726-L757 HydrophobicContact CD1-CB 4.36Å; I726-L788 HydrophobicContact CD1-CD1 4.06Å
727	C	72.3	Confident	65.5	Low	45 Å²	45	93.5 Å²	93.5	30%	0.304	45%	0.454	S	S	.	.			trans	-101.9	112.6	169	-60	0	0	0	0	106.3
728	P	66.4	Low	62.8	Low	29 Å²	29	101 Å²	101	19%	0.188	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-55.8	145.9	164.6	-18.5	31.6	0	0	0	109.5	Y621 L753	Y621-P728 HydrophobicContact CD1-CB 3.72Å; Y621-P728 HydrophobicContact CD2-CB 3.82Å; Y621-P728 HydrophobicContact CD2-CG 4.31Å; Y621-P728 HydrophobicContact CE1-CB 3.42Å; Y621-P728 VanDerWaalsContact CE1-CB 3.42Å; Y621-P728 HydrophobicContact CE2-CB 3.54Å; Y621-P728 HydrophobicContact CE2-CG 4.04Å; Y621-P728 HydrophobicContact CG-CB 3.92Å; P728-L753 WeakPolarHBondContact CD-O 3.44Å; P728-L753 HydrophobicContact CG-CB 4.47Å
729	K	57.2	Low	60.2	Low	156 Å²	156	104 Å²	104	68%	0.678	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-90.3	122.7	176.5	-78.6	-175.6	175.3	-178.3	0	109.6	Y621 E731	Y621-K729 WeakPolarHBondContact CE1-O 3.43Å; K729-E731 PolarHBondContact O-N 2.98Å
730	E	50.7	Low	57.4	Low	138 Å²	138	104.2 Å²	104.2	65%	0.645	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-67.7	117.2	160.4	-68	161.3	-171.9	0	0	108.6	K732	E730-K732 PolarHBondContact O-N 3.35Å
731	E	39	Very low	54.8	Low	142 Å²	142	107 Å²	107	66%	0.664	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-72.5	118.6	165.2	-79.3	-175.8	150	0	0	108.8	N624 K729 I733	N624-E731 PolarHBondContact ND2-OE1 3.42Å; N624-E731 PolarHBondContact ND2-OE2 2.7Å; K729-E731 PolarHBondContact O-N 2.98Å; E731-I733 PolarHBondContact O-N 3.06Å
732	K	34.4	Very low	52	Low	196 Å²	196	104.4 Å²	104.4	85%	0.852	53%	0.532	S	S	*	.			trans	-80.9	94.3	166.4	-72.1	-167.5	175.2	-167.1	0	108.7	E730 Q734	E730-K732 PolarHBondContact O-N 3.35Å; K732-Q734 PolarHBondContact O-N 3.45Å
733	I	36.7	Very low	49.2	Very low	139 Å²	139	111.4 Å²	111.4	71%	0.713	56%	0.564	S	S	*	*			trans	-61.5	120.5	168.1	-56.3	177.2	0	0	0	107.9	E731 Q735	E731-I733 PolarHBondContact O-N 3.06Å; I733-Q735 HydrophobicContact CG2-CG 3.97Å
734	Q	29.5	Very low	46.3	Very low	181 Å²	181	120.9 Å²	120.9	85%	0.846	61%	0.606	S	S	*	*			trans	-89.1	113.7	165.1	-69.8	178	-38.8	0	0	107	K732	K732-Q734 PolarHBondContact O-N 3.45Å
735	Q	35.7	Very low	43.2	Very low	171 Å²	171	127.2 Å²	127.2	80%	0.799	64%	0.644	S	S	*	*			trans	-92.5	107	173.9	-73.7	-176.8	-78	0	0	109.8	I733	I733-Q735 HydrophobicContact CG2-CG 3.97Å
736	E	30.3	Very low	40.4	Very low	196 Å²	196	132.1 Å²	132.1	92%	0.916	68%	0.676	S	S	*	*			trans	-104.9	91.9	166.3	-69.4	-171.2	139.3	0	0	109.6
737	S	33.6	Very low	37.6	Very low	90 Å²	90	138.3 Å²	138.3	63%	0.629	71%	0.714	S	S	*	*			trans	-165.9	114.3	167.8	54.8	0	0	0	0	106.8
738	L	33.4	Very low	35.8	Very low	158 Å²	158	141.7 Å²	141.7	83%	0.827	73%	0.733	S	S	*	*				51.1	104.4	62.9	-67.8	175.4	0	0	0	113.4
739	D	34.4	Very low	34.4	Very low	130 Å²	130	149 Å²	149	70%	0.695	77%	0.765	S	S	*	*			trans	63.6	102.9	143	-61	-2.6	0	0	0	121.4
740	N	31.7	Very low	34.2	Very low	131 Å²	131	148.1 Å²	148.1	70%	0.701	76%	0.757	S	S	*	*				74.6	117.7	127.9	-61.1	-43.8	0	0	0	121.2
741	N	31.9	Very low	34.3	Very low	155 Å²	155	143.3 Å²	143.3	83%	0.829	74%	0.739	S	S	*	*			trans	83.5	133.5	146.7	-59.5	-31.5	0	0	0	120.6
742	S	30.4	Very low	35.7	Very low	100 Å²	100	138.6 Å²	138.6	70%	0.699	72%	0.721	S	S	*	*			trans	80.5	143.4	165	-145.8	0	0	0	0	119.9
743	E	29.3	Very low	37.7	Very low	152 Å²	152	130 Å²	130	71%	0.71	69%	0.685	S	S	*	*			trans	57	94.2	152.6	-76	154.3	154.1	0	0	122.2
744	K	28.4	Very low	39.9	Very low	200 Å²	200	125 Å²	125	87%	0.87	66%	0.659	S	S	*	*				49.5	73.5	127.1	-61.9	174.4	-179.3	166.9	0	117.2
745	T	27.1	Very low	42.6	Very low	132 Å²	132	116.4 Å²	116.4	81%	0.81	62%	0.619	S	S	*	*			trans	-99.2	115.4	166	46.2	0	0	0	0	111.7	T747	T745-T747 PolarHBondContact O-N 3.01Å
746	T	28.3	Very low	45.2	Very low	130 Å²	130	110.6 Å²	110.6	80%	0.798	59%	0.59	S	S	*	*			trans	-79.9	113.5	177.2	39.6	0	0	0	0	111.2	T748	T746-T748 PolarHBondContact O-N 2.93Å
747	T	28.9	Very low	48.2	Very low	133 Å²	133	101.2 Å²	101.2	82%	0.816	55%	0.546	S	S	*	.			trans	-77.9	85.7	-176.4	-40.9	0	0	0	0	112.3	T745 Q749	T745-T747 PolarHBondContact O-N 3.01Å; T747-Q749 PolarHBondContact O-N 3.41Å
748	T	35.4	Very low	51	Low	116 Å²	116	97 Å²	97	71%	0.712	52%	0.517	S	S	*	.			trans	-69	100.4	179.9	-51.9	0	0	0	0	112.3	T746 R750	T746-T748 PolarHBondContact O-N 2.93Å; T748-R750 PolarHBondContact O-N 3.04Å
749	Q	36.2	Very low	53.8	Low	182 Å²	182	89.9 Å²	89.9	85%	0.85	48%	0.481	S	S	*	.			trans	-67.1	95.4	168.5	-76.1	-172.4	-16.8	0	0	111	T747 S751	T747-Q749 PolarHBondContact O-N 3.41Å; Q749-S751 PolarHBondContact O-N 2.93Å
750	R	52.1	Low	56.5	Low	139 Å²	139	83.9 Å²	83.9	53%	0.525	45%	0.449	S	S	.	.			trans	-72.8	107.9	166.4	-84	-174.6	165	172.6	-2.6	110	D620 T748	D620-R750 IonicContact OD2-CZ 2.93Å; D620-R750 IonicContact OD2-NH2 3.05Å; D620-R750 PolarHBondContact OD2-NH2 3.3Å; T748-R750 PolarHBondContact O-N 3.04Å
751	S	53.8	Low	59.2	Low	36 Å²	36	78.9 Å²	78.9	25%	0.252	42%	0.424	S	S	.	.			trans	-65.7	135.7	178.4	49.3	0	0	0	0	112.5	Q749 L753 R792	Q749-S751 PolarHBondContact O-N 2.93Å; S751-L753 PolarHBondContact O-N 3.38Å; S751-L753 VanDerWaalsContact O-N 3.16Å; S751-R792 PolarHBondContact OG-NE 2.96Å; S751-R792 PolarHBondContact OG-NH2 3.23Å
752	S	67.9	Low	61.8	Low	43 Å²	43	75.8 Å²	75.8	30%	0.301	41%	0.414	S	S	.	.			trans	-66.2	113.4	-175.8	69.9	0	0	0	0	112.2	R793	S752-R793 WeakPolarHBondContact O-CB 3.3Å; S752-R793 PolarHBondContact O-N 3.41Å; S752-R793 WeakPolarHBondContact OG-CD 3.22Å
753	L	77.2	Confident	64.5	Low	15 Å²	15	71.5 Å²	71.5	8%	0.079	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	137.6	179.1	-167.3	76.5	0	0	0	111.2	I614 L618 P728 S751 V755 A790 L791 R792	I614-L753 HydrophobicContact CG2-CD1 3.76Å; I614-L753 HydrophobicContact CG2-CD2 4.4Å; L618-L753 HydrophobicContact CD1-CD2 3.82Å; L618-L753 HydrophobicContact CD2-CD2 3.97Å; L618-L753 HydrophobicContact CG-CD2 3.55Å; P728-L753 WeakPolarHBondContact CD-O 3.44Å; P728-L753 HydrophobicContact CG-CB 4.47Å; S751-L753 PolarHBondContact O-N 3.38Å; S751-L753 VanDerWaalsContact O-N 3.16Å; L753-V755 HydrophobicContact CD2-CG2 3.79Å; L753-V755 HydrophobicContact CG-CG2 4.09Å; L753-A790 HydrophobicContact CD1-CB 4.38Å; L753-A790 HydrophobicContact CD2-CB 4.34Å; L753-L791 WeakPolarHBondContact CD1-O 3.4Å; L753-R792 HydrophobicContact CD1-CB 4.42Å
754	I	81.4	Confident	67.4	Low	35 Å²	35	64.3 Å²	64.3	18%	0.179	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.2	170.9	-60.6	-178	0	0	0	109.3	Y756 L791 R793	I754-Y756 HydrophobicContact CB-CE2 4.5Å; I754-Y756 HydrophobicContact CG2-CD2 4.16Å; I754-Y756 HydrophobicContact CG2-CE1 4.48Å; I754-Y756 HydrophobicContact CG2-CE2 3.49Å; I754-Y756 VanDerWaalsContact CG2-CE2 3.49Å; I754-L791 PolarHBondContact N-O 3.36Å; I754-L791 PolarHBondContact O-N 3.04Å; I754-R793 HydrophobicContact CD1-CG 4.31Å
755	V	87.8	Confident	70.2	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.2	-178.9	-176.5	0	0	0	0	111.1	L618 I726 L753 L788 L789 A790	L618-V755 HydrophobicContact CD1-CG2 3.92Å; L618-V755 HydrophobicContact CD2-CG2 3.87Å; L618-V755 HydrophobicContact CG-CG2 4.37Å; I726-V755 HydrophobicContact CB-CB 4.07Å; I726-V755 HydrophobicContact CB-CG1 4.36Å; I726-V755 HydrophobicContact CD1-CG1 4.31Å; I726-V755 HydrophobicContact CG2-CB 4.46Å; I726-V755 PolarHBondContact N-O 3.43Å; I726-V755 PolarHBondContact O-N 3.1Å; L753-V755 HydrophobicContact CD2-CG2 3.79Å; L753-V755 HydrophobicContact CG-CG2 4.09Å; V755-L788 HydrophobicContact CG1-CD1 3.49Å; V755-L788 VanDerWaalsContact CG1-CD1 3.49Å; V755-L788 HydrophobicContact CG1-CD2 4.03Å; V755-L788 HydrophobicContact CG1-CG 3.61Å; V755-L789 WeakPolarHBondContact CA-O 3.4Å; V755-A790 HydrophobicContact CG2-CB 3.98Å
756	Y	89.9	Confident	73	Confident	49 Å²	49	51.8 Å²	51.8	19%	0.192	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	142.1	173.9	-61.4	-86.2	0	0	0	110.3	W648 G724 I725 I754 F758 L788 L789 L791	W648-Y756 HydrophobicContact CH2-CD1 4.45Å; W648-Y756 HydrophobicContact CZ2-CD1 4.29Å; W648-Y756 AromaticContact CZ2-CE1 3.94Å; W648-Y756 HydrophobicContact CZ2-CE1 3.94Å; G724-Y756 WeakPolarHBondContact O-CA 3.48Å; I725-Y756 HydrophobicContact CD1-CD1 4.5Å; I725-Y756 HydrophobicContact CD1-CE1 4.13Å; I725-Y756 HydrophobicContact CG1-CD1 3.96Å; I725-Y756 HydrophobicContact CG1-CE1 4.05Å; I754-Y756 HydrophobicContact CB-CE2 4.5Å; I754-Y756 HydrophobicContact CG2-CD2 4.16Å; I754-Y756 HydrophobicContact CG2-CE1 4.48Å; I754-Y756 HydrophobicContact CG2-CE2 3.49Å; I754-Y756 VanDerWaalsContact CG2-CE2 3.49Å; Y756-F758 HydrophobicContact CG-CZ 4.19Å; Y756-L788 WeakPolarHBondContact O-CA 3.44Å; Y756-L789 PolarHBondContact N-O 3.45Å; Y756-L789 PolarHBondContact O-N 2.91Å; Y756-L791 HydrophobicContact CE2-CD1 4.22Å
757	L	92.9	Very high	75.7	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	110.6	177.5	178.2	64.7	0	0	0	109.2	F594 I638 L713 A723 G724 I726 M786 L788	F594-L757 HydrophobicContact CD1-CD2 4.07Å; F594-L757 HydrophobicContact CD2-CD2 4.35Å; F594-L757 HydrophobicContact CE1-CD1 4.33Å; F594-L757 HydrophobicContact CE1-CD2 3.78Å; F594-L757 HydrophobicContact CE2-CD1 4.27Å; F594-L757 HydrophobicContact CE2-CD2 4.07Å; F594-L757 HydrophobicContact CG-CD2 4.36Å; F594-L757 HydrophobicContact CZ-CD1 3.75Å; F594-L757 HydrophobicContact CZ-CD2 3.79Å; F594-L757 HydrophobicContact CZ-CG 4.41Å; I638-L757 HydrophobicContact CD1-CD2 3.72Å; I638-L757 HydrophobicContact CG1-CD2 4.37Å; L713-L757 HydrophobicContact CD2-CD2 4.16Å; A723-L757 WeakPolarHBondContact CA-O 3.3Å; G724-L757 PolarHBondContact N-O 3.23Å; G724-L757 PolarHBondContact O-N 3.22Å; I726-L757 HydrophobicContact CD1-CB 4.36Å; L757-M786 HydrophobicContact CD1-CB 3.92Å; L757-M786 HydrophobicContact CD1-CE 3.78Å; L757-M786 HydrophobicContact CD1-SD 4.09Å; L757-M786 HydrophobicContact CD2-CE 3.82Å; L757-M786 HydrophobicContact CD2-SD 4.34Å; L757-M786 HydrophobicContact CG-CE 3.55Å; L757-M786 HydrophobicContact CG-SD 4.37Å; L757-L788 HydrophobicContact CB-CD1 4.17Å; L757-L788 HydrophobicContact CD1-CD1 3.89Å
758	F	91.9	Very high	78.4	Confident	1 Å²	1	39.4 Å²	39.4	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	135.8	-178.2	-57	-79.3	0	0	0	111.2	L644 W648 A723 Y756 F763 A764 M786 I787 L789	L644-F758 HydrophobicContact CD2-CD1 4.31Å; L644-F758 HydrophobicContact CD2-CE1 4.12Å; W648-F758 AromaticContact CH2-CE1 3.76Å; W648-F758 HydrophobicContact CH2-CE1 3.76Å; W648-F758 AromaticContact CH2-CZ 3.91Å; W648-F758 HydrophobicContact CH2-CZ 3.91Å; W648-F758 AromaticContact CZ3-CE1 3.91Å; W648-F758 HydrophobicContact CZ3-CE1 3.91Å; W648-F758 HydrophobicContact CZ3-CZ 4.41Å; A723-F758 HydrophobicContact CB-CD1 3.81Å; A723-F758 HydrophobicContact CB-CE1 3.74Å; Y756-F758 HydrophobicContact CG-CZ 4.19Å; F758-F763 HydrophobicContact CD1-CD1 4.14Å; F758-F763 AromaticContact CD1-CE1 3.87Å; F758-F763 HydrophobicContact CD1-CE1 3.87Å; F758-F763 HydrophobicContact CD2-CE1 4.31Å; F758-F763 HydrophobicContact CE1-CD1 4.21Å; F758-F763 AromaticContact CE1-CE1 3.57Å; F758-F763 HydrophobicContact CE1-CE1 3.57Å; F758-F763 HydrophobicContact CE1-CZ 4.46Å; F758-F763 HydrophobicContact CE2-CE1 4.03Å; F758-F763 HydrophobicContact CG-CE1 4.24Å; F758-F763 AromaticContact CZ-CE1 3.65Å; F758-F763 HydrophobicContact CZ-CE1 3.65Å; F758-F763 HydrophobicContact CZ-CZ 4.28Å; F758-A764 HydrophobicContact CB-CB 4.35Å; F758-M786 WeakPolarHBondContact O-CA 3.43Å; F758-M786 WeakPolarHBondContact O-CB 3.2Å; F758-I787 HydrophobicContact CD2-CG2 4.47Å; F758-I787 PolarHBondContact N-O 3.24Å; F758-I787 PolarHBondContact O-N 3.24Å; F758-L789 HydrophobicContact CE2-CB 3.96Å; F758-L789 HydrophobicContact CE2-CD2 4.13Å
759	A	92.4	Very high	80.7	Confident	9 Å²	9	36.9 Å²	36.9	7%	0.074	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-81.4	161.7	165.6	0	0	0	0	0	110.7	I714 L717 K718 S761 M786	I714-A759 HydrophobicContact CG2-CB 4.39Å; L717-A759 HydrophobicContact CB-CB 4.08Å; K718-A759 HydrophobicContact CD-CB 4.33Å; K718-A759 HydrophobicContact CG-CB 3.76Å; A759-S761 PolarHBondContact O-N 3.47Å; A759-S761 PolarHBondContact O-OG 3Å; A759-M786 HydrophobicContact CB-CE 4.45Å
760	P	91.6	Very high	82.8	Confident	4 Å²	4	30.9 Å²	30.9	3%	0.026	17%	0.167	C	C	.	.	S	Bend	trans	-53.2	129	176.3	-28.4	38	0	0	0	111.8	I714 A780 T782 Y785	I714-P760 HydrophobicContact CG2-CG 4.48Å; P760-A780 CarbonylContact C-O 3.56Å; P760-T782 WeakPolarHBondContact CB-O 3.42Å; P760-T782 WeakPolarHBondContact CG-O 3.44Å; P760-Y785 HydrophobicContact CB-CE1 3.89Å; P760-Y785 WeakPolarHBondContact CD-O 3.39Å; P760-Y785 HydrophobicContact CG-CD1 3.95Å; P760-Y785 HydrophobicContact CG-CD2 4.48Å; P760-Y785 HydrophobicContact CG-CE1 3.78Å; P760-Y785 HydrophobicContact CG-CE2 4.34Å; P760-Y785 HydrophobicContact CG-CG 4.29Å; P760-Y785 WeakPolarHBondContact CG-O 3.48Å
761	S	88.6	Confident	83.9	Confident	26 Å²	26	24.9 Å²	24.9	18%	0.182	15%	0.147	C	C	.	.	S	Bend	trans	-169.2	165.1	-170.7	52.3	0	0	0	0	108.8	A759 F763 A764 L765 A780	A759-S761 PolarHBondContact O-N 3.47Å; A759-S761 PolarHBondContact O-OG 3Å; S761-F763 VanDerWaalsContact C-N 3.28Å; S761-F763 PolarHBondContact O-N 2.91Å; S761-A764 PolarHBondContact O-N 2.7Å; S761-A764 VanDerWaalsContact OG-CB 3.31Å; S761-A764 WeakPolarHBondContact OG-CB 3.32Å; S761-A764 PolarHBondContact OG-N 3.42Å; S761-L765 WeakPolarHBondContact O-CB 3.36Å; S761-L765 PolarHBondContact O-N 3.43Å; S761-A780 WeakPolarHBondContact CA-O 3.47Å; S761-A780 PolarHBondContact N-O 2.71Å
762	S	86.9	Confident	85.3	Confident	89 Å²	89	23.2 Å²	23.2	62%	0.622	14%	0.135	S	C	*	.	H	α-helix	trans	-57.5	-39.5	175.8	50.8	0	0	0	0	112.9	S766	S762-S766 WeakPolarHBondContact O-CB 3.24Å; S762-S766 PolarHBondContact O-N 3.27Å
763	F	87.3	Confident	85.8	Confident	11 Å²	11	24.2 Å²	24.2	5%	0.048	14%	0.141	C	C	.	.	H	α-helix	trans	-66.6	-45.9	174.9	170.6	-95.4	0	0	0	112.4	M649 A652 T653 I656 F758 S761 L765 S766 L767	M649-F763 HydrophobicContact CE-CB 3.51Å; M649-F763 HydrophobicContact CE-CG 4.25Å; M649-F763 HydrophobicContact SD-CB 3.8Å; M649-F763 HydrophobicContact SD-CD1 4.28Å; M649-F763 HydrophobicContact SD-CD2 4.35Å; M649-F763 HydrophobicContact SD-CG 3.89Å; A652-F763 HydrophobicContact CB-CE2 4.42Å; A652-F763 HydrophobicContact CB-CZ 4.31Å; T653-F763 WeakPolarHBondContact OG1-CD2 3.27Å; T653-F763 WeakPolarHBondContact OG1-CE2 3.31Å; I656-F763 HydrophobicContact CD1-CE2 4.45Å; I656-F763 HydrophobicContact CD1-CZ 3.77Å; F758-F763 HydrophobicContact CD1-CD1 4.14Å; F758-F763 AromaticContact CD1-CE1 3.87Å; F758-F763 HydrophobicContact CD1-CE1 3.87Å; F758-F763 HydrophobicContact CD2-CE1 4.31Å; F758-F763 HydrophobicContact CE1-CD1 4.21Å; F758-F763 AromaticContact CE1-CE1 3.57Å; F758-F763 HydrophobicContact CE1-CE1 3.57Å; F758-F763 HydrophobicContact CE1-CZ 4.46Å; F758-F763 HydrophobicContact CE2-CE1 4.03Å; F758-F763 HydrophobicContact CG-CE1 4.24Å; F758-F763 AromaticContact CZ-CE1 3.65Å; F758-F763 HydrophobicContact CZ-CE1 3.65Å; F758-F763 HydrophobicContact CZ-CZ 4.28Å; S761-F763 VanDerWaalsContact C-N 3.28Å; S761-F763 PolarHBondContact O-N 2.91Å; F763-L765 VanDerWaalsContact C-N 3.33Å; F763-L765 PolarHBondContact O-N 3.4Å; F763-S766 WeakPolarHBondContact O-CB 3.31Å; F763-S766 PolarHBondContact O-N 3.24Å; F763-S766 VanDerWaalsContact O-N 3.1Å; F763-L767 HydrophobicContact CD1-CD1 4.47Å; F763-L767 HydrophobicContact CE1-CD1 3.77Å; F763-L767 HydrophobicContact CE1-CG 4.4Å; F763-L767 HydrophobicContact CZ-CD1 3.92Å; F763-L767 HydrophobicContact CZ-CG 4.34Å; F763-L767 PolarHBondContact O-N 2.66Å
764	A	88.9	Confident	85.9	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60.3	-44.2	175.3	0	0	0	0	0	111.3	F758 S761 S766 L767 L768 I787	F758-A764 HydrophobicContact CB-CB 4.35Å; S761-A764 PolarHBondContact O-N 2.7Å; S761-A764 VanDerWaalsContact OG-CB 3.31Å; S761-A764 WeakPolarHBondContact OG-CB 3.32Å; S761-A764 PolarHBondContact OG-N 3.42Å; A764-S766 VanDerWaalsContact C-N 3.3Å; A764-S766 PolarHBondContact O-N 3.15Å; A764-L767 PolarHBondContact O-N 3.22Å; A764-L768 PolarHBondContact O-N 3.38Å; A764-I787 HydrophobicContact CB-CD1 4.01Å; A764-I787 WeakPolarHBondContact O-CD1 3.41Å
765	L	87.9	Confident	85.9	Confident	13 Å²	13	25.1 Å²	25.1	7%	0.068	15%	0.15	C	C	.	.	H	α-helix	trans	-61.4	-37.8	173.5	-178.7	67	0	0	0	112.1	S761 F763 L767 L768 K769 L779 A780	S761-L765 WeakPolarHBondContact O-CB 3.36Å; S761-L765 PolarHBondContact O-N 3.43Å; F763-L765 VanDerWaalsContact C-N 3.33Å; F763-L765 PolarHBondContact O-N 3.4Å; L765-L767 VanDerWaalsContact C-N 3.32Å; L765-L767 PolarHBondContact O-N 2.99Å; L765-L768 WeakPolarHBondContact O-CB 3.41Å; L765-L768 PolarHBondContact O-N 3.29Å; L765-L768 VanDerWaalsContact O-N 3.15Å; L765-K769 HydrophobicContact CD1-CD 4.47Å; L765-K769 HydrophobicContact CD1-CG 4.27Å; L765-K769 HydrophobicContact CG-CD 4.24Å; L765-K769 HydrophobicContact CG-CG 4.34Å; L765-K769 WeakPolarHBondContact O-CB 3.47Å; L765-K769 WeakPolarHBondContact O-CG 3.2Å; L765-K769 PolarHBondContact O-N 3.21Å; L765-L779 HydrophobicContact CD1-CB 3.96Å; L765-A780 HydrophobicContact CB-CB 4.15Å; L765-A780 HydrophobicContact CD2-CB 3.92Å
766	S	85.2	Confident	85.6	Confident	57 Å²	57	26.9 Å²	26.9	40%	0.399	16%	0.163	S	C	.	.	H	α-helix	trans	-63.5	-36.1	176.6	-166.2	0	0	0	0	112.6	S762 F763 A764 Q770	S762-S766 WeakPolarHBondContact O-CB 3.24Å; S762-S766 PolarHBondContact O-N 3.27Å; F763-S766 WeakPolarHBondContact O-CB 3.31Å; F763-S766 PolarHBondContact O-N 3.24Å; F763-S766 VanDerWaalsContact O-N 3.1Å; A764-S766 VanDerWaalsContact C-N 3.3Å; A764-S766 PolarHBondContact O-N 3.15Å; S766-Q770 WeakPolarHBondContact O-CG 3.37Å
767	L	84.6	Confident	85.3	Confident	3 Å²	3	28.2 Å²	28.2	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-67.9	-41.9	171	-62.4	-179.2	0	0	0	111.1	I656 L669 F763 A764 L765 K769 Q770 I787	I656-L767 HydrophobicContact CG2-CD2 3.72Å; L669-L767 HydrophobicContact CD1-CB 4.35Å; L669-L767 HydrophobicContact CD1-CD1 4.17Å; L669-L767 HydrophobicContact CD2-CB 4.36Å; F763-L767 HydrophobicContact CD1-CD1 4.47Å; F763-L767 HydrophobicContact CE1-CD1 3.77Å; F763-L767 HydrophobicContact CE1-CG 4.4Å; F763-L767 HydrophobicContact CZ-CD1 3.92Å; F763-L767 HydrophobicContact CZ-CG 4.34Å; F763-L767 PolarHBondContact O-N 2.66Å; A764-L767 PolarHBondContact O-N 3.22Å; L765-L767 VanDerWaalsContact C-N 3.32Å; L765-L767 PolarHBondContact O-N 2.99Å; L767-K769 VanDerWaalsContact C-N 3.33Å; L767-K769 PolarHBondContact O-N 3.31Å; L767-Q770 WeakPolarHBondContact O-CB 3.42Å; L767-Q770 PolarHBondContact O-N 3.38Å; L767-Q770 PolarHBondContact O-OE1 2.56Å; L767-I787 HydrophobicContact CB-CD1 4.48Å; L767-I787 HydrophobicContact CD1-CG2 4.49Å
768	L	86.1	Confident	84.9	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.3	-37	179.4	-157.2	62.7	0	0	0	112.3	L581 L608 L671 A764 L765 Q770 A771 A772 L775 L779 Y785 I787	L581-L768 HydrophobicContact CD2-CD1 3.98Å; L581-L768 HydrophobicContact CD2-CD2 4.3Å; L581-L768 HydrophobicContact CD2-CG 4.26Å; L608-L768 HydrophobicContact CD1-CD1 3.5Å; L608-L768 VanDerWaalsContact CD1-CD1 3.5Å; L608-L768 HydrophobicContact CD2-CD1 3.75Å; L608-L768 HydrophobicContact CG-CD1 4.3Å; L671-L768 HydrophobicContact CD1-CD1 4.25Å; A764-L768 PolarHBondContact O-N 3.38Å; L765-L768 WeakPolarHBondContact O-CB 3.41Å; L765-L768 PolarHBondContact O-N 3.29Å; L765-L768 VanDerWaalsContact O-N 3.15Å; L768-Q770 PolarHBondContact O-N 3.13Å; L768-A771 PolarHBondContact O-N 3.49Å; L768-A772 PolarHBondContact O-N 3.25Å; L768-L775 HydrophobicContact CB-CD1 4.32Å; L768-L775 HydrophobicContact CD2-CD1 3.59Å; L768-L775 HydrophobicContact CG-CD1 3.52Å; L768-L779 HydrophobicContact CD2-CD2 4.07Å; L768-Y785 HydrophobicContact CD2-CE2 4.15Å; L768-I787 HydrophobicContact CB-CD1 4.08Å; L768-I787 HydrophobicContact CD1-CD1 4.2Å
769	K	84.9	Confident	84.5	Confident	63 Å²	63	33.8 Å²	33.8	27%	0.274	21%	0.209	S	C	.	.	H	α-helix	trans	-71.4	-10.5	176.5	-73.6	-170.2	175.8	-161.7	0	114.6	L765 L767 A771 P773 L775 S777	L765-K769 HydrophobicContact CD1-CD 4.47Å; L765-K769 HydrophobicContact CD1-CG 4.27Å; L765-K769 HydrophobicContact CG-CD 4.24Å; L765-K769 HydrophobicContact CG-CG 4.34Å; L765-K769 WeakPolarHBondContact O-CB 3.47Å; L765-K769 WeakPolarHBondContact O-CG 3.2Å; L765-K769 PolarHBondContact O-N 3.21Å; L767-K769 VanDerWaalsContact C-N 3.33Å; L767-K769 PolarHBondContact O-N 3.31Å; K769-A771 VanDerWaalsContact C-N 3.29Å; K769-P773 WeakPolarHBondContact O-CA 3.35Å; K769-L775 WeakPolarHBondContact CE-O 3.22Å; K769-L775 PolarHBondContact NZ-O 2.86Å; K769-S777 PolarHBondContact NZ-OG 3.26Å
770	Q	79	Confident	84	Confident	56 Å²	56	34.4 Å²	34.4	26%	0.262	21%	0.214	S	C	.	.	H	α-helix	trans	-71.6	-27	166.7	-62.9	158.9	-14.6	0	0	111.7	I609 H657 L660 S766 L767 L768	I609-Q770 HydrophobicContact CD1-CB 4.08Å; H657-Q770 PolarHBondContact CD2-NE2 3.25Å; H657-Q770 PolarHBondContact CE1-NE2 3.16Å; H657-Q770 PolarHBondContact NE2-NE2 3.39Å; L660-Q770 VanDerWaalsContact CD1-CD 3.46Å; S766-Q770 WeakPolarHBondContact O-CG 3.37Å; L767-Q770 WeakPolarHBondContact O-CB 3.42Å; L767-Q770 PolarHBondContact O-N 3.38Å; L767-Q770 PolarHBondContact O-OE1 2.56Å; L768-Q770 PolarHBondContact O-N 3.13Å
771	A	76.9	Confident	83.6	Confident	13 Å²	13	39.3 Å²	39.3	11%	0.107	24%	0.244	C	C	.	.	H	α-helix	trans	-90.5	-55.2	174.6	0	0	0	0	0	111.3	L572 L608 I609 L768 K769	L572-A771 WeakPolarHBondContact CB-O 3.24Å; L572-A771 HydrophobicContact CD1-CB 4.43Å; L608-A771 HydrophobicContact CD2-CB 4.12Å; I609-A771 HydrophobicContact CD1-CB 3.93Å; I609-A771 HydrophobicContact CG1-CB 4.05Å; L768-A771 PolarHBondContact O-N 3.49Å; K769-A771 VanDerWaalsContact C-N 3.29Å
772	A	82.4	Confident	83.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	25%	0.246	C	C	.	.			trans	-123.5	90.7	-175.7	0	0	0	0	0	110.2	L581 L768 C774 L775	L581-A772 HydrophobicContact CD1-CB 4.05Å; L768-A772 PolarHBondContact O-N 3.25Å; A772-C774 VanDerWaalsContact C-N 3.28Å; A772-C774 PolarHBondContact O-N 3.43Å; A772-L775 HydrophobicContact CB-CD1 3.76Å; A772-L775 HydrophobicContact CB-CG 3.85Å; A772-L775 WeakPolarHBondContact O-CG 3.46Å; A772-L775 PolarHBondContact O-N 3.36Å
773	P	78	Confident	83.3	Confident	65 Å²	65	37.6 Å²	37.6	42%	0.422	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-24.3	-168	25.2	-34.7	0	0	0	114.4	K769	K769-P773 WeakPolarHBondContact O-CA 3.35Å
774	C	78.4	Confident	83.2	Confident	66 Å²	66	40.6 Å²	40.6	45%	0.446	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	1.9	-173.3	-64.3	0	0	0	0	114.7	K573 I575 A772	K573-C774 PolarHBondContact O-SG 3Å; I575-C774 CarbonylContact O-C 3.54Å; I575-C774 VanDerWaalsContact O-C 3.27Å; I575-C774 WeakPolarHBondContact O-CB 3.39Å; A772-C774 VanDerWaalsContact C-N 3.28Å; A772-C774 PolarHBondContact O-N 3.43Å
775	L	81.6	Confident	83.3	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.01	25%	0.247	C	C	.	.			trans	-56	141.9	176.8	-74.1	169.9	0	0	0	112.5	I575 V576 L581 L768 K769 A772 L779	I575-L775 HydrophobicContact CG2-CD2 3.89Å; I575-L775 PolarHBondContact O-N 3.06Å; V576-L775 WeakPolarHBondContact O-CA 3.27Å; L581-L775 HydrophobicContact CD2-CD1 4.12Å; L768-L775 HydrophobicContact CB-CD1 4.32Å; L768-L775 HydrophobicContact CD2-CD1 3.59Å; L768-L775 HydrophobicContact CG-CD1 3.52Å; K769-L775 WeakPolarHBondContact CE-O 3.22Å; K769-L775 PolarHBondContact NZ-O 2.86Å; A772-L775 HydrophobicContact CB-CD1 3.76Å; A772-L775 HydrophobicContact CB-CG 3.85Å; A772-L775 WeakPolarHBondContact O-CG 3.46Å; A772-L775 PolarHBondContact O-N 3.36Å; L775-L779 HydrophobicContact CD1-CD2 4.47Å; L775-L779 HydrophobicContact CD2-CD2 4.24Å
776	S	82.7	Confident	83.6	Confident	38 Å²	38	40 Å²	40	27%	0.266	24%	0.244	S	C	.	.			trans	-58.6	145.8	176.3	-169.9	0	0	0	0	112.2	V576 D778	V576-S776 PolarHBondContact O-N 2.76Å; S776-D778 PolarHBondContact O-N 2.8Å; S776-D778 VanDerWaalsContact OG-CG 3.25Å; S776-D778 PolarHBondContact OG-N 3.41Å; S776-D778 PolarHBondContact OG-OD2 2.94Å
777	S	83.2	Confident	83.9	Confident	76 Å²	76	37.2 Å²	37.2	53%	0.531	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-69.8	-19.7	175.3	-63.9	0	0	0	0	113.2	K769 L779 A780	K769-S777 PolarHBondContact NZ-OG 3.26Å; S777-L779 PolarHBondContact O-N 3.05Å; S777-A780 WeakPolarHBondContact O-CB 3.48Å; S777-A780 PolarHBondContact O-N 3.08Å; S777-A780 VanDerWaalsContact O-N 3.17Å
778	D	83.8	Confident	84.3	Confident	105 Å²	105	37.1 Å²	37.1	56%	0.561	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-59.4	-30.8	-179.8	-48.1	-45.4	0	0	0	112.4	S776 A780 T781 T782	S776-D778 PolarHBondContact O-N 2.8Å; S776-D778 VanDerWaalsContact OG-CG 3.25Å; S776-D778 PolarHBondContact OG-N 3.41Å; S776-D778 PolarHBondContact OG-OD2 2.94Å; D778-A780 PolarHBondContact O-N 2.69Å; D778-T781 PolarHBondContact O-N 2.64Å; D778-T781 PolarHBondContact O-OG1 3.46Å; D778-T782 PolarHBondContact O-N 3.44Å; D778-T782 PolarHBondContact O-OG1 2.77Å
779	L	83.8	Confident	84.4	Confident	14 Å²	14	37.1 Å²	37.1	7%	0.073	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-51.6	-31.9	177.4	-91.2	67.2	0	0	0	112.6	L578 L765 L768 L775 S777 T781 T782 Y785	L578-L779 HydrophobicContact CB-CD2 4.26Å; L578-L779 HydrophobicContact CD1-CD2 4.37Å; L765-L779 HydrophobicContact CD1-CB 3.96Å; L768-L779 HydrophobicContact CD2-CD2 4.07Å; L775-L779 HydrophobicContact CD1-CD2 4.47Å; L775-L779 HydrophobicContact CD2-CD2 4.24Å; S777-L779 PolarHBondContact O-N 3.05Å; L779-T781 PolarHBondContact O-N 2.86Å; L779-T781 VanDerWaalsContact O-N 3.13Å; L779-T782 WeakPolarHBondContact CA-OG1 3.31Å; L779-T782 PolarHBondContact O-N 3.05Å; L779-Y785 HydrophobicContact CB-CE1 3.94Å; L779-Y785 HydrophobicContact CD2-CE1 4.4Å; L779-Y785 HydrophobicContact CG-CE1 4.16Å; L779-Y785 VanDerWaalsContact O-CE1 3.31Å; L779-Y785 WeakPolarHBondContact O-CE1 3.31Å; L779-Y785 PolarHBondContact O-OH 3.13Å
780	A	81.3	Confident	84.6	Confident	21 Å²	21	34.1 Å²	34.1	17%	0.174	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-61.1	-21.1	175.9	0	0	0	0	0	113.7	P760 S761 L765 S777 D778	P760-A780 CarbonylContact C-O 3.56Å; S761-A780 WeakPolarHBondContact CA-O 3.47Å; S761-A780 PolarHBondContact N-O 2.71Å; L765-A780 HydrophobicContact CB-CB 4.15Å; L765-A780 HydrophobicContact CD2-CB 3.92Å; S777-A780 WeakPolarHBondContact O-CB 3.48Å; S777-A780 PolarHBondContact O-N 3.08Å; S777-A780 VanDerWaalsContact O-N 3.17Å; D778-A780 PolarHBondContact O-N 2.69Å
781	T	83.2	Confident	84.8	Confident	107 Å²	107	33.3 Å²	33.3	66%	0.656	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-24.7	179.8	72	0	0	0	0	113.5	K718 D778 L779	K718-T781 PolarHBondContact NZ-O 2.88Å; D778-T781 PolarHBondContact O-N 2.64Å; D778-T781 PolarHBondContact O-OG1 3.46Å; L779-T781 PolarHBondContact O-N 2.86Å; L779-T781 VanDerWaalsContact O-N 3.13Å
782	T	85.6	Confident	84.9	Confident	36 Å²	36	36.8 Å²	36.8	22%	0.221	22%	0.219	C	C	.	.			trans	-57.2	167.3	-179	-51	0	0	0	0	113.2	K718 P760 D778 L779 D784	K718-T782 PolarHBondContact NZ-O 2.78Å; P760-T782 WeakPolarHBondContact CB-O 3.42Å; P760-T782 WeakPolarHBondContact CG-O 3.44Å; D778-T782 PolarHBondContact O-N 3.44Å; D778-T782 PolarHBondContact O-OG1 2.77Å; L779-T782 WeakPolarHBondContact CA-OG1 3.31Å; L779-T782 PolarHBondContact O-N 3.05Å; T782-D784 HydrophobicContact CG2-CB 4.01Å; T782-D784 WeakPolarHBondContact CG2-OD2 3.11Å
783	S	84.4	Confident	84.4	Confident	44 Å²	44	47.5 Å²	47.5	31%	0.308	26%	0.259	S	S	.	.	S	Bend	trans	-129.3	24.2	-176.9	-57.1	0	0	0	0	114.1	H711 I714 K718	H711-S783 PolarHBondContact ND1-O 3.19Å; I714-S783 WeakPolarHBondContact CD1-O 2.97Å; K718-S783 PolarHBondContact NZ-OG 3.32Å
784	D	85.7	Confident	84.7	Confident	73 Å²	73	46.7 Å²	46.7	39%	0.39	25%	0.251	S	S	.	.	S	Bend	trans	-114.4	-6.7	-163.6	-50.2	-31.7	0	0	0	113.9	L578 P674 H711 T782	L578-D784 HydrophobicContact CD2-CB 4.47Å; P674-D784 WeakPolarHBondContact CD-O 3.49Å; H711-D784 IonicContact CE1-OD1 2.7Å; H711-D784 PolarHBondContact CE1-OD1 2.85Å; H711-D784 VanDerWaalsContact CE1-OD1 3.29Å; H711-D784 IonicContact ND1-OD1 2.66Å; T782-D784 HydrophobicContact CG2-CB 4.01Å; T782-D784 WeakPolarHBondContact CG2-OD2 3.11Å
785	Y	91.5	Very high	85	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.241	C	C	.	.			trans	-134	165.8	174.5	75	-82.4	0	0	0	111.6	L578 L671 I672 I714 P760 L768 L779 I787	L578-Y785 HydrophobicContact CD2-CD1 4.05Å; L578-Y785 HydrophobicContact CD2-CG 4.47Å; L671-Y785 HydrophobicContact CD1-CD2 3.87Å; L671-Y785 HydrophobicContact CD1-CG 4.24Å; I672-Y785 CarbonylContact O-C 3.56Å; I672-Y785 VanDerWaalsContact O-CA 3.28Å; I672-Y785 WeakPolarHBondContact O-CA 3.37Å; I714-Y785 WeakPolarHBondContact CD1-O 3.29Å; P760-Y785 HydrophobicContact CB-CE1 3.89Å; P760-Y785 WeakPolarHBondContact CD-O 3.39Å; P760-Y785 HydrophobicContact CG-CD1 3.95Å; P760-Y785 HydrophobicContact CG-CD2 4.48Å; P760-Y785 HydrophobicContact CG-CE1 3.78Å; P760-Y785 HydrophobicContact CG-CE2 4.34Å; P760-Y785 HydrophobicContact CG-CG 4.29Å; P760-Y785 WeakPolarHBondContact CG-O 3.48Å; L768-Y785 HydrophobicContact CD2-CE2 4.15Å; L779-Y785 HydrophobicContact CB-CE1 3.94Å; L779-Y785 HydrophobicContact CD2-CE1 4.4Å; L779-Y785 HydrophobicContact CG-CE1 4.16Å; L779-Y785 VanDerWaalsContact O-CE1 3.31Å; L779-Y785 WeakPolarHBondContact O-CE1 3.31Å; L779-Y785 PolarHBondContact O-OH 3.13Å; Y785-I787 HydrophobicContact CD2-CG1 4.19Å; Y785-I787 HydrophobicContact CE2-CD1 4.17Å; Y785-I787 HydrophobicContact CE2-CG1 4.05Å
786	M	93.3	Very high	85.2	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	166.6	162.8	-55.5	-174.6	76.3	0	0	109.6	I672 L710 L713 I714 L717 L757 F758 A759	I672-M786 HydrophobicContact CB-CB 3.91Å; I672-M786 WeakPolarHBondContact CB-O 2.91Å; I672-M786 HydrophobicContact CG2-CB 4.15Å; I672-M786 PolarHBondContact N-O 2.94Å; I672-M786 PolarHBondContact O-N 3.02Å; L710-M786 HydrophobicContact CD1-SD 3.83Å; L710-M786 HydrophobicContact CD2-CG 4.4Å; L710-M786 HydrophobicContact CG-SD 4.15Å; L713-M786 HydrophobicContact CD2-CE 4.49Å; L713-M786 HydrophobicContact CD2-SD 4.11Å; L713-M786 HydrophobicContact CG-CE 4.38Å; L713-M786 HydrophobicContact CG-SD 4.34Å; I714-M786 HydrophobicContact CD1-CG 3.66Å; I714-M786 HydrophobicContact CD1-SD 4.27Å; I714-M786 HydrophobicContact CG1-CE 4.19Å; I714-M786 HydrophobicContact CG1-CG 3.43Å; I714-M786 VanDerWaalsContact CG1-CG 3.43Å; I714-M786 HydrophobicContact CG1-SD 3.6Å; I714-M786 VanDerWaalsContact CG1-SD 3.6Å; L717-M786 HydrophobicContact CD1-CE 3.48Å; L717-M786 VanDerWaalsContact CD1-CE 3.48Å; L757-M786 HydrophobicContact CD1-CB 3.92Å; L757-M786 HydrophobicContact CD1-CE 3.78Å; L757-M786 HydrophobicContact CD1-SD 4.09Å; L757-M786 HydrophobicContact CD2-CE 3.82Å; L757-M786 HydrophobicContact CD2-SD 4.34Å; L757-M786 HydrophobicContact CG-CE 3.55Å; L757-M786 HydrophobicContact CG-SD 4.37Å; F758-M786 WeakPolarHBondContact O-CA 3.43Å; F758-M786 WeakPolarHBondContact O-CB 3.2Å; A759-M786 HydrophobicContact CB-CE 4.45Å
787	I	92.2	Very high	85.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	125.2	172.4	-69.1	-177.7	0	0	0	109.2	L669 F758 A764 L767 L768 Y785	L669-I787 HydrophobicContact CD1-CG2 3.47Å; L669-I787 VanDerWaalsContact CD1-CG2 3.47Å; L669-I787 HydrophobicContact CG-CG2 4.34Å; F758-I787 HydrophobicContact CD2-CG2 4.47Å; F758-I787 PolarHBondContact N-O 3.24Å; F758-I787 PolarHBondContact O-N 3.24Å; A764-I787 HydrophobicContact CB-CD1 4.01Å; A764-I787 WeakPolarHBondContact O-CD1 3.41Å; L767-I787 HydrophobicContact CB-CD1 4.48Å; L767-I787 HydrophobicContact CD1-CG2 4.49Å; L768-I787 HydrophobicContact CB-CD1 4.08Å; L768-I787 HydrophobicContact CD1-CD1 4.2Å; Y785-I787 HydrophobicContact CD2-CG1 4.19Å; Y785-I787 HydrophobicContact CE2-CD1 4.17Å; Y785-I787 HydrophobicContact CE2-CG1 4.05Å
788	L	91.7	Very high	85.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	129.3	169.9	-161.4	79.8	0	0	0	108.4	F594 L636 M670 I672 I726 V755 Y756 L757	F594-L788 HydrophobicContact CE1-CD1 4.26Å; F594-L788 HydrophobicContact CZ-CD1 4.34Å; L636-L788 HydrophobicContact CD1-CD2 4.28Å; M670-L788 HydrophobicContact CB-CB 4.23Å; M670-L788 HydrophobicContact CE-CD2 4.3Å; M670-L788 PolarHBondContact N-O 3Å; M670-L788 PolarHBondContact O-N 3.22Å; M670-L788 HydrophobicContact SD-CD2 3.91Å; I672-L788 HydrophobicContact CD1-CB 3.91Å; I672-L788 HydrophobicContact CD1-CD2 4.44Å; I672-L788 HydrophobicContact CG1-CB 3.82Å; I726-L788 HydrophobicContact CD1-CD1 4.06Å; V755-L788 HydrophobicContact CG1-CD1 3.49Å; V755-L788 VanDerWaalsContact CG1-CD1 3.49Å; V755-L788 HydrophobicContact CG1-CD2 4.03Å; V755-L788 HydrophobicContact CG1-CG 3.61Å; Y756-L788 WeakPolarHBondContact O-CA 3.44Å; L757-L788 HydrophobicContact CB-CD1 4.17Å; L757-L788 HydrophobicContact CD1-CD1 3.89Å
789	L	89.4	Confident	85.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	109.7	174.5	174.6	67.6	0	0	0	108.6	I656 L667 L669 V755 Y756 F758 L791	I656-L789 HydrophobicContact CD1-CD2 3.4Å; I656-L789 HydrophobicContact CG1-CD2 3.83Å; L667-L789 HydrophobicContact CD1-CD1 3.88Å; L667-L789 HydrophobicContact CD2-CD1 4.38Å; L667-L789 HydrophobicContact CG-CD1 3.83Å; L669-L789 HydrophobicContact CD1-CB 4.38Å; L669-L789 HydrophobicContact CD1-CD1 4.05Å; V755-L789 WeakPolarHBondContact CA-O 3.4Å; Y756-L789 PolarHBondContact N-O 3.45Å; Y756-L789 PolarHBondContact O-N 2.91Å; F758-L789 HydrophobicContact CE2-CB 3.96Å; F758-L789 HydrophobicContact CE2-CD2 4.13Å; L789-L791 HydrophobicContact CD1-CD2 4.04Å; L789-L791 HydrophobicContact CD1-CG 4.48Å; L789-L791 HydrophobicContact CD2-CD1 4.36Å; L789-L791 HydrophobicContact CD2-CG 4.4Å; L789-L791 HydrophobicContact CG-CD2 4.24Å; L789-L791 HydrophobicContact CG-CG 4.15Å
790	A	88.2	Confident	85.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	130.2	171.6	0	0	0	0	0	109.9	I614 L618 L667 C668 M670 L753 V755	I614-A790 HydrophobicContact CG2-CB 3.5Å; I614-A790 VanDerWaalsContact CG2-CB 3.5Å; L618-A790 HydrophobicContact CD1-CB 3.87Å; L667-A790 WeakPolarHBondContact CA-O 3.35Å; C668-A790 HydrophobicContact CB-CB 4.36Å; C668-A790 PolarHBondContact N-O 2.91Å; C668-A790 PolarHBondContact O-N 3.33Å; M670-A790 HydrophobicContact CE-CB 4.18Å; L753-A790 HydrophobicContact CD1-CB 4.38Å; L753-A790 HydrophobicContact CD2-CB 4.34Å; V755-A790 HydrophobicContact CG2-CB 3.98Å
791	L	84.1	Confident	86.1	Confident	39 Å²	39	47 Å²	47	20%	0.204	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	124	176.5	-62.9	177.7	0	0	0	109.7	L667 L753 I754 Y756 L789	L667-L791 HydrophobicContact CB-CD2 4.05Å; L667-L791 HydrophobicContact CD1-CD2 3.86Å; L667-L791 HydrophobicContact CG-CD2 3.95Å; L753-L791 WeakPolarHBondContact CD1-O 3.4Å; I754-L791 PolarHBondContact N-O 3.36Å; I754-L791 PolarHBondContact O-N 3.04Å; Y756-L791 HydrophobicContact CE2-CD1 4.22Å; L789-L791 HydrophobicContact CD1-CD2 4.04Å; L789-L791 HydrophobicContact CD1-CG 4.48Å; L789-L791 HydrophobicContact CD2-CD1 4.36Å; L789-L791 HydrophobicContact CD2-CG 4.4Å; L789-L791 HydrophobicContact CG-CD2 4.24Å; L789-L791 HydrophobicContact CG-CG 4.15Å
792	R	78.9	Confident	86.3	Confident	87 Å²	87	42 Å²	42	33%	0.328	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	132.1	167.7	-159.3	175.3	-162.6	149.2	13.1	108.3	I614 N666 S751 L753	I614-R792 HydrophobicContact CD1-CB 4.23Å; N666-R792 HydrophobicContact CB-CB 4.13Å; N666-R792 PolarHBondContact O-N 2.94Å; S751-R792 PolarHBondContact OG-NE 2.96Å; S751-R792 PolarHBondContact OG-NH2 3.23Å; L753-R792 HydrophobicContact CD1-CB 4.42Å
793	R	70.7	Confident	86.4	Confident	225 Å²	225	42.5 Å²	42.5	85%	0.849	19%	0.189	S	C	*	.			trans	-87.3	0	169.9	-78.2	-179.8	144.9	-176.8	-3.8	111.4	S752 I754	S752-R793 WeakPolarHBondContact O-CB 3.3Å; S752-R793 PolarHBondContact O-N 3.41Å; S752-R793 WeakPolarHBondContact OG-CD 3.22Å; I754-R793 HydrophobicContact CD1-CG 4.31Å

Retrieved 793 of 793 residues in 846.3 ms (Link to these results)

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